diff --git a/modelcenter/PP-HelixFold/APP/T1026.fasta b/modelcenter/PP-HelixFold/APP/T1026.fasta new file mode 100644 index 0000000000000000000000000000000000000000..d713b36e70126f6a4fa31bc0e34f8d0b8271f668 --- /dev/null +++ b/modelcenter/PP-HelixFold/APP/T1026.fasta @@ -0,0 +1,2 @@ +>T1026 FBNSV, , 172 residues| +MVSNWNWSGKKGRRTPRRGYTRPFKSAVPTTRVVVHQSAVLKKDDVSGSEIKPEGDVARYKIRKVMLSCTLRMRPGELVNYLIVKCSSPIVNWSAAFTAPALMVKESCQDMITIIGKGKVESNGVAGSDCTKSFNKFIRLGAGISQTQHLYVVMYTSEAVKTVLEHRVYIEV \ No newline at end of file diff --git a/modelcenter/PP-HelixFold/APP/T1026_pred.pdb b/modelcenter/PP-HelixFold/APP/T1026_pred.pdb new file mode 100644 index 0000000000000000000000000000000000000000..84c4c04c764e0d411116403061c30e791c375070 --- /dev/null +++ b/modelcenter/PP-HelixFold/APP/T1026_pred.pdb @@ -0,0 +1,1346 @@ +MODEL 1 +ATOM 1 N MET A 1 58.068 -32.487 -11.491 1.00 39.61 N +ATOM 2 CA MET A 1 57.040 -33.489 -11.224 1.00 39.61 C +ATOM 3 C MET A 1 56.865 -33.704 -9.725 1.00 39.61 C +ATOM 4 CB MET A 1 57.389 -34.813 -11.905 1.00 39.61 C +ATOM 5 O MET A 1 57.717 -34.314 -9.077 1.00 39.61 O +ATOM 6 CG MET A 1 56.788 -34.966 -13.293 1.00 39.61 C +ATOM 7 SD MET A 1 57.079 -36.632 -14.005 1.00 39.61 S +ATOM 8 CE MET A 1 56.754 -36.292 -15.758 1.00 39.61 C +ATOM 9 N VAL A 2 56.517 -32.670 -8.963 1.00 46.35 N +ATOM 10 CA VAL A 2 56.450 -32.771 -7.509 1.00 46.35 C +ATOM 11 C VAL A 2 55.011 -33.042 -7.075 1.00 46.35 C +ATOM 12 CB VAL A 2 56.980 -31.491 -6.825 1.00 46.35 C +ATOM 13 O VAL A 2 54.094 -32.308 -7.451 1.00 46.35 O +ATOM 14 CG1 VAL A 2 57.008 -31.661 -5.307 1.00 46.35 C +ATOM 15 CG2 VAL A 2 58.371 -31.142 -7.353 1.00 46.35 C +ATOM 16 N SER A 3 54.577 -34.346 -7.145 1.00 50.49 N +ATOM 17 CA SER A 3 53.385 -35.055 -6.693 1.00 50.49 C +ATOM 18 C SER A 3 53.127 -34.813 -5.209 1.00 50.49 C +ATOM 19 CB SER A 3 53.520 -36.555 -6.957 1.00 50.49 C +ATOM 20 O SER A 3 54.042 -34.918 -4.390 1.00 50.49 O +ATOM 21 OG SER A 3 54.578 -37.107 -6.194 1.00 50.49 O +ATOM 22 N ASN A 4 52.475 -33.721 -4.839 1.00 48.58 N +ATOM 23 CA ASN A 4 51.815 -33.337 -3.596 1.00 48.58 C +ATOM 24 C ASN A 4 50.812 -34.394 -3.144 1.00 48.58 C +ATOM 25 CB ASN A 4 51.122 -31.981 -3.753 1.00 48.58 C +ATOM 26 O ASN A 4 49.621 -34.108 -3.006 1.00 48.58 O +ATOM 27 CG ASN A 4 52.046 -30.816 -3.458 1.00 48.58 C +ATOM 28 ND2 ASN A 4 51.489 -29.612 -3.420 1.00 48.58 N +ATOM 29 OD1 ASN A 4 53.252 -30.997 -3.267 1.00 48.58 O +ATOM 30 N TRP A 5 51.224 -35.649 -3.023 1.00 36.79 N +ATOM 31 CA TRP A 5 50.427 -36.726 -2.444 1.00 36.79 C +ATOM 32 C TRP A 5 50.544 -36.732 -0.923 1.00 36.79 C +ATOM 33 CB TRP A 5 50.863 -38.081 -3.008 1.00 36.79 C +ATOM 34 O TRP A 5 51.647 -36.823 -0.380 1.00 36.79 O +ATOM 35 CG TRP A 5 49.750 -39.078 -3.126 1.00 36.79 C +ATOM 36 CD1 TRP A 5 48.997 -39.597 -2.109 1.00 36.79 C +ATOM 37 CD2 TRP A 5 49.267 -39.680 -4.330 1.00 36.79 C +ATOM 38 CE2 TRP A 5 48.218 -40.555 -3.969 1.00 36.79 C +ATOM 39 CE3 TRP A 5 49.618 -39.563 -5.682 1.00 36.79 C +ATOM 40 NE1 TRP A 5 48.074 -40.486 -2.610 1.00 36.79 N +ATOM 41 CH2 TRP A 5 47.882 -41.178 -6.228 1.00 36.79 C +ATOM 42 CZ2 TRP A 5 47.518 -41.310 -4.913 1.00 36.79 C +ATOM 43 CZ3 TRP A 5 48.920 -40.316 -6.619 1.00 36.79 C +ATOM 44 N ASN A 6 49.893 -35.858 -0.193 1.00 49.11 N +ATOM 45 CA ASN A 6 49.540 -35.771 1.220 1.00 49.11 C +ATOM 46 C ASN A 6 48.802 -37.020 1.691 1.00 49.11 C +ATOM 47 CB ASN A 6 48.696 -34.523 1.487 1.00 49.11 C +ATOM 48 O ASN A 6 47.947 -37.547 0.977 1.00 49.11 O +ATOM 49 CG ASN A 6 49.430 -33.487 2.315 1.00 49.11 C +ATOM 50 ND2 ASN A 6 48.781 -32.355 2.560 1.00 49.11 N +ATOM 51 OD1 ASN A 6 50.572 -33.703 2.731 1.00 49.11 O +ATOM 52 N TRP A 7 49.469 -38.042 2.327 1.00 48.83 N +ATOM 53 CA TRP A 7 49.471 -39.206 3.207 1.00 48.83 C +ATOM 54 C TRP A 7 48.211 -39.243 4.064 1.00 48.83 C +ATOM 55 CB TRP A 7 50.713 -39.201 4.103 1.00 48.83 C +ATOM 56 O TRP A 7 47.797 -40.310 4.526 1.00 48.83 O +ATOM 57 CG TRP A 7 51.215 -40.569 4.455 1.00 48.83 C +ATOM 58 CD1 TRP A 7 50.498 -41.592 5.012 1.00 48.83 C +ATOM 59 CD2 TRP A 7 52.546 -41.063 4.279 1.00 48.83 C +ATOM 60 CE2 TRP A 7 52.565 -42.394 4.750 1.00 48.83 C +ATOM 61 CE3 TRP A 7 53.726 -40.508 3.766 1.00 48.83 C +ATOM 62 NE1 TRP A 7 51.304 -42.692 5.192 1.00 48.83 N +ATOM 63 CH2 TRP A 7 54.860 -42.612 4.218 1.00 48.83 C +ATOM 64 CZ2 TRP A 7 53.720 -43.179 4.724 1.00 48.83 C +ATOM 65 CZ3 TRP A 7 54.875 -41.291 3.741 1.00 48.83 C +ATOM 66 N SER A 8 47.104 -38.526 3.663 1.00 54.35 N +ATOM 67 CA SER A 8 45.909 -38.802 4.454 1.00 54.35 C +ATOM 68 C SER A 8 44.648 -38.708 3.602 1.00 54.35 C +ATOM 69 CB SER A 8 45.811 -37.832 5.633 1.00 54.35 C +ATOM 70 O SER A 8 44.422 -37.701 2.927 1.00 54.35 O +ATOM 71 OG SER A 8 45.298 -36.580 5.213 1.00 54.35 O +ATOM 72 N GLY A 9 44.432 -39.457 2.515 1.00 50.38 N +ATOM 73 CA GLY A 9 43.245 -39.945 1.832 1.00 50.38 C +ATOM 74 C GLY A 9 42.008 -39.116 2.120 1.00 50.38 C +ATOM 75 O GLY A 9 40.913 -39.443 1.656 1.00 50.38 O +ATOM 76 N LYS A 10 42.209 -37.883 2.572 1.00 45.14 N +ATOM 77 CA LYS A 10 40.960 -37.153 2.772 1.00 45.14 C +ATOM 78 C LYS A 10 40.924 -35.885 1.924 1.00 45.14 C +ATOM 79 CB LYS A 10 40.773 -36.802 4.249 1.00 45.14 C +ATOM 80 O LYS A 10 41.865 -35.089 1.947 1.00 45.14 O +ATOM 81 CG LYS A 10 40.354 -37.980 5.116 1.00 45.14 C +ATOM 82 CD LYS A 10 39.962 -37.530 6.518 1.00 45.14 C +ATOM 83 CE LYS A 10 39.593 -38.713 7.403 1.00 45.14 C +ATOM 84 NZ LYS A 10 39.194 -38.275 8.774 1.00 45.14 N +ATOM 85 N LYS A 11 40.698 -35.956 0.642 1.00 47.16 N +ATOM 86 CA LYS A 11 40.280 -34.867 -0.236 1.00 47.16 C +ATOM 87 C LYS A 11 39.728 -33.694 0.568 1.00 47.16 C +ATOM 88 CB LYS A 11 39.233 -35.355 -1.238 1.00 47.16 C +ATOM 89 O LYS A 11 38.778 -33.854 1.337 1.00 47.16 O +ATOM 90 CG LYS A 11 39.781 -35.601 -2.636 1.00 47.16 C +ATOM 91 CD LYS A 11 38.672 -35.967 -3.614 1.00 47.16 C +ATOM 92 CE LYS A 11 39.230 -36.323 -4.986 1.00 47.16 C +ATOM 93 NZ LYS A 11 38.146 -36.680 -5.949 1.00 47.16 N +ATOM 94 N GLY A 12 40.559 -33.078 1.414 1.00 48.31 N +ATOM 95 CA GLY A 12 40.330 -31.770 2.008 1.00 48.31 C +ATOM 96 C GLY A 12 39.237 -30.982 1.311 1.00 48.31 C +ATOM 97 O GLY A 12 39.220 -30.887 0.082 1.00 48.31 O +ATOM 98 N ARG A 13 37.983 -31.383 1.452 1.00 50.02 N +ATOM 99 CA ARG A 13 36.767 -30.621 1.186 1.00 50.02 C +ATOM 100 C ARG A 13 37.016 -29.124 1.330 1.00 50.02 C +ATOM 101 CB ARG A 13 35.641 -31.059 2.125 1.00 50.02 C +ATOM 102 O ARG A 13 37.501 -28.667 2.368 1.00 50.02 O +ATOM 103 CG ARG A 13 34.262 -31.038 1.486 1.00 50.02 C +ATOM 104 CD ARG A 13 33.174 -31.423 2.479 1.00 50.02 C +ATOM 105 NE ARG A 13 31.852 -31.415 1.860 1.00 50.02 N +ATOM 106 NH1 ARG A 13 30.701 -31.796 3.826 1.00 50.02 N +ATOM 107 NH2 ARG A 13 29.560 -31.566 1.851 1.00 50.02 N +ATOM 108 CZ ARG A 13 30.707 -31.592 2.514 1.00 50.02 C +ATOM 109 N ARG A 14 37.658 -28.484 0.414 1.00 53.51 N +ATOM 110 CA ARG A 14 37.764 -27.047 0.181 1.00 53.51 C +ATOM 111 C ARG A 14 36.524 -26.317 0.687 1.00 53.51 C +ATOM 112 CB ARG A 14 37.972 -26.757 -1.307 1.00 53.51 C +ATOM 113 O ARG A 14 35.397 -26.711 0.381 1.00 53.51 O +ATOM 114 CG ARG A 14 39.421 -26.855 -1.756 1.00 53.51 C +ATOM 115 CD ARG A 14 39.590 -26.436 -3.210 1.00 53.51 C +ATOM 116 NE ARG A 14 40.950 -25.981 -3.486 1.00 53.51 N +ATOM 117 NH1 ARG A 14 41.096 -27.007 -5.550 1.00 53.51 N +ATOM 118 NH2 ARG A 14 42.865 -25.796 -4.739 1.00 53.51 N +ATOM 119 CZ ARG A 14 41.634 -26.262 -4.591 1.00 53.51 C +ATOM 120 N THR A 15 36.356 -26.071 1.936 1.00 54.37 N +ATOM 121 CA THR A 15 35.406 -25.099 2.465 1.00 54.37 C +ATOM 122 C THR A 15 35.247 -23.921 1.508 1.00 54.37 C +ATOM 123 CB THR A 15 35.847 -24.583 3.848 1.00 54.37 C +ATOM 124 O THR A 15 36.238 -23.356 1.040 1.00 54.37 O +ATOM 125 CG2 THR A 15 35.325 -25.483 4.963 1.00 54.37 C +ATOM 126 OG1 THR A 15 37.279 -24.552 3.905 1.00 54.37 O +ATOM 127 N PRO A 16 34.192 -23.891 0.573 1.00 53.09 N +ATOM 128 CA PRO A 16 33.920 -22.734 -0.283 1.00 53.09 C +ATOM 129 C PRO A 16 34.111 -21.405 0.443 1.00 53.09 C +ATOM 130 CB PRO A 16 32.457 -22.931 -0.687 1.00 53.09 C +ATOM 131 O PRO A 16 33.737 -21.276 1.611 1.00 53.09 O +ATOM 132 CG PRO A 16 31.985 -24.085 0.138 1.00 53.09 C +ATOM 133 CD PRO A 16 33.151 -24.624 0.916 1.00 53.09 C +ATOM 134 N ARG A 17 35.262 -20.879 0.486 1.00 53.48 N +ATOM 135 CA ARG A 17 35.590 -19.487 0.778 1.00 53.48 C +ATOM 136 C ARG A 17 34.346 -18.607 0.719 1.00 53.48 C +ATOM 137 CB ARG A 17 36.646 -18.967 -0.199 1.00 53.48 C +ATOM 138 O ARG A 17 33.631 -18.600 -0.285 1.00 53.48 O +ATOM 139 CG ARG A 17 38.077 -19.194 0.262 1.00 53.48 C +ATOM 140 CD ARG A 17 39.084 -18.571 -0.696 1.00 53.48 C +ATOM 141 NE ARG A 17 40.457 -18.893 -0.318 1.00 53.48 N +ATOM 142 NH1 ARG A 17 41.411 -17.982 -2.215 1.00 53.48 N +ATOM 143 NH2 ARG A 17 42.734 -18.945 -0.611 1.00 53.48 N +ATOM 144 CZ ARG A 17 41.531 -18.606 -1.049 1.00 53.48 C +ATOM 145 N ARG A 18 33.417 -18.710 1.625 1.00 51.50 N +ATOM 146 CA ARG A 18 32.375 -17.715 1.860 1.00 51.50 C +ATOM 147 C ARG A 18 32.776 -16.358 1.292 1.00 51.50 C +ATOM 148 CB ARG A 18 32.079 -17.590 3.356 1.00 51.50 C +ATOM 149 O ARG A 18 33.857 -15.847 1.594 1.00 51.50 O +ATOM 150 CG ARG A 18 31.017 -18.555 3.857 1.00 51.50 C +ATOM 151 CD ARG A 18 30.599 -18.243 5.287 1.00 51.50 C +ATOM 152 NE ARG A 18 29.792 -19.317 5.860 1.00 51.50 N +ATOM 153 NH1 ARG A 18 29.121 -18.106 7.709 1.00 51.50 N +ATOM 154 NH2 ARG A 18 28.406 -20.266 7.426 1.00 51.50 N +ATOM 155 CZ ARG A 18 29.108 -19.227 6.997 1.00 51.50 C +ATOM 156 N GLY A 19 32.946 -16.227 -0.001 1.00 48.14 N +ATOM 157 CA GLY A 19 33.000 -14.891 -0.572 1.00 48.14 C +ATOM 158 C GLY A 19 32.558 -13.810 0.395 1.00 48.14 C +ATOM 159 O GLY A 19 31.536 -13.953 1.070 1.00 48.14 O +ATOM 160 N TYR A 20 33.272 -13.646 1.488 1.00 49.08 N +ATOM 161 CA TYR A 20 33.205 -12.375 2.200 1.00 49.08 C +ATOM 162 C TYR A 20 32.337 -11.373 1.447 1.00 49.08 C +ATOM 163 CB TYR A 20 34.610 -11.799 2.404 1.00 49.08 C +ATOM 164 O TYR A 20 32.667 -10.976 0.327 1.00 49.08 O +ATOM 165 CG TYR A 20 35.252 -12.213 3.705 1.00 49.08 C +ATOM 166 CD1 TYR A 20 35.038 -11.484 4.873 1.00 49.08 C +ATOM 167 CD2 TYR A 20 36.075 -13.332 3.770 1.00 49.08 C +ATOM 168 CE1 TYR A 20 35.629 -11.861 6.075 1.00 49.08 C +ATOM 169 CE2 TYR A 20 36.672 -13.718 4.966 1.00 49.08 C +ATOM 170 OH TYR A 20 37.031 -13.355 7.297 1.00 49.08 O +ATOM 171 CZ TYR A 20 36.443 -12.978 6.111 1.00 49.08 C +ATOM 172 N THR A 21 31.121 -11.717 1.161 1.00 49.58 N +ATOM 173 CA THR A 21 30.170 -10.689 0.755 1.00 49.58 C +ATOM 174 C THR A 21 30.206 -9.508 1.721 1.00 49.58 C +ATOM 175 CB THR A 21 28.738 -11.251 0.680 1.00 49.58 C +ATOM 176 O THR A 21 30.431 -9.686 2.920 1.00 49.58 O +ATOM 177 CG2 THR A 21 28.495 -11.959 -0.649 1.00 49.58 C +ATOM 178 OG1 THR A 21 28.540 -12.183 1.749 1.00 49.58 O +ATOM 179 N ARG A 22 31.026 -8.521 1.438 1.00 51.01 N +ATOM 180 CA ARG A 22 30.993 -7.167 1.981 1.00 51.01 C +ATOM 181 C ARG A 22 29.797 -6.977 2.907 1.00 51.01 C +ATOM 182 CB ARG A 22 30.950 -6.135 0.851 1.00 51.01 C +ATOM 183 O ARG A 22 28.679 -7.376 2.576 1.00 51.01 O +ATOM 184 CG ARG A 22 32.306 -5.537 0.511 1.00 51.01 C +ATOM 185 CD ARG A 22 32.206 -4.520 -0.618 1.00 51.01 C +ATOM 186 NE ARG A 22 33.520 -4.017 -1.008 1.00 51.01 N +ATOM 187 NH1 ARG A 22 32.708 -2.461 -2.509 1.00 51.01 N +ATOM 188 NH2 ARG A 22 34.966 -2.670 -2.177 1.00 51.01 N +ATOM 189 CZ ARG A 22 33.729 -3.050 -1.897 1.00 51.01 C +ATOM 190 N PRO A 23 29.975 -6.825 4.225 1.00 48.13 N +ATOM 191 CA PRO A 23 28.895 -6.496 5.159 1.00 48.13 C +ATOM 192 C PRO A 23 27.912 -5.477 4.588 1.00 48.13 C +ATOM 193 CB PRO A 23 29.638 -5.920 6.368 1.00 48.13 C +ATOM 194 O PRO A 23 28.321 -4.529 3.914 1.00 48.13 O +ATOM 195 CG PRO A 23 31.081 -5.950 5.979 1.00 48.13 C +ATOM 196 CD PRO A 23 31.186 -6.477 4.577 1.00 48.13 C +ATOM 197 N PHE A 24 26.805 -5.911 4.010 1.00 49.27 N +ATOM 198 CA PHE A 24 25.656 -5.111 3.603 1.00 49.27 C +ATOM 199 C PHE A 24 25.540 -3.856 4.460 1.00 49.27 C +ATOM 200 CB PHE A 24 24.366 -5.932 3.699 1.00 49.27 C +ATOM 201 O PHE A 24 25.532 -3.935 5.690 1.00 49.27 O +ATOM 202 CG PHE A 24 23.173 -5.263 3.072 1.00 49.27 C +ATOM 203 CD1 PHE A 24 22.251 -4.579 3.855 1.00 49.27 C +ATOM 204 CD2 PHE A 24 22.972 -5.319 1.699 1.00 49.27 C +ATOM 205 CE1 PHE A 24 21.146 -3.958 3.278 1.00 49.27 C +ATOM 206 CE2 PHE A 24 21.870 -4.702 1.115 1.00 49.27 C +ATOM 207 CZ PHE A 24 20.957 -4.023 1.906 1.00 49.27 C +ATOM 208 N LYS A 25 26.277 -2.815 4.160 1.00 49.40 N +ATOM 209 CA LYS A 25 26.083 -1.518 4.803 1.00 49.40 C +ATOM 210 C LYS A 25 24.634 -1.057 4.684 1.00 49.40 C +ATOM 211 CB LYS A 25 27.018 -0.473 4.193 1.00 49.40 C +ATOM 212 O LYS A 25 24.033 -1.150 3.612 1.00 49.40 O +ATOM 213 CG LYS A 25 28.380 -0.392 4.867 1.00 49.40 C +ATOM 214 CD LYS A 25 29.224 0.736 4.289 1.00 49.40 C +ATOM 215 CE LYS A 25 30.620 0.760 4.897 1.00 49.40 C +ATOM 216 NZ LYS A 25 31.443 1.880 4.350 1.00 49.40 N +ATOM 217 N SER A 26 23.800 -1.274 5.722 1.00 47.55 N +ATOM 218 CA SER A 26 22.449 -0.743 5.866 1.00 47.55 C +ATOM 219 C SER A 26 22.321 0.629 5.212 1.00 47.55 C +ATOM 220 CB SER A 26 22.063 -0.651 7.343 1.00 47.55 C +ATOM 221 O SER A 26 23.128 1.524 5.473 1.00 47.55 O +ATOM 222 OG SER A 26 21.674 0.670 7.679 1.00 47.55 O +ATOM 223 N ALA A 27 22.338 0.710 3.924 1.00 53.34 N +ATOM 224 CA ALA A 27 22.067 1.962 3.223 1.00 53.34 C +ATOM 225 C ALA A 27 21.108 2.841 4.020 1.00 53.34 C +ATOM 226 CB ALA A 27 21.497 1.681 1.834 1.00 53.34 C +ATOM 227 O ALA A 27 20.144 2.344 4.609 1.00 53.34 O +ATOM 228 N VAL A 28 21.549 3.611 5.008 1.00 52.88 N +ATOM 229 CA VAL A 28 20.779 4.672 5.649 1.00 52.88 C +ATOM 230 C VAL A 28 19.689 5.165 4.701 1.00 52.88 C +ATOM 231 CB VAL A 28 21.684 5.849 6.079 1.00 52.88 C +ATOM 232 O VAL A 28 19.899 5.239 3.488 1.00 52.88 O +ATOM 233 CG1 VAL A 28 20.886 6.882 6.873 1.00 52.88 C +ATOM 234 CG2 VAL A 28 22.868 5.339 6.899 1.00 52.88 C +ATOM 235 N PRO A 29 18.448 5.111 5.200 1.00 55.11 N +ATOM 236 CA PRO A 29 17.440 5.679 4.302 1.00 55.11 C +ATOM 237 C PRO A 29 17.907 6.970 3.633 1.00 55.11 C +ATOM 238 CB PRO A 29 16.250 5.943 5.228 1.00 55.11 C +ATOM 239 O PRO A 29 18.492 7.834 4.291 1.00 55.11 O +ATOM 240 CG PRO A 29 16.670 5.396 6.554 1.00 55.11 C +ATOM 241 CD PRO A 29 18.128 5.042 6.485 1.00 55.11 C +ATOM 242 N THR A 30 18.004 6.991 2.314 1.00 57.54 N +ATOM 243 CA THR A 30 18.439 8.195 1.615 1.00 57.54 C +ATOM 244 C THR A 30 17.348 9.262 1.643 1.00 57.54 C +ATOM 245 CB THR A 30 18.821 7.887 0.155 1.00 57.54 C +ATOM 246 O THR A 30 17.642 10.459 1.645 1.00 57.54 O +ATOM 247 CG2 THR A 30 20.319 7.632 0.021 1.00 57.54 C +ATOM 248 OG1 THR A 30 18.109 6.723 -0.283 1.00 57.54 O +ATOM 249 N THR A 31 16.037 8.840 2.001 1.00 59.14 N +ATOM 250 CA THR A 31 15.049 9.913 1.960 1.00 59.14 C +ATOM 251 C THR A 31 14.782 10.456 3.361 1.00 59.14 C +ATOM 252 CB THR A 31 13.728 9.432 1.332 1.00 59.14 C +ATOM 253 O THR A 31 14.690 9.690 4.322 1.00 59.14 O +ATOM 254 CG2 THR A 31 13.914 9.077 -0.139 1.00 59.14 C +ATOM 255 OG1 THR A 31 13.265 8.273 2.037 1.00 59.14 O +ATOM 256 N ARG A 32 15.232 11.648 3.712 1.00 57.21 N +ATOM 257 CA ARG A 32 15.063 12.340 4.986 1.00 57.21 C +ATOM 258 C ARG A 32 13.589 12.589 5.284 1.00 57.21 C +ATOM 259 CB ARG A 32 15.828 13.665 4.984 1.00 57.21 C +ATOM 260 O ARG A 32 13.173 12.576 6.444 1.00 57.21 O +ATOM 261 CG ARG A 32 17.339 13.505 5.046 1.00 57.21 C +ATOM 262 CD ARG A 32 18.044 14.847 5.186 1.00 57.21 C +ATOM 263 NE ARG A 32 19.495 14.692 5.226 1.00 57.21 N +ATOM 264 NH1 ARG A 32 19.932 16.936 5.557 1.00 57.21 N +ATOM 265 NH2 ARG A 32 21.659 15.435 5.421 1.00 57.21 N +ATOM 266 CZ ARG A 32 20.359 15.688 5.401 1.00 57.21 C +ATOM 267 N VAL A 33 12.738 12.419 4.189 1.00 59.87 N +ATOM 268 CA VAL A 33 11.370 12.902 4.347 1.00 59.87 C +ATOM 269 C VAL A 33 10.391 11.738 4.207 1.00 59.87 C +ATOM 270 CB VAL A 33 11.035 14.006 3.320 1.00 59.87 C +ATOM 271 O VAL A 33 10.508 10.928 3.285 1.00 59.87 O +ATOM 272 CG1 VAL A 33 9.605 14.507 3.511 1.00 59.87 C +ATOM 273 CG2 VAL A 33 12.029 15.161 3.435 1.00 59.87 C +ATOM 274 N VAL A 34 9.610 11.548 5.187 1.00 64.60 N +ATOM 275 CA VAL A 34 8.479 10.627 5.179 1.00 64.60 C +ATOM 276 C VAL A 34 7.356 11.194 4.314 1.00 64.60 C +ATOM 277 CB VAL A 34 7.963 10.350 6.609 1.00 64.60 C +ATOM 278 O VAL A 34 6.986 12.362 4.454 1.00 64.60 O +ATOM 279 CG1 VAL A 34 6.745 9.429 6.574 1.00 64.60 C +ATOM 280 CG2 VAL A 34 9.071 9.743 7.467 1.00 64.60 C +ATOM 281 N VAL A 35 7.024 10.431 3.263 1.00 78.62 N +ATOM 282 CA VAL A 35 5.885 10.817 2.436 1.00 78.62 C +ATOM 283 C VAL A 35 4.583 10.487 3.164 1.00 78.62 C +ATOM 284 CB VAL A 35 5.919 10.116 1.060 1.00 78.62 C +ATOM 285 O VAL A 35 4.378 9.351 3.597 1.00 78.62 O +ATOM 286 CG1 VAL A 35 4.703 10.510 0.223 1.00 78.62 C +ATOM 287 CG2 VAL A 35 7.213 10.455 0.321 1.00 78.62 C +ATOM 288 N HIS A 36 3.821 11.601 3.295 1.00 82.98 N +ATOM 289 CA HIS A 36 2.542 11.506 3.989 1.00 82.98 C +ATOM 290 C HIS A 36 1.376 11.679 3.021 1.00 82.98 C +ATOM 291 CB HIS A 36 2.458 12.550 5.104 1.00 82.98 C +ATOM 292 O HIS A 36 1.274 12.704 2.342 1.00 82.98 O +ATOM 293 CG HIS A 36 1.173 12.509 5.869 1.00 82.98 C +ATOM 294 CD2 HIS A 36 0.044 13.246 5.750 1.00 82.98 C +ATOM 295 ND1 HIS A 36 0.951 11.626 6.903 1.00 82.98 N +ATOM 296 CE1 HIS A 36 -0.264 11.822 7.388 1.00 82.98 C +ATOM 297 NE2 HIS A 36 -0.835 12.800 6.706 1.00 82.98 N +ATOM 298 N GLN A 37 0.563 10.606 2.938 1.00 83.94 N +ATOM 299 CA GLN A 37 -0.613 10.628 2.075 1.00 83.94 C +ATOM 300 C GLN A 37 -1.863 10.194 2.836 1.00 83.94 C +ATOM 301 CB GLN A 37 -0.402 9.729 0.856 1.00 83.94 C +ATOM 302 O GLN A 37 -1.855 9.167 3.517 1.00 83.94 O +ATOM 303 CG GLN A 37 0.672 10.231 -0.100 1.00 83.94 C +ATOM 304 CD GLN A 37 0.842 9.337 -1.313 1.00 83.94 C +ATOM 305 NE2 GLN A 37 1.444 9.876 -2.368 1.00 83.94 N +ATOM 306 OE1 GLN A 37 0.437 8.170 -1.303 1.00 83.94 O +ATOM 307 N SER A 38 -2.842 11.041 2.739 1.00 85.51 N +ATOM 308 CA SER A 38 -4.112 10.711 3.377 1.00 85.51 C +ATOM 309 C SER A 38 -5.222 10.544 2.344 1.00 85.51 C +ATOM 310 CB SER A 38 -4.503 11.793 4.386 1.00 85.51 C +ATOM 311 O SER A 38 -5.223 11.217 1.312 1.00 85.51 O +ATOM 312 OG SER A 38 -4.697 13.038 3.738 1.00 85.51 O +ATOM 313 N ALA A 39 -6.045 9.520 2.516 1.00 85.50 N +ATOM 314 CA ALA A 39 -7.130 9.276 1.570 1.00 85.50 C +ATOM 315 C ALA A 39 -8.324 8.623 2.261 1.00 85.50 C +ATOM 316 CB ALA A 39 -6.644 8.401 0.417 1.00 85.50 C +ATOM 317 O ALA A 39 -8.178 8.018 3.326 1.00 85.50 O +ATOM 318 N VAL A 40 -9.447 8.898 1.681 1.00 84.07 N +ATOM 319 CA VAL A 40 -10.664 8.224 2.121 1.00 84.07 C +ATOM 320 C VAL A 40 -11.043 7.136 1.120 1.00 84.07 C +ATOM 321 CB VAL A 40 -11.833 9.219 2.295 1.00 84.07 C +ATOM 322 O VAL A 40 -11.257 7.418 -0.062 1.00 84.07 O +ATOM 323 CG1 VAL A 40 -13.099 8.492 2.744 1.00 84.07 C +ATOM 324 CG2 VAL A 40 -11.458 10.312 3.295 1.00 84.07 C +ATOM 325 N LEU A 41 -11.062 5.904 1.674 1.00 85.01 N +ATOM 326 CA LEU A 41 -11.386 4.774 0.810 1.00 85.01 C +ATOM 327 C LEU A 41 -12.881 4.474 0.846 1.00 85.01 C +ATOM 328 CB LEU A 41 -10.594 3.533 1.230 1.00 85.01 C +ATOM 329 O LEU A 41 -13.488 4.451 1.920 1.00 85.01 O +ATOM 330 CG LEU A 41 -9.073 3.684 1.278 1.00 85.01 C +ATOM 331 CD1 LEU A 41 -8.431 2.414 1.827 1.00 85.01 C +ATOM 332 CD2 LEU A 41 -8.524 4.010 -0.107 1.00 85.01 C +ATOM 333 N LYS A 42 -13.436 4.306 -0.313 1.00 85.86 N +ATOM 334 CA LYS A 42 -14.860 4.004 -0.421 1.00 85.86 C +ATOM 335 C LYS A 42 -15.127 2.521 -0.179 1.00 85.86 C +ATOM 336 CB LYS A 42 -15.393 4.415 -1.794 1.00 85.86 C +ATOM 337 O LYS A 42 -14.232 1.689 -0.341 1.00 85.86 O +ATOM 338 CG LYS A 42 -15.367 5.915 -2.044 1.00 85.86 C +ATOM 339 CD LYS A 42 -15.953 6.265 -3.406 1.00 85.86 C +ATOM 340 CE LYS A 42 -15.869 7.760 -3.684 1.00 85.86 C +ATOM 341 NZ LYS A 42 -16.416 8.105 -5.031 1.00 85.86 N +ATOM 342 N LYS A 43 -16.357 2.265 0.211 1.00 84.93 N +ATOM 343 CA LYS A 43 -16.750 0.886 0.485 1.00 84.93 C +ATOM 344 C LYS A 43 -16.627 0.021 -0.767 1.00 84.93 C +ATOM 345 CB LYS A 43 -18.181 0.831 1.022 1.00 84.93 C +ATOM 346 O LYS A 43 -17.067 0.418 -1.848 1.00 84.93 O +ATOM 347 CG LYS A 43 -18.637 -0.563 1.426 1.00 84.93 C +ATOM 348 CD LYS A 43 -20.077 -0.558 1.922 1.00 84.93 C +ATOM 349 CE LYS A 43 -20.556 -1.961 2.267 1.00 84.93 C +ATOM 350 NZ LYS A 43 -21.972 -1.963 2.741 1.00 84.93 N +ATOM 351 N ASP A 44 -16.058 -1.091 -0.651 1.00 79.93 N +ATOM 352 CA ASP A 44 -15.916 -2.133 -1.663 1.00 79.93 C +ATOM 353 C ASP A 44 -15.152 -1.617 -2.880 1.00 79.93 C +ATOM 354 CB ASP A 44 -17.289 -2.659 -2.088 1.00 79.93 C +ATOM 355 O ASP A 44 -15.414 -2.039 -4.008 1.00 79.93 O +ATOM 356 CG ASP A 44 -17.989 -3.443 -0.992 1.00 79.93 C +ATOM 357 OD1 ASP A 44 -17.304 -4.106 -0.183 1.00 79.93 O +ATOM 358 OD2 ASP A 44 -19.237 -3.401 -0.938 1.00 79.93 O +ATOM 359 N ASP A 45 -14.378 -0.603 -2.617 1.00 83.34 N +ATOM 360 CA ASP A 45 -13.573 -0.049 -3.701 1.00 83.34 C +ATOM 361 C ASP A 45 -12.103 -0.429 -3.542 1.00 83.34 C +ATOM 362 CB ASP A 45 -13.720 1.473 -3.755 1.00 83.34 C +ATOM 363 O ASP A 45 -11.644 -0.706 -2.431 1.00 83.34 O +ATOM 364 CG ASP A 45 -13.271 2.065 -5.079 1.00 83.34 C +ATOM 365 OD1 ASP A 45 -13.166 1.319 -6.077 1.00 83.34 O +ATOM 366 OD2 ASP A 45 -13.017 3.288 -5.125 1.00 83.34 O +ATOM 367 N VAL A 46 -11.451 -0.581 -4.744 1.00 83.48 N +ATOM 368 CA VAL A 46 -10.012 -0.826 -4.765 1.00 83.48 C +ATOM 369 C VAL A 46 -9.268 0.487 -5.000 1.00 83.48 C +ATOM 370 CB VAL A 46 -9.628 -1.858 -5.849 1.00 83.48 C +ATOM 371 O VAL A 46 -9.547 1.201 -5.966 1.00 83.48 O +ATOM 372 CG1 VAL A 46 -8.127 -2.143 -5.815 1.00 83.48 C +ATOM 373 CG2 VAL A 46 -10.424 -3.148 -5.663 1.00 83.48 C +ATOM 374 N SER A 47 -8.446 0.748 -4.012 1.00 85.08 N +ATOM 375 CA SER A 47 -7.643 1.959 -4.140 1.00 85.08 C +ATOM 376 C SER A 47 -6.158 1.660 -3.967 1.00 85.08 C +ATOM 377 CB SER A 47 -8.083 3.006 -3.116 1.00 85.08 C +ATOM 378 O SER A 47 -5.788 0.689 -3.302 1.00 85.08 O +ATOM 379 OG SER A 47 -7.878 2.534 -1.795 1.00 85.08 O +ATOM 380 N GLY A 48 -5.373 2.388 -4.713 1.00 86.12 N +ATOM 381 CA GLY A 48 -3.936 2.181 -4.633 1.00 86.12 C +ATOM 382 C GLY A 48 -3.145 3.476 -4.658 1.00 86.12 C +ATOM 383 O GLY A 48 -3.671 4.523 -5.040 1.00 86.12 O +ATOM 384 N SER A 49 -2.014 3.398 -4.033 1.00 88.65 N +ATOM 385 CA SER A 49 -1.085 4.523 -4.053 1.00 88.65 C +ATOM 386 C SER A 49 0.305 4.085 -4.502 1.00 88.65 C +ATOM 387 CB SER A 49 -1.001 5.174 -2.671 1.00 88.65 C +ATOM 388 O SER A 49 0.796 3.035 -4.083 1.00 88.65 O +ATOM 389 OG SER A 49 -0.071 6.243 -2.675 1.00 88.65 O +ATOM 390 N GLU A 50 0.835 4.936 -5.356 1.00 88.45 N +ATOM 391 CA GLU A 50 2.176 4.617 -5.838 1.00 88.45 C +ATOM 392 C GLU A 50 3.243 5.096 -4.858 1.00 88.45 C +ATOM 393 CB GLU A 50 2.413 5.235 -7.218 1.00 88.45 C +ATOM 394 O GLU A 50 3.164 6.213 -4.343 1.00 88.45 O +ATOM 395 CG GLU A 50 3.723 4.810 -7.866 1.00 88.45 C +ATOM 396 CD GLU A 50 3.911 5.374 -9.265 1.00 88.45 C +ATOM 397 OE1 GLU A 50 4.899 5.006 -9.940 1.00 88.45 O +ATOM 398 OE2 GLU A 50 3.064 6.191 -9.689 1.00 88.45 O +ATOM 399 N ILE A 51 4.264 4.207 -4.621 1.00 88.63 N +ATOM 400 CA ILE A 51 5.393 4.524 -3.753 1.00 88.63 C +ATOM 401 C ILE A 51 6.586 4.966 -4.598 1.00 88.63 C +ATOM 402 CB ILE A 51 5.782 3.318 -2.868 1.00 88.63 C +ATOM 403 O ILE A 51 7.131 4.179 -5.374 1.00 88.63 O +ATOM 404 CG1 ILE A 51 4.594 2.889 -1.999 1.00 88.63 C +ATOM 405 CG2 ILE A 51 7.001 3.652 -2.003 1.00 88.63 C +ATOM 406 CD1 ILE A 51 4.808 1.573 -1.264 1.00 88.63 C +ATOM 407 N LYS A 52 6.940 6.215 -4.416 1.00 85.27 N +ATOM 408 CA LYS A 52 8.081 6.805 -5.110 1.00 85.27 C +ATOM 409 C LYS A 52 8.903 7.683 -4.170 1.00 85.27 C +ATOM 410 CB LYS A 52 7.613 7.622 -6.315 1.00 85.27 C +ATOM 411 O LYS A 52 8.376 8.216 -3.192 1.00 85.27 O +ATOM 412 CG LYS A 52 7.005 6.786 -7.431 1.00 85.27 C +ATOM 413 CD LYS A 52 6.632 7.645 -8.633 1.00 85.27 C +ATOM 414 CE LYS A 52 6.038 6.807 -9.757 1.00 85.27 C +ATOM 415 NZ LYS A 52 5.669 7.645 -10.937 1.00 85.27 N +ATOM 416 N PRO A 53 10.216 7.728 -4.479 1.00 79.01 N +ATOM 417 CA PRO A 53 11.007 8.660 -3.672 1.00 79.01 C +ATOM 418 C PRO A 53 10.583 10.115 -3.866 1.00 79.01 C +ATOM 419 CB PRO A 53 12.436 8.436 -4.174 1.00 79.01 C +ATOM 420 O PRO A 53 10.077 10.477 -4.931 1.00 79.01 O +ATOM 421 CG PRO A 53 12.274 7.783 -5.508 1.00 79.01 C +ATOM 422 CD PRO A 53 10.912 7.152 -5.568 1.00 79.01 C +ATOM 423 N GLU A 54 10.562 10.839 -2.712 1.00 74.81 N +ATOM 424 CA GLU A 54 10.281 12.270 -2.782 1.00 74.81 C +ATOM 425 C GLU A 54 11.417 13.022 -3.471 1.00 74.81 C +ATOM 426 CB GLU A 54 10.045 12.841 -1.382 1.00 74.81 C +ATOM 427 O GLU A 54 12.592 12.775 -3.191 1.00 74.81 O +ATOM 428 CG GLU A 54 9.445 14.240 -1.381 1.00 74.81 C +ATOM 429 CD GLU A 54 9.135 14.759 0.014 1.00 74.81 C +ATOM 430 OE1 GLU A 54 8.630 15.898 0.140 1.00 74.81 O +ATOM 431 OE2 GLU A 54 9.401 14.022 0.989 1.00 74.81 O +ATOM 432 N GLY A 55 11.022 13.832 -4.467 1.00 69.08 N +ATOM 433 CA GLY A 55 12.011 14.628 -5.177 1.00 69.08 C +ATOM 434 C GLY A 55 12.330 14.089 -6.559 1.00 69.08 C +ATOM 435 O GLY A 55 11.790 13.059 -6.969 1.00 69.08 O +ATOM 436 N ASP A 56 12.821 15.025 -7.436 1.00 65.65 N +ATOM 437 CA ASP A 56 13.208 14.692 -8.803 1.00 65.65 C +ATOM 438 C ASP A 56 14.544 13.953 -8.831 1.00 65.65 C +ATOM 439 CB ASP A 56 13.288 15.955 -9.662 1.00 65.65 C +ATOM 440 O ASP A 56 15.606 14.580 -8.840 1.00 65.65 O +ATOM 441 CG ASP A 56 13.027 15.689 -11.135 1.00 65.65 C +ATOM 442 OD1 ASP A 56 12.787 14.522 -11.510 1.00 65.65 O +ATOM 443 OD2 ASP A 56 13.065 16.656 -11.927 1.00 65.65 O +ATOM 444 N VAL A 57 14.595 12.746 -8.397 1.00 67.62 N +ATOM 445 CA VAL A 57 15.808 11.939 -8.490 1.00 67.62 C +ATOM 446 C VAL A 57 15.837 11.203 -9.828 1.00 67.62 C +ATOM 447 CB VAL A 57 15.910 10.931 -7.324 1.00 67.62 C +ATOM 448 O VAL A 57 14.906 10.464 -10.157 1.00 67.62 O +ATOM 449 CG1 VAL A 57 17.232 10.167 -7.386 1.00 67.62 C +ATOM 450 CG2 VAL A 57 15.766 11.649 -5.984 1.00 67.62 C +ATOM 451 N ALA A 58 16.794 11.580 -10.670 1.00 66.42 N +ATOM 452 CA ALA A 58 16.855 11.166 -12.070 1.00 66.42 C +ATOM 453 C ALA A 58 17.111 9.666 -12.188 1.00 66.42 C +ATOM 454 CB ALA A 58 17.939 11.948 -12.809 1.00 66.42 C +ATOM 455 O ALA A 58 16.473 8.983 -12.992 1.00 66.42 O +ATOM 456 N ARG A 59 17.925 9.069 -11.262 1.00 77.73 N +ATOM 457 CA ARG A 59 18.229 7.642 -11.291 1.00 77.73 C +ATOM 458 C ARG A 59 18.306 7.070 -9.879 1.00 77.73 C +ATOM 459 CB ARG A 59 19.544 7.388 -12.031 1.00 77.73 C +ATOM 460 O ARG A 59 19.137 7.496 -9.075 1.00 77.73 O +ATOM 461 CG ARG A 59 19.487 7.708 -13.516 1.00 77.73 C +ATOM 462 CD ARG A 59 20.800 7.381 -14.215 1.00 77.73 C +ATOM 463 NE ARG A 59 20.781 7.789 -15.617 1.00 77.73 N +ATOM 464 NH1 ARG A 59 22.661 6.584 -16.208 1.00 77.73 N +ATOM 465 NH2 ARG A 59 21.554 7.833 -17.779 1.00 77.73 N +ATOM 466 CZ ARG A 59 21.665 7.401 -16.531 1.00 77.73 C +ATOM 467 N TYR A 60 17.218 6.238 -9.629 1.00 82.54 N +ATOM 468 CA TYR A 60 17.221 5.642 -8.297 1.00 82.54 C +ATOM 469 C TYR A 60 16.823 4.172 -8.357 1.00 82.54 C +ATOM 470 CB TYR A 60 16.272 6.402 -7.366 1.00 82.54 C +ATOM 471 O TYR A 60 16.221 3.725 -9.336 1.00 82.54 O +ATOM 472 CG TYR A 60 14.823 6.324 -7.780 1.00 82.54 C +ATOM 473 CD1 TYR A 60 14.257 7.304 -8.592 1.00 82.54 C +ATOM 474 CD2 TYR A 60 14.017 5.271 -7.360 1.00 82.54 C +ATOM 475 CE1 TYR A 60 12.921 7.238 -8.975 1.00 82.54 C +ATOM 476 CE2 TYR A 60 12.680 5.195 -7.737 1.00 82.54 C +ATOM 477 OH TYR A 60 10.819 6.110 -8.919 1.00 82.54 O +ATOM 478 CZ TYR A 60 12.142 6.181 -8.543 1.00 82.54 C +ATOM 479 N LYS A 61 17.413 3.465 -7.382 1.00 85.80 N +ATOM 480 CA LYS A 61 17.002 2.085 -7.138 1.00 85.80 C +ATOM 481 C LYS A 61 16.558 1.892 -5.691 1.00 85.80 C +ATOM 482 CB LYS A 61 18.140 1.119 -7.470 1.00 85.80 C +ATOM 483 O LYS A 61 17.352 2.063 -4.764 1.00 85.80 O +ATOM 484 CG LYS A 61 17.718 -0.342 -7.520 1.00 85.80 C +ATOM 485 CD LYS A 61 18.849 -1.234 -8.015 1.00 85.80 C +ATOM 486 CE LYS A 61 18.415 -2.691 -8.103 1.00 85.80 C +ATOM 487 NZ LYS A 61 19.503 -3.562 -8.641 1.00 85.80 N +ATOM 488 N ILE A 62 15.198 1.522 -5.546 1.00 87.31 N +ATOM 489 CA ILE A 62 14.651 1.322 -4.208 1.00 87.31 C +ATOM 490 C ILE A 62 15.002 -0.078 -3.711 1.00 87.31 C +ATOM 491 CB ILE A 62 13.120 1.531 -4.186 1.00 87.31 C +ATOM 492 O ILE A 62 14.634 -1.076 -4.336 1.00 87.31 O +ATOM 493 CG1 ILE A 62 12.765 2.931 -4.701 1.00 87.31 C +ATOM 494 CG2 ILE A 62 12.565 1.308 -2.777 1.00 87.31 C +ATOM 495 CD1 ILE A 62 11.274 3.152 -4.912 1.00 87.31 C +ATOM 496 N ARG A 63 15.604 -0.190 -2.553 1.00 86.75 N +ATOM 497 CA ARG A 63 16.042 -1.486 -2.045 1.00 86.75 C +ATOM 498 C ARG A 63 15.171 -1.940 -0.879 1.00 86.75 C +ATOM 499 CB ARG A 63 17.509 -1.426 -1.612 1.00 86.75 C +ATOM 500 O ARG A 63 14.992 -3.141 -0.662 1.00 86.75 O +ATOM 501 CG ARG A 63 18.486 -1.262 -2.766 1.00 86.75 C +ATOM 502 CD ARG A 63 18.584 -2.527 -3.606 1.00 86.75 C +ATOM 503 NE ARG A 63 19.661 -2.439 -4.588 1.00 86.75 N +ATOM 504 NH1 ARG A 63 19.328 -4.557 -5.449 1.00 86.75 N +ATOM 505 NH2 ARG A 63 20.988 -3.220 -6.293 1.00 86.75 N +ATOM 506 CZ ARG A 63 19.990 -3.406 -5.441 1.00 86.75 C +ATOM 507 N LYS A 64 14.713 -0.876 -0.251 1.00 87.79 N +ATOM 508 CA LYS A 64 13.920 -1.162 0.940 1.00 87.79 C +ATOM 509 C LYS A 64 12.874 -0.077 1.179 1.00 87.79 C +ATOM 510 CB LYS A 64 14.823 -1.298 2.167 1.00 87.79 C +ATOM 511 O LYS A 64 13.118 1.099 0.901 1.00 87.79 O +ATOM 512 CG LYS A 64 14.104 -1.793 3.414 1.00 87.79 C +ATOM 513 CD LYS A 64 15.063 -1.950 4.587 1.00 87.79 C +ATOM 514 CE LYS A 64 14.338 -2.402 5.847 1.00 87.79 C +ATOM 515 NZ LYS A 64 15.281 -2.609 6.986 1.00 87.79 N +ATOM 516 N VAL A 65 11.673 -0.500 1.732 1.00 88.27 N +ATOM 517 CA VAL A 65 10.603 0.460 1.986 1.00 88.27 C +ATOM 518 C VAL A 65 10.032 0.238 3.385 1.00 88.27 C +ATOM 519 CB VAL A 65 9.482 0.352 0.929 1.00 88.27 C +ATOM 520 O VAL A 65 9.775 -0.900 3.784 1.00 88.27 O +ATOM 521 CG1 VAL A 65 8.344 1.320 1.248 1.00 88.27 C +ATOM 522 CG2 VAL A 65 10.039 0.618 -0.468 1.00 88.27 C +ATOM 523 N MET A 66 9.987 1.347 4.026 1.00 88.64 N +ATOM 524 CA MET A 66 9.241 1.345 5.282 1.00 88.64 C +ATOM 525 C MET A 66 7.835 1.900 5.081 1.00 88.64 C +ATOM 526 CB MET A 66 9.978 2.159 6.347 1.00 88.64 C +ATOM 527 O MET A 66 7.669 3.071 4.736 1.00 88.64 O +ATOM 528 CG MET A 66 9.301 2.144 7.708 1.00 88.64 C +ATOM 529 SD MET A 66 10.068 3.320 8.888 1.00 88.64 S +ATOM 530 CE MET A 66 10.811 2.154 10.064 1.00 88.64 C +ATOM 531 N LEU A 67 6.873 1.119 5.441 1.00 89.58 N +ATOM 532 CA LEU A 67 5.480 1.490 5.218 1.00 89.58 C +ATOM 533 C LEU A 67 4.710 1.526 6.535 1.00 89.58 C +ATOM 534 CB LEU A 67 4.812 0.510 4.250 1.00 89.58 C +ATOM 535 O LEU A 67 4.791 0.589 7.332 1.00 89.58 O +ATOM 536 CG LEU A 67 3.377 0.839 3.834 1.00 89.58 C +ATOM 537 CD1 LEU A 67 3.371 1.940 2.779 1.00 89.58 C +ATOM 538 CD2 LEU A 67 2.670 -0.409 3.317 1.00 89.58 C +ATOM 539 N SER A 68 4.103 2.645 6.722 1.00 89.50 N +ATOM 540 CA SER A 68 3.210 2.788 7.867 1.00 89.50 C +ATOM 541 C SER A 68 1.836 3.289 7.437 1.00 89.50 C +ATOM 542 CB SER A 68 3.810 3.744 8.899 1.00 89.50 C +ATOM 543 O SER A 68 1.727 4.308 6.752 1.00 89.50 O +ATOM 544 OG SER A 68 2.967 3.853 10.033 1.00 89.50 O +ATOM 545 N CYS A 69 0.872 2.567 7.820 1.00 90.50 N +ATOM 546 CA CYS A 69 -0.489 2.934 7.447 1.00 90.50 C +ATOM 547 C CYS A 69 -1.407 2.930 8.664 1.00 90.50 C +ATOM 548 CB CYS A 69 -1.031 1.978 6.385 1.00 90.50 C +ATOM 549 O CYS A 69 -1.438 1.958 9.420 1.00 90.50 O +ATOM 550 SG CYS A 69 -2.670 2.424 5.772 1.00 90.50 S +ATOM 551 N THR A 70 -2.076 4.007 8.826 1.00 89.96 N +ATOM 552 CA THR A 70 -3.060 4.155 9.893 1.00 89.96 C +ATOM 553 C THR A 70 -4.472 4.230 9.319 1.00 89.96 C +ATOM 554 CB THR A 70 -2.780 5.410 10.741 1.00 89.96 C +ATOM 555 O THR A 70 -4.733 5.006 8.397 1.00 89.96 O +ATOM 556 CG2 THR A 70 -1.486 5.259 11.535 1.00 89.96 C +ATOM 557 OG1 THR A 70 -2.667 6.548 9.877 1.00 89.96 O +ATOM 558 N LEU A 71 -5.303 3.394 9.887 1.00 89.62 N +ATOM 559 CA LEU A 71 -6.671 3.297 9.390 1.00 89.62 C +ATOM 560 C LEU A 71 -7.675 3.575 10.503 1.00 89.62 C +ATOM 561 CB LEU A 71 -6.927 1.911 8.791 1.00 89.62 C +ATOM 562 O LEU A 71 -7.513 3.093 11.627 1.00 89.62 O +ATOM 563 CG LEU A 71 -5.939 1.442 7.721 1.00 89.62 C +ATOM 564 CD1 LEU A 71 -5.983 -0.076 7.589 1.00 89.62 C +ATOM 565 CD2 LEU A 71 -6.243 2.110 6.384 1.00 89.62 C +ATOM 566 N ARG A 72 -8.672 4.388 10.157 1.00 88.54 N +ATOM 567 CA ARG A 72 -9.818 4.603 11.035 1.00 88.54 C +ATOM 568 C ARG A 72 -11.064 3.917 10.487 1.00 88.54 C +ATOM 569 CB ARG A 72 -10.081 6.099 11.219 1.00 88.54 C +ATOM 570 O ARG A 72 -11.588 4.312 9.443 1.00 88.54 O +ATOM 571 CG ARG A 72 -9.634 6.642 12.567 1.00 88.54 C +ATOM 572 CD ARG A 72 -10.038 8.098 12.751 1.00 88.54 C +ATOM 573 NE ARG A 72 -9.684 8.593 14.078 1.00 88.54 N +ATOM 574 NH1 ARG A 72 -9.961 10.824 13.548 1.00 88.54 N +ATOM 575 NH2 ARG A 72 -9.318 10.215 15.662 1.00 88.54 N +ATOM 576 CZ ARG A 72 -9.655 9.876 14.426 1.00 88.54 C +ATOM 577 N MET A 73 -11.423 2.825 11.172 1.00 87.02 N +ATOM 578 CA MET A 73 -12.532 2.028 10.656 1.00 87.02 C +ATOM 579 C MET A 73 -13.448 1.574 11.787 1.00 87.02 C +ATOM 580 CB MET A 73 -12.010 0.813 9.887 1.00 87.02 C +ATOM 581 O MET A 73 -13.066 1.620 12.958 1.00 87.02 O +ATOM 582 CG MET A 73 -11.133 -0.109 10.719 1.00 87.02 C +ATOM 583 SD MET A 73 -10.362 -1.439 9.717 1.00 87.02 S +ATOM 584 CE MET A 73 -8.910 -1.810 10.740 1.00 87.02 C +ATOM 585 N ARG A 74 -14.734 1.241 11.373 1.00 85.35 N +ATOM 586 CA ARG A 74 -15.698 0.703 12.329 1.00 85.35 C +ATOM 587 C ARG A 74 -15.299 -0.698 12.778 1.00 85.35 C +ATOM 588 CB ARG A 74 -17.102 0.679 11.721 1.00 85.35 C +ATOM 589 O ARG A 74 -14.616 -1.420 12.048 1.00 85.35 O +ATOM 590 CG ARG A 74 -17.717 2.057 11.535 1.00 85.35 C +ATOM 591 CD ARG A 74 -19.140 1.973 11.003 1.00 85.35 C +ATOM 592 NE ARG A 74 -19.674 3.293 10.678 1.00 85.35 N +ATOM 593 NH1 ARG A 74 -21.687 2.506 9.862 1.00 85.35 N +ATOM 594 NH2 ARG A 74 -21.256 4.758 9.888 1.00 85.35 N +ATOM 595 CZ ARG A 74 -20.871 3.516 10.143 1.00 85.35 C +ATOM 596 N PRO A 75 -15.747 -1.040 14.078 1.00 83.63 N +ATOM 597 CA PRO A 75 -15.403 -2.377 14.566 1.00 83.63 C +ATOM 598 C PRO A 75 -16.008 -3.491 13.714 1.00 83.63 C +ATOM 599 CB PRO A 75 -15.985 -2.396 15.982 1.00 83.63 C +ATOM 600 O PRO A 75 -17.124 -3.349 13.209 1.00 83.63 O +ATOM 601 CG PRO A 75 -16.205 -0.958 16.324 1.00 83.63 C +ATOM 602 CD PRO A 75 -16.386 -0.187 15.048 1.00 83.63 C +ATOM 603 N GLY A 76 -15.248 -4.550 13.435 1.00 80.91 N +ATOM 604 CA GLY A 76 -15.685 -5.719 12.687 1.00 80.91 C +ATOM 605 C GLY A 76 -15.370 -5.631 11.206 1.00 80.91 C +ATOM 606 O GLY A 76 -15.716 -6.532 10.438 1.00 80.91 O +ATOM 607 N GLU A 77 -14.690 -4.585 10.847 1.00 84.33 N +ATOM 608 CA GLU A 77 -14.370 -4.416 9.433 1.00 84.33 C +ATOM 609 C GLU A 77 -12.948 -4.878 9.129 1.00 84.33 C +ATOM 610 CB GLU A 77 -14.550 -2.955 9.011 1.00 84.33 C +ATOM 611 O GLU A 77 -12.108 -4.950 10.029 1.00 84.33 O +ATOM 612 CG GLU A 77 -15.970 -2.436 9.183 1.00 84.33 C +ATOM 613 CD GLU A 77 -16.977 -3.132 8.281 1.00 84.33 C +ATOM 614 OE1 GLU A 77 -18.188 -3.117 8.598 1.00 84.33 O +ATOM 615 OE2 GLU A 77 -16.551 -3.698 7.250 1.00 84.33 O +ATOM 616 N LEU A 78 -12.823 -5.154 7.782 1.00 83.71 N +ATOM 617 CA LEU A 78 -11.534 -5.697 7.369 1.00 83.71 C +ATOM 618 C LEU A 78 -10.967 -4.914 6.189 1.00 83.71 C +ATOM 619 CB LEU A 78 -11.669 -7.176 6.997 1.00 83.71 C +ATOM 620 O LEU A 78 -11.716 -4.470 5.316 1.00 83.71 O +ATOM 621 CG LEU A 78 -10.388 -7.884 6.554 1.00 83.71 C +ATOM 622 CD1 LEU A 78 -9.892 -8.819 7.652 1.00 83.71 C +ATOM 623 CD2 LEU A 78 -10.621 -8.651 5.257 1.00 83.71 C +ATOM 624 N VAL A 79 -9.693 -4.744 6.286 1.00 87.38 N +ATOM 625 CA VAL A 79 -8.982 -4.116 5.177 1.00 87.38 C +ATOM 626 C VAL A 79 -7.865 -5.037 4.692 1.00 87.38 C +ATOM 627 CB VAL A 79 -8.402 -2.742 5.581 1.00 87.38 C +ATOM 628 O VAL A 79 -7.041 -5.497 5.486 1.00 87.38 O +ATOM 629 CG1 VAL A 79 -7.595 -2.139 4.433 1.00 87.38 C +ATOM 630 CG2 VAL A 79 -9.522 -1.795 6.007 1.00 87.38 C +ATOM 631 N ASN A 80 -7.901 -5.228 3.435 1.00 87.85 N +ATOM 632 CA ASN A 80 -6.841 -6.007 2.805 1.00 87.85 C +ATOM 633 C ASN A 80 -5.912 -5.122 1.978 1.00 87.85 C +ATOM 634 CB ASN A 80 -7.435 -7.115 1.932 1.00 87.85 C +ATOM 635 O ASN A 80 -6.364 -4.182 1.322 1.00 87.85 O +ATOM 636 CG ASN A 80 -8.196 -8.148 2.739 1.00 87.85 C +ATOM 637 ND2 ASN A 80 -9.374 -8.526 2.257 1.00 87.85 N +ATOM 638 OD1 ASN A 80 -7.729 -8.603 3.786 1.00 87.85 O +ATOM 639 N TYR A 81 -4.649 -5.506 2.068 1.00 87.80 N +ATOM 640 CA TYR A 81 -3.737 -4.716 1.248 1.00 87.80 C +ATOM 641 C TYR A 81 -2.716 -5.609 0.554 1.00 87.80 C +ATOM 642 CB TYR A 81 -3.019 -3.665 2.100 1.00 87.80 C +ATOM 643 O TYR A 81 -2.402 -6.698 1.040 1.00 87.80 O +ATOM 644 CG TYR A 81 -2.096 -4.254 3.139 1.00 87.80 C +ATOM 645 CD1 TYR A 81 -2.557 -4.550 4.420 1.00 87.80 C +ATOM 646 CD2 TYR A 81 -0.763 -4.515 2.843 1.00 87.80 C +ATOM 647 CE1 TYR A 81 -1.710 -5.091 5.382 1.00 87.80 C +ATOM 648 CE2 TYR A 81 0.093 -5.056 3.797 1.00 87.80 C +ATOM 649 OH TYR A 81 0.454 -5.875 6.009 1.00 87.80 O +ATOM 650 CZ TYR A 81 -0.389 -5.340 5.061 1.00 87.80 C +ATOM 651 N LEU A 82 -2.249 -5.130 -0.613 1.00 87.90 N +ATOM 652 CA LEU A 82 -1.204 -5.769 -1.405 1.00 87.90 C +ATOM 653 C LEU A 82 -0.103 -4.774 -1.758 1.00 87.90 C +ATOM 654 CB LEU A 82 -1.792 -6.372 -2.684 1.00 87.90 C +ATOM 655 O LEU A 82 -0.381 -3.601 -2.017 1.00 87.90 O +ATOM 656 CG LEU A 82 -2.814 -7.494 -2.496 1.00 87.90 C +ATOM 657 CD1 LEU A 82 -3.461 -7.850 -3.831 1.00 87.90 C +ATOM 658 CD2 LEU A 82 -2.155 -8.720 -1.873 1.00 87.90 C +ATOM 659 N ILE A 83 1.039 -5.300 -1.744 1.00 89.29 N +ATOM 660 CA ILE A 83 2.172 -4.545 -2.266 1.00 89.29 C +ATOM 661 C ILE A 83 2.658 -5.177 -3.569 1.00 89.29 C +ATOM 662 CB ILE A 83 3.326 -4.476 -1.241 1.00 89.29 C +ATOM 663 O ILE A 83 3.069 -6.339 -3.586 1.00 89.29 O +ATOM 664 CG1 ILE A 83 2.827 -3.894 0.087 1.00 89.29 C +ATOM 665 CG2 ILE A 83 4.493 -3.655 -1.795 1.00 89.29 C +ATOM 666 CD1 ILE A 83 3.829 -4.004 1.227 1.00 89.29 C +ATOM 667 N VAL A 84 2.614 -4.332 -4.531 1.00 87.85 N +ATOM 668 CA VAL A 84 2.865 -4.931 -5.838 1.00 87.85 C +ATOM 669 C VAL A 84 3.900 -4.103 -6.596 1.00 87.85 C +ATOM 670 CB VAL A 84 1.567 -5.051 -6.667 1.00 87.85 C +ATOM 671 O VAL A 84 4.017 -2.894 -6.379 1.00 87.85 O +ATOM 672 CG1 VAL A 84 0.555 -5.950 -5.958 1.00 87.85 C +ATOM 673 CG2 VAL A 84 0.970 -3.669 -6.925 1.00 87.85 C +ATOM 674 N LYS A 85 4.580 -4.886 -7.424 1.00 88.83 N +ATOM 675 CA LYS A 85 5.479 -4.211 -8.356 1.00 88.83 C +ATOM 676 C LYS A 85 5.118 -4.539 -9.802 1.00 88.83 C +ATOM 677 CB LYS A 85 6.932 -4.598 -8.077 1.00 88.83 C +ATOM 678 O LYS A 85 4.656 -5.643 -10.097 1.00 88.83 O +ATOM 679 CG LYS A 85 7.263 -6.044 -8.415 1.00 88.83 C +ATOM 680 CD LYS A 85 8.738 -6.347 -8.189 1.00 88.83 C +ATOM 681 CE LYS A 85 9.083 -7.777 -8.586 1.00 88.83 C +ATOM 682 NZ LYS A 85 10.545 -8.051 -8.452 1.00 88.83 N +ATOM 683 N CYS A 86 5.347 -3.494 -10.613 1.00 87.01 N +ATOM 684 CA CYS A 86 4.988 -3.669 -12.016 1.00 87.01 C +ATOM 685 C CYS A 86 5.915 -2.866 -12.920 1.00 87.01 C +ATOM 686 CB CYS A 86 3.538 -3.249 -12.255 1.00 87.01 C +ATOM 687 O CYS A 86 6.547 -1.907 -12.474 1.00 87.01 O +ATOM 688 SG CYS A 86 3.184 -1.546 -11.770 1.00 87.01 S +ATOM 689 N SER A 87 5.982 -3.350 -14.141 1.00 84.77 N +ATOM 690 CA SER A 87 6.825 -2.679 -15.124 1.00 84.77 C +ATOM 691 C SER A 87 6.068 -1.556 -15.827 1.00 84.77 C +ATOM 692 CB SER A 87 7.344 -3.679 -16.158 1.00 84.77 C +ATOM 693 O SER A 87 6.680 -0.638 -16.378 1.00 84.77 O +ATOM 694 OG SER A 87 6.272 -4.385 -16.758 1.00 84.77 O +ATOM 695 N SER A 88 4.733 -1.589 -15.705 1.00 84.28 N +ATOM 696 CA SER A 88 3.886 -0.566 -16.310 1.00 84.28 C +ATOM 697 C SER A 88 2.970 0.077 -15.274 1.00 84.28 C +ATOM 698 CB SER A 88 3.049 -1.164 -17.442 1.00 84.28 C +ATOM 699 O SER A 88 2.568 -0.571 -14.306 1.00 84.28 O +ATOM 700 OG SER A 88 2.239 -2.224 -16.964 1.00 84.28 O +ATOM 701 N PRO A 89 2.692 1.400 -15.509 1.00 83.74 N +ATOM 702 CA PRO A 89 1.817 2.066 -14.542 1.00 83.74 C +ATOM 703 C PRO A 89 0.395 1.509 -14.551 1.00 83.74 C +ATOM 704 CB PRO A 89 1.833 3.527 -15.000 1.00 83.74 C +ATOM 705 O PRO A 89 -0.127 1.157 -15.612 1.00 83.74 O +ATOM 706 CG PRO A 89 2.218 3.471 -16.443 1.00 83.74 C +ATOM 707 CD PRO A 89 3.050 2.241 -16.667 1.00 83.74 C +ATOM 708 N ILE A 90 -0.154 1.393 -13.349 1.00 81.89 N +ATOM 709 CA ILE A 90 -1.521 0.905 -13.210 1.00 81.89 C +ATOM 710 C ILE A 90 -2.498 2.076 -13.290 1.00 81.89 C +ATOM 711 CB ILE A 90 -1.715 0.136 -11.884 1.00 81.89 C +ATOM 712 O ILE A 90 -2.464 2.979 -12.451 1.00 81.89 O +ATOM 713 CG1 ILE A 90 -0.766 -1.067 -11.822 1.00 81.89 C +ATOM 714 CG2 ILE A 90 -3.172 -0.307 -11.724 1.00 81.89 C +ATOM 715 CD1 ILE A 90 -0.770 -1.789 -10.481 1.00 81.89 C +ATOM 716 N VAL A 91 -3.280 2.157 -14.283 1.00 76.46 N +ATOM 717 CA VAL A 91 -4.186 3.276 -14.522 1.00 76.46 C +ATOM 718 C VAL A 91 -5.539 2.995 -13.871 1.00 76.46 C +ATOM 719 CB VAL A 91 -4.368 3.546 -16.033 1.00 76.46 C +ATOM 720 O VAL A 91 -6.130 3.879 -13.248 1.00 76.46 O +ATOM 721 CG1 VAL A 91 -5.328 4.713 -16.261 1.00 76.46 C +ATOM 722 CG2 VAL A 91 -3.017 3.825 -16.690 1.00 76.46 C +ATOM 723 N ASN A 92 -5.932 1.749 -13.922 1.00 79.92 N +ATOM 724 CA ASN A 92 -7.207 1.333 -13.347 1.00 79.92 C +ATOM 725 C ASN A 92 -7.025 0.202 -12.339 1.00 79.92 C +ATOM 726 CB ASN A 92 -8.181 0.912 -14.449 1.00 79.92 C +ATOM 727 O ASN A 92 -6.887 -0.961 -12.723 1.00 79.92 O +ATOM 728 CG ASN A 92 -9.621 0.882 -13.976 1.00 79.92 C +ATOM 729 ND2 ASN A 92 -10.551 0.752 -14.915 1.00 79.92 N +ATOM 730 OD1 ASN A 92 -9.895 0.977 -12.777 1.00 79.92 O +ATOM 731 N TRP A 93 -7.132 0.542 -11.028 1.00 81.18 N +ATOM 732 CA TRP A 93 -6.893 -0.421 -9.958 1.00 81.18 C +ATOM 733 C TRP A 93 -7.986 -1.483 -9.926 1.00 81.18 C +ATOM 734 CB TRP A 93 -6.814 0.289 -8.604 1.00 81.18 C +ATOM 735 O TRP A 93 -7.703 -2.669 -9.736 1.00 81.18 O +ATOM 736 CG TRP A 93 -5.884 1.465 -8.586 1.00 81.18 C +ATOM 737 CD1 TRP A 93 -6.227 2.786 -8.503 1.00 81.18 C +ATOM 738 CD2 TRP A 93 -4.455 1.425 -8.657 1.00 81.18 C +ATOM 739 CE2 TRP A 93 -3.997 2.761 -8.611 1.00 81.18 C +ATOM 740 CE3 TRP A 93 -3.517 0.389 -8.753 1.00 81.18 C +ATOM 741 NE1 TRP A 93 -5.097 3.570 -8.518 1.00 81.18 N +ATOM 742 CH2 TRP A 93 -1.743 2.053 -8.754 1.00 81.18 C +ATOM 743 CZ2 TRP A 93 -2.640 3.086 -8.659 1.00 81.18 C +ATOM 744 CZ3 TRP A 93 -2.167 0.715 -8.801 1.00 81.18 C +ATOM 745 N SER A 94 -9.162 -1.008 -10.137 1.00 77.06 N +ATOM 746 CA SER A 94 -10.316 -1.898 -10.058 1.00 77.06 C +ATOM 747 C SER A 94 -10.267 -2.965 -11.147 1.00 77.06 C +ATOM 748 CB SER A 94 -11.616 -1.101 -10.172 1.00 77.06 C +ATOM 749 O SER A 94 -10.733 -4.088 -10.944 1.00 77.06 O +ATOM 750 OG SER A 94 -11.625 -0.320 -11.355 1.00 77.06 O +ATOM 751 N ALA A 95 -9.695 -2.637 -12.319 1.00 75.39 N +ATOM 752 CA ALA A 95 -9.584 -3.583 -13.425 1.00 75.39 C +ATOM 753 C ALA A 95 -8.480 -4.604 -13.165 1.00 75.39 C +ATOM 754 CB ALA A 95 -9.323 -2.843 -14.735 1.00 75.39 C +ATOM 755 O ALA A 95 -8.589 -5.763 -13.570 1.00 75.39 O +ATOM 756 N ALA A 96 -7.512 -4.136 -12.391 1.00 74.37 N +ATOM 757 CA ALA A 96 -6.352 -4.988 -12.147 1.00 74.37 C +ATOM 758 C ALA A 96 -6.591 -5.913 -10.957 1.00 74.37 C +ATOM 759 CB ALA A 96 -5.106 -4.137 -11.914 1.00 74.37 C +ATOM 760 O ALA A 96 -6.118 -7.052 -10.942 1.00 74.37 O +ATOM 761 N PHE A 97 -7.447 -5.292 -10.048 1.00 76.21 N +ATOM 762 CA PHE A 97 -7.694 -6.028 -8.815 1.00 76.21 C +ATOM 763 C PHE A 97 -9.182 -6.047 -8.484 1.00 76.21 C +ATOM 764 CB PHE A 97 -6.906 -5.415 -7.653 1.00 76.21 C +ATOM 765 O PHE A 97 -9.754 -5.019 -8.117 1.00 76.21 O +ATOM 766 CG PHE A 97 -5.418 -5.382 -7.880 1.00 76.21 C +ATOM 767 CD1 PHE A 97 -4.647 -6.522 -7.689 1.00 76.21 C +ATOM 768 CD2 PHE A 97 -4.791 -4.210 -8.283 1.00 76.21 C +ATOM 769 CE1 PHE A 97 -3.270 -6.494 -7.898 1.00 76.21 C +ATOM 770 CE2 PHE A 97 -3.416 -4.175 -8.494 1.00 76.21 C +ATOM 771 CZ PHE A 97 -2.657 -5.318 -8.300 1.00 76.21 C +ATOM 772 N THR A 98 -9.885 -7.055 -8.812 1.00 67.49 N +ATOM 773 CA THR A 98 -11.320 -7.128 -8.559 1.00 67.49 C +ATOM 774 C THR A 98 -11.594 -7.595 -7.132 1.00 67.49 C +ATOM 775 CB THR A 98 -12.016 -8.074 -9.555 1.00 67.49 C +ATOM 776 O THR A 98 -12.495 -7.080 -6.467 1.00 67.49 O +ATOM 777 CG2 THR A 98 -12.240 -7.389 -10.899 1.00 67.49 C +ATOM 778 OG1 THR A 98 -11.199 -9.234 -9.753 1.00 67.49 O +ATOM 779 N ALA A 99 -10.656 -8.448 -6.639 1.00 62.88 N +ATOM 780 CA ALA A 99 -10.717 -8.990 -5.284 1.00 62.88 C +ATOM 781 C ALA A 99 -9.318 -9.258 -4.738 1.00 62.88 C +ATOM 782 CB ALA A 99 -11.548 -10.271 -5.261 1.00 62.88 C +ATOM 783 O ALA A 99 -8.814 -10.380 -4.825 1.00 62.88 O +ATOM 784 N PRO A 100 -8.776 -8.201 -4.304 1.00 59.97 N +ATOM 785 CA PRO A 100 -7.367 -8.373 -3.944 1.00 59.97 C +ATOM 786 C PRO A 100 -7.150 -9.487 -2.923 1.00 59.97 C +ATOM 787 CB PRO A 100 -6.984 -7.012 -3.358 1.00 59.97 C +ATOM 788 O PRO A 100 -6.091 -10.119 -2.908 1.00 59.97 O +ATOM 789 CG PRO A 100 -8.269 -6.252 -3.287 1.00 59.97 C +ATOM 790 CD PRO A 100 -9.326 -7.031 -4.016 1.00 59.97 C +ATOM 791 N ALA A 101 -8.228 -9.779 -2.146 1.00 58.09 N +ATOM 792 CA ALA A 101 -8.081 -10.783 -1.096 1.00 58.09 C +ATOM 793 C ALA A 101 -8.115 -12.194 -1.677 1.00 58.09 C +ATOM 794 CB ALA A 101 -9.175 -10.618 -0.044 1.00 58.09 C +ATOM 795 O ALA A 101 -7.543 -13.123 -1.102 1.00 58.09 O +ATOM 796 N LEU A 102 -8.763 -12.265 -2.924 1.00 52.43 N +ATOM 797 CA LEU A 102 -9.026 -13.611 -3.421 1.00 52.43 C +ATOM 798 C LEU A 102 -7.904 -14.080 -4.341 1.00 52.43 C +ATOM 799 CB LEU A 102 -10.364 -13.656 -4.164 1.00 52.43 C +ATOM 800 O LEU A 102 -7.875 -15.244 -4.748 1.00 52.43 O +ATOM 801 CG LEU A 102 -11.620 -13.474 -3.310 1.00 52.43 C +ATOM 802 CD1 LEU A 102 -12.844 -13.287 -4.201 1.00 52.43 C +ATOM 803 CD2 LEU A 102 -11.809 -14.664 -2.376 1.00 52.43 C +ATOM 804 N MET A 103 -6.727 -13.430 -4.264 1.00 54.12 N +ATOM 805 CA MET A 103 -5.605 -13.970 -5.026 1.00 54.12 C +ATOM 806 C MET A 103 -6.079 -14.559 -6.350 1.00 54.12 C +ATOM 807 CB MET A 103 -4.866 -15.035 -4.214 1.00 54.12 C +ATOM 808 O MET A 103 -5.719 -15.685 -6.697 1.00 54.12 O +ATOM 809 CG MET A 103 -4.232 -14.504 -2.939 1.00 54.12 C +ATOM 810 SD MET A 103 -3.086 -15.712 -2.167 1.00 54.12 S +ATOM 811 CE MET A 103 -4.282 -16.883 -1.466 1.00 54.12 C +ATOM 812 N VAL A 104 -7.210 -14.127 -6.875 1.00 53.74 N +ATOM 813 CA VAL A 104 -7.645 -14.583 -8.192 1.00 53.74 C +ATOM 814 C VAL A 104 -6.790 -13.927 -9.274 1.00 53.74 C +ATOM 815 CB VAL A 104 -9.139 -14.275 -8.434 1.00 53.74 C +ATOM 816 O VAL A 104 -6.532 -12.722 -9.225 1.00 53.74 O +ATOM 817 CG1 VAL A 104 -9.579 -14.779 -9.807 1.00 53.74 C +ATOM 818 CG2 VAL A 104 -9.997 -14.897 -7.333 1.00 53.74 C +ATOM 819 N LYS A 105 -5.952 -14.803 -9.923 1.00 57.23 N +ATOM 820 CA LYS A 105 -5.156 -14.342 -11.056 1.00 57.23 C +ATOM 821 C LYS A 105 -6.037 -13.692 -12.119 1.00 57.23 C +ATOM 822 CB LYS A 105 -4.368 -15.503 -11.666 1.00 57.23 C +ATOM 823 O LYS A 105 -6.905 -14.348 -12.699 1.00 57.23 O +ATOM 824 CG LYS A 105 -3.264 -15.068 -12.618 1.00 57.23 C +ATOM 825 CD LYS A 105 -2.453 -16.259 -13.114 1.00 57.23 C +ATOM 826 CE LYS A 105 -1.403 -15.836 -14.132 1.00 57.23 C +ATOM 827 NZ LYS A 105 -0.586 -16.995 -14.601 1.00 57.23 N +ATOM 828 N GLU A 106 -5.934 -12.387 -12.160 1.00 65.23 N +ATOM 829 CA GLU A 106 -6.663 -11.657 -13.193 1.00 65.23 C +ATOM 830 C GLU A 106 -5.801 -11.451 -14.436 1.00 65.23 C +ATOM 831 CB GLU A 106 -7.145 -10.306 -12.658 1.00 65.23 C +ATOM 832 O GLU A 106 -4.590 -11.677 -14.402 1.00 65.23 O +ATOM 833 CG GLU A 106 -8.208 -10.417 -11.575 1.00 65.23 C +ATOM 834 CD GLU A 106 -8.684 -9.068 -11.061 1.00 65.23 C +ATOM 835 OE1 GLU A 106 -9.572 -9.033 -10.178 1.00 65.23 O +ATOM 836 OE2 GLU A 106 -8.166 -8.037 -11.545 1.00 65.23 O +ATOM 837 N SER A 107 -6.425 -11.390 -15.564 1.00 62.60 N +ATOM 838 CA SER A 107 -5.778 -11.389 -16.873 1.00 62.60 C +ATOM 839 C SER A 107 -4.662 -10.351 -16.937 1.00 62.60 C +ATOM 840 CB SER A 107 -6.801 -11.119 -17.977 1.00 62.60 C +ATOM 841 O SER A 107 -3.602 -10.606 -17.511 1.00 62.60 O +ATOM 842 OG SER A 107 -7.519 -9.925 -17.716 1.00 62.60 O +ATOM 843 N CYS A 108 -4.815 -9.269 -16.150 1.00 62.24 N +ATOM 844 CA CYS A 108 -3.843 -8.186 -16.251 1.00 62.24 C +ATOM 845 C CYS A 108 -2.757 -8.327 -15.191 1.00 62.24 C +ATOM 846 CB CYS A 108 -4.534 -6.830 -16.109 1.00 62.24 C +ATOM 847 O CYS A 108 -1.780 -7.577 -15.193 1.00 62.24 O +ATOM 848 SG CYS A 108 -5.825 -6.538 -17.338 1.00 62.24 S +ATOM 849 N GLN A 109 -2.806 -9.427 -14.389 1.00 64.54 N +ATOM 850 CA GLN A 109 -1.895 -9.576 -13.259 1.00 64.54 C +ATOM 851 C GLN A 109 -0.577 -10.208 -13.694 1.00 64.54 C +ATOM 852 CB GLN A 109 -2.541 -10.416 -12.156 1.00 64.54 C +ATOM 853 O GLN A 109 0.350 -10.338 -12.892 1.00 64.54 O +ATOM 854 CG GLN A 109 -3.464 -9.624 -11.239 1.00 64.54 C +ATOM 855 CD GLN A 109 -3.998 -10.452 -10.086 1.00 64.54 C +ATOM 856 NE2 GLN A 109 -4.624 -9.788 -9.120 1.00 64.54 N +ATOM 857 OE1 GLN A 109 -3.850 -11.678 -10.064 1.00 64.54 O +ATOM 858 N ASP A 110 -0.566 -10.594 -15.035 1.00 65.20 N +ATOM 859 CA ASP A 110 0.652 -11.248 -15.503 1.00 65.20 C +ATOM 860 C ASP A 110 1.844 -10.295 -15.444 1.00 65.20 C +ATOM 861 CB ASP A 110 0.467 -11.770 -16.929 1.00 65.20 C +ATOM 862 O ASP A 110 2.973 -10.720 -15.190 1.00 65.20 O +ATOM 863 CG ASP A 110 -0.486 -12.950 -17.009 1.00 65.20 C +ATOM 864 OD1 ASP A 110 -0.636 -13.682 -16.008 1.00 65.20 O +ATOM 865 OD2 ASP A 110 -1.091 -13.150 -18.085 1.00 65.20 O +ATOM 866 N MET A 111 1.494 -9.082 -15.439 1.00 71.66 N +ATOM 867 CA MET A 111 2.554 -8.077 -15.464 1.00 71.66 C +ATOM 868 C MET A 111 2.816 -7.528 -14.066 1.00 71.66 C +ATOM 869 CB MET A 111 2.191 -6.936 -16.415 1.00 71.66 C +ATOM 870 O MET A 111 3.737 -6.734 -13.869 1.00 71.66 O +ATOM 871 CG MET A 111 1.997 -7.377 -17.857 1.00 71.66 C +ATOM 872 SD MET A 111 1.898 -5.960 -19.018 1.00 71.66 S +ATOM 873 CE MET A 111 0.319 -5.231 -18.501 1.00 71.66 C +ATOM 874 N ILE A 112 2.007 -8.068 -13.091 1.00 80.57 N +ATOM 875 CA ILE A 112 2.088 -7.561 -11.725 1.00 80.57 C +ATOM 876 C ILE A 112 2.701 -8.622 -10.815 1.00 80.57 C +ATOM 877 CB ILE A 112 0.699 -7.138 -11.196 1.00 80.57 C +ATOM 878 O ILE A 112 2.294 -9.786 -10.847 1.00 80.57 O +ATOM 879 CG1 ILE A 112 0.099 -6.043 -12.086 1.00 80.57 C +ATOM 880 CG2 ILE A 112 0.795 -6.671 -9.741 1.00 80.57 C +ATOM 881 CD1 ILE A 112 -1.357 -5.724 -11.776 1.00 80.57 C +ATOM 882 N THR A 113 3.675 -8.222 -10.114 1.00 84.41 N +ATOM 883 CA THR A 113 4.269 -9.120 -9.129 1.00 84.41 C +ATOM 884 C THR A 113 3.883 -8.702 -7.713 1.00 84.41 C +ATOM 885 CB THR A 113 5.803 -9.153 -9.257 1.00 84.41 C +ATOM 886 O THR A 113 4.102 -7.555 -7.318 1.00 84.41 O +ATOM 887 CG2 THR A 113 6.410 -10.200 -8.329 1.00 84.41 C +ATOM 888 OG1 THR A 113 6.157 -9.468 -10.610 1.00 84.41 O +ATOM 889 N ILE A 114 3.370 -9.713 -6.992 1.00 84.55 N +ATOM 890 CA ILE A 114 2.975 -9.447 -5.613 1.00 84.55 C +ATOM 891 C ILE A 114 4.164 -9.677 -4.683 1.00 84.55 C +ATOM 892 CB ILE A 114 1.782 -10.332 -5.187 1.00 84.55 C +ATOM 893 O ILE A 114 4.694 -10.787 -4.605 1.00 84.55 O +ATOM 894 CG1 ILE A 114 0.573 -10.071 -6.092 1.00 84.55 C +ATOM 895 CG2 ILE A 114 1.428 -10.089 -3.717 1.00 84.55 C +ATOM 896 CD1 ILE A 114 -0.592 -11.023 -5.858 1.00 84.55 C +ATOM 897 N ILE A 115 4.484 -8.655 -3.953 1.00 86.61 N +ATOM 898 CA ILE A 115 5.668 -8.680 -3.101 1.00 86.61 C +ATOM 899 C ILE A 115 5.262 -8.995 -1.663 1.00 86.61 C +ATOM 900 CB ILE A 115 6.435 -7.340 -3.160 1.00 86.61 C +ATOM 901 O ILE A 115 6.002 -9.660 -0.934 1.00 86.61 O +ATOM 902 CG1 ILE A 115 6.817 -7.007 -4.607 1.00 86.61 C +ATOM 903 CG2 ILE A 115 7.676 -7.388 -2.263 1.00 86.61 C +ATOM 904 CD1 ILE A 115 7.314 -5.582 -4.803 1.00 86.61 C +ATOM 905 N GLY A 116 4.116 -8.529 -1.377 1.00 84.99 N +ATOM 906 CA GLY A 116 3.620 -8.729 -0.025 1.00 84.99 C +ATOM 907 C GLY A 116 2.115 -8.572 0.087 1.00 84.99 C +ATOM 908 O GLY A 116 1.477 -8.006 -0.803 1.00 84.99 O +ATOM 909 N LYS A 117 1.620 -9.121 1.184 1.00 86.10 N +ATOM 910 CA LYS A 117 0.188 -9.025 1.454 1.00 86.10 C +ATOM 911 C LYS A 117 -0.086 -8.971 2.955 1.00 86.10 C +ATOM 912 CB LYS A 117 -0.556 -10.205 0.828 1.00 86.10 C +ATOM 913 O LYS A 117 0.730 -9.431 3.757 1.00 86.10 O +ATOM 914 CG LYS A 117 -0.188 -11.556 1.424 1.00 86.10 C +ATOM 915 CD LYS A 117 -0.978 -12.686 0.776 1.00 86.10 C +ATOM 916 CE LYS A 117 -0.637 -14.034 1.397 1.00 86.10 C +ATOM 917 NZ LYS A 117 -1.389 -15.149 0.747 1.00 86.10 N +ATOM 918 N GLY A 118 -1.263 -8.431 3.206 1.00 87.10 N +ATOM 919 CA GLY A 118 -1.643 -8.344 4.607 1.00 87.10 C +ATOM 920 C GLY A 118 -3.112 -8.026 4.809 1.00 87.10 C +ATOM 921 O GLY A 118 -3.832 -7.756 3.845 1.00 87.10 O +ATOM 922 N LYS A 119 -3.449 -8.235 6.050 1.00 86.97 N +ATOM 923 CA LYS A 119 -4.836 -7.981 6.429 1.00 86.97 C +ATOM 924 C LYS A 119 -4.916 -7.268 7.776 1.00 86.97 C +ATOM 925 CB LYS A 119 -5.627 -9.289 6.481 1.00 86.97 C +ATOM 926 O LYS A 119 -4.122 -7.543 8.678 1.00 86.97 O +ATOM 927 CG LYS A 119 -7.074 -9.120 6.920 1.00 86.97 C +ATOM 928 CD LYS A 119 -7.776 -10.465 7.057 1.00 86.97 C +ATOM 929 CE LYS A 119 -9.183 -10.307 7.620 1.00 86.97 C +ATOM 930 NZ LYS A 119 -9.860 -11.626 7.797 1.00 86.97 N +ATOM 931 N VAL A 120 -5.814 -6.284 7.800 1.00 87.69 N +ATOM 932 CA VAL A 120 -6.037 -5.556 9.045 1.00 87.69 C +ATOM 933 C VAL A 120 -7.505 -5.665 9.452 1.00 87.69 C +ATOM 934 CB VAL A 120 -5.629 -4.071 8.914 1.00 87.69 C +ATOM 935 O VAL A 120 -8.400 -5.362 8.659 1.00 87.69 O +ATOM 936 CG1 VAL A 120 -5.859 -3.330 10.230 1.00 87.69 C +ATOM 937 CG2 VAL A 120 -4.170 -3.955 8.479 1.00 87.69 C +ATOM 938 N GLU A 121 -7.644 -6.122 10.671 1.00 85.12 N +ATOM 939 CA GLU A 121 -8.999 -6.273 11.194 1.00 85.12 C +ATOM 940 C GLU A 121 -9.199 -5.439 12.456 1.00 85.12 C +ATOM 941 CB GLU A 121 -9.303 -7.745 11.482 1.00 85.12 C +ATOM 942 O GLU A 121 -8.292 -5.326 13.283 1.00 85.12 O +ATOM 943 CG GLU A 121 -9.252 -8.637 10.250 1.00 85.12 C +ATOM 944 CD GLU A 121 -9.503 -10.104 10.560 1.00 85.12 C +ATOM 945 OE1 GLU A 121 -9.539 -10.926 9.617 1.00 85.12 O +ATOM 946 OE2 GLU A 121 -9.666 -10.433 11.756 1.00 85.12 O +ATOM 947 N SER A 122 -10.294 -4.777 12.425 1.00 82.34 N +ATOM 948 CA SER A 122 -10.593 -3.985 13.614 1.00 82.34 C +ATOM 949 C SER A 122 -11.436 -4.776 14.608 1.00 82.34 C +ATOM 950 CB SER A 122 -11.319 -2.695 13.230 1.00 82.34 C +ATOM 951 O SER A 122 -12.333 -5.524 14.212 1.00 82.34 O +ATOM 952 OG SER A 122 -12.613 -2.977 12.726 1.00 82.34 O +ATOM 953 N ASN A 123 -10.909 -4.785 15.866 1.00 77.65 N +ATOM 954 CA ASN A 123 -11.666 -5.313 16.996 1.00 77.65 C +ATOM 955 C ASN A 123 -12.124 -4.199 17.933 1.00 77.65 C +ATOM 956 CB ASN A 123 -10.837 -6.345 17.763 1.00 77.65 C +ATOM 957 O ASN A 123 -11.431 -3.193 18.095 1.00 77.65 O +ATOM 958 CG ASN A 123 -10.470 -7.547 16.914 1.00 77.65 C +ATOM 959 ND2 ASN A 123 -9.336 -8.165 17.221 1.00 77.65 N +ATOM 960 OD1 ASN A 123 -11.199 -7.915 15.990 1.00 77.65 O +ATOM 961 N GLY A 124 -13.426 -4.207 18.226 1.00 69.22 N +ATOM 962 CA GLY A 124 -13.931 -3.229 19.177 1.00 69.22 C +ATOM 963 C GLY A 124 -15.434 -3.303 19.369 1.00 69.22 C +ATOM 964 O GLY A 124 -16.074 -4.263 18.935 1.00 69.22 O +ATOM 965 N VAL A 125 -15.889 -2.437 20.401 1.00 69.68 N +ATOM 966 CA VAL A 125 -17.295 -2.319 20.775 1.00 69.68 C +ATOM 967 C VAL A 125 -18.026 -1.436 19.767 1.00 69.68 C +ATOM 968 CB VAL A 125 -17.457 -1.748 22.201 1.00 69.68 C +ATOM 969 O VAL A 125 -17.482 -0.431 19.304 1.00 69.68 O +ATOM 970 CG1 VAL A 125 -18.933 -1.661 22.584 1.00 69.68 C +ATOM 971 CG2 VAL A 125 -16.689 -2.602 23.208 1.00 69.68 C +ATOM 972 N ALA A 126 -19.196 -1.966 19.356 1.00 66.46 N +ATOM 973 CA ALA A 126 -20.111 -1.272 18.454 1.00 66.46 C +ATOM 974 C ALA A 126 -20.345 0.165 18.910 1.00 66.46 C +ATOM 975 CB ALA A 126 -21.438 -2.021 18.361 1.00 66.46 C +ATOM 976 O ALA A 126 -20.435 0.435 20.110 1.00 66.46 O +ATOM 977 N GLY A 127 -20.045 1.171 18.047 1.00 68.21 N +ATOM 978 CA GLY A 127 -20.541 2.528 18.208 1.00 68.21 C +ATOM 979 C GLY A 127 -19.441 3.572 18.181 1.00 68.21 C +ATOM 980 O GLY A 127 -19.718 4.773 18.134 1.00 68.21 O +ATOM 981 N SER A 128 -18.140 3.083 18.120 1.00 76.87 N +ATOM 982 CA SER A 128 -17.053 4.046 17.979 1.00 76.87 C +ATOM 983 C SER A 128 -16.007 3.556 16.983 1.00 76.87 C +ATOM 984 CB SER A 128 -16.394 4.314 19.332 1.00 76.87 C +ATOM 985 O SER A 128 -15.817 2.349 16.818 1.00 76.87 O +ATOM 986 OG SER A 128 -15.810 3.131 19.851 1.00 76.87 O +ATOM 987 N ASP A 129 -15.584 4.510 16.093 1.00 79.46 N +ATOM 988 CA ASP A 129 -14.506 4.214 15.154 1.00 79.46 C +ATOM 989 C ASP A 129 -13.233 3.804 15.891 1.00 79.46 C +ATOM 990 CB ASP A 129 -14.229 5.422 14.257 1.00 79.46 C +ATOM 991 O ASP A 129 -12.938 4.325 16.969 1.00 79.46 O +ATOM 992 CG ASP A 129 -15.332 5.674 13.244 1.00 79.46 C +ATOM 993 OD1 ASP A 129 -16.185 4.784 13.037 1.00 79.46 O +ATOM 994 OD2 ASP A 129 -15.346 6.771 12.644 1.00 79.46 O +ATOM 995 N CYS A 130 -12.612 2.748 15.435 1.00 81.16 N +ATOM 996 CA CYS A 130 -11.344 2.259 15.963 1.00 81.16 C +ATOM 997 C CYS A 130 -10.194 2.600 15.022 1.00 81.16 C +ATOM 998 CB CYS A 130 -11.402 0.748 16.185 1.00 81.16 C +ATOM 999 O CYS A 130 -10.375 2.643 13.804 1.00 81.16 O +ATOM 1000 SG CYS A 130 -12.773 0.219 17.236 1.00 81.16 S +ATOM 1001 N THR A 131 -9.160 3.038 15.655 1.00 85.64 N +ATOM 1002 CA THR A 131 -7.950 3.337 14.896 1.00 85.64 C +ATOM 1003 C THR A 131 -6.974 2.166 14.953 1.00 85.64 C +ATOM 1004 CB THR A 131 -7.261 4.610 15.421 1.00 85.64 C +ATOM 1005 O THR A 131 -6.623 1.695 16.037 1.00 85.64 O +ATOM 1006 CG2 THR A 131 -6.090 5.008 14.530 1.00 85.64 C +ATOM 1007 OG1 THR A 131 -8.211 5.682 15.452 1.00 85.64 O +ATOM 1008 N LYS A 132 -6.641 1.702 13.741 1.00 87.39 N +ATOM 1009 CA LYS A 132 -5.650 0.637 13.623 1.00 87.39 C +ATOM 1010 C LYS A 132 -4.508 1.048 12.697 1.00 87.39 C +ATOM 1011 CB LYS A 132 -6.302 -0.649 13.112 1.00 87.39 C +ATOM 1012 O LYS A 132 -4.682 1.911 11.834 1.00 87.39 O +ATOM 1013 CG LYS A 132 -7.313 -1.255 14.073 1.00 87.39 C +ATOM 1014 CD LYS A 132 -6.629 -1.901 15.271 1.00 87.39 C +ATOM 1015 CE LYS A 132 -7.630 -2.613 16.171 1.00 87.39 C +ATOM 1016 NZ LYS A 132 -6.967 -3.228 17.359 1.00 87.39 N +ATOM 1017 N SER A 133 -3.368 0.482 13.018 1.00 86.10 N +ATOM 1018 CA SER A 133 -2.226 0.818 12.174 1.00 86.10 C +ATOM 1019 C SER A 133 -1.333 -0.396 11.944 1.00 86.10 C +ATOM 1020 CB SER A 133 -1.411 1.950 12.801 1.00 86.10 C +ATOM 1021 O SER A 133 -1.364 -1.353 12.721 1.00 86.10 O +ATOM 1022 OG SER A 133 -0.836 1.535 14.028 1.00 86.10 O +ATOM 1023 N PHE A 134 -0.741 -0.415 10.758 1.00 87.51 N +ATOM 1024 CA PHE A 134 0.295 -1.415 10.527 1.00 87.51 C +ATOM 1025 C PHE A 134 1.553 -0.769 9.958 1.00 87.51 C +ATOM 1026 CB PHE A 134 -0.211 -2.505 9.578 1.00 87.51 C +ATOM 1027 O PHE A 134 1.483 0.284 9.321 1.00 87.51 O +ATOM 1028 CG PHE A 134 -0.410 -2.034 8.162 1.00 87.51 C +ATOM 1029 CD1 PHE A 134 -1.642 -1.547 7.744 1.00 87.51 C +ATOM 1030 CD2 PHE A 134 0.636 -2.077 7.250 1.00 87.51 C +ATOM 1031 CE1 PHE A 134 -1.830 -1.110 6.435 1.00 87.51 C +ATOM 1032 CE2 PHE A 134 0.457 -1.642 5.940 1.00 87.51 C +ATOM 1033 CZ PHE A 134 -0.777 -1.160 5.534 1.00 87.51 C +ATOM 1034 N ASN A 135 2.616 -1.418 10.437 1.00 88.70 N +ATOM 1035 CA ASN A 135 3.947 -1.013 9.997 1.00 88.70 C +ATOM 1036 C ASN A 135 4.746 -2.198 9.464 1.00 88.70 C +ATOM 1037 CB ASN A 135 4.705 -0.331 11.138 1.00 88.70 C +ATOM 1038 O ASN A 135 4.837 -3.237 10.120 1.00 88.70 O +ATOM 1039 CG ASN A 135 5.988 0.330 10.673 1.00 88.70 C +ATOM 1040 ND2 ASN A 135 6.483 1.280 11.458 1.00 88.70 N +ATOM 1041 OD1 ASN A 135 6.528 -0.009 9.618 1.00 88.70 O +ATOM 1042 N LYS A 136 5.251 -1.911 8.243 1.00 88.04 N +ATOM 1043 CA LYS A 136 5.975 -3.026 7.640 1.00 88.04 C +ATOM 1044 C LYS A 136 7.209 -2.539 6.888 1.00 88.04 C +ATOM 1045 CB LYS A 136 5.062 -3.812 6.697 1.00 88.04 C +ATOM 1046 O LYS A 136 7.172 -1.494 6.234 1.00 88.04 O +ATOM 1047 CG LYS A 136 5.653 -5.130 6.219 1.00 88.04 C +ATOM 1048 CD LYS A 136 4.603 -6.001 5.542 1.00 88.04 C +ATOM 1049 CE LYS A 136 5.167 -7.361 5.156 1.00 88.04 C +ATOM 1050 NZ LYS A 136 4.099 -8.288 4.676 1.00 88.04 N +ATOM 1051 N PHE A 137 8.259 -3.375 7.088 1.00 87.83 N +ATOM 1052 CA PHE A 137 9.443 -3.190 6.257 1.00 87.83 C +ATOM 1053 C PHE A 137 9.465 -4.199 5.115 1.00 87.83 C +ATOM 1054 CB PHE A 137 10.717 -3.320 7.097 1.00 87.83 C +ATOM 1055 O PHE A 137 9.299 -5.400 5.337 1.00 87.83 O +ATOM 1056 CG PHE A 137 11.041 -2.091 7.903 1.00 87.83 C +ATOM 1057 CD1 PHE A 137 11.798 -1.062 7.355 1.00 87.83 C +ATOM 1058 CD2 PHE A 137 10.588 -1.964 9.209 1.00 87.83 C +ATOM 1059 CE1 PHE A 137 12.098 0.076 8.098 1.00 87.83 C +ATOM 1060 CE2 PHE A 137 10.884 -0.829 9.959 1.00 87.83 C +ATOM 1061 CZ PHE A 137 11.641 0.190 9.401 1.00 87.83 C +ATOM 1062 N ILE A 138 9.701 -3.637 3.939 1.00 88.47 N +ATOM 1063 CA ILE A 138 9.722 -4.526 2.783 1.00 88.47 C +ATOM 1064 C ILE A 138 11.081 -4.444 2.093 1.00 88.47 C +ATOM 1065 CB ILE A 138 8.593 -4.182 1.786 1.00 88.47 C +ATOM 1066 O ILE A 138 11.481 -3.377 1.620 1.00 88.47 O +ATOM 1067 CG1 ILE A 138 7.232 -4.199 2.492 1.00 88.47 C +ATOM 1068 CG2 ILE A 138 8.606 -5.151 0.600 1.00 88.47 C +ATOM 1069 CD1 ILE A 138 6.109 -3.559 1.688 1.00 88.47 C +ATOM 1070 N ARG A 139 11.687 -5.645 2.028 1.00 87.36 N +ATOM 1071 CA ARG A 139 12.953 -5.733 1.308 1.00 87.36 C +ATOM 1072 C ARG A 139 12.727 -6.094 -0.156 1.00 87.36 C +ATOM 1073 CB ARG A 139 13.876 -6.761 1.966 1.00 87.36 C +ATOM 1074 O ARG A 139 12.125 -7.126 -0.460 1.00 87.36 O +ATOM 1075 CG ARG A 139 14.370 -6.353 3.345 1.00 87.36 C +ATOM 1076 CD ARG A 139 15.334 -7.378 3.924 1.00 87.36 C +ATOM 1077 NE ARG A 139 15.741 -7.028 5.282 1.00 87.36 N +ATOM 1078 NH1 ARG A 139 17.092 -8.879 5.577 1.00 87.36 N +ATOM 1079 NH2 ARG A 139 16.869 -7.337 7.259 1.00 87.36 N +ATOM 1080 CZ ARG A 139 16.566 -7.749 6.036 1.00 87.36 C +ATOM 1081 N LEU A 140 13.264 -5.201 -1.016 1.00 86.06 N +ATOM 1082 CA LEU A 140 13.037 -5.357 -2.448 1.00 86.06 C +ATOM 1083 C LEU A 140 14.271 -5.936 -3.134 1.00 86.06 C +ATOM 1084 CB LEU A 140 12.669 -4.014 -3.083 1.00 86.06 C +ATOM 1085 O LEU A 140 15.255 -5.225 -3.352 1.00 86.06 O +ATOM 1086 CG LEU A 140 11.412 -3.330 -2.542 1.00 86.06 C +ATOM 1087 CD1 LEU A 140 11.325 -1.897 -3.058 1.00 86.06 C +ATOM 1088 CD2 LEU A 140 10.166 -4.119 -2.926 1.00 86.06 C +ATOM 1089 N GLY A 141 14.597 -7.224 -2.835 1.00 81.06 N +ATOM 1090 CA GLY A 141 15.694 -7.984 -3.415 1.00 81.06 C +ATOM 1091 C GLY A 141 16.563 -7.161 -4.347 1.00 81.06 C +ATOM 1092 O GLY A 141 17.296 -6.276 -3.901 1.00 81.06 O +ATOM 1093 N ALA A 142 16.255 -7.428 -5.779 1.00 82.27 N +ATOM 1094 CA ALA A 142 17.069 -6.818 -6.827 1.00 82.27 C +ATOM 1095 C ALA A 142 16.843 -5.310 -6.890 1.00 82.27 C +ATOM 1096 CB ALA A 142 16.760 -7.456 -8.179 1.00 82.27 C +ATOM 1097 O ALA A 142 17.615 -4.586 -7.522 1.00 82.27 O +ATOM 1098 N GLY A 143 15.890 -4.822 -6.144 1.00 84.22 N +ATOM 1099 CA GLY A 143 15.569 -3.403 -6.149 1.00 84.22 C +ATOM 1100 C GLY A 143 14.611 -3.012 -7.258 1.00 84.22 C +ATOM 1101 O GLY A 143 14.346 -3.804 -8.165 1.00 84.22 O +ATOM 1102 N ILE A 144 13.915 -1.913 -6.977 1.00 87.68 N +ATOM 1103 CA ILE A 144 12.978 -1.342 -7.939 1.00 87.68 C +ATOM 1104 C ILE A 144 13.564 -0.064 -8.533 1.00 87.68 C +ATOM 1105 CB ILE A 144 11.607 -1.052 -7.288 1.00 87.68 C +ATOM 1106 O ILE A 144 13.821 0.903 -7.812 1.00 87.68 O +ATOM 1107 CG1 ILE A 144 10.989 -2.346 -6.745 1.00 87.68 C +ATOM 1108 CG2 ILE A 144 10.667 -0.374 -8.289 1.00 87.68 C +ATOM 1109 CD1 ILE A 144 9.655 -2.146 -6.038 1.00 87.68 C +ATOM 1110 N SER A 145 13.784 -0.188 -9.855 1.00 86.91 N +ATOM 1111 CA SER A 145 14.379 0.952 -10.545 1.00 86.91 C +ATOM 1112 C SER A 145 13.323 1.991 -10.909 1.00 86.91 C +ATOM 1113 CB SER A 145 15.110 0.493 -11.808 1.00 86.91 C +ATOM 1114 O SER A 145 12.133 1.786 -10.662 1.00 86.91 O +ATOM 1115 OG SER A 145 14.200 -0.062 -12.742 1.00 86.91 O +ATOM 1116 N GLN A 146 13.703 3.068 -11.487 1.00 82.48 N +ATOM 1117 CA GLN A 146 12.836 4.186 -11.844 1.00 82.48 C +ATOM 1118 C GLN A 146 11.860 3.795 -12.950 1.00 82.48 C +ATOM 1119 CB GLN A 146 13.668 5.393 -12.281 1.00 82.48 C +ATOM 1120 O GLN A 146 10.828 4.444 -13.132 1.00 82.48 O +ATOM 1121 CG GLN A 146 14.480 5.154 -13.547 1.00 82.48 C +ATOM 1122 CD GLN A 146 15.366 6.331 -13.906 1.00 82.48 C +ATOM 1123 NE2 GLN A 146 16.152 6.180 -14.967 1.00 82.48 N +ATOM 1124 OE1 GLN A 146 15.345 7.369 -13.237 1.00 82.48 O +ATOM 1125 N THR A 147 12.225 2.722 -13.671 1.00 85.27 N +ATOM 1126 CA THR A 147 11.385 2.302 -14.787 1.00 85.27 C +ATOM 1127 C THR A 147 10.260 1.391 -14.304 1.00 85.27 C +ATOM 1128 CB THR A 147 12.210 1.576 -15.865 1.00 85.27 C +ATOM 1129 O THR A 147 9.326 1.099 -15.053 1.00 85.27 O +ATOM 1130 CG2 THR A 147 13.230 2.514 -16.502 1.00 85.27 C +ATOM 1131 OG1 THR A 147 12.902 0.473 -15.266 1.00 85.27 O +ATOM 1132 N GLN A 148 10.451 0.971 -13.039 1.00 88.60 N +ATOM 1133 CA GLN A 148 9.418 0.109 -12.474 1.00 88.60 C +ATOM 1134 C GLN A 148 8.558 0.868 -11.467 1.00 88.60 C +ATOM 1135 CB GLN A 148 10.046 -1.117 -11.809 1.00 88.60 C +ATOM 1136 O GLN A 148 8.915 1.969 -11.043 1.00 88.60 O +ATOM 1137 CG GLN A 148 10.790 -2.027 -12.776 1.00 88.60 C +ATOM 1138 CD GLN A 148 11.385 -3.246 -12.095 1.00 88.60 C +ATOM 1139 NE2 GLN A 148 11.490 -4.345 -12.833 1.00 88.60 N +ATOM 1140 OE1 GLN A 148 11.747 -3.199 -10.915 1.00 88.60 O +ATOM 1141 N HIS A 149 7.381 0.230 -11.215 1.00 88.08 N +ATOM 1142 CA HIS A 149 6.435 0.908 -10.335 1.00 88.08 C +ATOM 1143 C HIS A 149 6.081 0.039 -9.133 1.00 88.08 C +ATOM 1144 CB HIS A 149 5.167 1.287 -11.102 1.00 88.08 C +ATOM 1145 O HIS A 149 5.890 -1.171 -9.271 1.00 88.08 O +ATOM 1146 CG HIS A 149 5.428 2.102 -12.328 1.00 88.08 C +ATOM 1147 CD2 HIS A 149 5.673 1.730 -13.607 1.00 88.08 C +ATOM 1148 ND1 HIS A 149 5.459 3.479 -12.314 1.00 88.08 N +ATOM 1149 CE1 HIS A 149 5.712 3.921 -13.535 1.00 88.08 C +ATOM 1150 NE2 HIS A 149 5.846 2.879 -14.338 1.00 88.08 N +ATOM 1151 N LEU A 150 6.060 0.736 -8.003 1.00 90.10 N +ATOM 1152 CA LEU A 150 5.694 0.091 -6.748 1.00 90.10 C +ATOM 1153 C LEU A 150 4.411 0.691 -6.182 1.00 90.10 C +ATOM 1154 CB LEU A 150 6.826 0.223 -5.726 1.00 90.10 C +ATOM 1155 O LEU A 150 4.315 1.908 -6.006 1.00 90.10 O +ATOM 1156 CG LEU A 150 6.630 -0.508 -4.397 1.00 90.10 C +ATOM 1157 CD1 LEU A 150 6.605 -2.017 -4.622 1.00 90.10 C +ATOM 1158 CD2 LEU A 150 7.727 -0.127 -3.410 1.00 90.10 C +ATOM 1159 N TYR A 151 3.458 -0.256 -5.882 1.00 89.51 N +ATOM 1160 CA TYR A 151 2.157 0.226 -5.433 1.00 89.51 C +ATOM 1161 C TYR A 151 1.729 -0.476 -4.150 1.00 89.51 C +ATOM 1162 CB TYR A 151 1.100 0.013 -6.521 1.00 89.51 C +ATOM 1163 O TYR A 151 2.125 -1.616 -3.897 1.00 89.51 O +ATOM 1164 CG TYR A 151 1.343 0.825 -7.770 1.00 89.51 C +ATOM 1165 CD1 TYR A 151 0.980 2.169 -7.833 1.00 89.51 C +ATOM 1166 CD2 TYR A 151 1.934 0.251 -8.890 1.00 89.51 C +ATOM 1167 CE1 TYR A 151 1.200 2.921 -8.982 1.00 89.51 C +ATOM 1168 CE2 TYR A 151 2.159 0.993 -10.045 1.00 89.51 C +ATOM 1169 OH TYR A 151 2.010 3.065 -11.222 1.00 89.51 O +ATOM 1170 CZ TYR A 151 1.790 2.325 -10.081 1.00 89.51 C +ATOM 1171 N VAL A 152 0.992 0.251 -3.361 1.00 88.97 N +ATOM 1172 CA VAL A 152 0.201 -0.349 -2.292 1.00 88.97 C +ATOM 1173 C VAL A 152 -1.283 -0.277 -2.643 1.00 88.97 C +ATOM 1174 CB VAL A 152 0.462 0.344 -0.936 1.00 88.97 C +ATOM 1175 O VAL A 152 -1.817 0.807 -2.888 1.00 88.97 O +ATOM 1176 CG1 VAL A 152 -0.401 -0.276 0.162 1.00 88.97 C +ATOM 1177 CG2 VAL A 152 1.942 0.257 -0.569 1.00 88.97 C +ATOM 1178 N VAL A 153 -1.835 -1.459 -2.726 1.00 88.76 N +ATOM 1179 CA VAL A 153 -3.238 -1.554 -3.114 1.00 88.76 C +ATOM 1180 C VAL A 153 -4.073 -2.021 -1.924 1.00 88.76 C +ATOM 1181 CB VAL A 153 -3.433 -2.511 -4.311 1.00 88.76 C +ATOM 1182 O VAL A 153 -3.738 -3.015 -1.275 1.00 88.76 O +ATOM 1183 CG1 VAL A 153 -4.901 -2.562 -4.728 1.00 88.76 C +ATOM 1184 CG2 VAL A 153 -2.555 -2.083 -5.485 1.00 88.76 C +ATOM 1185 N MET A 154 -5.133 -1.320 -1.720 1.00 88.40 N +ATOM 1186 CA MET A 154 -5.961 -1.635 -0.560 1.00 88.40 C +ATOM 1187 C MET A 154 -7.403 -1.905 -0.978 1.00 88.40 C +ATOM 1188 CB MET A 154 -5.917 -0.495 0.460 1.00 88.40 C +ATOM 1189 O MET A 154 -7.905 -1.292 -1.921 1.00 88.40 O +ATOM 1190 CG MET A 154 -4.541 -0.268 1.065 1.00 88.40 C +ATOM 1191 SD MET A 154 -4.537 1.074 2.317 1.00 88.40 S +ATOM 1192 CE MET A 154 -2.826 1.655 2.158 1.00 88.40 C +ATOM 1193 N TYR A 155 -7.925 -2.832 -0.305 1.00 87.23 N +ATOM 1194 CA TYR A 155 -9.336 -3.165 -0.468 1.00 87.23 C +ATOM 1195 C TYR A 155 -10.054 -3.171 0.876 1.00 87.23 C +ATOM 1196 CB TYR A 155 -9.491 -4.529 -1.149 1.00 87.23 C +ATOM 1197 O TYR A 155 -9.670 -3.905 1.789 1.00 87.23 O +ATOM 1198 CG TYR A 155 -10.927 -4.964 -1.315 1.00 87.23 C +ATOM 1199 CD1 TYR A 155 -11.496 -5.899 -0.453 1.00 87.23 C +ATOM 1200 CD2 TYR A 155 -11.717 -4.443 -2.334 1.00 87.23 C +ATOM 1201 CE1 TYR A 155 -12.818 -6.305 -0.603 1.00 87.23 C +ATOM 1202 CE2 TYR A 155 -13.040 -4.842 -2.494 1.00 87.23 C +ATOM 1203 OH TYR A 155 -14.890 -6.169 -1.778 1.00 87.23 O +ATOM 1204 CZ TYR A 155 -13.581 -5.771 -1.624 1.00 87.23 C +ATOM 1205 N THR A 156 -11.074 -2.359 0.848 1.00 86.18 N +ATOM 1206 CA THR A 156 -11.761 -2.230 2.129 1.00 86.18 C +ATOM 1207 C THR A 156 -13.210 -2.694 2.014 1.00 86.18 C +ATOM 1208 CB THR A 156 -11.724 -0.777 2.638 1.00 86.18 C +ATOM 1209 O THR A 156 -13.827 -2.566 0.955 1.00 86.18 O +ATOM 1210 CG2 THR A 156 -10.289 -0.279 2.774 1.00 86.18 C +ATOM 1211 OG1 THR A 156 -12.425 0.065 1.715 1.00 86.18 O +ATOM 1212 N SER A 157 -13.723 -3.295 3.038 1.00 83.06 N +ATOM 1213 CA SER A 157 -15.109 -3.750 3.082 1.00 83.06 C +ATOM 1214 C SER A 157 -16.053 -2.610 3.449 1.00 83.06 C +ATOM 1215 CB SER A 157 -15.265 -4.896 4.083 1.00 83.06 C +ATOM 1216 O SER A 157 -17.247 -2.665 3.147 1.00 83.06 O +ATOM 1217 OG SER A 157 -14.892 -4.480 5.385 1.00 83.06 O +ATOM 1218 N GLU A 158 -15.523 -1.527 4.005 1.00 84.44 N +ATOM 1219 CA GLU A 158 -16.275 -0.334 4.383 1.00 84.44 C +ATOM 1220 C GLU A 158 -15.476 0.935 4.097 1.00 84.44 C +ATOM 1221 CB GLU A 158 -16.663 -0.388 5.863 1.00 84.44 C +ATOM 1222 O GLU A 158 -14.287 0.867 3.778 1.00 84.44 O +ATOM 1223 CG GLU A 158 -17.731 0.621 6.256 1.00 84.44 C +ATOM 1224 CD GLU A 158 -18.244 0.431 7.674 1.00 84.44 C +ATOM 1225 OE1 GLU A 158 -19.238 1.091 8.055 1.00 84.44 O +ATOM 1226 OE2 GLU A 158 -17.647 -0.385 8.412 1.00 84.44 O +ATOM 1227 N ALA A 159 -16.212 2.043 4.248 1.00 84.31 N +ATOM 1228 CA ALA A 159 -15.518 3.312 4.045 1.00 84.31 C +ATOM 1229 C ALA A 159 -14.536 3.588 5.179 1.00 84.31 C +ATOM 1230 CB ALA A 159 -16.523 4.455 3.925 1.00 84.31 C +ATOM 1231 O ALA A 159 -14.899 3.513 6.356 1.00 84.31 O +ATOM 1232 N VAL A 160 -13.242 3.817 4.802 1.00 86.87 N +ATOM 1233 CA VAL A 160 -12.169 3.958 5.781 1.00 86.87 C +ATOM 1234 C VAL A 160 -11.321 5.182 5.444 1.00 86.87 C +ATOM 1235 CB VAL A 160 -11.283 2.694 5.838 1.00 86.87 C +ATOM 1236 O VAL A 160 -11.107 5.493 4.270 1.00 86.87 O +ATOM 1237 CG1 VAL A 160 -10.139 2.882 6.833 1.00 86.87 C +ATOM 1238 CG2 VAL A 160 -12.121 1.472 6.208 1.00 86.87 C +ATOM 1239 N LYS A 161 -11.004 5.872 6.518 1.00 86.92 N +ATOM 1240 CA LYS A 161 -9.996 6.915 6.355 1.00 86.92 C +ATOM 1241 C LYS A 161 -8.593 6.366 6.597 1.00 86.92 C +ATOM 1242 CB LYS A 161 -10.273 8.083 7.303 1.00 86.92 C +ATOM 1243 O LYS A 161 -8.344 5.709 7.610 1.00 86.92 O +ATOM 1244 CG LYS A 161 -11.549 8.848 6.986 1.00 86.92 C +ATOM 1245 CD LYS A 161 -11.753 10.015 7.944 1.00 86.92 C +ATOM 1246 CE LYS A 161 -13.061 10.744 7.667 1.00 86.92 C +ATOM 1247 NZ LYS A 161 -13.289 11.860 8.634 1.00 86.92 N +ATOM 1248 N THR A 162 -7.742 6.625 5.633 1.00 89.13 N +ATOM 1249 CA THR A 162 -6.417 6.022 5.731 1.00 89.13 C +ATOM 1250 C THR A 162 -5.329 7.083 5.598 1.00 89.13 C +ATOM 1251 CB THR A 162 -6.215 4.938 4.655 1.00 89.13 C +ATOM 1252 O THR A 162 -5.506 8.077 4.891 1.00 89.13 O +ATOM 1253 CG2 THR A 162 -7.313 3.882 4.727 1.00 89.13 C +ATOM 1254 OG1 THR A 162 -6.239 5.550 3.360 1.00 89.13 O +ATOM 1255 N VAL A 163 -4.356 6.887 6.425 1.00 89.51 N +ATOM 1256 CA VAL A 163 -3.139 7.684 6.320 1.00 89.51 C +ATOM 1257 C VAL A 163 -1.947 6.773 6.035 1.00 89.51 C +ATOM 1258 CB VAL A 163 -2.887 8.506 7.604 1.00 89.51 C +ATOM 1259 O VAL A 163 -1.601 5.918 6.855 1.00 89.51 O +ATOM 1260 CG1 VAL A 163 -1.596 9.315 7.483 1.00 89.51 C +ATOM 1261 CG2 VAL A 163 -4.072 9.426 7.890 1.00 89.51 C +ATOM 1262 N LEU A 164 -1.367 7.016 4.872 1.00 89.56 N +ATOM 1263 CA LEU A 164 -0.230 6.197 4.468 1.00 89.56 C +ATOM 1264 C LEU A 164 1.065 7.002 4.520 1.00 89.56 C +ATOM 1265 CB LEU A 164 -0.443 5.642 3.058 1.00 89.56 C +ATOM 1266 O LEU A 164 1.150 8.086 3.938 1.00 89.56 O +ATOM 1267 CG LEU A 164 0.670 4.751 2.505 1.00 89.56 C +ATOM 1268 CD1 LEU A 164 0.699 3.417 3.245 1.00 89.56 C +ATOM 1269 CD2 LEU A 164 0.487 4.533 1.007 1.00 89.56 C +ATOM 1270 N GLU A 165 1.969 6.407 5.230 1.00 88.93 N +ATOM 1271 CA GLU A 165 3.304 6.990 5.315 1.00 88.93 C +ATOM 1272 C GLU A 165 4.372 5.989 4.882 1.00 88.93 C +ATOM 1273 CB GLU A 165 3.589 7.480 6.737 1.00 88.93 C +ATOM 1274 O GLU A 165 4.330 4.821 5.272 1.00 88.93 O +ATOM 1275 CG GLU A 165 2.662 8.594 7.201 1.00 88.93 C +ATOM 1276 CD GLU A 165 2.898 9.010 8.644 1.00 88.93 C +ATOM 1277 OE1 GLU A 165 2.444 10.107 9.042 1.00 88.93 O +ATOM 1278 OE2 GLU A 165 3.544 8.233 9.382 1.00 88.93 O +ATOM 1279 N HIS A 166 5.189 6.466 4.032 1.00 87.71 N +ATOM 1280 CA HIS A 166 6.245 5.547 3.625 1.00 87.71 C +ATOM 1281 C HIS A 166 7.584 6.266 3.499 1.00 87.71 C +ATOM 1282 CB HIS A 166 5.886 4.871 2.300 1.00 87.71 C +ATOM 1283 O HIS A 166 7.624 7.476 3.264 1.00 87.71 O +ATOM 1284 CG HIS A 166 5.758 5.825 1.155 1.00 87.71 C +ATOM 1285 CD2 HIS A 166 6.638 6.175 0.187 1.00 87.71 C +ATOM 1286 ND1 HIS A 166 4.611 6.549 0.914 1.00 87.71 N +ATOM 1287 CE1 HIS A 166 4.791 7.304 -0.157 1.00 87.71 C +ATOM 1288 NE2 HIS A 166 6.013 7.096 -0.616 1.00 87.71 N +ATOM 1289 N ARG A 167 8.585 5.465 3.812 1.00 85.14 N +ATOM 1290 CA ARG A 167 9.976 5.873 3.644 1.00 85.14 C +ATOM 1291 C ARG A 167 10.737 4.878 2.774 1.00 85.14 C +ATOM 1292 CB ARG A 167 10.664 6.012 5.004 1.00 85.14 C +ATOM 1293 O ARG A 167 10.613 3.665 2.955 1.00 85.14 O +ATOM 1294 CG ARG A 167 10.229 7.238 5.791 1.00 85.14 C +ATOM 1295 CD ARG A 167 11.008 7.379 7.091 1.00 85.14 C +ATOM 1296 NE ARG A 167 10.637 8.593 7.813 1.00 85.14 N +ATOM 1297 NH1 ARG A 167 12.014 8.185 9.623 1.00 85.14 N +ATOM 1298 NH2 ARG A 167 10.717 10.074 9.566 1.00 85.14 N +ATOM 1299 CZ ARG A 167 11.123 8.948 8.999 1.00 85.14 C +ATOM 1300 N VAL A 168 11.498 5.481 1.847 1.00 85.42 N +ATOM 1301 CA VAL A 168 12.177 4.585 0.917 1.00 85.42 C +ATOM 1302 C VAL A 168 13.688 4.681 1.118 1.00 85.42 C +ATOM 1303 CB VAL A 168 11.813 4.907 -0.550 1.00 85.42 C +ATOM 1304 O VAL A 168 14.215 5.757 1.411 1.00 85.42 O +ATOM 1305 CG1 VAL A 168 12.503 3.934 -1.504 1.00 85.42 C +ATOM 1306 CG2 VAL A 168 10.298 4.867 -0.744 1.00 85.42 C +ATOM 1307 N TYR A 169 14.338 3.539 0.942 1.00 84.41 N +ATOM 1308 CA TYR A 169 15.793 3.444 0.951 1.00 84.41 C +ATOM 1309 C TYR A 169 16.338 3.276 -0.462 1.00 84.41 C +ATOM 1310 CB TYR A 169 16.250 2.276 1.829 1.00 84.41 C +ATOM 1311 O TYR A 169 16.088 2.259 -1.114 1.00 84.41 O +ATOM 1312 CG TYR A 169 15.823 2.397 3.272 1.00 84.41 C +ATOM 1313 CD1 TYR A 169 16.742 2.725 4.266 1.00 84.41 C +ATOM 1314 CD2 TYR A 169 14.500 2.182 3.644 1.00 84.41 C +ATOM 1315 CE1 TYR A 169 16.353 2.836 5.597 1.00 84.41 C +ATOM 1316 CE2 TYR A 169 14.100 2.290 4.972 1.00 84.41 C +ATOM 1317 OH TYR A 169 14.641 2.726 7.255 1.00 84.41 O +ATOM 1318 CZ TYR A 169 15.032 2.618 5.939 1.00 84.41 C +ATOM 1319 N ILE A 170 17.013 4.334 -0.912 1.00 79.35 N +ATOM 1320 CA ILE A 170 17.402 4.339 -2.318 1.00 79.35 C +ATOM 1321 C ILE A 170 18.918 4.189 -2.434 1.00 79.35 C +ATOM 1322 CB ILE A 170 16.935 5.628 -3.029 1.00 79.35 C +ATOM 1323 O ILE A 170 19.658 4.588 -1.531 1.00 79.35 O +ATOM 1324 CG1 ILE A 170 17.493 6.865 -2.315 1.00 79.35 C +ATOM 1325 CG2 ILE A 170 15.406 5.681 -3.103 1.00 79.35 C +ATOM 1326 CD1 ILE A 170 17.252 8.171 -3.059 1.00 79.35 C +ATOM 1327 N GLU A 171 19.314 3.465 -3.459 1.00 76.18 N +ATOM 1328 CA GLU A 171 20.702 3.424 -3.910 1.00 76.18 C +ATOM 1329 C GLU A 171 20.914 4.318 -5.128 1.00 76.18 C +ATOM 1330 CB GLU A 171 21.120 1.987 -4.232 1.00 76.18 C +ATOM 1331 O GLU A 171 20.216 4.180 -6.134 1.00 76.18 O +ATOM 1332 CG GLU A 171 22.624 1.801 -4.375 1.00 76.18 C +ATOM 1333 CD GLU A 171 23.028 0.357 -4.627 1.00 76.18 C +ATOM 1334 OE1 GLU A 171 24.235 0.092 -4.831 1.00 76.18 O +ATOM 1335 OE2 GLU A 171 22.131 -0.516 -4.622 1.00 76.18 O +ATOM 1336 N VAL A 172 21.574 5.494 -4.960 1.00 65.41 N +ATOM 1337 CA VAL A 172 21.890 6.348 -6.100 1.00 65.41 C +ATOM 1338 C VAL A 172 23.189 5.880 -6.752 1.00 65.41 C +ATOM 1339 CB VAL A 172 22.006 7.831 -5.683 1.00 65.41 C +ATOM 1340 O VAL A 172 24.127 5.476 -6.061 1.00 65.41 O +ATOM 1341 CG1 VAL A 172 22.253 8.717 -6.903 1.00 65.41 C +ATOM 1342 CG2 VAL A 172 20.748 8.277 -4.941 1.00 65.41 C +TER 1343 VAL A 172 +ENDMDL +END diff --git a/modelcenter/PP-HelixFold/APP/T1037.fasta b/modelcenter/PP-HelixFold/APP/T1037.fasta new file mode 100644 index 0000000000000000000000000000000000000000..9851ed55f3e2e70ef6933ca326e133dbac285798 --- /dev/null +++ b/modelcenter/PP-HelixFold/APP/T1037.fasta @@ -0,0 +1,2 @@ +>T1037 S0A2C3d4, , 404 residues| +SKINFYTTTIETLETEDQNNTLTTFKVQNVSNASTIFSNGKTYWNFARPSYISNRINTFKNNPGVLRQLLNTSYGQSSLWAKHLLGEEKNVTGDFVLAGNARESASENRLKSLELSIFNSLQEKDKGAEGNDNGSISIVDQLADKLNKVLRGGTKNGTSIYSTVTPGDKSTLHEIKIDHFIPETISSFSNGTMIFNDKIVNAFTDHFVSEVNRMKEAYQELETLPESKRVVHYHTDARGNVMKDGKLAGNAFKSGHILSELSFDQITQDDNEMLKLYNEDGSPINPKGAVSNEQKILIKQTINKVLNQRIKENIRYFKDQGLVIDTVNKDGNKGFHFHGLDKSIMSEYTDDIQLTEFDISHVVSDFTLNSILASIEYTKLFTGDPANYKNMVDFFKRVPATYTN \ No newline at end of file diff --git a/modelcenter/PP-HelixFold/APP/T1037_pred.pdb b/modelcenter/PP-HelixFold/APP/T1037_pred.pdb new file mode 100644 index 0000000000000000000000000000000000000000..50fa5322b66c42e24d6a0ad602d8daa11e3a1f1e --- /dev/null +++ b/modelcenter/PP-HelixFold/APP/T1037_pred.pdb @@ -0,0 +1,3209 @@ +MODEL 1 +ATOM 1 N SER A 1 29.969 5.065 -7.001 1.00 28.98 N +ATOM 2 CA SER A 1 30.077 4.656 -5.605 1.00 28.98 C +ATOM 3 C SER A 1 29.135 3.498 -5.293 1.00 28.98 C +ATOM 4 CB SER A 1 29.776 5.833 -4.676 1.00 28.98 C +ATOM 5 O SER A 1 27.989 3.484 -5.747 1.00 28.98 O +ATOM 6 OG SER A 1 28.401 6.173 -4.725 1.00 28.98 O +ATOM 7 N LYS A 2 29.549 2.213 -5.346 1.00 24.61 N +ATOM 8 CA LYS A 2 28.907 0.931 -5.068 1.00 24.61 C +ATOM 9 C LYS A 2 28.441 0.853 -3.617 1.00 24.61 C +ATOM 10 CB LYS A 2 29.862 -0.224 -5.375 1.00 24.61 C +ATOM 11 O LYS A 2 29.215 1.119 -2.695 1.00 24.61 O +ATOM 12 CG LYS A 2 29.697 -0.810 -6.769 1.00 24.61 C +ATOM 13 CD LYS A 2 30.611 -2.009 -6.984 1.00 24.61 C +ATOM 14 CE LYS A 2 30.505 -2.547 -8.404 1.00 24.61 C +ATOM 15 NZ LYS A 2 31.389 -3.732 -8.615 1.00 24.61 N +ATOM 16 N ILE A 3 27.264 1.260 -3.278 1.00 26.52 N +ATOM 17 CA ILE A 3 26.585 1.149 -1.992 1.00 26.52 C +ATOM 18 C ILE A 3 26.312 -0.321 -1.678 1.00 26.52 C +ATOM 19 CB ILE A 3 25.266 1.953 -1.979 1.00 26.52 C +ATOM 20 O ILE A 3 25.752 -1.045 -2.504 1.00 26.52 O +ATOM 21 CG1 ILE A 3 25.546 3.443 -2.207 1.00 26.52 C +ATOM 22 CG2 ILE A 3 24.512 1.733 -0.664 1.00 26.52 C +ATOM 23 CD1 ILE A 3 24.294 4.285 -2.411 1.00 26.52 C +ATOM 24 N ASN A 4 27.100 -0.983 -0.883 1.00 27.30 N +ATOM 25 CA ASN A 4 26.868 -2.322 -0.353 1.00 27.30 C +ATOM 26 C ASN A 4 25.764 -2.324 0.701 1.00 27.30 C +ATOM 27 CB ASN A 4 28.159 -2.901 0.229 1.00 27.30 C +ATOM 28 O ASN A 4 25.745 -1.469 1.588 1.00 27.30 O +ATOM 29 CG ASN A 4 29.138 -3.340 -0.842 1.00 27.30 C +ATOM 30 ND2 ASN A 4 30.428 -3.206 -0.558 1.00 27.30 N +ATOM 31 OD1 ASN A 4 28.737 -3.796 -1.917 1.00 27.30 O +ATOM 32 N PHE A 5 24.684 -3.072 0.545 1.00 31.46 N +ATOM 33 CA PHE A 5 23.437 -3.186 1.292 1.00 31.46 C +ATOM 34 C PHE A 5 23.466 -4.399 2.214 1.00 31.46 C +ATOM 35 CB PHE A 5 22.243 -3.281 0.337 1.00 31.46 C +ATOM 36 O PHE A 5 23.862 -5.490 1.800 1.00 31.46 O +ATOM 37 CG PHE A 5 22.116 -2.106 -0.595 1.00 31.46 C +ATOM 38 CD1 PHE A 5 21.550 -0.914 -0.160 1.00 31.46 C +ATOM 39 CD2 PHE A 5 22.563 -2.194 -1.907 1.00 31.46 C +ATOM 40 CE1 PHE A 5 21.432 0.175 -1.020 1.00 31.46 C +ATOM 41 CE2 PHE A 5 22.447 -1.110 -2.773 1.00 31.46 C +ATOM 42 CZ PHE A 5 21.880 0.073 -2.327 1.00 31.46 C +ATOM 43 N TYR A 6 23.542 -4.247 3.485 1.00 31.07 N +ATOM 44 CA TYR A 6 23.490 -5.424 4.346 1.00 31.07 C +ATOM 45 C TYR A 6 22.092 -5.616 4.921 1.00 31.07 C +ATOM 46 CB TYR A 6 24.510 -5.305 5.482 1.00 31.07 C +ATOM 47 O TYR A 6 21.496 -4.675 5.450 1.00 31.07 O +ATOM 48 CG TYR A 6 25.942 -5.245 5.008 1.00 31.07 C +ATOM 49 CD1 TYR A 6 26.665 -6.411 4.765 1.00 31.07 C +ATOM 50 CD2 TYR A 6 26.575 -4.024 4.804 1.00 31.07 C +ATOM 51 CE1 TYR A 6 27.985 -6.361 4.331 1.00 31.07 C +ATOM 52 CE2 TYR A 6 27.895 -3.962 4.370 1.00 31.07 C +ATOM 53 OH TYR A 6 29.897 -5.079 3.705 1.00 31.07 O +ATOM 54 CZ TYR A 6 28.590 -5.134 4.136 1.00 31.07 C +ATOM 55 N THR A 7 21.244 -6.568 4.412 1.00 30.67 N +ATOM 56 CA THR A 7 20.026 -7.036 5.066 1.00 30.67 C +ATOM 57 C THR A 7 20.274 -8.357 5.788 1.00 30.67 C +ATOM 58 CB THR A 7 18.880 -7.209 4.052 1.00 30.67 C +ATOM 59 O THR A 7 21.069 -9.181 5.331 1.00 30.67 O +ATOM 60 CG2 THR A 7 17.570 -6.653 4.603 1.00 30.67 C +ATOM 61 OG1 THR A 7 19.209 -6.514 2.843 1.00 30.67 O +ATOM 62 N THR A 8 20.128 -8.451 7.080 1.00 31.85 N +ATOM 63 CA THR A 8 20.184 -9.727 7.786 1.00 31.85 C +ATOM 64 C THR A 8 18.912 -10.534 7.546 1.00 31.85 C +ATOM 65 CB THR A 8 20.385 -9.519 9.299 1.00 31.85 C +ATOM 66 O THR A 8 17.804 -10.029 7.737 1.00 31.85 O +ATOM 67 CG2 THR A 8 20.614 -10.849 10.010 1.00 31.85 C +ATOM 68 OG1 THR A 8 21.523 -8.674 9.512 1.00 31.85 O +ATOM 69 N THR A 9 18.842 -11.613 6.669 1.00 29.97 N +ATOM 70 CA THR A 9 17.812 -12.599 6.363 1.00 29.97 C +ATOM 71 C THR A 9 17.781 -13.696 7.423 1.00 29.97 C +ATOM 72 CB THR A 9 18.036 -13.229 4.975 1.00 29.97 C +ATOM 73 O THR A 9 18.829 -14.181 7.853 1.00 29.97 O +ATOM 74 CG2 THR A 9 16.810 -14.015 4.524 1.00 29.97 C +ATOM 75 OG1 THR A 9 18.302 -12.191 4.024 1.00 29.97 O +ATOM 76 N ILE A 10 16.660 -14.114 8.139 1.00 28.28 N +ATOM 77 CA ILE A 10 16.361 -15.152 9.120 1.00 28.28 C +ATOM 78 C ILE A 10 16.000 -16.451 8.404 1.00 28.28 C +ATOM 79 CB ILE A 10 15.216 -14.724 10.064 1.00 28.28 C +ATOM 80 O ILE A 10 15.080 -16.479 7.583 1.00 28.28 O +ATOM 81 CG1 ILE A 10 15.536 -13.373 10.715 1.00 28.28 C +ATOM 82 CG2 ILE A 10 14.962 -15.797 11.127 1.00 28.28 C +ATOM 83 CD1 ILE A 10 14.383 -12.782 11.515 1.00 28.28 C +ATOM 84 N GLU A 11 16.939 -17.438 8.063 1.00 25.59 N +ATOM 85 CA GLU A 11 16.727 -18.749 7.455 1.00 25.59 C +ATOM 86 C GLU A 11 16.496 -19.819 8.517 1.00 25.59 C +ATOM 87 CB GLU A 11 17.918 -19.131 6.573 1.00 25.59 C +ATOM 88 O GLU A 11 17.153 -19.818 9.560 1.00 25.59 O +ATOM 89 CG GLU A 11 17.880 -18.509 5.184 1.00 25.59 C +ATOM 90 CD GLU A 11 19.022 -18.967 4.290 1.00 25.59 C +ATOM 91 OE1 GLU A 11 19.081 -18.541 3.115 1.00 25.59 O +ATOM 92 OE2 GLU A 11 19.864 -19.759 4.769 1.00 25.59 O +ATOM 93 N THR A 12 15.443 -20.720 8.468 1.00 27.12 N +ATOM 94 CA THR A 12 15.059 -21.902 9.232 1.00 27.12 C +ATOM 95 C THR A 12 15.469 -23.176 8.500 1.00 27.12 C +ATOM 96 CB THR A 12 13.543 -21.926 9.500 1.00 27.12 C +ATOM 97 O THR A 12 15.359 -23.257 7.274 1.00 27.12 O +ATOM 98 CG2 THR A 12 13.185 -21.074 10.713 1.00 27.12 C +ATOM 99 OG1 THR A 12 12.852 -21.417 8.352 1.00 27.12 O +ATOM 100 N LEU A 13 16.284 -24.134 9.106 1.00 25.52 N +ATOM 101 CA LEU A 13 16.749 -25.466 8.737 1.00 25.52 C +ATOM 102 C LEU A 13 15.730 -26.528 9.137 1.00 25.52 C +ATOM 103 CB LEU A 13 18.100 -25.764 9.394 1.00 25.52 C +ATOM 104 O LEU A 13 15.145 -26.455 10.220 1.00 25.52 O +ATOM 105 CG LEU A 13 19.333 -25.175 8.707 1.00 25.52 C +ATOM 106 CD1 LEU A 13 20.456 -24.971 9.719 1.00 25.52 C +ATOM 107 CD2 LEU A 13 19.791 -26.076 7.566 1.00 25.52 C +ATOM 108 N GLU A 14 15.465 -27.490 8.229 1.00 25.75 N +ATOM 109 CA GLU A 14 14.880 -28.826 8.176 1.00 25.75 C +ATOM 110 C GLU A 14 15.941 -29.902 8.388 1.00 25.75 C +ATOM 111 CB GLU A 14 14.166 -29.048 6.840 1.00 25.75 C +ATOM 112 O GLU A 14 17.008 -29.860 7.771 1.00 25.75 O +ATOM 113 CG GLU A 14 12.751 -28.489 6.799 1.00 25.75 C +ATOM 114 CD GLU A 14 12.001 -28.847 5.526 1.00 25.75 C +ATOM 115 OE1 GLU A 14 10.804 -28.499 5.408 1.00 25.75 O +ATOM 116 OE2 GLU A 14 12.615 -29.482 4.639 1.00 25.75 O +ATOM 117 N THR A 15 16.019 -30.553 9.575 1.00 23.36 N +ATOM 118 CA THR A 15 16.755 -31.650 10.193 1.00 23.36 C +ATOM 119 C THR A 15 16.393 -32.980 9.538 1.00 23.36 C +ATOM 120 CB THR A 15 16.477 -31.727 11.705 1.00 23.36 C +ATOM 121 O THR A 15 15.217 -33.259 9.295 1.00 23.36 O +ATOM 122 CG2 THR A 15 17.049 -30.515 12.432 1.00 23.36 C +ATOM 123 OG1 THR A 15 15.062 -31.777 11.923 1.00 23.36 O +ATOM 124 N GLU A 16 17.290 -33.583 8.724 1.00 23.50 N +ATOM 125 CA GLU A 16 17.352 -34.979 8.300 1.00 23.50 C +ATOM 126 C GLU A 16 18.565 -35.684 8.900 1.00 23.50 C +ATOM 127 CB GLU A 16 17.389 -35.076 6.773 1.00 23.50 C +ATOM 128 O GLU A 16 19.692 -35.200 8.782 1.00 23.50 O +ATOM 129 CG GLU A 16 16.106 -35.619 6.160 1.00 23.50 C +ATOM 130 CD GLU A 16 16.149 -35.691 4.642 1.00 23.50 C +ATOM 131 OE1 GLU A 16 15.127 -36.061 4.022 1.00 23.50 O +ATOM 132 OE2 GLU A 16 17.215 -35.375 4.068 1.00 23.50 O +ATOM 133 N ASP A 17 18.500 -36.444 9.934 1.00 23.73 N +ATOM 134 CA ASP A 17 18.773 -37.727 10.576 1.00 23.73 C +ATOM 135 C ASP A 17 19.834 -38.511 9.808 1.00 23.73 C +ATOM 136 CB ASP A 17 17.490 -38.552 10.692 1.00 23.73 C +ATOM 137 O ASP A 17 19.769 -38.617 8.581 1.00 23.73 O +ATOM 138 CG ASP A 17 16.811 -38.408 12.042 1.00 23.73 C +ATOM 139 OD1 ASP A 17 17.420 -37.836 12.972 1.00 23.73 O +ATOM 140 OD2 ASP A 17 15.659 -38.873 12.179 1.00 23.73 O +ATOM 141 N GLN A 18 21.032 -38.871 10.392 1.00 24.39 N +ATOM 142 CA GLN A 18 21.585 -40.215 10.525 1.00 24.39 C +ATOM 143 C GLN A 18 23.107 -40.197 10.411 1.00 24.39 C +ATOM 144 CB GLN A 18 20.991 -41.148 9.468 1.00 24.39 C +ATOM 145 O GLN A 18 23.658 -39.591 9.490 1.00 24.39 O +ATOM 146 CG GLN A 18 19.537 -41.522 9.726 1.00 24.39 C +ATOM 147 CD GLN A 18 19.254 -42.990 9.469 1.00 24.39 C +ATOM 148 NE2 GLN A 18 18.173 -43.497 10.052 1.00 24.39 N +ATOM 149 OE1 GLN A 18 20.001 -43.663 8.751 1.00 24.39 O +ATOM 150 N ASN A 19 23.898 -40.103 11.517 1.00 23.53 N +ATOM 151 CA ASN A 19 25.019 -41.005 11.758 1.00 23.53 C +ATOM 152 C ASN A 19 26.349 -40.258 11.769 1.00 23.53 C +ATOM 153 CB ASN A 19 25.045 -42.120 10.710 1.00 23.53 C +ATOM 154 O ASN A 19 26.663 -39.528 10.827 1.00 23.53 O +ATOM 155 CG ASN A 19 24.245 -43.337 11.132 1.00 23.53 C +ATOM 156 ND2 ASN A 19 24.064 -44.276 10.211 1.00 23.53 N +ATOM 157 OD1 ASN A 19 23.792 -43.431 12.276 1.00 23.53 O +ATOM 158 N ASN A 20 26.861 -39.734 12.903 1.00 22.19 N +ATOM 159 CA ASN A 20 28.264 -39.916 13.261 1.00 22.19 C +ATOM 160 C ASN A 20 29.037 -38.603 13.185 1.00 22.19 C +ATOM 161 CB ASN A 20 28.916 -40.968 12.361 1.00 22.19 C +ATOM 162 O ASN A 20 29.055 -37.947 12.142 1.00 22.19 O +ATOM 163 CG ASN A 20 29.335 -42.210 13.123 1.00 22.19 C +ATOM 164 ND2 ASN A 20 29.981 -43.141 12.431 1.00 22.19 N +ATOM 165 OD1 ASN A 20 29.080 -42.332 14.324 1.00 22.19 O +ATOM 166 N THR A 21 29.089 -37.734 14.239 1.00 21.28 N +ATOM 167 CA THR A 21 30.142 -36.892 14.795 1.00 21.28 C +ATOM 168 C THR A 21 29.579 -35.546 15.242 1.00 21.28 C +ATOM 169 CB THR A 21 31.272 -36.664 13.773 1.00 21.28 C +ATOM 170 O THR A 21 28.835 -34.900 14.501 1.00 21.28 O +ATOM 171 CG2 THR A 21 32.523 -37.449 14.153 1.00 21.28 C +ATOM 172 OG1 THR A 21 30.830 -37.089 12.478 1.00 21.28 O +ATOM 173 N LEU A 22 29.047 -35.447 16.442 1.00 18.87 N +ATOM 174 CA LEU A 22 28.998 -34.538 17.582 1.00 18.87 C +ATOM 175 C LEU A 22 29.805 -33.275 17.305 1.00 18.87 C +ATOM 176 CB LEU A 22 29.526 -35.230 18.842 1.00 18.87 C +ATOM 177 O LEU A 22 31.027 -33.336 17.148 1.00 18.87 O +ATOM 178 CG LEU A 22 28.482 -35.628 19.885 1.00 18.87 C +ATOM 179 CD1 LEU A 22 28.514 -37.135 20.120 1.00 18.87 C +ATOM 180 CD2 LEU A 22 28.714 -34.874 21.190 1.00 18.87 C +ATOM 181 N THR A 23 29.433 -32.419 16.376 1.00 20.44 N +ATOM 182 CA THR A 23 29.771 -31.018 16.597 1.00 20.44 C +ATOM 183 C THR A 23 28.559 -30.124 16.352 1.00 20.44 C +ATOM 184 CB THR A 23 30.932 -30.573 15.689 1.00 20.44 C +ATOM 185 O THR A 23 27.957 -30.167 15.278 1.00 20.44 O +ATOM 186 CG2 THR A 23 31.757 -29.473 16.349 1.00 20.44 C +ATOM 187 OG1 THR A 23 31.781 -31.697 15.423 1.00 20.44 O +ATOM 188 N THR A 24 27.613 -30.137 17.238 1.00 18.18 N +ATOM 189 CA THR A 24 26.542 -29.245 17.669 1.00 18.18 C +ATOM 190 C THR A 24 26.831 -27.808 17.246 1.00 18.18 C +ATOM 191 CB THR A 24 26.346 -29.305 19.195 1.00 18.18 C +ATOM 192 O THR A 24 27.886 -27.260 17.572 1.00 18.18 O +ATOM 193 CG2 THR A 24 24.880 -29.109 19.569 1.00 18.18 C +ATOM 194 OG1 THR A 24 26.784 -30.581 19.678 1.00 18.18 O +ATOM 195 N PHE A 25 26.752 -27.405 15.972 1.00 19.86 N +ATOM 196 CA PHE A 25 26.699 -25.980 15.668 1.00 19.86 C +ATOM 197 C PHE A 25 25.297 -25.429 15.895 1.00 19.86 C +ATOM 198 CB PHE A 25 27.138 -25.720 14.223 1.00 19.86 C +ATOM 199 O PHE A 25 24.329 -25.921 15.311 1.00 19.86 O +ATOM 200 CG PHE A 25 28.595 -26.000 13.971 1.00 19.86 C +ATOM 201 CD1 PHE A 25 29.558 -25.032 14.231 1.00 19.86 C +ATOM 202 CD2 PHE A 25 29.002 -27.231 13.475 1.00 19.86 C +ATOM 203 CE1 PHE A 25 30.907 -25.288 13.999 1.00 19.86 C +ATOM 204 CE2 PHE A 25 30.349 -27.494 13.240 1.00 19.86 C +ATOM 205 CZ PHE A 25 31.299 -26.521 13.502 1.00 19.86 C +ATOM 206 N LYS A 26 24.863 -25.293 17.123 1.00 19.82 N +ATOM 207 CA LYS A 26 23.790 -24.437 17.619 1.00 19.82 C +ATOM 208 C LYS A 26 23.760 -23.104 16.875 1.00 19.82 C +ATOM 209 CB LYS A 26 23.947 -24.195 19.121 1.00 19.82 C +ATOM 210 O LYS A 26 24.764 -22.390 16.832 1.00 19.82 O +ATOM 211 CG LYS A 26 22.927 -24.932 19.977 1.00 19.82 C +ATOM 212 CD LYS A 26 23.067 -24.569 21.450 1.00 19.82 C +ATOM 213 CE LYS A 26 22.060 -25.322 22.309 1.00 19.82 C +ATOM 214 NZ LYS A 26 22.196 -24.972 23.755 1.00 19.82 N +ATOM 215 N VAL A 27 23.289 -23.056 15.664 1.00 22.62 N +ATOM 216 CA VAL A 27 22.877 -21.890 14.890 1.00 22.62 C +ATOM 217 C VAL A 27 21.985 -20.992 15.744 1.00 22.62 C +ATOM 218 CB VAL A 27 22.138 -22.300 13.596 1.00 22.62 C +ATOM 219 O VAL A 27 20.952 -21.434 16.252 1.00 22.62 O +ATOM 220 CG1 VAL A 27 21.685 -21.065 12.819 1.00 22.62 C +ATOM 221 CG2 VAL A 27 23.032 -23.182 12.728 1.00 22.62 C +ATOM 222 N GLN A 28 22.533 -20.211 16.562 1.00 22.56 N +ATOM 223 CA GLN A 28 22.319 -18.993 17.335 1.00 22.56 C +ATOM 224 C GLN A 28 21.617 -17.927 16.499 1.00 22.56 C +ATOM 225 CB GLN A 28 23.648 -18.453 17.866 1.00 22.56 C +ATOM 226 O GLN A 28 22.043 -17.626 15.382 1.00 22.56 O +ATOM 227 CG GLN A 28 23.886 -18.746 19.341 1.00 22.56 C +ATOM 228 CD GLN A 28 25.192 -18.165 19.852 1.00 22.56 C +ATOM 229 NE2 GLN A 28 25.395 -18.227 21.164 1.00 22.56 N +ATOM 230 OE1 GLN A 28 26.011 -17.666 19.074 1.00 22.56 O +ATOM 231 N ASN A 29 20.296 -17.902 16.345 1.00 24.35 N +ATOM 232 CA ASN A 29 19.223 -16.914 16.296 1.00 24.35 C +ATOM 233 C ASN A 29 19.774 -15.491 16.248 1.00 24.35 C +ATOM 234 CB ASN A 29 18.285 -17.080 17.493 1.00 24.35 C +ATOM 235 O ASN A 29 20.453 -15.053 17.178 1.00 24.35 O +ATOM 236 CG ASN A 29 17.087 -17.955 17.178 1.00 24.35 C +ATOM 237 ND2 ASN A 29 16.581 -18.653 18.188 1.00 24.35 N +ATOM 238 OD1 ASN A 29 16.621 -18.004 16.037 1.00 24.35 O +ATOM 239 N VAL A 30 20.453 -15.004 15.216 1.00 26.71 N +ATOM 240 CA VAL A 30 21.196 -13.790 14.894 1.00 26.71 C +ATOM 241 C VAL A 30 20.235 -12.607 14.795 1.00 26.71 C +ATOM 242 CB VAL A 30 21.991 -13.943 13.578 1.00 26.71 C +ATOM 243 O VAL A 30 19.375 -12.571 13.911 1.00 26.71 O +ATOM 244 CG1 VAL A 30 23.082 -12.878 13.480 1.00 26.71 C +ATOM 245 CG2 VAL A 30 22.596 -15.342 13.480 1.00 26.71 C +ATOM 246 N SER A 31 19.598 -12.052 15.818 1.00 29.71 N +ATOM 247 CA SER A 31 19.220 -10.649 15.948 1.00 29.71 C +ATOM 248 C SER A 31 20.397 -9.800 16.415 1.00 29.71 C +ATOM 249 CB SER A 31 18.052 -10.497 16.923 1.00 29.71 C +ATOM 250 O SER A 31 20.897 -9.981 17.528 1.00 29.71 O +ATOM 251 OG SER A 31 18.507 -10.541 18.264 1.00 29.71 O +ATOM 252 N ASN A 32 21.558 -9.743 15.776 1.00 31.96 N +ATOM 253 CA ASN A 32 22.902 -9.297 16.125 1.00 31.96 C +ATOM 254 C ASN A 32 22.960 -7.784 16.314 1.00 31.96 C +ATOM 255 CB ASN A 32 23.908 -9.737 15.058 1.00 31.96 C +ATOM 256 O ASN A 32 22.843 -7.028 15.348 1.00 31.96 O +ATOM 257 CG ASN A 32 24.297 -11.197 15.190 1.00 31.96 C +ATOM 258 ND2 ASN A 32 24.948 -11.731 14.163 1.00 31.96 N +ATOM 259 OD1 ASN A 32 24.015 -11.838 16.205 1.00 31.96 O +ATOM 260 N ALA A 33 22.301 -7.137 17.254 1.00 32.52 N +ATOM 261 CA ALA A 33 22.971 -5.912 17.683 1.00 32.52 C +ATOM 262 C ALA A 33 24.209 -6.227 18.517 1.00 32.52 C +ATOM 263 CB ALA A 33 22.009 -5.030 18.476 1.00 32.52 C +ATOM 264 O ALA A 33 24.138 -6.997 19.478 1.00 32.52 O +ATOM 265 N SER A 34 25.220 -6.902 18.002 1.00 27.72 N +ATOM 266 CA SER A 34 26.475 -7.022 18.737 1.00 27.72 C +ATOM 267 C SER A 34 26.996 -5.655 19.167 1.00 27.72 C +ATOM 268 CB SER A 34 27.529 -7.734 17.888 1.00 27.72 C +ATOM 269 O SER A 34 26.959 -4.698 18.390 1.00 27.72 O +ATOM 270 OG SER A 34 27.801 -7.002 16.706 1.00 27.72 O +ATOM 271 N THR A 35 26.606 -5.161 20.298 1.00 29.74 N +ATOM 272 CA THR A 35 27.255 -3.994 20.884 1.00 29.74 C +ATOM 273 C THR A 35 28.532 -4.397 21.617 1.00 29.74 C +ATOM 274 CB THR A 35 26.313 -3.258 21.854 1.00 29.74 C +ATOM 275 O THR A 35 28.552 -5.400 22.334 1.00 29.74 O +ATOM 276 CG2 THR A 35 26.734 -1.803 22.033 1.00 29.74 C +ATOM 277 OG1 THR A 35 24.978 -3.297 21.336 1.00 29.74 O +ATOM 278 N ILE A 36 29.763 -4.184 21.050 1.00 28.19 N +ATOM 279 CA ILE A 36 31.065 -4.324 21.692 1.00 28.19 C +ATOM 280 C ILE A 36 31.142 -3.406 22.910 1.00 28.19 C +ATOM 281 CB ILE A 36 32.217 -4.010 20.711 1.00 28.19 C +ATOM 282 O ILE A 36 30.920 -2.198 22.798 1.00 28.19 O +ATOM 283 CG1 ILE A 36 32.118 -4.904 19.469 1.00 28.19 C +ATOM 284 CG2 ILE A 36 33.574 -4.177 21.399 1.00 28.19 C +ATOM 285 CD1 ILE A 36 33.134 -4.571 18.385 1.00 28.19 C +ATOM 286 N PHE A 37 30.710 -3.833 24.140 1.00 26.28 N +ATOM 287 CA PHE A 37 30.958 -3.070 25.357 1.00 26.28 C +ATOM 288 C PHE A 37 32.408 -3.219 25.803 1.00 26.28 C +ATOM 289 CB PHE A 37 30.015 -3.520 26.477 1.00 26.28 C +ATOM 290 O PHE A 37 33.101 -4.147 25.380 1.00 26.28 O +ATOM 291 CG PHE A 37 28.658 -2.872 26.424 1.00 26.28 C +ATOM 292 CD1 PHE A 37 28.431 -1.649 27.044 1.00 26.28 C +ATOM 293 CD2 PHE A 37 27.608 -3.487 25.755 1.00 26.28 C +ATOM 294 CE1 PHE A 37 27.176 -1.047 26.996 1.00 26.28 C +ATOM 295 CE2 PHE A 37 26.350 -2.892 25.703 1.00 26.28 C +ATOM 296 CZ PHE A 37 26.136 -1.673 26.326 1.00 26.28 C +ATOM 297 N SER A 38 32.968 -2.078 26.309 1.00 34.35 N +ATOM 298 CA SER A 38 34.225 -1.798 26.996 1.00 34.35 C +ATOM 299 C SER A 38 34.686 -2.998 27.816 1.00 34.35 C +ATOM 300 CB SER A 38 34.080 -0.575 27.902 1.00 34.35 C +ATOM 301 O SER A 38 33.867 -3.699 28.414 1.00 34.35 O +ATOM 302 OG SER A 38 33.323 -0.892 29.058 1.00 34.35 O +ATOM 303 N ASN A 39 35.616 -3.791 27.366 1.00 38.08 N +ATOM 304 CA ASN A 39 36.522 -4.788 27.927 1.00 38.08 C +ATOM 305 C ASN A 39 36.503 -6.081 27.118 1.00 38.08 C +ATOM 306 CB ASN A 39 36.169 -5.071 29.389 1.00 38.08 C +ATOM 307 O ASN A 39 36.877 -7.140 27.623 1.00 38.08 O +ATOM 308 CG ASN A 39 36.853 -4.119 30.350 1.00 38.08 C +ATOM 309 ND2 ASN A 39 36.751 -4.407 31.643 1.00 38.08 N +ATOM 310 OD1 ASN A 39 37.468 -3.134 29.935 1.00 38.08 O +ATOM 311 N GLY A 40 36.147 -6.022 25.780 1.00 32.07 N +ATOM 312 CA GLY A 40 36.369 -7.161 24.905 1.00 32.07 C +ATOM 313 C GLY A 40 35.365 -8.279 25.114 1.00 32.07 C +ATOM 314 O GLY A 40 35.521 -9.372 24.564 1.00 32.07 O +ATOM 315 N LYS A 41 34.244 -8.009 25.925 1.00 26.18 N +ATOM 316 CA LYS A 41 33.198 -9.003 26.146 1.00 26.18 C +ATOM 317 C LYS A 41 31.946 -8.672 25.339 1.00 26.18 C +ATOM 318 CB LYS A 41 32.854 -9.099 27.633 1.00 26.18 C +ATOM 319 O LYS A 41 31.558 -7.506 25.236 1.00 26.18 O +ATOM 320 CG LYS A 41 33.956 -9.709 28.486 1.00 26.18 C +ATOM 321 CD LYS A 41 33.447 -10.088 29.870 1.00 26.18 C +ATOM 322 CE LYS A 41 34.560 -10.655 30.741 1.00 26.18 C +ATOM 323 NZ LYS A 41 34.056 -11.074 32.083 1.00 26.18 N +ATOM 324 N THR A 42 31.536 -9.528 24.342 1.00 30.05 N +ATOM 325 CA THR A 42 30.334 -9.503 23.516 1.00 30.05 C +ATOM 326 C THR A 42 29.125 -10.000 24.304 1.00 30.05 C +ATOM 327 CB THR A 42 30.509 -10.357 22.247 1.00 30.05 C +ATOM 328 O THR A 42 29.186 -11.051 24.946 1.00 30.05 O +ATOM 329 CG2 THR A 42 29.736 -9.764 21.074 1.00 30.05 C +ATOM 330 OG1 THR A 42 31.900 -10.417 21.907 1.00 30.05 O +ATOM 331 N TYR A 43 28.327 -9.078 24.833 1.00 24.17 N +ATOM 332 CA TYR A 43 27.048 -9.503 25.389 1.00 24.17 C +ATOM 333 C TYR A 43 25.963 -9.508 24.318 1.00 24.17 C +ATOM 334 CB TYR A 43 26.634 -8.589 26.546 1.00 24.17 C +ATOM 335 O TYR A 43 25.929 -8.628 23.455 1.00 24.17 O +ATOM 336 CG TYR A 43 27.391 -8.850 27.826 1.00 24.17 C +ATOM 337 CD1 TYR A 43 26.943 -9.799 28.742 1.00 24.17 C +ATOM 338 CD2 TYR A 43 28.554 -8.147 28.122 1.00 24.17 C +ATOM 339 CE1 TYR A 43 27.636 -10.042 29.923 1.00 24.17 C +ATOM 340 CE2 TYR A 43 29.255 -8.381 29.301 1.00 24.17 C +ATOM 341 OH TYR A 43 29.479 -9.565 31.361 1.00 24.17 O +ATOM 342 CZ TYR A 43 28.789 -9.329 30.193 1.00 24.17 C +ATOM 343 N TRP A 44 25.201 -10.713 24.123 1.00 31.73 N +ATOM 344 CA TRP A 44 24.060 -10.929 23.240 1.00 31.73 C +ATOM 345 C TRP A 44 22.758 -10.523 23.923 1.00 31.73 C +ATOM 346 CB TRP A 44 23.986 -12.395 22.804 1.00 31.73 C +ATOM 347 O TRP A 44 22.501 -10.912 25.065 1.00 31.73 O +ATOM 348 CG TRP A 44 25.219 -12.885 22.105 1.00 31.73 C +ATOM 349 CD1 TRP A 44 26.287 -13.525 22.669 1.00 31.73 C +ATOM 350 CD2 TRP A 44 25.513 -12.769 20.709 1.00 31.73 C +ATOM 351 CE2 TRP A 44 26.777 -13.362 20.497 1.00 31.73 C +ATOM 352 CE3 TRP A 44 24.828 -12.221 19.616 1.00 31.73 C +ATOM 353 NE1 TRP A 44 27.227 -13.815 21.708 1.00 31.73 N +ATOM 354 CH2 TRP A 44 26.680 -12.879 18.182 1.00 31.73 C +ATOM 355 CZ2 TRP A 44 27.371 -13.422 19.234 1.00 31.73 C +ATOM 356 CZ3 TRP A 44 25.421 -12.282 18.360 1.00 31.73 C +ATOM 357 N ASN A 45 22.181 -9.332 23.716 1.00 27.08 N +ATOM 358 CA ASN A 45 20.840 -9.007 24.190 1.00 27.08 C +ATOM 359 C ASN A 45 19.766 -9.657 23.322 1.00 27.08 C +ATOM 360 CB ASN A 45 20.639 -7.491 24.238 1.00 27.08 C +ATOM 361 O ASN A 45 19.855 -9.629 22.093 1.00 27.08 O +ATOM 362 CG ASN A 45 21.138 -6.876 25.530 1.00 27.08 C +ATOM 363 ND2 ASN A 45 21.689 -5.671 25.440 1.00 27.08 N +ATOM 364 OD1 ASN A 45 21.030 -7.479 26.601 1.00 27.08 O +ATOM 365 N PHE A 46 19.255 -10.856 23.631 1.00 29.57 N +ATOM 366 CA PHE A 46 18.134 -11.490 22.949 1.00 29.57 C +ATOM 367 C PHE A 46 16.942 -10.543 22.870 1.00 29.57 C +ATOM 368 CB PHE A 46 17.729 -12.784 23.664 1.00 29.57 C +ATOM 369 O PHE A 46 16.517 -9.986 23.884 1.00 29.57 O +ATOM 370 CG PHE A 46 18.710 -13.910 23.480 1.00 29.57 C +ATOM 371 CD1 PHE A 46 18.663 -14.714 22.347 1.00 29.57 C +ATOM 372 CD2 PHE A 46 19.679 -14.167 24.442 1.00 29.57 C +ATOM 373 CE1 PHE A 46 19.570 -15.757 22.175 1.00 29.57 C +ATOM 374 CE2 PHE A 46 20.588 -15.208 24.277 1.00 29.57 C +ATOM 375 CZ PHE A 46 20.531 -16.002 23.143 1.00 29.57 C +ATOM 376 N ALA A 47 16.800 -9.726 21.806 1.00 40.51 N +ATOM 377 CA ALA A 47 15.577 -8.955 21.598 1.00 40.51 C +ATOM 378 C ALA A 47 14.385 -9.874 21.348 1.00 40.51 C +ATOM 379 CB ALA A 47 15.751 -7.985 20.432 1.00 40.51 C +ATOM 380 O ALA A 47 14.523 -10.922 20.713 1.00 40.51 O +ATOM 381 N ARG A 48 13.480 -10.050 22.272 1.00 43.50 N +ATOM 382 CA ARG A 48 12.184 -10.687 22.065 1.00 43.50 C +ATOM 383 C ARG A 48 11.639 -10.380 20.674 1.00 43.50 C +ATOM 384 CB ARG A 48 11.185 -10.231 23.131 1.00 43.50 C +ATOM 385 O ARG A 48 11.862 -9.292 20.140 1.00 43.50 O +ATOM 386 CG ARG A 48 11.524 -10.704 24.535 1.00 43.50 C +ATOM 387 CD ARG A 48 10.420 -10.364 25.527 1.00 43.50 C +ATOM 388 NE ARG A 48 10.694 -10.920 26.849 1.00 43.50 N +ATOM 389 NH1 ARG A 48 8.889 -9.906 27.876 1.00 43.50 N +ATOM 390 NH2 ARG A 48 10.299 -11.247 29.088 1.00 43.50 N +ATOM 391 CZ ARG A 48 9.960 -10.690 27.935 1.00 43.50 C +ATOM 392 N PRO A 49 11.229 -11.508 19.910 1.00 55.54 N +ATOM 393 CA PRO A 49 10.664 -11.240 18.585 1.00 55.54 C +ATOM 394 C PRO A 49 9.614 -10.132 18.604 1.00 55.54 C +ATOM 395 CB PRO A 49 10.038 -12.581 18.192 1.00 55.54 C +ATOM 396 O PRO A 49 8.912 -9.959 19.604 1.00 55.54 O +ATOM 397 CG PRO A 49 9.926 -13.341 19.474 1.00 55.54 C +ATOM 398 CD PRO A 49 10.858 -12.724 20.477 1.00 55.54 C +ATOM 399 N SER A 50 9.733 -9.260 17.582 1.00 66.15 N +ATOM 400 CA SER A 50 8.735 -8.207 17.417 1.00 66.15 C +ATOM 401 C SER A 50 7.379 -8.787 17.031 1.00 66.15 C +ATOM 402 CB SER A 50 9.188 -7.201 16.359 1.00 66.15 C +ATOM 403 O SER A 50 7.273 -9.972 16.709 1.00 66.15 O +ATOM 404 OG SER A 50 9.108 -7.765 15.061 1.00 66.15 O +ATOM 405 N TYR A 51 6.280 -7.997 17.278 1.00 70.13 N +ATOM 406 CA TYR A 51 4.934 -8.359 16.849 1.00 70.13 C +ATOM 407 C TYR A 51 4.929 -8.818 15.396 1.00 70.13 C +ATOM 408 CB TYR A 51 3.976 -7.177 17.027 1.00 70.13 C +ATOM 409 O TYR A 51 4.315 -9.834 15.061 1.00 70.13 O +ATOM 410 CG TYR A 51 2.621 -7.393 16.398 1.00 70.13 C +ATOM 411 CD1 TYR A 51 2.315 -6.851 15.152 1.00 70.13 C +ATOM 412 CD2 TYR A 51 1.644 -8.139 17.049 1.00 70.13 C +ATOM 413 CE1 TYR A 51 1.067 -7.046 14.569 1.00 70.13 C +ATOM 414 CE2 TYR A 51 0.393 -8.340 16.476 1.00 70.13 C +ATOM 415 OH TYR A 51 -1.123 -7.988 14.666 1.00 70.13 O +ATOM 416 CZ TYR A 51 0.114 -7.792 15.238 1.00 70.13 C +ATOM 417 N ILE A 52 5.645 -8.095 14.575 1.00 76.79 N +ATOM 418 CA ILE A 52 5.671 -8.397 13.148 1.00 76.79 C +ATOM 419 C ILE A 52 6.352 -9.744 12.918 1.00 76.79 C +ATOM 420 CB ILE A 52 6.391 -7.288 12.349 1.00 76.79 C +ATOM 421 O ILE A 52 5.851 -10.578 12.160 1.00 76.79 O +ATOM 422 CG1 ILE A 52 5.657 -5.952 12.508 1.00 76.79 C +ATOM 423 CG2 ILE A 52 6.507 -7.676 10.872 1.00 76.79 C +ATOM 424 CD1 ILE A 52 6.363 -4.775 11.848 1.00 76.79 C +ATOM 425 N SER A 53 7.421 -9.877 13.617 1.00 76.01 N +ATOM 426 CA SER A 53 8.147 -11.138 13.511 1.00 76.01 C +ATOM 427 C SER A 53 7.284 -12.313 13.959 1.00 76.01 C +ATOM 428 CB SER A 53 9.429 -11.090 14.343 1.00 76.01 C +ATOM 429 O SER A 53 7.267 -13.361 13.310 1.00 76.01 O +ATOM 430 OG SER A 53 10.105 -12.335 14.298 1.00 76.01 O +ATOM 431 N ASN A 54 6.552 -12.153 15.029 1.00 78.83 N +ATOM 432 CA ASN A 54 5.672 -13.203 15.530 1.00 78.83 C +ATOM 433 C ASN A 54 4.548 -13.510 14.544 1.00 78.83 C +ATOM 434 CB ASN A 54 5.092 -12.815 16.892 1.00 78.83 C +ATOM 435 O ASN A 54 4.190 -14.672 14.347 1.00 78.83 O +ATOM 436 CG ASN A 54 6.109 -12.922 18.011 1.00 78.83 C +ATOM 437 ND2 ASN A 54 5.902 -12.157 19.076 1.00 78.83 N +ATOM 438 OD1 ASN A 54 7.073 -13.687 17.920 1.00 78.83 O +ATOM 439 N ARG A 55 4.055 -12.442 13.943 1.00 83.68 N +ATOM 440 CA ARG A 55 2.988 -12.634 12.966 1.00 83.68 C +ATOM 441 C ARG A 55 3.494 -13.390 11.743 1.00 83.68 C +ATOM 442 CB ARG A 55 2.399 -11.286 12.543 1.00 83.68 C +ATOM 443 O ARG A 55 2.813 -14.282 11.232 1.00 83.68 O +ATOM 444 CG ARG A 55 1.088 -11.400 11.781 1.00 83.68 C +ATOM 445 CD ARG A 55 -0.049 -11.865 12.681 1.00 83.68 C +ATOM 446 NE ARG A 55 -1.341 -11.775 12.007 1.00 83.68 N +ATOM 447 NH1 ARG A 55 -2.426 -13.218 13.449 1.00 83.68 N +ATOM 448 NH2 ARG A 55 -3.564 -12.265 11.702 1.00 83.68 N +ATOM 449 CZ ARG A 55 -2.441 -12.419 12.387 1.00 83.68 C +ATOM 450 N ILE A 56 4.645 -13.053 11.278 1.00 86.74 N +ATOM 451 CA ILE A 56 5.235 -13.749 10.140 1.00 86.74 C +ATOM 452 C ILE A 56 5.434 -15.223 10.484 1.00 86.74 C +ATOM 453 CB ILE A 56 6.578 -13.110 9.722 1.00 86.74 C +ATOM 454 O ILE A 56 5.133 -16.102 9.673 1.00 86.74 O +ATOM 455 CG1 ILE A 56 6.339 -11.747 9.062 1.00 86.74 C +ATOM 456 CG2 ILE A 56 7.352 -14.043 8.786 1.00 86.74 C +ATOM 457 CD1 ILE A 56 7.615 -10.977 8.752 1.00 86.74 C +ATOM 458 N ASN A 57 5.873 -15.475 11.705 1.00 84.76 N +ATOM 459 CA ASN A 57 6.058 -16.853 12.148 1.00 84.76 C +ATOM 460 C ASN A 57 4.733 -17.609 12.196 1.00 84.76 C +ATOM 461 CB ASN A 57 6.739 -16.889 13.518 1.00 84.76 C +ATOM 462 O ASN A 57 4.678 -18.794 11.863 1.00 84.76 O +ATOM 463 CG ASN A 57 8.222 -16.583 13.441 1.00 84.76 C +ATOM 464 ND2 ASN A 57 8.782 -16.082 14.535 1.00 84.76 N +ATOM 465 OD1 ASN A 57 8.859 -16.795 12.406 1.00 84.76 O +ATOM 466 N THR A 58 3.697 -16.878 12.567 1.00 88.43 N +ATOM 467 CA THR A 58 2.368 -17.480 12.557 1.00 88.43 C +ATOM 468 C THR A 58 1.953 -17.851 11.137 1.00 88.43 C +ATOM 469 CB THR A 58 1.321 -16.531 13.169 1.00 88.43 C +ATOM 470 O THR A 58 1.405 -18.931 10.907 1.00 88.43 O +ATOM 471 CG2 THR A 58 -0.073 -17.147 13.123 1.00 88.43 C +ATOM 472 OG1 THR A 58 1.668 -16.262 14.533 1.00 88.43 O +ATOM 473 N PHE A 59 2.257 -16.981 10.204 1.00 91.98 N +ATOM 474 CA PHE A 59 1.937 -17.267 8.811 1.00 91.98 C +ATOM 475 C PHE A 59 2.669 -18.516 8.333 1.00 91.98 C +ATOM 476 CB PHE A 59 2.298 -16.074 7.920 1.00 91.98 C +ATOM 477 O PHE A 59 2.090 -19.352 7.637 1.00 91.98 O +ATOM 478 CG PHE A 59 1.583 -14.803 8.289 1.00 91.98 C +ATOM 479 CD1 PHE A 59 0.358 -14.843 8.943 1.00 91.98 C +ATOM 480 CD2 PHE A 59 2.136 -13.567 7.981 1.00 91.98 C +ATOM 481 CE1 PHE A 59 -0.306 -13.667 9.286 1.00 91.98 C +ATOM 482 CE2 PHE A 59 1.479 -12.388 8.321 1.00 91.98 C +ATOM 483 CZ PHE A 59 0.257 -12.440 8.972 1.00 91.98 C +ATOM 484 N LYS A 60 3.893 -18.622 8.721 1.00 91.58 N +ATOM 485 CA LYS A 60 4.743 -19.721 8.270 1.00 91.58 C +ATOM 486 C LYS A 60 4.288 -21.049 8.868 1.00 91.58 C +ATOM 487 CB LYS A 60 6.204 -19.455 8.636 1.00 91.58 C +ATOM 488 O LYS A 60 4.308 -22.080 8.191 1.00 91.58 O +ATOM 489 CG LYS A 60 6.842 -18.321 7.848 1.00 91.58 C +ATOM 490 CD LYS A 60 8.298 -18.112 8.248 1.00 91.58 C +ATOM 491 CE LYS A 60 8.967 -17.048 7.389 1.00 91.58 C +ATOM 492 NZ LYS A 60 10.399 -16.851 7.768 1.00 91.58 N +ATOM 493 N ASN A 61 3.829 -21.000 10.086 1.00 91.05 N +ATOM 494 CA ASN A 61 3.448 -22.213 10.803 1.00 91.05 C +ATOM 495 C ASN A 61 2.006 -22.611 10.505 1.00 91.05 C +ATOM 496 CB ASN A 61 3.648 -22.031 12.309 1.00 91.05 C +ATOM 497 O ASN A 61 1.669 -23.796 10.519 1.00 91.05 O +ATOM 498 CG ASN A 61 5.111 -21.955 12.700 1.00 91.05 C +ATOM 499 ND2 ASN A 61 5.407 -21.186 13.741 1.00 91.05 N +ATOM 500 OD1 ASN A 61 5.968 -22.580 12.069 1.00 91.05 O +ATOM 501 N ASN A 62 1.239 -21.607 10.277 1.00 93.48 N +ATOM 502 CA ASN A 62 -0.180 -21.821 10.016 1.00 93.48 C +ATOM 503 C ASN A 62 -0.703 -20.869 8.945 1.00 93.48 C +ATOM 504 CB ASN A 62 -0.992 -21.669 11.304 1.00 93.48 C +ATOM 505 O ASN A 62 -1.306 -19.842 9.261 1.00 93.48 O +ATOM 506 CG ASN A 62 -2.454 -22.025 11.119 1.00 93.48 C +ATOM 507 ND2 ASN A 62 -3.270 -21.724 12.122 1.00 93.48 N +ATOM 508 OD1 ASN A 62 -2.847 -22.568 10.083 1.00 93.48 O +ATOM 509 N PRO A 63 -0.487 -21.281 7.650 1.00 93.45 N +ATOM 510 CA PRO A 63 -0.884 -20.397 6.551 1.00 93.45 C +ATOM 511 C PRO A 63 -2.388 -20.133 6.520 1.00 93.45 C +ATOM 512 CB PRO A 63 -0.439 -21.164 5.303 1.00 93.45 C +ATOM 513 O PRO A 63 -2.839 -19.185 5.873 1.00 93.45 O +ATOM 514 CG PRO A 63 0.687 -22.029 5.768 1.00 93.45 C +ATOM 515 CD PRO A 63 0.406 -22.461 7.179 1.00 93.45 C +ATOM 516 N GLY A 64 -3.187 -20.928 7.217 1.00 92.41 N +ATOM 517 CA GLY A 64 -4.631 -20.776 7.298 1.00 92.41 C +ATOM 518 C GLY A 64 -5.059 -19.422 7.833 1.00 92.41 C +ATOM 519 O GLY A 64 -6.155 -18.947 7.529 1.00 92.41 O +ATOM 520 N VAL A 65 -4.213 -18.798 8.586 1.00 91.96 N +ATOM 521 CA VAL A 65 -4.506 -17.485 9.151 1.00 91.96 C +ATOM 522 C VAL A 65 -4.641 -16.458 8.029 1.00 91.96 C +ATOM 523 CB VAL A 65 -3.414 -17.041 10.151 1.00 91.96 C +ATOM 524 O VAL A 65 -5.476 -15.554 8.104 1.00 91.96 O +ATOM 525 CG1 VAL A 65 -3.648 -15.600 10.601 1.00 91.96 C +ATOM 526 CG2 VAL A 65 -3.381 -17.981 11.355 1.00 91.96 C +ATOM 527 N LEU A 66 -3.813 -16.590 7.002 1.00 94.59 N +ATOM 528 CA LEU A 66 -3.903 -15.709 5.843 1.00 94.59 C +ATOM 529 C LEU A 66 -5.224 -15.910 5.108 1.00 94.59 C +ATOM 530 CB LEU A 66 -2.732 -15.956 4.889 1.00 94.59 C +ATOM 531 O LEU A 66 -5.833 -14.945 4.640 1.00 94.59 O +ATOM 532 CG LEU A 66 -1.354 -15.503 5.375 1.00 94.59 C +ATOM 533 CD1 LEU A 66 -0.266 -16.023 4.442 1.00 94.59 C +ATOM 534 CD2 LEU A 66 -1.296 -13.983 5.478 1.00 94.59 C +ATOM 535 N ARG A 67 -5.697 -17.125 5.099 1.00 93.00 N +ATOM 536 CA ARG A 67 -6.979 -17.415 4.465 1.00 93.00 C +ATOM 537 C ARG A 67 -8.129 -16.777 5.237 1.00 93.00 C +ATOM 538 CB ARG A 67 -7.195 -18.926 4.357 1.00 93.00 C +ATOM 539 O ARG A 67 -9.076 -16.262 4.638 1.00 93.00 O +ATOM 540 CG ARG A 67 -6.471 -19.570 3.185 1.00 93.00 C +ATOM 541 CD ARG A 67 -6.718 -21.071 3.125 1.00 93.00 C +ATOM 542 NE ARG A 67 -5.700 -21.753 2.330 1.00 93.00 N +ATOM 543 NH1 ARG A 67 -5.006 -23.147 4.036 1.00 93.00 N +ATOM 544 NH2 ARG A 67 -4.019 -23.275 1.972 1.00 93.00 N +ATOM 545 CZ ARG A 67 -4.911 -22.723 2.781 1.00 93.00 C +ATOM 546 N GLN A 68 -7.987 -16.847 6.531 1.00 91.80 N +ATOM 547 CA GLN A 68 -8.990 -16.202 7.372 1.00 91.80 C +ATOM 548 C GLN A 68 -9.055 -14.702 7.099 1.00 91.80 C +ATOM 549 CB GLN A 68 -8.692 -16.454 8.851 1.00 91.80 C +ATOM 550 O GLN A 68 -10.141 -14.122 7.044 1.00 91.80 O +ATOM 551 CG GLN A 68 -8.907 -17.898 9.285 1.00 91.80 C +ATOM 552 CD GLN A 68 -8.532 -18.137 10.735 1.00 91.80 C +ATOM 553 NE2 GLN A 68 -8.584 -19.394 11.161 1.00 91.80 N +ATOM 554 OE1 GLN A 68 -8.197 -17.200 11.467 1.00 91.80 O +ATOM 555 N LEU A 69 -7.840 -14.204 6.889 1.00 90.65 N +ATOM 556 CA LEU A 69 -7.754 -12.783 6.570 1.00 90.65 C +ATOM 557 C LEU A 69 -8.479 -12.474 5.264 1.00 90.65 C +ATOM 558 CB LEU A 69 -6.291 -12.343 6.471 1.00 90.65 C +ATOM 559 O LEU A 69 -9.201 -11.478 5.171 1.00 90.65 O +ATOM 560 CG LEU A 69 -6.047 -10.871 6.134 1.00 90.65 C +ATOM 561 CD1 LEU A 69 -6.184 -10.011 7.386 1.00 90.65 C +ATOM 562 CD2 LEU A 69 -4.671 -10.688 5.502 1.00 90.65 C +ATOM 563 N LEU A 70 -8.368 -13.367 4.331 1.00 92.32 N +ATOM 564 CA LEU A 70 -8.951 -13.168 3.009 1.00 92.32 C +ATOM 565 C LEU A 70 -10.472 -13.273 3.065 1.00 92.32 C +ATOM 566 CB LEU A 70 -8.393 -14.192 2.017 1.00 92.32 C +ATOM 567 O LEU A 70 -11.161 -12.856 2.132 1.00 92.32 O +ATOM 568 CG LEU A 70 -6.935 -14.001 1.594 1.00 92.32 C +ATOM 569 CD1 LEU A 70 -6.506 -15.120 0.651 1.00 92.32 C +ATOM 570 CD2 LEU A 70 -6.743 -12.638 0.937 1.00 92.32 C +ATOM 571 N ASN A 71 -10.998 -13.749 4.222 1.00 89.44 N +ATOM 572 CA ASN A 71 -12.439 -13.904 4.389 1.00 89.44 C +ATOM 573 C ASN A 71 -13.060 -12.684 5.064 1.00 89.44 C +ATOM 574 CB ASN A 71 -12.754 -15.171 5.188 1.00 89.44 C +ATOM 575 O ASN A 71 -14.269 -12.648 5.300 1.00 89.44 O +ATOM 576 CG ASN A 71 -12.527 -16.438 4.387 1.00 89.44 C +ATOM 577 ND2 ASN A 71 -12.215 -17.528 5.077 1.00 89.44 N +ATOM 578 OD1 ASN A 71 -12.631 -16.436 3.157 1.00 89.44 O +ATOM 579 N THR A 72 -12.197 -11.713 5.346 1.00 85.88 N +ATOM 580 CA THR A 72 -12.715 -10.481 5.931 1.00 85.88 C +ATOM 581 C THR A 72 -12.980 -9.438 4.848 1.00 85.88 C +ATOM 582 CB THR A 72 -11.740 -9.905 6.974 1.00 85.88 C +ATOM 583 O THR A 72 -12.468 -9.550 3.733 1.00 85.88 O +ATOM 584 CG2 THR A 72 -11.362 -10.956 8.013 1.00 85.88 C +ATOM 585 OG1 THR A 72 -10.552 -9.454 6.312 1.00 85.88 O +ATOM 586 N SER A 73 -13.887 -8.428 5.180 1.00 83.66 N +ATOM 587 CA SER A 73 -14.270 -7.391 4.227 1.00 83.66 C +ATOM 588 C SER A 73 -13.063 -6.566 3.793 1.00 83.66 C +ATOM 589 CB SER A 73 -15.334 -6.473 4.831 1.00 83.66 C +ATOM 590 O SER A 73 -12.895 -6.279 2.606 1.00 83.66 O +ATOM 591 OG SER A 73 -14.906 -5.964 6.083 1.00 83.66 O +ATOM 592 N TYR A 74 -12.158 -6.350 4.700 1.00 85.44 N +ATOM 593 CA TYR A 74 -11.001 -5.508 4.419 1.00 85.44 C +ATOM 594 C TYR A 74 -9.863 -6.327 3.820 1.00 85.44 C +ATOM 595 CB TYR A 74 -10.524 -4.807 5.695 1.00 85.44 C +ATOM 596 O TYR A 74 -9.206 -5.888 2.873 1.00 85.44 O +ATOM 597 CG TYR A 74 -9.370 -3.860 5.472 1.00 85.44 C +ATOM 598 CD1 TYR A 74 -8.113 -4.123 6.010 1.00 85.44 C +ATOM 599 CD2 TYR A 74 -9.536 -2.699 4.724 1.00 85.44 C +ATOM 600 CE1 TYR A 74 -7.047 -3.252 5.809 1.00 85.44 C +ATOM 601 CE2 TYR A 74 -8.477 -1.820 4.516 1.00 85.44 C +ATOM 602 OH TYR A 74 -6.188 -1.239 4.859 1.00 85.44 O +ATOM 603 CZ TYR A 74 -7.239 -2.105 5.061 1.00 85.44 C +ATOM 604 N GLY A 75 -9.670 -7.576 4.239 1.00 87.69 N +ATOM 605 CA GLY A 75 -8.531 -8.404 3.877 1.00 87.69 C +ATOM 606 C GLY A 75 -8.721 -9.138 2.562 1.00 87.69 C +ATOM 607 O GLY A 75 -7.758 -9.648 1.986 1.00 87.69 O +ATOM 608 N GLN A 76 -9.911 -9.220 2.049 1.00 88.94 N +ATOM 609 CA GLN A 76 -10.228 -10.047 0.889 1.00 88.94 C +ATOM 610 C GLN A 76 -9.469 -9.574 -0.347 1.00 88.94 C +ATOM 611 CB GLN A 76 -11.733 -10.037 0.618 1.00 88.94 C +ATOM 612 O GLN A 76 -9.238 -10.352 -1.276 1.00 88.94 O +ATOM 613 CG GLN A 76 -12.272 -8.678 0.191 1.00 88.94 C +ATOM 614 CD GLN A 76 -13.766 -8.695 -0.069 1.00 88.94 C +ATOM 615 NE2 GLN A 76 -14.357 -7.513 -0.211 1.00 88.94 N +ATOM 616 OE1 GLN A 76 -14.385 -9.761 -0.143 1.00 88.94 O +ATOM 617 N SER A 77 -9.056 -8.332 -0.386 1.00 91.55 N +ATOM 618 CA SER A 77 -8.375 -7.781 -1.553 1.00 91.55 C +ATOM 619 C SER A 77 -6.860 -7.854 -1.396 1.00 91.55 C +ATOM 620 CB SER A 77 -8.803 -6.332 -1.788 1.00 91.55 C +ATOM 621 O SER A 77 -6.119 -7.283 -2.199 1.00 91.55 O +ATOM 622 OG SER A 77 -8.453 -5.518 -0.682 1.00 91.55 O +ATOM 623 N SER A 78 -6.348 -8.492 -0.360 1.00 94.82 N +ATOM 624 CA SER A 78 -4.912 -8.527 -0.104 1.00 94.82 C +ATOM 625 C SER A 78 -4.173 -9.282 -1.204 1.00 94.82 C +ATOM 626 CB SER A 78 -4.624 -9.173 1.251 1.00 94.82 C +ATOM 627 O SER A 78 -4.390 -10.480 -1.396 1.00 94.82 O +ATOM 628 OG SER A 78 -3.229 -9.326 1.450 1.00 94.82 O +ATOM 629 N LEU A 79 -3.217 -8.573 -1.822 1.00 95.18 N +ATOM 630 CA LEU A 79 -2.401 -9.185 -2.865 1.00 95.18 C +ATOM 631 C LEU A 79 -1.300 -10.048 -2.257 1.00 95.18 C +ATOM 632 CB LEU A 79 -1.785 -8.110 -3.764 1.00 95.18 C +ATOM 633 O LEU A 79 -0.983 -11.118 -2.782 1.00 95.18 O +ATOM 634 CG LEU A 79 -2.760 -7.308 -4.628 1.00 95.18 C +ATOM 635 CD1 LEU A 79 -2.018 -6.211 -5.384 1.00 95.18 C +ATOM 636 CD2 LEU A 79 -3.498 -8.227 -5.595 1.00 95.18 C +ATOM 637 N TRP A 80 -0.782 -9.591 -1.163 1.00 95.98 N +ATOM 638 CA TRP A 80 0.297 -10.327 -0.512 1.00 95.98 C +ATOM 639 C TRP A 80 -0.206 -11.657 0.038 1.00 95.98 C +ATOM 640 CB TRP A 80 0.913 -9.494 0.615 1.00 95.98 C +ATOM 641 O TRP A 80 0.438 -12.693 -0.141 1.00 95.98 O +ATOM 642 CG TRP A 80 1.897 -8.465 0.145 1.00 95.98 C +ATOM 643 CD1 TRP A 80 2.081 -8.026 -1.137 1.00 95.98 C +ATOM 644 CD2 TRP A 80 2.836 -7.749 0.952 1.00 95.98 C +ATOM 645 CE2 TRP A 80 3.558 -6.891 0.093 1.00 95.98 C +ATOM 646 CE3 TRP A 80 3.137 -7.749 2.321 1.00 95.98 C +ATOM 647 NE1 TRP A 80 3.078 -7.079 -1.175 1.00 95.98 N +ATOM 648 CH2 TRP A 80 4.837 -6.060 1.903 1.00 95.98 C +ATOM 649 CZ2 TRP A 80 4.563 -6.040 0.560 1.00 95.98 C +ATOM 650 CZ3 TRP A 80 4.138 -6.902 2.783 1.00 95.98 C +ATOM 651 N ALA A 81 -1.378 -11.544 0.632 1.00 96.63 N +ATOM 652 CA ALA A 81 -1.926 -12.773 1.199 1.00 96.63 C +ATOM 653 C ALA A 81 -2.214 -13.800 0.108 1.00 96.63 C +ATOM 654 CB ALA A 81 -3.196 -12.474 1.992 1.00 96.63 C +ATOM 655 O ALA A 81 -1.860 -14.974 0.242 1.00 96.63 O +ATOM 656 N LYS A 82 -2.779 -13.319 -0.997 1.00 96.21 N +ATOM 657 CA LYS A 82 -3.048 -14.207 -2.124 1.00 96.21 C +ATOM 658 C LYS A 82 -1.753 -14.759 -2.711 1.00 96.21 C +ATOM 659 CB LYS A 82 -3.844 -13.475 -3.206 1.00 96.21 C +ATOM 660 O LYS A 82 -1.666 -15.946 -3.030 1.00 96.21 O +ATOM 661 CG LYS A 82 -5.273 -13.141 -2.804 1.00 96.21 C +ATOM 662 CD LYS A 82 -5.970 -12.298 -3.864 1.00 96.21 C +ATOM 663 CE LYS A 82 -7.370 -11.890 -3.425 1.00 96.21 C +ATOM 664 NZ LYS A 82 -7.995 -10.933 -4.386 1.00 96.21 N +ATOM 665 N HIS A 83 -0.821 -13.882 -2.767 1.00 96.22 N +ATOM 666 CA HIS A 83 0.487 -14.272 -3.281 1.00 96.22 C +ATOM 667 C HIS A 83 1.148 -15.308 -2.377 1.00 96.22 C +ATOM 668 CB HIS A 83 1.393 -13.048 -3.426 1.00 96.22 C +ATOM 669 O HIS A 83 1.619 -16.343 -2.853 1.00 96.22 O +ATOM 670 CG HIS A 83 2.804 -13.386 -3.792 1.00 96.22 C +ATOM 671 CD2 HIS A 83 3.940 -13.371 -3.056 1.00 96.22 C +ATOM 672 ND1 HIS A 83 3.167 -13.795 -5.056 1.00 96.22 N +ATOM 673 CE1 HIS A 83 4.471 -14.018 -5.082 1.00 96.22 C +ATOM 674 NE2 HIS A 83 4.963 -13.769 -3.881 1.00 96.22 N +ATOM 675 N LEU A 84 1.122 -15.100 -1.128 1.00 96.99 N +ATOM 676 CA LEU A 84 1.789 -15.976 -0.172 1.00 96.99 C +ATOM 677 C LEU A 84 1.101 -17.335 -0.107 1.00 96.99 C +ATOM 678 CB LEU A 84 1.811 -15.335 1.218 1.00 96.99 C +ATOM 679 O LEU A 84 1.753 -18.356 0.121 1.00 96.99 O +ATOM 680 CG LEU A 84 2.743 -14.136 1.398 1.00 96.99 C +ATOM 681 CD1 LEU A 84 2.457 -13.435 2.722 1.00 96.99 C +ATOM 682 CD2 LEU A 84 4.201 -14.576 1.324 1.00 96.99 C +ATOM 683 N LEU A 85 -0.182 -17.345 -0.415 1.00 96.15 N +ATOM 684 CA LEU A 85 -0.959 -18.578 -0.349 1.00 96.15 C +ATOM 685 C LEU A 85 -0.958 -19.294 -1.695 1.00 96.15 C +ATOM 686 CB LEU A 85 -2.398 -18.283 0.084 1.00 96.15 C +ATOM 687 O LEU A 85 -1.407 -20.438 -1.795 1.00 96.15 O +ATOM 688 CG LEU A 85 -2.603 -17.922 1.556 1.00 96.15 C +ATOM 689 CD1 LEU A 85 -4.005 -17.364 1.775 1.00 96.15 C +ATOM 690 CD2 LEU A 85 -2.361 -19.139 2.443 1.00 96.15 C +ATOM 691 N GLY A 86 -0.426 -18.609 -2.733 1.00 94.46 N +ATOM 692 CA GLY A 86 -0.520 -19.143 -4.083 1.00 94.46 C +ATOM 693 C GLY A 86 -1.938 -19.159 -4.621 1.00 94.46 C +ATOM 694 O GLY A 86 -2.292 -20.024 -5.425 1.00 94.46 O +ATOM 695 N GLU A 87 -2.757 -18.253 -4.107 1.00 94.61 N +ATOM 696 CA GLU A 87 -4.177 -18.251 -4.445 1.00 94.61 C +ATOM 697 C GLU A 87 -4.520 -17.097 -5.383 1.00 94.61 C +ATOM 698 CB GLU A 87 -5.032 -18.170 -3.177 1.00 94.61 C +ATOM 699 O GLU A 87 -5.626 -16.555 -5.330 1.00 94.61 O +ATOM 700 CG GLU A 87 -4.965 -19.418 -2.309 1.00 94.61 C +ATOM 701 CD GLU A 87 -5.983 -19.419 -1.180 1.00 94.61 C +ATOM 702 OE1 GLU A 87 -6.173 -20.475 -0.535 1.00 94.61 O +ATOM 703 OE2 GLU A 87 -6.597 -18.355 -0.939 1.00 94.61 O +ATOM 704 N GLU A 88 -3.609 -16.725 -6.167 1.00 93.02 N +ATOM 705 CA GLU A 88 -3.890 -15.727 -7.196 1.00 93.02 C +ATOM 706 C GLU A 88 -4.825 -16.285 -8.265 1.00 93.02 C +ATOM 707 CB GLU A 88 -2.590 -15.236 -7.838 1.00 93.02 C +ATOM 708 O GLU A 88 -4.710 -17.450 -8.651 1.00 93.02 O +ATOM 709 CG GLU A 88 -1.590 -14.665 -6.843 1.00 93.02 C +ATOM 710 CD GLU A 88 -0.525 -15.666 -6.422 1.00 93.02 C +ATOM 711 OE1 GLU A 88 0.646 -15.264 -6.237 1.00 93.02 O +ATOM 712 OE2 GLU A 88 -0.865 -16.861 -6.276 1.00 93.02 O +ATOM 713 N LYS A 89 -5.710 -15.438 -8.711 1.00 90.86 N +ATOM 714 CA LYS A 89 -6.693 -15.860 -9.705 1.00 90.86 C +ATOM 715 C LYS A 89 -6.511 -15.099 -11.016 1.00 90.86 C +ATOM 716 CB LYS A 89 -8.114 -15.659 -9.175 1.00 90.86 C +ATOM 717 O LYS A 89 -6.022 -13.968 -11.020 1.00 90.86 O +ATOM 718 CG LYS A 89 -8.469 -16.558 -8.000 1.00 90.86 C +ATOM 719 CD LYS A 89 -9.927 -16.391 -7.590 1.00 90.86 C +ATOM 720 CE LYS A 89 -10.312 -17.366 -6.486 1.00 90.86 C +ATOM 721 NZ LYS A 89 -11.744 -17.215 -6.089 1.00 90.86 N +ATOM 722 N ASN A 90 -6.881 -15.834 -12.117 1.00 86.80 N +ATOM 723 CA ASN A 90 -6.855 -15.175 -13.418 1.00 86.80 C +ATOM 724 C ASN A 90 -8.144 -14.401 -13.680 1.00 86.80 C +ATOM 725 CB ASN A 90 -6.613 -16.195 -14.533 1.00 86.80 C +ATOM 726 O ASN A 90 -9.000 -14.295 -12.800 1.00 86.80 O +ATOM 727 CG ASN A 90 -7.709 -17.239 -14.616 1.00 86.80 C +ATOM 728 ND2 ASN A 90 -7.352 -18.439 -15.061 1.00 86.80 N +ATOM 729 OD1 ASN A 90 -8.866 -16.970 -14.285 1.00 86.80 O +ATOM 730 N VAL A 91 -8.244 -13.841 -14.857 1.00 77.80 N +ATOM 731 CA VAL A 91 -9.337 -12.938 -15.203 1.00 77.80 C +ATOM 732 C VAL A 91 -10.663 -13.694 -15.165 1.00 77.80 C +ATOM 733 CB VAL A 91 -9.127 -12.300 -16.595 1.00 77.80 C +ATOM 734 O VAL A 91 -11.725 -13.088 -15.003 1.00 77.80 O +ATOM 735 CG1 VAL A 91 -7.948 -11.328 -16.572 1.00 77.80 C +ATOM 736 CG2 VAL A 91 -8.909 -13.383 -17.650 1.00 77.80 C +ATOM 737 N THR A 92 -10.625 -15.084 -15.375 1.00 81.97 N +ATOM 738 CA THR A 92 -11.836 -15.896 -15.395 1.00 81.97 C +ATOM 739 C THR A 92 -12.218 -16.334 -13.984 1.00 81.97 C +ATOM 740 CB THR A 92 -11.663 -17.136 -16.291 1.00 81.97 C +ATOM 741 O THR A 92 -13.271 -16.941 -13.780 1.00 81.97 O +ATOM 742 CG2 THR A 92 -11.399 -16.736 -17.739 1.00 81.97 C +ATOM 743 OG1 THR A 92 -10.559 -17.913 -15.813 1.00 81.97 O +ATOM 744 N GLY A 93 -11.316 -16.020 -13.011 1.00 84.25 N +ATOM 745 CA GLY A 93 -11.601 -16.342 -11.621 1.00 84.25 C +ATOM 746 C GLY A 93 -11.000 -17.662 -11.179 1.00 84.25 C +ATOM 747 O GLY A 93 -11.212 -18.099 -10.046 1.00 84.25 O +ATOM 748 N ASP A 94 -10.297 -18.278 -12.116 1.00 90.14 N +ATOM 749 CA ASP A 94 -9.617 -19.528 -11.790 1.00 90.14 C +ATOM 750 C ASP A 94 -8.254 -19.263 -11.154 1.00 90.14 C +ATOM 751 CB ASP A 94 -9.454 -20.393 -13.041 1.00 90.14 C +ATOM 752 O ASP A 94 -7.606 -18.260 -11.459 1.00 90.14 O +ATOM 753 CG ASP A 94 -10.780 -20.827 -13.640 1.00 90.14 C +ATOM 754 OD1 ASP A 94 -11.765 -20.989 -12.887 1.00 90.14 O +ATOM 755 OD2 ASP A 94 -10.841 -21.011 -14.875 1.00 90.14 O +ATOM 756 N PHE A 95 -7.883 -20.240 -10.245 1.00 92.13 N +ATOM 757 CA PHE A 95 -6.547 -20.133 -9.671 1.00 92.13 C +ATOM 758 C PHE A 95 -5.482 -20.256 -10.753 1.00 92.13 C +ATOM 759 CB PHE A 95 -6.333 -21.206 -8.599 1.00 92.13 C +ATOM 760 O PHE A 95 -5.598 -21.089 -11.655 1.00 92.13 O +ATOM 761 CG PHE A 95 -7.148 -20.989 -7.352 1.00 92.13 C +ATOM 762 CD1 PHE A 95 -6.902 -19.901 -6.524 1.00 92.13 C +ATOM 763 CD2 PHE A 95 -8.161 -21.875 -7.009 1.00 92.13 C +ATOM 764 CE1 PHE A 95 -7.655 -19.698 -5.370 1.00 92.13 C +ATOM 765 CE2 PHE A 95 -8.917 -21.680 -5.857 1.00 92.13 C +ATOM 766 CZ PHE A 95 -8.662 -20.591 -5.038 1.00 92.13 C +ATOM 767 N VAL A 96 -4.505 -19.397 -10.591 1.00 92.18 N +ATOM 768 CA VAL A 96 -3.394 -19.390 -11.537 1.00 92.18 C +ATOM 769 C VAL A 96 -2.594 -20.684 -11.404 1.00 92.18 C +ATOM 770 CB VAL A 96 -2.473 -18.169 -11.322 1.00 92.18 C +ATOM 771 O VAL A 96 -2.185 -21.275 -12.406 1.00 92.18 O +ATOM 772 CG1 VAL A 96 -1.221 -18.277 -12.190 1.00 92.18 C +ATOM 773 CG2 VAL A 96 -3.225 -16.874 -11.623 1.00 92.18 C +ATOM 774 N LEU A 97 -2.415 -21.138 -10.150 1.00 92.51 N +ATOM 775 CA LEU A 97 -1.675 -22.361 -9.858 1.00 92.51 C +ATOM 776 C LEU A 97 -2.625 -23.494 -9.484 1.00 92.51 C +ATOM 777 CB LEU A 97 -0.674 -22.124 -8.724 1.00 92.51 C +ATOM 778 O LEU A 97 -3.648 -23.264 -8.836 1.00 92.51 O +ATOM 779 CG LEU A 97 0.394 -21.058 -8.974 1.00 92.51 C +ATOM 780 CD1 LEU A 97 1.187 -20.792 -7.699 1.00 92.51 C +ATOM 781 CD2 LEU A 97 1.321 -21.484 -10.107 1.00 92.51 C +ATOM 782 N ALA A 98 -2.302 -24.686 -9.951 1.00 89.50 N +ATOM 783 CA ALA A 98 -3.056 -25.875 -9.564 1.00 89.50 C +ATOM 784 C ALA A 98 -2.823 -26.218 -8.095 1.00 89.50 C +ATOM 785 CB ALA A 98 -2.675 -27.058 -10.450 1.00 89.50 C +ATOM 786 O ALA A 98 -1.884 -25.713 -7.475 1.00 89.50 O +ATOM 787 N GLY A 99 -3.668 -27.090 -7.472 1.00 84.87 N +ATOM 788 CA GLY A 99 -3.709 -27.383 -6.049 1.00 84.87 C +ATOM 789 C GLY A 99 -2.350 -27.732 -5.472 1.00 84.87 C +ATOM 790 O GLY A 99 -1.871 -27.067 -4.551 1.00 84.87 O +ATOM 791 N ASN A 100 -1.621 -28.772 -6.031 1.00 90.40 N +ATOM 792 CA ASN A 100 -0.322 -29.161 -5.493 1.00 90.40 C +ATOM 793 C ASN A 100 0.727 -28.076 -5.721 1.00 90.40 C +ATOM 794 CB ASN A 100 0.139 -30.484 -6.109 1.00 90.40 C +ATOM 795 O ASN A 100 1.568 -27.829 -4.855 1.00 90.40 O +ATOM 796 CG ASN A 100 -0.648 -31.673 -5.595 1.00 90.40 C +ATOM 797 ND2 ASN A 100 -0.621 -32.770 -6.343 1.00 90.40 N +ATOM 798 OD1 ASN A 100 -1.276 -31.607 -4.535 1.00 90.40 O +ATOM 799 N ALA A 101 0.621 -27.405 -6.853 1.00 93.48 N +ATOM 800 CA ALA A 101 1.541 -26.313 -7.161 1.00 93.48 C +ATOM 801 C ALA A 101 1.290 -25.111 -6.255 1.00 93.48 C +ATOM 802 CB ALA A 101 1.413 -25.907 -8.627 1.00 93.48 C +ATOM 803 O ALA A 101 2.227 -24.407 -5.873 1.00 93.48 O +ATOM 804 N ARG A 102 0.066 -24.943 -5.817 1.00 92.94 N +ATOM 805 CA ARG A 102 -0.291 -23.846 -4.923 1.00 92.94 C +ATOM 806 C ARG A 102 0.318 -24.047 -3.539 1.00 92.94 C +ATOM 807 CB ARG A 102 -1.812 -23.716 -4.812 1.00 92.94 C +ATOM 808 O ARG A 102 0.888 -23.117 -2.966 1.00 92.94 O +ATOM 809 CG ARG A 102 -2.273 -22.450 -4.109 1.00 92.94 C +ATOM 810 CD ARG A 102 -3.789 -22.316 -4.124 1.00 92.94 C +ATOM 811 NE ARG A 102 -4.444 -23.557 -3.721 1.00 92.94 N +ATOM 812 NH1 ARG A 102 -6.485 -23.029 -4.666 1.00 92.94 N +ATOM 813 NH2 ARG A 102 -6.204 -25.024 -3.572 1.00 92.94 N +ATOM 814 CZ ARG A 102 -5.709 -23.867 -3.987 1.00 92.94 C +ATOM 815 N GLU A 103 0.238 -25.271 -3.080 1.00 92.30 N +ATOM 816 CA GLU A 103 0.781 -25.582 -1.761 1.00 92.30 C +ATOM 817 C GLU A 103 2.300 -25.431 -1.741 1.00 92.30 C +ATOM 818 CB GLU A 103 0.388 -26.999 -1.337 1.00 92.30 C +ATOM 819 O GLU A 103 2.861 -24.873 -0.796 1.00 92.30 O +ATOM 820 CG GLU A 103 -1.092 -27.157 -1.020 1.00 92.30 C +ATOM 821 CD GLU A 103 -1.486 -28.589 -0.694 1.00 92.30 C +ATOM 822 OE1 GLU A 103 -2.688 -28.849 -0.460 1.00 92.30 O +ATOM 823 OE2 GLU A 103 -0.586 -29.457 -0.671 1.00 92.30 O +ATOM 824 N SER A 104 2.906 -25.899 -2.821 1.00 94.58 N +ATOM 825 CA SER A 104 4.357 -25.787 -2.932 1.00 94.58 C +ATOM 826 C SER A 104 4.793 -24.329 -3.028 1.00 94.58 C +ATOM 827 CB SER A 104 4.862 -26.561 -4.150 1.00 94.58 C +ATOM 828 O SER A 104 5.747 -23.916 -2.367 1.00 94.58 O +ATOM 829 OG SER A 104 4.627 -27.950 -3.997 1.00 94.58 O +ATOM 830 N ALA A 105 4.043 -23.598 -3.800 1.00 94.45 N +ATOM 831 CA ALA A 105 4.341 -22.176 -3.946 1.00 94.45 C +ATOM 832 C ALA A 105 4.170 -21.441 -2.620 1.00 94.45 C +ATOM 833 CB ALA A 105 3.449 -21.552 -5.016 1.00 94.45 C +ATOM 834 O ALA A 105 4.996 -20.599 -2.258 1.00 94.45 O +ATOM 835 N SER A 106 3.120 -21.731 -1.961 1.00 95.57 N +ATOM 836 CA SER A 106 2.849 -21.109 -0.669 1.00 95.57 C +ATOM 837 C SER A 106 3.984 -21.363 0.317 1.00 95.57 C +ATOM 838 CB SER A 106 1.533 -21.629 -0.089 1.00 95.57 C +ATOM 839 O SER A 106 4.481 -20.432 0.954 1.00 95.57 O +ATOM 840 OG SER A 106 1.283 -21.056 1.183 1.00 95.57 O +ATOM 841 N GLU A 107 4.432 -22.622 0.391 1.00 94.58 N +ATOM 842 CA GLU A 107 5.513 -22.993 1.299 1.00 94.58 C +ATOM 843 C GLU A 107 6.794 -22.229 0.974 1.00 94.58 C +ATOM 844 CB GLU A 107 5.771 -24.501 1.239 1.00 94.58 C +ATOM 845 O GLU A 107 7.436 -21.674 1.868 1.00 94.58 O +ATOM 846 CG GLU A 107 4.707 -25.335 1.937 1.00 94.58 C +ATOM 847 CD GLU A 107 4.948 -26.832 1.825 1.00 94.58 C +ATOM 848 OE1 GLU A 107 4.107 -27.621 2.312 1.00 94.58 O +ATOM 849 OE2 GLU A 107 5.988 -27.219 1.247 1.00 94.58 O +ATOM 850 N ASN A 108 7.119 -22.182 -0.298 1.00 94.43 N +ATOM 851 CA ASN A 108 8.336 -21.505 -0.733 1.00 94.43 C +ATOM 852 C ASN A 108 8.253 -19.999 -0.500 1.00 94.43 C +ATOM 853 CB ASN A 108 8.616 -21.800 -2.208 1.00 94.43 C +ATOM 854 O ASN A 108 9.217 -19.384 -0.041 1.00 94.43 O +ATOM 855 CG ASN A 108 9.091 -23.221 -2.439 1.00 94.43 C +ATOM 856 ND2 ASN A 108 8.910 -23.716 -3.658 1.00 94.43 N +ATOM 857 OD1 ASN A 108 9.616 -23.869 -1.530 1.00 94.43 O +ATOM 858 N ARG A 109 7.174 -19.415 -0.728 1.00 95.05 N +ATOM 859 CA ARG A 109 6.980 -17.973 -0.615 1.00 95.05 C +ATOM 860 C ARG A 109 6.965 -17.536 0.846 1.00 95.05 C +ATOM 861 CB ARG A 109 5.680 -17.550 -1.301 1.00 95.05 C +ATOM 862 O ARG A 109 7.531 -16.498 1.195 1.00 95.05 O +ATOM 863 CG ARG A 109 5.721 -17.656 -2.818 1.00 95.05 C +ATOM 864 CD ARG A 109 4.344 -17.454 -3.435 1.00 95.05 C +ATOM 865 NE ARG A 109 4.391 -17.524 -4.892 1.00 95.05 N +ATOM 866 NH1 ARG A 109 2.098 -17.584 -5.170 1.00 95.05 N +ATOM 867 NH2 ARG A 109 3.481 -17.644 -6.997 1.00 95.05 N +ATOM 868 CZ ARG A 109 3.323 -17.584 -5.683 1.00 95.05 C +ATOM 869 N LEU A 110 6.356 -18.319 1.679 1.00 94.23 N +ATOM 870 CA LEU A 110 6.344 -18.021 3.107 1.00 94.23 C +ATOM 871 C LEU A 110 7.743 -18.150 3.701 1.00 94.23 C +ATOM 872 CB LEU A 110 5.378 -18.954 3.842 1.00 94.23 C +ATOM 873 O LEU A 110 8.122 -17.375 4.582 1.00 94.23 O +ATOM 874 CG LEU A 110 3.889 -18.629 3.709 1.00 94.23 C +ATOM 875 CD1 LEU A 110 3.045 -19.810 4.178 1.00 94.23 C +ATOM 876 CD2 LEU A 110 3.544 -17.371 4.498 1.00 94.23 C +ATOM 877 N LYS A 111 8.487 -19.138 3.158 1.00 89.63 N +ATOM 878 CA LYS A 111 9.865 -19.310 3.611 1.00 89.63 C +ATOM 879 C LYS A 111 10.723 -18.108 3.228 1.00 89.63 C +ATOM 880 CB LYS A 111 10.466 -20.590 3.029 1.00 89.63 C +ATOM 881 O LYS A 111 11.617 -17.712 3.979 1.00 89.63 O +ATOM 882 CG LYS A 111 10.037 -21.859 3.751 1.00 89.63 C +ATOM 883 CD LYS A 111 10.711 -23.092 3.162 1.00 89.63 C +ATOM 884 CE LYS A 111 10.200 -24.372 3.809 1.00 89.63 C +ATOM 885 NZ LYS A 111 10.831 -25.586 3.211 1.00 89.63 N +ATOM 886 N SER A 112 10.381 -17.503 2.154 1.00 87.97 N +ATOM 887 CA SER A 112 11.179 -16.398 1.632 1.00 87.97 C +ATOM 888 C SER A 112 10.758 -15.071 2.252 1.00 87.97 C +ATOM 889 CB SER A 112 11.056 -16.321 0.109 1.00 87.97 C +ATOM 890 O SER A 112 11.442 -14.058 2.087 1.00 87.97 O +ATOM 891 OG SER A 112 9.757 -15.899 -0.269 1.00 87.97 O +ATOM 892 N LEU A 113 9.565 -15.027 2.886 1.00 89.94 N +ATOM 893 CA LEU A 113 9.091 -13.831 3.573 1.00 89.94 C +ATOM 894 C LEU A 113 9.925 -13.552 4.818 1.00 89.94 C +ATOM 895 CB LEU A 113 7.616 -13.982 3.955 1.00 89.94 C +ATOM 896 O LEU A 113 9.924 -14.346 5.762 1.00 89.94 O +ATOM 897 CG LEU A 113 6.978 -12.794 4.677 1.00 89.94 C +ATOM 898 CD1 LEU A 113 6.907 -11.586 3.749 1.00 89.94 C +ATOM 899 CD2 LEU A 113 5.590 -13.163 5.190 1.00 89.94 C +ATOM 900 N GLU A 114 10.635 -12.381 4.778 1.00 82.76 N +ATOM 901 CA GLU A 114 11.578 -12.106 5.858 1.00 82.76 C +ATOM 902 C GLU A 114 11.396 -10.692 6.402 1.00 82.76 C +ATOM 903 CB GLU A 114 13.018 -12.304 5.377 1.00 82.76 C +ATOM 904 O GLU A 114 10.992 -9.786 5.670 1.00 82.76 O +ATOM 905 CG GLU A 114 13.345 -13.738 4.989 1.00 82.76 C +ATOM 906 CD GLU A 114 14.780 -13.920 4.520 1.00 82.76 C +ATOM 907 OE1 GLU A 114 15.202 -15.077 4.292 1.00 82.76 O +ATOM 908 OE2 GLU A 114 15.489 -12.898 4.381 1.00 82.76 O +ATOM 909 N LEU A 115 11.631 -10.592 7.689 1.00 79.83 N +ATOM 910 CA LEU A 115 11.657 -9.309 8.384 1.00 79.83 C +ATOM 911 C LEU A 115 13.083 -8.926 8.766 1.00 79.83 C +ATOM 912 CB LEU A 115 10.777 -9.360 9.636 1.00 79.83 C +ATOM 913 O LEU A 115 13.819 -9.740 9.328 1.00 79.83 O +ATOM 914 CG LEU A 115 10.644 -8.057 10.425 1.00 79.83 C +ATOM 915 CD1 LEU A 115 9.790 -7.055 9.654 1.00 79.83 C +ATOM 916 CD2 LEU A 115 10.051 -8.324 11.804 1.00 79.83 C +ATOM 917 N SER A 116 13.428 -7.707 8.329 1.00 70.63 N +ATOM 918 CA SER A 116 14.753 -7.215 8.691 1.00 70.63 C +ATOM 919 C SER A 116 14.674 -5.835 9.336 1.00 70.63 C +ATOM 920 CB SER A 116 15.659 -7.160 7.460 1.00 70.63 C +ATOM 921 O SER A 116 13.649 -5.157 9.239 1.00 70.63 O +ATOM 922 OG SER A 116 15.135 -6.270 6.489 1.00 70.63 O +ATOM 923 N ILE A 117 15.713 -5.499 10.147 1.00 65.66 N +ATOM 924 CA ILE A 117 15.834 -4.181 10.762 1.00 65.66 C +ATOM 925 C ILE A 117 16.868 -3.351 10.004 1.00 65.66 C +ATOM 926 CB ILE A 117 16.221 -4.286 12.254 1.00 65.66 C +ATOM 927 O ILE A 117 17.971 -3.826 9.726 1.00 65.66 O +ATOM 928 CG1 ILE A 117 15.167 -5.090 13.023 1.00 65.66 C +ATOM 929 CG2 ILE A 117 16.401 -2.894 12.865 1.00 65.66 C +ATOM 930 CD1 ILE A 117 15.553 -5.400 14.463 1.00 65.66 C +ATOM 931 N PHE A 118 16.333 -2.223 9.619 1.00 61.49 N +ATOM 932 CA PHE A 118 17.289 -1.316 8.995 1.00 61.49 C +ATOM 933 C PHE A 118 18.311 -0.824 10.013 1.00 61.49 C +ATOM 934 CB PHE A 118 16.566 -0.125 8.360 1.00 61.49 C +ATOM 935 O PHE A 118 17.946 -0.231 11.030 1.00 61.49 O +ATOM 936 CG PHE A 118 17.484 0.838 7.657 1.00 61.49 C +ATOM 937 CD1 PHE A 118 17.910 2.001 8.288 1.00 61.49 C +ATOM 938 CD2 PHE A 118 17.921 0.581 6.364 1.00 61.49 C +ATOM 939 CE1 PHE A 118 18.760 2.894 7.640 1.00 61.49 C +ATOM 940 CE2 PHE A 118 18.770 1.469 5.710 1.00 61.49 C +ATOM 941 CZ PHE A 118 19.188 2.625 6.349 1.00 61.49 C +ATOM 942 N ASN A 119 19.587 -1.099 9.857 1.00 55.55 N +ATOM 943 CA ASN A 119 20.583 -0.739 10.860 1.00 55.55 C +ATOM 944 C ASN A 119 21.233 0.606 10.549 1.00 55.55 C +ATOM 945 CB ASN A 119 21.650 -1.831 10.974 1.00 55.55 C +ATOM 946 O ASN A 119 21.018 1.585 11.265 1.00 55.55 O +ATOM 947 CG ASN A 119 21.172 -3.034 11.762 1.00 55.55 C +ATOM 948 ND2 ASN A 119 21.824 -4.173 11.559 1.00 55.55 N +ATOM 949 OD1 ASN A 119 20.224 -2.942 12.546 1.00 55.55 O +ATOM 950 N SER A 120 21.956 0.730 9.512 1.00 51.50 N +ATOM 951 CA SER A 120 22.731 1.926 9.200 1.00 51.50 C +ATOM 952 C SER A 120 23.249 1.890 7.766 1.00 51.50 C +ATOM 953 CB SER A 120 23.903 2.074 10.170 1.00 51.50 C +ATOM 954 O SER A 120 23.276 0.830 7.136 1.00 51.50 O +ATOM 955 OG SER A 120 24.813 0.997 10.028 1.00 51.50 O +ATOM 956 N LEU A 121 23.382 3.171 7.205 1.00 48.58 N +ATOM 957 CA LEU A 121 24.065 3.350 5.928 1.00 48.58 C +ATOM 958 C LEU A 121 25.559 3.573 6.136 1.00 48.58 C +ATOM 959 CB LEU A 121 23.463 4.530 5.160 1.00 48.58 C +ATOM 960 O LEU A 121 25.959 4.377 6.982 1.00 48.58 O +ATOM 961 CG LEU A 121 22.128 4.272 4.458 1.00 48.58 C +ATOM 962 CD1 LEU A 121 21.423 5.591 4.160 1.00 48.58 C +ATOM 963 CD2 LEU A 121 22.342 3.473 3.178 1.00 48.58 C +ATOM 964 N GLN A 122 26.363 2.715 5.432 1.00 42.12 N +ATOM 965 CA GLN A 122 27.810 2.842 5.568 1.00 42.12 C +ATOM 966 C GLN A 122 28.466 3.133 4.222 1.00 42.12 C +ATOM 967 CB GLN A 122 28.406 1.572 6.179 1.00 42.12 C +ATOM 968 O GLN A 122 28.107 2.533 3.207 1.00 42.12 O +ATOM 969 CG GLN A 122 28.028 1.355 7.637 1.00 42.12 C +ATOM 970 CD GLN A 122 28.635 0.093 8.220 1.00 42.12 C +ATOM 971 NE2 GLN A 122 28.620 -0.016 9.544 1.00 42.12 N +ATOM 972 OE1 GLN A 122 29.113 -0.778 7.486 1.00 42.12 O +ATOM 973 N GLU A 123 29.282 4.239 4.195 1.00 40.96 N +ATOM 974 CA GLU A 123 30.087 4.466 2.999 1.00 40.96 C +ATOM 975 C GLU A 123 31.175 3.405 2.856 1.00 40.96 C +ATOM 976 CB GLU A 123 30.716 5.861 3.030 1.00 40.96 C +ATOM 977 O GLU A 123 31.600 2.807 3.847 1.00 40.96 O +ATOM 978 CG GLU A 123 29.720 6.989 2.799 1.00 40.96 C +ATOM 979 CD GLU A 123 30.372 8.362 2.738 1.00 40.96 C +ATOM 980 OE1 GLU A 123 29.649 9.370 2.569 1.00 40.96 O +ATOM 981 OE2 GLU A 123 31.615 8.429 2.859 1.00 40.96 O +ATOM 982 N LYS A 124 31.451 3.012 1.587 1.00 40.87 N +ATOM 983 CA LYS A 124 32.560 2.104 1.308 1.00 40.87 C +ATOM 984 C LYS A 124 33.832 2.555 2.020 1.00 40.87 C +ATOM 985 CB LYS A 124 32.809 2.007 -0.198 1.00 40.87 C +ATOM 986 O LYS A 124 34.173 3.740 2.002 1.00 40.87 O +ATOM 987 CG LYS A 124 33.728 0.864 -0.601 1.00 40.87 C +ATOM 988 CD LYS A 124 33.883 0.778 -2.114 1.00 40.87 C +ATOM 989 CE LYS A 124 34.870 -0.310 -2.515 1.00 40.87 C +ATOM 990 NZ LYS A 124 34.983 -0.435 -3.999 1.00 40.87 N +ATOM 991 N ASP A 125 34.454 1.723 2.881 1.00 39.89 N +ATOM 992 CA ASP A 125 35.761 1.838 3.521 1.00 39.89 C +ATOM 993 C ASP A 125 35.682 2.698 4.780 1.00 39.89 C +ATOM 994 CB ASP A 125 36.785 2.424 2.547 1.00 39.89 C +ATOM 995 O ASP A 125 36.708 3.143 5.299 1.00 39.89 O +ATOM 996 CG ASP A 125 37.080 1.507 1.373 1.00 39.89 C +ATOM 997 OD1 ASP A 125 37.073 0.269 1.550 1.00 39.89 O +ATOM 998 OD2 ASP A 125 37.324 2.026 0.263 1.00 39.89 O +ATOM 999 N LYS A 126 34.406 2.982 5.177 1.00 41.61 N +ATOM 1000 CA LYS A 126 34.212 3.704 6.431 1.00 41.61 C +ATOM 1001 C LYS A 126 33.345 2.904 7.398 1.00 41.61 C +ATOM 1002 CB LYS A 126 33.581 5.073 6.171 1.00 41.61 C +ATOM 1003 O LYS A 126 32.286 3.371 7.823 1.00 41.61 O +ATOM 1004 CG LYS A 126 34.488 6.041 5.426 1.00 41.61 C +ATOM 1005 CD LYS A 126 34.010 7.480 5.572 1.00 41.61 C +ATOM 1006 CE LYS A 126 34.953 8.456 4.881 1.00 41.61 C +ATOM 1007 NZ LYS A 126 34.489 9.869 5.022 1.00 41.61 N +ATOM 1008 N GLY A 127 33.686 1.576 7.580 1.00 39.92 N +ATOM 1009 CA GLY A 127 32.936 0.626 8.386 1.00 39.92 C +ATOM 1010 C GLY A 127 32.689 1.110 9.802 1.00 39.92 C +ATOM 1011 O GLY A 127 31.648 0.813 10.392 1.00 39.92 O +ATOM 1012 N ALA A 128 33.605 2.055 10.247 1.00 45.94 N +ATOM 1013 CA ALA A 128 33.523 2.502 11.636 1.00 45.94 C +ATOM 1014 C ALA A 128 32.610 3.718 11.767 1.00 45.94 C +ATOM 1015 CB ALA A 128 34.915 2.826 12.174 1.00 45.94 C +ATOM 1016 O ALA A 128 32.143 4.035 12.864 1.00 45.94 O +ATOM 1017 N GLU A 129 32.023 4.303 10.643 1.00 45.76 N +ATOM 1018 CA GLU A 129 31.300 5.570 10.700 1.00 45.76 C +ATOM 1019 C GLU A 129 29.873 5.415 10.184 1.00 45.76 C +ATOM 1020 CB GLU A 129 32.037 6.645 9.897 1.00 45.76 C +ATOM 1021 O GLU A 129 29.386 6.258 9.428 1.00 45.76 O +ATOM 1022 CG GLU A 129 33.411 6.993 10.451 1.00 45.76 C +ATOM 1023 CD GLU A 129 34.132 8.059 9.641 1.00 45.76 C +ATOM 1024 OE1 GLU A 129 35.322 8.330 9.917 1.00 45.76 O +ATOM 1025 OE2 GLU A 129 33.500 8.629 8.723 1.00 45.76 O +ATOM 1026 N GLY A 130 29.209 4.275 10.368 1.00 42.55 N +ATOM 1027 CA GLY A 130 27.847 4.140 9.878 1.00 42.55 C +ATOM 1028 C GLY A 130 26.888 5.137 10.500 1.00 42.55 C +ATOM 1029 O GLY A 130 27.126 5.630 11.604 1.00 42.55 O +ATOM 1030 N ASN A 131 26.050 5.762 9.650 1.00 48.68 N +ATOM 1031 CA ASN A 131 25.031 6.684 10.141 1.00 48.68 C +ATOM 1032 C ASN A 131 23.765 5.945 10.564 1.00 48.68 C +ATOM 1033 CB ASN A 131 24.703 7.736 9.080 1.00 48.68 C +ATOM 1034 O ASN A 131 23.365 4.972 9.923 1.00 48.68 O +ATOM 1035 CG ASN A 131 25.855 8.688 8.826 1.00 48.68 C +ATOM 1036 ND2 ASN A 131 25.933 9.214 7.610 1.00 48.68 N +ATOM 1037 OD1 ASN A 131 26.670 8.948 9.716 1.00 48.68 O +ATOM 1038 N ASP A 132 23.327 6.171 11.826 1.00 49.11 N +ATOM 1039 CA ASP A 132 22.035 5.661 12.277 1.00 49.11 C +ATOM 1040 C ASP A 132 20.900 6.190 11.402 1.00 49.11 C +ATOM 1041 CB ASP A 132 21.791 6.036 13.740 1.00 49.11 C +ATOM 1042 O ASP A 132 21.086 7.144 10.645 1.00 49.11 O +ATOM 1043 CG ASP A 132 22.699 5.291 14.702 1.00 49.11 C +ATOM 1044 OD1 ASP A 132 23.275 4.251 14.317 1.00 49.11 O +ATOM 1045 OD2 ASP A 132 22.837 5.746 15.858 1.00 49.11 O +ATOM 1046 N ASN A 133 19.765 5.469 11.260 1.00 50.59 N +ATOM 1047 CA ASN A 133 18.614 5.868 10.456 1.00 50.59 C +ATOM 1048 C ASN A 133 18.283 7.345 10.646 1.00 50.59 C +ATOM 1049 CB ASN A 133 17.398 5.003 10.794 1.00 50.59 C +ATOM 1050 O ASN A 133 17.962 8.043 9.682 1.00 50.59 O +ATOM 1051 CG ASN A 133 16.242 5.222 9.837 1.00 50.59 C +ATOM 1052 ND2 ASN A 133 15.028 5.262 10.373 1.00 50.59 N +ATOM 1053 OD1 ASN A 133 16.439 5.354 8.626 1.00 50.59 O +ATOM 1054 N GLY A 134 18.501 7.882 11.873 1.00 49.59 N +ATOM 1055 CA GLY A 134 18.168 9.264 12.177 1.00 49.59 C +ATOM 1056 C GLY A 134 19.170 10.257 11.619 1.00 49.59 C +ATOM 1057 O GLY A 134 18.833 11.416 11.373 1.00 49.59 O +ATOM 1058 N SER A 135 20.319 9.755 11.180 1.00 54.63 N +ATOM 1059 CA SER A 135 21.394 10.665 10.799 1.00 54.63 C +ATOM 1060 C SER A 135 21.661 10.609 9.299 1.00 54.63 C +ATOM 1061 CB SER A 135 22.675 10.331 11.565 1.00 54.63 C +ATOM 1062 O SER A 135 22.533 11.316 8.791 1.00 54.63 O +ATOM 1063 OG SER A 135 22.441 10.332 12.963 1.00 54.63 O +ATOM 1064 N ILE A 136 20.913 9.705 8.565 1.00 59.59 N +ATOM 1065 CA ILE A 136 21.066 9.560 7.121 1.00 59.59 C +ATOM 1066 C ILE A 136 20.358 10.710 6.409 1.00 59.59 C +ATOM 1067 CB ILE A 136 20.513 8.203 6.628 1.00 59.59 C +ATOM 1068 O ILE A 136 19.295 11.158 6.844 1.00 59.59 O +ATOM 1069 CG1 ILE A 136 21.251 7.046 7.312 1.00 59.59 C +ATOM 1070 CG2 ILE A 136 20.621 8.098 5.104 1.00 59.59 C +ATOM 1071 CD1 ILE A 136 20.609 5.684 7.088 1.00 59.59 C +ATOM 1072 N SER A 137 21.084 11.299 5.403 1.00 69.97 N +ATOM 1073 CA SER A 137 20.422 12.351 4.639 1.00 69.97 C +ATOM 1074 C SER A 137 19.163 11.830 3.955 1.00 69.97 C +ATOM 1075 CB SER A 137 21.375 12.936 3.596 1.00 69.97 C +ATOM 1076 O SER A 137 19.063 10.639 3.652 1.00 69.97 O +ATOM 1077 OG SER A 137 21.578 12.022 2.532 1.00 69.97 O +ATOM 1078 N ILE A 138 18.157 12.585 3.832 1.00 70.28 N +ATOM 1079 CA ILE A 138 16.876 12.249 3.220 1.00 70.28 C +ATOM 1080 C ILE A 138 17.106 11.680 1.822 1.00 70.28 C +ATOM 1081 CB ILE A 138 15.942 13.478 3.151 1.00 70.28 C +ATOM 1082 O ILE A 138 16.475 10.693 1.434 1.00 70.28 O +ATOM 1083 CG1 ILE A 138 15.507 13.897 4.560 1.00 70.28 C +ATOM 1084 CG2 ILE A 138 14.727 13.184 2.267 1.00 70.28 C +ATOM 1085 CD1 ILE A 138 14.797 15.243 4.614 1.00 70.28 C +ATOM 1086 N VAL A 139 18.080 12.237 1.108 1.00 75.78 N +ATOM 1087 CA VAL A 139 18.344 11.805 -0.260 1.00 75.78 C +ATOM 1088 C VAL A 139 18.881 10.376 -0.256 1.00 75.78 C +ATOM 1089 CB VAL A 139 19.343 12.747 -0.969 1.00 75.78 C +ATOM 1090 O VAL A 139 18.468 9.549 -1.073 1.00 75.78 O +ATOM 1091 CG1 VAL A 139 19.708 12.206 -2.351 1.00 75.78 C +ATOM 1092 CG2 VAL A 139 18.762 14.155 -1.080 1.00 75.78 C +ATOM 1093 N ASP A 140 19.748 10.081 0.645 1.00 73.04 N +ATOM 1094 CA ASP A 140 20.316 8.741 0.755 1.00 73.04 C +ATOM 1095 C ASP A 140 19.255 7.727 1.176 1.00 73.04 C +ATOM 1096 CB ASP A 140 21.478 8.730 1.750 1.00 73.04 C +ATOM 1097 O ASP A 140 19.231 6.601 0.674 1.00 73.04 O +ATOM 1098 CG ASP A 140 22.732 9.391 1.205 1.00 73.04 C +ATOM 1099 OD1 ASP A 140 22.868 9.515 -0.032 1.00 73.04 O +ATOM 1100 OD2 ASP A 140 23.593 9.789 2.019 1.00 73.04 O +ATOM 1101 N GLN A 141 18.401 8.127 2.022 1.00 75.28 N +ATOM 1102 CA GLN A 141 17.318 7.251 2.458 1.00 75.28 C +ATOM 1103 C GLN A 141 16.373 6.929 1.304 1.00 75.28 C +ATOM 1104 CB GLN A 141 16.540 7.891 3.610 1.00 75.28 C +ATOM 1105 O GLN A 141 15.962 5.779 1.134 1.00 75.28 O +ATOM 1106 CG GLN A 141 17.271 7.846 4.945 1.00 75.28 C +ATOM 1107 CD GLN A 141 16.466 8.460 6.075 1.00 75.28 C +ATOM 1108 NE2 GLN A 141 17.142 8.800 7.167 1.00 75.28 N +ATOM 1109 OE1 GLN A 141 15.247 8.627 5.968 1.00 75.28 O +ATOM 1110 N LEU A 142 16.128 7.983 0.569 1.00 81.72 N +ATOM 1111 CA LEU A 142 15.237 7.800 -0.571 1.00 81.72 C +ATOM 1112 C LEU A 142 15.878 6.900 -1.623 1.00 81.72 C +ATOM 1113 CB LEU A 142 14.874 9.151 -1.192 1.00 81.72 C +ATOM 1114 O LEU A 142 15.219 6.017 -2.176 1.00 81.72 O +ATOM 1115 CG LEU A 142 13.876 10.009 -0.412 1.00 81.72 C +ATOM 1116 CD1 LEU A 142 13.752 11.389 -1.049 1.00 81.72 C +ATOM 1117 CD2 LEU A 142 12.517 9.321 -0.346 1.00 81.72 C +ATOM 1118 N ALA A 143 17.126 7.197 -1.890 1.00 82.73 N +ATOM 1119 CA ALA A 143 17.845 6.360 -2.848 1.00 82.73 C +ATOM 1120 C ALA A 143 17.870 4.904 -2.393 1.00 82.73 C +ATOM 1121 CB ALA A 143 19.267 6.878 -3.045 1.00 82.73 C +ATOM 1122 O ALA A 143 17.695 3.991 -3.203 1.00 82.73 O +ATOM 1123 N ASP A 144 18.066 4.725 -1.144 1.00 81.56 N +ATOM 1124 CA ASP A 144 18.058 3.382 -0.573 1.00 81.56 C +ATOM 1125 C ASP A 144 16.698 2.713 -0.759 1.00 81.56 C +ATOM 1126 CB ASP A 144 18.423 3.428 0.912 1.00 81.56 C +ATOM 1127 O ASP A 144 16.617 1.579 -1.235 1.00 81.56 O +ATOM 1128 CG ASP A 144 18.433 2.056 1.563 1.00 81.56 C +ATOM 1129 OD1 ASP A 144 19.314 1.232 1.236 1.00 81.56 O +ATOM 1130 OD2 ASP A 144 17.549 1.795 2.408 1.00 81.56 O +ATOM 1131 N LYS A 145 15.702 3.383 -0.472 1.00 85.23 N +ATOM 1132 CA LYS A 145 14.351 2.846 -0.605 1.00 85.23 C +ATOM 1133 C LYS A 145 14.027 2.525 -2.062 1.00 85.23 C +ATOM 1134 CB LYS A 145 13.324 3.832 -0.045 1.00 85.23 C +ATOM 1135 O LYS A 145 13.442 1.481 -2.358 1.00 85.23 O +ATOM 1136 CG LYS A 145 13.300 3.905 1.474 1.00 85.23 C +ATOM 1137 CD LYS A 145 12.213 4.848 1.972 1.00 85.23 C +ATOM 1138 CE LYS A 145 12.241 4.984 3.488 1.00 85.23 C +ATOM 1139 NZ LYS A 145 11.221 5.960 3.976 1.00 85.23 N +ATOM 1140 N LEU A 146 14.474 3.416 -2.912 1.00 88.82 N +ATOM 1141 CA LEU A 146 14.251 3.207 -4.339 1.00 88.82 C +ATOM 1142 C LEU A 146 14.889 1.902 -4.803 1.00 88.82 C +ATOM 1143 CB LEU A 146 14.813 4.379 -5.147 1.00 88.82 C +ATOM 1144 O LEU A 146 14.234 1.083 -5.452 1.00 88.82 O +ATOM 1145 CG LEU A 146 13.918 5.614 -5.263 1.00 88.82 C +ATOM 1146 CD1 LEU A 146 14.727 6.811 -5.753 1.00 88.82 C +ATOM 1147 CD2 LEU A 146 12.744 5.338 -6.195 1.00 88.82 C +ATOM 1148 N ASN A 147 16.097 1.707 -4.420 1.00 88.82 N +ATOM 1149 CA ASN A 147 16.831 0.521 -4.850 1.00 88.82 C +ATOM 1150 C ASN A 147 16.245 -0.751 -4.245 1.00 88.82 C +ATOM 1151 CB ASN A 147 18.313 0.647 -4.489 1.00 88.82 C +ATOM 1152 O ASN A 147 16.110 -1.765 -4.932 1.00 88.82 O +ATOM 1153 CG ASN A 147 19.078 1.523 -5.461 1.00 88.82 C +ATOM 1154 ND2 ASN A 147 19.478 2.705 -5.006 1.00 88.82 N +ATOM 1155 OD1 ASN A 147 19.307 1.142 -6.612 1.00 88.82 O +ATOM 1156 N LYS A 148 15.800 -0.692 -3.043 1.00 89.11 N +ATOM 1157 CA LYS A 148 15.259 -1.857 -2.348 1.00 89.11 C +ATOM 1158 C LYS A 148 13.918 -2.277 -2.943 1.00 89.11 C +ATOM 1159 CB LYS A 148 15.102 -1.566 -0.855 1.00 89.11 C +ATOM 1160 O LYS A 148 13.678 -3.465 -3.168 1.00 89.11 O +ATOM 1161 CG LYS A 148 16.410 -1.597 -0.078 1.00 89.11 C +ATOM 1162 CD LYS A 148 16.201 -1.217 1.383 1.00 89.11 C +ATOM 1163 CE LYS A 148 17.476 -1.395 2.195 1.00 89.11 C +ATOM 1164 NZ LYS A 148 17.329 -0.859 3.582 1.00 89.11 N +ATOM 1165 N VAL A 149 13.131 -1.323 -3.220 1.00 92.85 N +ATOM 1166 CA VAL A 149 11.810 -1.633 -3.755 1.00 92.85 C +ATOM 1167 C VAL A 149 11.936 -2.106 -5.202 1.00 92.85 C +ATOM 1168 CB VAL A 149 10.864 -0.415 -3.673 1.00 92.85 C +ATOM 1169 O VAL A 149 11.354 -3.124 -5.582 1.00 92.85 O +ATOM 1170 CG1 VAL A 149 9.576 -0.677 -4.452 1.00 92.85 C +ATOM 1171 CG2 VAL A 149 10.551 -0.079 -2.216 1.00 92.85 C +ATOM 1172 N LEU A 150 12.759 -1.449 -6.028 1.00 94.30 N +ATOM 1173 CA LEU A 150 12.833 -1.694 -7.464 1.00 94.30 C +ATOM 1174 C LEU A 150 13.630 -2.960 -7.759 1.00 94.30 C +ATOM 1175 CB LEU A 150 13.467 -0.499 -8.180 1.00 94.30 C +ATOM 1176 O LEU A 150 13.559 -3.500 -8.865 1.00 94.30 O +ATOM 1177 CG LEU A 150 12.644 0.790 -8.209 1.00 94.30 C +ATOM 1178 CD1 LEU A 150 13.438 1.911 -8.871 1.00 94.30 C +ATOM 1179 CD2 LEU A 150 11.321 0.563 -8.933 1.00 94.30 C +ATOM 1180 N ARG A 151 14.349 -3.404 -6.824 1.00 92.34 N +ATOM 1181 CA ARG A 151 15.104 -4.640 -7.001 1.00 92.34 C +ATOM 1182 C ARG A 151 14.182 -5.798 -7.366 1.00 92.34 C +ATOM 1183 CB ARG A 151 15.890 -4.976 -5.732 1.00 92.34 C +ATOM 1184 O ARG A 151 14.593 -6.732 -8.058 1.00 92.34 O +ATOM 1185 CG ARG A 151 16.868 -6.128 -5.900 1.00 92.34 C +ATOM 1186 CD ARG A 151 17.808 -6.249 -4.708 1.00 92.34 C +ATOM 1187 NE ARG A 151 18.796 -7.305 -4.906 1.00 92.34 N +ATOM 1188 NH1 ARG A 151 18.263 -8.450 -2.971 1.00 92.34 N +ATOM 1189 NH2 ARG A 151 19.916 -9.232 -4.353 1.00 92.34 N +ATOM 1190 CZ ARG A 151 18.989 -8.327 -4.076 1.00 92.34 C +ATOM 1191 N GLY A 152 12.954 -5.789 -6.901 1.00 90.25 N +ATOM 1192 CA GLY A 152 11.961 -6.806 -7.208 1.00 90.25 C +ATOM 1193 C GLY A 152 11.657 -6.916 -8.690 1.00 90.25 C +ATOM 1194 O GLY A 152 11.165 -7.947 -9.153 1.00 90.25 O +ATOM 1195 N GLY A 153 11.961 -5.898 -9.412 1.00 89.10 N +ATOM 1196 CA GLY A 153 11.705 -5.869 -10.843 1.00 89.10 C +ATOM 1197 C GLY A 153 12.834 -6.463 -11.664 1.00 89.10 C +ATOM 1198 O GLY A 153 12.723 -6.584 -12.886 1.00 89.10 O +ATOM 1199 N THR A 154 13.863 -6.950 -11.023 1.00 89.26 N +ATOM 1200 CA THR A 154 14.996 -7.550 -11.719 1.00 89.26 C +ATOM 1201 C THR A 154 14.874 -9.071 -11.741 1.00 89.26 C +ATOM 1202 CB THR A 154 16.331 -7.149 -11.063 1.00 89.26 C +ATOM 1203 O THR A 154 14.068 -9.644 -11.005 1.00 89.26 O +ATOM 1204 CG2 THR A 154 16.454 -5.633 -10.948 1.00 89.26 C +ATOM 1205 OG1 THR A 154 16.404 -7.723 -9.752 1.00 89.26 O +ATOM 1206 N LYS A 155 15.432 -9.843 -12.722 1.00 79.67 N +ATOM 1207 CA LYS A 155 15.339 -11.262 -13.051 1.00 79.67 C +ATOM 1208 C LYS A 155 15.623 -12.130 -11.829 1.00 79.67 C +ATOM 1209 CB LYS A 155 16.307 -11.616 -14.181 1.00 79.67 C +ATOM 1210 O LYS A 155 14.919 -13.112 -11.581 1.00 79.67 O +ATOM 1211 CG LYS A 155 16.108 -13.012 -14.753 1.00 79.67 C +ATOM 1212 CD LYS A 155 17.043 -13.274 -15.926 1.00 79.67 C +ATOM 1213 CE LYS A 155 16.896 -14.695 -16.453 1.00 79.67 C +ATOM 1214 NZ LYS A 155 17.815 -14.958 -17.601 1.00 79.67 N +ATOM 1215 N ASN A 156 16.164 -11.677 -10.691 1.00 76.29 N +ATOM 1216 CA ASN A 156 16.442 -12.459 -9.491 1.00 76.29 C +ATOM 1217 C ASN A 156 16.382 -11.597 -8.233 1.00 76.29 C +ATOM 1218 CB ASN A 156 17.807 -13.143 -9.601 1.00 76.29 C +ATOM 1219 O ASN A 156 16.897 -11.986 -7.184 1.00 76.29 O +ATOM 1220 CG ASN A 156 17.858 -14.168 -10.717 1.00 76.29 C +ATOM 1221 ND2 ASN A 156 19.003 -14.263 -11.382 1.00 76.29 N +ATOM 1222 OD1 ASN A 156 16.877 -14.867 -10.980 1.00 76.29 O +ATOM 1223 N GLY A 157 15.597 -10.515 -8.442 1.00 84.42 N +ATOM 1224 CA GLY A 157 15.610 -9.616 -7.299 1.00 84.42 C +ATOM 1225 C GLY A 157 14.345 -9.691 -6.466 1.00 84.42 C +ATOM 1226 O GLY A 157 13.306 -10.150 -6.946 1.00 84.42 O +ATOM 1227 N THR A 158 14.495 -9.472 -5.177 1.00 89.70 N +ATOM 1228 CA THR A 158 13.375 -9.391 -4.247 1.00 89.70 C +ATOM 1229 C THR A 158 13.260 -7.987 -3.659 1.00 89.70 C +ATOM 1230 CB THR A 158 13.519 -10.417 -3.108 1.00 89.70 C +ATOM 1231 O THR A 158 14.270 -7.364 -3.325 1.00 89.70 O +ATOM 1232 CG2 THR A 158 12.284 -10.422 -2.212 1.00 89.70 C +ATOM 1233 OG1 THR A 158 13.695 -11.724 -3.669 1.00 89.70 O +ATOM 1234 N SER A 159 12.010 -7.626 -3.606 1.00 92.09 N +ATOM 1235 CA SER A 159 11.782 -6.288 -3.071 1.00 92.09 C +ATOM 1236 C SER A 159 11.851 -6.282 -1.547 1.00 92.09 C +ATOM 1237 CB SER A 159 10.425 -5.751 -3.530 1.00 92.09 C +ATOM 1238 O SER A 159 11.459 -7.255 -0.899 1.00 92.09 O +ATOM 1239 OG SER A 159 10.405 -5.570 -4.935 1.00 92.09 O +ATOM 1240 N ILE A 160 12.358 -5.206 -1.057 1.00 88.61 N +ATOM 1241 CA ILE A 160 12.343 -4.937 0.376 1.00 88.61 C +ATOM 1242 C ILE A 160 11.560 -3.656 0.653 1.00 88.61 C +ATOM 1243 CB ILE A 160 13.775 -4.824 0.945 1.00 88.61 C +ATOM 1244 O ILE A 160 11.904 -2.588 0.141 1.00 88.61 O +ATOM 1245 CG1 ILE A 160 14.570 -6.101 0.650 1.00 88.61 C +ATOM 1246 CG2 ILE A 160 13.737 -4.538 2.449 1.00 88.61 C +ATOM 1247 CD1 ILE A 160 16.053 -5.997 0.978 1.00 88.61 C +ATOM 1248 N TYR A 161 10.468 -3.814 1.476 1.00 88.46 N +ATOM 1249 CA TYR A 161 9.585 -2.685 1.748 1.00 88.46 C +ATOM 1250 C TYR A 161 9.719 -2.225 3.195 1.00 88.46 C +ATOM 1251 CB TYR A 161 8.129 -3.057 1.452 1.00 88.46 C +ATOM 1252 O TYR A 161 9.790 -3.047 4.111 1.00 88.46 O +ATOM 1253 CG TYR A 161 7.885 -3.460 0.017 1.00 88.46 C +ATOM 1254 CD1 TYR A 161 7.749 -2.500 -0.982 1.00 88.46 C +ATOM 1255 CD2 TYR A 161 7.790 -4.800 -0.340 1.00 88.46 C +ATOM 1256 CE1 TYR A 161 7.522 -2.866 -2.305 1.00 88.46 C +ATOM 1257 CE2 TYR A 161 7.564 -5.178 -1.660 1.00 88.46 C +ATOM 1258 OH TYR A 161 7.208 -4.573 -3.941 1.00 88.46 O +ATOM 1259 CZ TYR A 161 7.432 -4.205 -2.634 1.00 88.46 C +ATOM 1260 N SER A 162 9.734 -0.931 3.292 1.00 80.59 N +ATOM 1261 CA SER A 162 9.728 -0.380 4.644 1.00 80.59 C +ATOM 1262 C SER A 162 8.335 -0.443 5.260 1.00 80.59 C +ATOM 1263 CB SER A 162 10.227 1.066 4.636 1.00 80.59 C +ATOM 1264 O SER A 162 7.334 -0.254 4.565 1.00 80.59 O +ATOM 1265 OG SER A 162 11.560 1.135 4.161 1.00 80.59 O +ATOM 1266 N THR A 163 8.320 -0.760 6.558 1.00 75.89 N +ATOM 1267 CA THR A 163 7.044 -0.785 7.265 1.00 75.89 C +ATOM 1268 C THR A 163 6.627 0.623 7.678 1.00 75.89 C +ATOM 1269 CB THR A 163 7.112 -1.690 8.509 1.00 75.89 C +ATOM 1270 O THR A 163 7.436 1.552 7.639 1.00 75.89 O +ATOM 1271 CG2 THR A 163 7.561 -3.100 8.140 1.00 75.89 C +ATOM 1272 OG1 THR A 163 8.042 -1.134 9.447 1.00 75.89 O +ATOM 1273 N VAL A 164 5.338 0.760 7.987 1.00 68.21 N +ATOM 1274 CA VAL A 164 4.833 2.028 8.502 1.00 68.21 C +ATOM 1275 C VAL A 164 5.386 2.274 9.904 1.00 68.21 C +ATOM 1276 CB VAL A 164 3.288 2.056 8.526 1.00 68.21 C +ATOM 1277 O VAL A 164 5.257 1.423 10.787 1.00 68.21 O +ATOM 1278 CG1 VAL A 164 2.780 3.412 9.012 1.00 68.21 C +ATOM 1279 CG2 VAL A 164 2.727 1.737 7.141 1.00 68.21 C +ATOM 1280 N THR A 165 6.559 2.977 10.070 1.00 60.19 N +ATOM 1281 CA THR A 165 7.174 3.187 11.377 1.00 60.19 C +ATOM 1282 C THR A 165 6.676 4.484 12.007 1.00 60.19 C +ATOM 1283 CB THR A 165 8.710 3.220 11.273 1.00 60.19 C +ATOM 1284 O THR A 165 6.491 5.486 11.313 1.00 60.19 O +ATOM 1285 CG2 THR A 165 9.359 2.742 12.568 1.00 60.19 C +ATOM 1286 OG1 THR A 165 9.129 2.369 10.199 1.00 60.19 O +ATOM 1287 N PRO A 166 6.361 4.494 13.302 1.00 52.12 N +ATOM 1288 CA PRO A 166 6.138 5.786 13.955 1.00 52.12 C +ATOM 1289 C PRO A 166 7.353 6.707 13.870 1.00 52.12 C +ATOM 1290 CB PRO A 166 5.846 5.400 15.408 1.00 52.12 C +ATOM 1291 O PRO A 166 8.487 6.232 13.769 1.00 52.12 O +ATOM 1292 CG PRO A 166 5.693 3.914 15.385 1.00 52.12 C +ATOM 1293 CD PRO A 166 6.286 3.393 14.107 1.00 52.12 C +ATOM 1294 N GLY A 167 7.190 8.012 13.577 1.00 44.90 N +ATOM 1295 CA GLY A 167 8.110 9.119 13.377 1.00 44.90 C +ATOM 1296 C GLY A 167 9.129 9.257 14.493 1.00 44.90 C +ATOM 1297 O GLY A 167 10.251 9.714 14.264 1.00 44.90 O +ATOM 1298 N ASP A 168 8.955 8.660 15.734 1.00 45.37 N +ATOM 1299 CA ASP A 168 9.833 8.918 16.872 1.00 45.37 C +ATOM 1300 C ASP A 168 10.769 7.737 17.121 1.00 45.37 C +ATOM 1301 CB ASP A 168 9.012 9.212 18.129 1.00 45.37 C +ATOM 1302 O ASP A 168 11.639 7.801 17.992 1.00 45.37 O +ATOM 1303 CG ASP A 168 8.003 8.122 18.446 1.00 45.37 C +ATOM 1304 OD1 ASP A 168 7.526 7.442 17.512 1.00 45.37 O +ATOM 1305 OD2 ASP A 168 7.680 7.944 19.640 1.00 45.37 O +ATOM 1306 N LYS A 169 10.775 6.771 16.169 1.00 51.46 N +ATOM 1307 CA LYS A 169 11.587 5.616 16.538 1.00 51.46 C +ATOM 1308 C LYS A 169 12.786 5.466 15.605 1.00 51.46 C +ATOM 1309 CB LYS A 169 10.745 4.339 16.517 1.00 51.46 C +ATOM 1310 O LYS A 169 12.726 5.862 14.439 1.00 51.46 O +ATOM 1311 CG LYS A 169 9.558 4.366 17.468 1.00 51.46 C +ATOM 1312 CD LYS A 169 10.002 4.262 18.921 1.00 51.46 C +ATOM 1313 CE LYS A 169 8.812 4.215 19.869 1.00 51.46 C +ATOM 1314 NZ LYS A 169 9.241 4.240 21.299 1.00 51.46 N +ATOM 1315 N SER A 170 13.942 4.874 16.199 1.00 54.70 N +ATOM 1316 CA SER A 170 15.246 4.772 15.553 1.00 54.70 C +ATOM 1317 C SER A 170 15.335 3.525 14.680 1.00 54.70 C +ATOM 1318 CB SER A 170 16.362 4.752 16.599 1.00 54.70 C +ATOM 1319 O SER A 170 16.166 3.455 13.772 1.00 54.70 O +ATOM 1320 OG SER A 170 16.173 3.687 17.516 1.00 54.70 O +ATOM 1321 N THR A 171 14.302 2.541 14.941 1.00 59.73 N +ATOM 1322 CA THR A 171 14.405 1.283 14.208 1.00 59.73 C +ATOM 1323 C THR A 171 13.339 1.202 13.120 1.00 59.73 C +ATOM 1324 CB THR A 171 14.272 0.074 15.153 1.00 59.73 C +ATOM 1325 O THR A 171 12.166 1.486 13.371 1.00 59.73 O +ATOM 1326 CG2 THR A 171 15.465 -0.020 16.098 1.00 59.73 C +ATOM 1327 OG1 THR A 171 13.073 0.209 15.926 1.00 59.73 O +ATOM 1328 N LEU A 172 13.752 0.918 11.963 1.00 68.65 N +ATOM 1329 CA LEU A 172 12.874 0.747 10.811 1.00 68.65 C +ATOM 1330 C LEU A 172 12.865 -0.705 10.344 1.00 68.65 C +ATOM 1331 CB LEU A 172 13.312 1.661 9.663 1.00 68.65 C +ATOM 1332 O LEU A 172 13.905 -1.244 9.960 1.00 68.65 O +ATOM 1333 CG LEU A 172 12.481 1.586 8.382 1.00 68.65 C +ATOM 1334 CD1 LEU A 172 11.070 2.107 8.633 1.00 68.65 C +ATOM 1335 CD2 LEU A 172 13.154 2.370 7.261 1.00 68.65 C +ATOM 1336 N HIS A 173 11.696 -1.335 10.527 1.00 75.75 N +ATOM 1337 CA HIS A 173 11.561 -2.691 10.006 1.00 75.75 C +ATOM 1338 C HIS A 173 11.349 -2.682 8.496 1.00 75.75 C +ATOM 1339 CB HIS A 173 10.402 -3.416 10.694 1.00 75.75 C +ATOM 1340 O HIS A 173 10.710 -1.774 7.960 1.00 75.75 O +ATOM 1341 CG HIS A 173 10.683 -3.779 12.118 1.00 75.75 C +ATOM 1342 CD2 HIS A 173 11.256 -4.880 12.658 1.00 75.75 C +ATOM 1343 ND1 HIS A 173 10.357 -2.955 13.173 1.00 75.75 N +ATOM 1344 CE1 HIS A 173 10.720 -3.535 14.305 1.00 75.75 C +ATOM 1345 NE2 HIS A 173 11.268 -4.704 14.020 1.00 75.75 N +ATOM 1346 N GLU A 174 11.934 -3.755 7.896 1.00 81.08 N +ATOM 1347 CA GLU A 174 11.784 -3.942 6.456 1.00 81.08 C +ATOM 1348 C GLU A 174 11.304 -5.353 6.129 1.00 81.08 C +ATOM 1349 CB GLU A 174 13.105 -3.655 5.737 1.00 81.08 C +ATOM 1350 O GLU A 174 11.746 -6.323 6.747 1.00 81.08 O +ATOM 1351 CG GLU A 174 13.594 -2.223 5.895 1.00 81.08 C +ATOM 1352 CD GLU A 174 14.950 -1.977 5.253 1.00 81.08 C +ATOM 1353 OE1 GLU A 174 15.240 -0.821 4.872 1.00 81.08 O +ATOM 1354 OE2 GLU A 174 15.727 -2.950 5.129 1.00 81.08 O +ATOM 1355 N ILE A 175 10.355 -5.327 5.202 1.00 85.74 N +ATOM 1356 CA ILE A 175 9.794 -6.618 4.816 1.00 85.74 C +ATOM 1357 C ILE A 175 10.325 -7.021 3.442 1.00 85.74 C +ATOM 1358 CB ILE A 175 8.250 -6.582 4.804 1.00 85.74 C +ATOM 1359 O ILE A 175 10.165 -6.283 2.467 1.00 85.74 O +ATOM 1360 CG1 ILE A 175 7.712 -6.273 6.206 1.00 85.74 C +ATOM 1361 CG2 ILE A 175 7.683 -7.905 4.280 1.00 85.74 C +ATOM 1362 CD1 ILE A 175 6.210 -6.029 6.253 1.00 85.74 C +ATOM 1363 N LYS A 176 10.984 -8.172 3.459 1.00 89.71 N +ATOM 1364 CA LYS A 176 11.416 -8.774 2.201 1.00 89.71 C +ATOM 1365 C LYS A 176 10.364 -9.741 1.665 1.00 89.71 C +ATOM 1366 CB LYS A 176 12.750 -9.499 2.383 1.00 89.71 C +ATOM 1367 O LYS A 176 10.021 -10.723 2.327 1.00 89.71 O +ATOM 1368 CG LYS A 176 13.320 -10.078 1.096 1.00 89.71 C +ATOM 1369 CD LYS A 176 14.647 -10.785 1.341 1.00 89.71 C +ATOM 1370 CE LYS A 176 15.180 -11.432 0.069 1.00 89.71 C +ATOM 1371 NZ LYS A 176 16.483 -12.123 0.303 1.00 89.71 N +ATOM 1372 N ILE A 177 9.887 -9.424 0.509 1.00 92.69 N +ATOM 1373 CA ILE A 177 8.863 -10.266 -0.099 1.00 92.69 C +ATOM 1374 C ILE A 177 9.048 -10.290 -1.615 1.00 92.69 C +ATOM 1375 CB ILE A 177 7.442 -9.777 0.260 1.00 92.69 C +ATOM 1376 O ILE A 177 9.373 -9.267 -2.223 1.00 92.69 O +ATOM 1377 CG1 ILE A 177 6.389 -10.745 -0.290 1.00 92.69 C +ATOM 1378 CG2 ILE A 177 7.210 -8.358 -0.268 1.00 92.69 C +ATOM 1379 CD1 ILE A 177 4.994 -10.531 0.280 1.00 92.69 C +ATOM 1380 N ASP A 178 8.861 -11.476 -2.193 1.00 91.46 N +ATOM 1381 CA ASP A 178 9.036 -11.627 -3.634 1.00 91.46 C +ATOM 1382 C ASP A 178 7.747 -11.294 -4.381 1.00 91.46 C +ATOM 1383 CB ASP A 178 9.489 -13.049 -3.974 1.00 91.46 C +ATOM 1384 O ASP A 178 7.142 -12.167 -5.007 1.00 91.46 O +ATOM 1385 CG ASP A 178 8.688 -14.115 -3.248 1.00 91.46 C +ATOM 1386 OD1 ASP A 178 7.748 -13.769 -2.500 1.00 91.46 O +ATOM 1387 OD2 ASP A 178 9.000 -15.313 -3.425 1.00 91.46 O +ATOM 1388 N HIS A 179 7.306 -10.150 -4.166 1.00 93.46 N +ATOM 1389 CA HIS A 179 6.133 -9.624 -4.855 1.00 93.46 C +ATOM 1390 C HIS A 179 6.369 -8.194 -5.330 1.00 93.46 C +ATOM 1391 CB HIS A 179 4.906 -9.679 -3.943 1.00 93.46 C +ATOM 1392 O HIS A 179 6.624 -7.300 -4.519 1.00 93.46 O +ATOM 1393 CG HIS A 179 3.621 -9.387 -4.649 1.00 93.46 C +ATOM 1394 CD2 HIS A 179 2.670 -10.215 -5.144 1.00 93.46 C +ATOM 1395 ND1 HIS A 179 3.193 -8.105 -4.917 1.00 93.46 N +ATOM 1396 CE1 HIS A 179 2.032 -8.157 -5.548 1.00 93.46 C +ATOM 1397 NE2 HIS A 179 1.693 -9.426 -5.698 1.00 93.46 N +ATOM 1398 N PHE A 180 6.311 -8.065 -6.682 1.00 94.47 N +ATOM 1399 CA PHE A 180 6.535 -6.796 -7.364 1.00 94.47 C +ATOM 1400 C PHE A 180 5.751 -6.737 -8.670 1.00 94.47 C +ATOM 1401 CB PHE A 180 8.028 -6.588 -7.637 1.00 94.47 C +ATOM 1402 O PHE A 180 5.764 -7.691 -9.451 1.00 94.47 O +ATOM 1403 CG PHE A 180 8.345 -5.280 -8.311 1.00 94.47 C +ATOM 1404 CD1 PHE A 180 8.484 -5.209 -9.692 1.00 94.47 C +ATOM 1405 CD2 PHE A 180 8.503 -4.120 -7.563 1.00 94.47 C +ATOM 1406 CE1 PHE A 180 8.777 -4.000 -10.318 1.00 94.47 C +ATOM 1407 CE2 PHE A 180 8.796 -2.909 -8.182 1.00 94.47 C +ATOM 1408 CZ PHE A 180 8.934 -2.851 -9.559 1.00 94.47 C +ATOM 1409 N ILE A 181 5.001 -5.642 -8.787 1.00 93.96 N +ATOM 1410 CA ILE A 181 4.302 -5.460 -10.054 1.00 93.96 C +ATOM 1411 C ILE A 181 5.130 -4.570 -10.978 1.00 93.96 C +ATOM 1412 CB ILE A 181 2.897 -4.854 -9.842 1.00 93.96 C +ATOM 1413 O ILE A 181 5.197 -3.354 -10.781 1.00 93.96 O +ATOM 1414 CG1 ILE A 181 2.075 -5.729 -8.889 1.00 93.96 C +ATOM 1415 CG2 ILE A 181 2.176 -4.678 -11.183 1.00 93.96 C +ATOM 1416 CD1 ILE A 181 0.698 -5.167 -8.564 1.00 93.96 C +ATOM 1417 N PRO A 182 5.702 -5.251 -12.037 1.00 91.33 N +ATOM 1418 CA PRO A 182 6.535 -4.458 -12.944 1.00 91.33 C +ATOM 1419 C PRO A 182 5.721 -3.739 -14.017 1.00 91.33 C +ATOM 1420 CB PRO A 182 7.465 -5.500 -13.571 1.00 91.33 C +ATOM 1421 O PRO A 182 4.541 -4.045 -14.211 1.00 91.33 O +ATOM 1422 CG PRO A 182 6.649 -6.750 -13.637 1.00 91.33 C +ATOM 1423 CD PRO A 182 5.748 -6.796 -12.436 1.00 91.33 C +ATOM 1424 N GLU A 183 6.279 -2.768 -14.635 1.00 88.96 N +ATOM 1425 CA GLU A 183 5.718 -2.077 -15.792 1.00 88.96 C +ATOM 1426 C GLU A 183 4.321 -1.542 -15.491 1.00 88.96 C +ATOM 1427 CB GLU A 183 5.676 -3.008 -17.006 1.00 88.96 C +ATOM 1428 O GLU A 183 3.371 -1.828 -16.223 1.00 88.96 O +ATOM 1429 CG GLU A 183 7.046 -3.484 -17.464 1.00 88.96 C +ATOM 1430 CD GLU A 183 6.989 -4.404 -18.673 1.00 88.96 C +ATOM 1431 OE1 GLU A 183 8.056 -4.867 -19.135 1.00 88.96 O +ATOM 1432 OE2 GLU A 183 5.867 -4.664 -19.163 1.00 88.96 O +ATOM 1433 N THR A 184 4.326 -0.724 -14.458 1.00 93.65 N +ATOM 1434 CA THR A 184 3.050 -0.195 -13.990 1.00 93.65 C +ATOM 1435 C THR A 184 2.461 0.775 -15.011 1.00 93.65 C +ATOM 1436 CB THR A 184 3.203 0.515 -12.632 1.00 93.65 C +ATOM 1437 O THR A 184 1.245 0.973 -15.056 1.00 93.65 O +ATOM 1438 CG2 THR A 184 3.620 -0.467 -11.542 1.00 93.65 C +ATOM 1439 OG1 THR A 184 4.200 1.538 -12.744 1.00 93.65 O +ATOM 1440 N ILE A 185 3.285 1.337 -15.814 1.00 93.28 N +ATOM 1441 CA ILE A 185 2.830 2.181 -16.914 1.00 93.28 C +ATOM 1442 C ILE A 185 2.859 1.388 -18.218 1.00 93.28 C +ATOM 1443 CB ILE A 185 3.692 3.456 -17.042 1.00 93.28 C +ATOM 1444 O ILE A 185 3.895 0.831 -18.590 1.00 93.28 O +ATOM 1445 CG1 ILE A 185 3.548 4.327 -15.788 1.00 93.28 C +ATOM 1446 CG2 ILE A 185 3.311 4.241 -18.301 1.00 93.28 C +ATOM 1447 CD1 ILE A 185 4.478 5.532 -15.761 1.00 93.28 C +ATOM 1448 N SER A 186 1.731 1.340 -18.926 1.00 90.51 N +ATOM 1449 CA SER A 186 1.653 0.621 -20.193 1.00 90.51 C +ATOM 1450 C SER A 186 2.014 1.527 -21.366 1.00 90.51 C +ATOM 1451 CB SER A 186 0.252 0.043 -20.397 1.00 90.51 C +ATOM 1452 O SER A 186 2.678 1.094 -22.310 1.00 90.51 O +ATOM 1453 OG SER A 186 -0.719 1.076 -20.421 1.00 90.51 O +ATOM 1454 N SER A 187 1.538 2.758 -21.316 1.00 89.83 N +ATOM 1455 CA SER A 187 1.807 3.722 -22.378 1.00 89.83 C +ATOM 1456 C SER A 187 1.549 5.150 -21.907 1.00 89.83 C +ATOM 1457 CB SER A 187 0.948 3.420 -23.607 1.00 89.83 C +ATOM 1458 O SER A 187 1.043 5.363 -20.803 1.00 89.83 O +ATOM 1459 OG SER A 187 -0.428 3.587 -23.313 1.00 89.83 O +ATOM 1460 N PHE A 188 2.085 6.183 -22.744 1.00 86.82 N +ATOM 1461 CA PHE A 188 1.808 7.606 -22.584 1.00 86.82 C +ATOM 1462 C PHE A 188 0.878 8.104 -23.684 1.00 86.82 C +ATOM 1463 CB PHE A 188 3.111 8.413 -22.593 1.00 86.82 C +ATOM 1464 O PHE A 188 1.069 7.781 -24.859 1.00 86.82 O +ATOM 1465 CG PHE A 188 3.705 8.621 -21.227 1.00 86.82 C +ATOM 1466 CD1 PHE A 188 3.585 9.846 -20.581 1.00 86.82 C +ATOM 1467 CD2 PHE A 188 4.384 7.592 -20.587 1.00 86.82 C +ATOM 1468 CE1 PHE A 188 4.134 10.041 -19.315 1.00 86.82 C +ATOM 1469 CE2 PHE A 188 4.935 7.780 -19.323 1.00 86.82 C +ATOM 1470 CZ PHE A 188 4.810 9.006 -18.689 1.00 86.82 C +ATOM 1471 N SER A 189 -0.190 8.631 -23.267 1.00 84.11 N +ATOM 1472 CA SER A 189 -1.067 9.254 -24.253 1.00 84.11 C +ATOM 1473 C SER A 189 -1.382 10.698 -23.878 1.00 84.11 C +ATOM 1474 CB SER A 189 -2.366 8.459 -24.394 1.00 84.11 C +ATOM 1475 O SER A 189 -1.929 10.961 -22.805 1.00 84.11 O +ATOM 1476 OG SER A 189 -3.199 9.029 -25.389 1.00 84.11 O +ATOM 1477 N ASN A 190 -0.986 11.675 -24.722 1.00 79.66 N +ATOM 1478 CA ASN A 190 -1.311 13.090 -24.570 1.00 79.66 C +ATOM 1479 C ASN A 190 -0.893 13.617 -23.201 1.00 79.66 C +ATOM 1480 CB ASN A 190 -2.807 13.323 -24.795 1.00 79.66 C +ATOM 1481 O ASN A 190 -1.658 14.325 -22.543 1.00 79.66 O +ATOM 1482 CG ASN A 190 -3.225 13.090 -26.233 1.00 79.66 C +ATOM 1483 ND2 ASN A 190 -4.522 12.915 -26.453 1.00 79.66 N +ATOM 1484 OD1 ASN A 190 -2.388 13.067 -27.140 1.00 79.66 O +ATOM 1485 N GLY A 191 0.276 13.191 -22.718 1.00 79.62 N +ATOM 1486 CA GLY A 191 0.807 13.717 -21.471 1.00 79.62 C +ATOM 1487 C GLY A 191 0.276 12.998 -20.246 1.00 79.62 C +ATOM 1488 O GLY A 191 0.559 13.396 -19.114 1.00 79.62 O +ATOM 1489 N THR A 192 -0.578 12.030 -20.520 1.00 87.20 N +ATOM 1490 CA THR A 192 -1.149 11.261 -19.419 1.00 87.20 C +ATOM 1491 C THR A 192 -0.635 9.825 -19.439 1.00 87.20 C +ATOM 1492 CB THR A 192 -2.688 11.260 -19.477 1.00 87.20 C +ATOM 1493 O THR A 192 -0.569 9.198 -20.498 1.00 87.20 O +ATOM 1494 CG2 THR A 192 -3.282 10.500 -18.296 1.00 87.20 C +ATOM 1495 OG1 THR A 192 -3.162 12.612 -19.448 1.00 87.20 O +ATOM 1496 N MET A 193 -0.297 9.364 -18.231 1.00 91.89 N +ATOM 1497 CA MET A 193 0.181 7.992 -18.095 1.00 91.89 C +ATOM 1498 C MET A 193 -0.982 7.006 -18.110 1.00 91.89 C +ATOM 1499 CB MET A 193 0.988 7.828 -16.805 1.00 91.89 C +ATOM 1500 O MET A 193 -1.990 7.218 -17.433 1.00 91.89 O +ATOM 1501 CG MET A 193 2.257 8.663 -16.766 1.00 91.89 C +ATOM 1502 SD MET A 193 3.014 8.714 -15.095 1.00 91.89 S +ATOM 1503 CE MET A 193 2.029 10.036 -14.338 1.00 91.89 C +ATOM 1504 N ILE A 194 -0.789 5.997 -18.988 1.00 93.88 N +ATOM 1505 CA ILE A 194 -1.758 4.907 -18.992 1.00 93.88 C +ATOM 1506 C ILE A 194 -1.201 3.718 -18.212 1.00 93.88 C +ATOM 1507 CB ILE A 194 -2.123 4.480 -20.431 1.00 93.88 C +ATOM 1508 O ILE A 194 -0.146 3.180 -18.557 1.00 93.88 O +ATOM 1509 CG1 ILE A 194 -2.570 5.695 -21.252 1.00 93.88 C +ATOM 1510 CG2 ILE A 194 -3.209 3.400 -20.416 1.00 93.88 C +ATOM 1511 CD1 ILE A 194 -3.826 6.373 -20.721 1.00 93.88 C +ATOM 1512 N PHE A 195 -1.964 3.320 -17.124 1.00 94.77 N +ATOM 1513 CA PHE A 195 -1.474 2.276 -16.233 1.00 94.77 C +ATOM 1514 C PHE A 195 -1.919 0.900 -16.714 1.00 94.77 C +ATOM 1515 CB PHE A 195 -1.964 2.516 -14.801 1.00 94.77 C +ATOM 1516 O PHE A 195 -2.965 0.769 -17.354 1.00 94.77 O +ATOM 1517 CG PHE A 195 -1.463 3.799 -14.195 1.00 94.77 C +ATOM 1518 CD1 PHE A 195 -0.165 3.895 -13.709 1.00 94.77 C +ATOM 1519 CD2 PHE A 195 -2.292 4.911 -14.112 1.00 94.77 C +ATOM 1520 CE1 PHE A 195 0.301 5.082 -13.148 1.00 94.77 C +ATOM 1521 CE2 PHE A 195 -1.833 6.100 -13.552 1.00 94.77 C +ATOM 1522 CZ PHE A 195 -0.537 6.183 -13.070 1.00 94.77 C +ATOM 1523 N ASN A 196 -1.096 -0.047 -16.412 1.00 93.71 N +ATOM 1524 CA ASN A 196 -1.496 -1.407 -16.759 1.00 93.71 C +ATOM 1525 C ASN A 196 -2.654 -1.889 -15.890 1.00 93.71 C +ATOM 1526 CB ASN A 196 -0.307 -2.363 -16.639 1.00 93.71 C +ATOM 1527 O ASN A 196 -2.887 -1.353 -14.805 1.00 93.71 O +ATOM 1528 CG ASN A 196 0.069 -2.649 -15.199 1.00 93.71 C +ATOM 1529 ND2 ASN A 196 1.294 -3.116 -14.987 1.00 93.71 N +ATOM 1530 OD1 ASN A 196 -0.735 -2.453 -14.283 1.00 93.71 O +ATOM 1531 N ASP A 197 -3.348 -2.880 -16.334 1.00 91.79 N +ATOM 1532 CA ASP A 197 -4.611 -3.320 -15.751 1.00 91.79 C +ATOM 1533 C ASP A 197 -4.392 -3.954 -14.380 1.00 91.79 C +ATOM 1534 CB ASP A 197 -5.316 -4.310 -16.681 1.00 91.79 C +ATOM 1535 O ASP A 197 -5.211 -3.786 -13.474 1.00 91.79 O +ATOM 1536 CG ASP A 197 -5.944 -3.641 -17.892 1.00 91.79 C +ATOM 1537 OD1 ASP A 197 -6.100 -2.401 -17.892 1.00 91.79 O +ATOM 1538 OD2 ASP A 197 -6.288 -4.362 -18.854 1.00 91.79 O +ATOM 1539 N LYS A 198 -3.295 -4.581 -14.291 1.00 92.22 N +ATOM 1540 CA LYS A 198 -3.010 -5.278 -13.041 1.00 92.22 C +ATOM 1541 C LYS A 198 -2.942 -4.303 -11.870 1.00 92.22 C +ATOM 1542 CB LYS A 198 -1.699 -6.059 -13.149 1.00 92.22 C +ATOM 1543 O LYS A 198 -3.519 -4.556 -10.810 1.00 92.22 O +ATOM 1544 CG LYS A 198 -1.426 -6.978 -11.968 1.00 92.22 C +ATOM 1545 CD LYS A 198 -0.183 -7.828 -12.196 1.00 92.22 C +ATOM 1546 CE LYS A 198 0.096 -8.742 -11.010 1.00 92.22 C +ATOM 1547 NZ LYS A 198 1.295 -9.601 -11.243 1.00 92.22 N +ATOM 1548 N ILE A 199 -2.253 -3.174 -12.082 1.00 93.88 N +ATOM 1549 CA ILE A 199 -2.062 -2.195 -11.017 1.00 93.88 C +ATOM 1550 C ILE A 199 -3.376 -1.468 -10.742 1.00 93.88 C +ATOM 1551 CB ILE A 199 -0.952 -1.181 -11.374 1.00 93.88 C +ATOM 1552 O ILE A 199 -3.747 -1.259 -9.585 1.00 93.88 O +ATOM 1553 CG1 ILE A 199 -0.544 -0.377 -10.134 1.00 93.88 C +ATOM 1554 CG2 ILE A 199 -1.413 -0.251 -12.501 1.00 93.88 C +ATOM 1555 CD1 ILE A 199 0.053 -1.223 -9.017 1.00 93.88 C +ATOM 1556 N VAL A 200 -4.043 -1.156 -11.775 1.00 93.47 N +ATOM 1557 CA VAL A 200 -5.315 -0.458 -11.621 1.00 93.47 C +ATOM 1558 C VAL A 200 -6.310 -1.353 -10.885 1.00 93.47 C +ATOM 1559 CB VAL A 200 -5.895 -0.027 -12.986 1.00 93.47 C +ATOM 1560 O VAL A 200 -7.002 -0.901 -9.970 1.00 93.47 O +ATOM 1561 CG1 VAL A 200 -7.307 0.534 -12.820 1.00 93.47 C +ATOM 1562 CG2 VAL A 200 -4.983 1.002 -13.652 1.00 93.47 C +ATOM 1563 N ASN A 201 -6.312 -2.595 -11.227 1.00 92.45 N +ATOM 1564 CA ASN A 201 -7.211 -3.543 -10.576 1.00 92.45 C +ATOM 1565 C ASN A 201 -6.852 -3.737 -9.106 1.00 92.45 C +ATOM 1566 CB ASN A 201 -7.196 -4.887 -11.308 1.00 92.45 C +ATOM 1567 O ASN A 201 -7.737 -3.868 -8.259 1.00 92.45 O +ATOM 1568 CG ASN A 201 -7.938 -4.840 -12.629 1.00 92.45 C +ATOM 1569 ND2 ASN A 201 -7.647 -5.794 -13.507 1.00 92.45 N +ATOM 1570 OD1 ASN A 201 -8.765 -3.954 -12.860 1.00 92.45 O +ATOM 1571 N ALA A 202 -5.585 -3.724 -8.865 1.00 92.89 N +ATOM 1572 CA ALA A 202 -5.136 -3.862 -7.482 1.00 92.89 C +ATOM 1573 C ALA A 202 -5.684 -2.733 -6.613 1.00 92.89 C +ATOM 1574 CB ALA A 202 -3.611 -3.886 -7.418 1.00 92.89 C +ATOM 1575 O ALA A 202 -6.253 -2.982 -5.548 1.00 92.89 O +ATOM 1576 N PHE A 203 -5.602 -1.548 -7.076 1.00 93.06 N +ATOM 1577 CA PHE A 203 -6.062 -0.395 -6.312 1.00 93.06 C +ATOM 1578 C PHE A 203 -7.584 -0.326 -6.299 1.00 93.06 C +ATOM 1579 CB PHE A 203 -5.482 0.900 -6.889 1.00 93.06 C +ATOM 1580 O PHE A 203 -8.186 0.057 -5.293 1.00 93.06 O +ATOM 1581 CG PHE A 203 -4.053 1.154 -6.494 1.00 93.06 C +ATOM 1582 CD1 PHE A 203 -3.749 1.749 -5.275 1.00 93.06 C +ATOM 1583 CD2 PHE A 203 -3.012 0.798 -7.341 1.00 93.06 C +ATOM 1584 CE1 PHE A 203 -2.427 1.986 -4.907 1.00 93.06 C +ATOM 1585 CE2 PHE A 203 -1.688 1.032 -6.980 1.00 93.06 C +ATOM 1586 CZ PHE A 203 -1.398 1.626 -5.763 1.00 93.06 C +ATOM 1587 N THR A 204 -8.129 -0.740 -7.401 1.00 91.99 N +ATOM 1588 CA THR A 204 -9.586 -0.790 -7.458 1.00 91.99 C +ATOM 1589 C THR A 204 -10.132 -1.798 -6.450 1.00 91.99 C +ATOM 1590 CB THR A 204 -10.078 -1.154 -8.871 1.00 91.99 C +ATOM 1591 O THR A 204 -11.058 -1.490 -5.697 1.00 91.99 O +ATOM 1592 CG2 THR A 204 -11.599 -1.255 -8.915 1.00 91.99 C +ATOM 1593 OG1 THR A 204 -9.650 -0.146 -9.794 1.00 91.99 O +ATOM 1594 N ASP A 205 -9.557 -2.944 -6.435 1.00 91.63 N +ATOM 1595 CA ASP A 205 -9.994 -3.983 -5.508 1.00 91.63 C +ATOM 1596 C ASP A 205 -9.840 -3.527 -4.059 1.00 91.63 C +ATOM 1597 CB ASP A 205 -9.208 -5.275 -5.739 1.00 91.63 C +ATOM 1598 O ASP A 205 -10.696 -3.810 -3.218 1.00 91.63 O +ATOM 1599 CG ASP A 205 -9.608 -5.992 -7.016 1.00 91.63 C +ATOM 1600 OD1 ASP A 205 -10.647 -5.639 -7.615 1.00 91.63 O +ATOM 1601 OD2 ASP A 205 -8.880 -6.922 -7.426 1.00 91.63 O +ATOM 1602 N HIS A 206 -8.768 -2.878 -3.849 1.00 92.12 N +ATOM 1603 CA HIS A 206 -8.568 -2.346 -2.506 1.00 92.12 C +ATOM 1604 C HIS A 206 -9.675 -1.368 -2.129 1.00 92.12 C +ATOM 1605 CB HIS A 206 -7.204 -1.662 -2.399 1.00 92.12 C +ATOM 1606 O HIS A 206 -10.255 -1.467 -1.046 1.00 92.12 O +ATOM 1607 CG HIS A 206 -7.025 -0.875 -1.140 1.00 92.12 C +ATOM 1608 CD2 HIS A 206 -6.896 0.458 -0.935 1.00 92.12 C +ATOM 1609 ND1 HIS A 206 -6.957 -1.465 0.104 1.00 92.12 N +ATOM 1610 CE1 HIS A 206 -6.796 -0.526 1.022 1.00 92.12 C +ATOM 1611 NE2 HIS A 206 -6.756 0.649 0.418 1.00 92.12 N +ATOM 1612 N PHE A 207 -9.946 -0.487 -3.005 1.00 91.46 N +ATOM 1613 CA PHE A 207 -10.949 0.523 -2.693 1.00 91.46 C +ATOM 1614 C PHE A 207 -12.332 -0.106 -2.572 1.00 91.46 C +ATOM 1615 CB PHE A 207 -10.963 1.618 -3.765 1.00 91.46 C +ATOM 1616 O PHE A 207 -13.140 0.314 -1.742 1.00 91.46 O +ATOM 1617 CG PHE A 207 -11.824 2.801 -3.414 1.00 91.46 C +ATOM 1618 CD1 PHE A 207 -12.917 3.141 -4.201 1.00 91.46 C +ATOM 1619 CD2 PHE A 207 -11.540 3.574 -2.295 1.00 91.46 C +ATOM 1620 CE1 PHE A 207 -13.717 4.235 -3.878 1.00 91.46 C +ATOM 1621 CE2 PHE A 207 -12.334 4.669 -1.966 1.00 91.46 C +ATOM 1622 CZ PHE A 207 -13.421 4.998 -2.760 1.00 91.46 C +ATOM 1623 N VAL A 208 -12.592 -1.028 -3.409 1.00 90.51 N +ATOM 1624 CA VAL A 208 -13.855 -1.752 -3.311 1.00 90.51 C +ATOM 1625 C VAL A 208 -13.986 -2.376 -1.923 1.00 90.51 C +ATOM 1626 CB VAL A 208 -13.971 -2.842 -4.399 1.00 90.51 C +ATOM 1627 O VAL A 208 -15.067 -2.364 -1.330 1.00 90.51 O +ATOM 1628 CG1 VAL A 208 -15.136 -3.783 -4.099 1.00 90.51 C +ATOM 1629 CG2 VAL A 208 -14.135 -2.204 -5.777 1.00 90.51 C +ATOM 1630 N SER A 209 -12.921 -2.896 -1.431 1.00 89.95 N +ATOM 1631 CA SER A 209 -12.931 -3.431 -0.074 1.00 89.95 C +ATOM 1632 C SER A 209 -13.288 -2.353 0.944 1.00 89.95 C +ATOM 1633 CB SER A 209 -11.572 -4.041 0.273 1.00 89.95 C +ATOM 1634 O SER A 209 -13.998 -2.619 1.916 1.00 89.95 O +ATOM 1635 OG SER A 209 -11.321 -5.191 -0.516 1.00 89.95 O +ATOM 1636 N GLU A 210 -12.867 -1.178 0.676 1.00 89.52 N +ATOM 1637 CA GLU A 210 -13.182 -0.069 1.573 1.00 89.52 C +ATOM 1638 C GLU A 210 -14.658 0.310 1.484 1.00 89.52 C +ATOM 1639 CB GLU A 210 -12.307 1.146 1.254 1.00 89.52 C +ATOM 1640 O GLU A 210 -15.296 0.585 2.503 1.00 89.52 O +ATOM 1641 CG GLU A 210 -10.833 0.943 1.576 1.00 89.52 C +ATOM 1642 CD GLU A 210 -10.055 2.246 1.669 1.00 89.52 C +ATOM 1643 OE1 GLU A 210 -8.824 2.202 1.894 1.00 89.52 O +ATOM 1644 OE2 GLU A 210 -10.681 3.318 1.517 1.00 89.52 O +ATOM 1645 N VAL A 211 -15.137 0.266 0.297 1.00 89.46 N +ATOM 1646 CA VAL A 211 -16.553 0.553 0.096 1.00 89.46 C +ATOM 1647 C VAL A 211 -17.400 -0.510 0.791 1.00 89.46 C +ATOM 1648 CB VAL A 211 -16.911 0.621 -1.406 1.00 89.46 C +ATOM 1649 O VAL A 211 -18.390 -0.189 1.453 1.00 89.46 O +ATOM 1650 CG1 VAL A 211 -18.423 0.729 -1.597 1.00 89.46 C +ATOM 1651 CG2 VAL A 211 -16.200 1.799 -2.071 1.00 89.46 C +ATOM 1652 N ASN A 212 -17.017 -1.708 0.634 1.00 88.91 N +ATOM 1653 CA ASN A 212 -17.730 -2.790 1.304 1.00 88.91 C +ATOM 1654 C ASN A 212 -17.710 -2.620 2.820 1.00 88.91 C +ATOM 1655 CB ASN A 212 -17.138 -4.146 0.914 1.00 88.91 C +ATOM 1656 O ASN A 212 -18.710 -2.884 3.492 1.00 88.91 O +ATOM 1657 CG ASN A 212 -17.500 -4.557 -0.500 1.00 88.91 C +ATOM 1658 ND2 ASN A 212 -16.678 -5.411 -1.098 1.00 88.91 N +ATOM 1659 OD1 ASN A 212 -18.510 -4.109 -1.050 1.00 88.91 O +ATOM 1660 N ARG A 213 -16.582 -2.179 3.267 1.00 89.50 N +ATOM 1661 CA ARG A 213 -16.511 -1.878 4.693 1.00 89.50 C +ATOM 1662 C ARG A 213 -17.529 -0.811 5.079 1.00 89.50 C +ATOM 1663 CB ARG A 213 -15.102 -1.421 5.076 1.00 89.50 C +ATOM 1664 O ARG A 213 -18.207 -0.933 6.102 1.00 89.50 O +ATOM 1665 CG ARG A 213 -14.956 -1.036 6.540 1.00 89.50 C +ATOM 1666 CD ARG A 213 -13.770 -0.109 6.764 1.00 89.50 C +ATOM 1667 NE ARG A 213 -13.939 1.162 6.066 1.00 89.50 N +ATOM 1668 NH1 ARG A 213 -11.757 1.278 5.316 1.00 89.50 N +ATOM 1669 NH2 ARG A 213 -13.243 2.944 4.795 1.00 89.50 N +ATOM 1670 CZ ARG A 213 -12.979 1.791 5.394 1.00 89.50 C +ATOM 1671 N MET A 214 -17.587 0.204 4.323 1.00 90.68 N +ATOM 1672 CA MET A 214 -18.528 1.293 4.573 1.00 90.68 C +ATOM 1673 C MET A 214 -19.964 0.780 4.582 1.00 90.68 C +ATOM 1674 CB MET A 214 -18.371 2.392 3.521 1.00 90.68 C +ATOM 1675 O MET A 214 -20.755 1.152 5.450 1.00 90.68 O +ATOM 1676 CG MET A 214 -17.032 3.109 3.578 1.00 90.68 C +ATOM 1677 SD MET A 214 -16.793 4.264 2.172 1.00 90.68 S +ATOM 1678 CE MET A 214 -15.019 4.607 2.339 1.00 90.68 C +ATOM 1679 N LYS A 215 -20.216 -0.043 3.642 1.00 91.37 N +ATOM 1680 CA LYS A 215 -21.552 -0.622 3.540 1.00 91.37 C +ATOM 1681 C LYS A 215 -21.883 -1.462 4.770 1.00 91.37 C +ATOM 1682 CB LYS A 215 -21.672 -1.475 2.276 1.00 91.37 C +ATOM 1683 O LYS A 215 -22.982 -1.361 5.320 1.00 91.37 O +ATOM 1684 CG LYS A 215 -21.627 -0.674 0.983 1.00 91.37 C +ATOM 1685 CD LYS A 215 -21.775 -1.574 -0.238 1.00 91.37 C +ATOM 1686 CE LYS A 215 -21.935 -0.762 -1.516 1.00 91.37 C +ATOM 1687 NZ LYS A 215 -22.120 -1.640 -2.710 1.00 91.37 N +ATOM 1688 N GLU A 216 -20.914 -2.265 5.192 1.00 90.29 N +ATOM 1689 CA GLU A 216 -21.103 -3.101 6.374 1.00 90.29 C +ATOM 1690 C GLU A 216 -21.339 -2.251 7.619 1.00 90.29 C +ATOM 1691 CB GLU A 216 -19.894 -4.016 6.584 1.00 90.29 C +ATOM 1692 O GLU A 216 -22.230 -2.546 8.419 1.00 90.29 O +ATOM 1693 CG GLU A 216 -19.796 -5.147 5.570 1.00 90.29 C +ATOM 1694 CD GLU A 216 -18.548 -5.999 5.740 1.00 90.29 C +ATOM 1695 OE1 GLU A 216 -18.312 -6.903 4.907 1.00 90.29 O +ATOM 1696 OE2 GLU A 216 -17.801 -5.761 6.716 1.00 90.29 O +ATOM 1697 N ALA A 217 -20.587 -1.216 7.697 1.00 91.08 N +ATOM 1698 CA ALA A 217 -20.703 -0.327 8.850 1.00 91.08 C +ATOM 1699 C ALA A 217 -22.058 0.373 8.870 1.00 91.08 C +ATOM 1700 CB ALA A 217 -19.575 0.702 8.844 1.00 91.08 C +ATOM 1701 O ALA A 217 -22.663 0.540 9.931 1.00 91.08 O +ATOM 1702 N TYR A 218 -22.469 0.733 7.692 1.00 92.63 N +ATOM 1703 CA TYR A 218 -23.770 1.385 7.593 1.00 92.63 C +ATOM 1704 C TYR A 218 -24.888 0.437 8.007 1.00 92.63 C +ATOM 1705 CB TYR A 218 -24.013 1.887 6.166 1.00 92.63 C +ATOM 1706 O TYR A 218 -25.810 0.830 8.726 1.00 92.63 O +ATOM 1707 CG TYR A 218 -25.234 2.764 6.031 1.00 92.63 C +ATOM 1708 CD1 TYR A 218 -26.444 2.242 5.580 1.00 92.63 C +ATOM 1709 CD2 TYR A 218 -25.180 4.116 6.353 1.00 92.63 C +ATOM 1710 CE1 TYR A 218 -27.571 3.046 5.452 1.00 92.63 C +ATOM 1711 CE2 TYR A 218 -26.301 4.930 6.228 1.00 92.63 C +ATOM 1712 OH TYR A 218 -28.603 5.188 5.653 1.00 92.63 O +ATOM 1713 CZ TYR A 218 -27.490 4.387 5.778 1.00 92.63 C +ATOM 1714 N GLN A 219 -24.798 -0.755 7.634 1.00 91.49 N +ATOM 1715 CA GLN A 219 -25.773 -1.769 8.020 1.00 91.49 C +ATOM 1716 C GLN A 219 -25.757 -2.002 9.528 1.00 91.49 C +ATOM 1717 CB GLN A 219 -25.504 -3.082 7.283 1.00 91.49 C +ATOM 1718 O GLN A 219 -26.807 -2.197 10.143 1.00 91.49 O +ATOM 1719 CG GLN A 219 -25.785 -3.017 5.787 1.00 91.49 C +ATOM 1720 CD GLN A 219 -25.405 -4.294 5.062 1.00 91.49 C +ATOM 1721 NE2 GLN A 219 -25.655 -4.333 3.758 1.00 91.49 N +ATOM 1722 OE1 GLN A 219 -24.890 -5.238 5.669 1.00 91.49 O +ATOM 1723 N GLU A 220 -24.605 -1.952 10.048 1.00 92.36 N +ATOM 1724 CA GLU A 220 -24.459 -2.118 11.491 1.00 92.36 C +ATOM 1725 C GLU A 220 -25.167 -1.000 12.249 1.00 92.36 C +ATOM 1726 CB GLU A 220 -22.979 -2.163 11.880 1.00 92.36 C +ATOM 1727 O GLU A 220 -25.740 -1.232 13.316 1.00 92.36 O +ATOM 1728 CG GLU A 220 -22.269 -3.440 11.454 1.00 92.36 C +ATOM 1729 CD GLU A 220 -20.762 -3.383 11.648 1.00 92.36 C +ATOM 1730 OE1 GLU A 220 -20.074 -4.388 11.360 1.00 92.36 O +ATOM 1731 OE2 GLU A 220 -20.266 -2.324 12.093 1.00 92.36 O +ATOM 1732 N LEU A 221 -25.129 0.182 11.689 1.00 91.09 N +ATOM 1733 CA LEU A 221 -25.806 1.304 12.328 1.00 91.09 C +ATOM 1734 C LEU A 221 -27.309 1.057 12.409 1.00 91.09 C +ATOM 1735 CB LEU A 221 -25.531 2.602 11.565 1.00 91.09 C +ATOM 1736 O LEU A 221 -27.966 1.507 13.351 1.00 91.09 O +ATOM 1737 CG LEU A 221 -24.137 3.208 11.737 1.00 91.09 C +ATOM 1738 CD1 LEU A 221 -23.991 4.455 10.872 1.00 91.09 C +ATOM 1739 CD2 LEU A 221 -23.873 3.533 13.203 1.00 91.09 C +ATOM 1740 N GLU A 222 -27.775 0.242 11.454 1.00 87.72 N +ATOM 1741 CA GLU A 222 -29.211 -0.013 11.390 1.00 87.72 C +ATOM 1742 C GLU A 222 -29.615 -1.138 12.338 1.00 87.72 C +ATOM 1743 CB GLU A 222 -29.633 -0.356 9.958 1.00 87.72 C +ATOM 1744 O GLU A 222 -30.740 -1.159 12.842 1.00 87.72 O +ATOM 1745 CG GLU A 222 -29.506 0.808 8.985 1.00 87.72 C +ATOM 1746 CD GLU A 222 -30.007 0.478 7.588 1.00 87.72 C +ATOM 1747 OE1 GLU A 222 -30.346 1.414 6.828 1.00 87.72 O +ATOM 1748 OE2 GLU A 222 -30.062 -0.726 7.250 1.00 87.72 O +ATOM 1749 N THR A 223 -28.643 -1.960 12.686 1.00 89.63 N +ATOM 1750 CA THR A 223 -28.997 -3.198 13.371 1.00 89.63 C +ATOM 1751 C THR A 223 -28.398 -3.230 14.774 1.00 89.63 C +ATOM 1752 CB THR A 223 -28.521 -4.430 12.579 1.00 89.63 C +ATOM 1753 O THR A 223 -28.961 -3.846 15.681 1.00 89.63 O +ATOM 1754 CG2 THR A 223 -29.245 -4.536 11.240 1.00 89.63 C +ATOM 1755 OG1 THR A 223 -27.112 -4.323 12.340 1.00 89.63 O +ATOM 1756 N LEU A 224 -27.286 -2.544 14.977 1.00 90.15 N +ATOM 1757 CA LEU A 224 -26.565 -2.613 16.243 1.00 90.15 C +ATOM 1758 C LEU A 224 -27.154 -1.639 17.258 1.00 90.15 C +ATOM 1759 CB LEU A 224 -25.079 -2.312 16.032 1.00 90.15 C +ATOM 1760 O LEU A 224 -27.404 -0.475 16.934 1.00 90.15 O +ATOM 1761 CG LEU A 224 -24.232 -3.449 15.458 1.00 90.15 C +ATOM 1762 CD1 LEU A 224 -22.825 -2.953 15.142 1.00 90.15 C +ATOM 1763 CD2 LEU A 224 -24.185 -4.623 16.429 1.00 90.15 C +ATOM 1764 N PRO A 225 -27.373 -2.191 18.524 1.00 90.33 N +ATOM 1765 CA PRO A 225 -27.755 -1.231 19.563 1.00 90.33 C +ATOM 1766 C PRO A 225 -26.691 -0.161 19.798 1.00 90.33 C +ATOM 1767 CB PRO A 225 -27.933 -2.107 20.805 1.00 90.33 C +ATOM 1768 O PRO A 225 -25.505 -0.403 19.562 1.00 90.33 O +ATOM 1769 CG PRO A 225 -27.178 -3.361 20.499 1.00 90.33 C +ATOM 1770 CD PRO A 225 -27.024 -3.473 19.010 1.00 90.33 C +ATOM 1771 N GLU A 226 -27.138 1.034 20.214 1.00 88.46 N +ATOM 1772 CA GLU A 226 -26.244 2.167 20.433 1.00 88.46 C +ATOM 1773 C GLU A 226 -25.093 1.791 21.362 1.00 88.46 C +ATOM 1774 CB GLU A 226 -27.016 3.358 21.007 1.00 88.46 C +ATOM 1775 O GLU A 226 -23.957 2.222 21.157 1.00 88.46 O +ATOM 1776 CG GLU A 226 -26.211 4.649 21.049 1.00 88.46 C +ATOM 1777 CD GLU A 226 -27.028 5.851 21.496 1.00 88.46 C +ATOM 1778 OE1 GLU A 226 -26.440 6.931 21.732 1.00 88.46 O +ATOM 1779 OE2 GLU A 226 -28.266 5.711 21.613 1.00 88.46 O +ATOM 1780 N SER A 227 -25.311 0.872 22.348 1.00 88.61 N +ATOM 1781 CA SER A 227 -24.335 0.475 23.357 1.00 88.61 C +ATOM 1782 C SER A 227 -23.216 -0.361 22.745 1.00 88.61 C +ATOM 1783 CB SER A 227 -25.013 -0.310 24.480 1.00 88.61 C +ATOM 1784 O SER A 227 -22.130 -0.469 23.318 1.00 88.61 O +ATOM 1785 OG SER A 227 -25.622 -1.486 23.976 1.00 88.61 O +ATOM 1786 N LYS A 228 -23.495 -0.906 21.537 1.00 89.85 N +ATOM 1787 CA LYS A 228 -22.507 -1.785 20.919 1.00 89.85 C +ATOM 1788 C LYS A 228 -21.793 -1.084 19.766 1.00 89.85 C +ATOM 1789 CB LYS A 228 -23.169 -3.070 20.421 1.00 89.85 C +ATOM 1790 O LYS A 228 -20.953 -1.685 19.092 1.00 89.85 O +ATOM 1791 CG LYS A 228 -23.681 -3.974 21.533 1.00 89.85 C +ATOM 1792 CD LYS A 228 -24.032 -5.361 21.010 1.00 89.85 C +ATOM 1793 CE LYS A 228 -24.461 -6.292 22.135 1.00 89.85 C +ATOM 1794 NZ LYS A 228 -24.901 -7.622 21.617 1.00 89.85 N +ATOM 1795 N ARG A 229 -22.170 0.120 19.522 1.00 89.19 N +ATOM 1796 CA ARG A 229 -21.487 0.897 18.492 1.00 89.19 C +ATOM 1797 C ARG A 229 -20.099 1.323 18.957 1.00 89.19 C +ATOM 1798 CB ARG A 229 -22.312 2.127 18.110 1.00 89.19 C +ATOM 1799 O ARG A 229 -19.919 1.714 20.112 1.00 89.19 O +ATOM 1800 CG ARG A 229 -23.648 1.797 17.463 1.00 89.19 C +ATOM 1801 CD ARG A 229 -24.468 3.050 17.189 1.00 89.19 C +ATOM 1802 NE ARG A 229 -25.793 2.725 16.671 1.00 89.19 N +ATOM 1803 NH1 ARG A 229 -26.558 4.905 16.679 1.00 89.19 N +ATOM 1804 NH2 ARG A 229 -27.926 3.208 15.969 1.00 89.19 N +ATOM 1805 CZ ARG A 229 -26.756 3.613 16.441 1.00 89.19 C +ATOM 1806 N VAL A 230 -19.163 1.218 18.038 1.00 87.09 N +ATOM 1807 CA VAL A 230 -17.762 1.465 18.363 1.00 87.09 C +ATOM 1808 C VAL A 230 -17.429 2.937 18.132 1.00 87.09 C +ATOM 1809 CB VAL A 230 -16.820 0.568 17.529 1.00 87.09 C +ATOM 1810 O VAL A 230 -17.629 3.460 17.034 1.00 87.09 O +ATOM 1811 CG1 VAL A 230 -15.360 0.827 17.899 1.00 87.09 C +ATOM 1812 CG2 VAL A 230 -17.172 -0.905 17.727 1.00 87.09 C +ATOM 1813 N VAL A 231 -16.942 3.585 19.204 1.00 87.74 N +ATOM 1814 CA VAL A 231 -16.576 4.996 19.142 1.00 87.74 C +ATOM 1815 C VAL A 231 -15.463 5.196 18.115 1.00 87.74 C +ATOM 1816 CB VAL A 231 -16.130 5.528 20.522 1.00 87.74 C +ATOM 1817 O VAL A 231 -14.521 4.403 18.049 1.00 87.74 O +ATOM 1818 CG1 VAL A 231 -15.615 6.962 20.407 1.00 87.74 C +ATOM 1819 CG2 VAL A 231 -17.282 5.449 21.521 1.00 87.74 C +ATOM 1820 N HIS A 232 -15.578 6.164 17.240 1.00 86.61 N +ATOM 1821 CA HIS A 232 -14.672 6.592 16.180 1.00 86.61 C +ATOM 1822 C HIS A 232 -14.872 5.763 14.916 1.00 86.61 C +ATOM 1823 CB HIS A 232 -13.219 6.496 16.647 1.00 86.61 C +ATOM 1824 O HIS A 232 -14.649 6.252 13.806 1.00 86.61 O +ATOM 1825 CG HIS A 232 -12.874 7.458 17.739 1.00 86.61 C +ATOM 1826 CD2 HIS A 232 -12.377 7.251 18.981 1.00 86.61 C +ATOM 1827 ND1 HIS A 232 -13.037 8.820 17.610 1.00 86.61 N +ATOM 1828 CE1 HIS A 232 -12.654 9.411 18.729 1.00 86.61 C +ATOM 1829 NE2 HIS A 232 -12.249 8.482 19.577 1.00 86.61 N +ATOM 1830 N TYR A 233 -15.260 4.533 15.105 1.00 89.98 N +ATOM 1831 CA TYR A 233 -15.521 3.687 13.946 1.00 89.98 C +ATOM 1832 C TYR A 233 -16.908 3.957 13.375 1.00 89.98 C +ATOM 1833 CB TYR A 233 -15.389 2.208 14.320 1.00 89.98 C +ATOM 1834 O TYR A 233 -17.040 4.377 12.223 1.00 89.98 O +ATOM 1835 CG TYR A 233 -15.565 1.268 13.152 1.00 89.98 C +ATOM 1836 CD1 TYR A 233 -16.731 0.519 13.005 1.00 89.98 C +ATOM 1837 CD2 TYR A 233 -14.568 1.127 12.193 1.00 89.98 C +ATOM 1838 CE1 TYR A 233 -16.897 -0.349 11.931 1.00 89.98 C +ATOM 1839 CE2 TYR A 233 -14.723 0.262 11.115 1.00 89.98 C +ATOM 1840 OH TYR A 233 -16.049 -1.329 9.928 1.00 89.98 O +ATOM 1841 CZ TYR A 233 -15.890 -0.470 10.993 1.00 89.98 C +ATOM 1842 N HIS A 234 -17.946 3.773 14.265 1.00 91.27 N +ATOM 1843 CA HIS A 234 -19.331 4.014 13.874 1.00 91.27 C +ATOM 1844 C HIS A 234 -19.725 5.468 14.110 1.00 91.27 C +ATOM 1845 CB HIS A 234 -20.273 3.083 14.639 1.00 91.27 C +ATOM 1846 O HIS A 234 -20.537 6.024 13.367 1.00 91.27 O +ATOM 1847 CG HIS A 234 -20.043 1.632 14.358 1.00 91.27 C +ATOM 1848 CD2 HIS A 234 -20.167 0.918 13.215 1.00 91.27 C +ATOM 1849 ND1 HIS A 234 -19.636 0.742 15.328 1.00 91.27 N +ATOM 1850 CE1 HIS A 234 -19.518 -0.461 14.791 1.00 91.27 C +ATOM 1851 NE2 HIS A 234 -19.834 -0.381 13.509 1.00 91.27 N +ATOM 1852 N THR A 235 -19.142 6.042 15.196 1.00 91.00 N +ATOM 1853 CA THR A 235 -19.542 7.357 15.685 1.00 91.00 C +ATOM 1854 C THR A 235 -18.324 8.253 15.886 1.00 91.00 C +ATOM 1855 CB THR A 235 -20.326 7.247 17.006 1.00 91.00 C +ATOM 1856 O THR A 235 -17.187 7.816 15.693 1.00 91.00 O +ATOM 1857 CG2 THR A 235 -21.502 6.285 16.869 1.00 91.00 C +ATOM 1858 OG1 THR A 235 -19.451 6.773 18.036 1.00 91.00 O +ATOM 1859 N ASP A 236 -18.529 9.556 16.203 1.00 89.91 N +ATOM 1860 CA ASP A 236 -17.446 10.454 16.593 1.00 89.91 C +ATOM 1861 C ASP A 236 -17.062 10.247 18.056 1.00 89.91 C +ATOM 1862 CB ASP A 236 -17.845 11.912 16.355 1.00 89.91 C +ATOM 1863 O ASP A 236 -17.526 9.302 18.698 1.00 89.91 O +ATOM 1864 CG ASP A 236 -18.980 12.370 17.254 1.00 89.91 C +ATOM 1865 OD1 ASP A 236 -19.305 11.665 18.234 1.00 89.91 O +ATOM 1866 OD2 ASP A 236 -19.556 13.445 16.979 1.00 89.91 O +ATOM 1867 N ALA A 237 -16.190 11.093 18.580 1.00 87.17 N +ATOM 1868 CA ALA A 237 -15.629 10.925 19.918 1.00 87.17 C +ATOM 1869 C ALA A 237 -16.717 11.015 20.984 1.00 87.17 C +ATOM 1870 CB ALA A 237 -14.548 11.972 20.177 1.00 87.17 C +ATOM 1871 O ALA A 237 -16.588 10.430 22.063 1.00 87.17 O +ATOM 1872 N ARG A 238 -17.832 11.701 20.564 1.00 88.90 N +ATOM 1873 CA ARG A 238 -18.905 11.924 21.528 1.00 88.90 C +ATOM 1874 C ARG A 238 -20.022 10.900 21.350 1.00 88.90 C +ATOM 1875 CB ARG A 238 -19.467 13.340 21.390 1.00 88.90 C +ATOM 1876 O ARG A 238 -21.045 10.965 22.035 1.00 88.90 O +ATOM 1877 CG ARG A 238 -18.459 14.436 21.700 1.00 88.90 C +ATOM 1878 CD ARG A 238 -19.062 15.823 21.526 1.00 88.90 C +ATOM 1879 NE ARG A 238 -18.093 16.873 21.828 1.00 88.90 N +ATOM 1880 NH1 ARG A 238 -19.538 18.620 21.382 1.00 88.90 N +ATOM 1881 NH2 ARG A 238 -17.387 19.047 22.051 1.00 88.90 N +ATOM 1882 CZ ARG A 238 -18.342 18.177 21.753 1.00 88.90 C +ATOM 1883 N GLY A 239 -19.853 10.038 20.407 1.00 87.77 N +ATOM 1884 CA GLY A 239 -20.817 8.970 20.199 1.00 87.77 C +ATOM 1885 C GLY A 239 -21.914 9.339 19.218 1.00 87.77 C +ATOM 1886 O GLY A 239 -22.917 8.632 19.105 1.00 87.77 O +ATOM 1887 N ASN A 240 -21.723 10.504 18.544 1.00 92.57 N +ATOM 1888 CA ASN A 240 -22.709 10.928 17.554 1.00 92.57 C +ATOM 1889 C ASN A 240 -22.472 10.256 16.205 1.00 92.57 C +ATOM 1890 CB ASN A 240 -22.694 12.450 17.400 1.00 92.57 C +ATOM 1891 O ASN A 240 -21.337 10.193 15.728 1.00 92.57 O +ATOM 1892 CG ASN A 240 -22.994 13.172 18.699 1.00 92.57 C +ATOM 1893 ND2 ASN A 240 -22.172 14.160 19.031 1.00 92.57 N +ATOM 1894 OD1 ASN A 240 -23.955 12.843 19.399 1.00 92.57 O +ATOM 1895 N VAL A 241 -23.551 9.789 15.561 1.00 92.00 N +ATOM 1896 CA VAL A 241 -23.467 9.117 14.268 1.00 92.00 C +ATOM 1897 C VAL A 241 -23.277 10.151 13.160 1.00 92.00 C +ATOM 1898 CB VAL A 241 -24.723 8.262 13.990 1.00 92.00 C +ATOM 1899 O VAL A 241 -22.528 9.919 12.208 1.00 92.00 O +ATOM 1900 CG1 VAL A 241 -24.698 7.713 12.565 1.00 92.00 C +ATOM 1901 CG2 VAL A 241 -24.828 7.123 15.003 1.00 92.00 C +ATOM 1902 N MET A 242 -23.840 11.327 13.440 1.00 92.89 N +ATOM 1903 CA MET A 242 -23.804 12.378 12.427 1.00 92.89 C +ATOM 1904 C MET A 242 -23.124 13.631 12.968 1.00 92.89 C +ATOM 1905 CB MET A 242 -25.217 12.714 11.949 1.00 92.89 C +ATOM 1906 O MET A 242 -23.281 13.971 14.142 1.00 92.89 O +ATOM 1907 CG MET A 242 -25.964 11.529 11.360 1.00 92.89 C +ATOM 1908 SD MET A 242 -25.249 10.969 9.766 1.00 92.89 S +ATOM 1909 CE MET A 242 -25.855 12.280 8.666 1.00 92.89 C +ATOM 1910 N LYS A 243 -22.376 14.295 12.150 1.00 87.76 N +ATOM 1911 CA LYS A 243 -21.795 15.611 12.396 1.00 87.76 C +ATOM 1912 C LYS A 243 -21.996 16.534 11.197 1.00 87.76 C +ATOM 1913 CB LYS A 243 -20.305 15.489 12.719 1.00 87.76 C +ATOM 1914 O LYS A 243 -21.529 16.239 10.095 1.00 87.76 O +ATOM 1915 CG LYS A 243 -19.656 16.795 13.153 1.00 87.76 C +ATOM 1916 CD LYS A 243 -18.180 16.606 13.476 1.00 87.76 C +ATOM 1917 CE LYS A 243 -17.526 17.915 13.897 1.00 87.76 C +ATOM 1918 NZ LYS A 243 -16.081 17.732 14.226 1.00 87.76 N +ATOM 1919 N ASP A 244 -22.825 17.578 11.333 1.00 87.10 N +ATOM 1920 CA ASP A 244 -23.127 18.552 10.288 1.00 87.10 C +ATOM 1921 C ASP A 244 -23.781 17.879 9.083 1.00 87.10 C +ATOM 1922 CB ASP A 244 -21.856 19.285 9.855 1.00 87.10 C +ATOM 1923 O ASP A 244 -23.422 18.160 7.938 1.00 87.10 O +ATOM 1924 CG ASP A 244 -21.215 20.076 10.982 1.00 87.10 C +ATOM 1925 OD1 ASP A 244 -21.946 20.651 11.817 1.00 87.10 O +ATOM 1926 OD2 ASP A 244 -19.967 20.126 11.034 1.00 87.10 O +ATOM 1927 N GLY A 245 -24.654 16.943 9.381 1.00 86.04 N +ATOM 1928 CA GLY A 245 -25.437 16.294 8.342 1.00 86.04 C +ATOM 1929 C GLY A 245 -24.690 15.175 7.642 1.00 86.04 C +ATOM 1930 O GLY A 245 -25.177 14.617 6.657 1.00 86.04 O +ATOM 1931 N LYS A 246 -23.493 14.872 8.139 1.00 89.96 N +ATOM 1932 CA LYS A 246 -22.682 13.823 7.528 1.00 89.96 C +ATOM 1933 C LYS A 246 -22.333 12.738 8.542 1.00 89.96 C +ATOM 1934 CB LYS A 246 -21.404 14.413 6.930 1.00 89.96 C +ATOM 1935 O LYS A 246 -22.263 13.003 9.744 1.00 89.96 O +ATOM 1936 CG LYS A 246 -21.649 15.471 5.865 1.00 89.96 C +ATOM 1937 CD LYS A 246 -20.342 16.070 5.361 1.00 89.96 C +ATOM 1938 CE LYS A 246 -20.588 17.153 4.318 1.00 89.96 C +ATOM 1939 NZ LYS A 246 -19.313 17.787 3.867 1.00 89.96 N +ATOM 1940 N LEU A 247 -22.133 11.547 8.006 1.00 91.32 N +ATOM 1941 CA LEU A 247 -21.696 10.457 8.871 1.00 91.32 C +ATOM 1942 C LEU A 247 -20.323 10.751 9.465 1.00 91.32 C +ATOM 1943 CB LEU A 247 -21.657 9.138 8.093 1.00 91.32 C +ATOM 1944 O LEU A 247 -19.382 11.072 8.736 1.00 91.32 O +ATOM 1945 CG LEU A 247 -23.009 8.498 7.777 1.00 91.32 C +ATOM 1946 CD1 LEU A 247 -22.836 7.362 6.774 1.00 91.32 C +ATOM 1947 CD2 LEU A 247 -23.675 7.994 9.053 1.00 91.32 C +ATOM 1948 N ALA A 248 -20.239 10.599 10.783 1.00 89.54 N +ATOM 1949 CA ALA A 248 -19.077 11.087 11.522 1.00 89.54 C +ATOM 1950 C ALA A 248 -18.041 9.982 11.705 1.00 89.54 C +ATOM 1951 CB ALA A 248 -19.504 11.642 12.878 1.00 89.54 C +ATOM 1952 O ALA A 248 -16.850 10.260 11.866 1.00 89.54 O +ATOM 1953 N GLY A 249 -18.421 8.761 11.584 1.00 89.50 N +ATOM 1954 CA GLY A 249 -17.555 7.632 11.885 1.00 89.50 C +ATOM 1955 C GLY A 249 -16.459 7.430 10.856 1.00 89.50 C +ATOM 1956 O GLY A 249 -16.660 7.685 9.667 1.00 89.50 O +ATOM 1957 N ASN A 250 -15.287 6.842 11.308 1.00 88.00 N +ATOM 1958 CA ASN A 250 -14.142 6.599 10.437 1.00 88.00 C +ATOM 1959 C ASN A 250 -14.425 5.480 9.438 1.00 88.00 C +ATOM 1960 CB ASN A 250 -12.898 6.270 11.265 1.00 88.00 C +ATOM 1961 O ASN A 250 -13.741 5.364 8.420 1.00 88.00 O +ATOM 1962 CG ASN A 250 -12.352 7.477 12.003 1.00 88.00 C +ATOM 1963 ND2 ASN A 250 -11.606 7.230 13.073 1.00 88.00 N +ATOM 1964 OD1 ASN A 250 -12.599 8.622 11.614 1.00 88.00 O +ATOM 1965 N ALA A 251 -15.433 4.709 9.772 1.00 87.79 N +ATOM 1966 CA ALA A 251 -15.812 3.606 8.892 1.00 87.79 C +ATOM 1967 C ALA A 251 -16.263 4.123 7.529 1.00 87.79 C +ATOM 1968 CB ALA A 251 -16.917 2.770 9.533 1.00 87.79 C +ATOM 1969 O ALA A 251 -16.234 3.388 6.539 1.00 87.79 O +ATOM 1970 N PHE A 252 -16.699 5.360 7.467 1.00 89.23 N +ATOM 1971 CA PHE A 252 -17.316 5.891 6.257 1.00 89.23 C +ATOM 1972 C PHE A 252 -16.349 6.802 5.511 1.00 89.23 C +ATOM 1973 CB PHE A 252 -18.600 6.655 6.598 1.00 89.23 C +ATOM 1974 O PHE A 252 -16.757 7.561 4.630 1.00 89.23 O +ATOM 1975 CG PHE A 252 -19.597 5.847 7.384 1.00 89.23 C +ATOM 1976 CD1 PHE A 252 -20.306 4.816 6.780 1.00 89.23 C +ATOM 1977 CD2 PHE A 252 -19.825 6.119 8.726 1.00 89.23 C +ATOM 1978 CE1 PHE A 252 -21.230 4.066 7.505 1.00 89.23 C +ATOM 1979 CE2 PHE A 252 -20.747 5.374 9.457 1.00 89.23 C +ATOM 1980 CZ PHE A 252 -21.449 4.349 8.844 1.00 89.23 C +ATOM 1981 N LYS A 253 -15.090 6.730 5.880 1.00 85.70 N +ATOM 1982 CA LYS A 253 -14.025 7.446 5.184 1.00 85.70 C +ATOM 1983 C LYS A 253 -13.111 6.481 4.434 1.00 85.70 C +ATOM 1984 CB LYS A 253 -13.207 8.282 6.170 1.00 85.70 C +ATOM 1985 O LYS A 253 -12.932 5.336 4.853 1.00 85.70 O +ATOM 1986 CG LYS A 253 -14.027 9.306 6.941 1.00 85.70 C +ATOM 1987 CD LYS A 253 -13.165 10.082 7.930 1.00 85.70 C +ATOM 1988 CE LYS A 253 -13.989 11.091 8.719 1.00 85.70 C +ATOM 1989 NZ LYS A 253 -13.157 11.822 9.721 1.00 85.70 N +ATOM 1990 N SER A 254 -12.796 6.884 3.119 1.00 74.64 N +ATOM 1991 CA SER A 254 -11.769 6.090 2.454 1.00 74.64 C +ATOM 1992 C SER A 254 -10.433 6.193 3.182 1.00 74.64 C +ATOM 1993 CB SER A 254 -11.603 6.537 1.001 1.00 74.64 C +ATOM 1994 O SER A 254 -10.051 7.272 3.639 1.00 74.64 O +ATOM 1995 OG SER A 254 -12.796 6.318 0.268 1.00 74.64 O +ATOM 1996 N GLY A 255 -10.069 4.968 3.546 1.00 62.48 N +ATOM 1997 CA GLY A 255 -8.801 4.572 4.136 1.00 62.48 C +ATOM 1998 C GLY A 255 -7.643 5.455 3.709 1.00 62.48 C +ATOM 1999 O GLY A 255 -7.742 6.182 2.718 1.00 62.48 O +ATOM 2000 N HIS A 256 -6.921 6.066 4.548 1.00 62.54 N +ATOM 2001 CA HIS A 256 -5.864 7.056 4.721 1.00 62.54 C +ATOM 2002 C HIS A 256 -4.890 7.033 3.548 1.00 62.54 C +ATOM 2003 CB HIS A 256 -5.113 6.813 6.032 1.00 62.54 C +ATOM 2004 O HIS A 256 -4.494 8.086 3.044 1.00 62.54 O +ATOM 2005 CG HIS A 256 -5.962 6.987 7.251 1.00 62.54 C +ATOM 2006 CD2 HIS A 256 -6.418 6.086 8.152 1.00 62.54 C +ATOM 2007 ND1 HIS A 256 -6.441 8.214 7.654 1.00 62.54 N +ATOM 2008 CE1 HIS A 256 -7.157 8.060 8.756 1.00 62.54 C +ATOM 2009 NE2 HIS A 256 -7.159 6.778 9.078 1.00 62.54 N +ATOM 2010 N ILE A 257 -4.811 5.762 2.765 1.00 69.34 N +ATOM 2011 CA ILE A 257 -3.798 5.692 1.718 1.00 69.34 C +ATOM 2012 C ILE A 257 -4.351 6.283 0.423 1.00 69.34 C +ATOM 2013 CB ILE A 257 -3.325 4.240 1.485 1.00 69.34 C +ATOM 2014 O ILE A 257 -3.637 6.975 -0.306 1.00 69.34 O +ATOM 2015 CG1 ILE A 257 -2.629 3.698 2.739 1.00 69.34 C +ATOM 2016 CG2 ILE A 257 -2.399 4.162 0.268 1.00 69.34 C +ATOM 2017 CD1 ILE A 257 -2.299 2.213 2.670 1.00 69.34 C +ATOM 2018 N LEU A 258 -5.796 6.263 0.245 1.00 79.73 N +ATOM 2019 CA LEU A 258 -6.496 6.911 -0.859 1.00 79.73 C +ATOM 2020 C LEU A 258 -7.542 7.891 -0.338 1.00 79.73 C +ATOM 2021 CB LEU A 258 -7.162 5.866 -1.758 1.00 79.73 C +ATOM 2022 O LEU A 258 -8.701 7.849 -0.758 1.00 79.73 O +ATOM 2023 CG LEU A 258 -6.225 4.884 -2.464 1.00 79.73 C +ATOM 2024 CD1 LEU A 258 -7.031 3.821 -3.202 1.00 79.73 C +ATOM 2025 CD2 LEU A 258 -5.300 5.624 -3.425 1.00 79.73 C +ATOM 2026 N SER A 259 -7.051 8.758 0.643 1.00 79.21 N +ATOM 2027 CA SER A 259 -7.937 9.665 1.365 1.00 79.21 C +ATOM 2028 C SER A 259 -8.642 10.624 0.411 1.00 79.21 C +ATOM 2029 CB SER A 259 -7.154 10.459 2.412 1.00 79.21 C +ATOM 2030 O SER A 259 -9.703 11.162 0.736 1.00 79.21 O +ATOM 2031 OG SER A 259 -6.090 11.175 1.808 1.00 79.21 O +ATOM 2032 N GLU A 260 -8.066 10.719 -0.781 1.00 79.02 N +ATOM 2033 CA GLU A 260 -8.622 11.640 -1.768 1.00 79.02 C +ATOM 2034 C GLU A 260 -9.963 11.139 -2.297 1.00 79.02 C +ATOM 2035 CB GLU A 260 -7.642 11.842 -2.927 1.00 79.02 C +ATOM 2036 O GLU A 260 -10.705 11.889 -2.934 1.00 79.02 O +ATOM 2037 CG GLU A 260 -6.282 12.372 -2.496 1.00 79.02 C +ATOM 2038 CD GLU A 260 -5.287 11.272 -2.165 1.00 79.02 C +ATOM 2039 OE1 GLU A 260 -4.062 11.521 -2.233 1.00 79.02 O +ATOM 2040 OE2 GLU A 260 -5.735 10.151 -1.836 1.00 79.02 O +ATOM 2041 N LEU A 261 -10.169 9.877 -1.936 1.00 82.01 N +ATOM 2042 CA LEU A 261 -11.397 9.284 -2.453 1.00 82.01 C +ATOM 2043 C LEU A 261 -12.501 9.319 -1.402 1.00 82.01 C +ATOM 2044 CB LEU A 261 -11.149 7.841 -2.901 1.00 82.01 C +ATOM 2045 O LEU A 261 -13.611 8.839 -1.644 1.00 82.01 O +ATOM 2046 CG LEU A 261 -10.166 7.650 -4.057 1.00 82.01 C +ATOM 2047 CD1 LEU A 261 -9.983 6.166 -4.356 1.00 82.01 C +ATOM 2048 CD2 LEU A 261 -10.648 8.395 -5.297 1.00 82.01 C +ATOM 2049 N SER A 262 -12.171 9.901 -0.296 1.00 83.66 N +ATOM 2050 CA SER A 262 -13.151 10.032 0.778 1.00 83.66 C +ATOM 2051 C SER A 262 -14.179 11.113 0.459 1.00 83.66 C +ATOM 2052 CB SER A 262 -12.455 10.353 2.101 1.00 83.66 C +ATOM 2053 O SER A 262 -13.846 12.134 -0.146 1.00 83.66 O +ATOM 2054 OG SER A 262 -13.384 10.344 3.172 1.00 83.66 O +ATOM 2055 N PHE A 263 -15.435 10.858 0.856 1.00 84.38 N +ATOM 2056 CA PHE A 263 -16.552 11.747 0.559 1.00 84.38 C +ATOM 2057 C PHE A 263 -16.200 13.190 0.900 1.00 84.38 C +ATOM 2058 CB PHE A 263 -17.804 11.316 1.329 1.00 84.38 C +ATOM 2059 O PHE A 263 -16.440 14.099 0.102 1.00 84.38 O +ATOM 2060 CG PHE A 263 -18.984 12.227 1.128 1.00 84.38 C +ATOM 2061 CD1 PHE A 263 -19.389 13.096 2.134 1.00 84.38 C +ATOM 2062 CD2 PHE A 263 -19.690 12.214 -0.068 1.00 84.38 C +ATOM 2063 CE1 PHE A 263 -20.481 13.941 1.950 1.00 84.38 C +ATOM 2064 CE2 PHE A 263 -20.783 13.055 -0.259 1.00 84.38 C +ATOM 2065 CZ PHE A 263 -21.177 13.917 0.751 1.00 84.38 C +ATOM 2066 N ASP A 264 -15.486 13.417 1.945 1.00 79.50 N +ATOM 2067 CA ASP A 264 -15.228 14.769 2.428 1.00 79.50 C +ATOM 2068 C ASP A 264 -14.023 15.385 1.721 1.00 79.50 C +ATOM 2069 CB ASP A 264 -15.003 14.764 3.942 1.00 79.50 C +ATOM 2070 O ASP A 264 -13.747 16.577 1.877 1.00 79.50 O +ATOM 2071 CG ASP A 264 -13.907 13.806 4.375 1.00 79.50 C +ATOM 2072 OD1 ASP A 264 -13.636 12.823 3.653 1.00 79.50 O +ATOM 2073 OD2 ASP A 264 -13.312 14.035 5.451 1.00 79.50 O +ATOM 2074 N GLN A 265 -13.326 14.579 0.942 1.00 79.11 N +ATOM 2075 CA GLN A 265 -12.133 15.099 0.282 1.00 79.11 C +ATOM 2076 C GLN A 265 -12.355 15.249 -1.220 1.00 79.11 C +ATOM 2077 CB GLN A 265 -10.933 14.188 0.547 1.00 79.11 C +ATOM 2078 O GLN A 265 -11.483 15.747 -1.935 1.00 79.11 O +ATOM 2079 CG GLN A 265 -10.533 14.108 2.014 1.00 79.11 C +ATOM 2080 CD GLN A 265 -10.111 15.451 2.582 1.00 79.11 C +ATOM 2081 NE2 GLN A 265 -10.632 15.787 3.757 1.00 79.11 N +ATOM 2082 OE1 GLN A 265 -9.324 16.179 1.969 1.00 79.11 O +ATOM 2083 N ILE A 266 -13.584 14.741 -1.619 1.00 75.61 N +ATOM 2084 CA ILE A 266 -13.862 14.798 -3.050 1.00 75.61 C +ATOM 2085 C ILE A 266 -14.135 16.242 -3.466 1.00 75.61 C +ATOM 2086 CB ILE A 266 -15.058 13.896 -3.430 1.00 75.61 C +ATOM 2087 O ILE A 266 -14.931 16.938 -2.831 1.00 75.61 O +ATOM 2088 CG1 ILE A 266 -14.736 12.428 -3.129 1.00 75.61 C +ATOM 2089 CG2 ILE A 266 -15.430 14.084 -4.904 1.00 75.61 C +ATOM 2090 CD1 ILE A 266 -15.927 11.491 -3.276 1.00 75.61 C +ATOM 2091 N THR A 267 -13.280 16.817 -4.321 1.00 68.10 N +ATOM 2092 CA THR A 267 -13.447 18.177 -4.823 1.00 68.10 C +ATOM 2093 C THR A 267 -14.556 18.235 -5.870 1.00 68.10 C +ATOM 2094 CB THR A 267 -12.137 18.714 -5.427 1.00 68.10 C +ATOM 2095 O THR A 267 -15.049 17.197 -6.317 1.00 68.10 O +ATOM 2096 CG2 THR A 267 -10.993 18.633 -4.422 1.00 68.10 C +ATOM 2097 OG1 THR A 267 -11.798 17.938 -6.583 1.00 68.10 O +ATOM 2098 N GLN A 268 -15.065 19.496 -6.189 1.00 60.71 N +ATOM 2099 CA GLN A 268 -16.111 19.734 -7.178 1.00 60.71 C +ATOM 2100 C GLN A 268 -15.731 19.145 -8.534 1.00 60.71 C +ATOM 2101 CB GLN A 268 -16.390 21.231 -7.316 1.00 60.71 C +ATOM 2102 O GLN A 268 -16.594 18.666 -9.273 1.00 60.71 O +ATOM 2103 CG GLN A 268 -17.477 21.743 -6.380 1.00 60.71 C +ATOM 2104 CD GLN A 268 -17.814 23.203 -6.614 1.00 60.71 C +ATOM 2105 NE2 GLN A 268 -18.807 23.706 -5.889 1.00 60.71 N +ATOM 2106 OE1 GLN A 268 -17.185 23.874 -7.439 1.00 60.71 O +ATOM 2107 N ASP A 269 -14.411 18.962 -8.801 1.00 60.75 N +ATOM 2108 CA ASP A 269 -13.957 18.459 -10.094 1.00 60.75 C +ATOM 2109 C ASP A 269 -14.100 16.941 -10.173 1.00 60.75 C +ATOM 2110 CB ASP A 269 -12.503 18.864 -10.348 1.00 60.75 C +ATOM 2111 O ASP A 269 -14.135 16.372 -11.266 1.00 60.75 O +ATOM 2112 CG ASP A 269 -12.334 20.357 -10.568 1.00 60.75 C +ATOM 2113 OD1 ASP A 269 -13.330 21.045 -10.878 1.00 60.75 O +ATOM 2114 OD2 ASP A 269 -11.193 20.849 -10.434 1.00 60.75 O +ATOM 2115 N ASP A 270 -14.456 16.290 -9.065 1.00 65.00 N +ATOM 2116 CA ASP A 270 -14.588 14.837 -9.020 1.00 65.00 C +ATOM 2117 C ASP A 270 -16.032 14.425 -8.744 1.00 65.00 C +ATOM 2118 CB ASP A 270 -13.660 14.247 -7.956 1.00 65.00 C +ATOM 2119 O ASP A 270 -16.280 13.448 -8.035 1.00 65.00 O +ATOM 2120 CG ASP A 270 -12.192 14.337 -8.333 1.00 65.00 C +ATOM 2121 OD1 ASP A 270 -11.866 14.267 -9.538 1.00 65.00 O +ATOM 2122 OD2 ASP A 270 -11.353 14.477 -7.417 1.00 65.00 O +ATOM 2123 N ASN A 271 -16.975 15.154 -9.421 1.00 64.27 N +ATOM 2124 CA ASN A 271 -18.412 15.057 -9.185 1.00 64.27 C +ATOM 2125 C ASN A 271 -18.929 13.646 -9.448 1.00 64.27 C +ATOM 2126 CB ASN A 271 -19.167 16.069 -10.049 1.00 64.27 C +ATOM 2127 O ASN A 271 -19.845 13.179 -8.768 1.00 64.27 O +ATOM 2128 CG ASN A 271 -20.615 16.229 -9.630 1.00 64.27 C +ATOM 2129 ND2 ASN A 271 -21.341 17.099 -10.323 1.00 64.27 N +ATOM 2130 OD1 ASN A 271 -21.078 15.577 -8.690 1.00 64.27 O +ATOM 2131 N GLU A 272 -18.076 12.930 -10.217 1.00 73.09 N +ATOM 2132 CA GLU A 272 -18.569 11.607 -10.588 1.00 73.09 C +ATOM 2133 C GLU A 272 -18.428 10.621 -9.432 1.00 73.09 C +ATOM 2134 CB GLU A 272 -17.826 11.083 -11.820 1.00 73.09 C +ATOM 2135 O GLU A 272 -19.269 9.737 -9.257 1.00 73.09 O +ATOM 2136 CG GLU A 272 -18.217 11.778 -13.116 1.00 73.09 C +ATOM 2137 CD GLU A 272 -17.563 11.168 -14.345 1.00 73.09 C +ATOM 2138 OE1 GLU A 272 -17.880 11.597 -15.478 1.00 73.09 O +ATOM 2139 OE2 GLU A 272 -16.728 10.252 -14.175 1.00 73.09 O +ATOM 2140 N MET A 273 -17.417 10.913 -8.584 1.00 74.90 N +ATOM 2141 CA MET A 273 -17.186 10.029 -7.446 1.00 74.90 C +ATOM 2142 C MET A 273 -18.307 10.160 -6.419 1.00 74.90 C +ATOM 2143 CB MET A 273 -15.838 10.335 -6.790 1.00 74.90 C +ATOM 2144 O MET A 273 -18.558 9.233 -5.647 1.00 74.90 O +ATOM 2145 CG MET A 273 -14.647 9.773 -7.548 1.00 74.90 C +ATOM 2146 SD MET A 273 -14.716 7.947 -7.713 1.00 74.90 S +ATOM 2147 CE MET A 273 -14.547 7.462 -5.973 1.00 74.90 C +ATOM 2148 N LEU A 274 -18.933 11.338 -6.515 1.00 75.87 N +ATOM 2149 CA LEU A 274 -20.022 11.591 -5.578 1.00 75.87 C +ATOM 2150 C LEU A 274 -21.179 10.627 -5.816 1.00 75.87 C +ATOM 2151 CB LEU A 274 -20.512 13.036 -5.704 1.00 75.87 C +ATOM 2152 O LEU A 274 -22.008 10.414 -4.929 1.00 75.87 O +ATOM 2153 CG LEU A 274 -19.604 14.115 -5.112 1.00 75.87 C +ATOM 2154 CD1 LEU A 274 -20.130 15.502 -5.462 1.00 75.87 C +ATOM 2155 CD2 LEU A 274 -19.490 13.947 -3.600 1.00 75.87 C +ATOM 2156 N LYS A 275 -20.994 9.915 -7.002 1.00 80.84 N +ATOM 2157 CA LYS A 275 -22.026 8.945 -7.357 1.00 80.84 C +ATOM 2158 C LYS A 275 -21.881 7.665 -6.540 1.00 80.84 C +ATOM 2159 CB LYS A 275 -21.969 8.623 -8.851 1.00 80.84 C +ATOM 2160 O LYS A 275 -22.760 6.801 -6.569 1.00 80.84 O +ATOM 2161 CG LYS A 275 -22.405 9.771 -9.749 1.00 80.84 C +ATOM 2162 CD LYS A 275 -22.352 9.381 -11.220 1.00 80.84 C +ATOM 2163 CE LYS A 275 -22.737 10.546 -12.123 1.00 80.84 C +ATOM 2164 NZ LYS A 275 -22.654 10.178 -13.568 1.00 80.84 N +ATOM 2165 N LEU A 276 -20.790 7.637 -5.755 1.00 83.15 N +ATOM 2166 CA LEU A 276 -20.582 6.468 -4.906 1.00 83.15 C +ATOM 2167 C LEU A 276 -21.199 6.681 -3.528 1.00 83.15 C +ATOM 2168 CB LEU A 276 -19.088 6.165 -4.769 1.00 83.15 C +ATOM 2169 O LEU A 276 -21.312 5.738 -2.741 1.00 83.15 O +ATOM 2170 CG LEU A 276 -18.375 5.682 -6.033 1.00 83.15 C +ATOM 2171 CD1 LEU A 276 -16.878 5.545 -5.777 1.00 83.15 C +ATOM 2172 CD2 LEU A 276 -18.965 4.359 -6.508 1.00 83.15 C +ATOM 2173 N TYR A 277 -21.511 7.961 -3.313 1.00 87.44 N +ATOM 2174 CA TYR A 277 -21.954 8.307 -1.967 1.00 87.44 C +ATOM 2175 C TYR A 277 -23.292 9.035 -2.004 1.00 87.44 C +ATOM 2176 CB TYR A 277 -20.907 9.176 -1.263 1.00 87.44 C +ATOM 2177 O TYR A 277 -23.619 9.696 -2.993 1.00 87.44 O +ATOM 2178 CG TYR A 277 -19.533 8.553 -1.218 1.00 87.44 C +ATOM 2179 CD1 TYR A 277 -19.184 7.660 -0.207 1.00 87.44 C +ATOM 2180 CD2 TYR A 277 -18.580 8.857 -2.184 1.00 87.44 C +ATOM 2181 CE1 TYR A 277 -17.918 7.085 -0.160 1.00 87.44 C +ATOM 2182 CE2 TYR A 277 -17.311 8.288 -2.147 1.00 87.44 C +ATOM 2183 OH TYR A 277 -15.736 6.838 -1.092 1.00 87.44 O +ATOM 2184 CZ TYR A 277 -16.990 7.404 -1.133 1.00 87.44 C +ATOM 2185 N ASN A 278 -24.101 8.869 -0.933 1.00 88.54 N +ATOM 2186 CA ASN A 278 -25.246 9.742 -0.698 1.00 88.54 C +ATOM 2187 C ASN A 278 -24.814 11.094 -0.136 1.00 88.54 C +ATOM 2188 CB ASN A 278 -26.248 9.071 0.244 1.00 88.54 C +ATOM 2189 O ASN A 278 -23.637 11.298 0.165 1.00 88.54 O +ATOM 2190 CG ASN A 278 -26.868 7.824 -0.356 1.00 88.54 C +ATOM 2191 ND2 ASN A 278 -26.901 6.747 0.419 1.00 88.54 N +ATOM 2192 OD1 ASN A 278 -27.312 7.829 -1.507 1.00 88.54 O +ATOM 2193 N GLU A 279 -25.736 12.001 0.057 1.00 85.18 N +ATOM 2194 CA GLU A 279 -25.438 13.365 0.482 1.00 85.18 C +ATOM 2195 C GLU A 279 -24.837 13.386 1.885 1.00 85.18 C +ATOM 2196 CB GLU A 279 -26.699 14.231 0.437 1.00 85.18 C +ATOM 2197 O GLU A 279 -24.065 14.286 2.222 1.00 85.18 O +ATOM 2198 CG GLU A 279 -27.152 14.583 -0.973 1.00 85.18 C +ATOM 2199 CD GLU A 279 -28.357 15.510 -1.001 1.00 85.18 C +ATOM 2200 OE1 GLU A 279 -28.801 15.894 -2.107 1.00 85.18 O +ATOM 2201 OE2 GLU A 279 -28.861 15.855 0.091 1.00 85.18 O +ATOM 2202 N ASP A 280 -25.144 12.337 2.611 1.00 87.16 N +ATOM 2203 CA ASP A 280 -24.666 12.296 3.990 1.00 87.16 C +ATOM 2204 C ASP A 280 -23.340 11.547 4.090 1.00 87.16 C +ATOM 2205 CB ASP A 280 -25.709 11.643 4.900 1.00 87.16 C +ATOM 2206 O ASP A 280 -22.811 11.353 5.186 1.00 87.16 O +ATOM 2207 CG ASP A 280 -26.011 10.204 4.518 1.00 87.16 C +ATOM 2208 OD1 ASP A 280 -25.519 9.735 3.470 1.00 87.16 O +ATOM 2209 OD2 ASP A 280 -26.751 9.535 5.272 1.00 87.16 O +ATOM 2210 N GLY A 281 -22.803 11.058 2.960 1.00 86.32 N +ATOM 2211 CA GLY A 281 -21.525 10.364 2.923 1.00 86.32 C +ATOM 2212 C GLY A 281 -21.664 8.855 2.992 1.00 86.32 C +ATOM 2213 O GLY A 281 -20.667 8.132 2.935 1.00 86.32 O +ATOM 2214 N SER A 282 -22.871 8.394 3.142 1.00 88.61 N +ATOM 2215 CA SER A 282 -23.094 6.952 3.156 1.00 88.61 C +ATOM 2216 C SER A 282 -23.000 6.365 1.751 1.00 88.61 C +ATOM 2217 CB SER A 282 -24.459 6.626 3.763 1.00 88.61 C +ATOM 2218 O SER A 282 -23.243 7.061 0.764 1.00 88.61 O +ATOM 2219 OG SER A 282 -25.505 7.136 2.953 1.00 88.61 O +ATOM 2220 N PRO A 283 -22.589 5.071 1.689 1.00 88.78 N +ATOM 2221 CA PRO A 283 -22.503 4.438 0.371 1.00 88.78 C +ATOM 2222 C PRO A 283 -23.870 4.250 -0.284 1.00 88.78 C +ATOM 2223 CB PRO A 283 -21.851 3.086 0.672 1.00 88.78 C +ATOM 2224 O PRO A 283 -24.870 4.057 0.411 1.00 88.78 O +ATOM 2225 CG PRO A 283 -22.214 2.795 2.093 1.00 88.78 C +ATOM 2226 CD PRO A 283 -22.306 4.095 2.837 1.00 88.78 C +ATOM 2227 N ILE A 284 -23.869 4.316 -1.608 1.00 86.32 N +ATOM 2228 CA ILE A 284 -25.093 4.017 -2.343 1.00 86.32 C +ATOM 2229 C ILE A 284 -25.379 2.518 -2.282 1.00 86.32 C +ATOM 2230 CB ILE A 284 -25.000 4.486 -3.812 1.00 86.32 C +ATOM 2231 O ILE A 284 -24.459 1.701 -2.361 1.00 86.32 O +ATOM 2232 CG1 ILE A 284 -24.955 6.017 -3.882 1.00 86.32 C +ATOM 2233 CG2 ILE A 284 -26.170 3.934 -4.631 1.00 86.32 C +ATOM 2234 CD1 ILE A 284 -24.700 6.565 -5.280 1.00 86.32 C +ATOM 2235 N ASN A 285 -26.603 2.165 -2.116 1.00 85.13 N +ATOM 2236 CA ASN A 285 -27.048 0.776 -2.075 1.00 85.13 C +ATOM 2237 C ASN A 285 -26.257 -0.036 -1.054 1.00 85.13 C +ATOM 2238 CB ASN A 285 -26.940 0.136 -3.461 1.00 85.13 C +ATOM 2239 O ASN A 285 -25.550 -0.978 -1.417 1.00 85.13 O +ATOM 2240 CG ASN A 285 -27.664 -1.193 -3.548 1.00 85.13 C +ATOM 2241 ND2 ASN A 285 -27.367 -1.962 -4.589 1.00 85.13 N +ATOM 2242 OD1 ASN A 285 -28.484 -1.525 -2.688 1.00 85.13 O +ATOM 2243 N PRO A 286 -26.420 0.195 0.241 1.00 82.84 N +ATOM 2244 CA PRO A 286 -25.621 -0.433 1.297 1.00 82.84 C +ATOM 2245 C PRO A 286 -25.845 -1.940 1.389 1.00 82.84 C +ATOM 2246 CB PRO A 286 -26.103 0.270 2.568 1.00 82.84 C +ATOM 2247 O PRO A 286 -24.989 -2.665 1.903 1.00 82.84 O +ATOM 2248 CG PRO A 286 -27.444 0.826 2.213 1.00 82.84 C +ATOM 2249 CD PRO A 286 -27.462 1.124 0.741 1.00 82.84 C +ATOM 2250 N LYS A 287 -26.921 -2.501 0.769 1.00 83.62 N +ATOM 2251 CA LYS A 287 -27.234 -3.922 0.882 1.00 83.62 C +ATOM 2252 C LYS A 287 -26.766 -4.689 -0.352 1.00 83.62 C +ATOM 2253 CB LYS A 287 -28.736 -4.127 1.087 1.00 83.62 C +ATOM 2254 O LYS A 287 -26.636 -5.914 -0.316 1.00 83.62 O +ATOM 2255 CG LYS A 287 -29.253 -3.617 2.425 1.00 83.62 C +ATOM 2256 CD LYS A 287 -30.733 -3.926 2.606 1.00 83.62 C +ATOM 2257 CE LYS A 287 -31.257 -3.395 3.934 1.00 83.62 C +ATOM 2258 NZ LYS A 287 -32.711 -3.686 4.111 1.00 83.62 N +ATOM 2259 N GLY A 288 -26.285 -4.006 -1.370 1.00 83.69 N +ATOM 2260 CA GLY A 288 -25.874 -4.656 -2.605 1.00 83.69 C +ATOM 2261 C GLY A 288 -24.378 -4.590 -2.844 1.00 83.69 C +ATOM 2262 O GLY A 288 -23.659 -3.892 -2.126 1.00 83.69 O +ATOM 2263 N ALA A 289 -23.958 -5.429 -3.796 1.00 84.85 N +ATOM 2264 CA ALA A 289 -22.558 -5.415 -4.214 1.00 84.85 C +ATOM 2265 C ALA A 289 -22.238 -4.157 -5.016 1.00 84.85 C +ATOM 2266 CB ALA A 289 -22.235 -6.662 -5.034 1.00 84.85 C +ATOM 2267 O ALA A 289 -23.137 -3.521 -5.572 1.00 84.85 O +ATOM 2268 N VAL A 290 -21.009 -3.791 -4.940 1.00 88.04 N +ATOM 2269 CA VAL A 290 -20.559 -2.711 -5.813 1.00 88.04 C +ATOM 2270 C VAL A 290 -20.811 -3.085 -7.271 1.00 88.04 C +ATOM 2271 CB VAL A 290 -19.063 -2.391 -5.595 1.00 88.04 C +ATOM 2272 O VAL A 290 -20.312 -4.106 -7.752 1.00 88.04 O +ATOM 2273 CG1 VAL A 290 -18.613 -1.261 -6.519 1.00 88.04 C +ATOM 2274 CG2 VAL A 290 -18.802 -2.028 -4.135 1.00 88.04 C +ATOM 2275 N SER A 291 -21.628 -2.259 -7.950 1.00 88.59 N +ATOM 2276 CA SER A 291 -22.030 -2.552 -9.322 1.00 88.59 C +ATOM 2277 C SER A 291 -20.871 -2.355 -10.292 1.00 88.59 C +ATOM 2278 CB SER A 291 -23.208 -1.668 -9.735 1.00 88.59 C +ATOM 2279 O SER A 291 -19.883 -1.694 -9.962 1.00 88.59 O +ATOM 2280 OG SER A 291 -22.793 -0.322 -9.899 1.00 88.59 O +ATOM 2281 N ASN A 292 -20.974 -2.910 -11.465 1.00 88.47 N +ATOM 2282 CA ASN A 292 -19.985 -2.743 -12.525 1.00 88.47 C +ATOM 2283 C ASN A 292 -19.824 -1.276 -12.916 1.00 88.47 C +ATOM 2284 CB ASN A 292 -20.362 -3.580 -13.749 1.00 88.47 C +ATOM 2285 O ASN A 292 -18.715 -0.825 -13.207 1.00 88.47 O +ATOM 2286 CG ASN A 292 -20.087 -5.058 -13.553 1.00 88.47 C +ATOM 2287 ND2 ASN A 292 -20.741 -5.894 -14.350 1.00 88.47 N +ATOM 2288 OD1 ASN A 292 -19.293 -5.445 -12.691 1.00 88.47 O +ATOM 2289 N GLU A 293 -20.936 -0.567 -12.906 1.00 87.71 N +ATOM 2290 CA GLU A 293 -20.895 0.859 -13.215 1.00 87.71 C +ATOM 2291 C GLU A 293 -20.076 1.625 -12.180 1.00 87.71 C +ATOM 2292 CB GLU A 293 -22.311 1.433 -13.296 1.00 87.71 C +ATOM 2293 O GLU A 293 -19.292 2.509 -12.531 1.00 87.71 O +ATOM 2294 CG GLU A 293 -23.099 0.961 -14.509 1.00 87.71 C +ATOM 2295 CD GLU A 293 -23.755 -0.396 -14.307 1.00 87.71 C +ATOM 2296 OE1 GLU A 293 -24.182 -1.018 -15.306 1.00 87.71 O +ATOM 2297 OE2 GLU A 293 -23.843 -0.840 -13.141 1.00 87.71 O +ATOM 2298 N GLN A 294 -20.243 1.217 -10.907 1.00 88.05 N +ATOM 2299 CA GLN A 294 -19.472 1.830 -9.830 1.00 88.05 C +ATOM 2300 C GLN A 294 -17.988 1.503 -9.961 1.00 88.05 C +ATOM 2301 CB GLN A 294 -19.993 1.369 -8.467 1.00 88.05 C +ATOM 2302 O GLN A 294 -17.135 2.372 -9.765 1.00 88.05 O +ATOM 2303 CG GLN A 294 -21.362 1.932 -8.110 1.00 88.05 C +ATOM 2304 CD GLN A 294 -21.925 1.340 -6.831 1.00 88.05 C +ATOM 2305 NE2 GLN A 294 -22.294 2.202 -5.891 1.00 88.05 N +ATOM 2306 OE1 GLN A 294 -22.028 0.117 -6.691 1.00 88.05 O +ATOM 2307 N LYS A 295 -17.687 0.271 -10.368 1.00 89.46 N +ATOM 2308 CA LYS A 295 -16.301 -0.161 -10.525 1.00 89.46 C +ATOM 2309 C LYS A 295 -15.604 0.620 -11.635 1.00 89.46 C +ATOM 2310 CB LYS A 295 -16.237 -1.661 -10.820 1.00 89.46 C +ATOM 2311 O LYS A 295 -14.432 0.981 -11.505 1.00 89.46 O +ATOM 2312 CG LYS A 295 -16.492 -2.541 -9.606 1.00 89.46 C +ATOM 2313 CD LYS A 295 -16.299 -4.016 -9.935 1.00 89.46 C +ATOM 2314 CE LYS A 295 -16.589 -4.901 -8.730 1.00 89.46 C +ATOM 2315 NZ LYS A 295 -16.405 -6.349 -9.049 1.00 89.46 N +ATOM 2316 N ILE A 296 -16.358 0.840 -12.747 1.00 90.07 N +ATOM 2317 CA ILE A 296 -15.822 1.617 -13.859 1.00 90.07 C +ATOM 2318 C ILE A 296 -15.480 3.028 -13.386 1.00 90.07 C +ATOM 2319 CB ILE A 296 -16.817 1.674 -15.040 1.00 90.07 C +ATOM 2320 O ILE A 296 -14.411 3.554 -13.705 1.00 90.07 O +ATOM 2321 CG1 ILE A 296 -16.935 0.298 -15.705 1.00 90.07 C +ATOM 2322 CG2 ILE A 296 -16.390 2.738 -16.055 1.00 90.07 C +ATOM 2323 CD1 ILE A 296 -18.073 0.192 -16.711 1.00 90.07 C +ATOM 2324 N LEU A 297 -16.357 3.584 -12.600 1.00 87.12 N +ATOM 2325 CA LEU A 297 -16.134 4.920 -12.057 1.00 87.12 C +ATOM 2326 C LEU A 297 -14.932 4.932 -11.119 1.00 87.12 C +ATOM 2327 CB LEU A 297 -17.380 5.412 -11.316 1.00 87.12 C +ATOM 2328 O LEU A 297 -14.107 5.847 -11.172 1.00 87.12 O +ATOM 2329 CG LEU A 297 -17.304 6.820 -10.723 1.00 87.12 C +ATOM 2330 CD1 LEU A 297 -17.142 7.854 -11.832 1.00 87.12 C +ATOM 2331 CD2 LEU A 297 -18.544 7.116 -9.886 1.00 87.12 C +ATOM 2332 N ILE A 298 -14.832 3.960 -10.325 1.00 88.30 N +ATOM 2333 CA ILE A 298 -13.724 3.831 -9.385 1.00 88.30 C +ATOM 2334 C ILE A 298 -12.407 3.724 -10.151 1.00 88.30 C +ATOM 2335 CB ILE A 298 -13.907 2.607 -8.459 1.00 88.30 C +ATOM 2336 O ILE A 298 -11.430 4.397 -9.815 1.00 88.30 O +ATOM 2337 CG1 ILE A 298 -15.084 2.833 -7.503 1.00 88.30 C +ATOM 2338 CG2 ILE A 298 -12.619 2.319 -7.684 1.00 88.30 C +ATOM 2339 CD1 ILE A 298 -15.502 1.589 -6.731 1.00 88.30 C +ATOM 2340 N LYS A 299 -12.388 2.950 -11.195 1.00 90.39 N +ATOM 2341 CA LYS A 299 -11.183 2.767 -11.998 1.00 90.39 C +ATOM 2342 C LYS A 299 -10.741 4.082 -12.633 1.00 90.39 C +ATOM 2343 CB LYS A 299 -11.414 1.713 -13.082 1.00 90.39 C +ATOM 2344 O LYS A 299 -9.550 4.399 -12.653 1.00 90.39 O +ATOM 2345 CG LYS A 299 -11.376 0.281 -12.570 1.00 90.39 C +ATOM 2346 CD LYS A 299 -11.530 -0.723 -13.706 1.00 90.39 C +ATOM 2347 CE LYS A 299 -11.493 -2.157 -13.195 1.00 90.39 C +ATOM 2348 NZ LYS A 299 -11.634 -3.145 -14.307 1.00 90.39 N +ATOM 2349 N GLN A 300 -11.650 4.809 -13.149 1.00 87.65 N +ATOM 2350 CA GLN A 300 -11.348 6.095 -13.770 1.00 87.65 C +ATOM 2351 C GLN A 300 -10.737 7.063 -12.761 1.00 87.65 C +ATOM 2352 CB GLN A 300 -12.610 6.704 -14.384 1.00 87.65 C +ATOM 2353 O GLN A 300 -9.754 7.743 -13.062 1.00 87.65 O +ATOM 2354 CG GLN A 300 -13.090 5.989 -15.640 1.00 87.65 C +ATOM 2355 CD GLN A 300 -14.409 6.531 -16.157 1.00 87.65 C +ATOM 2356 NE2 GLN A 300 -14.750 6.182 -17.392 1.00 87.65 N +ATOM 2357 OE1 GLN A 300 -15.116 7.258 -15.451 1.00 87.65 O +ATOM 2358 N THR A 301 -11.271 7.021 -11.608 1.00 85.50 N +ATOM 2359 CA THR A 301 -10.783 7.906 -10.555 1.00 85.50 C +ATOM 2360 C THR A 301 -9.405 7.464 -10.072 1.00 85.50 C +ATOM 2361 CB THR A 301 -11.758 7.948 -9.364 1.00 85.50 C +ATOM 2362 O THR A 301 -8.528 8.297 -9.835 1.00 85.50 O +ATOM 2363 CG2 THR A 301 -11.280 8.926 -8.296 1.00 85.50 C +ATOM 2364 OG1 THR A 301 -13.051 8.358 -9.827 1.00 85.50 O +ATOM 2365 N ILE A 302 -9.305 6.231 -9.924 1.00 89.00 N +ATOM 2366 CA ILE A 302 -8.028 5.671 -9.494 1.00 89.00 C +ATOM 2367 C ILE A 302 -6.940 6.037 -10.500 1.00 89.00 C +ATOM 2368 CB ILE A 302 -8.111 4.138 -9.326 1.00 89.00 C +ATOM 2369 O ILE A 302 -5.829 6.410 -10.115 1.00 89.00 O +ATOM 2370 CG1 ILE A 302 -8.882 3.780 -8.051 1.00 89.00 C +ATOM 2371 CG2 ILE A 302 -6.709 3.520 -9.310 1.00 89.00 C +ATOM 2372 CD1 ILE A 302 -8.210 4.251 -6.768 1.00 89.00 C +ATOM 2373 N ASN A 303 -7.250 6.011 -11.738 1.00 90.36 N +ATOM 2374 CA ASN A 303 -6.290 6.401 -12.765 1.00 90.36 C +ATOM 2375 C ASN A 303 -5.847 7.852 -12.596 1.00 90.36 C +ATOM 2376 CB ASN A 303 -6.878 6.185 -14.160 1.00 90.36 C +ATOM 2377 O ASN A 303 -4.658 8.158 -12.694 1.00 90.36 O +ATOM 2378 CG ASN A 303 -6.628 4.786 -14.689 1.00 90.36 C +ATOM 2379 ND2 ASN A 303 -7.701 4.043 -14.934 1.00 90.36 N +ATOM 2380 OD1 ASN A 303 -5.479 4.376 -14.875 1.00 90.36 O +ATOM 2381 N LYS A 304 -6.757 8.665 -12.313 1.00 87.64 N +ATOM 2382 CA LYS A 304 -6.456 10.080 -12.116 1.00 87.64 C +ATOM 2383 C LYS A 304 -5.580 10.289 -10.884 1.00 87.64 C +ATOM 2384 CB LYS A 304 -7.746 10.891 -11.985 1.00 87.64 C +ATOM 2385 O LYS A 304 -4.584 11.013 -10.940 1.00 87.64 O +ATOM 2386 CG LYS A 304 -8.522 11.033 -13.286 1.00 87.64 C +ATOM 2387 CD LYS A 304 -9.795 11.848 -13.092 1.00 87.64 C +ATOM 2388 CE LYS A 304 -10.646 11.866 -14.354 1.00 87.64 C +ATOM 2389 NZ LYS A 304 -11.931 12.599 -14.145 1.00 87.64 N +ATOM 2390 N VAL A 305 -5.949 9.623 -9.848 1.00 87.64 N +ATOM 2391 CA VAL A 305 -5.237 9.757 -8.581 1.00 87.64 C +ATOM 2392 C VAL A 305 -3.805 9.249 -8.736 1.00 87.64 C +ATOM 2393 CB VAL A 305 -5.953 8.993 -7.445 1.00 87.64 C +ATOM 2394 O VAL A 305 -2.857 9.902 -8.293 1.00 87.64 O +ATOM 2395 CG1 VAL A 305 -5.060 8.901 -6.209 1.00 87.64 C +ATOM 2396 CG2 VAL A 305 -7.279 9.669 -7.101 1.00 87.64 C +ATOM 2397 N LEU A 306 -3.688 8.152 -9.393 1.00 91.99 N +ATOM 2398 CA LEU A 306 -2.365 7.566 -9.577 1.00 91.99 C +ATOM 2399 C LEU A 306 -1.491 8.459 -10.452 1.00 91.99 C +ATOM 2400 CB LEU A 306 -2.478 6.173 -10.201 1.00 91.99 C +ATOM 2401 O LEU A 306 -0.307 8.649 -10.166 1.00 91.99 O +ATOM 2402 CG LEU A 306 -3.196 5.112 -9.366 1.00 91.99 C +ATOM 2403 CD1 LEU A 306 -3.127 3.755 -10.059 1.00 91.99 C +ATOM 2404 CD2 LEU A 306 -2.595 5.034 -7.967 1.00 91.99 C +ATOM 2405 N ASN A 307 -2.065 8.974 -11.474 1.00 92.31 N +ATOM 2406 CA ASN A 307 -1.332 9.896 -12.336 1.00 92.31 C +ATOM 2407 C ASN A 307 -0.786 11.085 -11.550 1.00 92.31 C +ATOM 2408 CB ASN A 307 -2.222 10.381 -13.482 1.00 92.31 C +ATOM 2409 O ASN A 307 0.385 11.441 -11.689 1.00 92.31 O +ATOM 2410 CG ASN A 307 -1.423 10.874 -14.673 1.00 92.31 C +ATOM 2411 ND2 ASN A 307 -1.378 10.072 -15.730 1.00 92.31 N +ATOM 2412 OD1 ASN A 307 -0.850 11.966 -14.642 1.00 92.31 O +ATOM 2413 N GLN A 308 -1.651 11.650 -10.724 1.00 89.50 N +ATOM 2414 CA GLN A 308 -1.262 12.807 -9.924 1.00 89.50 C +ATOM 2415 C GLN A 308 -0.162 12.445 -8.931 1.00 89.50 C +ATOM 2416 CB GLN A 308 -2.472 13.379 -9.183 1.00 89.50 C +ATOM 2417 O GLN A 308 0.807 13.191 -8.771 1.00 89.50 O +ATOM 2418 CG GLN A 308 -2.167 14.646 -8.395 1.00 89.50 C +ATOM 2419 CD GLN A 308 -3.413 15.290 -7.815 1.00 89.50 C +ATOM 2420 NE2 GLN A 308 -3.233 16.405 -7.114 1.00 89.50 N +ATOM 2421 OE1 GLN A 308 -4.527 14.790 -7.995 1.00 89.50 O +ATOM 2422 N ARG A 309 -0.271 11.338 -8.345 1.00 90.72 N +ATOM 2423 CA ARG A 309 0.709 10.903 -7.355 1.00 90.72 C +ATOM 2424 C ARG A 309 2.078 10.696 -7.993 1.00 90.72 C +ATOM 2425 CB ARG A 309 0.248 9.613 -6.673 1.00 90.72 C +ATOM 2426 O ARG A 309 3.099 11.090 -7.426 1.00 90.72 O +ATOM 2427 CG ARG A 309 -0.874 9.814 -5.668 1.00 90.72 C +ATOM 2428 CD ARG A 309 -1.082 8.581 -4.800 1.00 90.72 C +ATOM 2429 NE ARG A 309 -2.079 8.816 -3.759 1.00 90.72 N +ATOM 2430 NH1 ARG A 309 -1.133 7.360 -2.235 1.00 90.72 N +ATOM 2431 NH2 ARG A 309 -3.036 8.518 -1.693 1.00 90.72 N +ATOM 2432 CZ ARG A 309 -2.080 8.231 -2.565 1.00 90.72 C +ATOM 2433 N ILE A 310 2.049 10.139 -9.163 1.00 94.52 N +ATOM 2434 CA ILE A 310 3.309 9.889 -9.854 1.00 94.52 C +ATOM 2435 C ILE A 310 3.943 11.215 -10.268 1.00 94.52 C +ATOM 2436 CB ILE A 310 3.106 8.983 -11.089 1.00 94.52 C +ATOM 2437 O ILE A 310 5.144 11.422 -10.079 1.00 94.52 O +ATOM 2438 CG1 ILE A 310 2.574 7.610 -10.663 1.00 94.52 C +ATOM 2439 CG2 ILE A 310 4.412 8.844 -11.877 1.00 94.52 C +ATOM 2440 CD1 ILE A 310 3.439 6.905 -9.627 1.00 94.52 C +ATOM 2441 N LYS A 311 3.199 12.098 -10.753 1.00 93.15 N +ATOM 2442 CA LYS A 311 3.707 13.410 -11.142 1.00 93.15 C +ATOM 2443 C LYS A 311 4.292 14.151 -9.943 1.00 93.15 C +ATOM 2444 CB LYS A 311 2.598 14.246 -11.785 1.00 93.15 C +ATOM 2445 O LYS A 311 5.365 14.751 -10.040 1.00 93.15 O +ATOM 2446 CG LYS A 311 2.241 13.816 -13.200 1.00 93.15 C +ATOM 2447 CD LYS A 311 1.140 14.690 -13.788 1.00 93.15 C +ATOM 2448 CE LYS A 311 0.796 14.274 -15.212 1.00 93.15 C +ATOM 2449 NZ LYS A 311 -0.334 15.079 -15.766 1.00 93.15 N +ATOM 2450 N GLU A 312 3.549 14.106 -8.868 1.00 93.09 N +ATOM 2451 CA GLU A 312 4.019 14.760 -7.651 1.00 93.09 C +ATOM 2452 C GLU A 312 5.316 14.130 -7.151 1.00 93.09 C +ATOM 2453 CB GLU A 312 2.948 14.697 -6.558 1.00 93.09 C +ATOM 2454 O GLU A 312 6.225 14.835 -6.708 1.00 93.09 O +ATOM 2455 CG GLU A 312 1.750 15.597 -6.819 1.00 93.09 C +ATOM 2456 CD GLU A 312 0.627 15.409 -5.811 1.00 93.09 C +ATOM 2457 OE1 GLU A 312 -0.414 16.095 -5.926 1.00 93.09 O +ATOM 2458 OE2 GLU A 312 0.790 14.569 -4.898 1.00 93.09 O +ATOM 2459 N ASN A 313 5.368 12.841 -7.303 1.00 93.85 N +ATOM 2460 CA ASN A 313 6.565 12.152 -6.833 1.00 93.85 C +ATOM 2461 C ASN A 313 7.767 12.443 -7.727 1.00 93.85 C +ATOM 2462 CB ASN A 313 6.318 10.644 -6.750 1.00 93.85 C +ATOM 2463 O ASN A 313 8.898 12.526 -7.246 1.00 93.85 O +ATOM 2464 CG ASN A 313 5.741 10.220 -5.414 1.00 93.85 C +ATOM 2465 ND2 ASN A 313 5.244 8.990 -5.346 1.00 93.85 N +ATOM 2466 OD1 ASN A 313 5.740 10.991 -4.451 1.00 93.85 O +ATOM 2467 N ILE A 314 7.505 12.552 -9.011 1.00 93.80 N +ATOM 2468 CA ILE A 314 8.584 12.929 -9.917 1.00 93.80 C +ATOM 2469 C ILE A 314 9.124 14.305 -9.533 1.00 93.80 C +ATOM 2470 CB ILE A 314 8.113 12.929 -11.388 1.00 93.80 C +ATOM 2471 O ILE A 314 10.338 14.502 -9.451 1.00 93.80 O +ATOM 2472 CG1 ILE A 314 7.869 11.494 -11.871 1.00 93.80 C +ATOM 2473 CG2 ILE A 314 9.133 13.642 -12.282 1.00 93.80 C +ATOM 2474 CD1 ILE A 314 7.193 11.406 -13.232 1.00 93.80 C +ATOM 2475 N ARG A 315 8.232 15.224 -9.275 1.00 94.03 N +ATOM 2476 CA ARG A 315 8.626 16.561 -8.843 1.00 94.03 C +ATOM 2477 C ARG A 315 9.430 16.504 -7.548 1.00 94.03 C +ATOM 2478 CB ARG A 315 7.396 17.452 -8.657 1.00 94.03 C +ATOM 2479 O ARG A 315 10.451 17.181 -7.415 1.00 94.03 O +ATOM 2480 CG ARG A 315 7.726 18.904 -8.353 1.00 94.03 C +ATOM 2481 CD ARG A 315 6.471 19.758 -8.245 1.00 94.03 C +ATOM 2482 NE ARG A 315 6.787 21.142 -7.904 1.00 94.03 N +ATOM 2483 NH1 ARG A 315 4.664 21.949 -8.326 1.00 94.03 N +ATOM 2484 NH2 ARG A 315 6.317 23.371 -7.618 1.00 94.03 N +ATOM 2485 CZ ARG A 315 5.922 22.151 -7.950 1.00 94.03 C +ATOM 2486 N TYR A 316 8.912 15.702 -6.709 1.00 93.60 N +ATOM 2487 CA TYR A 316 9.576 15.541 -5.420 1.00 93.60 C +ATOM 2488 C TYR A 316 10.988 14.997 -5.598 1.00 93.60 C +ATOM 2489 CB TYR A 316 8.768 14.610 -4.511 1.00 93.60 C +ATOM 2490 O TYR A 316 11.935 15.496 -4.985 1.00 93.60 O +ATOM 2491 CG TYR A 316 9.412 14.362 -3.169 1.00 93.60 C +ATOM 2492 CD1 TYR A 316 9.948 13.116 -2.851 1.00 93.60 C +ATOM 2493 CD2 TYR A 316 9.486 15.372 -2.216 1.00 93.60 C +ATOM 2494 CE1 TYR A 316 10.541 12.882 -1.615 1.00 93.60 C +ATOM 2495 CE2 TYR A 316 10.077 15.150 -0.976 1.00 93.60 C +ATOM 2496 OH TYR A 316 11.187 13.678 0.540 1.00 93.60 O +ATOM 2497 CZ TYR A 316 10.601 13.904 -0.686 1.00 93.60 C +ATOM 2498 N PHE A 317 11.175 14.045 -6.458 1.00 93.29 N +ATOM 2499 CA PHE A 317 12.487 13.463 -6.716 1.00 93.29 C +ATOM 2500 C PHE A 317 13.412 14.483 -7.370 1.00 93.29 C +ATOM 2501 CB PHE A 317 12.361 12.223 -7.606 1.00 93.29 C +ATOM 2502 O PHE A 317 14.608 14.525 -7.070 1.00 93.29 O +ATOM 2503 CG PHE A 317 11.862 11.003 -6.879 1.00 93.29 C +ATOM 2504 CD1 PHE A 317 11.934 10.924 -5.494 1.00 93.29 C +ATOM 2505 CD2 PHE A 317 11.322 9.934 -7.582 1.00 93.29 C +ATOM 2506 CE1 PHE A 317 11.474 9.796 -4.818 1.00 93.29 C +ATOM 2507 CE2 PHE A 317 10.860 8.803 -6.914 1.00 93.29 C +ATOM 2508 CZ PHE A 317 10.937 8.736 -5.532 1.00 93.29 C +ATOM 2509 N LYS A 318 12.896 15.286 -8.186 1.00 92.91 N +ATOM 2510 CA LYS A 318 13.683 16.360 -8.786 1.00 92.91 C +ATOM 2511 C LYS A 318 14.137 17.364 -7.730 1.00 92.91 C +ATOM 2512 CB LYS A 318 12.878 17.072 -9.874 1.00 92.91 C +ATOM 2513 O LYS A 318 15.300 17.774 -7.715 1.00 92.91 O +ATOM 2514 CG LYS A 318 12.689 16.252 -11.141 1.00 92.91 C +ATOM 2515 CD LYS A 318 11.906 17.024 -12.196 1.00 92.91 C +ATOM 2516 CE LYS A 318 11.845 16.265 -13.515 1.00 92.91 C +ATOM 2517 NZ LYS A 318 11.105 17.032 -14.561 1.00 92.91 N +ATOM 2518 N ASP A 319 13.224 17.700 -6.865 1.00 91.40 N +ATOM 2519 CA ASP A 319 13.513 18.670 -5.813 1.00 91.40 C +ATOM 2520 C ASP A 319 14.602 18.155 -4.875 1.00 91.40 C +ATOM 2521 CB ASP A 319 12.246 18.996 -5.020 1.00 91.40 C +ATOM 2522 O ASP A 319 15.382 18.940 -4.331 1.00 91.40 O +ATOM 2523 CG ASP A 319 11.255 19.837 -5.805 1.00 91.40 C +ATOM 2524 OD1 ASP A 319 11.619 20.368 -6.876 1.00 91.40 O +ATOM 2525 OD2 ASP A 319 10.099 19.971 -5.347 1.00 91.40 O +ATOM 2526 N GLN A 320 14.597 16.852 -4.755 1.00 87.80 N +ATOM 2527 CA GLN A 320 15.567 16.248 -3.848 1.00 87.80 C +ATOM 2528 C GLN A 320 16.893 15.986 -4.556 1.00 87.80 C +ATOM 2529 CB GLN A 320 15.018 14.947 -3.262 1.00 87.80 C +ATOM 2530 O GLN A 320 17.849 15.510 -3.940 1.00 87.80 O +ATOM 2531 CG GLN A 320 13.769 15.134 -2.412 1.00 87.80 C +ATOM 2532 CD GLN A 320 13.990 16.074 -1.242 1.00 87.80 C +ATOM 2533 NE2 GLN A 320 13.130 17.079 -1.118 1.00 87.80 N +ATOM 2534 OE1 GLN A 320 14.927 15.898 -0.456 1.00 87.80 O +ATOM 2535 N GLY A 321 16.927 16.224 -5.845 1.00 89.18 N +ATOM 2536 CA GLY A 321 18.146 16.079 -6.624 1.00 89.18 C +ATOM 2537 C GLY A 321 18.404 14.652 -7.069 1.00 89.18 C +ATOM 2538 O GLY A 321 19.534 14.298 -7.413 1.00 89.18 O +ATOM 2539 N LEU A 322 17.454 13.786 -6.968 1.00 89.93 N +ATOM 2540 CA LEU A 322 17.602 12.403 -7.407 1.00 89.93 C +ATOM 2541 C LEU A 322 17.419 12.289 -8.917 1.00 89.93 C +ATOM 2542 CB LEU A 322 16.594 11.501 -6.690 1.00 89.93 C +ATOM 2543 O LEU A 322 18.037 11.437 -9.559 1.00 89.93 O +ATOM 2544 CG LEU A 322 16.914 11.150 -5.236 1.00 89.93 C +ATOM 2545 CD1 LEU A 322 15.700 10.516 -4.565 1.00 89.93 C +ATOM 2546 CD2 LEU A 322 18.119 10.219 -5.163 1.00 89.93 C +ATOM 2547 N VAL A 323 16.529 13.110 -9.420 1.00 92.24 N +ATOM 2548 CA VAL A 323 16.355 13.241 -10.863 1.00 92.24 C +ATOM 2549 C VAL A 323 16.906 14.587 -11.330 1.00 92.24 C +ATOM 2550 CB VAL A 323 14.870 13.104 -11.270 1.00 92.24 C +ATOM 2551 O VAL A 323 16.457 15.641 -10.873 1.00 92.24 O +ATOM 2552 CG1 VAL A 323 14.702 13.304 -12.775 1.00 92.24 C +ATOM 2553 CG2 VAL A 323 14.326 11.741 -10.845 1.00 92.24 C +ATOM 2554 N ILE A 324 17.863 14.537 -12.299 1.00 90.74 N +ATOM 2555 CA ILE A 324 18.548 15.745 -12.747 1.00 90.74 C +ATOM 2556 C ILE A 324 18.335 15.932 -14.247 1.00 90.74 C +ATOM 2557 CB ILE A 324 20.058 15.691 -12.422 1.00 90.74 C +ATOM 2558 O ILE A 324 18.491 14.987 -15.025 1.00 90.74 O +ATOM 2559 CG1 ILE A 324 20.274 15.488 -10.918 1.00 90.74 C +ATOM 2560 CG2 ILE A 324 20.760 16.962 -12.909 1.00 90.74 C +ATOM 2561 CD1 ILE A 324 21.704 15.128 -10.541 1.00 90.74 C +ATOM 2562 N ASP A 325 17.961 17.156 -14.575 1.00 90.35 N +ATOM 2563 CA ASP A 325 17.836 17.507 -15.987 1.00 90.35 C +ATOM 2564 C ASP A 325 19.204 17.562 -16.663 1.00 90.35 C +ATOM 2565 CB ASP A 325 17.117 18.849 -16.144 1.00 90.35 C +ATOM 2566 O ASP A 325 20.153 18.121 -16.111 1.00 90.35 O +ATOM 2567 CG ASP A 325 15.676 18.809 -15.668 1.00 90.35 C +ATOM 2568 OD1 ASP A 325 14.960 17.830 -15.971 1.00 90.35 O +ATOM 2569 OD2 ASP A 325 15.250 19.767 -14.987 1.00 90.35 O +ATOM 2570 N THR A 326 19.268 16.920 -17.773 1.00 88.71 N +ATOM 2571 CA THR A 326 20.511 16.960 -18.534 1.00 88.71 C +ATOM 2572 C THR A 326 20.248 17.374 -19.979 1.00 88.71 C +ATOM 2573 CB THR A 326 21.224 15.595 -18.511 1.00 88.71 C +ATOM 2574 O THR A 326 19.115 17.290 -20.458 1.00 88.71 O +ATOM 2575 CG2 THR A 326 21.528 15.158 -17.081 1.00 88.71 C +ATOM 2576 OG1 THR A 326 20.385 14.613 -19.131 1.00 88.71 O +ATOM 2577 N VAL A 327 21.274 17.980 -20.587 1.00 84.25 N +ATOM 2578 CA VAL A 327 21.245 18.309 -22.008 1.00 84.25 C +ATOM 2579 C VAL A 327 22.417 17.635 -22.719 1.00 84.25 C +ATOM 2580 CB VAL A 327 21.288 19.836 -22.239 1.00 84.25 C +ATOM 2581 O VAL A 327 23.562 17.735 -22.272 1.00 84.25 O +ATOM 2582 CG1 VAL A 327 21.201 20.159 -23.729 1.00 84.25 C +ATOM 2583 CG2 VAL A 327 20.160 20.523 -21.472 1.00 84.25 C +ATOM 2584 N ASN A 328 22.014 16.803 -23.684 1.00 78.93 N +ATOM 2585 CA ASN A 328 23.106 16.160 -24.407 1.00 78.93 C +ATOM 2586 C ASN A 328 23.749 17.111 -25.413 1.00 78.93 C +ATOM 2587 CB ASN A 328 22.611 14.896 -25.114 1.00 78.93 C +ATOM 2588 O ASN A 328 23.346 18.270 -25.522 1.00 78.93 O +ATOM 2589 CG ASN A 328 21.626 15.196 -26.227 1.00 78.93 C +ATOM 2590 ND2 ASN A 328 20.933 14.167 -26.699 1.00 78.93 N +ATOM 2591 OD1 ASN A 328 21.490 16.344 -26.659 1.00 78.93 O +ATOM 2592 N LYS A 329 24.869 16.637 -26.085 1.00 77.18 N +ATOM 2593 CA LYS A 329 25.667 17.442 -27.005 1.00 77.18 C +ATOM 2594 C LYS A 329 24.809 17.990 -28.142 1.00 77.18 C +ATOM 2595 CB LYS A 329 26.826 16.621 -27.571 1.00 77.18 C +ATOM 2596 O LYS A 329 25.106 19.050 -28.696 1.00 77.18 O +ATOM 2597 CG LYS A 329 27.894 16.268 -26.546 1.00 77.18 C +ATOM 2598 CD LYS A 329 29.063 15.532 -27.187 1.00 77.18 C +ATOM 2599 CE LYS A 329 30.105 15.127 -26.153 1.00 77.18 C +ATOM 2600 NZ LYS A 329 31.206 14.322 -26.761 1.00 77.18 N +ATOM 2601 N ASP A 330 23.666 17.278 -28.402 1.00 80.71 N +ATOM 2602 CA ASP A 330 22.781 17.686 -29.488 1.00 80.71 C +ATOM 2603 C ASP A 330 21.728 18.676 -28.996 1.00 80.71 C +ATOM 2604 CB ASP A 330 22.103 16.466 -30.116 1.00 80.71 C +ATOM 2605 O ASP A 330 20.895 19.144 -29.776 1.00 80.71 O +ATOM 2606 CG ASP A 330 23.086 15.520 -30.784 1.00 80.71 C +ATOM 2607 OD1 ASP A 330 24.106 15.989 -31.335 1.00 80.71 O +ATOM 2608 OD2 ASP A 330 22.837 14.295 -30.762 1.00 80.71 O +ATOM 2609 N GLY A 331 21.816 19.082 -27.758 1.00 81.56 N +ATOM 2610 CA GLY A 331 20.884 20.038 -27.183 1.00 81.56 C +ATOM 2611 C GLY A 331 19.577 19.406 -26.743 1.00 81.56 C +ATOM 2612 O GLY A 331 18.612 20.111 -26.439 1.00 81.56 O +ATOM 2613 N ASN A 332 19.496 18.051 -26.840 1.00 84.09 N +ATOM 2614 CA ASN A 332 18.278 17.369 -26.415 1.00 84.09 C +ATOM 2615 C ASN A 332 18.217 17.226 -24.897 1.00 84.09 C +ATOM 2616 CB ASN A 332 18.171 15.996 -27.083 1.00 84.09 C +ATOM 2617 O ASN A 332 19.206 16.852 -24.264 1.00 84.09 O +ATOM 2618 CG ASN A 332 18.011 16.090 -28.587 1.00 84.09 C +ATOM 2619 ND2 ASN A 332 18.499 15.081 -29.299 1.00 84.09 N +ATOM 2620 OD1 ASN A 332 17.453 17.061 -29.105 1.00 84.09 O +ATOM 2621 N LYS A 333 17.005 17.505 -24.397 1.00 84.90 N +ATOM 2622 CA LYS A 333 16.784 17.418 -22.957 1.00 84.90 C +ATOM 2623 C LYS A 333 16.610 15.969 -22.514 1.00 84.90 C +ATOM 2624 CB LYS A 333 15.561 18.241 -22.550 1.00 84.90 C +ATOM 2625 O LYS A 333 15.950 15.181 -23.195 1.00 84.90 O +ATOM 2626 CG LYS A 333 15.757 19.745 -22.676 1.00 84.90 C +ATOM 2627 CD LYS A 333 14.540 20.511 -22.174 1.00 84.90 C +ATOM 2628 CE LYS A 333 14.722 22.015 -22.329 1.00 84.90 C +ATOM 2629 NZ LYS A 333 13.524 22.770 -21.853 1.00 84.90 N +ATOM 2630 N GLY A 334 17.293 15.597 -21.460 1.00 89.42 N +ATOM 2631 CA GLY A 334 17.158 14.288 -20.841 1.00 89.42 C +ATOM 2632 C GLY A 334 17.275 14.328 -19.329 1.00 89.42 C +ATOM 2633 O GLY A 334 17.162 15.395 -18.720 1.00 89.42 O +ATOM 2634 N PHE A 335 17.303 13.071 -18.836 1.00 91.09 N +ATOM 2635 CA PHE A 335 17.353 12.993 -17.381 1.00 91.09 C +ATOM 2636 C PHE A 335 18.412 11.995 -16.928 1.00 91.09 C +ATOM 2637 CB PHE A 335 15.985 12.601 -16.814 1.00 91.09 C +ATOM 2638 O PHE A 335 18.770 11.081 -17.674 1.00 91.09 O +ATOM 2639 CG PHE A 335 14.861 13.493 -17.269 1.00 91.09 C +ATOM 2640 CD1 PHE A 335 14.510 14.620 -16.536 1.00 91.09 C +ATOM 2641 CD2 PHE A 335 14.156 13.203 -18.429 1.00 91.09 C +ATOM 2642 CE1 PHE A 335 13.470 15.447 -16.954 1.00 91.09 C +ATOM 2643 CE2 PHE A 335 13.116 14.025 -18.854 1.00 91.09 C +ATOM 2644 CZ PHE A 335 12.774 15.146 -18.114 1.00 91.09 C +ATOM 2645 N HIS A 336 18.929 12.272 -15.781 1.00 88.82 N +ATOM 2646 CA HIS A 336 19.752 11.317 -15.047 1.00 88.82 C +ATOM 2647 C HIS A 336 19.155 11.015 -13.677 1.00 88.82 C +ATOM 2648 CB HIS A 336 21.179 11.846 -14.894 1.00 88.82 C +ATOM 2649 O HIS A 336 18.630 11.912 -13.012 1.00 88.82 O +ATOM 2650 CG HIS A 336 22.118 10.864 -14.269 1.00 88.82 C +ATOM 2651 CD2 HIS A 336 22.590 10.768 -13.003 1.00 88.82 C +ATOM 2652 ND1 HIS A 336 22.686 9.825 -14.973 1.00 88.82 N +ATOM 2653 CE1 HIS A 336 23.469 9.129 -14.165 1.00 88.82 C +ATOM 2654 NE2 HIS A 336 23.428 9.680 -12.964 1.00 88.82 N +ATOM 2655 N PHE A 337 19.155 9.709 -13.304 1.00 88.65 N +ATOM 2656 CA PHE A 337 18.659 9.328 -11.987 1.00 88.65 C +ATOM 2657 C PHE A 337 19.814 9.035 -11.037 1.00 88.65 C +ATOM 2658 CB PHE A 337 17.741 8.105 -12.091 1.00 88.65 C +ATOM 2659 O PHE A 337 20.420 7.963 -11.100 1.00 88.65 O +ATOM 2660 CG PHE A 337 16.646 8.080 -11.059 1.00 88.65 C +ATOM 2661 CD1 PHE A 337 16.945 8.162 -9.705 1.00 88.65 C +ATOM 2662 CD2 PHE A 337 15.316 7.973 -11.444 1.00 88.65 C +ATOM 2663 CE1 PHE A 337 15.933 8.138 -8.748 1.00 88.65 C +ATOM 2664 CE2 PHE A 337 14.299 7.949 -10.494 1.00 88.65 C +ATOM 2665 CZ PHE A 337 14.610 8.030 -9.146 1.00 88.65 C +ATOM 2666 N HIS A 338 20.065 9.949 -10.115 1.00 85.87 N +ATOM 2667 CA HIS A 338 21.157 9.836 -9.155 1.00 85.87 C +ATOM 2668 C HIS A 338 20.802 8.874 -8.026 1.00 85.87 C +ATOM 2669 CB HIS A 338 21.511 11.210 -8.582 1.00 85.87 C +ATOM 2670 O HIS A 338 19.741 8.999 -7.409 1.00 85.87 O +ATOM 2671 CG HIS A 338 22.689 11.191 -7.661 1.00 85.87 C +ATOM 2672 CD2 HIS A 338 22.771 11.350 -6.319 1.00 85.87 C +ATOM 2673 ND1 HIS A 338 23.978 10.990 -8.106 1.00 85.87 N +ATOM 2674 CE1 HIS A 338 24.804 11.027 -7.074 1.00 85.87 C +ATOM 2675 NE2 HIS A 338 24.097 11.244 -5.978 1.00 85.87 N +ATOM 2676 N GLY A 339 21.654 7.835 -7.773 1.00 83.10 N +ATOM 2677 CA GLY A 339 21.515 6.955 -6.623 1.00 83.10 C +ATOM 2678 C GLY A 339 20.821 5.647 -6.953 1.00 83.10 C +ATOM 2679 O GLY A 339 20.615 4.808 -6.074 1.00 83.10 O +ATOM 2680 N LEU A 340 20.438 5.508 -8.254 1.00 87.53 N +ATOM 2681 CA LEU A 340 19.795 4.269 -8.678 1.00 87.53 C +ATOM 2682 C LEU A 340 20.822 3.283 -9.225 1.00 87.53 C +ATOM 2683 CB LEU A 340 18.728 4.554 -9.739 1.00 87.53 C +ATOM 2684 O LEU A 340 21.634 3.638 -10.082 1.00 87.53 O +ATOM 2685 CG LEU A 340 17.836 3.377 -10.137 1.00 87.53 C +ATOM 2686 CD1 LEU A 340 17.004 2.916 -8.945 1.00 87.53 C +ATOM 2687 CD2 LEU A 340 16.936 3.759 -11.307 1.00 87.53 C +ATOM 2688 N ASP A 341 20.779 2.100 -8.737 1.00 86.41 N +ATOM 2689 CA ASP A 341 21.708 1.055 -9.154 1.00 86.41 C +ATOM 2690 C ASP A 341 21.602 0.791 -10.654 1.00 86.41 C +ATOM 2691 CB ASP A 341 21.448 -0.236 -8.374 1.00 86.41 C +ATOM 2692 O ASP A 341 20.499 0.710 -11.199 1.00 86.41 O +ATOM 2693 CG ASP A 341 21.966 -0.181 -6.947 1.00 86.41 C +ATOM 2694 OD1 ASP A 341 22.729 0.750 -6.611 1.00 86.41 O +ATOM 2695 OD2 ASP A 341 21.611 -1.079 -6.153 1.00 86.41 O +ATOM 2696 N LYS A 342 22.776 0.594 -11.272 1.00 86.09 N +ATOM 2697 CA LYS A 342 22.855 0.405 -12.718 1.00 86.09 C +ATOM 2698 C LYS A 342 22.093 -0.844 -13.152 1.00 86.09 C +ATOM 2699 CB LYS A 342 24.314 0.311 -13.168 1.00 86.09 C +ATOM 2700 O LYS A 342 21.453 -0.852 -14.205 1.00 86.09 O +ATOM 2701 CG LYS A 342 25.055 1.640 -13.147 1.00 86.09 C +ATOM 2702 CD LYS A 342 26.475 1.497 -13.678 1.00 86.09 C +ATOM 2703 CE LYS A 342 27.243 2.809 -13.584 1.00 86.09 C +ATOM 2704 NZ LYS A 342 28.657 2.656 -14.039 1.00 86.09 N +ATOM 2705 N SER A 343 22.173 -1.882 -12.335 1.00 87.81 N +ATOM 2706 CA SER A 343 21.501 -3.135 -12.660 1.00 87.81 C +ATOM 2707 C SER A 343 19.986 -2.959 -12.689 1.00 87.81 C +ATOM 2708 CB SER A 343 21.876 -4.223 -11.653 1.00 87.81 C +ATOM 2709 O SER A 343 19.294 -3.618 -13.468 1.00 87.81 O +ATOM 2710 OG SER A 343 21.399 -3.896 -10.359 1.00 87.81 O +ATOM 2711 N ILE A 344 19.491 -2.096 -11.818 1.00 89.58 N +ATOM 2712 CA ILE A 344 18.060 -1.816 -11.785 1.00 89.58 C +ATOM 2713 C ILE A 344 17.677 -0.940 -12.976 1.00 89.58 C +ATOM 2714 CB ILE A 344 17.648 -1.132 -10.462 1.00 89.58 C +ATOM 2715 O ILE A 344 16.693 -1.215 -13.665 1.00 89.58 O +ATOM 2716 CG1 ILE A 344 17.827 -2.096 -9.284 1.00 89.58 C +ATOM 2717 CG2 ILE A 344 16.205 -0.626 -10.542 1.00 89.58 C +ATOM 2718 CD1 ILE A 344 17.631 -1.449 -7.919 1.00 89.58 C +ATOM 2719 N MET A 345 18.509 0.078 -13.181 1.00 88.89 N +ATOM 2720 CA MET A 345 18.255 1.018 -14.269 1.00 88.89 C +ATOM 2721 C MET A 345 18.224 0.298 -15.613 1.00 88.89 C +ATOM 2722 CB MET A 345 19.317 2.119 -14.289 1.00 88.89 C +ATOM 2723 O MET A 345 17.443 0.656 -16.496 1.00 88.89 O +ATOM 2724 CG MET A 345 19.044 3.214 -15.307 1.00 88.89 C +ATOM 2725 SD MET A 345 17.429 4.041 -15.035 1.00 88.89 S +ATOM 2726 CE MET A 345 17.775 4.916 -13.483 1.00 88.89 C +ATOM 2727 N SER A 346 18.998 -0.755 -15.780 1.00 88.96 N +ATOM 2728 CA SER A 346 19.115 -1.493 -17.034 1.00 88.96 C +ATOM 2729 C SER A 346 17.819 -2.226 -17.367 1.00 88.96 C +ATOM 2730 CB SER A 346 20.271 -2.491 -16.964 1.00 88.96 C +ATOM 2731 O SER A 346 17.592 -2.602 -18.518 1.00 88.96 O +ATOM 2732 OG SER A 346 19.994 -3.517 -16.026 1.00 88.96 O +ATOM 2733 N GLU A 347 16.930 -2.349 -16.323 1.00 88.79 N +ATOM 2734 CA GLU A 347 15.627 -2.962 -16.560 1.00 88.79 C +ATOM 2735 C GLU A 347 14.687 -2.000 -17.280 1.00 88.79 C +ATOM 2736 CB GLU A 347 15.001 -3.422 -15.242 1.00 88.79 C +ATOM 2737 O GLU A 347 13.717 -2.426 -17.911 1.00 88.79 O +ATOM 2738 CG GLU A 347 15.764 -4.547 -14.557 1.00 88.79 C +ATOM 2739 CD GLU A 347 15.835 -5.817 -15.390 1.00 88.79 C +ATOM 2740 OE1 GLU A 347 16.863 -6.529 -15.326 1.00 88.79 O +ATOM 2741 OE2 GLU A 347 14.855 -6.102 -16.115 1.00 88.79 O +ATOM 2742 N TYR A 348 15.010 -0.721 -17.243 1.00 88.87 N +ATOM 2743 CA TYR A 348 14.120 0.286 -17.809 1.00 88.87 C +ATOM 2744 C TYR A 348 14.681 0.838 -19.114 1.00 88.87 C +ATOM 2745 CB TYR A 348 13.896 1.427 -16.813 1.00 88.87 C +ATOM 2746 O TYR A 348 13.931 1.112 -20.053 1.00 88.87 O +ATOM 2747 CG TYR A 348 13.165 1.006 -15.561 1.00 88.87 C +ATOM 2748 CD1 TYR A 348 11.774 1.060 -15.492 1.00 88.87 C +ATOM 2749 CD2 TYR A 348 13.862 0.554 -14.446 1.00 88.87 C +ATOM 2750 CE1 TYR A 348 11.096 0.675 -14.340 1.00 88.87 C +ATOM 2751 CE2 TYR A 348 13.194 0.166 -13.289 1.00 88.87 C +ATOM 2752 OH TYR A 348 11.147 -0.154 -12.103 1.00 88.87 O +ATOM 2753 CZ TYR A 348 11.813 0.229 -13.246 1.00 88.87 C +ATOM 2754 N THR A 349 15.923 0.993 -19.153 1.00 87.33 N +ATOM 2755 CA THR A 349 16.548 1.517 -20.362 1.00 87.33 C +ATOM 2756 C THR A 349 18.039 1.191 -20.385 1.00 87.33 C +ATOM 2757 CB THR A 349 16.351 3.039 -20.479 1.00 87.33 C +ATOM 2758 O THR A 349 18.659 1.025 -19.333 1.00 87.33 O +ATOM 2759 CG2 THR A 349 16.977 3.768 -19.294 1.00 87.33 C +ATOM 2760 OG1 THR A 349 16.963 3.503 -21.689 1.00 87.33 O +ATOM 2761 N ASP A 350 18.545 1.013 -21.678 1.00 79.51 N +ATOM 2762 CA ASP A 350 19.983 0.829 -21.849 1.00 79.51 C +ATOM 2763 C ASP A 350 20.668 2.150 -22.193 1.00 79.51 C +ATOM 2764 CB ASP A 350 20.266 -0.210 -22.936 1.00 79.51 C +ATOM 2765 O ASP A 350 21.891 2.201 -22.338 1.00 79.51 O +ATOM 2766 CG ASP A 350 19.854 -1.615 -22.535 1.00 79.51 C +ATOM 2767 OD1 ASP A 350 19.940 -1.957 -21.336 1.00 79.51 O +ATOM 2768 OD2 ASP A 350 19.443 -2.389 -23.427 1.00 79.51 O +ATOM 2769 N ASP A 351 19.822 3.161 -22.190 1.00 79.38 N +ATOM 2770 CA ASP A 351 20.337 4.465 -22.597 1.00 79.38 C +ATOM 2771 C ASP A 351 20.976 5.196 -21.418 1.00 79.38 C +ATOM 2772 CB ASP A 351 19.221 5.319 -23.202 1.00 79.38 C +ATOM 2773 O ASP A 351 20.549 5.030 -20.273 1.00 79.38 O +ATOM 2774 CG ASP A 351 18.730 4.792 -24.539 1.00 79.38 C +ATOM 2775 OD1 ASP A 351 19.496 4.093 -25.238 1.00 79.38 O +ATOM 2776 OD2 ASP A 351 17.568 5.080 -24.899 1.00 79.38 O +ATOM 2777 N ILE A 352 22.011 5.937 -21.758 1.00 73.06 N +ATOM 2778 CA ILE A 352 22.714 6.705 -20.736 1.00 73.06 C +ATOM 2779 C ILE A 352 21.842 7.872 -20.277 1.00 73.06 C +ATOM 2780 CB ILE A 352 24.075 7.223 -21.253 1.00 73.06 C +ATOM 2781 O ILE A 352 21.762 8.162 -19.081 1.00 73.06 O +ATOM 2782 CG1 ILE A 352 24.998 6.048 -21.595 1.00 73.06 C +ATOM 2783 CG2 ILE A 352 24.726 8.151 -20.223 1.00 73.06 C +ATOM 2784 CD1 ILE A 352 26.260 6.451 -22.346 1.00 73.06 C +ATOM 2785 N GLN A 353 21.063 8.434 -21.285 1.00 82.26 N +ATOM 2786 CA GLN A 353 20.166 9.546 -20.983 1.00 82.26 C +ATOM 2787 C GLN A 353 18.712 9.086 -20.950 1.00 82.26 C +ATOM 2788 CB GLN A 353 20.339 10.669 -22.007 1.00 82.26 C +ATOM 2789 O GLN A 353 18.198 8.562 -21.941 1.00 82.26 O +ATOM 2790 CG GLN A 353 19.674 11.977 -21.602 1.00 82.26 C +ATOM 2791 CD GLN A 353 20.015 13.123 -22.537 1.00 82.26 C +ATOM 2792 NE2 GLN A 353 19.222 14.188 -22.483 1.00 82.26 N +ATOM 2793 OE1 GLN A 353 20.982 13.051 -23.301 1.00 82.26 O +ATOM 2794 N LEU A 354 18.022 9.412 -19.798 1.00 88.78 N +ATOM 2795 CA LEU A 354 16.659 8.934 -19.593 1.00 88.78 C +ATOM 2796 C LEU A 354 15.646 9.906 -20.189 1.00 88.78 C +ATOM 2797 CB LEU A 354 16.379 8.739 -18.100 1.00 88.78 C +ATOM 2798 O LEU A 354 15.839 11.123 -20.132 1.00 88.78 O +ATOM 2799 CG LEU A 354 17.320 7.795 -17.351 1.00 88.78 C +ATOM 2800 CD1 LEU A 354 17.006 7.806 -15.859 1.00 88.78 C +ATOM 2801 CD2 LEU A 354 17.219 6.381 -17.914 1.00 88.78 C +ATOM 2802 N THR A 355 14.665 9.367 -20.850 1.00 88.83 N +ATOM 2803 CA THR A 355 13.536 10.155 -21.331 1.00 88.83 C +ATOM 2804 C THR A 355 12.519 10.379 -20.215 1.00 88.83 C +ATOM 2805 CB THR A 355 12.848 9.473 -22.527 1.00 88.83 C +ATOM 2806 O THR A 355 12.640 9.801 -19.133 1.00 88.83 O +ATOM 2807 CG2 THR A 355 13.855 9.133 -23.621 1.00 88.83 C +ATOM 2808 OG1 THR A 355 12.216 8.266 -22.083 1.00 88.83 O +ATOM 2809 N GLU A 356 11.566 11.209 -20.487 1.00 86.40 N +ATOM 2810 CA GLU A 356 10.459 11.424 -19.560 1.00 86.40 C +ATOM 2811 C GLU A 356 9.694 10.129 -19.303 1.00 86.40 C +ATOM 2812 CB GLU A 356 9.510 12.499 -20.096 1.00 86.40 C +ATOM 2813 O GLU A 356 9.268 9.867 -18.176 1.00 86.40 O +ATOM 2814 CG GLU A 356 8.442 12.928 -19.101 1.00 86.40 C +ATOM 2815 CD GLU A 356 7.607 14.103 -19.586 1.00 86.40 C +ATOM 2816 OE1 GLU A 356 6.673 14.522 -18.866 1.00 86.40 O +ATOM 2817 OE2 GLU A 356 7.889 14.607 -20.696 1.00 86.40 O +ATOM 2818 N PHE A 357 9.568 9.404 -20.326 1.00 88.01 N +ATOM 2819 CA PHE A 357 8.896 8.117 -20.195 1.00 88.01 C +ATOM 2820 C PHE A 357 9.674 7.192 -19.266 1.00 88.01 C +ATOM 2821 CB PHE A 357 8.722 7.458 -21.567 1.00 88.01 C +ATOM 2822 O PHE A 357 9.089 6.535 -18.403 1.00 88.01 O +ATOM 2823 CG PHE A 357 8.048 6.113 -21.512 1.00 88.01 C +ATOM 2824 CD1 PHE A 357 8.785 4.944 -21.660 1.00 88.01 C +ATOM 2825 CD2 PHE A 357 6.677 6.018 -21.314 1.00 88.01 C +ATOM 2826 CE1 PHE A 357 8.165 3.698 -21.610 1.00 88.01 C +ATOM 2827 CE2 PHE A 357 6.050 4.776 -21.263 1.00 88.01 C +ATOM 2828 CZ PHE A 357 6.795 3.618 -21.412 1.00 88.01 C +ATOM 2829 N ASP A 358 10.960 7.178 -19.353 1.00 90.43 N +ATOM 2830 CA ASP A 358 11.817 6.328 -18.532 1.00 90.43 C +ATOM 2831 C ASP A 358 11.701 6.694 -17.055 1.00 90.43 C +ATOM 2832 CB ASP A 358 13.274 6.434 -18.988 1.00 90.43 C +ATOM 2833 O ASP A 358 11.533 5.818 -16.204 1.00 90.43 O +ATOM 2834 CG ASP A 358 13.492 5.922 -20.401 1.00 90.43 C +ATOM 2835 OD1 ASP A 358 12.844 4.929 -20.797 1.00 90.43 O +ATOM 2836 OD2 ASP A 358 14.323 6.514 -21.123 1.00 90.43 O +ATOM 2837 N ILE A 359 11.718 7.963 -16.825 1.00 91.71 N +ATOM 2838 CA ILE A 359 11.655 8.430 -15.444 1.00 91.71 C +ATOM 2839 C ILE A 359 10.276 8.132 -14.861 1.00 91.71 C +ATOM 2840 CB ILE A 359 11.964 9.941 -15.344 1.00 91.71 C +ATOM 2841 O ILE A 359 10.162 7.688 -13.716 1.00 91.71 O +ATOM 2842 CG1 ILE A 359 13.430 10.211 -15.700 1.00 91.71 C +ATOM 2843 CG2 ILE A 359 11.633 10.468 -13.945 1.00 91.71 C +ATOM 2844 CD1 ILE A 359 14.427 9.554 -14.755 1.00 91.71 C +ATOM 2845 N SER A 360 9.313 8.347 -15.667 1.00 93.11 N +ATOM 2846 CA SER A 360 7.950 8.087 -15.216 1.00 93.11 C +ATOM 2847 C SER A 360 7.746 6.610 -14.894 1.00 93.11 C +ATOM 2848 CB SER A 360 6.940 8.530 -16.276 1.00 93.11 C +ATOM 2849 O SER A 360 7.083 6.269 -13.912 1.00 93.11 O +ATOM 2850 OG SER A 360 6.987 9.935 -16.459 1.00 93.11 O +ATOM 2851 N HIS A 361 8.347 5.820 -15.691 1.00 93.15 N +ATOM 2852 CA HIS A 361 8.234 4.382 -15.475 1.00 93.15 C +ATOM 2853 C HIS A 361 8.924 3.963 -14.181 1.00 93.15 C +ATOM 2854 CB HIS A 361 8.826 3.614 -16.659 1.00 93.15 C +ATOM 2855 O HIS A 361 8.361 3.200 -13.392 1.00 93.15 O +ATOM 2856 CG HIS A 361 8.335 2.206 -16.766 1.00 93.15 C +ATOM 2857 CD2 HIS A 361 7.240 1.689 -17.373 1.00 93.15 C +ATOM 2858 ND1 HIS A 361 9.001 1.140 -16.199 1.00 93.15 N +ATOM 2859 CE1 HIS A 361 8.335 0.026 -16.455 1.00 93.15 C +ATOM 2860 NE2 HIS A 361 7.263 0.332 -17.165 1.00 93.15 N +ATOM 2861 N VAL A 362 10.065 4.458 -13.945 1.00 94.08 N +ATOM 2862 CA VAL A 362 10.827 4.128 -12.745 1.00 94.08 C +ATOM 2863 C VAL A 362 10.081 4.620 -11.507 1.00 94.08 C +ATOM 2864 CB VAL A 362 12.246 4.738 -12.789 1.00 94.08 C +ATOM 2865 O VAL A 362 9.852 3.854 -10.567 1.00 94.08 O +ATOM 2866 CG1 VAL A 362 12.946 4.576 -11.440 1.00 94.08 C +ATOM 2867 CG2 VAL A 362 13.069 4.093 -13.902 1.00 94.08 C +ATOM 2868 N VAL A 363 9.699 5.818 -11.571 1.00 95.08 N +ATOM 2869 CA VAL A 363 9.040 6.444 -10.429 1.00 95.08 C +ATOM 2870 C VAL A 363 7.686 5.781 -10.186 1.00 95.08 C +ATOM 2871 CB VAL A 363 8.859 7.963 -10.641 1.00 95.08 C +ATOM 2872 O VAL A 363 7.292 5.564 -9.038 1.00 95.08 O +ATOM 2873 CG1 VAL A 363 7.999 8.565 -9.531 1.00 95.08 C +ATOM 2874 CG2 VAL A 363 10.218 8.658 -10.704 1.00 95.08 C +ATOM 2875 N SER A 364 7.036 5.441 -11.255 1.00 96.12 N +ATOM 2876 CA SER A 364 5.745 4.772 -11.136 1.00 96.12 C +ATOM 2877 C SER A 364 5.887 3.410 -10.466 1.00 96.12 C +ATOM 2878 CB SER A 364 5.096 4.609 -12.511 1.00 96.12 C +ATOM 2879 O SER A 364 5.160 3.097 -9.522 1.00 96.12 O +ATOM 2880 OG SER A 364 3.879 3.889 -12.411 1.00 96.12 O +ATOM 2881 N ASP A 365 6.805 2.605 -10.878 1.00 96.21 N +ATOM 2882 CA ASP A 365 7.025 1.291 -10.282 1.00 96.21 C +ATOM 2883 C ASP A 365 7.359 1.410 -8.797 1.00 96.21 C +ATOM 2884 CB ASP A 365 8.144 0.549 -11.015 1.00 96.21 C +ATOM 2885 O ASP A 365 6.841 0.650 -7.976 1.00 96.21 O +ATOM 2886 CG ASP A 365 7.690 -0.058 -12.331 1.00 96.21 C +ATOM 2887 OD1 ASP A 365 6.497 0.065 -12.680 1.00 96.21 O +ATOM 2888 OD2 ASP A 365 8.534 -0.668 -13.024 1.00 96.21 O +ATOM 2889 N PHE A 366 8.148 2.348 -8.544 1.00 95.53 N +ATOM 2890 CA PHE A 366 8.531 2.553 -7.152 1.00 95.53 C +ATOM 2891 C PHE A 366 7.337 3.013 -6.325 1.00 95.53 C +ATOM 2892 CB PHE A 366 9.666 3.577 -7.051 1.00 95.53 C +ATOM 2893 O PHE A 366 7.034 2.426 -5.283 1.00 95.53 O +ATOM 2894 CG PHE A 366 9.876 4.115 -5.661 1.00 95.53 C +ATOM 2895 CD1 PHE A 366 9.497 5.412 -5.338 1.00 95.53 C +ATOM 2896 CD2 PHE A 366 10.452 3.322 -4.677 1.00 95.53 C +ATOM 2897 CE1 PHE A 366 9.689 5.912 -4.052 1.00 95.53 C +ATOM 2898 CE2 PHE A 366 10.648 3.815 -3.390 1.00 95.53 C +ATOM 2899 CZ PHE A 366 10.267 5.111 -3.080 1.00 95.53 C +ATOM 2900 N THR A 367 6.711 4.044 -6.744 1.00 94.88 N +ATOM 2901 CA THR A 367 5.659 4.706 -5.981 1.00 94.88 C +ATOM 2902 C THR A 367 4.476 3.767 -5.761 1.00 94.88 C +ATOM 2903 CB THR A 367 5.176 5.986 -6.690 1.00 94.88 C +ATOM 2904 O THR A 367 4.008 3.604 -4.633 1.00 94.88 O +ATOM 2905 CG2 THR A 367 4.063 6.665 -5.899 1.00 94.88 C +ATOM 2906 OG1 THR A 367 6.275 6.895 -6.823 1.00 94.88 O +ATOM 2907 N LEU A 368 4.049 3.183 -6.792 1.00 95.56 N +ATOM 2908 CA LEU A 368 2.834 2.381 -6.712 1.00 95.56 C +ATOM 2909 C LEU A 368 3.076 1.105 -5.913 1.00 95.56 C +ATOM 2910 CB LEU A 368 2.330 2.030 -8.115 1.00 95.56 C +ATOM 2911 O LEU A 368 2.236 0.706 -5.103 1.00 95.56 O +ATOM 2912 CG LEU A 368 1.923 3.207 -9.003 1.00 95.56 C +ATOM 2913 CD1 LEU A 368 1.318 2.701 -10.308 1.00 95.56 C +ATOM 2914 CD2 LEU A 368 0.944 4.117 -8.271 1.00 95.56 C +ATOM 2915 N ASN A 369 4.190 0.483 -6.106 1.00 95.34 N +ATOM 2916 CA ASN A 369 4.513 -0.689 -5.300 1.00 95.34 C +ATOM 2917 C ASN A 369 4.709 -0.323 -3.831 1.00 95.34 C +ATOM 2918 CB ASN A 369 5.761 -1.387 -5.844 1.00 95.34 C +ATOM 2919 O ASN A 369 4.368 -1.103 -2.941 1.00 95.34 O +ATOM 2920 CG ASN A 369 5.449 -2.339 -6.982 1.00 95.34 C +ATOM 2921 ND2 ASN A 369 5.679 -1.890 -8.210 1.00 95.34 N +ATOM 2922 OD1 ASN A 369 5.003 -3.467 -6.759 1.00 95.34 O +ATOM 2923 N SER A 370 5.226 0.790 -3.598 1.00 92.50 N +ATOM 2924 CA SER A 370 5.398 1.241 -2.220 1.00 92.50 C +ATOM 2925 C SER A 370 4.052 1.488 -1.548 1.00 92.50 C +ATOM 2926 CB SER A 370 6.242 2.515 -2.174 1.00 92.50 C +ATOM 2927 O SER A 370 3.855 1.122 -0.388 1.00 92.50 O +ATOM 2928 OG SER A 370 7.563 2.261 -2.621 1.00 92.50 O +ATOM 2929 N ILE A 371 3.192 2.094 -2.276 1.00 92.16 N +ATOM 2930 CA ILE A 371 1.854 2.344 -1.751 1.00 92.16 C +ATOM 2931 C ILE A 371 1.144 1.017 -1.493 1.00 92.16 C +ATOM 2932 CB ILE A 371 1.023 3.219 -2.717 1.00 92.16 C +ATOM 2933 O ILE A 371 0.542 0.824 -0.434 1.00 92.16 O +ATOM 2934 CG1 ILE A 371 1.608 4.634 -2.794 1.00 92.16 C +ATOM 2935 CG2 ILE A 371 -0.446 3.256 -2.283 1.00 92.16 C +ATOM 2936 CD1 ILE A 371 0.987 5.502 -3.879 1.00 92.16 C +ATOM 2937 N LEU A 372 1.250 0.141 -2.404 1.00 92.96 N +ATOM 2938 CA LEU A 372 0.640 -1.175 -2.250 1.00 92.96 C +ATOM 2939 C LEU A 372 1.211 -1.900 -1.036 1.00 92.96 C +ATOM 2940 CB LEU A 372 0.857 -2.017 -3.510 1.00 92.96 C +ATOM 2941 O LEU A 372 0.470 -2.537 -0.283 1.00 92.96 O +ATOM 2942 CG LEU A 372 -0.075 -1.727 -4.688 1.00 92.96 C +ATOM 2943 CD1 LEU A 372 0.347 -2.537 -5.909 1.00 92.96 C +ATOM 2944 CD2 LEU A 372 -1.522 -2.028 -4.313 1.00 92.96 C +ATOM 2945 N ALA A 373 2.456 -1.738 -0.916 1.00 91.88 N +ATOM 2946 CA ALA A 373 3.107 -2.377 0.225 1.00 91.88 C +ATOM 2947 C ALA A 373 2.573 -1.821 1.543 1.00 91.88 C +ATOM 2948 CB ALA A 373 4.620 -2.192 0.147 1.00 91.88 C +ATOM 2949 O ALA A 373 2.342 -2.573 2.493 1.00 91.88 O +ATOM 2950 N SER A 374 2.372 -0.604 1.570 1.00 87.67 N +ATOM 2951 CA SER A 374 1.825 0.017 2.771 1.00 87.67 C +ATOM 2952 C SER A 374 0.407 -0.471 3.049 1.00 87.67 C +ATOM 2953 CB SER A 374 1.832 1.541 2.637 1.00 87.67 C +ATOM 2954 O SER A 374 0.051 -0.737 4.199 1.00 87.67 O +ATOM 2955 OG SER A 374 3.159 2.036 2.591 1.00 87.67 O +ATOM 2956 N ILE A 375 -0.334 -0.556 2.018 1.00 89.44 N +ATOM 2957 CA ILE A 375 -1.689 -1.084 2.133 1.00 89.44 C +ATOM 2958 C ILE A 375 -1.641 -2.527 2.629 1.00 89.44 C +ATOM 2959 CB ILE A 375 -2.442 -1.005 0.786 1.00 89.44 C +ATOM 2960 O ILE A 375 -2.371 -2.899 3.551 1.00 89.44 O +ATOM 2961 CG1 ILE A 375 -2.754 0.454 0.433 1.00 89.44 C +ATOM 2962 CG2 ILE A 375 -3.723 -1.843 0.834 1.00 89.44 C +ATOM 2963 CD1 ILE A 375 -3.253 0.653 -0.991 1.00 89.44 C +ATOM 2964 N GLU A 376 -0.751 -3.250 2.044 1.00 92.30 N +ATOM 2965 CA GLU A 376 -0.632 -4.662 2.394 1.00 92.30 C +ATOM 2966 C GLU A 376 -0.150 -4.836 3.831 1.00 92.30 C +ATOM 2967 CB GLU A 376 0.318 -5.377 1.430 1.00 92.30 C +ATOM 2968 O GLU A 376 -0.606 -5.735 4.540 1.00 92.30 O +ATOM 2969 CG GLU A 376 -0.232 -5.524 0.019 1.00 92.30 C +ATOM 2970 CD GLU A 376 -1.498 -6.365 -0.046 1.00 92.30 C +ATOM 2971 OE1 GLU A 376 -2.480 -5.933 -0.692 1.00 92.30 O +ATOM 2972 OE2 GLU A 376 -1.507 -7.463 0.553 1.00 92.30 O +ATOM 2973 N TYR A 377 0.724 -3.961 4.183 1.00 88.12 N +ATOM 2974 CA TYR A 377 1.183 -3.979 5.567 1.00 88.12 C +ATOM 2975 C TYR A 377 0.015 -3.812 6.532 1.00 88.12 C +ATOM 2976 CB TYR A 377 2.218 -2.875 5.805 1.00 88.12 C +ATOM 2977 O TYR A 377 -0.095 -4.547 7.516 1.00 88.12 O +ATOM 2978 CG TYR A 377 2.625 -2.725 7.251 1.00 88.12 C +ATOM 2979 CD1 TYR A 377 1.977 -1.818 8.086 1.00 88.12 C +ATOM 2980 CD2 TYR A 377 3.658 -3.488 7.784 1.00 88.12 C +ATOM 2981 CE1 TYR A 377 2.349 -1.675 9.419 1.00 88.12 C +ATOM 2982 CE2 TYR A 377 4.039 -3.354 9.115 1.00 88.12 C +ATOM 2983 OH TYR A 377 3.752 -2.308 11.242 1.00 88.12 O +ATOM 2984 CZ TYR A 377 3.379 -2.446 9.923 1.00 88.12 C +ATOM 2985 N THR A 378 -0.842 -2.913 6.242 1.00 85.30 N +ATOM 2986 CA THR A 378 -1.980 -2.678 7.123 1.00 85.30 C +ATOM 2987 C THR A 378 -2.906 -3.890 7.145 1.00 85.30 C +ATOM 2988 CB THR A 378 -2.772 -1.430 6.691 1.00 85.30 C +ATOM 2989 O THR A 378 -3.445 -4.247 8.195 1.00 85.30 O +ATOM 2990 CG2 THR A 378 -1.874 -0.199 6.638 1.00 85.30 C +ATOM 2991 OG1 THR A 378 -3.335 -1.655 5.393 1.00 85.30 O +ATOM 2992 N LYS A 379 -3.040 -4.558 6.100 1.00 87.93 N +ATOM 2993 CA LYS A 379 -3.927 -5.714 6.011 1.00 87.93 C +ATOM 2994 C LYS A 379 -3.362 -6.902 6.784 1.00 87.93 C +ATOM 2995 CB LYS A 379 -4.158 -6.101 4.549 1.00 87.93 C +ATOM 2996 O LYS A 379 -4.094 -7.589 7.498 1.00 87.93 O +ATOM 2997 CG LYS A 379 -4.997 -5.101 3.769 1.00 87.93 C +ATOM 2998 CD LYS A 379 -5.228 -5.562 2.336 1.00 87.93 C +ATOM 2999 CE LYS A 379 -6.094 -4.577 1.562 1.00 87.93 C +ATOM 3000 NZ LYS A 379 -6.372 -5.054 0.175 1.00 87.93 N +ATOM 3001 N LEU A 380 -2.110 -7.011 6.738 1.00 88.29 N +ATOM 3002 CA LEU A 380 -1.498 -8.214 7.291 1.00 88.29 C +ATOM 3003 C LEU A 380 -1.145 -8.017 8.762 1.00 88.29 C +ATOM 3004 CB LEU A 380 -0.244 -8.591 6.499 1.00 88.29 C +ATOM 3005 O LEU A 380 -1.201 -8.963 9.550 1.00 88.29 O +ATOM 3006 CG LEU A 380 -0.466 -9.058 5.059 1.00 88.29 C +ATOM 3007 CD1 LEU A 380 0.871 -9.285 4.363 1.00 88.29 C +ATOM 3008 CD2 LEU A 380 -1.312 -10.327 5.033 1.00 88.29 C +ATOM 3009 N PHE A 381 -0.950 -6.785 9.142 1.00 83.23 N +ATOM 3010 CA PHE A 381 -0.292 -6.685 10.439 1.00 83.23 C +ATOM 3011 C PHE A 381 -1.068 -5.760 11.370 1.00 83.23 C +ATOM 3012 CB PHE A 381 1.146 -6.181 10.277 1.00 83.23 C +ATOM 3013 O PHE A 381 -1.073 -5.958 12.587 1.00 83.23 O +ATOM 3014 CG PHE A 381 2.006 -7.067 9.417 1.00 83.23 C +ATOM 3015 CD1 PHE A 381 2.527 -8.253 9.920 1.00 83.23 C +ATOM 3016 CD2 PHE A 381 2.295 -6.713 8.106 1.00 83.23 C +ATOM 3017 CE1 PHE A 381 3.324 -9.075 9.127 1.00 83.23 C +ATOM 3018 CE2 PHE A 381 3.091 -7.529 7.307 1.00 83.23 C +ATOM 3019 CZ PHE A 381 3.605 -8.709 7.820 1.00 83.23 C +ATOM 3020 N THR A 382 -1.733 -4.836 10.830 1.00 77.00 N +ATOM 3021 CA THR A 382 -2.277 -3.830 11.736 1.00 77.00 C +ATOM 3022 C THR A 382 -3.803 -3.849 11.712 1.00 77.00 C +ATOM 3023 CB THR A 382 -1.773 -2.421 11.373 1.00 77.00 C +ATOM 3024 O THR A 382 -4.449 -3.492 12.699 1.00 77.00 O +ATOM 3025 CG2 THR A 382 -0.264 -2.310 11.564 1.00 77.00 C +ATOM 3026 OG1 THR A 382 -2.092 -2.144 10.003 1.00 77.00 O +ATOM 3027 N GLY A 383 -4.322 -4.245 10.593 1.00 80.59 N +ATOM 3028 CA GLY A 383 -5.765 -4.193 10.421 1.00 80.59 C +ATOM 3029 C GLY A 383 -6.240 -2.917 9.753 1.00 80.59 C +ATOM 3030 O GLY A 383 -5.430 -2.066 9.380 1.00 80.59 O +ATOM 3031 N ASP A 384 -7.540 -2.806 9.599 1.00 82.83 N +ATOM 3032 CA ASP A 384 -8.165 -1.679 8.912 1.00 82.83 C +ATOM 3033 C ASP A 384 -7.932 -0.375 9.672 1.00 82.83 C +ATOM 3034 CB ASP A 384 -9.665 -1.924 8.734 1.00 82.83 C +ATOM 3035 O ASP A 384 -8.327 -0.248 10.833 1.00 82.83 O +ATOM 3036 CG ASP A 384 -10.328 -0.903 7.827 1.00 82.83 C +ATOM 3037 OD1 ASP A 384 -9.729 0.163 7.567 1.00 82.83 O +ATOM 3038 OD2 ASP A 384 -11.462 -1.166 7.369 1.00 82.83 O +ATOM 3039 N PRO A 385 -7.322 0.584 8.985 1.00 80.89 N +ATOM 3040 CA PRO A 385 -7.040 1.865 9.639 1.00 80.89 C +ATOM 3041 C PRO A 385 -8.303 2.563 10.138 1.00 80.89 C +ATOM 3042 CB PRO A 385 -6.365 2.683 8.535 1.00 80.89 C +ATOM 3043 O PRO A 385 -8.232 3.410 11.032 1.00 80.89 O +ATOM 3044 CG PRO A 385 -5.735 1.666 7.637 1.00 80.89 C +ATOM 3045 CD PRO A 385 -6.616 0.450 7.603 1.00 80.89 C +ATOM 3046 N ALA A 386 -9.428 2.224 9.602 1.00 83.70 N +ATOM 3047 CA ALA A 386 -10.697 2.850 9.963 1.00 83.70 C +ATOM 3048 C ALA A 386 -11.074 2.531 11.407 1.00 83.70 C +ATOM 3049 CB ALA A 386 -11.804 2.396 9.015 1.00 83.70 C +ATOM 3050 O ALA A 386 -11.915 3.211 12.001 1.00 83.70 O +ATOM 3051 N ASN A 387 -10.425 1.555 11.963 1.00 80.98 N +ATOM 3052 CA ASN A 387 -10.725 1.141 13.330 1.00 80.98 C +ATOM 3053 C ASN A 387 -10.006 2.016 14.352 1.00 80.98 C +ATOM 3054 CB ASN A 387 -10.357 -0.330 13.537 1.00 80.98 C +ATOM 3055 O ASN A 387 -10.215 1.869 15.558 1.00 80.98 O +ATOM 3056 CG ASN A 387 -11.333 -1.277 12.867 1.00 80.98 C +ATOM 3057 ND2 ASN A 387 -10.806 -2.295 12.197 1.00 80.98 N +ATOM 3058 OD1 ASN A 387 -12.550 -1.094 12.950 1.00 80.98 O +ATOM 3059 N TYR A 388 -9.251 2.964 13.798 1.00 78.71 N +ATOM 3060 CA TYR A 388 -8.479 3.812 14.699 1.00 78.71 C +ATOM 3061 C TYR A 388 -9.029 5.234 14.714 1.00 78.71 C +ATOM 3062 CB TYR A 388 -7.003 3.828 14.290 1.00 78.71 C +ATOM 3063 O TYR A 388 -9.710 5.653 13.776 1.00 78.71 O +ATOM 3064 CG TYR A 388 -6.355 2.465 14.303 1.00 78.71 C +ATOM 3065 CD1 TYR A 388 -5.687 2.000 15.434 1.00 78.71 C +ATOM 3066 CD2 TYR A 388 -6.409 1.639 13.186 1.00 78.71 C +ATOM 3067 CE1 TYR A 388 -5.086 0.746 15.450 1.00 78.71 C +ATOM 3068 CE2 TYR A 388 -5.812 0.382 13.190 1.00 78.71 C +ATOM 3069 OH TYR A 388 -4.562 -1.298 14.336 1.00 78.71 O +ATOM 3070 CZ TYR A 388 -5.155 -0.055 14.326 1.00 78.71 C +ATOM 3071 N LYS A 389 -8.730 5.964 15.820 1.00 71.00 N +ATOM 3072 CA LYS A 389 -9.253 7.313 16.011 1.00 71.00 C +ATOM 3073 C LYS A 389 -8.769 8.252 14.910 1.00 71.00 C +ATOM 3074 CB LYS A 389 -8.846 7.858 17.381 1.00 71.00 C +ATOM 3075 O LYS A 389 -9.551 9.031 14.362 1.00 71.00 O +ATOM 3076 CG LYS A 389 -9.374 9.255 17.674 1.00 71.00 C +ATOM 3077 CD LYS A 389 -8.917 9.750 19.040 1.00 71.00 C +ATOM 3078 CE LYS A 389 -9.341 11.192 19.284 1.00 71.00 C +ATOM 3079 NZ LYS A 389 -8.851 11.699 20.600 1.00 71.00 N +ATOM 3080 N ASN A 390 -7.520 8.191 14.672 1.00 71.86 N +ATOM 3081 CA ASN A 390 -6.841 8.961 13.636 1.00 71.86 C +ATOM 3082 C ASN A 390 -5.507 8.328 13.250 1.00 71.86 C +ATOM 3083 CB ASN A 390 -6.630 10.406 14.092 1.00 71.86 C +ATOM 3084 O ASN A 390 -5.129 7.288 13.793 1.00 71.86 O +ATOM 3085 CG ASN A 390 -5.891 10.500 15.412 1.00 71.86 C +ATOM 3086 ND2 ASN A 390 -6.411 11.311 16.326 1.00 71.86 N +ATOM 3087 OD1 ASN A 390 -4.861 9.850 15.609 1.00 71.86 O +ATOM 3088 N MET A 391 -4.803 8.950 12.305 1.00 69.43 N +ATOM 3089 CA MET A 391 -3.568 8.354 11.802 1.00 69.43 C +ATOM 3090 C MET A 391 -2.482 8.368 12.872 1.00 69.43 C +ATOM 3091 CB MET A 391 -3.083 9.094 10.554 1.00 69.43 C +ATOM 3092 O MET A 391 -1.637 7.472 12.917 1.00 69.43 O +ATOM 3093 CG MET A 391 -3.862 8.750 9.295 1.00 69.43 C +ATOM 3094 SD MET A 391 -3.870 6.949 8.945 1.00 69.43 S +ATOM 3095 CE MET A 391 -2.111 6.684 8.589 1.00 69.43 C +ATOM 3096 N VAL A 392 -2.634 9.378 13.667 1.00 70.99 N +ATOM 3097 CA VAL A 392 -1.685 9.448 14.772 1.00 70.99 C +ATOM 3098 C VAL A 392 -1.884 8.252 15.701 1.00 70.99 C +ATOM 3099 CB VAL A 392 -1.831 10.767 15.563 1.00 70.99 C +ATOM 3100 O VAL A 392 -0.917 7.590 16.087 1.00 70.99 O +ATOM 3101 CG1 VAL A 392 -0.951 10.749 16.812 1.00 70.99 C +ATOM 3102 CG2 VAL A 392 -1.481 11.961 14.677 1.00 70.99 C +ATOM 3103 N ASP A 393 -3.142 7.997 15.987 1.00 67.37 N +ATOM 3104 CA ASP A 393 -3.493 6.836 16.799 1.00 67.37 C +ATOM 3105 C ASP A 393 -3.101 5.537 16.098 1.00 67.37 C +ATOM 3106 CB ASP A 393 -4.991 6.833 17.112 1.00 67.37 C +ATOM 3107 O ASP A 393 -2.585 4.615 16.732 1.00 67.37 O +ATOM 3108 CG ASP A 393 -5.380 5.784 18.138 1.00 67.37 C +ATOM 3109 OD1 ASP A 393 -4.807 5.775 19.249 1.00 67.37 O +ATOM 3110 OD2 ASP A 393 -6.266 4.957 17.832 1.00 67.37 O +ATOM 3111 N PHE A 394 -3.373 5.460 14.861 1.00 71.70 N +ATOM 3112 CA PHE A 394 -2.991 4.312 14.046 1.00 71.70 C +ATOM 3113 C PHE A 394 -1.496 4.039 14.160 1.00 71.70 C +ATOM 3114 CB PHE A 394 -3.372 4.542 12.580 1.00 71.70 C +ATOM 3115 O PHE A 394 -1.086 2.914 14.452 1.00 71.70 O +ATOM 3116 CG PHE A 394 -2.857 3.481 11.645 1.00 71.70 C +ATOM 3117 CD1 PHE A 394 -1.749 3.721 10.842 1.00 71.70 C +ATOM 3118 CD2 PHE A 394 -3.481 2.243 11.570 1.00 71.70 C +ATOM 3119 CE1 PHE A 394 -1.270 2.741 9.976 1.00 71.70 C +ATOM 3120 CE2 PHE A 394 -3.009 1.258 10.707 1.00 71.70 C +ATOM 3121 CZ PHE A 394 -1.904 1.509 9.910 1.00 71.70 C +ATOM 3122 N PHE A 395 -0.706 5.031 14.026 1.00 67.32 N +ATOM 3123 CA PHE A 395 0.745 4.879 14.043 1.00 67.32 C +ATOM 3124 C PHE A 395 1.232 4.493 15.435 1.00 67.32 C +ATOM 3125 CB PHE A 395 1.427 6.172 13.588 1.00 67.32 C +ATOM 3126 O PHE A 395 2.222 3.771 15.573 1.00 67.32 O +ATOM 3127 CG PHE A 395 1.375 6.396 12.101 1.00 67.32 C +ATOM 3128 CD1 PHE A 395 2.003 5.514 11.229 1.00 67.32 C +ATOM 3129 CD2 PHE A 395 0.697 7.487 11.574 1.00 67.32 C +ATOM 3130 CE1 PHE A 395 1.956 5.718 9.852 1.00 67.32 C +ATOM 3131 CE2 PHE A 395 0.646 7.698 10.199 1.00 67.32 C +ATOM 3132 CZ PHE A 395 1.277 6.813 9.340 1.00 67.32 C +ATOM 3133 N LYS A 396 0.490 5.016 16.462 1.00 64.61 N +ATOM 3134 CA LYS A 396 0.859 4.694 17.837 1.00 64.61 C +ATOM 3135 C LYS A 396 0.575 3.228 18.154 1.00 64.61 C +ATOM 3136 CB LYS A 396 0.111 5.596 18.820 1.00 64.61 C +ATOM 3137 O LYS A 396 1.250 2.626 18.991 1.00 64.61 O +ATOM 3138 CG LYS A 396 0.632 7.025 18.868 1.00 64.61 C +ATOM 3139 CD LYS A 396 -0.128 7.863 19.888 1.00 64.61 C +ATOM 3140 CE LYS A 396 0.368 9.302 19.911 1.00 64.61 C +ATOM 3141 NZ LYS A 396 -0.411 10.142 20.870 1.00 64.61 N +ATOM 3142 N ARG A 397 -0.465 2.667 17.452 1.00 62.83 N +ATOM 3143 CA ARG A 397 -0.947 1.336 17.809 1.00 62.83 C +ATOM 3144 C ARG A 397 -0.358 0.275 16.885 1.00 62.83 C +ATOM 3145 CB ARG A 397 -2.475 1.286 17.758 1.00 62.83 C +ATOM 3146 O ARG A 397 -0.669 -0.911 17.016 1.00 62.83 O +ATOM 3147 CG ARG A 397 -3.155 2.129 18.825 1.00 62.83 C +ATOM 3148 CD ARG A 397 -4.671 2.007 18.759 1.00 62.83 C +ATOM 3149 NE ARG A 397 -5.326 2.913 19.698 1.00 62.83 N +ATOM 3150 NH1 ARG A 397 -5.758 1.290 21.283 1.00 62.83 N +ATOM 3151 NH2 ARG A 397 -6.403 3.458 21.652 1.00 62.83 N +ATOM 3152 CZ ARG A 397 -5.827 2.552 20.875 1.00 62.83 C +ATOM 3153 N VAL A 398 0.169 0.769 15.743 1.00 61.02 N +ATOM 3154 CA VAL A 398 0.941 -0.216 14.993 1.00 61.02 C +ATOM 3155 C VAL A 398 1.840 -1.001 15.945 1.00 61.02 C +ATOM 3156 CB VAL A 398 1.789 0.451 13.887 1.00 61.02 C +ATOM 3157 O VAL A 398 2.588 -0.413 16.730 1.00 61.02 O +ATOM 3158 CG1 VAL A 398 2.625 -0.592 13.146 1.00 61.02 C +ATOM 3159 CG2 VAL A 398 0.892 1.212 12.913 1.00 61.02 C +ATOM 3160 N PRO A 399 1.289 -2.261 16.368 1.00 51.26 N +ATOM 3161 CA PRO A 399 2.029 -3.061 17.347 1.00 51.26 C +ATOM 3162 C PRO A 399 3.515 -2.714 17.389 1.00 51.26 C +ATOM 3163 CB PRO A 399 1.817 -4.497 16.861 1.00 51.26 C +ATOM 3164 O PRO A 399 4.105 -2.383 16.357 1.00 51.26 O +ATOM 3165 CG PRO A 399 0.765 -4.391 15.804 1.00 51.26 C +ATOM 3166 CD PRO A 399 0.664 -2.956 15.373 1.00 51.26 C +ATOM 3167 N ALA A 400 3.863 -1.975 18.438 1.00 45.45 N +ATOM 3168 CA ALA A 400 5.198 -1.666 18.945 1.00 45.45 C +ATOM 3169 C ALA A 400 6.264 -2.475 18.212 1.00 45.45 C +ATOM 3170 CB ALA A 400 5.271 -1.932 20.447 1.00 45.45 C +ATOM 3171 O ALA A 400 6.238 -3.708 18.230 1.00 45.45 O +ATOM 3172 N THR A 401 6.259 -2.451 16.849 1.00 41.58 N +ATOM 3173 CA THR A 401 7.392 -2.921 16.060 1.00 41.58 C +ATOM 3174 C THR A 401 8.696 -2.762 16.837 1.00 41.58 C +ATOM 3175 CB THR A 401 7.494 -2.165 14.722 1.00 41.58 C +ATOM 3176 O THR A 401 9.779 -2.996 16.297 1.00 41.58 O +ATOM 3177 CG2 THR A 401 6.336 -2.525 13.798 1.00 41.58 C +ATOM 3178 OG1 THR A 401 7.467 -0.754 14.974 1.00 41.58 O +ATOM 3179 N TYR A 402 8.831 -2.766 18.315 1.00 43.69 N +ATOM 3180 CA TYR A 402 10.116 -2.749 19.005 1.00 43.69 C +ATOM 3181 C TYR A 402 10.186 -3.853 20.053 1.00 43.69 C +ATOM 3182 CB TYR A 402 10.355 -1.387 19.664 1.00 43.69 C +ATOM 3183 O TYR A 402 9.163 -4.438 20.418 1.00 43.69 O +ATOM 3184 CG TYR A 402 10.044 -0.215 18.766 1.00 43.69 C +ATOM 3185 CD1 TYR A 402 10.971 0.235 17.828 1.00 43.69 C +ATOM 3186 CD2 TYR A 402 8.823 0.445 18.853 1.00 43.69 C +ATOM 3187 CE1 TYR A 402 10.689 1.316 17.000 1.00 43.69 C +ATOM 3188 CE2 TYR A 402 8.530 1.527 18.029 1.00 43.69 C +ATOM 3189 OH TYR A 402 9.183 3.025 16.289 1.00 43.69 O +ATOM 3190 CZ TYR A 402 9.468 1.954 17.107 1.00 43.69 C +ATOM 3191 N THR A 403 11.404 -4.423 20.223 1.00 36.54 N +ATOM 3192 CA THR A 403 11.877 -5.266 21.315 1.00 36.54 C +ATOM 3193 C THR A 403 12.108 -4.438 22.576 1.00 36.54 C +ATOM 3194 CB THR A 403 13.178 -5.997 20.933 1.00 36.54 C +ATOM 3195 O THR A 403 12.564 -3.295 22.500 1.00 36.54 O +ATOM 3196 CG2 THR A 403 12.897 -7.161 19.988 1.00 36.54 C +ATOM 3197 OG1 THR A 403 14.065 -5.076 20.287 1.00 36.54 O +ATOM 3198 N ASN A 404 11.212 -4.399 23.622 1.00 28.91 N +ATOM 3199 CA ASN A 404 11.607 -3.880 24.927 1.00 28.91 C +ATOM 3200 C ASN A 404 13.041 -4.270 25.274 1.00 28.91 C +ATOM 3201 CB ASN A 404 10.646 -4.369 26.013 1.00 28.91 C +ATOM 3202 O ASN A 404 13.471 -5.389 24.988 1.00 28.91 O +ATOM 3203 CG ASN A 404 9.350 -3.582 26.043 1.00 28.91 C +ATOM 3204 ND2 ASN A 404 8.355 -4.105 26.750 1.00 28.91 N +ATOM 3205 OD1 ASN A 404 9.244 -2.513 25.436 1.00 28.91 O +TER 3206 ASN A 404 +ENDMDL +END diff --git a/modelcenter/PP-HelixFold/APP/app.py b/modelcenter/PP-HelixFold/APP/app.py new file mode 100644 index 0000000000000000000000000000000000000000..41b8eb7fad96a55e0030ddc0286e91150b8e991a --- /dev/null +++ b/modelcenter/PP-HelixFold/APP/app.py @@ -0,0 +1,97 @@ +!pip install -q gradio + +import gradio as gr +import os + +def molecule(input_pdb): + + mol = read_mol(input_pdb) + + x = ( + """ + + + + + + + +
+ + + """ + ) + + return f"""""" + +def get_pdb(pdb_code="", filepath=""): + if pdb_code is None or pdb_code == "": + try: + return filepath.name + except AttributeError as e: + return None + else: + os.system(f"wget -qnc https://files.rcsb.org/view/{pdb_code}.pdb") + return f"{pdb_code}.pdb" + + +def read_mol(molpath): + with open(molpath, "r") as fp: + lines = fp.readlines() + mol = "" + for l in lines: + mol += l + return mol + + + +def update(fastaName='',fastaContent=''): + if(fastaName==''): + return None + else: + return molecule(fastaName+"_pred.pdb") + + +demo = gr.Blocks() +with demo: + gr.Markdown("# PDB viewer using 3Dmol.js") + with gr.Row(): + with gr.Box(): + fastaName = gr.Textbox(interactive=False,label='Fasta label') + fastaContent = gr.Textbox(interactive=False,label='Fasta content') + gr.Examples([["T1026", read_mol( "T1026.fasta")],["T1037", read_mol("T1037.fasta")]], [fastaName,fastaContent]) + btn = gr.Button("View") + mol = gr.HTML() + btn.click(fn=update, inputs=[fastaName,fastaContent], outputs=mol) +demo.launch() \ No newline at end of file diff --git a/modelcenter/PP-HelixFold/APP/app.yml b/modelcenter/PP-HelixFold/APP/app.yml new file mode 100644 index 0000000000000000000000000000000000000000..76236db342c6ee4fc62cd51b3ddd6c9288e25a56 --- /dev/null +++ b/modelcenter/PP-HelixFold/APP/app.yml @@ -0,0 +1,11 @@ +【PP-HelixFold-App-YAML】 + +APP_Info: + title: PP-HelixFold-App + colorFrom: blue + colorTo: yellow + sdk: gradio + sdk_version: 3.4.1 + app_file: app.py + license: apache-2.0 + device: gpu \ No newline at end of file diff --git a/modelcenter/PP-HelixFold/APP/requirements.txt b/modelcenter/PP-HelixFold/APP/requirements.txt new file mode 100644 index 0000000000000000000000000000000000000000..9dfc4b72bf6912e3cddfb43ecb8c6a49e9699f5c --- /dev/null +++ b/modelcenter/PP-HelixFold/APP/requirements.txt @@ -0,0 +1,2 @@ +gradio +paddlepaddle diff --git a/modelcenter/PP-HelixFold/benchmark_cn.md b/modelcenter/PP-HelixFold/benchmark_cn.md new file mode 100644 index 0000000000000000000000000000000000000000..ffe7c650c14d1e17bc5f5a02a37b50bbde0b4740 --- /dev/null +++ b/modelcenter/PP-HelixFold/benchmark_cn.md @@ -0,0 +1,22 @@ +## 1. 推理 Benchmark + +### 1.1 软硬件环境 +PP-Helixfold模型的推理测试是在NVIDIA A100 (40G)单卡上完成的,batch size大小为1。为了能复现我们论文中报告的实验结果,需在特定环境下进行实验。 + +* Python: 3.7 +* CUDA 11.2 +* CUDNN 8.10.1 +* NCCL 2.12.12. + +### 1.2 数据集 +PP-HelixFold模型使用的训练样本25%来自RCSB PDB,75%来自自蒸馏数据集。测试时,我们搜集了87个CASP14的结构域蛋白和371个从2021-09-04到2022-02-19的CAMEO蛋白作为测试集。 + +### 1.3 模型效果 +通过与原版AlphaFold2模型和哥伦比亚大学Mohammed AlQuraishi教授团队基于PyTorch复现的OpenFold模型的性能对比测试显示,PP-HelixFold模型的训练性能相比AlphaFold2提升106.97%,相比OpenFold提升104.86%,将训练耗时从约11天减少到7.5天,并且在使用混合并行时能进一步降低至5.3天。在性能大幅度提升的同时,PP-HelixFold从头端到端完整训练可以达到AlphaFold2论文媲美的精度。在包含87个蛋白的CASP14数据集和371个蛋白的CAMEO数据集上,PP-HelixFold模型的TM-score指标分别达到0.8771和0.8885,与原版AlphaFold2准确率相当甚至更优。 + +![](https://github.com/PaddlePaddle/PaddleHelix/blob/dev/.github/HelixFold_computational_performance.png) +![](https://github.com/PaddlePaddle/PaddleHelix/blob/dev/.github/HelixFold_accuracy.png) + + +## 2. 相关使用说明 +请参考:https://github.com/PaddlePaddle/PaddleHelix/tree/dev/apps/protein_folding/helixfold diff --git a/modelcenter/PP-HelixFold/benchmark_en.md b/modelcenter/PP-HelixFold/benchmark_en.md new file mode 100644 index 0000000000000000000000000000000000000000..985ef63d12ff2a822d895434e1c2c6ab4b7183c1 --- /dev/null +++ b/modelcenter/PP-HelixFold/benchmark_en.md @@ -0,0 +1,22 @@ +## 1. Inference Benchmark + +### 1.1 Environment +The PP-Helixfold model's inference test is tested on single-card NVIDIA A100 (40G), batch size=1. To reproduce the results reported in our paper, specific environment settings are required as below. + +* Python: 3.7 +* CUDA 11.2 +* CUDNN 8.10.1 +* NCCL 2.12.12. + +### 1.2 Datasets +For training, the PP-Helixfold model uses 25% of samples from RCSB PDB and 75% of self-distillation samples. For evaluation, we collect 87 domain targets from CASP14 and 371 protein targets from CAMEO, ranging from 2021-09-04 to 2022-02-19. + +### 1.3 Performance +Compared with the computational performance of AlphaFold2 reported in the paper and OpenFold implemented through PyTorch, PP-Helixfold reduces the training time from about 11 days to 7.5 days, and it can be further reduced to only 5.3 days when using hybrid parallelism. Training PP-Helixfold from scratch can achieve competitive accuracy with AlphaFold2. + +![](https://github.com/PaddlePaddle/PaddleHelix/blob/dev/.github/HelixFold_computational_performance.png) +![](https://github.com/PaddlePaddle/PaddleHelix/blob/dev/.github/HelixFold_accuracy.png) + + +## 2. Reference +Ref: https://github.com/PaddlePaddle/PaddleHelix/tree/dev/apps/protein_folding/helixfold diff --git a/modelcenter/PP-HelixFold/download_cn.md b/modelcenter/PP-HelixFold/download_cn.md new file mode 100644 index 0000000000000000000000000000000000000000..ebc558903692a00aa80f2aa7745627b908e42473 --- /dev/null +++ b/modelcenter/PP-HelixFold/download_cn.md @@ -0,0 +1,16 @@ +# 提供模型推理所需预训练模型参数和数据库下载: + +| 模型名称 | 模型简介 | 模型参数大小 | 下载地址 | +|--------|----|------------|------------| +| AlphaFold2_parameters | 蛋白质结构预测 | ~ 93M | [预训练模型](https://storage.googleapis.com/alphafold/alphafold_params_2021-10-27.tar) | + + +| 数据库名称 | 功能简介 | 数据库大小 | 下载地址 | +|--------|----|------------|------------| +| bfd | MSA搜索 | ~ 1.7 TB (解压前: 271.6 GB) | [bfd](https://storage.googleapis.com/alphafold-databases/casp14_versions/bfd_metaclust_clu_complete_id30_c90_final_seq.sorted_opt.tar.gz) | +| small_bfd | MSA搜索 | ~ 17 GB (解压前: 9.6 GB) | [small_bfd](https://storage.googleapis.com/alphafold-databases/reduced_dbs/bfd-first_non_consensus_sequences.fasta.gz) | +| mgnify | MSA搜索 | ~ 64 GB (解压前: 32.9 GB) | [mgnify](https://storage.googleapis.com/alphafold-databases/casp14_versions/mgy_clusters_2018_12.fa.gz) | +| uniclust30 | MSA搜索 | ~ 86 GB (解压前: 24.9 GB) | [uniclust30](https://storage.googleapis.com/alphafold-databases/casp14_versions/uniclust30_2018_08_hhsuite.tar.gz) | +| uniref90 | MSA搜索 | ~ 58 GB (解压前: 29.7 GB) | [uniref90](ftp://ftp.uniprot.org/pub/databases/uniprot/uniref/uniref90/uniref90.fasta.gz) | +| pdb70 | 模板搜索 | ~ 56 GB (解压前: 19.5 GB) | [pdb70](http://wwwuser.gwdg.de/~compbiol/data/hhsuite/databases/hhsuite_dbs/old-releases/pdb70_from_mmcif_200401.tar.gz) | +| pdb_mmcif | 模板搜索 | ~ 206 GB (解压前: 46 GB) | [pdb_mmcif](rsync.rcsb.org::ftp_data/structures/divided/mmCIF/) | \ No newline at end of file diff --git a/modelcenter/PP-HelixFold/download_en.md b/modelcenter/PP-HelixFold/download_en.md new file mode 100644 index 0000000000000000000000000000000000000000..21184e8de4e969d805643924161cd04129b422ec --- /dev/null +++ b/modelcenter/PP-HelixFold/download_en.md @@ -0,0 +1,16 @@ +# Download + +| model | task | model_size | download | +|--------|----|------------|------------| +| AlphaFold2_parameters | Protein_Structure_Prediction | ~ 93M | [pretrained_models](https://storage.googleapis.com/alphafold/alphafold_params_2021-10-27.tar) | + + +| database | task | size | download | +|--------|----|------------|------------| +| bfd | MSA_Search | ~ 1.7 TB (download: 271.6 GB) | [bfd](https://storage.googleapis.com/alphafold-databases/casp14_versions/bfd_metaclust_clu_complete_id30_c90_final_seq.sorted_opt.tar.gz) | +| small_bfd | MSA_Search | ~ 17 GB (download: 9.6 GB) | [small_bfd](https://storage.googleapis.com/alphafold-databases/reduced_dbs/bfd-first_non_consensus_sequences.fasta.gz) | +| mgnify | MSA_Search | ~ 64 GB (download: 32.9 GB) | [mgnify](https://storage.googleapis.com/alphafold-databases/casp14_versions/mgy_clusters_2018_12.fa.gz) | +| uniclust30 | MSA_Search | ~ 86 GB (download: 24.9 GB) | [uniclust30](https://storage.googleapis.com/alphafold-databases/casp14_versions/uniclust30_2018_08_hhsuite.tar.gz) | +| uniref90 | MSA_Search | ~ 58 GB (download: 29.7 GB) | [uniref90](ftp://ftp.uniprot.org/pub/databases/uniprot/uniref/uniref90/uniref90.fasta.gz) | +| pdb70 | Template_Search | ~ 56 GB (download: 19.5 GB) | [pdb70](http://wwwuser.gwdg.de/~compbiol/data/hhsuite/databases/hhsuite_dbs/old-releases/pdb70_from_mmcif_200401.tar.gz) | +| pdb_mmcif | Template_Search | ~ 206 GB (download: 46 GB) | [pdb_mmcif](rsync.rcsb.org::ftp_data/structures/divided/mmCIF/) | \ No newline at end of file diff --git a/modelcenter/PP-HelixFold/info.yaml b/modelcenter/PP-HelixFold/info.yaml new file mode 100644 index 0000000000000000000000000000000000000000..3d5bd61b7a9c257b99f35fa9d9c9dec5eac47295 --- /dev/null +++ b/modelcenter/PP-HelixFold/info.yaml @@ -0,0 +1,49 @@ +【PP-HelixFold-YAML】(注:本yaml样例仅供大家了解数据结构,研发同学会提供页面配置前端工具,到时候自动生成yaml文件) + +Model_Info: + name: "PP-HelixFold" + description: + description_en: + update_time: + icon: + from_repo: "PaddleHelix" + +Task: +- + tag: "生物计算" + tag_en: "Biological Computing" + sub_tag: "蛋白质结构预测" + sub_tag_en: "Protein Structure Prediction" + +Example: +- + tag: + tag_en: + sub_tag: + sub_tag_en: + title: + title_en: + url: + url_en: + + +Datasets: "RCSB PDB, Self-distillation datasets, CAMEO, CASP14" + +Pulisher: "Baidu" + +License: "Apache 2.0" + +Paper: +- + title: HelixFold: "An Efficient Implementation of AlphaFold2 using PaddlePaddle" + url: "https://arxiv.org/abs/2207.05477" +- + title: "Efficient AlphaFold2 Training using Parallel Evoformer and Branch Parallelism" + url: "https://arxiv.org/abs/2211.00235" + +IfTraining: 1 + +IfOnlineDemo: 1 + + + diff --git a/modelcenter/PP-HelixFold/introduction_cn.ipynb b/modelcenter/PP-HelixFold/introduction_cn.ipynb new file mode 100644 index 0000000000000000000000000000000000000000..5c9d2b2b9c0de3bfb49272de9d105730aa2a5226 --- /dev/null +++ b/modelcenter/PP-HelixFold/introduction_cn.ipynb @@ -0,0 +1,227 @@ +{ + "cells": [ + { + "cell_type": "markdown", + "id": "69972530-dd2b-443c-a1e1-6bcebe1c46b9", + "metadata": {}, + "source": [ + "## 1. PP-HelixFold模型简介\n", + "\n", + "AlphaFold2是一款高精度的蛋白质结构预测模型。PP-HelixFold基于PaddlePaddle框架在GPU和DCU上完整复现了AlphaFold2的训练和推理流程,并进一步提升模型性能与精度。通过与原版AlphaFold2模型和哥伦比亚大学Mohammed AlQuraishi教授团队基于PyTorch复现的OpenFold模型的性能对比测试显示,PP-HelixFold将训练耗时从约11天减少到7.5天。在性能大幅度提升的同时,PP-HelixFold从头端到端完整训练可以达到AlphaFold2论文媲美的精度。\n", + "\n", + "

\n", + "\n", + "\n", + "

\n", + "\n", + "\n", + "## 2. 技术创新\n", + "\n", + "* **分支并行与混合并行策略** PP-HelixFold创新性地提出**分支并行 (Branch Parallelism, BP)** 策略,将不同的网络模型分支放在不同的卡上并行计算,从而在initial training阶段大幅提高了模型并行效率和训练速度。并且,分支并行和已有的**动态轴并行 (Dynamic Axial Parallelism, DAP)** 和**数据并行 (Data Parallelism, DP)** 结合使用,通过BP-DAP-DP三维混合并行,进一步加快了模型的整体训练速度。\n", + "\n", + "* **算子融合优化技术和张量融合低频次访存技术** 针对AlphaFold2中Gated Self-Attention小算子组合CPU调度开销大、模型参数小、参数个数多的问题,PP-HelixFold将Gated Self-Attention整个模块融合用一个算子实现,将CPU调度开销优化到极致。同时,将数千个小张量融合成一个连续的大张量,模型参数的梯度、优化器状态都相应更新,大幅减少了访存次数、CPU调度开销和显存碎片,从而提升了训练速度。\n", + "\n", + "* **多维度显存优化方案** 采用Recompute、BFloat16、显存复用、Subbatch(Chunking)等技术,将显存峰值降低到40G以内,同时支持MSA长度为512、ExtraMSA长度为5120、残基序列长度为384的最大模型配置的微调训练,从而解决了模型结构深,中间结果计算量大,ExtraMSAStack输入过长等导致无法训练的问题。\n", + "\n", + "\n", + "## 3. 线上服务\n", + "\n", + "如果您想免安装直接尝试使用我们的模型,我们还提供了线上服务器[PaddleHelix HelixFold Forecast](https://paddlehelix.baidu.com/app/drug/protein/forecast)。\n", + "\n", + "\n", + "## 4. 环境需求\n", + "\n", + "为了能复现我们论文中报告的实验结果,需在特定环境下进行实验。\n", + "\n", + "- python: 3.7\n", + "- cuda: 11.2\n", + "- cudnn: 8.10.1\n", + "- nccl: 2.12.12\n", + "\n", + "\n", + "## 4. 模型如何使用\n", + "\n", + "### 安装\n", + "\n", + "PP-HelixFold基于[PaddlePaddle](https://github.com/paddlepaddle/paddle)实现。\n", + "通过`pip`安装的Python相关库在`requirements.txt`文件中提供,PP-HelixFold需要使用的`openmm==7.5.1`和`pdbfixer`工具,仅可通过`conda`安装。 同时,还需要安装`kalign`、[HH-suite](https://github.com/soedinglab/hh-suite)和`jackhmmer`等工具来生成多序列比对文件。下载脚本需要支持`aria2c`。\n", + "\n", + "我们提供脚本`setup_env`来安装`conda`环境和所需的所有第三方工具库。您可以在`setup_env`中更改环境名字和CUDA版本。运行命令如下:\n", + "```bash\n", + "git clone https://github.com/PaddlePaddle/PaddleHelix.git # download PaddleHelix\n", + "cd https://github.com/PaddlePaddle/PaddleHelix/tree/dev/apps/protein_folding/helixfold\n", + "wget https://paddle-wheel.bj.bcebos.com/develop/linux/linux-gpu-cuda11.2-cudnn8-mkl-gcc8.2-avx/paddlepaddle_gpu-0.0.0.post112-cp37-cp37m-linux_x86_64.whl\n", + "sh setup_env\n", + "conda activate helixfold # activate the conda environment\n", + "```\n", + "注意:如果您环境中的Python3和CUDA版本与我们提供的Paddle whl包不匹配,请参考[这里](https://www.paddlepaddle.org.cn/whl/linux/gpu/develop.html)下载安装对应版本的PaddlePaddle `dev`包。\n", + "\n", + "为了代码运行时支持开启DAP/BP/DP-DAP-BP模式,您还需安装`ppfleetx`。更多详细信息请参考[这里](https://github.com/PaddlePaddle/PaddleFleetX/tree/release/2.4/projects/protein_folding)。\n", + "```bash\n", + "git clone https://github.com/PaddlePaddle/PaddleFleetX.git\n", + "git checkout release/2.4 # change branch\n", + "python setup.py develop # install ppfleetx\n", + "```\n", + "\n", + "### 使用\n", + "\n", + "在运行PP-HelixFold前,需要先下载所需的数据库和预训练模型参数。\n", + "\n", + "与原版AlphaFold2一样,您可以运行脚本`scripts/download_all_data.sh`下载所有所需的数据库和预训练模型参数文件:\n", + "\n", + "* 默认选项:\n", + "\n", + " ```bash\n", + " scripts/download_all_data.sh \n", + " ```\n", + "\n", + " 将下载完整版数据库。完整版数据库和预训练模型参数文件的解压前总大小约415 GB,解压后约2.2 TB。\n", + "\n", + "* `reduced_dbs`选项:\n", + "\n", + " ```bash\n", + " scripts/download_all_data.sh reduced_dbs\n", + " ```\n", + "\n", + " 将下载精简版数据库。精简版数据库和预训练模型参数文件的解压前总大小约190 GB,解压后约530 GB。\n", + "\n", + "### PP-HelixFold模型推理\n", + "\n", + "可以使用如下脚本运行PP-HelixFold模型推理单个或多个蛋白序列文件:\n", + "\n", + "* 在单卡GPU上推理(DP模式):\n", + " ```bash\n", + " fasta_file=\"target.fasta\" # path to the target protein\n", + " model_name=\"model_5\" # the alphafold model name\n", + " DATA_DIR=\"data\" # path to the databases\n", + " OUTPUT_DIR=\"helixfold_output\" # path to save the outputs\n", + "\n", + " python run_helixfold.py \\\n", + " --fasta_paths=${fasta_file} \\\n", + " --data_dir=${DATA_DIR} \\\n", + " --bfd_database_path=${DATA_DIR}/bfd/bfd_metaclust_clu_complete_id30_c90_final_seq.sorted_opt \\\n", + " --small_bfd_database_path=${DATA_DIR}/small_bfd/bfd-first_non_consensus_sequences.fasta \\\n", + " --uniclust30_database_path=${DATA_DIR}/uniclust30/uniclust30_2018_08/uniclust30_2018_08 \\\n", + " --uniref90_database_path=${DATA_DIR}/uniref90/uniref90.fasta \\\n", + " --mgnify_database_path=${DATA_DIR}/mgnify/mgy_clusters_2018_12.fa \\\n", + " --pdb70_database_path=${DATA_DIR}/pdb70/pdb70 \\\n", + " --template_mmcif_dir=${DATA_DIR}/pdb_mmcif/mmcif_files \\\n", + " --obsolete_pdbs_path=${DATA_DIR}/pdb_mmcif/obsolete.dat \\\n", + " --max_template_date=2020-05-14 \\\n", + " --model_names=${model_name} \\\n", + " --output_dir=${OUTPUT_DIR} \\\n", + " --preset='reduced_dbs' \\\n", + " --jackhmmer_binary_path /opt/conda/envs/helixfold/bin/jackhmmer \\\n", + " --hhblits_binary_path /opt/conda/envs/helixfold/bin/hhblits \\\n", + " --hhsearch_binary_path /opt/conda/envs/helixfold/bin/hhsearch \\\n", + " --kalign_binary_path /opt/conda/envs/helixfold/bin/kalign \\\n", + " --random_seed=0\n", + " ```\n", + "\n", + "* 在多卡GPU上推理(DAP模式):\n", + " ```bash\n", + " fasta_file=\"target.fasta\" # path to the target protein\n", + " model_name=\"model_5\" # the alphafold model name\n", + " DATA_DIR=\"data\" # path to the databases\n", + " OUTPUT_DIR=\"helixfold_output\" # path to save the outputs\n", + " log_dir=\"demo_log\" # path to log file\n", + "\n", + " distributed_args=\"--run_mode=collective --log_dir=${log_dir}\"\n", + " python -m paddle.distributed.launch ${distributed_args} \\\n", + " --gpus=\"0,1,2,3,4,5,6,7\" \\\n", + " run_helixfold.py \\\n", + " --distributed \\\n", + " --dap_degree 8 \\\n", + " --fasta_paths=${fasta_file} \\\n", + " --data_dir=${DATA_DIR} \\\n", + " --bfd_database_path=${DATA_DIR}/bfd/bfd_metaclust_clu_complete_id30_c90_final_seq.sorted_opt \\\n", + " --small_bfd_database_path=${DATA_DIR}/small_bfd/bfd-first_non_consensus_sequences.fasta \\\n", + " --uniclust30_database_path=${DATA_DIR}/uniclust30/uniclust30_2018_08/uniclust30_2018_08 \\\n", + " --uniref90_database_path=${DATA_DIR}/uniref90/uniref90.fasta \\\n", + " --mgnify_database_path=${DATA_DIR}/mgnify/mgy_clusters_2018_12.fa \\\n", + " --pdb70_database_path=${DATA_DIR}/pdb70/pdb70 \\\n", + " --template_mmcif_dir=${DATA_DIR}/pdb_mmcif/mmcif_files \\\n", + " --obsolete_pdbs_path=${DATA_DIR}/pdb_mmcif/obsolete.dat \\\n", + " --max_template_date=2020-05-14 \\\n", + " --model_names=${model_name} \\\n", + " --output_dir=${OUTPUT_DIR} \\\n", + " --preset='reduced_dbs' \\\n", + " --seed 2022 \\\n", + " --jackhmmer_binary_path /opt/conda/envs/helixfold/bin/jackhmmer \\\n", + " --hhblits_binary_path /opt/conda/envs/helixfold/bin/hhblits \\\n", + " --hhsearch_binary_path /opt/conda/envs/helixfold/bin/hhsearch \\\n", + " --kalign_binary_path /opt/conda/envs/helixfold/bin/kalign \\\n", + " --random_seed=0\n", + " ```\n", + "您可以使用命令`python run_helixfold.py -h`查找各参数选项具体描述与定义。\n", + "\n", + "### PP-HelixFold模型在CASP14 Demo上推理\n", + "\n", + "为了使用方便,我们提供一键式运行脚本`gpu_infer.sh`来运行目录`demo_data/casp14_demo`底下的部分CASP14蛋白。您可以运行以下命令来使用:\n", + "\n", + "```bash\n", + "sh gpu_infer.sh T1026\n", + "```\n", + "\n", + "注意:运行demo蛋白T1026和T1037,您无需下载庞大的数据库,仅需下载预训练模型参数即可使用。\n", + "\n", + "\n", + "## 5. 相关论文以及引用信息\n", + "\n", + "如果您使用了该代码库里的任何代码和数据,请引用:\n", + "\n", + "```bibtex\n", + "@article{AlphaFold2021,\n", + " author={Jumper, John and Evans, Richard and Pritzel, Alexander and Green, Tim and Figurnov, Michael and Ronneberger, Olaf and Tunyasuvunakool, Kathryn and Bates, Russ and {\\v{Z}}{\\'\\i}dek, Augustin and Potapenko, Anna and Bridgland, Alex and Meyer, Clemens and Kohl, Simon A A and Ballard, Andrew J and Cowie, Andrew and Romera-Paredes, Bernardino and Nikolov, Stanislav and Jain, Rishub and Adler, Jonas and Back, Trevor and Petersen, Stig and Reiman, David and Clancy, Ellen and Zielinski, Michal and Steinegger, Martin and Pacholska, Michalina and Berghammer, Tamas and Bodenstein, Sebastian and Silver, David and Vinyals, Oriol and Senior, Andrew W and Kavukcuoglu, Koray and Kohli, Pushmeet and Hassabis, Demis},\n", + " journal={Nature},\n", + " title={Highly accurate protein structure prediction with {AlphaFold}},\n", + " year={2021},\n", + " volume={596},\n", + " number={7873},\n", + " pages={583--589},\n", + " doi={10.1038/s41586-021-03819-2}\n", + "}\n", + "\n", + "@article{wang2022helixfold,\n", + " title={HelixFold: An Efficient Implementation of AlphaFold2 using PaddlePaddle},\n", + " author={Wang, Guoxia and Fang, Xiaomin and Wu, Zhihua and Liu, Yiqun and Xue, Yang and Xiang, Yingfei and Yu, Dianhai and Wang, Fan and Ma, Yanjun},\n", + " journal={arXiv preprint arXiv:2207.05477},\n", + " year={2022}\n", + "}\n", + "\n", + "@article{wang2022efficient_alphafold2,\n", + " title={Efficient AlphaFold2 Training using Parallel Evoformer and Branch Parallelism},\n", + " author={Wang, Guoxia and Wu, Zhihua and Fang, Xiaomin and Xiang, Yingfei and Liu, Yiqun and Yu, Dianhai and Ma, Yanjun},\n", + " journal={arXiv preprint arXiv:2211.00235},\n", + " year={2022}\n", + "}\n", + "```\n", + "\n", + "## 6. 版权所有\n", + "\n", + "PP-HelixFold代码使用的是Apache 2.0 License许可文件,该许可与原版AlphaFold2相同。但是,我们使用了由DeepMind提供的AlphaFold2预训练模型参数,根据CC BY-NC 4.0 license许可文件规定,仅可用于非商业用途。\n" + ] + } + ], + "metadata": { + "kernelspec": { + "display_name": "Python 3 (ipykernel)", + "language": "python", + "name": "python3" + }, + "language_info": { + "codemirror_mode": { + "name": "ipython", + "version": 3 + }, + "file_extension": ".py", + "mimetype": "text/x-python", + "name": "python", + "nbconvert_exporter": "python", + "pygments_lexer": "ipython3", + "version": "3.7.0" + } + }, + "nbformat": 4, + "nbformat_minor": 5 +} diff --git a/modelcenter/PP-HelixFold/introduction_en.ipynb b/modelcenter/PP-HelixFold/introduction_en.ipynb new file mode 100644 index 0000000000000000000000000000000000000000..6569489ffcbfc96b6d52a247a8fabfa24cd04591 --- /dev/null +++ b/modelcenter/PP-HelixFold/introduction_en.ipynb @@ -0,0 +1,228 @@ +{ + "cells": [ + { + "cell_type": "markdown", + "id": "64e80e67-78d1-4595-8873-dd4d157c469d", + "metadata": {}, + "source": [ + "## 1. PP-HelixFold Introduction\n", + "\n", + "AlphaFold2 is an accurate protein structure prediction pipeline. PP-HelixFold provides an efficient and improved implementation of the complete training and inference pipelines of AlphaFold2 in GPU and DCU. Compared with the computational performance of AlphaFold2 reported in the paper and OpenFold implemented through PyTorch, PP-HelixFold reduces the training time from about 11 days to 7.5 days. Training PP-HelixFold from scratch can achieve competitive accuracy with AlphaFold2.\n", + "\n", + "

\n", + "\n", + "\n", + "

\n", + "\n", + "\n", + "## 2. Technical Highlights for Efficient Implementation\n", + "\n", + "* **Branch Parallelism and Hybrid Parallelism** PP-HelixFold proposes **Branch Parallelism (BP)** to split the calculation branch across multiple devices in order to accelerate computation during the initial training phase. The training cost is further reduced by training with **Hybrid Parallelism**, combining BP with Dynamic Axial Parallelism (DAP) and Data Parallelism (DP).\n", + "\n", + "* **Operator Fusion and Tensor Fusion to Reduce the Cost of Scheduling** Scheduling a huge number of operators is one of the bottlenecks for the training. To reduce the cost of scheduling, **Fused Gated Self-Attention** is utilized to combine multiple blocks into an operator, and thousands of tensors are fused into only a few tensors.\n", + "\n", + "* **Multi-dimensional Memory Optimization** Multiple techniques, including Recompute, BFloat16, In-place memory, and Subbatch (Chunking), are exploited to reduce the memory required for training.\n", + "\n", + "\n", + "## 3. Online Service\n", + "\n", + "For those who want to try out our model without any installation, we also provide an online interface [PaddleHelix HelixFold Forecast](https://paddlehelix.baidu.com/app/drug/protein/forecast) through web service.\n", + "\n", + "\n", + "## 4. Environment\n", + "\n", + "To reproduce the results reported in our paper, specific environment settings are required as below. \n", + "\n", + "- python: 3.7\n", + "- cuda: 11.2\n", + "- cudnn: 8.10.1\n", + "- nccl: 2.12.12\n", + "\n", + "\n", + "## 4. How to Use the Model\n", + "\n", + "### Installation\n", + "\n", + "PP-HelixFold depends on [PaddlePaddle](https://github.com/paddlepaddle/paddle).\n", + "Python dependencies available through `pip` is provided in `requirements.txt`. PP-HelixFold also depends on `openmm==7.5.1` and `pdbfixer`, which are only available via `conda`. For producing multiple sequence alignments, `kalign`, the [HH-suite](https://github.com/soedinglab/hh-suite) and `jackhmmer` are also needed. The download scripts require `aria2c`.\n", + "\n", + "We provide a script `setup_env` that setup a `conda` environment and installs all dependencies. You can change the name of the environment and CUDA version in `setup_env`. Run:\n", + "```bash\n", + "git clone https://github.com/PaddlePaddle/PaddleHelix.git # download PaddleHelix\n", + "cd https://github.com/PaddlePaddle/PaddleHelix/tree/dev/apps/protein_folding/helixfold\n", + "wget https://paddle-wheel.bj.bcebos.com/develop/linux/linux-gpu-cuda11.2-cudnn8-mkl-gcc8.2-avx/paddlepaddle_gpu-0.0.0.post112-cp37-cp37m-linux_x86_64.whl\n", + "sh setup_env\n", + "conda activate helixfold # activate the conda environment\n", + "```\n", + "Note: If you have a different version of python3 and cuda, please refer to [here](https://www.paddlepaddle.org.cn/whl/linux/gpu/develop.html) for the compatible PaddlePaddle `dev` package.\n", + "\n", + "In order to run scripts with DAP/BP/DP-DAP-BP mode, you also need to install `ppfleetx`. Please refer to [here](https://github.com/PaddlePaddle/PaddleFleetX/tree/release/2.4/projects/protein_folding) for more details.\n", + "```bash\n", + "git clone https://github.com/PaddlePaddle/PaddleFleetX.git\n", + "git checkout release/2.4 # change branch\n", + "python setup.py develop # install ppfleetx\n", + "```\n", + "\n", + "### Usage\n", + "\n", + "In order to run PP-HelixFold, the genetic databases and model parameters are required.\n", + "\n", + "You can use a script `scripts/download_all_data.sh`, which is the same as the original AlphaFold that can be used to download and set up all databases and model parameters:\n", + "\n", + "* Default:\n", + "\n", + " ```bash\n", + " scripts/download_all_data.sh \n", + " ```\n", + "\n", + " will download the full databases. The total download size for the full databases is around 415 GB and the total size when unzipped is 2.2 TB. \n", + "\n", + "* With `reduced_dbs`:\n", + "\n", + " ```bash\n", + " scripts/download_all_data.sh reduced_dbs\n", + " ```\n", + "\n", + " will download a reduced version of the databases to be used with the\n", + " `reduced_dbs` preset. The total download size for the reduced databases is around 190 GB and the total size when unzipped is around 530 GB. \n", + "\n", + "### Running PP-HelixFold for Inference\n", + "\n", + "To run inference on a sequence or multiple sequences using a set of DeepMind's pretrained parameters, run e.g.:\n", + "\n", + "* Inference on single GPU (DP):\n", + " ```bash\n", + " fasta_file=\"target.fasta\" # path to the target protein\n", + " model_name=\"model_5\" # the alphafold model name\n", + " DATA_DIR=\"data\" # path to the databases\n", + " OUTPUT_DIR=\"helixfold_output\" # path to save the outputs\n", + "\n", + " python run_helixfold.py \\\n", + " --fasta_paths=${fasta_file} \\\n", + " --data_dir=${DATA_DIR} \\\n", + " --bfd_database_path=${DATA_DIR}/bfd/bfd_metaclust_clu_complete_id30_c90_final_seq.sorted_opt \\\n", + " --small_bfd_database_path=${DATA_DIR}/small_bfd/bfd-first_non_consensus_sequences.fasta \\\n", + " --uniclust30_database_path=${DATA_DIR}/uniclust30/uniclust30_2018_08/uniclust30_2018_08 \\\n", + " --uniref90_database_path=${DATA_DIR}/uniref90/uniref90.fasta \\\n", + " --mgnify_database_path=${DATA_DIR}/mgnify/mgy_clusters_2018_12.fa \\\n", + " --pdb70_database_path=${DATA_DIR}/pdb70/pdb70 \\\n", + " --template_mmcif_dir=${DATA_DIR}/pdb_mmcif/mmcif_files \\\n", + " --obsolete_pdbs_path=${DATA_DIR}/pdb_mmcif/obsolete.dat \\\n", + " --max_template_date=2020-05-14 \\\n", + " --model_names=${model_name} \\\n", + " --output_dir=${OUTPUT_DIR} \\\n", + " --preset='reduced_dbs' \\\n", + " --jackhmmer_binary_path /opt/conda/envs/helixfold/bin/jackhmmer \\\n", + " --hhblits_binary_path /opt/conda/envs/helixfold/bin/hhblits \\\n", + " --hhsearch_binary_path /opt/conda/envs/helixfold/bin/hhsearch \\\n", + " --kalign_binary_path /opt/conda/envs/helixfold/bin/kalign \\\n", + " --random_seed=0\n", + " ```\n", + "\n", + "* Inference on multiple GPUs (DAP):\n", + " ```bash\n", + " fasta_file=\"target.fasta\" # path to the target protein\n", + " model_name=\"model_5\" # the alphafold model name\n", + " DATA_DIR=\"data\" # path to the databases\n", + " OUTPUT_DIR=\"helixfold_output\" # path to save the outputs\n", + " log_dir=\"demo_log\" # path to log file\n", + "\n", + " distributed_args=\"--run_mode=collective --log_dir=${log_dir}\"\n", + " python -m paddle.distributed.launch ${distributed_args} \\\n", + " --gpus=\"0,1,2,3,4,5,6,7\" \\\n", + " run_helixfold.py \\\n", + " --distributed \\\n", + " --dap_degree 8 \\\n", + " --fasta_paths=${fasta_file} \\\n", + " --data_dir=${DATA_DIR} \\\n", + " --bfd_database_path=${DATA_DIR}/bfd/bfd_metaclust_clu_complete_id30_c90_final_seq.sorted_opt \\\n", + " --small_bfd_database_path=${DATA_DIR}/small_bfd/bfd-first_non_consensus_sequences.fasta \\\n", + " --uniclust30_database_path=${DATA_DIR}/uniclust30/uniclust30_2018_08/uniclust30_2018_08 \\\n", + " --uniref90_database_path=${DATA_DIR}/uniref90/uniref90.fasta \\\n", + " --mgnify_database_path=${DATA_DIR}/mgnify/mgy_clusters_2018_12.fa \\\n", + " --pdb70_database_path=${DATA_DIR}/pdb70/pdb70 \\\n", + " --template_mmcif_dir=${DATA_DIR}/pdb_mmcif/mmcif_files \\\n", + " --obsolete_pdbs_path=${DATA_DIR}/pdb_mmcif/obsolete.dat \\\n", + " --max_template_date=2020-05-14 \\\n", + " --model_names=${model_name} \\\n", + " --output_dir=${OUTPUT_DIR} \\\n", + " --preset='reduced_dbs' \\\n", + " --seed 2022 \\\n", + " --jackhmmer_binary_path /opt/conda/envs/helixfold/bin/jackhmmer \\\n", + " --hhblits_binary_path /opt/conda/envs/helixfold/bin/hhblits \\\n", + " --hhsearch_binary_path /opt/conda/envs/helixfold/bin/hhsearch \\\n", + " --kalign_binary_path /opt/conda/envs/helixfold/bin/kalign \\\n", + " --random_seed=0\n", + " ```\n", + "You can use `python run_helixfold.py -h` to find the description of the arguments.\n", + "\n", + "### Running PP-HelixFold for CASP14 Demo\n", + "\n", + "For convenience, we also provide a demo script `gpu_infer.sh` for some CASP14 proteins under folder `demo_data/casp14_demo`. To run them, you just need to execute following command:\n", + "\n", + "```bash\n", + "sh gpu_infer.sh T1026\n", + "```\n", + "\n", + "Note that such demo for T1026 and T1037 can work without downloading large MSA datasets, only model parameters are required.\n", + "\n", + "\n", + "## 5. Related papers and citations\n", + "\n", + "If you use the code or data in this repos, please cite:\n", + "\n", + "```bibtex\n", + "@article{AlphaFold2021,\n", + " author={Jumper, John and Evans, Richard and Pritzel, Alexander and Green, Tim and Figurnov, Michael and Ronneberger, Olaf and Tunyasuvunakool, Kathryn and Bates, Russ and {\\v{Z}}{\\'\\i}dek, Augustin and Potapenko, Anna and Bridgland, Alex and Meyer, Clemens and Kohl, Simon A A and Ballard, Andrew J and Cowie, Andrew and Romera-Paredes, Bernardino and Nikolov, Stanislav and Jain, Rishub and Adler, Jonas and Back, Trevor and Petersen, Stig and Reiman, David and Clancy, Ellen and Zielinski, Michal and Steinegger, Martin and Pacholska, Michalina and Berghammer, Tamas and Bodenstein, Sebastian and Silver, David and Vinyals, Oriol and Senior, Andrew W and Kavukcuoglu, Koray and Kohli, Pushmeet and Hassabis, Demis},\n", + " journal={Nature},\n", + " title={Highly accurate protein structure prediction with {AlphaFold}},\n", + " year={2021},\n", + " volume={596},\n", + " number={7873},\n", + " pages={583--589},\n", + " doi={10.1038/s41586-021-03819-2}\n", + "}\n", + "\n", + "@article{wang2022helixfold,\n", + " title={HelixFold: An Efficient Implementation of AlphaFold2 using PaddlePaddle},\n", + " author={Wang, Guoxia and Fang, Xiaomin and Wu, Zhihua and Liu, Yiqun and Xue, Yang and Xiang, Yingfei and Yu, Dianhai and Wang, Fan and Ma, Yanjun},\n", + " journal={arXiv preprint arXiv:2207.05477},\n", + " year={2022}\n", + "}\n", + "\n", + "@article{wang2022efficient_alphafold2,\n", + " title={Efficient AlphaFold2 Training using Parallel Evoformer and Branch Parallelism},\n", + " author={Wang, Guoxia and Wu, Zhihua and Fang, Xiaomin and Xiang, Yingfei and Liu, Yiqun and Yu, Dianhai and Ma, Yanjun},\n", + " journal={arXiv preprint arXiv:2211.00235},\n", + " year={2022}\n", + "}\n", + "```\n", + "\n", + "## 6. Copyright\n", + "\n", + "PP-HelixFold code is licensed under the Apache 2.0 License, which is same as AlphaFold. However, we use the AlphaFold parameters pretrained by DeepMind, which are made available for non-commercial use only under the terms of the CC BY-NC 4.0 license.\n" + ] + } + ], + "metadata": { + "kernelspec": { + "display_name": "Python 3 (ipykernel)", + "language": "python", + "name": "python3" + }, + "language_info": { + "codemirror_mode": { + "name": "ipython", + "version": 3 + }, + "file_extension": ".py", + "mimetype": "text/x-python", + "name": "python", + "nbconvert_exporter": "python", + "pygments_lexer": "ipython3", + "version": "3.7.0" + } + }, + "nbformat": 4, + "nbformat_minor": 5 +}