Browse entries in the PDBbind-CN Database
HEADER 5B5P_COMPLEX COMPND 5B5P_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 145 TYR ASN VAL PHE PRO ARG THR LEU LYS TRP SER LYS MET SEQRES 2 A 145 ASN LEU THR TYR ARG ILE VAL ASN TYR THR PRO ASP MET SEQRES 3 A 145 THR HIS SER GLU VAL GLU LYS ALA PHE LYS LYS ALA PHE SEQRES 4 A 145 LYS VAL TRP SER ASP VAL THR PRO LEU ASN PHE THR ARG SEQRES 5 A 145 LEU HIS ASP GLY ILE ALA ASP ILE MET ILE SER PHE GLY SEQRES 6 A 145 ILE LYS GLU HIS GLY ASP PHE TYR PRO PHE ASP GLY PRO SEQRES 7 A 145 SER GLY LEU LEU ALA HIS ALA PHE PRO PRO GLY PRO ASN SEQRES 8 A 145 TYR GLY GLY ASP ALA HIS PHE ASP ASP ASP GLU THR TRP SEQRES 9 A 145 THR SER SER SER LYS GLY TYR ASN LEU PHE LEU VAL ALA SEQRES 10 A 145 ALA HIS GLU PHE GLY HIS SER LEU GLY LEU ASP HIS SER SEQRES 11 A 145 LYS ASP PRO GLY ALA LEU MET PHE PRO ILE TYR THR TYR SEQRES 12 A 145 THR GLY SEQRES 1 A 22 HIS PHE MET LEU PRO ASP ASP ASP VAL GLN GLY ILE GLN SEQRES 2 A 22 SER LEU TYR GLY PRO GLY ASP GLU ASP HET ZN A 1 1 HET ZN A 2 1 HET CA A 3 1 HET CA A 4 1 HET CA A 5 1 HET WNN A 384 48 ATOM 1 N TYR A 104 -11.898 6.484 10.836 1.00 37.80 N ATOM 2 CA TYR A 104 -12.173 7.611 11.771 1.00 38.15 C ATOM 3 C TYR A 104 -13.394 8.397 11.326 1.00 38.51 C ATOM 4 O TYR A 104 -13.832 8.291 10.179 1.00 36.93 O ATOM 5 CB TYR A 104 -10.958 8.543 11.879 1.00 38.50 C ATOM 6 CG TYR A 104 -10.652 9.336 10.622 1.00 36.91 C ATOM 7 CD1 TYR A 104 -11.358 10.509 10.319 1.00 37.94 C ATOM 8 CD2 TYR A 104 -9.652 8.926 9.747 1.00 39.01 C ATOM 9 CE1 TYR A 104 -11.079 11.238 9.172 1.00 35.97 C ATOM 10 CE2 TYR A 104 -9.361 9.652 8.597 1.00 38.50 C ATOM 11 CZ TYR A 104 -10.085 10.803 8.315 1.00 37.82 C ATOM 12 OH TYR A 104 -9.797 11.526 7.181 1.00 41.88 O ATOM 13 HH TYR A 104 -10.399 12.310 7.129 1.00 0.00 H ATOM 14 HN3 TYR A 104 -11.725 6.861 9.882 1.00 0.00 H ATOM 15 HN2 TYR A 104 -12.718 5.845 10.814 1.00 0.00 H ATOM 16 HN1 TYR A 104 -11.059 5.962 11.161 1.00 0.00 H ATOM 17 N ASN A 105 -13.939 9.186 12.244 1.00 38.72 N ATOM 18 CA ASN A 105 -15.032 10.086 11.929 1.00 40.07 C ATOM 19 C ASN A 105 -14.835 11.426 12.619 1.00 40.90 C ATOM 20 O ASN A 105 -14.469 11.485 13.794 1.00 41.63 O ATOM 21 CB ASN A 105 -16.372 9.459 12.312 1.00 38.68 C ATOM 22 CG ASN A 105 -16.714 8.253 11.453 1.00 42.71 C ATOM 23 OD1 ASN A 105 -16.667 7.107 11.914 1.00 43.13 O ATOM 24 ND2 ASN A 105 -17.033 8.504 10.188 1.00 42.07 N ATOM 25 HD22 ASN A 105 -17.060 9.485 9.843 1.00 0.00 H ATOM 26 HD21 ASN A 105 -17.256 7.720 9.542 1.00 0.00 H ATOM 27 H ASN A 105 -13.572 9.158 13.217 1.00 0.00 H ATOM 28 N VAL A 106 -15.035 12.493 11.857 1.00 41.51 N ATOM 29 CA VAL A 106 -15.066 13.850 12.383 1.00 42.73 C ATOM 30 C VAL A 106 -16.539 14.214 12.574 1.00 42.82 C ATOM 31 O VAL A 106 -17.417 13.586 11.976 1.00 42.13 O ATOM 32 CB VAL A 106 -14.360 14.829 11.407 1.00 42.40 C ATOM 33 CG1 VAL A 106 -14.641 16.277 11.768 1.00 45.07 C ATOM 34 CG2 VAL A 106 -12.851 14.564 11.373 1.00 41.78 C ATOM 35 H VAL A 106 -15.176 12.354 10.836 1.00 0.00 H ATOM 36 N PHE A 107 -16.813 15.208 13.417 1.00 44.47 N ATOM 37 CA PHE A 107 -18.179 15.706 13.602 1.00 44.52 C ATOM 38 C PHE A 107 -18.674 16.448 12.345 1.00 44.97 C ATOM 39 O PHE A 107 -17.903 17.186 11.725 1.00 45.86 O ATOM 40 CB PHE A 107 -18.252 16.638 14.817 1.00 44.35 C ATOM 41 CG PHE A 107 -18.017 15.957 16.143 1.00 42.47 C ATOM 42 CD1 PHE A 107 -16.964 16.361 16.964 1.00 42.17 C ATOM 43 CD2 PHE A 107 -18.864 14.945 16.591 1.00 41.22 C ATOM 44 CE1 PHE A 107 -16.741 15.753 18.203 1.00 43.78 C ATOM 45 CE2 PHE A 107 -18.654 14.330 17.824 1.00 42.35 C ATOM 46 CZ PHE A 107 -17.591 14.736 18.633 1.00 44.14 C ATOM 47 H PHE A 107 -16.038 15.642 13.958 1.00 0.00 H ATOM 48 N PRO A 108 -19.954 16.248 11.963 1.00 45.70 N ATOM 49 CA PRO A 108 -20.627 16.902 10.812 1.00 45.82 C ATOM 50 C PRO A 108 -20.553 18.448 10.769 1.00 46.76 C ATOM 51 O PRO A 108 -20.251 19.077 11.783 1.00 47.98 O ATOM 52 CB PRO A 108 -22.083 16.448 10.958 1.00 45.56 C ATOM 53 CG PRO A 108 -22.006 15.167 11.693 1.00 44.78 C ATOM 54 CD PRO A 108 -20.857 15.304 12.649 1.00 45.86 C ATOM 55 N ARG A 109 -20.853 19.033 9.604 1.00 45.95 N ATOM 56 CA ARG A 109 -20.653 20.476 9.329 1.00 46.50 C ATOM 57 C ARG A 109 -21.755 21.384 9.876 1.00 43.23 C ATOM 58 O ARG A 109 -21.493 22.511 10.306 1.00 43.99 O ATOM 59 CB ARG A 109 -20.493 20.738 7.821 1.00 48.10 C ATOM 60 CG ARG A 109 -19.287 20.058 7.145 1.00 54.17 C ATOM 61 CD ARG A 109 -19.585 18.614 6.699 1.00 61.75 C ATOM 62 NE ARG A 109 -20.669 18.530 5.713 1.00 67.29 N ATOM 63 CZ ARG A 109 -21.916 18.139 5.978 1.00 68.74 C ATOM 64 NH1 ARG A 109 -22.270 17.783 7.209 1.00 70.30 N ATOM 65 NH2 ARG A 109 -22.818 18.105 5.005 1.00 68.80 N ATOM 66 HE ARG A 109 -20.447 18.796 4.732 1.00 0.00 H ATOM 67 HH12 ARG A 109 -23.246 17.480 7.402 1.00 0.00 H ATOM 68 HH11 ARG A 109 -21.571 17.808 7.979 1.00 0.00 H ATOM 69 HH22 ARG A 109 -23.791 17.800 5.209 1.00 0.00 H ATOM 70 HH21 ARG A 109 -22.551 18.383 4.039 1.00 0.00 H ATOM 71 H ARG A 109 -21.250 18.441 8.847 1.00 0.00 H ATOM 72 N THR A 110 -22.994 20.915 9.812 1.00 39.96 N ATOM 73 CA THR A 110 -24.092 21.613 10.460 1.00 36.11 C ATOM 74 C THR A 110 -24.704 20.682 11.491 1.00 32.13 C ATOM 75 O THR A 110 -24.494 19.462 11.447 1.00 31.18 O ATOM 76 CB THR A 110 -25.192 22.060 9.459 1.00 36.36 C ATOM 77 OG1 THR A 110 -25.627 20.930 8.693 1.00 39.08 O ATOM 78 CG2 THR A 110 -24.677 23.143 8.521 1.00 38.77 C ATOM 79 HG1 THR A 110 -26.328 21.215 8.055 1.00 0.00 H ATOM 80 H THR A 110 -23.183 20.035 9.291 1.00 0.00 H ATOM 81 N LEU A 111 -25.446 21.264 12.425 1.00 28.29 N ATOM 82 CA LEU A 111 -26.244 20.481 13.351 1.00 28.37 C ATOM 83 C LEU A 111 -27.461 19.973 12.586 1.00 26.74 C ATOM 84 O LEU A 111 -28.306 20.757 12.155 1.00 26.61 O ATOM 85 CB LEU A 111 -26.673 21.311 14.569 1.00 28.15 C ATOM 86 CG LEU A 111 -25.637 21.797 15.597 1.00 34.49 C ATOM 87 CD1 LEU A 111 -24.603 22.750 15.021 1.00 41.76 C ATOM 88 CD2 LEU A 111 -26.333 22.461 16.776 1.00 30.23 C ATOM 89 H LEU A 111 -25.456 22.302 12.495 1.00 0.00 H ATOM 90 N LYS A 112 -27.524 18.660 12.406 1.00 25.72 N ATOM 91 CA LYS A 112 -28.638 18.000 11.727 1.00 24.99 C ATOM 92 C LYS A 112 -28.712 16.560 12.207 1.00 23.97 C ATOM 93 O LYS A 112 -27.734 16.025 12.750 1.00 25.40 O ATOM 94 CB LYS A 112 -28.461 18.026 10.199 1.00 25.63 C ATOM 95 CG LYS A 112 -27.169 17.368 9.699 1.00 28.37 C ATOM 96 CD LYS A 112 -27.173 17.114 8.198 1.00 30.60 C ATOM 97 CE LYS A 112 -26.876 18.379 7.412 1.00 39.24 C ATOM 98 NZ LYS A 112 -26.366 18.086 6.036 1.00 45.25 N ATOM 99 HZ1 LYS A 112 -25.487 17.534 6.104 1.00 0.00 H ATOM 100 HZ2 LYS A 112 -27.080 17.541 5.512 1.00 0.00 H ATOM 101 HZ3 LYS A 112 -26.178 18.980 5.540 1.00 0.00 H ATOM 102 H LYS A 112 -26.744 18.073 12.765 1.00 0.00 H ATOM 103 N TRP A 113 -29.864 15.934 12.004 1.00 22.71 N ATOM 104 CA TRP A 113 -30.015 14.509 12.304 1.00 23.96 C ATOM 105 C TRP A 113 -29.250 13.712 11.261 1.00 25.81 C ATOM 106 O TRP A 113 -29.237 14.074 10.083 1.00 26.31 O ATOM 107 CB TRP A 113 -31.490 14.109 12.326 1.00 23.54 C ATOM 108 CG TRP A 113 -32.240 14.785 13.443 1.00 21.34 C ATOM 109 CD1 TRP A 113 -33.036 15.906 13.345 1.00 21.34 C ATOM 110 CD2 TRP A 113 -32.225 14.424 14.831 1.00 21.43 C ATOM 111 NE1 TRP A 113 -33.530 16.236 14.587 1.00 21.33 N ATOM 112 CE2 TRP A 113 -33.051 15.349 15.514 1.00 22.46 C ATOM 113 CE3 TRP A 113 -31.606 13.399 15.565 1.00 22.29 C ATOM 114 CZ2 TRP A 113 -33.270 15.284 16.892 1.00 23.72 C ATOM 115 CZ3 TRP A 113 -31.823 13.336 16.936 1.00 23.94 C ATOM 116 CH2 TRP A 113 -32.649 14.277 17.585 1.00 24.41 C ATOM 117 HE1 TRP A 113 -34.167 17.033 14.789 1.00 0.00 H ATOM 118 H TRP A 113 -30.674 16.465 11.625 1.00 0.00 H ATOM 119 N SER A 114 -28.602 12.639 11.703 1.00 26.83 N ATOM 120 CA SER A 114 -27.790 11.818 10.805 1.00 29.49 C ATOM 121 C SER A 114 -28.584 10.617 10.280 1.00 29.49 C ATOM 122 O SER A 114 -28.022 9.708 9.663 1.00 29.50 O ATOM 123 CB SER A 114 -26.505 11.364 11.512 1.00 31.33 C ATOM 124 OG SER A 114 -26.804 10.560 12.644 1.00 35.90 O ATOM 125 HG SER A 114 -27.308 9.759 12.354 1.00 0.00 H ATOM 126 H SER A 114 -28.674 12.378 12.707 1.00 0.00 H ATOM 127 N LYS A 115 -29.890 10.631 10.526 1.00 28.04 N ATOM 128 CA LYS A 115 -30.801 9.575 10.079 1.00 28.18 C ATOM 129 C LYS A 115 -32.109 10.206 9.588 1.00 27.71 C ATOM 130 O LYS A 115 -32.460 11.320 10.003 1.00 27.82 O ATOM 131 CB LYS A 115 -31.069 8.584 11.218 1.00 29.43 C ATOM 132 CG LYS A 115 -31.662 9.227 12.468 1.00 30.34 C ATOM 133 CD LYS A 115 -31.794 8.255 13.632 1.00 30.73 C ATOM 134 CE LYS A 115 -32.319 9.001 14.861 1.00 30.30 C ATOM 135 NZ LYS A 115 -32.399 8.134 16.059 1.00 34.62 N ATOM 136 HZ1 LYS A 115 -33.041 7.339 15.868 1.00 0.00 H ATOM 137 HZ2 LYS A 115 -31.452 7.769 16.285 1.00 0.00 H ATOM 138 HZ3 LYS A 115 -32.760 8.687 16.862 1.00 0.00 H ATOM 139 H LYS A 115 -30.284 11.430 11.062 1.00 0.00 H ATOM 140 N MET A 116 -32.823 9.508 8.707 1.00 26.67 N ATOM 141 CA MET A 116 -34.083 10.035 8.155 1.00 25.44 C ATOM 142 C MET A 116 -35.303 9.614 8.975 1.00 25.63 C ATOM 143 O MET A 116 -36.328 10.283 8.945 1.00 24.92 O ATOM 144 CB MET A 116 -34.277 9.621 6.688 1.00 26.87 C ATOM 145 CG MET A 116 -33.231 10.164 5.720 1.00 27.67 C ATOM 146 SD MET A 116 -33.172 11.972 5.674 1.00 31.17 S ATOM 147 CE MET A 116 -31.666 12.281 4.765 1.00 31.65 C ATOM 148 H MET A 116 -32.485 8.573 8.403 1.00 0.00 H ATOM 149 N ASN A 117 -35.192 8.504 9.698 1.00 22.75 N ATOM 150 CA ASN A 117 -36.294 8.023 10.517 1.00 24.39 C ATOM 151 C ASN A 117 -36.210 8.622 11.912 1.00 24.63 C ATOM 152 O ASN A 117 -35.339 8.247 12.705 1.00 26.95 O ATOM 153 CB ASN A 117 -36.282 6.488 10.613 1.00 24.00 C ATOM 154 CG ASN A 117 -36.536 5.802 9.280 1.00 26.91 C ATOM 155 OD1 ASN A 117 -36.987 6.412 8.312 1.00 27.73 O ATOM 156 ND2 ASN A 117 -36.244 4.510 9.233 1.00 26.41 N ATOM 157 HD22 ASN A 117 -35.864 4.032 10.075 1.00 0.00 H ATOM 158 HD21 ASN A 117 -36.395 3.974 8.354 1.00 0.00 H ATOM 159 H ASN A 117 -34.300 7.969 9.678 1.00 0.00 H ATOM 160 N LEU A 118 -37.098 9.569 12.203 1.00 22.79 N ATOM 161 CA LEU A 118 -37.118 10.207 13.512 1.00 22.67 C ATOM 162 C LEU A 118 -38.371 9.832 14.288 1.00 21.25 C ATOM 163 O LEU A 118 -39.428 9.574 13.703 1.00 21.59 O ATOM 164 CB LEU A 118 -37.001 11.733 13.380 1.00 21.74 C ATOM 165 CG LEU A 118 -35.703 12.220 12.713 1.00 20.51 C ATOM 166 CD1 LEU A 118 -35.785 13.705 12.413 1.00 25.32 C ATOM 167 CD2 LEU A 118 -34.482 11.892 13.567 1.00 25.33 C ATOM 168 H LEU A 118 -37.790 9.859 11.483 1.00 0.00 H ATOM 169 N THR A 119 -38.242 9.786 15.606 1.00 21.15 N ATOM 170 CA THR A 119 -39.384 9.478 16.463 1.00 20.03 C ATOM 171 C THR A 119 -39.733 10.662 17.346 1.00 18.76 C ATOM 172 O THR A 119 -38.866 11.484 17.682 1.00 18.17 O ATOM 173 CB THR A 119 -39.146 8.232 17.353 1.00 21.02 C ATOM 174 OG1 THR A 119 -38.009 8.459 18.199 1.00 19.95 O ATOM 175 CG2 THR A 119 -38.913 7.001 16.499 1.00 21.20 C ATOM 176 HG1 THR A 119 -37.858 7.663 18.767 1.00 0.00 H ATOM 177 H THR A 119 -37.314 9.972 16.037 1.00 0.00 H ATOM 178 N TYR A 120 -41.007 10.742 17.712 1.00 17.70 N ATOM 179 CA TYR A 120 -41.429 11.719 18.698 1.00 15.52 C ATOM 180 C TYR A 120 -42.338 11.118 19.755 1.00 16.94 C ATOM 181 O TYR A 120 -42.957 10.079 19.540 1.00 18.13 O ATOM 182 CB TYR A 120 -42.052 12.954 18.041 1.00 16.44 C ATOM 183 CG TYR A 120 -43.402 12.758 17.384 1.00 17.52 C ATOM 184 CD1 TYR A 120 -44.580 13.104 18.058 1.00 18.04 C ATOM 185 CD2 TYR A 120 -43.503 12.271 16.076 1.00 17.57 C ATOM 186 CE1 TYR A 120 -45.831 12.963 17.442 1.00 23.08 C ATOM 187 CE2 TYR A 120 -44.748 12.124 15.456 1.00 16.75 C ATOM 188 CZ TYR A 120 -45.904 12.474 16.146 1.00 19.82 C ATOM 189 OH TYR A 120 -47.139 12.334 15.550 1.00 21.32 O ATOM 190 HH TYR A 120 -47.844 12.628 16.180 1.00 0.00 H ATOM 191 H TYR A 120 -41.707 10.100 17.289 1.00 0.00 H ATOM 192 N ARG A 121 -42.403 11.781 20.902 1.00 15.43 N ATOM 193 CA ARG A 121 -43.256 11.341 22.001 1.00 14.56 C ATOM 194 C ARG A 121 -43.932 12.546 22.648 1.00 15.24 C ATOM 195 O ARG A 121 -43.267 13.528 23.009 1.00 15.56 O ATOM 196 CB ARG A 121 -42.455 10.571 23.058 1.00 15.23 C ATOM 197 CG ARG A 121 -43.296 10.190 24.286 1.00 15.40 C ATOM 198 CD ARG A 121 -42.504 9.414 25.338 1.00 17.09 C ATOM 199 NE ARG A 121 -43.210 9.393 26.624 1.00 18.29 N ATOM 200 CZ ARG A 121 -42.634 9.121 27.793 1.00 18.44 C ATOM 201 NH1 ARG A 121 -41.339 8.821 27.859 1.00 17.48 N ATOM 202 NH2 ARG A 121 -43.362 9.151 28.900 1.00 19.62 N ATOM 203 HE ARG A 121 -44.228 9.605 26.622 1.00 0.00 H ATOM 204 HH12 ARG A 121 -40.900 8.610 28.778 1.00 0.00 H ATOM 205 HH11 ARG A 121 -40.766 8.797 26.992 1.00 0.00 H ATOM 206 HH22 ARG A 121 -42.921 8.940 29.818 1.00 0.00 H ATOM 207 HH21 ARG A 121 -44.374 9.386 28.851 1.00 0.00 H ATOM 208 H ARG A 121 -41.829 12.640 21.022 1.00 0.00 H ATOM 209 N ILE A 122 -45.256 12.473 22.773 1.00 15.23 N ATOM 210 CA ILE A 122 -46.004 13.495 23.501 1.00 15.74 C ATOM 211 C ILE A 122 -46.079 13.041 24.956 1.00 15.44 C ATOM 212 O ILE A 122 -46.839 12.136 25.306 1.00 16.45 O ATOM 213 CB ILE A 122 -47.417 13.730 22.903 1.00 15.56 C ATOM 214 CG1 ILE A 122 -47.335 13.963 21.383 1.00 16.78 C ATOM 215 CG2 ILE A 122 -48.104 14.908 23.629 1.00 18.58 C ATOM 216 CD1 ILE A 122 -48.679 13.825 20.651 1.00 16.58 C ATOM 217 H ILE A 122 -45.766 11.674 22.345 1.00 0.00 H ATOM 218 N VAL A 123 -45.229 13.653 25.781 1.00 14.63 N ATOM 219 CA VAL A 123 -45.002 13.197 27.144 1.00 15.19 C ATOM 220 C VAL A 123 -46.180 13.546 28.052 1.00 15.27 C ATOM 221 O VAL A 123 -46.578 12.752 28.894 1.00 15.98 O ATOM 222 CB VAL A 123 -43.694 13.786 27.724 1.00 15.21 C ATOM 223 CG1 VAL A 123 -43.524 13.403 29.183 1.00 17.22 C ATOM 224 CG2 VAL A 123 -42.486 13.336 26.899 1.00 14.39 C ATOM 225 H VAL A 123 -44.710 14.486 25.438 1.00 0.00 H ATOM 226 N ASN A 124 -46.714 14.753 27.888 1.00 16.79 N ATOM 227 CA ASN A 124 -47.907 15.154 28.622 1.00 15.47 C ATOM 228 C ASN A 124 -48.717 16.120 27.772 1.00 15.57 C ATOM 229 O ASN A 124 -48.336 16.421 26.629 1.00 14.51 O ATOM 230 CB ASN A 124 -47.555 15.732 30.000 1.00 17.12 C ATOM 231 CG ASN A 124 -46.619 16.924 29.917 1.00 18.15 C ATOM 232 OD1 ASN A 124 -46.483 17.549 28.865 1.00 18.82 O ATOM 233 ND2 ASN A 124 -45.954 17.231 31.025 1.00 24.57 N ATOM 234 HD22 ASN A 124 -46.101 16.674 31.891 1.00 0.00 H ATOM 235 HD21 ASN A 124 -45.286 18.028 31.027 1.00 0.00 H ATOM 236 H ASN A 124 -46.273 15.422 27.225 1.00 0.00 H ATOM 237 N TYR A 125 -49.832 16.596 28.314 1.00 15.88 N ATOM 238 CA TYR A 125 -50.792 17.344 27.511 1.00 13.91 C ATOM 239 C TYR A 125 -51.274 18.612 28.182 1.00 15.31 C ATOM 240 O TYR A 125 -51.462 18.655 29.401 1.00 15.88 O ATOM 241 CB TYR A 125 -52.003 16.468 27.174 1.00 16.33 C ATOM 242 CG TYR A 125 -51.742 15.396 26.143 1.00 16.22 C ATOM 243 CD1 TYR A 125 -51.061 14.227 26.480 1.00 20.58 C ATOM 244 CD2 TYR A 125 -52.211 15.532 24.836 1.00 15.97 C ATOM 245 CE1 TYR A 125 -50.834 13.233 25.532 1.00 19.51 C ATOM 246 CE2 TYR A 125 -51.990 14.544 23.881 1.00 16.96 C ATOM 247 CZ TYR A 125 -51.307 13.392 24.242 1.00 20.23 C ATOM 248 OH TYR A 125 -51.067 12.400 23.322 1.00 21.45 O ATOM 249 HH TYR A 125 -51.929 12.060 22.972 1.00 0.00 H ATOM 250 H TYR A 125 -50.023 16.433 29.323 1.00 0.00 H ATOM 251 N THR A 126 -51.496 19.643 27.371 1.00 14.74 N ATOM 252 CA THR A 126 -52.057 20.904 27.868 1.00 15.96 C ATOM 253 C THR A 126 -53.515 20.748 28.336 1.00 16.32 C ATOM 254 O THR A 126 -54.253 19.928 27.780 1.00 17.79 O ATOM 255 CB THR A 126 -51.979 22.011 26.787 1.00 16.89 C ATOM 256 OG1 THR A 126 -52.555 23.222 27.294 1.00 18.22 O ATOM 257 CG2 THR A 126 -52.698 21.607 25.506 1.00 16.25 C ATOM 258 HG1 THR A 126 -52.056 23.512 28.098 1.00 0.00 H ATOM 259 H THR A 126 -51.266 19.553 26.361 1.00 0.00 H ATOM 260 N PRO A 127 -53.931 21.519 29.371 1.00 15.99 N ATOM 261 CA PRO A 127 -55.358 21.536 29.747 1.00 15.44 C ATOM 262 C PRO A 127 -56.278 22.088 28.652 1.00 17.29 C ATOM 263 O PRO A 127 -57.470 21.758 28.623 1.00 18.28 O ATOM 264 CB PRO A 127 -55.395 22.461 30.967 1.00 16.36 C ATOM 265 CG PRO A 127 -54.008 22.442 31.511 1.00 15.48 C ATOM 266 CD PRO A 127 -53.117 22.345 30.287 1.00 15.29 C ATOM 267 N ASP A 128 -55.708 22.893 27.756 1.00 17.84 N ATOM 268 CA ASP A 128 -56.474 23.753 26.832 1.00 18.06 C ATOM 269 C ASP A 128 -57.225 23.058 25.701 1.00 17.92 C ATOM 270 O ASP A 128 -58.180 23.613 25.153 1.00 18.67 O ATOM 271 CB ASP A 128 -55.538 24.808 26.220 1.00 18.17 C ATOM 272 CG ASP A 128 -54.994 25.774 27.246 1.00 27.32 C ATOM 273 OD1 ASP A 128 -55.628 25.937 28.309 1.00 30.40 O ATOM 274 OD2 ASP A 128 -53.933 26.378 26.984 1.00 27.43 O ATOM 275 H ASP A 128 -54.670 22.917 27.705 1.00 0.00 H ATOM 276 N MET A 129 -56.773 21.860 25.332 1.00 16.94 N ATOM 277 CA MET A 129 -57.228 21.184 24.124 1.00 16.94 C ATOM 278 C MET A 129 -57.396 19.706 24.436 1.00 16.61 C ATOM 279 O MET A 129 -56.757 19.203 25.368 1.00 16.01 O ATOM 280 CB MET A 129 -56.183 21.351 23.007 1.00 17.61 C ATOM 281 CG MET A 129 -55.881 22.815 22.622 1.00 17.48 C ATOM 282 SD MET A 129 -54.428 23.032 21.565 1.00 19.12 S ATOM 283 CE MET A 129 -54.890 22.092 20.108 1.00 23.84 C ATOM 284 H MET A 129 -56.066 21.388 25.931 1.00 0.00 H ATOM 285 N THR A 130 -58.226 19.010 23.658 1.00 14.73 N ATOM 286 CA THR A 130 -58.361 17.557 23.816 1.00 16.86 C ATOM 287 C THR A 130 -57.071 16.841 23.410 1.00 17.17 C ATOM 288 O THR A 130 -56.250 17.390 22.666 1.00 16.61 O ATOM 289 CB THR A 130 -59.525 16.976 22.960 1.00 17.06 C ATOM 290 OG1 THR A 130 -59.191 17.033 21.562 1.00 19.27 O ATOM 291 CG2 THR A 130 -60.817 17.737 23.221 1.00 16.18 C ATOM 292 HG1 THR A 130 -59.938 16.661 21.030 1.00 0.00 H ATOM 293 H THR A 130 -58.784 19.502 22.931 1.00 0.00 H ATOM 294 N HIS A 131 -56.892 15.614 23.878 1.00 17.23 N ATOM 295 CA HIS A 131 -55.755 14.805 23.429 1.00 16.73 C ATOM 296 C HIS A 131 -55.726 14.707 21.912 1.00 16.71 C ATOM 297 O HIS A 131 -54.677 14.867 21.303 1.00 16.99 O ATOM 298 CB HIS A 131 -55.813 13.396 24.032 1.00 18.79 C ATOM 299 CG HIS A 131 -55.407 13.333 25.471 1.00 22.41 C ATOM 300 ND1 HIS A 131 -56.138 13.918 26.481 1.00 30.12 N ATOM 301 CD2 HIS A 131 -54.351 12.735 26.071 1.00 30.86 C ATOM 302 CE1 HIS A 131 -55.548 13.689 27.641 1.00 28.03 C ATOM 303 NE2 HIS A 131 -54.462 12.972 27.420 1.00 29.02 N ATOM 304 H HIS A 131 -57.563 15.222 24.569 1.00 0.00 H ATOM 305 N SER A 132 -56.883 14.434 21.307 1.00 16.46 N ATOM 306 CA SER A 132 -56.974 14.286 19.859 1.00 18.55 C ATOM 307 C SER A 132 -56.536 15.562 19.120 1.00 17.09 C ATOM 308 O SER A 132 -55.799 15.496 18.130 1.00 18.34 O ATOM 309 CB SER A 132 -58.402 13.886 19.461 1.00 19.08 C ATOM 310 OG SER A 132 -58.559 13.958 18.059 1.00 25.82 O ATOM 311 HG SER A 132 -58.386 14.884 17.756 1.00 0.00 H ATOM 312 H SER A 132 -57.742 14.324 21.883 1.00 0.00 H ATOM 313 N GLU A 133 -56.967 16.724 19.609 1.00 16.79 N ATOM 314 CA GLU A 133 -56.590 18.006 18.996 1.00 18.50 C ATOM 315 C GLU A 133 -55.079 18.241 19.035 1.00 17.16 C ATOM 316 O GLU A 133 -54.480 18.713 18.059 1.00 18.49 O ATOM 317 CB GLU A 133 -57.282 19.161 19.715 1.00 19.17 C ATOM 318 CG GLU A 133 -58.745 19.344 19.340 1.00 22.05 C ATOM 319 CD GLU A 133 -59.473 20.381 20.214 1.00 26.57 C ATOM 320 OE1 GLU A 133 -59.101 20.581 21.394 1.00 26.07 O ATOM 321 OE2 GLU A 133 -60.443 20.988 19.712 1.00 34.87 O ATOM 322 H GLU A 133 -57.585 16.724 20.445 1.00 0.00 H ATOM 323 N VAL A 134 -54.468 17.906 20.168 1.00 14.92 N ATOM 324 CA VAL A 134 -53.024 18.057 20.358 1.00 15.44 C ATOM 325 C VAL A 134 -52.265 17.121 19.406 1.00 17.07 C ATOM 326 O VAL A 134 -51.376 17.550 18.664 1.00 17.80 O ATOM 327 CB VAL A 134 -52.638 17.827 21.840 1.00 15.38 C ATOM 328 CG1 VAL A 134 -51.126 17.697 22.015 1.00 15.94 C ATOM 329 CG2 VAL A 134 -53.168 18.982 22.702 1.00 16.30 C ATOM 330 H VAL A 134 -55.038 17.522 20.949 1.00 0.00 H ATOM 331 N GLU A 135 -52.654 15.852 19.412 1.00 15.14 N ATOM 332 CA GLU A 135 -52.087 14.864 18.505 1.00 16.16 C ATOM 333 C GLU A 135 -52.210 15.264 17.028 1.00 16.91 C ATOM 334 O GLU A 135 -51.244 15.124 16.273 1.00 17.46 O ATOM 335 CB GLU A 135 -52.718 13.501 18.772 1.00 15.77 C ATOM 336 CG GLU A 135 -52.312 12.930 20.127 1.00 19.86 C ATOM 337 CD GLU A 135 -53.313 11.958 20.718 1.00 23.78 C ATOM 338 OE1 GLU A 135 -54.283 11.563 20.022 1.00 23.02 O ATOM 339 OE2 GLU A 135 -53.131 11.593 21.904 1.00 25.17 O ATOM 340 H GLU A 135 -53.387 15.554 20.086 1.00 0.00 H ATOM 341 N LYS A 136 -53.383 15.757 16.618 1.00 15.95 N ATOM 342 CA LYS A 136 -53.590 16.206 15.230 1.00 18.31 C ATOM 343 C LYS A 136 -52.671 17.372 14.876 1.00 17.92 C ATOM 344 O LYS A 136 -52.076 17.395 13.786 1.00 17.99 O ATOM 345 CB LYS A 136 -55.045 16.631 14.992 1.00 18.31 C ATOM 346 CG LYS A 136 -55.921 15.602 14.294 1.00 29.54 C ATOM 347 CD LYS A 136 -56.211 14.391 15.150 1.00 37.34 C ATOM 348 CE LYS A 136 -57.530 13.733 14.737 1.00 42.46 C ATOM 349 NZ LYS A 136 -57.749 12.450 15.463 1.00 47.81 N ATOM 350 HZ1 LYS A 136 -56.971 11.794 15.248 1.00 0.00 H ATOM 351 HZ2 LYS A 136 -57.777 12.633 16.486 1.00 0.00 H ATOM 352 HZ3 LYS A 136 -58.651 12.031 15.160 1.00 0.00 H ATOM 353 H LYS A 136 -54.169 15.825 17.296 1.00 0.00 H ATOM 354 N ALA A 137 -52.558 18.325 15.805 1.00 16.59 N ATOM 355 CA ALA A 137 -51.705 19.505 15.639 1.00 16.44 C ATOM 356 C ALA A 137 -50.252 19.100 15.409 1.00 15.75 C ATOM 357 O ALA A 137 -49.628 19.567 14.461 1.00 17.74 O ATOM 358 CB ALA A 137 -51.818 20.441 16.850 1.00 16.96 C ATOM 359 H ALA A 137 -53.100 18.225 16.687 1.00 0.00 H ATOM 360 N PHE A 138 -49.730 18.201 16.248 1.00 17.61 N ATOM 361 CA PHE A 138 -48.331 17.785 16.137 1.00 17.82 C ATOM 362 C PHE A 138 -48.094 16.954 14.885 1.00 18.39 C ATOM 363 O PHE A 138 -47.095 17.138 14.197 1.00 17.31 O ATOM 364 CB PHE A 138 -47.843 17.037 17.387 1.00 17.86 C ATOM 365 CG PHE A 138 -47.730 17.905 18.614 1.00 18.42 C ATOM 366 CD1 PHE A 138 -47.349 19.239 18.513 1.00 19.64 C ATOM 367 CD2 PHE A 138 -47.996 17.385 19.875 1.00 17.62 C ATOM 368 CE1 PHE A 138 -47.236 20.042 19.650 1.00 19.32 C ATOM 369 CE2 PHE A 138 -47.896 18.173 21.020 1.00 16.67 C ATOM 370 CZ PHE A 138 -47.512 19.514 20.909 1.00 15.19 C ATOM 371 H PHE A 138 -50.328 17.790 16.993 1.00 0.00 H ATOM 372 N LYS A 139 -49.027 16.048 14.585 1.00 17.05 N ATOM 373 CA LYS A 139 -48.937 15.255 13.356 1.00 17.96 C ATOM 374 C LYS A 139 -48.873 16.164 12.124 1.00 17.92 C ATOM 375 O LYS A 139 -48.046 15.952 11.228 1.00 18.64 O ATOM 376 CB LYS A 139 -50.109 14.267 13.247 1.00 18.25 C ATOM 377 CG LYS A 139 -49.995 13.311 12.070 1.00 21.43 C ATOM 378 CD LYS A 139 -51.172 12.339 12.034 1.00 24.32 C ATOM 379 CE LYS A 139 -50.870 11.169 11.099 1.00 33.83 C ATOM 380 NZ LYS A 139 -52.095 10.408 10.733 1.00 40.88 N ATOM 381 HZ1 LYS A 139 -52.535 10.027 11.595 1.00 0.00 H ATOM 382 HZ2 LYS A 139 -52.764 11.042 10.251 1.00 0.00 H ATOM 383 HZ3 LYS A 139 -51.839 9.625 10.098 1.00 0.00 H ATOM 384 H LYS A 139 -49.828 15.903 15.232 1.00 0.00 H ATOM 385 N LYS A 140 -49.737 17.180 12.083 1.00 17.53 N ATOM 386 CA LYS A 140 -49.753 18.133 10.967 1.00 19.25 C ATOM 387 C LYS A 140 -48.445 18.926 10.903 1.00 18.73 C ATOM 388 O LYS A 140 -47.891 19.141 9.814 1.00 18.13 O ATOM 389 CB LYS A 140 -50.950 19.084 11.070 1.00 19.06 C ATOM 390 CG LYS A 140 -51.207 19.911 9.814 1.00 22.62 C ATOM 391 CD LYS A 140 -52.492 20.712 9.938 1.00 25.94 C ATOM 392 CE LYS A 140 -52.901 21.351 8.616 1.00 35.22 C ATOM 393 NZ LYS A 140 -52.078 22.545 8.292 1.00 42.76 N ATOM 394 HZ1 LYS A 140 -52.189 23.256 9.043 1.00 0.00 H ATOM 395 HZ2 LYS A 140 -51.078 22.267 8.222 1.00 0.00 H ATOM 396 HZ3 LYS A 140 -52.392 22.945 7.385 1.00 0.00 H ATOM 397 H LYS A 140 -50.416 17.300 12.861 1.00 0.00 H ATOM 398 N ALA A 141 -47.955 19.343 12.070 1.00 16.60 N ATOM 399 CA ALA A 141 -46.696 20.090 12.158 1.00 18.43 C ATOM 400 C ALA A 141 -45.494 19.295 11.614 1.00 18.00 C ATOM 401 O ALA A 141 -44.652 19.845 10.890 1.00 18.60 O ATOM 402 CB ALA A 141 -46.443 20.549 13.584 1.00 18.83 C ATOM 403 H ALA A 141 -48.480 19.133 12.943 1.00 0.00 H ATOM 404 N PHE A 142 -45.406 18.010 11.948 1.00 16.73 N ATOM 405 CA PHE A 142 -44.327 17.185 11.410 1.00 17.17 C ATOM 406 C PHE A 142 -44.487 16.993 9.903 1.00 17.97 C ATOM 407 O PHE A 142 -43.505 16.966 9.173 1.00 17.95 O ATOM 408 CB PHE A 142 -44.243 15.835 12.131 1.00 18.02 C ATOM 409 CG PHE A 142 -43.591 15.914 13.486 1.00 18.70 C ATOM 410 CD1 PHE A 142 -42.246 16.277 13.608 1.00 19.44 C ATOM 411 CD2 PHE A 142 -44.325 15.649 14.639 1.00 18.26 C ATOM 412 CE1 PHE A 142 -41.634 16.362 14.860 1.00 18.07 C ATOM 413 CE2 PHE A 142 -43.719 15.729 15.900 1.00 18.62 C ATOM 414 CZ PHE A 142 -42.377 16.083 16.010 1.00 18.41 C ATOM 415 H PHE A 142 -46.107 17.592 12.593 1.00 0.00 H ATOM 416 N LYS A 143 -45.731 16.881 9.443 1.00 18.89 N ATOM 417 CA LYS A 143 -46.009 16.687 8.017 1.00 20.70 C ATOM 418 C LYS A 143 -45.538 17.874 7.164 1.00 19.91 C ATOM 419 O LYS A 143 -45.116 17.702 6.017 1.00 20.28 O ATOM 420 CB LYS A 143 -47.497 16.396 7.797 1.00 20.49 C ATOM 421 CG LYS A 143 -47.856 16.008 6.369 1.00 23.73 C ATOM 422 CD LYS A 143 -49.305 15.530 6.280 1.00 25.69 C ATOM 423 CE LYS A 143 -49.873 15.698 4.874 1.00 32.30 C ATOM 424 NZ LYS A 143 -49.021 15.064 3.836 1.00 38.05 N ATOM 425 HZ1 LYS A 143 -48.075 15.497 3.853 1.00 0.00 H ATOM 426 HZ2 LYS A 143 -48.941 14.045 4.030 1.00 0.00 H ATOM 427 HZ3 LYS A 143 -49.452 15.207 2.900 1.00 0.00 H ATOM 428 H LYS A 143 -46.526 16.932 10.112 1.00 0.00 H ATOM 429 N VAL A 144 -45.559 19.072 7.744 1.00 17.15 N ATOM 430 CA VAL A 144 -45.008 20.259 7.088 1.00 18.98 C ATOM 431 C VAL A 144 -43.586 19.979 6.569 1.00 19.06 C ATOM 432 O VAL A 144 -43.236 20.327 5.429 1.00 20.91 O ATOM 433 CB VAL A 144 -45.003 21.464 8.074 1.00 18.50 C ATOM 434 CG1 VAL A 144 -44.159 22.630 7.547 1.00 19.68 C ATOM 435 CG2 VAL A 144 -46.427 21.913 8.380 1.00 21.24 C ATOM 436 H VAL A 144 -45.979 19.167 8.691 1.00 0.00 H ATOM 437 N TRP A 145 -42.781 19.335 7.413 1.00 19.83 N ATOM 438 CA TRP A 145 -41.366 19.127 7.153 1.00 19.65 C ATOM 439 C TRP A 145 -41.079 17.841 6.370 1.00 20.22 C ATOM 440 O TRP A 145 -40.215 17.836 5.494 1.00 20.60 O ATOM 441 CB TRP A 145 -40.576 19.148 8.462 1.00 18.30 C ATOM 442 CG TRP A 145 -40.701 20.446 9.223 1.00 16.79 C ATOM 443 CD1 TRP A 145 -41.330 20.634 10.427 1.00 18.62 C ATOM 444 CD2 TRP A 145 -40.204 21.731 8.823 1.00 16.85 C ATOM 445 NE1 TRP A 145 -41.242 21.964 10.802 1.00 16.68 N ATOM 446 CE2 TRP A 145 -40.555 22.653 9.837 1.00 16.48 C ATOM 447 CE3 TRP A 145 -39.478 22.193 7.712 1.00 16.33 C ATOM 448 CZ2 TRP A 145 -40.209 24.012 9.773 1.00 17.34 C ATOM 449 CZ3 TRP A 145 -39.136 23.548 7.647 1.00 18.04 C ATOM 450 CH2 TRP A 145 -39.509 24.440 8.669 1.00 18.83 C ATOM 451 HE1 TRP A 145 -41.634 22.373 11.674 1.00 0.00 H ATOM 452 H TRP A 145 -43.183 18.964 8.298 1.00 0.00 H ATOM 453 N SER A 146 -41.808 16.771 6.671 1.00 19.50 N ATOM 454 CA SER A 146 -41.637 15.510 5.936 1.00 19.98 C ATOM 455 C SER A 146 -42.103 15.636 4.480 1.00 20.66 C ATOM 456 O SER A 146 -41.573 14.954 3.605 1.00 22.59 O ATOM 457 CB SER A 146 -42.340 14.353 6.644 1.00 21.06 C ATOM 458 OG SER A 146 -43.730 14.558 6.645 1.00 20.29 O ATOM 459 HG SER A 146 -44.055 14.613 5.711 1.00 0.00 H ATOM 460 H SER A 146 -42.509 16.827 7.437 1.00 0.00 H ATOM 461 N ASP A 147 -43.062 16.531 4.215 1.00 19.35 N ATOM 462 CA ASP A 147 -43.585 16.717 2.861 1.00 20.36 C ATOM 463 C ASP A 147 -42.541 17.261 1.891 1.00 20.06 C ATOM 464 O ASP A 147 -42.688 17.100 0.684 1.00 23.15 O ATOM 465 CB ASP A 147 -44.808 17.642 2.848 1.00 20.96 C ATOM 466 CG ASP A 147 -46.129 16.905 3.082 1.00 26.31 C ATOM 467 OD1 ASP A 147 -46.155 15.652 3.122 1.00 27.36 O ATOM 468 OD2 ASP A 147 -47.160 17.607 3.200 1.00 31.40 O ATOM 469 H ASP A 147 -43.445 17.109 4.990 1.00 0.00 H ATOM 470 N VAL A 148 -41.500 17.904 2.418 1.00 18.92 N ATOM 471 CA VAL A 148 -40.485 18.578 1.577 1.00 20.67 C ATOM 472 C VAL A 148 -39.044 18.072 1.775 1.00 19.43 C ATOM 473 O VAL A 148 -38.083 18.704 1.331 1.00 20.19 O ATOM 474 CB VAL A 148 -40.543 20.121 1.746 1.00 19.26 C ATOM 475 CG1 VAL A 148 -41.912 20.665 1.304 1.00 20.74 C ATOM 476 CG2 VAL A 148 -40.252 20.522 3.183 1.00 19.87 C ATOM 477 H VAL A 148 -41.397 17.933 3.452 1.00 0.00 H ATOM 478 N THR A 149 -38.912 16.909 2.410 1.00 19.18 N ATOM 479 CA THR A 149 -37.626 16.291 2.711 1.00 19.29 C ATOM 480 C THR A 149 -37.805 14.770 2.600 1.00 19.51 C ATOM 481 O THR A 149 -38.905 14.306 2.330 1.00 20.61 O ATOM 482 CB THR A 149 -37.152 16.607 4.146 1.00 19.60 C ATOM 483 OG1 THR A 149 -38.094 16.073 5.087 1.00 19.63 O ATOM 484 CG2 THR A 149 -36.988 18.101 4.374 1.00 21.80 C ATOM 485 HG1 THR A 149 -38.981 16.484 4.933 1.00 0.00 H ATOM 486 H THR A 149 -39.776 16.413 2.708 1.00 0.00 H ATOM 487 N PRO A 150 -36.722 13.994 2.794 1.00 20.50 N ATOM 488 CA PRO A 150 -36.875 12.547 2.960 1.00 20.82 C ATOM 489 C PRO A 150 -37.156 12.093 4.403 1.00 20.59 C ATOM 490 O PRO A 150 -37.180 10.886 4.670 1.00 23.38 O ATOM 491 CB PRO A 150 -35.513 11.992 2.505 1.00 22.44 C ATOM 492 CG PRO A 150 -34.635 13.191 2.172 1.00 20.17 C ATOM 493 CD PRO A 150 -35.301 14.384 2.800 1.00 20.28 C ATOM 494 N LEU A 151 -37.371 13.036 5.318 1.00 20.13 N ATOM 495 CA LEU A 151 -37.598 12.703 6.736 1.00 19.08 C ATOM 496 C LEU A 151 -38.904 11.953 6.992 1.00 20.16 C ATOM 497 O LEU A 151 -39.930 12.249 6.376 1.00 22.24 O ATOM 498 CB LEU A 151 -37.561 13.970 7.603 1.00 19.22 C ATOM 499 CG LEU A 151 -36.247 14.742 7.719 1.00 17.99 C ATOM 500 CD1 LEU A 151 -36.518 16.082 8.403 1.00 21.61 C ATOM 501 CD2 LEU A 151 -35.183 13.940 8.467 1.00 23.54 C ATOM 502 H LEU A 151 -37.379 14.034 5.025 1.00 0.00 H ATOM 503 N ASN A 152 -38.844 10.961 7.880 1.00 19.58 N ATOM 504 CA ASN A 152 -40.027 10.233 8.339 1.00 21.41 C ATOM 505 C ASN A 152 -40.181 10.424 9.836 1.00 22.27 C ATOM 506 O ASN A 152 -39.194 10.340 10.582 1.00 25.37 O ATOM 507 CB ASN A 152 -39.922 8.738 8.022 1.00 22.13 C ATOM 508 CG ASN A 152 -39.779 8.455 6.533 1.00 25.62 C ATOM 509 OD1 ASN A 152 -40.530 8.978 5.707 1.00 28.52 O ATOM 510 ND2 ASN A 152 -38.827 7.597 6.188 1.00 27.14 N ATOM 511 HD22 ASN A 152 -38.215 7.179 6.917 1.00 0.00 H ATOM 512 HD21 ASN A 152 -38.693 7.343 5.188 1.00 0.00 H ATOM 513 H ASN A 152 -37.915 10.693 8.264 1.00 0.00 H ATOM 514 N PHE A 153 -41.415 10.664 10.271 1.00 20.79 N ATOM 515 CA PHE A 153 -41.726 10.872 11.686 1.00 20.24 C ATOM 516 C PHE A 153 -42.698 9.826 12.190 1.00 20.79 C ATOM 517 O PHE A 153 -43.784 9.663 11.631 1.00 21.34 O ATOM 518 CB PHE A 153 -42.296 12.272 11.924 1.00 19.25 C ATOM 519 CG PHE A 153 -41.329 13.365 11.598 1.00 19.13 C ATOM 520 CD1 PHE A 153 -40.285 13.664 12.468 1.00 20.15 C ATOM 521 CD2 PHE A 153 -41.430 14.070 10.405 1.00 20.33 C ATOM 522 CE1 PHE A 153 -39.377 14.655 12.163 1.00 18.46 C ATOM 523 CE2 PHE A 153 -40.516 15.073 10.094 1.00 18.30 C ATOM 524 CZ PHE A 153 -39.483 15.357 10.972 1.00 19.38 C ATOM 525 H PHE A 153 -42.189 10.705 9.578 1.00 0.00 H ATOM 526 N THR A 154 -42.295 9.117 13.235 1.00 19.98 N ATOM 527 CA THR A 154 -43.158 8.103 13.848 1.00 20.74 C ATOM 528 C THR A 154 -43.379 8.431 15.320 1.00 19.76 C ATOM 529 O THR A 154 -42.438 8.709 16.069 1.00 19.62 O ATOM 530 CB THR A 154 -42.579 6.674 13.705 1.00 22.93 C ATOM 531 OG1 THR A 154 -42.120 6.465 12.367 1.00 24.76 O ATOM 532 CG2 THR A 154 -43.644 5.632 14.018 1.00 25.18 C ATOM 533 HG1 THR A 154 -41.414 7.126 12.154 1.00 0.00 H ATOM 534 H THR A 154 -41.347 9.284 13.628 1.00 0.00 H ATOM 535 N ARG A 155 -44.636 8.399 15.730 1.00 19.75 N ATOM 536 CA ARG A 155 -44.990 8.647 17.115 1.00 19.62 C ATOM 537 C ARG A 155 -44.773 7.412 18.007 1.00 20.00 C ATOM 538 O ARG A 155 -45.191 6.294 17.668 1.00 20.77 O ATOM 539 CB ARG A 155 -46.439 9.114 17.193 1.00 19.20 C ATOM 540 CG ARG A 155 -46.871 9.509 18.585 1.00 20.72 C ATOM 541 CD ARG A 155 -48.344 9.861 18.621 1.00 25.46 C ATOM 542 NE ARG A 155 -48.802 9.889 20.001 1.00 25.19 N ATOM 543 CZ ARG A 155 -50.060 9.725 20.387 1.00 27.16 C ATOM 544 NH1 ARG A 155 -50.347 9.760 21.680 1.00 30.42 N ATOM 545 NH2 ARG A 155 -51.027 9.523 19.496 1.00 29.74 N ATOM 546 HE ARG A 155 -48.089 10.050 20.741 1.00 0.00 H ATOM 547 HH12 ARG A 155 -51.329 9.633 21.998 1.00 0.00 H ATOM 548 HH11 ARG A 155 -49.590 9.914 22.377 1.00 0.00 H ATOM 549 HH22 ARG A 155 -52.009 9.396 19.814 1.00 0.00 H ATOM 550 HH21 ARG A 155 -50.801 9.492 18.481 1.00 0.00 H ATOM 551 H ARG A 155 -45.389 8.191 15.043 1.00 0.00 H ATOM 552 N LEU A 156 -44.102 7.629 19.136 1.00 19.89 N ATOM 553 CA LEU A 156 -43.974 6.628 20.189 1.00 22.29 C ATOM 554 C LEU A 156 -44.912 6.982 21.327 1.00 22.29 C ATOM 555 O LEU A 156 -45.076 8.160 21.662 1.00 22.55 O ATOM 556 CB LEU A 156 -42.545 6.602 20.728 1.00 23.34 C ATOM 557 CG LEU A 156 -41.498 5.673 20.126 1.00 29.09 C ATOM 558 CD1 LEU A 156 -41.641 5.515 18.631 1.00 33.52 C ATOM 559 CD2 LEU A 156 -40.112 6.163 20.500 1.00 24.33 C ATOM 560 H LEU A 156 -43.648 8.555 19.273 1.00 0.00 H ATOM 561 N HIS A 157 -45.508 5.970 21.946 1.00 25.03 N ATOM 562 CA HIS A 157 -46.417 6.223 23.061 1.00 26.09 C ATOM 563 C HIS A 157 -45.723 6.363 24.411 1.00 25.70 C ATOM 564 O HIS A 157 -46.259 6.996 25.326 1.00 27.93 O ATOM 565 CB HIS A 157 -47.570 5.216 23.063 1.00 29.20 C ATOM 566 CG HIS A 157 -48.561 5.481 21.974 1.00 36.06 C ATOM 567 ND1 HIS A 157 -49.713 6.211 22.175 1.00 42.85 N ATOM 568 CD2 HIS A 157 -48.535 5.175 20.655 1.00 42.41 C ATOM 569 CE1 HIS A 157 -50.373 6.310 21.035 1.00 44.16 C ATOM 570 NE2 HIS A 157 -49.678 5.693 20.096 1.00 45.38 N ATOM 571 H HIS A 157 -45.327 4.994 21.636 1.00 0.00 H ATOM 572 N ASP A 158 -44.510 5.823 24.504 1.00 25.32 N ATOM 573 CA ASP A 158 -43.705 5.866 25.723 1.00 26.55 C ATOM 574 C ASP A 158 -42.229 5.652 25.391 1.00 25.85 C ATOM 575 O ASP A 158 -41.864 5.498 24.226 1.00 26.53 O ATOM 576 CB ASP A 158 -44.178 4.781 26.686 1.00 28.51 C ATOM 577 CG ASP A 158 -44.350 3.444 26.000 1.00 32.90 C ATOM 578 OD1 ASP A 158 -45.443 2.854 26.120 1.00 43.85 O ATOM 579 OD2 ASP A 158 -43.403 2.987 25.317 1.00 37.34 O ATOM 580 H ASP A 158 -44.116 5.347 23.668 1.00 0.00 H ATOM 581 N GLY A 159 -41.381 5.633 26.417 1.00 25.31 N ATOM 582 CA GLY A 159 -39.954 5.437 26.222 1.00 25.41 C ATOM 583 C GLY A 159 -39.230 6.651 25.665 1.00 25.71 C ATOM 584 O GLY A 159 -39.723 7.788 25.755 1.00 23.00 O ATOM 585 H GLY A 159 -41.748 5.762 27.381 1.00 0.00 H ATOM 586 N ILE A 160 -38.053 6.412 25.089 1.00 26.57 N ATOM 587 CA ILE A 160 -37.204 7.495 24.602 1.00 27.08 C ATOM 588 C ILE A 160 -37.361 7.689 23.099 1.00 25.85 C ATOM 589 O ILE A 160 -37.085 6.790 22.305 1.00 27.99 O ATOM 590 CB ILE A 160 -35.708 7.295 24.976 1.00 30.74 C ATOM 591 CG1 ILE A 160 -35.556 7.057 26.485 1.00 33.95 C ATOM 592 CG2 ILE A 160 -34.890 8.514 24.541 1.00 32.87 C ATOM 593 CD1 ILE A 160 -34.244 6.384 26.886 1.00 39.70 C ATOM 594 H ILE A 160 -37.731 5.429 24.984 1.00 0.00 H ATOM 595 N ALA A 161 -37.843 8.869 22.728 1.00 22.66 N ATOM 596 CA ALA A 161 -37.930 9.275 21.341 1.00 20.81 C ATOM 597 C ALA A 161 -36.871 10.340 21.052 1.00 20.18 C ATOM 598 O ALA A 161 -36.355 10.982 21.979 1.00 20.82 O ATOM 599 CB ALA A 161 -39.318 9.826 21.059 1.00 21.16 C ATOM 600 H ALA A 161 -38.171 9.528 23.463 1.00 0.00 H ATOM 601 N ASP A 162 -36.556 10.535 19.770 1.00 19.54 N ATOM 602 CA ASP A 162 -35.641 11.598 19.354 1.00 19.77 C ATOM 603 C ASP A 162 -36.154 12.963 19.786 1.00 20.28 C ATOM 604 O ASP A 162 -35.429 13.747 20.392 1.00 22.25 O ATOM 605 CB ASP A 162 -35.433 11.582 17.838 1.00 19.73 C ATOM 606 CG ASP A 162 -34.848 10.269 17.348 1.00 24.39 C ATOM 607 OD1 ASP A 162 -33.752 9.896 17.829 1.00 26.39 O ATOM 608 OD2 ASP A 162 -35.478 9.606 16.493 1.00 24.56 O ATOM 609 H ASP A 162 -36.972 9.914 19.047 1.00 0.00 H ATOM 610 N ILE A 163 -37.416 13.225 19.477 1.00 18.53 N ATOM 611 CA ILE A 163 -38.049 14.499 19.822 1.00 19.38 C ATOM 612 C ILE A 163 -39.059 14.279 20.956 1.00 18.93 C ATOM 613 O ILE A 163 -40.165 13.794 20.721 1.00 18.11 O ATOM 614 CB ILE A 163 -38.719 15.125 18.573 1.00 18.03 C ATOM 615 CG1 ILE A 163 -37.656 15.418 17.493 1.00 20.69 C ATOM 616 CG2 ILE A 163 -39.518 16.375 18.952 1.00 17.62 C ATOM 617 CD1 ILE A 163 -38.214 15.718 16.116 1.00 23.07 C ATOM 618 H ILE A 163 -37.973 12.504 18.975 1.00 0.00 H ATOM 619 N MET A 164 -38.652 14.597 22.183 1.00 18.33 N ATOM 620 CA MET A 164 -39.536 14.518 23.352 1.00 17.30 C ATOM 621 C MET A 164 -40.305 15.829 23.499 1.00 17.72 C ATOM 622 O MET A 164 -39.697 16.899 23.649 1.00 18.43 O ATOM 623 CB MET A 164 -38.730 14.231 24.623 1.00 18.58 C ATOM 624 CG MET A 164 -37.892 12.966 24.545 1.00 17.27 C ATOM 625 SD MET A 164 -38.889 11.464 24.656 1.00 22.26 S ATOM 626 CE MET A 164 -39.117 11.360 26.426 1.00 25.47 C ATOM 627 H MET A 164 -37.671 14.913 22.318 1.00 0.00 H ATOM 628 N ILE A 165 -41.633 15.745 23.419 1.00 16.96 N ATOM 629 CA ILE A 165 -42.502 16.923 23.476 1.00 15.57 C ATOM 630 C ILE A 165 -43.199 17.010 24.831 1.00 17.28 C ATOM 631 O ILE A 165 -43.799 16.044 25.291 1.00 16.05 O ATOM 632 CB ILE A 165 -43.571 16.894 22.351 1.00 15.71 C ATOM 633 CG1 ILE A 165 -42.895 16.811 20.974 1.00 17.32 C ATOM 634 CG2 ILE A 165 -44.471 18.129 22.434 1.00 16.58 C ATOM 635 CD1 ILE A 165 -43.807 16.276 19.872 1.00 18.83 C ATOM 636 H ILE A 165 -42.069 14.807 23.312 1.00 0.00 H ATOM 637 N SER A 166 -43.147 18.178 25.469 1.00 15.39 N ATOM 638 CA SER A 166 -43.865 18.331 26.736 1.00 16.09 C ATOM 639 C SER A 166 -44.345 19.745 26.982 1.00 15.71 C ATOM 640 O SER A 166 -43.848 20.695 26.380 1.00 16.85 O ATOM 641 CB SER A 166 -42.996 17.874 27.905 1.00 19.09 C ATOM 642 OG SER A 166 -41.805 18.621 27.968 1.00 22.63 O ATOM 643 HG SER A 166 -41.297 18.501 27.127 1.00 0.00 H ATOM 644 H SER A 166 -42.603 18.971 25.072 1.00 0.00 H ATOM 645 N PHE A 167 -45.310 19.847 27.892 1.00 15.97 N ATOM 646 CA PHE A 167 -45.864 21.105 28.375 1.00 16.04 C ATOM 647 C PHE A 167 -45.430 21.299 29.827 1.00 18.53 C ATOM 648 O PHE A 167 -45.563 20.402 30.664 1.00 19.42 O ATOM 649 CB PHE A 167 -47.391 21.071 28.288 1.00 16.90 C ATOM 650 CG PHE A 167 -47.924 21.014 26.882 1.00 16.82 C ATOM 651 CD1 PHE A 167 -48.099 19.791 26.228 1.00 17.43 C ATOM 652 CD2 PHE A 167 -48.282 22.200 26.214 1.00 15.93 C ATOM 653 CE1 PHE A 167 -48.601 19.741 24.925 1.00 18.06 C ATOM 654 CE2 PHE A 167 -48.793 22.152 24.915 1.00 16.96 C ATOM 655 CZ PHE A 167 -48.948 20.932 24.272 1.00 17.25 C ATOM 656 H PHE A 167 -45.697 18.966 28.287 1.00 0.00 H ATOM 657 N GLY A 168 -44.895 22.473 30.129 1.00 18.31 N ATOM 658 CA GLY A 168 -44.473 22.749 31.482 1.00 18.85 C ATOM 659 C GLY A 168 -44.540 24.230 31.773 1.00 15.95 C ATOM 660 O GLY A 168 -44.750 25.044 30.874 1.00 18.54 O ATOM 661 H GLY A 168 -44.779 23.196 29.391 1.00 0.00 H ATOM 662 N ILE A 169 -44.371 24.574 33.042 1.00 16.00 N ATOM 663 CA ILE A 169 -44.340 25.982 33.440 1.00 14.97 C ATOM 664 C ILE A 169 -43.079 26.277 34.237 1.00 15.18 C ATOM 665 O ILE A 169 -42.468 25.367 34.809 1.00 16.48 O ATOM 666 CB ILE A 169 -45.591 26.390 34.253 1.00 15.78 C ATOM 667 CG1 ILE A 169 -45.672 25.615 35.575 1.00 18.00 C ATOM 668 CG2 ILE A 169 -46.877 26.187 33.411 1.00 15.44 C ATOM 669 CD1 ILE A 169 -46.724 26.139 36.543 1.00 17.58 C ATOM 670 H ILE A 169 -44.259 23.834 33.764 1.00 0.00 H ATOM 671 N LYS A 170 -42.693 27.550 34.244 1.00 15.92 N ATOM 672 CA LYS A 170 -41.559 28.037 35.042 1.00 18.05 C ATOM 673 C LYS A 170 -40.321 27.121 34.912 1.00 18.14 C ATOM 674 O LYS A 170 -39.914 26.797 33.789 1.00 17.67 O ATOM 675 CB LYS A 170 -42.004 28.230 36.501 1.00 18.81 C ATOM 676 CG LYS A 170 -43.215 29.162 36.693 1.00 19.68 C ATOM 677 CD LYS A 170 -42.966 30.572 36.158 1.00 23.03 C ATOM 678 CE LYS A 170 -44.180 31.479 36.374 1.00 25.70 C ATOM 679 NZ LYS A 170 -44.410 31.796 37.822 1.00 29.25 N ATOM 680 HZ1 LYS A 170 -44.572 30.913 38.347 1.00 0.00 H ATOM 681 HZ2 LYS A 170 -43.574 32.282 38.206 1.00 0.00 H ATOM 682 HZ3 LYS A 170 -45.243 32.412 37.913 1.00 0.00 H ATOM 683 H LYS A 170 -43.217 28.231 33.659 1.00 0.00 H ATOM 684 N GLU A 171 -39.713 26.715 36.030 1.00 18.48 N ATOM 685 CA GLU A 171 -38.593 25.760 35.980 1.00 19.43 C ATOM 686 C GLU A 171 -39.138 24.375 35.647 1.00 19.85 C ATOM 687 O GLU A 171 -39.961 23.834 36.395 1.00 18.30 O ATOM 688 CB GLU A 171 -37.795 25.738 37.295 1.00 21.07 C ATOM 689 CG GLU A 171 -37.049 27.046 37.621 1.00 22.13 C ATOM 690 CD GLU A 171 -35.779 27.256 36.789 1.00 28.19 C ATOM 691 OE1 GLU A 171 -35.398 26.363 35.997 1.00 27.15 O ATOM 692 OE2 GLU A 171 -35.138 28.327 36.934 1.00 28.89 O ATOM 693 H GLU A 171 -40.035 27.079 36.949 1.00 0.00 H ATOM 694 N HIS A 172 -38.682 23.814 34.525 1.00 18.32 N ATOM 695 CA HIS A 172 -39.202 22.541 34.018 1.00 19.42 C ATOM 696 C HIS A 172 -38.122 21.497 33.661 1.00 19.02 C ATOM 697 O HIS A 172 -38.433 20.475 33.032 1.00 19.14 O ATOM 698 CB HIS A 172 -40.161 22.786 32.830 1.00 17.76 C ATOM 699 CG HIS A 172 -39.505 23.441 31.650 1.00 14.20 C ATOM 700 ND1 HIS A 172 -39.349 24.808 31.549 1.00 16.76 N ATOM 701 CD2 HIS A 172 -38.910 22.910 30.554 1.00 18.03 C ATOM 702 CE1 HIS A 172 -38.696 25.092 30.433 1.00 17.27 C ATOM 703 NE2 HIS A 172 -38.402 23.956 29.818 1.00 14.00 N ATOM 704 H HIS A 172 -37.931 24.297 33.992 1.00 0.00 H ATOM 705 N GLY A 173 -36.874 21.741 34.080 1.00 19.02 N ATOM 706 CA GLY A 173 -35.790 20.753 33.947 1.00 20.30 C ATOM 707 C GLY A 173 -34.691 21.090 32.946 1.00 19.60 C ATOM 708 O GLY A 173 -34.054 20.194 32.381 1.00 21.33 O ATOM 709 H GLY A 173 -36.662 22.662 34.515 1.00 0.00 H ATOM 710 N ASP A 174 -34.471 22.381 32.717 1.00 19.49 N ATOM 711 CA ASP A 174 -33.373 22.830 31.858 1.00 20.08 C ATOM 712 C ASP A 174 -32.979 24.260 32.206 1.00 20.25 C ATOM 713 O ASP A 174 -33.480 24.820 33.171 1.00 20.49 O ATOM 714 CB ASP A 174 -33.730 22.684 30.372 1.00 19.19 C ATOM 715 CG ASP A 174 -34.958 23.490 29.972 1.00 20.45 C ATOM 716 OD1 ASP A 174 -35.231 24.550 30.557 1.00 18.44 O ATOM 717 OD2 ASP A 174 -35.656 23.034 29.062 1.00 18.78 O ATOM 718 H ASP A 174 -35.093 23.088 33.158 1.00 0.00 H ATOM 719 N PHE A 175 -32.079 24.846 31.417 1.00 20.44 N ATOM 720 CA PHE A 175 -31.568 26.187 31.680 1.00 21.46 C ATOM 721 C PHE A 175 -32.419 27.286 31.043 1.00 21.39 C ATOM 722 O PHE A 175 -32.003 28.443 30.967 1.00 22.52 O ATOM 723 CB PHE A 175 -30.125 26.306 31.181 1.00 21.30 C ATOM 724 CG PHE A 175 -29.102 25.718 32.112 1.00 22.52 C ATOM 725 CD1 PHE A 175 -29.032 26.124 33.441 1.00 22.53 C ATOM 726 CD2 PHE A 175 -28.184 24.778 31.649 1.00 23.23 C ATOM 727 CE1 PHE A 175 -28.074 25.583 34.302 1.00 23.75 C ATOM 728 CE2 PHE A 175 -27.219 24.237 32.500 1.00 27.73 C ATOM 729 CZ PHE A 175 -27.166 24.641 33.828 1.00 26.15 C ATOM 730 H PHE A 175 -31.729 24.330 30.585 1.00 0.00 H ATOM 731 N TYR A 176 -33.613 26.917 30.592 1.00 20.56 N ATOM 732 CA TYR A 176 -34.499 27.837 29.900 1.00 21.42 C ATOM 733 C TYR A 176 -35.875 27.892 30.582 1.00 19.33 C ATOM 734 O TYR A 176 -36.887 27.517 29.976 1.00 18.92 O ATOM 735 CB TYR A 176 -34.600 27.446 28.414 1.00 23.93 C ATOM 736 CG TYR A 176 -33.250 27.370 27.720 1.00 27.19 C ATOM 737 CD1 TYR A 176 -32.530 26.178 27.683 1.00 30.58 C ATOM 738 CD2 TYR A 176 -32.689 28.498 27.118 1.00 33.21 C ATOM 739 CE1 TYR A 176 -31.280 26.107 27.063 1.00 35.21 C ATOM 740 CE2 TYR A 176 -31.442 28.438 26.493 1.00 34.08 C ATOM 741 CZ TYR A 176 -30.745 27.242 26.469 1.00 34.16 C ATOM 742 OH TYR A 176 -29.513 27.171 25.852 1.00 36.01 O ATOM 743 HH TYR A 176 -29.160 26.249 25.928 1.00 0.00 H ATOM 744 H TYR A 176 -33.924 25.936 30.739 1.00 0.00 H ATOM 745 N PRO A 177 -35.925 28.376 31.841 1.00 19.70 N ATOM 746 CA PRO A 177 -37.210 28.403 32.542 1.00 19.45 C ATOM 747 C PRO A 177 -38.241 29.301 31.856 1.00 19.56 C ATOM 748 O PRO A 177 -37.879 30.338 31.273 1.00 19.63 O ATOM 749 CB PRO A 177 -36.854 28.969 33.914 1.00 21.89 C ATOM 750 CG PRO A 177 -35.574 29.747 33.685 1.00 20.10 C ATOM 751 CD PRO A 177 -34.839 28.921 32.679 1.00 20.28 C ATOM 752 N PHE A 178 -39.509 28.900 31.920 1.00 18.37 N ATOM 753 CA PHE A 178 -40.583 29.731 31.390 1.00 17.64 C ATOM 754 C PHE A 178 -40.918 30.845 32.367 1.00 19.56 C ATOM 755 O PHE A 178 -40.382 30.886 33.481 1.00 19.20 O ATOM 756 CB PHE A 178 -41.809 28.891 31.009 1.00 17.44 C ATOM 757 CG PHE A 178 -41.596 28.046 29.779 1.00 16.87 C ATOM 758 CD1 PHE A 178 -41.098 28.617 28.608 1.00 16.42 C ATOM 759 CD2 PHE A 178 -41.878 26.677 29.797 1.00 19.35 C ATOM 760 CE1 PHE A 178 -40.899 27.840 27.462 1.00 16.35 C ATOM 761 CE2 PHE A 178 -41.683 25.883 28.663 1.00 18.43 C ATOM 762 CZ PHE A 178 -41.188 26.461 27.491 1.00 18.72 C ATOM 763 H PHE A 178 -39.736 27.982 32.354 1.00 0.00 H ATOM 764 N ASP A 179 -41.788 31.750 31.935 1.00 18.90 N ATOM 765 CA ASP A 179 -41.940 33.049 32.582 1.00 21.18 C ATOM 766 C ASP A 179 -43.394 33.436 32.886 1.00 20.56 C ATOM 767 O ASP A 179 -43.699 34.612 33.120 1.00 20.06 O ATOM 768 CB ASP A 179 -41.285 34.116 31.691 1.00 20.25 C ATOM 769 CG ASP A 179 -41.894 34.174 30.288 1.00 23.69 C ATOM 770 OD1 ASP A 179 -42.762 33.321 29.945 1.00 19.14 O ATOM 771 OD2 ASP A 179 -41.511 35.094 29.522 1.00 24.08 O ATOM 772 H ASP A 179 -42.380 31.526 31.110 1.00 0.00 H ATOM 773 N GLY A 180 -44.287 32.453 32.876 1.00 19.04 N ATOM 774 CA GLY A 180 -45.705 32.716 33.064 1.00 20.93 C ATOM 775 C GLY A 180 -46.379 33.163 31.776 1.00 19.06 C ATOM 776 O GLY A 180 -45.812 32.989 30.676 1.00 19.99 O ATOM 777 H GLY A 180 -43.966 31.475 32.731 1.00 0.00 H ATOM 778 N PRO A 181 -47.593 33.741 31.893 1.00 20.81 N ATOM 779 CA PRO A 181 -48.372 34.181 30.729 1.00 23.30 C ATOM 780 C PRO A 181 -47.609 35.184 29.866 1.00 24.67 C ATOM 781 O PRO A 181 -46.902 36.053 30.398 1.00 25.65 O ATOM 782 CB PRO A 181 -49.624 34.823 31.345 1.00 24.39 C ATOM 783 CG PRO A 181 -49.683 34.358 32.743 1.00 24.90 C ATOM 784 CD PRO A 181 -48.287 33.997 33.168 1.00 22.98 C ATOM 785 N SER A 182 -47.732 35.033 28.548 1.00 25.53 N ATOM 786 CA SER A 182 -46.991 35.836 27.552 1.00 25.96 C ATOM 787 C SER A 182 -45.459 35.731 27.707 1.00 24.13 C ATOM 788 O SER A 182 -44.959 34.803 28.363 1.00 20.79 O ATOM 789 CB SER A 182 -47.501 37.287 27.478 1.00 28.01 C ATOM 790 OG SER A 182 -47.568 37.896 28.754 1.00 36.41 O ATOM 791 HG SER A 182 -48.186 37.381 29.332 1.00 0.00 H ATOM 792 H SER A 182 -48.389 34.306 28.199 1.00 0.00 H ATOM 793 N GLY A 183 -44.715 36.634 27.068 1.00 23.02 N ATOM 794 CA GLY A 183 -43.258 36.521 27.019 1.00 21.72 C ATOM 795 C GLY A 183 -42.839 35.281 26.236 1.00 21.31 C ATOM 796 O GLY A 183 -43.326 35.050 25.128 1.00 21.49 O ATOM 797 H GLY A 183 -45.180 37.435 26.595 1.00 0.00 H ATOM 798 N LEU A 184 -41.946 34.482 26.812 1.00 21.21 N ATOM 799 CA LEU A 184 -41.552 33.201 26.210 1.00 21.81 C ATOM 800 C LEU A 184 -42.759 32.285 26.084 1.00 19.99 C ATOM 801 O LEU A 184 -43.598 32.218 27.003 1.00 20.38 O ATOM 802 CB LEU A 184 -40.478 32.492 27.042 1.00 22.85 C ATOM 803 CG LEU A 184 -39.244 33.295 27.441 1.00 24.26 C ATOM 804 CD1 LEU A 184 -38.459 32.516 28.482 1.00 26.59 C ATOM 805 CD2 LEU A 184 -38.381 33.591 26.223 1.00 26.09 C ATOM 806 H LEU A 184 -41.515 34.772 27.713 1.00 0.00 H ATOM 807 N LEU A 185 -42.866 31.618 24.940 1.00 18.79 N ATOM 808 CA LEU A 185 -43.980 30.683 24.706 1.00 18.81 C ATOM 809 C LEU A 185 -43.590 29.223 24.541 1.00 17.62 C ATOM 810 O LEU A 185 -44.406 28.343 24.812 1.00 16.70 O ATOM 811 CB LEU A 185 -44.843 31.110 23.516 1.00 18.89 C ATOM 812 CG LEU A 185 -44.273 31.239 22.112 1.00 25.03 C ATOM 813 CD1 LEU A 185 -45.305 30.849 21.057 1.00 24.26 C ATOM 814 CD2 LEU A 185 -43.885 32.683 21.904 1.00 25.97 C ATOM 815 H LEU A 185 -42.151 31.758 24.197 1.00 0.00 H ATOM 816 N ALA A 186 -42.361 28.980 24.081 1.00 16.07 N ATOM 817 CA ALA A 186 -41.889 27.635 23.763 1.00 15.43 C ATOM 818 C ALA A 186 -40.426 27.710 23.401 1.00 17.21 C ATOM 819 O ALA A 186 -39.905 28.790 23.128 1.00 17.99 O ATOM 820 CB ALA A 186 -42.704 27.039 22.601 1.00 16.93 C ATOM 821 H ALA A 186 -41.713 29.781 23.943 1.00 0.00 H ATOM 822 N HIS A 187 -39.752 26.565 23.424 1.00 16.28 N ATOM 823 CA HIS A 187 -38.417 26.475 22.849 1.00 15.83 C ATOM 824 C HIS A 187 -38.129 25.034 22.491 1.00 16.76 C ATOM 825 O HIS A 187 -38.769 24.114 23.004 1.00 16.05 O ATOM 826 CB HIS A 187 -37.328 27.022 23.786 1.00 18.55 C ATOM 827 CG HIS A 187 -37.383 26.453 25.162 1.00 18.41 C ATOM 828 ND1 HIS A 187 -37.795 27.189 26.249 1.00 26.64 N ATOM 829 CD2 HIS A 187 -37.117 25.210 25.625 1.00 21.48 C ATOM 830 CE1 HIS A 187 -37.762 26.428 27.328 1.00 24.90 C ATOM 831 NE2 HIS A 187 -37.349 25.224 26.976 1.00 21.53 N ATOM 832 H HIS A 187 -40.183 25.724 23.858 1.00 0.00 H ATOM 833 N ALA A 188 -37.171 24.865 21.589 1.00 16.58 N ATOM 834 CA ALA A 188 -36.771 23.556 21.102 1.00 17.50 C ATOM 835 C ALA A 188 -35.258 23.511 20.958 1.00 17.64 C ATOM 836 O ALA A 188 -34.611 24.531 20.674 1.00 19.04 O ATOM 837 CB ALA A 188 -37.460 23.257 19.778 1.00 16.67 C ATOM 838 H ALA A 188 -36.686 25.705 21.215 1.00 0.00 H ATOM 839 N PHE A 189 -34.682 22.336 21.184 1.00 18.20 N ATOM 840 CA PHE A 189 -33.240 22.151 21.074 1.00 19.61 C ATOM 841 C PHE A 189 -32.841 21.689 19.673 1.00 21.12 C ATOM 842 O PHE A 189 -33.551 20.889 19.061 1.00 19.46 O ATOM 843 CB PHE A 189 -32.773 21.121 22.107 1.00 21.37 C ATOM 844 CG PHE A 189 -32.959 21.567 23.523 1.00 21.84 C ATOM 845 CD1 PHE A 189 -34.180 21.403 24.168 1.00 25.58 C ATOM 846 CD2 PHE A 189 -31.909 22.166 24.215 1.00 26.80 C ATOM 847 CE1 PHE A 189 -34.364 21.839 25.480 1.00 26.21 C ATOM 848 CE2 PHE A 189 -32.078 22.598 25.529 1.00 28.64 C ATOM 849 CZ PHE A 189 -33.310 22.430 26.167 1.00 27.46 C ATOM 850 H PHE A 189 -35.277 21.524 21.447 1.00 0.00 H ATOM 851 N PRO A 190 -31.700 22.185 19.159 1.00 23.06 N ATOM 852 CA PRO A 190 -31.216 21.695 17.866 1.00 21.89 C ATOM 853 C PRO A 190 -30.902 20.201 17.902 1.00 22.43 C ATOM 854 O PRO A 190 -30.747 19.637 18.986 1.00 22.41 O ATOM 855 CB PRO A 190 -29.937 22.509 17.614 1.00 24.39 C ATOM 856 CG PRO A 190 -29.628 23.216 18.875 1.00 27.89 C ATOM 857 CD PRO A 190 -30.834 23.229 19.738 1.00 23.55 C ATOM 858 N PRO A 191 -30.803 19.564 16.722 1.00 23.13 N ATOM 859 CA PRO A 191 -30.514 18.124 16.649 1.00 24.71 C ATOM 860 C PRO A 191 -29.311 17.719 17.504 1.00 27.71 C ATOM 861 O PRO A 191 -28.335 18.468 17.600 1.00 25.78 O ATOM 862 CB PRO A 191 -30.221 17.906 15.167 1.00 26.04 C ATOM 863 CG PRO A 191 -31.021 18.958 14.480 1.00 25.09 C ATOM 864 CD PRO A 191 -30.973 20.156 15.382 1.00 22.73 C ATOM 865 N GLY A 192 -29.410 16.551 18.134 1.00 28.38 N ATOM 866 CA GLY A 192 -28.368 16.047 19.032 1.00 30.69 C ATOM 867 C GLY A 192 -28.928 15.038 20.021 1.00 32.12 C ATOM 868 O GLY A 192 -30.124 14.729 19.975 1.00 29.20 O ATOM 869 H GLY A 192 -30.261 15.973 17.983 1.00 0.00 H ATOM 870 N PRO A 193 -28.067 14.512 20.919 1.00 34.72 N ATOM 871 CA PRO A 193 -28.469 13.507 21.905 1.00 35.34 C ATOM 872 C PRO A 193 -29.142 14.118 23.132 1.00 35.01 C ATOM 873 O PRO A 193 -29.107 15.341 23.318 1.00 34.75 O ATOM 874 CB PRO A 193 -27.137 12.870 22.307 1.00 36.09 C ATOM 875 CG PRO A 193 -26.160 13.986 22.194 1.00 37.69 C ATOM 876 CD PRO A 193 -26.633 14.849 21.042 1.00 35.89 C ATOM 877 N ASN A 194 -29.726 13.256 23.968 1.00 34.35 N ATOM 878 CA ASN A 194 -30.488 13.679 25.138 1.00 33.89 C ATOM 879 C ASN A 194 -31.439 14.794 24.731 1.00 30.47 C ATOM 880 O ASN A 194 -32.292 14.589 23.867 1.00 28.57 O ATOM 881 CB ASN A 194 -29.568 14.118 26.291 1.00 35.65 C ATOM 882 CG ASN A 194 -28.686 12.992 26.804 1.00 43.37 C ATOM 883 OD1 ASN A 194 -27.878 12.425 26.060 1.00 46.64 O ATOM 884 ND2 ASN A 194 -28.824 12.674 28.089 1.00 48.92 N ATOM 885 HD22 ASN A 194 -29.517 13.178 28.678 1.00 0.00 H ATOM 886 HD21 ASN A 194 -28.239 11.921 28.504 1.00 0.00 H ATOM 887 H ASN A 194 -29.634 12.238 23.777 1.00 0.00 H ATOM 888 N TYR A 195 -31.244 15.979 25.306 1.00 30.75 N ATOM 889 CA TYR A 195 -32.104 17.144 25.060 1.00 29.68 C ATOM 890 C TYR A 195 -32.277 17.523 23.594 1.00 26.50 C ATOM 891 O TYR A 195 -33.298 18.122 23.228 1.00 24.31 O ATOM 892 CB TYR A 195 -31.591 18.350 25.858 1.00 32.37 C ATOM 893 CG TYR A 195 -31.920 18.251 27.322 1.00 37.96 C ATOM 894 CD1 TYR A 195 -31.057 17.601 28.210 1.00 43.11 C ATOM 895 CD2 TYR A 195 -33.104 18.790 27.825 1.00 39.72 C ATOM 896 CE1 TYR A 195 -31.371 17.492 29.566 1.00 42.87 C ATOM 897 CE2 TYR A 195 -33.421 18.695 29.180 1.00 42.63 C ATOM 898 CZ TYR A 195 -32.551 18.046 30.044 1.00 42.54 C ATOM 899 OH TYR A 195 -32.864 17.944 31.383 1.00 41.47 O ATOM 900 HH TYR A 195 -32.956 18.851 31.769 1.00 0.00 H ATOM 901 H TYR A 195 -30.444 16.085 25.961 1.00 0.00 H ATOM 902 N GLY A 196 -31.293 17.174 22.764 1.00 23.90 N ATOM 903 CA GLY A 196 -31.309 17.520 21.344 1.00 22.31 C ATOM 904 C GLY A 196 -32.630 17.165 20.682 1.00 21.34 C ATOM 905 O GLY A 196 -33.129 16.056 20.861 1.00 21.83 O ATOM 906 H GLY A 196 -30.486 16.637 23.140 1.00 0.00 H ATOM 907 N GLY A 197 -33.211 18.103 19.938 1.00 20.25 N ATOM 908 CA GLY A 197 -34.490 17.857 19.271 1.00 19.27 C ATOM 909 C GLY A 197 -35.722 18.097 20.131 1.00 19.39 C ATOM 910 O GLY A 197 -36.819 18.285 19.598 1.00 18.81 O ATOM 911 H GLY A 197 -32.748 19.028 19.829 1.00 0.00 H ATOM 912 N ASP A 198 -35.581 18.058 21.453 1.00 17.86 N ATOM 913 CA ASP A 198 -36.773 18.166 22.320 1.00 18.92 C ATOM 914 C ASP A 198 -37.481 19.513 22.170 1.00 18.59 C ATOM 915 O ASP A 198 -36.849 20.526 21.854 1.00 17.88 O ATOM 916 CB ASP A 198 -36.427 17.895 23.781 1.00 20.10 C ATOM 917 CG ASP A 198 -35.918 16.472 24.016 1.00 22.94 C ATOM 918 OD1 ASP A 198 -35.775 15.682 23.040 1.00 20.58 O ATOM 919 OD2 ASP A 198 -35.655 16.142 25.192 1.00 25.49 O ATOM 920 H ASP A 198 -34.636 17.952 21.875 1.00 0.00 H ATOM 921 N ALA A 199 -38.799 19.494 22.353 1.00 17.24 N ATOM 922 CA ALA A 199 -39.625 20.695 22.224 1.00 15.80 C ATOM 923 C ALA A 199 -40.487 20.874 23.462 1.00 16.29 C ATOM 924 O ALA A 199 -41.221 19.962 23.858 1.00 15.68 O ATOM 925 CB ALA A 199 -40.484 20.616 20.982 1.00 17.52 C ATOM 926 H ALA A 199 -39.258 18.593 22.596 1.00 0.00 H ATOM 927 N HIS A 200 -40.382 22.061 24.057 1.00 14.34 N ATOM 928 CA HIS A 200 -41.098 22.409 25.283 1.00 15.53 C ATOM 929 C HIS A 200 -42.029 23.584 25.047 1.00 14.35 C ATOM 930 O HIS A 200 -41.616 24.605 24.479 1.00 14.35 O ATOM 931 CB HIS A 200 -40.117 22.792 26.392 1.00 17.32 C ATOM 932 CG HIS A 200 -39.179 21.689 26.779 1.00 17.77 C ATOM 933 ND1 HIS A 200 -38.052 21.903 27.538 1.00 18.68 N ATOM 934 CD2 HIS A 200 -39.205 20.362 26.512 1.00 17.07 C ATOM 935 CE1 HIS A 200 -37.419 20.758 27.723 1.00 20.32 C ATOM 936 NE2 HIS A 200 -38.097 19.805 27.110 1.00 22.39 N ATOM 937 H HIS A 200 -39.760 22.776 23.628 1.00 0.00 H ATOM 938 N PHE A 201 -43.262 23.447 25.530 1.00 14.45 N ATOM 939 CA PHE A 201 -44.289 24.463 25.380 1.00 13.41 C ATOM 940 C PHE A 201 -44.696 24.992 26.747 1.00 14.89 C ATOM 941 O PHE A 201 -44.903 24.220 27.676 1.00 15.73 O ATOM 942 CB PHE A 201 -45.489 23.850 24.628 1.00 13.75 C ATOM 943 CG PHE A 201 -45.148 23.414 23.228 1.00 15.06 C ATOM 944 CD1 PHE A 201 -45.387 24.270 22.147 1.00 13.96 C ATOM 945 CD2 PHE A 201 -44.576 22.158 22.989 1.00 14.82 C ATOM 946 CE1 PHE A 201 -45.055 23.880 20.844 1.00 15.17 C ATOM 947 CE2 PHE A 201 -44.241 21.767 21.690 1.00 18.08 C ATOM 948 CZ PHE A 201 -44.481 22.637 20.622 1.00 15.76 C ATOM 949 H PHE A 201 -43.501 22.572 26.038 1.00 0.00 H ATOM 950 N ASP A 202 -44.811 26.314 26.857 1.00 15.27 N ATOM 951 CA ASP A 202 -45.149 26.971 28.115 1.00 15.44 C ATOM 952 C ASP A 202 -46.633 26.804 28.402 1.00 16.41 C ATOM 953 O ASP A 202 -47.485 27.391 27.717 1.00 16.24 O ATOM 954 CB ASP A 202 -44.770 28.460 28.043 1.00 15.45 C ATOM 955 CG ASP A 202 -44.947 29.192 29.369 1.00 14.80 C ATOM 956 OD1 ASP A 202 -45.480 28.608 30.335 1.00 15.98 O ATOM 957 OD2 ASP A 202 -44.550 30.391 29.441 1.00 15.92 O ATOM 958 H ASP A 202 -44.654 26.901 26.013 1.00 0.00 H ATOM 959 N ASP A 203 -46.956 26.013 29.420 1.00 16.70 N ATOM 960 CA ASP A 203 -48.374 25.787 29.716 1.00 18.49 C ATOM 961 C ASP A 203 -49.046 26.911 30.520 1.00 18.38 C ATOM 962 O ASP A 203 -50.166 26.753 30.991 1.00 18.03 O ATOM 963 CB ASP A 203 -48.625 24.408 30.337 1.00 19.57 C ATOM 964 CG ASP A 203 -49.788 23.675 29.675 1.00 22.63 C ATOM 965 OD1 ASP A 203 -50.639 24.329 29.004 1.00 22.58 O ATOM 966 OD2 ASP A 203 -49.848 22.437 29.827 1.00 23.06 O ATOM 967 H ASP A 203 -46.216 25.563 29.996 1.00 0.00 H ATOM 968 N ASP A 204 -48.367 28.048 30.662 1.00 16.83 N ATOM 969 CA ASP A 204 -49.042 29.261 31.123 1.00 18.64 C ATOM 970 C ASP A 204 -49.629 30.077 29.948 1.00 19.56 C ATOM 971 O ASP A 204 -50.299 31.084 30.156 1.00 21.49 O ATOM 972 CB ASP A 204 -48.108 30.114 31.991 1.00 17.47 C ATOM 973 CG ASP A 204 -48.058 29.644 33.452 1.00 19.79 C ATOM 974 OD1 ASP A 204 -49.092 29.196 33.986 1.00 18.41 O ATOM 975 OD2 ASP A 204 -46.990 29.752 34.094 1.00 18.64 O ATOM 976 H ASP A 204 -47.350 28.074 30.444 1.00 0.00 H ATOM 977 N GLU A 205 -49.358 29.641 28.719 1.00 17.91 N ATOM 978 CA GLU A 205 -49.974 30.244 27.540 1.00 17.59 C ATOM 979 C GLU A 205 -51.280 29.528 27.248 1.00 18.39 C ATOM 980 O GLU A 205 -51.521 28.424 27.752 1.00 20.90 O ATOM 981 CB GLU A 205 -49.054 30.142 26.309 1.00 17.32 C ATOM 982 CG GLU A 205 -47.609 30.617 26.507 1.00 19.36 C ATOM 983 CD GLU A 205 -47.495 32.053 26.985 1.00 25.15 C ATOM 984 OE1 GLU A 205 -48.424 32.856 26.740 1.00 25.82 O ATOM 985 OE2 GLU A 205 -46.459 32.377 27.611 1.00 23.12 O ATOM 986 H GLU A 205 -48.692 28.852 28.596 1.00 0.00 H ATOM 987 N THR A 206 -52.113 30.156 26.422 1.00 18.15 N ATOM 988 CA THR A 206 -53.336 29.529 25.915 1.00 17.47 C ATOM 989 C THR A 206 -53.095 28.936 24.519 1.00 18.19 C ATOM 990 O THR A 206 -52.828 29.663 23.561 1.00 19.14 O ATOM 991 CB THR A 206 -54.499 30.540 25.925 1.00 19.62 C ATOM 992 OG1 THR A 206 -54.705 30.992 27.274 1.00 23.22 O ATOM 993 CG2 THR A 206 -55.801 29.910 25.399 1.00 19.06 C ATOM 994 HG1 THR A 206 -54.927 30.218 27.850 1.00 0.00 H ATOM 995 H THR A 206 -51.888 31.127 26.126 1.00 0.00 H ATOM 996 N TRP A 207 -53.163 27.603 24.438 1.00 15.25 N ATOM 997 CA TRP A 207 -52.944 26.848 23.196 1.00 12.94 C ATOM 998 C TRP A 207 -54.285 26.482 22.567 1.00 16.10 C ATOM 999 O TRP A 207 -55.203 26.031 23.264 1.00 16.08 O ATOM 1000 CB TRP A 207 -52.133 25.572 23.489 1.00 13.69 C ATOM 1001 CG TRP A 207 -50.826 25.912 24.116 1.00 14.63 C ATOM 1002 CD1 TRP A 207 -50.482 25.782 25.425 1.00 15.96 C ATOM 1003 CD2 TRP A 207 -49.703 26.489 23.454 1.00 14.89 C ATOM 1004 NE1 TRP A 207 -49.190 26.231 25.628 1.00 15.65 N ATOM 1005 CE2 TRP A 207 -48.693 26.681 24.430 1.00 14.04 C ATOM 1006 CE3 TRP A 207 -49.449 26.868 22.130 1.00 17.40 C ATOM 1007 CZ2 TRP A 207 -47.452 27.239 24.120 1.00 15.89 C ATOM 1008 CZ3 TRP A 207 -48.219 27.425 21.818 1.00 16.26 C ATOM 1009 CH2 TRP A 207 -47.228 27.601 22.810 1.00 13.04 C ATOM 1010 HE1 TRP A 207 -48.681 26.228 26.535 1.00 0.00 H ATOM 1011 H TRP A 207 -53.383 27.070 25.303 1.00 0.00 H ATOM 1012 N THR A 208 -54.401 26.686 21.257 1.00 14.40 N ATOM 1013 CA THR A 208 -55.673 26.444 20.575 1.00 16.65 C ATOM 1014 C THR A 208 -55.544 25.728 19.232 1.00 17.88 C ATOM 1015 O THR A 208 -54.455 25.621 18.663 1.00 16.13 O ATOM 1016 CB THR A 208 -56.409 27.767 20.283 1.00 18.12 C ATOM 1017 OG1 THR A 208 -55.716 28.470 19.244 1.00 18.81 O ATOM 1018 CG2 THR A 208 -56.529 28.641 21.531 1.00 18.36 C ATOM 1019 HG1 THR A 208 -56.185 29.321 19.053 1.00 0.00 H ATOM 1020 H THR A 208 -53.580 27.020 20.713 1.00 0.00 H ATOM 1021 N SER A 209 -56.691 25.298 18.707 1.00 19.19 N ATOM 1022 CA SER A 209 -56.791 24.823 17.331 1.00 21.90 C ATOM 1023 C SER A 209 -57.626 25.832 16.543 1.00 24.43 C ATOM 1024 O SER A 209 -58.491 25.456 15.739 1.00 26.57 O ATOM 1025 CB SER A 209 -57.430 23.437 17.292 1.00 22.62 C ATOM 1026 OG SER A 209 -58.664 23.455 17.984 1.00 27.14 O ATOM 1027 HG SER A 209 -59.272 24.107 17.555 1.00 0.00 H ATOM 1028 H SER A 209 -57.546 25.301 19.300 1.00 0.00 H ATOM 1029 N SER A 210 -57.365 27.114 16.803 1.00 22.34 N ATOM 1030 CA SER A 210 -58.114 28.230 16.209 1.00 24.03 C ATOM 1031 C SER A 210 -57.196 29.438 16.027 1.00 23.10 C ATOM 1032 O SER A 210 -55.973 29.338 16.196 1.00 23.77 O ATOM 1033 CB SER A 210 -59.306 28.610 17.101 1.00 24.00 C ATOM 1034 OG SER A 210 -58.903 29.413 18.207 1.00 22.95 O ATOM 1035 HG SER A 210 -59.695 29.637 18.757 1.00 0.00 H ATOM 1036 H SER A 210 -56.591 27.335 17.461 1.00 0.00 H ATOM 1037 N SER A 211 -57.798 30.584 15.710 1.00 25.10 N ATOM 1038 CA SER A 211 -57.074 31.851 15.605 1.00 25.27 C ATOM 1039 C SER A 211 -56.811 32.518 16.959 1.00 25.21 C ATOM 1040 O SER A 211 -56.060 33.492 17.030 1.00 26.32 O ATOM 1041 CB SER A 211 -57.852 32.817 14.710 1.00 27.78 C ATOM 1042 OG SER A 211 -59.051 33.229 15.341 1.00 26.98 O ATOM 1043 HG SER A 211 -59.615 32.437 15.524 1.00 0.00 H ATOM 1044 H SER A 211 -58.822 30.577 15.530 1.00 0.00 H ATOM 1045 N LYS A 212 -57.437 32.016 18.024 1.00 22.79 N ATOM 1046 CA LYS A 212 -57.283 32.594 19.363 1.00 23.41 C ATOM 1047 C LYS A 212 -56.023 32.095 20.069 1.00 23.21 C ATOM 1048 O LYS A 212 -55.473 31.052 19.697 1.00 22.74 O ATOM 1049 CB LYS A 212 -58.503 32.280 20.231 1.00 23.89 C ATOM 1050 CG LYS A 212 -59.851 32.651 19.607 1.00 27.29 C ATOM 1051 CD LYS A 212 -59.967 34.144 19.378 1.00 30.45 C ATOM 1052 CE LYS A 212 -61.306 34.492 18.755 1.00 29.15 C ATOM 1053 NZ LYS A 212 -61.329 35.912 18.302 1.00 32.25 N ATOM 1054 HZ1 LYS A 212 -61.166 36.537 19.117 1.00 0.00 H ATOM 1055 HZ2 LYS A 212 -60.582 36.061 17.594 1.00 0.00 H ATOM 1056 HZ3 LYS A 212 -62.255 36.125 17.880 1.00 0.00 H ATOM 1057 H LYS A 212 -58.054 31.188 17.901 1.00 0.00 H ATOM 1058 N GLY A 213 -55.575 32.838 21.086 1.00 22.83 N ATOM 1059 CA GLY A 213 -54.344 32.508 21.819 1.00 20.76 C ATOM 1060 C GLY A 213 -53.189 32.222 20.877 1.00 20.74 C ATOM 1061 O GLY A 213 -52.941 32.986 19.935 1.00 21.96 O ATOM 1062 H GLY A 213 -56.117 33.680 21.369 1.00 0.00 H ATOM 1063 N TYR A 214 -52.474 31.128 21.127 1.00 18.97 N ATOM 1064 CA TYR A 214 -51.457 30.672 20.185 1.00 18.72 C ATOM 1065 C TYR A 214 -51.940 29.394 19.547 1.00 17.56 C ATOM 1066 O TYR A 214 -52.264 28.444 20.249 1.00 17.64 O ATOM 1067 CB TYR A 214 -50.152 30.357 20.897 1.00 20.18 C ATOM 1068 CG TYR A 214 -49.337 31.549 21.295 1.00 22.35 C ATOM 1069 CD1 TYR A 214 -48.755 32.375 20.335 1.00 21.87 C ATOM 1070 CD2 TYR A 214 -49.095 31.815 22.638 1.00 27.44 C ATOM 1071 CE1 TYR A 214 -47.966 33.463 20.715 1.00 27.71 C ATOM 1072 CE2 TYR A 214 -48.314 32.889 23.028 1.00 32.00 C ATOM 1073 CZ TYR A 214 -47.754 33.709 22.067 1.00 30.90 C ATOM 1074 OH TYR A 214 -46.975 34.769 22.468 1.00 30.03 O ATOM 1075 HH TYR A 214 -46.203 34.432 22.988 1.00 0.00 H ATOM 1076 H TYR A 214 -52.642 30.592 22.003 1.00 0.00 H ATOM 1077 N ASN A 215 -51.968 29.370 18.219 1.00 16.61 N ATOM 1078 CA ASN A 215 -52.350 28.178 17.487 1.00 17.39 C ATOM 1079 C ASN A 215 -51.254 27.122 17.647 1.00 16.98 C ATOM 1080 O ASN A 215 -50.105 27.351 17.272 1.00 15.91 O ATOM 1081 CB ASN A 215 -52.572 28.516 16.013 1.00 18.56 C ATOM 1082 CG ASN A 215 -53.047 27.316 15.209 1.00 19.70 C ATOM 1083 OD1 ASN A 215 -52.239 26.580 14.651 1.00 19.73 O ATOM 1084 ND2 ASN A 215 -54.364 27.103 15.170 1.00 21.00 N ATOM 1085 HD22 ASN A 215 -55.011 27.755 15.659 1.00 0.00 H ATOM 1086 HD21 ASN A 215 -54.743 26.285 14.651 1.00 0.00 H ATOM 1087 H ASN A 215 -51.709 30.228 17.691 1.00 0.00 H ATOM 1088 N LEU A 216 -51.608 25.978 18.227 1.00 15.35 N ATOM 1089 CA LEU A 216 -50.594 24.975 18.559 1.00 14.84 C ATOM 1090 C LEU A 216 -49.894 24.424 17.318 1.00 15.33 C ATOM 1091 O LEU A 216 -48.678 24.262 17.334 1.00 17.38 O ATOM 1092 CB LEU A 216 -51.169 23.835 19.393 1.00 14.24 C ATOM 1093 CG LEU A 216 -50.166 22.775 19.854 1.00 14.92 C ATOM 1094 CD1 LEU A 216 -49.152 23.355 20.830 1.00 16.85 C ATOM 1095 CD2 LEU A 216 -50.893 21.587 20.469 1.00 15.19 C ATOM 1096 H LEU A 216 -52.608 25.796 18.445 1.00 0.00 H ATOM 1097 N PHE A 217 -50.651 24.130 16.257 1.00 15.61 N ATOM 1098 CA PHE A 217 -50.050 23.660 15.001 1.00 15.62 C ATOM 1099 C PHE A 217 -48.957 24.627 14.495 1.00 16.28 C ATOM 1100 O PHE A 217 -47.845 24.211 14.154 1.00 16.45 O ATOM 1101 CB PHE A 217 -51.108 23.482 13.900 1.00 15.72 C ATOM 1102 CG PHE A 217 -50.529 23.546 12.519 1.00 16.58 C ATOM 1103 CD1 PHE A 217 -49.759 22.498 12.034 1.00 18.37 C ATOM 1104 CD2 PHE A 217 -50.708 24.671 11.727 1.00 16.57 C ATOM 1105 CE1 PHE A 217 -49.187 22.555 10.767 1.00 18.22 C ATOM 1106 CE2 PHE A 217 -50.124 24.750 10.459 1.00 18.62 C ATOM 1107 CZ PHE A 217 -49.376 23.680 9.981 1.00 19.15 C ATOM 1108 H PHE A 217 -51.684 24.236 16.321 1.00 0.00 H ATOM 1109 N LEU A 218 -49.284 25.915 14.458 1.00 16.18 N ATOM 1110 CA LEU A 218 -48.361 26.903 13.927 1.00 15.56 C ATOM 1111 C LEU A 218 -47.089 27.021 14.775 1.00 15.80 C ATOM 1112 O LEU A 218 -45.965 27.040 14.234 1.00 17.04 O ATOM 1113 CB LEU A 218 -49.062 28.257 13.796 1.00 15.17 C ATOM 1114 CG LEU A 218 -48.294 29.417 13.178 1.00 21.26 C ATOM 1115 CD1 LEU A 218 -47.714 29.009 11.828 1.00 22.44 C ATOM 1116 CD2 LEU A 218 -49.246 30.611 13.040 1.00 19.09 C ATOM 1117 H LEU A 218 -50.213 26.219 14.814 1.00 0.00 H ATOM 1118 N VAL A 219 -47.261 27.092 16.092 1.00 14.62 N ATOM 1119 CA VAL A 219 -46.099 27.181 16.987 1.00 15.00 C ATOM 1120 C VAL A 219 -45.277 25.891 16.921 1.00 15.59 C ATOM 1121 O VAL A 219 -44.053 25.940 16.857 1.00 14.23 O ATOM 1122 CB VAL A 219 -46.506 27.532 18.444 1.00 13.44 C ATOM 1123 CG1 VAL A 219 -45.288 27.516 19.404 1.00 13.12 C ATOM 1124 CG2 VAL A 219 -47.207 28.892 18.475 1.00 16.13 C ATOM 1125 H VAL A 219 -48.222 27.084 16.490 1.00 0.00 H ATOM 1126 N ALA A 220 -45.953 24.743 16.924 1.00 13.83 N ATOM 1127 CA ALA A 220 -45.272 23.442 16.821 1.00 15.59 C ATOM 1128 C ALA A 220 -44.456 23.323 15.527 1.00 15.39 C ATOM 1129 O ALA A 220 -43.308 22.880 15.570 1.00 15.87 O ATOM 1130 CB ALA A 220 -46.280 22.310 16.928 1.00 16.08 C ATOM 1131 H ALA A 220 -46.990 24.767 17.001 1.00 0.00 H ATOM 1132 N ALA A 221 -45.039 23.723 14.395 1.00 15.35 N ATOM 1133 CA ALA A 221 -44.335 23.675 13.099 1.00 16.37 C ATOM 1134 C ALA A 221 -43.040 24.499 13.130 1.00 16.50 C ATOM 1135 O ALA A 221 -41.989 24.038 12.657 1.00 16.69 O ATOM 1136 CB ALA A 221 -45.249 24.134 11.973 1.00 16.96 C ATOM 1137 H ALA A 221 -46.016 24.078 14.427 1.00 0.00 H ATOM 1138 N HIS A 222 -43.121 25.714 13.682 1.00 14.98 N ATOM 1139 CA HIS A 222 -41.938 26.549 13.934 1.00 15.36 C ATOM 1140 C HIS A 222 -40.938 25.844 14.855 1.00 14.55 C ATOM 1141 O HIS A 222 -39.760 25.748 14.526 1.00 17.03 O ATOM 1142 CB HIS A 222 -42.377 27.890 14.532 1.00 15.25 C ATOM 1143 CG HIS A 222 -41.251 28.818 14.893 1.00 14.13 C ATOM 1144 ND1 HIS A 222 -40.950 29.942 14.150 1.00 18.37 N ATOM 1145 CD2 HIS A 222 -40.378 28.812 15.932 1.00 16.50 C ATOM 1146 CE1 HIS A 222 -39.943 30.586 14.712 1.00 16.69 C ATOM 1147 NE2 HIS A 222 -39.571 29.921 15.792 1.00 13.82 N ATOM 1148 H HIS A 222 -44.058 26.083 13.943 1.00 0.00 H ATOM 1149 N GLU A 223 -41.391 25.366 16.011 1.00 14.37 N ATOM 1150 CA GLU A 223 -40.476 24.747 16.977 1.00 15.05 C ATOM 1151 C GLU A 223 -39.785 23.505 16.399 1.00 13.79 C ATOM 1152 O GLU A 223 -38.591 23.271 16.647 1.00 15.77 O ATOM 1153 CB GLU A 223 -41.189 24.397 18.297 1.00 16.03 C ATOM 1154 CG GLU A 223 -41.633 25.617 19.108 1.00 18.05 C ATOM 1155 CD GLU A 223 -40.498 26.586 19.426 1.00 18.76 C ATOM 1156 OE1 GLU A 223 -39.396 26.140 19.806 1.00 22.91 O ATOM 1157 OE2 GLU A 223 -40.716 27.812 19.290 1.00 22.86 O ATOM 1158 H GLU A 223 -42.405 25.432 16.233 1.00 0.00 H ATOM 1159 N PHE A 224 -40.529 22.712 15.625 1.00 15.26 N ATOM 1160 CA PHE A 224 -39.933 21.525 15.006 1.00 15.21 C ATOM 1161 C PHE A 224 -38.876 21.912 13.964 1.00 16.59 C ATOM 1162 O PHE A 224 -37.902 21.187 13.755 1.00 17.06 O ATOM 1163 CB PHE A 224 -41.007 20.590 14.425 1.00 14.87 C ATOM 1164 CG PHE A 224 -41.977 20.047 15.463 1.00 15.61 C ATOM 1165 CD1 PHE A 224 -43.236 19.591 15.080 1.00 16.13 C ATOM 1166 CD2 PHE A 224 -41.631 19.991 16.812 1.00 17.53 C ATOM 1167 CE1 PHE A 224 -44.137 19.092 16.026 1.00 17.36 C ATOM 1168 CE2 PHE A 224 -42.523 19.493 17.763 1.00 16.53 C ATOM 1169 CZ PHE A 224 -43.777 19.039 17.367 1.00 16.92 C ATOM 1170 H PHE A 224 -41.531 22.936 15.461 1.00 0.00 H ATOM 1171 N GLY A 225 -39.040 23.082 13.350 1.00 15.89 N ATOM 1172 CA GLY A 225 -37.985 23.627 12.496 1.00 17.88 C ATOM 1173 C GLY A 225 -36.677 23.694 13.271 1.00 17.59 C ATOM 1174 O GLY A 225 -35.644 23.251 12.780 1.00 18.25 O ATOM 1175 H GLY A 225 -39.925 23.613 13.479 1.00 0.00 H ATOM 1176 N HIS A 226 -36.735 24.222 14.496 1.00 16.49 N ATOM 1177 CA HIS A 226 -35.569 24.249 15.397 1.00 16.76 C ATOM 1178 C HIS A 226 -35.090 22.830 15.735 1.00 16.68 C ATOM 1179 O HIS A 226 -33.889 22.544 15.685 1.00 18.38 O ATOM 1180 CB HIS A 226 -35.870 25.018 16.695 1.00 16.98 C ATOM 1181 CG HIS A 226 -36.141 26.484 16.504 1.00 14.25 C ATOM 1182 ND1 HIS A 226 -35.383 27.289 15.679 1.00 16.76 N ATOM 1183 CD2 HIS A 226 -37.071 27.291 17.066 1.00 17.84 C ATOM 1184 CE1 HIS A 226 -35.841 28.527 15.733 1.00 20.26 C ATOM 1185 NE2 HIS A 226 -36.865 28.556 16.568 1.00 14.09 N ATOM 1186 H HIS A 226 -37.634 24.628 14.826 1.00 0.00 H ATOM 1187 N SER A 227 -36.030 21.945 16.084 1.00 15.51 N ATOM 1188 CA SER A 227 -35.713 20.540 16.391 1.00 16.40 C ATOM 1189 C SER A 227 -34.959 19.842 15.258 1.00 18.81 C ATOM 1190 O SER A 227 -34.226 18.872 15.500 1.00 21.20 O ATOM 1191 CB SER A 227 -36.988 19.751 16.679 1.00 16.37 C ATOM 1192 OG SER A 227 -37.655 20.232 17.830 1.00 18.02 O ATOM 1193 HG SER A 227 -37.056 20.153 18.614 1.00 0.00 H ATOM 1194 H SER A 227 -37.020 22.260 16.141 1.00 0.00 H ATOM 1195 N LEU A 228 -35.147 20.339 14.037 1.00 19.06 N ATOM 1196 CA LEU A 228 -34.524 19.764 12.839 1.00 19.87 C ATOM 1197 C LEU A 228 -33.272 20.492 12.368 1.00 21.25 C ATOM 1198 O LEU A 228 -32.602 20.033 11.437 1.00 20.28 O ATOM 1199 CB LEU A 228 -35.538 19.673 11.699 1.00 19.48 C ATOM 1200 CG LEU A 228 -36.733 18.770 11.973 1.00 18.32 C ATOM 1201 CD1 LEU A 228 -37.797 18.988 10.921 1.00 19.57 C ATOM 1202 CD2 LEU A 228 -36.296 17.284 12.040 1.00 17.95 C ATOM 1203 H LEU A 228 -35.762 21.171 13.928 1.00 0.00 H ATOM 1204 N GLY A 229 -32.964 21.629 12.992 1.00 20.34 N ATOM 1205 CA GLY A 229 -31.739 22.358 12.679 1.00 20.95 C ATOM 1206 C GLY A 229 -31.873 23.704 11.988 1.00 21.76 C ATOM 1207 O GLY A 229 -30.872 24.231 11.492 1.00 20.79 O ATOM 1208 H GLY A 229 -33.609 22.004 13.716 1.00 0.00 H ATOM 1209 N LEU A 230 -33.081 24.269 11.934 1.00 19.71 N ATOM 1210 CA LEU A 230 -33.248 25.624 11.396 1.00 19.51 C ATOM 1211 C LEU A 230 -33.246 26.631 12.530 1.00 20.20 C ATOM 1212 O LEU A 230 -33.894 26.413 13.557 1.00 21.57 O ATOM 1213 CB LEU A 230 -34.547 25.763 10.583 1.00 20.80 C ATOM 1214 CG LEU A 230 -34.647 25.056 9.230 1.00 23.49 C ATOM 1215 CD1 LEU A 230 -35.990 25.350 8.567 1.00 22.37 C ATOM 1216 CD2 LEU A 230 -33.502 25.481 8.317 1.00 27.28 C ATOM 1217 H LEU A 230 -33.911 23.744 12.276 1.00 0.00 H ATOM 1218 N ASP A 231 -32.488 27.709 12.354 1.00 19.58 N ATOM 1219 CA ASP A 231 -32.550 28.845 13.252 1.00 19.01 C ATOM 1220 C ASP A 231 -33.555 29.836 12.666 1.00 19.56 C ATOM 1221 O ASP A 231 -34.348 29.462 11.799 1.00 19.73 O ATOM 1222 CB ASP A 231 -31.168 29.471 13.416 1.00 21.25 C ATOM 1223 CG ASP A 231 -31.007 30.197 14.739 1.00 28.59 C ATOM 1224 OD1 ASP A 231 -32.022 30.474 15.415 1.00 31.39 O ATOM 1225 OD2 ASP A 231 -29.853 30.488 15.109 1.00 28.14 O ATOM 1226 H ASP A 231 -31.831 27.738 11.548 1.00 0.00 H ATOM 1227 N HIS A 232 -33.542 31.083 13.141 1.00 20.64 N ATOM 1228 CA HIS A 232 -34.516 32.066 12.673 1.00 20.60 C ATOM 1229 C HIS A 232 -34.149 32.655 11.318 1.00 22.02 C ATOM 1230 O HIS A 232 -32.974 32.751 10.966 1.00 24.84 O ATOM 1231 CB HIS A 232 -34.739 33.169 13.714 1.00 20.58 C ATOM 1232 CG HIS A 232 -35.478 32.697 14.925 1.00 20.35 C ATOM 1233 ND1 HIS A 232 -35.090 33.013 16.208 1.00 23.44 N ATOM 1234 CD2 HIS A 232 -36.562 31.895 15.048 1.00 20.25 C ATOM 1235 CE1 HIS A 232 -35.909 32.437 17.069 1.00 25.99 C ATOM 1236 NE2 HIS A 232 -36.810 31.751 16.389 1.00 19.70 N ATOM 1237 H HIS A 232 -32.833 31.357 13.850 1.00 0.00 H ATOM 1238 N SER A 233 -35.182 33.045 10.574 1.00 22.20 N ATOM 1239 CA SER A 233 -35.054 33.680 9.271 1.00 22.09 C ATOM 1240 C SER A 233 -35.329 35.179 9.368 1.00 20.87 C ATOM 1241 O SER A 233 -36.047 35.621 10.255 1.00 21.57 O ATOM 1242 CB SER A 233 -36.089 33.089 8.326 1.00 22.78 C ATOM 1243 OG SER A 233 -36.049 33.751 7.079 1.00 23.18 O ATOM 1244 HG SER A 233 -36.727 33.356 6.475 1.00 0.00 H ATOM 1245 H SER A 233 -36.140 32.886 10.947 1.00 0.00 H ATOM 1246 N LYS A 234 -34.783 35.948 8.433 1.00 20.68 N ATOM 1247 CA LYS A 234 -35.101 37.375 8.351 1.00 21.20 C ATOM 1248 C LYS A 234 -36.291 37.676 7.435 1.00 22.61 C ATOM 1249 O LYS A 234 -36.737 38.827 7.350 1.00 23.45 O ATOM 1250 CB LYS A 234 -33.878 38.184 7.913 1.00 22.34 C ATOM 1251 CG LYS A 234 -33.517 38.053 6.451 1.00 23.05 C ATOM 1252 CD LYS A 234 -32.682 39.256 6.064 1.00 26.29 C ATOM 1253 CE LYS A 234 -32.208 39.188 4.634 1.00 27.65 C ATOM 1254 NZ LYS A 234 -31.384 40.403 4.326 1.00 25.37 N ATOM 1255 HZ1 LYS A 234 -31.963 41.256 4.461 1.00 0.00 H ATOM 1256 HZ2 LYS A 234 -30.563 40.435 4.964 1.00 0.00 H ATOM 1257 HZ3 LYS A 234 -31.056 40.357 3.340 1.00 0.00 H ATOM 1258 H LYS A 234 -34.120 35.531 7.749 1.00 0.00 H ATOM 1259 N ASP A 235 -36.788 36.650 6.743 1.00 21.41 N ATOM 1260 CA ASP A 235 -37.928 36.817 5.851 1.00 23.00 C ATOM 1261 C ASP A 235 -39.220 36.951 6.684 1.00 24.76 C ATOM 1262 O ASP A 235 -39.629 35.999 7.345 1.00 22.12 O ATOM 1263 CB ASP A 235 -37.982 35.626 4.886 1.00 25.49 C ATOM 1264 CG ASP A 235 -39.108 35.716 3.865 1.00 29.79 C ATOM 1265 OD1 ASP A 235 -39.970 36.614 3.935 1.00 28.81 O ATOM 1266 OD2 ASP A 235 -39.124 34.846 2.970 1.00 39.53 O ATOM 1267 H ASP A 235 -36.353 35.711 6.842 1.00 0.00 H ATOM 1268 N PRO A 236 -39.875 38.134 6.657 1.00 23.77 N ATOM 1269 CA PRO A 236 -41.079 38.340 7.486 1.00 23.29 C ATOM 1270 C PRO A 236 -42.240 37.392 7.158 1.00 23.48 C ATOM 1271 O PRO A 236 -43.164 37.236 7.969 1.00 23.42 O ATOM 1272 CB PRO A 236 -41.487 39.781 7.172 1.00 25.23 C ATOM 1273 CG PRO A 236 -40.263 40.410 6.605 1.00 26.72 C ATOM 1274 CD PRO A 236 -39.527 39.350 5.893 1.00 26.24 C ATOM 1275 N GLY A 237 -42.191 36.775 5.981 1.00 22.49 N ATOM 1276 CA GLY A 237 -43.208 35.807 5.580 1.00 24.12 C ATOM 1277 C GLY A 237 -42.867 34.358 5.908 1.00 22.73 C ATOM 1278 O GLY A 237 -43.665 33.471 5.639 1.00 23.95 O ATOM 1279 H GLY A 237 -41.409 36.987 5.330 1.00 0.00 H ATOM 1280 N ALA A 238 -41.694 34.114 6.485 1.00 20.33 N ATOM 1281 CA ALA A 238 -41.245 32.744 6.745 1.00 19.29 C ATOM 1282 C ALA A 238 -41.879 32.126 7.991 1.00 18.77 C ATOM 1283 O ALA A 238 -42.216 32.831 8.948 1.00 19.78 O ATOM 1284 CB ALA A 238 -39.727 32.695 6.857 1.00 20.51 C ATOM 1285 H ALA A 238 -41.084 34.911 6.757 1.00 0.00 H ATOM 1286 N LEU A 239 -42.018 30.797 7.979 1.00 18.31 N ATOM 1287 CA LEU A 239 -42.438 30.063 9.177 1.00 17.92 C ATOM 1288 C LEU A 239 -41.438 30.317 10.311 1.00 17.10 C ATOM 1289 O LEU A 239 -41.827 30.470 11.477 1.00 18.35 O ATOM 1290 CB LEU A 239 -42.547 28.556 8.892 1.00 17.61 C ATOM 1291 CG LEU A 239 -42.948 27.705 10.103 1.00 17.17 C ATOM 1292 CD1 LEU A 239 -44.290 28.167 10.684 1.00 16.91 C ATOM 1293 CD2 LEU A 239 -43.004 26.228 9.751 1.00 17.66 C ATOM 1294 H LEU A 239 -41.824 30.273 7.102 1.00 0.00 H ATOM 1295 N MET A 240 -40.158 30.394 9.945 1.00 17.10 N ATOM 1296 CA MET A 240 -39.070 30.535 10.917 1.00 15.33 C ATOM 1297 C MET A 240 -38.730 31.992 11.280 1.00 15.49 C ATOM 1298 O MET A 240 -37.743 32.241 11.971 1.00 17.14 O ATOM 1299 CB MET A 240 -37.828 29.765 10.443 1.00 15.01 C ATOM 1300 CG MET A 240 -38.050 28.237 10.285 1.00 15.03 C ATOM 1301 SD MET A 240 -38.806 27.437 11.730 1.00 17.96 S ATOM 1302 CE MET A 240 -37.551 27.728 12.991 1.00 15.16 C ATOM 1303 H MET A 240 -39.923 30.352 8.933 1.00 0.00 H ATOM 1304 N PHE A 241 -39.552 32.948 10.843 1.00 16.74 N ATOM 1305 CA PHE A 241 -39.411 34.324 11.298 1.00 18.38 C ATOM 1306 C PHE A 241 -39.580 34.299 12.823 1.00 19.00 C ATOM 1307 O PHE A 241 -40.316 33.460 13.334 1.00 17.40 O ATOM 1308 CB PHE A 241 -40.467 35.204 10.625 1.00 18.02 C ATOM 1309 CG PHE A 241 -40.250 36.686 10.824 1.00 19.85 C ATOM 1310 CD1 PHE A 241 -39.151 37.323 10.248 1.00 21.09 C ATOM 1311 CD2 PHE A 241 -41.142 37.433 11.587 1.00 20.02 C ATOM 1312 CE1 PHE A 241 -38.937 38.694 10.434 1.00 20.55 C ATOM 1313 CE2 PHE A 241 -40.949 38.806 11.778 1.00 23.73 C ATOM 1314 CZ PHE A 241 -39.840 39.435 11.198 1.00 22.30 C ATOM 1315 H PHE A 241 -40.305 32.707 10.167 1.00 0.00 H ATOM 1316 N PRO A 242 -38.845 35.159 13.560 1.00 20.65 N ATOM 1317 CA PRO A 242 -38.895 35.085 15.025 1.00 21.66 C ATOM 1318 C PRO A 242 -40.115 35.636 15.760 1.00 21.93 C ATOM 1319 O PRO A 242 -40.135 35.576 16.985 1.00 25.21 O ATOM 1320 CB PRO A 242 -37.621 35.823 15.467 1.00 23.69 C ATOM 1321 CG PRO A 242 -37.290 36.724 14.361 1.00 23.37 C ATOM 1322 CD PRO A 242 -37.857 36.149 13.091 1.00 22.12 C ATOM 1323 N ILE A 243 -41.120 36.140 15.046 1.00 19.72 N ATOM 1324 CA ILE A 243 -42.292 36.717 15.705 1.00 20.53 C ATOM 1325 C ILE A 243 -43.588 36.106 15.194 1.00 20.02 C ATOM 1326 O ILE A 243 -43.854 36.105 13.991 1.00 20.73 O ATOM 1327 CB ILE A 243 -42.346 38.243 15.523 1.00 21.33 C ATOM 1328 CG1 ILE A 243 -41.083 38.878 16.115 1.00 23.56 C ATOM 1329 CG2 ILE A 243 -43.590 38.822 16.197 1.00 23.99 C ATOM 1330 CD1 ILE A 243 -40.747 40.236 15.551 1.00 29.13 C ATOM 1331 H ILE A 243 -41.071 36.123 14.007 1.00 0.00 H ATOM 1332 N TYR A 244 -44.388 35.598 16.132 1.00 18.65 N ATOM 1333 CA TYR A 244 -45.668 34.957 15.828 1.00 18.83 C ATOM 1334 C TYR A 244 -46.708 35.946 15.301 1.00 19.30 C ATOM 1335 O TYR A 244 -46.968 36.976 15.932 1.00 20.30 O ATOM 1336 CB TYR A 244 -46.215 34.269 17.087 1.00 19.42 C ATOM 1337 CG TYR A 244 -47.565 33.587 16.919 1.00 17.66 C ATOM 1338 CD1 TYR A 244 -47.650 32.240 16.573 1.00 17.38 C ATOM 1339 CD2 TYR A 244 -48.761 34.291 17.133 1.00 18.36 C ATOM 1340 CE1 TYR A 244 -48.884 31.607 16.431 1.00 17.27 C ATOM 1341 CE2 TYR A 244 -49.999 33.668 16.978 1.00 20.16 C ATOM 1342 CZ TYR A 244 -50.048 32.325 16.639 1.00 17.26 C ATOM 1343 OH TYR A 244 -51.271 31.715 16.496 1.00 20.35 O ATOM 1344 HH TYR A 244 -51.769 31.773 17.349 1.00 0.00 H ATOM 1345 H TYR A 244 -44.088 35.660 17.126 1.00 0.00 H ATOM 1346 N THR A 245 -47.310 35.607 14.162 1.00 21.25 N ATOM 1347 CA THR A 245 -48.509 36.283 13.655 1.00 25.85 C ATOM 1348 C THR A 245 -49.424 35.237 13.011 1.00 26.98 C ATOM 1349 O THR A 245 -48.976 34.444 12.186 1.00 29.88 O ATOM 1350 CB THR A 245 -48.174 37.379 12.610 1.00 27.04 C ATOM 1351 OG1 THR A 245 -47.401 38.419 13.225 1.00 31.82 O ATOM 1352 CG2 THR A 245 -49.454 37.996 12.032 1.00 30.41 C ATOM 1353 HG1 THR A 245 -47.191 39.114 12.552 1.00 0.00 H ATOM 1354 H THR A 245 -46.910 34.825 13.605 1.00 0.00 H ATOM 1355 N TYR A 246 -50.696 35.220 13.394 1.00 26.79 N ATOM 1356 CA TYR A 246 -51.644 34.288 12.793 1.00 26.98 C ATOM 1357 C TYR A 246 -52.295 34.934 11.563 1.00 30.25 C ATOM 1358 O TYR A 246 -53.048 35.897 11.697 1.00 28.81 O ATOM 1359 CB TYR A 246 -52.693 33.859 13.819 1.00 26.99 C ATOM 1360 CG TYR A 246 -53.653 32.810 13.316 1.00 26.62 C ATOM 1361 CD1 TYR A 246 -54.801 33.169 12.608 1.00 26.08 C ATOM 1362 CD2 TYR A 246 -53.417 31.455 13.550 1.00 24.90 C ATOM 1363 CE1 TYR A 246 -55.688 32.204 12.142 1.00 27.97 C ATOM 1364 CE2 TYR A 246 -54.295 30.483 13.090 1.00 26.64 C ATOM 1365 CZ TYR A 246 -55.432 30.865 12.393 1.00 27.84 C ATOM 1366 OH TYR A 246 -56.307 29.911 11.934 1.00 32.04 O ATOM 1367 HH TYR A 246 -56.658 29.391 12.700 1.00 0.00 H ATOM 1368 H TYR A 246 -51.020 35.879 14.131 1.00 0.00 H ATOM 1369 N THR A 247 -52.003 34.410 10.372 1.00 32.46 N ATOM 1370 CA THR A 247 -52.460 35.062 9.132 1.00 38.50 C ATOM 1371 C THR A 247 -53.798 34.554 8.593 1.00 40.82 C ATOM 1372 O THR A 247 -54.500 35.285 7.885 1.00 43.00 O ATOM 1373 CB THR A 247 -51.393 35.032 8.007 1.00 38.64 C ATOM 1374 OG1 THR A 247 -51.016 33.680 7.729 1.00 42.35 O ATOM 1375 CG2 THR A 247 -50.158 35.835 8.409 1.00 40.72 C ATOM 1376 HG1 THR A 247 -50.640 33.269 8.547 1.00 0.00 H ATOM 1377 H THR A 247 -51.447 33.533 10.318 1.00 0.00 H ATOM 1378 N GLY A 248 -54.143 33.311 8.920 1.00 42.21 N ATOM 1379 CA GLY A 248 -55.431 32.732 8.533 1.00 43.61 C ATOM 1380 C GLY A 248 -55.337 31.847 7.305 1.00 45.61 C ATOM 1381 O GLY A 248 -55.451 32.326 6.177 1.00 47.34 O ATOM 1382 H GLY A 248 -53.476 32.732 9.469 1.00 0.00 H TER 1383 GLY A 248 ATOM 1384 N HIS A 251 -55.499 26.762 3.642 1.00 44.07 N ATOM 1385 CA HIS A 251 -54.558 25.696 3.321 1.00 43.35 C ATOM 1386 C HIS A 251 -53.119 26.148 3.575 1.00 41.95 C ATOM 1387 O HIS A 251 -52.632 27.101 2.947 1.00 41.37 O ATOM 1388 CB HIS A 251 -54.730 25.239 1.868 1.00 45.22 C ATOM 1389 CG HIS A 251 -53.857 24.081 1.492 1.00 49.13 C ATOM 1390 ND1 HIS A 251 -52.748 24.217 0.684 1.00 52.74 N ATOM 1391 CD2 HIS A 251 -53.923 22.770 1.824 1.00 52.10 C ATOM 1392 CE1 HIS A 251 -52.173 23.038 0.528 1.00 53.99 C ATOM 1393 NE2 HIS A 251 -52.865 22.143 1.211 1.00 54.86 N ATOM 1394 HN3 HIS A 251 -55.297 27.591 3.048 1.00 0.00 H ATOM 1395 HN2 HIS A 251 -55.400 27.020 4.645 1.00 0.00 H ATOM 1396 HN1 HIS A 251 -56.469 26.432 3.462 1.00 0.00 H ATOM 1397 N PHE A 252 -52.444 25.464 4.499 1.00 39.02 N ATOM 1398 CA PHE A 252 -51.078 25.831 4.871 1.00 36.61 C ATOM 1399 C PHE A 252 -50.107 25.471 3.765 1.00 35.69 C ATOM 1400 O PHE A 252 -50.118 24.350 3.253 1.00 35.80 O ATOM 1401 CB PHE A 252 -50.647 25.156 6.178 1.00 35.57 C ATOM 1402 CG PHE A 252 -49.269 25.559 6.645 1.00 33.73 C ATOM 1403 CD1 PHE A 252 -48.150 24.814 6.286 1.00 32.25 C ATOM 1404 CD2 PHE A 252 -49.095 26.688 7.440 1.00 32.87 C ATOM 1405 CE1 PHE A 252 -46.876 25.189 6.711 1.00 29.59 C ATOM 1406 CE2 PHE A 252 -47.826 27.069 7.875 1.00 35.44 C ATOM 1407 CZ PHE A 252 -46.714 26.315 7.508 1.00 31.53 C ATOM 1408 H PHE A 252 -52.898 24.653 4.965 1.00 0.00 H ATOM 1409 N MET A 253 -49.264 26.434 3.405 1.00 34.28 N ATOM 1410 CA MET A 253 -48.168 26.191 2.476 1.00 34.27 C ATOM 1411 C MET A 253 -46.884 26.674 3.135 1.00 28.21 C ATOM 1412 O MET A 253 -46.800 27.830 3.563 1.00 27.44 O ATOM 1413 CB MET A 253 -48.397 26.930 1.155 1.00 34.08 C ATOM 1414 CG MET A 253 -49.628 26.474 0.371 1.00 40.65 C ATOM 1415 SD MET A 253 -49.897 27.425 -1.150 1.00 47.81 S ATOM 1416 CE MET A 253 -50.505 28.987 -0.502 1.00 47.95 C ATOM 1417 H MET A 253 -49.390 27.389 3.798 1.00 0.00 H ATOM 1418 N LEU A 254 -45.901 25.785 3.238 1.00 24.74 N ATOM 1419 CA LEU A 254 -44.594 26.164 3.786 1.00 21.62 C ATOM 1420 C LEU A 254 -43.953 27.184 2.846 1.00 20.59 C ATOM 1421 O LEU A 254 -43.822 26.914 1.650 1.00 21.11 O ATOM 1422 CB LEU A 254 -43.689 24.935 3.955 1.00 21.60 C ATOM 1423 CG LEU A 254 -42.358 25.096 4.700 1.00 21.41 C ATOM 1424 CD1 LEU A 254 -42.583 25.549 6.140 1.00 18.70 C ATOM 1425 CD2 LEU A 254 -41.550 23.792 4.673 1.00 21.28 C ATOM 1426 H LEU A 254 -46.061 24.806 2.925 1.00 0.00 H ATOM 1427 N PRO A 255 -43.593 28.369 3.374 1.00 18.91 N ATOM 1428 CA PRO A 255 -42.933 29.406 2.568 1.00 20.24 C ATOM 1429 C PRO A 255 -41.615 28.938 1.946 1.00 20.68 C ATOM 1430 O PRO A 255 -40.918 28.072 2.492 1.00 19.40 O ATOM 1431 CB PRO A 255 -42.695 30.543 3.576 1.00 21.33 C ATOM 1432 CG PRO A 255 -43.732 30.327 4.623 1.00 21.54 C ATOM 1433 CD PRO A 255 -43.842 28.833 4.752 1.00 19.73 C ATOM 1434 N ASP A 256 -41.276 29.525 0.807 1.00 21.84 N ATOM 1435 CA ASP A 256 -40.094 29.095 0.083 1.00 22.23 C ATOM 1436 C ASP A 256 -38.806 29.204 0.903 1.00 21.24 C ATOM 1437 O ASP A 256 -37.950 28.325 0.814 1.00 21.29 O ATOM 1438 CB ASP A 256 -39.943 29.850 -1.229 1.00 24.72 C ATOM 1439 CG ASP A 256 -38.877 29.236 -2.118 1.00 31.46 C ATOM 1440 OD1 ASP A 256 -39.122 28.151 -2.694 1.00 39.65 O ATOM 1441 OD2 ASP A 256 -37.781 29.829 -2.221 1.00 37.80 O ATOM 1442 H ASP A 256 -41.860 30.298 0.430 1.00 0.00 H ATOM 1443 N ASP A 257 -38.673 30.259 1.709 1.00 21.02 N ATOM 1444 CA ASP A 257 -37.471 30.401 2.538 1.00 19.57 C ATOM 1445 C ASP A 257 -37.246 29.185 3.451 1.00 20.43 C ATOM 1446 O ASP A 257 -36.123 28.682 3.576 1.00 19.88 O ATOM 1447 CB ASP A 257 -37.505 31.680 3.369 1.00 17.81 C ATOM 1448 CG ASP A 257 -36.242 31.860 4.196 1.00 20.01 C ATOM 1449 OD1 ASP A 257 -35.173 32.131 3.605 1.00 24.40 O ATOM 1450 OD2 ASP A 257 -36.317 31.701 5.431 1.00 21.70 O ATOM 1451 H ASP A 257 -39.421 30.980 1.750 1.00 0.00 H ATOM 1452 N ASP A 258 -38.318 28.700 4.075 1.00 18.77 N ATOM 1453 CA ASP A 258 -38.231 27.513 4.928 1.00 19.06 C ATOM 1454 C ASP A 258 -37.941 26.225 4.143 1.00 18.51 C ATOM 1455 O ASP A 258 -37.171 25.382 4.609 1.00 19.15 O ATOM 1456 CB ASP A 258 -39.498 27.378 5.775 1.00 19.04 C ATOM 1457 CG ASP A 258 -39.877 28.682 6.441 1.00 20.93 C ATOM 1458 OD1 ASP A 258 -39.184 29.089 7.401 1.00 21.92 O ATOM 1459 OD2 ASP A 258 -40.861 29.310 5.985 1.00 22.93 O ATOM 1460 H ASP A 258 -39.236 29.174 3.954 1.00 0.00 H ATOM 1461 N VAL A 259 -38.567 26.072 2.975 1.00 18.60 N ATOM 1462 CA VAL A 259 -38.271 24.951 2.063 1.00 20.52 C ATOM 1463 C VAL A 259 -36.779 24.942 1.714 1.00 20.07 C ATOM 1464 O VAL A 259 -36.099 23.923 1.856 1.00 19.81 O ATOM 1465 CB VAL A 259 -39.135 25.004 0.769 1.00 21.45 C ATOM 1466 CG1 VAL A 259 -38.685 23.945 -0.243 1.00 20.58 C ATOM 1467 CG2 VAL A 259 -40.601 24.805 1.099 1.00 20.74 C ATOM 1468 H VAL A 259 -39.289 26.767 2.698 1.00 0.00 H ATOM 1469 N GLN A 260 -36.252 26.091 1.304 1.00 20.08 N ATOM 1470 CA GLN A 260 -34.839 26.147 0.932 1.00 21.10 C ATOM 1471 C GLN A 260 -33.950 25.800 2.124 1.00 20.95 C ATOM 1472 O GLN A 260 -32.969 25.071 1.980 1.00 21.16 O ATOM 1473 CB GLN A 260 -34.491 27.524 0.350 1.00 21.81 C ATOM 1474 CG GLN A 260 -35.234 27.838 -0.953 1.00 22.12 C ATOM 1475 CD GLN A 260 -34.957 26.838 -2.069 1.00 28.25 C ATOM 1476 OE1 GLN A 260 -33.830 26.369 -2.239 1.00 30.45 O ATOM 1477 NE2 GLN A 260 -35.991 26.509 -2.834 1.00 26.74 N ATOM 1478 HE22 GLN A 260 -36.925 26.929 -2.655 1.00 0.00 H ATOM 1479 HE21 GLN A 260 -35.867 25.831 -3.613 1.00 0.00 H ATOM 1480 H GLN A 260 -36.842 26.946 1.248 1.00 0.00 H ATOM 1481 N GLY A 261 -34.325 26.293 3.306 1.00 19.27 N ATOM 1482 CA GLY A 261 -33.553 26.046 4.521 1.00 19.47 C ATOM 1483 C GLY A 261 -33.508 24.582 4.910 1.00 19.75 C ATOM 1484 O GLY A 261 -32.438 24.027 5.165 1.00 21.34 O ATOM 1485 H GLY A 261 -35.190 26.868 3.364 1.00 0.00 H ATOM 1486 N ILE A 262 -34.670 23.947 4.959 1.00 18.71 N ATOM 1487 CA ILE A 262 -34.713 22.552 5.384 1.00 19.91 C ATOM 1488 C ILE A 262 -34.079 21.614 4.352 1.00 20.71 C ATOM 1489 O ILE A 262 -33.463 20.612 4.724 1.00 21.44 O ATOM 1490 CB ILE A 262 -36.143 22.094 5.800 1.00 20.63 C ATOM 1491 CG1 ILE A 262 -36.079 20.821 6.663 1.00 20.68 C ATOM 1492 CG2 ILE A 262 -37.083 21.959 4.590 1.00 20.06 C ATOM 1493 CD1 ILE A 262 -35.514 21.067 8.057 1.00 22.41 C ATOM 1494 H ILE A 262 -35.547 24.440 4.696 1.00 0.00 H ATOM 1495 N GLN A 263 -34.218 21.953 3.072 1.00 19.60 N ATOM 1496 CA GLN A 263 -33.644 21.133 2.005 1.00 21.74 C ATOM 1497 C GLN A 263 -32.130 21.274 1.926 1.00 22.15 C ATOM 1498 O GLN A 263 -31.449 20.367 1.427 1.00 22.20 O ATOM 1499 CB GLN A 263 -34.317 21.423 0.663 1.00 22.31 C ATOM 1500 CG GLN A 263 -35.751 20.888 0.609 1.00 21.31 C ATOM 1501 CD GLN A 263 -36.442 21.127 -0.714 1.00 21.09 C ATOM 1502 OE1 GLN A 263 -35.941 21.856 -1.573 1.00 22.17 O ATOM 1503 NE2 GLN A 263 -37.604 20.513 -0.886 1.00 18.99 N ATOM 1504 HE22 GLN A 263 -37.988 19.907 -0.133 1.00 0.00 H ATOM 1505 HE21 GLN A 263 -38.131 20.637 -1.774 1.00 0.00 H ATOM 1506 H GLN A 263 -34.744 22.816 2.826 1.00 0.00 H ATOM 1507 N SER A 264 -31.602 22.391 2.433 1.00 21.33 N ATOM 1508 CA SER A 264 -30.149 22.568 2.530 1.00 22.60 C ATOM 1509 C SER A 264 -29.539 21.564 3.512 1.00 23.72 C ATOM 1510 O SER A 264 -28.374 21.181 3.374 1.00 26.22 O ATOM 1511 CB SER A 264 -29.768 24.006 2.913 1.00 21.60 C ATOM 1512 OG SER A 264 -29.950 24.251 4.300 1.00 22.35 O ATOM 1513 HG SER A 264 -30.900 24.108 4.537 1.00 0.00 H ATOM 1514 H SER A 264 -32.232 23.149 2.765 1.00 0.00 H ATOM 1515 N LEU A 265 -30.335 21.149 4.499 1.00 21.42 N ATOM 1516 CA LEU A 265 -29.903 20.184 5.500 1.00 22.59 C ATOM 1517 C LEU A 265 -30.148 18.725 5.101 1.00 22.66 C ATOM 1518 O LEU A 265 -29.271 17.875 5.299 1.00 24.08 O ATOM 1519 CB LEU A 265 -30.577 20.470 6.845 1.00 22.62 C ATOM 1520 CG LEU A 265 -30.263 21.781 7.570 1.00 21.93 C ATOM 1521 CD1 LEU A 265 -31.112 21.880 8.820 1.00 26.72 C ATOM 1522 CD2 LEU A 265 -28.792 21.855 7.939 1.00 23.68 C ATOM 1523 H LEU A 265 -31.301 21.529 4.556 1.00 0.00 H ATOM 1524 N TYR A 266 -31.329 18.441 4.543 1.00 22.87 N ATOM 1525 CA TYR A 266 -31.786 17.061 4.348 1.00 23.00 C ATOM 1526 C TYR A 266 -32.047 16.626 2.907 1.00 22.37 C ATOM 1527 O TYR A 266 -32.331 15.445 2.648 1.00 23.40 O ATOM 1528 CB TYR A 266 -33.026 16.789 5.218 1.00 21.93 C ATOM 1529 CG TYR A 266 -32.764 16.998 6.688 1.00 23.45 C ATOM 1530 CD1 TYR A 266 -32.003 16.081 7.412 1.00 21.05 C ATOM 1531 CD2 TYR A 266 -33.238 18.131 7.350 1.00 20.68 C ATOM 1532 CE1 TYR A 266 -31.738 16.274 8.760 1.00 22.50 C ATOM 1533 CE2 TYR A 266 -32.975 18.336 8.694 1.00 21.30 C ATOM 1534 CZ TYR A 266 -32.220 17.409 9.394 1.00 22.03 C ATOM 1535 OH TYR A 266 -31.961 17.606 10.725 1.00 23.55 O ATOM 1536 HH TYR A 266 -31.468 18.456 10.842 1.00 0.00 H ATOM 1537 H TYR A 266 -31.943 19.223 4.238 1.00 0.00 H ATOM 1538 N GLY A 267 -31.936 17.559 1.967 1.00 22.92 N ATOM 1539 CA GLY A 267 -32.353 17.294 0.593 1.00 23.46 C ATOM 1540 C GLY A 267 -33.875 17.341 0.439 1.00 21.41 C ATOM 1541 O GLY A 267 -34.596 17.460 1.432 1.00 20.69 O ATOM 1542 H GLY A 267 -31.547 18.491 2.214 1.00 0.00 H ATOM 1543 N PRO A 268 -34.376 17.284 -0.811 1.00 21.75 N ATOM 1544 CA PRO A 268 -35.813 17.412 -1.074 1.00 21.73 C ATOM 1545 C PRO A 268 -36.667 16.158 -0.873 1.00 22.03 C ATOM 1546 O PRO A 268 -37.895 16.251 -0.867 1.00 21.91 O ATOM 1547 CB PRO A 268 -35.856 17.832 -2.544 1.00 23.40 C ATOM 1548 CG PRO A 268 -34.634 17.235 -3.144 1.00 22.93 C ATOM 1549 CD PRO A 268 -33.593 17.189 -2.062 1.00 22.45 C ATOM 1550 N GLY A 269 -36.034 15.000 -0.720 1.00 19.06 N ATOM 1551 CA GLY A 269 -36.771 13.741 -0.843 1.00 20.63 C ATOM 1552 C GLY A 269 -37.425 13.700 -2.213 1.00 19.33 C ATOM 1553 O GLY A 269 -36.883 14.256 -3.179 1.00 23.19 O ATOM 1554 H GLY A 269 -35.015 14.988 -0.513 1.00 0.00 H ATOM 1555 N ASP A 270 -38.575 13.038 -2.306 1.00 21.26 N ATOM 1556 CA ASP A 270 -39.311 12.949 -3.551 1.00 20.68 C ATOM 1557 C ASP A 270 -39.850 14.320 -3.924 1.00 22.89 C ATOM 1558 O ASP A 270 -40.641 14.901 -3.181 1.00 24.61 O ATOM 1559 CB ASP A 270 -40.457 11.952 -3.426 1.00 22.70 C ATOM 1560 CG ASP A 270 -41.076 11.592 -4.770 1.00 22.98 C ATOM 1561 OD1 ASP A 270 -41.039 12.407 -5.716 1.00 25.95 O ATOM 1562 OD2 ASP A 270 -41.600 10.464 -4.878 1.00 30.00 O ATOM 1563 H ASP A 270 -38.957 12.570 -1.460 1.00 0.00 H ATOM 1564 N GLU A 271 -39.420 14.822 -5.076 1.00 22.73 N ATOM 1565 CA GLU A 271 -39.767 16.184 -5.493 1.00 26.01 C ATOM 1566 C GLU A 271 -41.187 16.299 -6.024 1.00 30.75 C ATOM 1567 O GLU A 271 -41.714 17.409 -6.142 1.00 31.62 O ATOM 1568 CB GLU A 271 -38.765 16.701 -6.524 1.00 25.60 C ATOM 1569 CG GLU A 271 -37.373 16.964 -5.948 1.00 23.70 C ATOM 1570 CD GLU A 271 -36.313 17.114 -7.022 1.00 27.63 C ATOM 1571 OE1 GLU A 271 -36.561 17.828 -8.019 1.00 27.14 O ATOM 1572 OE2 GLU A 271 -35.214 16.537 -6.853 1.00 23.53 O ATOM 1573 H GLU A 271 -38.824 14.236 -5.696 1.00 0.00 H ATOM 1574 N ASP A 272 -41.798 15.157 -6.339 1.00 34.80 N ATOM 1575 CA ASP A 272 -43.190 15.115 -6.763 1.00 39.49 C ATOM 1576 C ASP A 272 -43.918 13.952 -6.098 1.00 41.03 C ATOM 1577 O ASP A 272 -44.314 14.048 -4.933 1.00 43.37 O ATOM 1578 CB ASP A 272 -43.291 15.002 -8.284 1.00 42.06 C ATOM 1579 CG ASP A 272 -44.576 15.613 -8.835 1.00 47.81 C ATOM 1580 OD1 ASP A 272 -45.667 15.303 -8.306 1.00 52.08 O ATOM 1581 OD2 ASP A 272 -44.490 16.401 -9.804 1.00 52.56 O ATOM 1582 H ASP A 272 -41.263 14.267 -6.280 1.00 0.00 H TER 1583 ASP A 272 HETATM 1584 ZN ZN A 1 -38.044 30.227 16.989 1.00 17.55 ZN HETATM 1585 ZN ZN A 2 -37.349 23.725 28.392 1.00 17.79 ZN HETATM 1586 CA CA A 3 -44.655 32.588 28.859 1.00 16.91 CA HETATM 1587 CA CA A 4 -33.982 14.321 22.241 1.00 24.19 CA HETATM 1588 CA CA A 5 -52.357 26.441 29.277 1.00 49.47 CA HETATM 1589 O HOH 6 -43.540 10.095 -6.484 1.00 42.36 O HETATM 1590 O HOH 7 -27.816 30.302 13.578 1.00 43.02 O HETATM 1591 O HOH 8 -39.650 36.776 30.080 1.00 30.42 O HETATM 1592 O HOH 9 -46.174 4.183 18.765 1.00 52.75 O HETATM 1593 O HOH 10 -36.517 30.511 36.960 1.00 38.34 O HETATM 1594 O HOH 11 -45.975 34.243 24.799 1.00 41.77 O HETATM 1595 O HOH 12 -59.951 28.784 20.498 1.00 38.32 O HETATM 1596 O HOH 13 -34.500 12.305 23.233 1.00 22.83 O HETATM 1597 O HOH 14 -56.468 10.478 20.937 1.00 40.06 O HETATM 1598 O HOH 15 -53.307 33.184 17.232 1.00 25.18 O HETATM 1599 O HOH 16 -28.378 23.281 11.465 1.00 23.79 O HETATM 1600 O HOH 17 -39.617 7.096 11.922 1.00 26.57 O HETATM 1601 O HOH 18 -34.569 37.037 11.897 1.00 29.04 O HETATM 1602 O HOH 19 -43.890 14.361 -2.357 1.00 44.59 O HETATM 1603 O HOH 20 -46.797 10.112 22.145 1.00 16.78 O HETATM 1604 O HOH 21 -43.914 28.171 -0.688 1.00 42.65 O HETATM 1605 O HOH 22 -35.390 7.174 15.421 1.00 42.19 O HETATM 1606 O HOH 23 -55.326 11.166 17.606 1.00 44.04 O HETATM 1607 O HOH 24 -36.544 6.343 18.893 1.00 29.46 O HETATM 1608 O HOH 25 -54.336 18.131 25.705 1.00 22.25 O HETATM 1609 O HOH 26 -45.060 13.646 4.516 1.00 24.57 O HETATM 1610 O HOH 27 -45.100 33.692 3.397 1.00 38.35 O HETATM 1611 O HOH 28 -27.959 17.700 22.792 1.00 38.50 O HETATM 1612 O HOH 29 -44.457 1.295 23.531 1.00 42.89 O HETATM 1613 O HOH 30 -38.105 19.996 -8.303 1.00 30.86 O HETATM 1614 O HOH 31 -34.800 13.816 26.204 1.00 30.78 O HETATM 1615 O HOH 32 -31.789 24.362 -0.319 1.00 27.71 O HETATM 1616 O HOH 33 -25.365 14.864 12.280 1.00 30.94 O HETATM 1617 O HOH 34 -56.409 27.280 12.446 1.00 48.61 O HETATM 1618 O HOH 35 -57.878 25.960 23.492 1.00 21.70 O HETATM 1619 O HOH 36 -43.663 5.313 10.492 1.00 30.13 O HETATM 1620 O HOH 37 -31.235 13.761 0.862 1.00 24.13 O HETATM 1621 O HOH 38 -47.474 19.876 4.615 1.00 31.54 O HETATM 1622 O HOH 39 -37.756 19.049 30.848 1.00 37.55 O HETATM 1623 O HOH 40 -32.860 26.756 34.940 1.00 27.48 O HETATM 1624 O HOH 41 -55.875 20.285 16.372 1.00 29.42 O HETATM 1625 O HOH 42 -42.948 10.171 5.813 1.00 30.94 O HETATM 1626 O HOH 43 -39.825 17.304 26.316 1.00 23.12 O HETATM 1627 O HOH 44 -35.690 18.032 -10.569 1.00 31.57 O HETATM 1628 O HOH 45 -31.356 26.718 -3.273 1.00 35.80 O HETATM 1629 O HOH 46 -39.696 18.035 -1.811 1.00 25.22 O HETATM 1630 O HOH 47 -60.123 16.093 17.482 1.00 42.79 O HETATM 1631 O HOH 48 -61.194 16.263 19.906 1.00 25.41 O HETATM 1632 O HOH 49 -44.575 29.484 32.891 1.00 14.18 O HETATM 1633 O HOH 50 -49.410 13.078 16.831 1.00 19.82 O HETATM 1634 O HOH 51 -40.337 19.862 29.882 1.00 39.98 O HETATM 1635 O HOH 52 -32.153 13.141 20.825 1.00 24.37 O HETATM 1636 O HOH 53 -52.258 31.207 32.032 1.00 39.33 O HETATM 1637 O HOH 54 -18.974 13.122 9.800 1.00 52.51 O HETATM 1638 O HOH 55 -60.746 31.121 15.094 1.00 37.70 O HETATM 1639 O HOH 56 -32.102 10.779 19.798 1.00 27.57 O HETATM 1640 O HOH 57 -50.974 32.928 25.801 1.00 31.15 O HETATM 1641 O HOH 58 -45.919 10.154 29.350 1.00 21.08 O HETATM 1642 O HOH 59 -63.804 35.962 17.176 1.00 25.82 O HETATM 1643 O HOH 60 -57.715 25.280 29.926 1.00 39.11 O HETATM 1644 O HOH 61 -43.959 34.896 9.293 1.00 22.77 O HETATM 1645 O HOH 62 -47.108 30.366 2.599 1.00 44.39 O HETATM 1646 O HOH 63 -45.027 21.299 3.611 1.00 23.03 O HETATM 1647 O HOH 64 -47.126 5.614 15.864 1.00 33.74 O HETATM 1648 O HOH 65 -34.403 32.035 0.985 1.00 19.29 O HETATM 1649 O HOH 66 -51.349 30.721 34.205 1.00 23.48 O HETATM 1650 O HOH 67 -40.410 32.712 1.843 1.00 24.68 O HETATM 1651 O HOH 68 -36.964 17.309 27.307 1.00 25.59 O HETATM 1652 O HOH 69 -55.585 28.629 28.858 1.00 38.10 O HETATM 1653 O HOH 70 -36.488 29.559 7.152 1.00 19.47 O HETATM 1654 O HOH 71 -39.843 9.488 3.090 1.00 27.47 O HETATM 1655 O HOH 72 -48.624 10.342 24.211 1.00 28.39 O HETATM 1656 O HOH 73 -33.745 23.404 -2.203 1.00 26.12 O HETATM 1657 O HOH 74 -44.862 16.393 -0.879 1.00 47.63 O HETATM 1658 O HOH 75 -34.414 29.872 9.049 1.00 19.93 O HETATM 1659 O HOH 76 -27.766 8.004 13.197 1.00 48.94 O HETATM 1660 O HOH 77 -32.676 34.371 16.539 1.00 45.90 O HETATM 1661 O HOH 78 -46.771 7.839 14.024 1.00 27.14 O HETATM 1662 O HOH 79 -44.579 13.383 9.033 1.00 24.01 O HETATM 1663 O HOH 80 -42.885 31.603 -0.151 1.00 30.43 O HETATM 1664 O HOH 81 -44.257 36.748 30.986 1.00 35.28 O HETATM 1665 O HOH 82 -46.880 13.508 10.480 1.00 18.63 O HETATM 1666 O HOH 83 -51.560 37.022 15.370 1.00 37.70 O HETATM 1667 O HOH 84 -29.624 11.998 30.698 1.00 50.46 O HETATM 1668 O HOH 85 -59.386 36.057 16.274 1.00 43.20 O HETATM 1669 O HOH 86 -45.996 9.642 26.296 1.00 23.41 O HETATM 1670 O HOH 87 -40.771 12.034 -8.492 1.00 29.67 O HETATM 1671 O HOH 88 -44.332 24.532 0.236 1.00 44.28 O HETATM 1672 O HOH 89 -26.457 21.951 1.457 1.00 41.49 O HETATM 1673 O HOH 90 -32.625 42.856 4.951 1.00 32.87 O HETATM 1674 O HOH 91 -35.296 23.474 35.653 1.00 20.05 O HETATM 1675 O HOH 92 -38.332 29.933 25.856 1.00 32.01 O HETATM 1676 O HOH 93 -38.122 6.185 3.846 1.00 33.68 O HETATM 1677 O HOH 94 -31.536 15.914 32.833 1.00 24.60 O HETATM 1678 O HOH 95 -40.629 12.269 3.637 1.00 23.73 O HETATM 1679 O HOH 96 -53.493 23.822 16.703 1.00 20.53 O HETATM 1680 O HOH 97 -44.273 38.817 10.040 1.00 28.71 O HETATM 1681 O HOH 98 -44.591 34.616 38.070 1.00 56.84 O HETATM 1682 O HOH 99 -43.536 10.842 8.391 1.00 20.85 O HETATM 1683 O HOH 100 -44.894 36.511 11.371 1.00 33.29 O HETATM 1684 O HOH 101 -35.497 31.092 29.901 1.00 27.17 O HETATM 1685 O HOH 102 -36.521 25.068 33.150 1.00 16.82 O HETATM 1686 O HOH 103 -40.327 3.425 22.946 1.00 36.93 O HETATM 1687 O HOH 104 -42.341 17.768 -2.101 1.00 46.46 O HETATM 1688 O HOH 105 -53.233 15.957 11.566 1.00 24.25 O HETATM 1689 O HOH 106 -40.489 15.117 -0.285 1.00 33.20 O HETATM 1690 O HOH 107 -35.265 3.305 11.677 1.00 33.26 O HETATM 1691 O HOH 108 -40.752 32.173 23.038 1.00 39.03 O HETATM 1692 O HOH 109 -58.979 14.588 25.628 1.00 27.33 O HETATM 1693 O HOH 110 -42.672 24.283 37.504 1.00 40.81 O HETATM 1694 O HOH 111 -60.218 37.615 20.388 1.00 46.76 O HETATM 1695 O HOH 112 -37.711 3.942 22.257 1.00 41.52 O HETATM 1696 O HOH 113 -43.732 22.351 34.820 1.00 24.60 O HETATM 1697 O HOH 114 -29.004 39.420 5.705 1.00 43.89 O HETATM 1698 O HOH 115 -33.766 26.040 23.029 1.00 28.71 O HETATM 1699 O HOH 116 -33.069 30.330 18.142 1.00 53.40 O HETATM 1700 O HOH 117 -47.781 29.967 36.904 1.00 32.67 O HETATM 1701 O HOH 118 -46.358 37.759 18.698 1.00 35.77 O HETATM 1702 O HOH 119 -35.604 5.853 5.777 1.00 50.93 O HETATM 1703 O HOH 120 -61.234 25.473 16.829 1.00 55.67 O HETATM 1704 O HOH 121 -38.912 19.980 -3.485 1.00 32.37 O HETATM 1705 O HOH 122 -59.350 13.519 22.662 1.00 21.18 O HETATM 1706 O HOH 123 -57.050 27.680 1.285 1.00 50.67 O HETATM 1707 O HOH 124 -37.759 33.131 32.280 1.00 36.70 O HETATM 1708 O HOH 125 -53.818 24.768 7.357 1.00 50.29 O HETATM 1709 O HOH 126 -45.320 3.165 20.975 1.00 35.98 O HETATM 1710 O HOH 127 -33.880 26.865 18.978 1.00 37.36 O HETATM 1711 O HOH 128 -36.989 3.631 25.013 1.00 39.10 O HETATM 1712 O HOH 129 -29.251 10.903 14.316 1.00 52.57 O HETATM 1713 O HOH 130 -43.292 18.704 31.600 1.00 41.10 O HETATM 1714 O HOH 131 -36.239 27.493 20.365 1.00 20.70 O HETATM 1715 O HOH 132 -43.990 36.085 19.059 1.00 24.37 O HETATM 1716 O HOH 133 -41.778 34.747 22.583 1.00 44.72 O HETATM 1717 O HOH 134 -54.464 9.858 23.949 1.00 45.32 O HETATM 1718 O HOH 135 -55.185 24.450 14.045 1.00 39.69 O HETATM 1719 O HOH 136 -33.100 6.356 9.605 1.00 27.30 O HETATM 1720 O HOH 137 -31.828 6.986 7.414 1.00 39.75 O HETATM 1721 O HOH 138 -50.494 29.147 3.887 1.00 38.01 O HETATM 1722 O HOH 139 -27.082 24.402 5.241 1.00 40.24 O HETATM 1723 O HOH 140 -58.988 25.486 20.720 1.00 29.45 O HETATM 1724 O HOH 141 -49.056 19.536 7.006 1.00 29.21 O HETATM 1725 O HOH 142 -41.151 19.043 32.887 1.00 41.18 O HETATM 1726 O HOH 143 -53.498 8.092 20.712 1.00 47.67 O HETATM 1727 O HOH 144 -59.491 23.124 13.940 1.00 50.93 O HETATM 1728 O HOH 145 -50.873 10.673 16.599 1.00 26.73 O HETATM 1729 O HOH 146 -39.960 11.890 0.247 1.00 27.07 O HETATM 1730 O HOH 147 -41.367 37.105 19.421 1.00 45.38 O HETATM 1731 O HOH 148 -45.929 22.964 1.874 1.00 35.17 O HETATM 1732 O HOH 149 -40.697 26.645 39.008 1.00 33.08 O HETATM 1733 O HOH 150 -28.258 24.357 25.255 1.00 53.06 O HETATM 1734 O HOH 151 -45.240 8.734 8.994 1.00 50.52 O HETATM 1735 O HOH 152 -32.419 31.479 30.224 1.00 54.13 O HETATM 1736 O HOH 153 -11.490 7.006 7.729 1.00 35.49 O HETATM 1737 O HOH 154 -30.474 23.236 29.152 1.00 20.88 O HETATM 1738 O HOH 155 -38.917 28.252 -5.896 1.00 44.87 O HETATM 1739 O HOH 156 -28.898 20.101 21.569 1.00 38.52 O HETATM 1740 O HOH 157 -47.952 10.123 13.369 1.00 46.43 O HETATM 1741 O HOH 158 -15.715 5.407 9.326 1.00 43.99 O HETATM 1742 O HOH 159 -48.402 4.177 26.622 1.00 36.23 O HETATM 1743 O HOH 160 -15.032 12.173 8.586 1.00 38.81 O HETATM 1744 O HOH 161 -51.572 35.903 20.637 1.00 48.21 O HETATM 1745 O HOH 162 -46.610 11.827 12.305 1.00 35.15 O HETATM 1746 O HOH 163 -31.007 33.295 13.744 1.00 49.15 O HETATM 1747 O HOH 164 -34.069 7.064 19.562 1.00 44.88 O HETATM 1748 O HOH 165 -54.122 25.840 11.995 1.00 43.08 O HETATM 1749 O HOH 166 -57.218 36.537 17.806 1.00 49.44 O HETATM 1750 O HOH 167 -25.671 11.328 28.346 1.00 42.97 O HETATM 1751 O HOH 168 -51.819 29.391 10.049 1.00 43.95 O HETATM 1752 O HOH 169 -60.987 22.918 22.983 1.00 32.82 O HETATM 1753 O HOH 170 -46.139 29.047 38.852 1.00 34.02 O HETATM 1754 O HOH 171 -47.282 7.765 28.524 1.00 33.62 O HETATM 1755 O HOH 172 -32.857 14.480 27.968 1.00 49.46 O HETATM 1756 O HOH 173 -43.293 11.945 3.377 1.00 24.85 O HETATM 1757 O HOH 174 -31.764 29.168 34.366 1.00 48.11 O HETATM 1758 O HOH 175 -28.034 13.101 15.111 1.00 39.47 O HETATM 1759 O HOH 176 -27.482 27.953 28.594 1.00 52.66 O HETATM 1760 O HOH 177 -38.903 32.441 -4.298 1.00 39.62 O HETATM 1761 O HOH 178 -38.861 33.510 -0.290 1.00 34.77 O HETATM 1762 O HOH 179 -49.472 6.827 16.741 1.00 44.11 O HETATM 1763 O HOH 180 -62.991 38.419 16.228 1.00 43.52 O HETATM 1764 O HOH 181 -28.414 24.338 27.908 1.00 43.64 O HETATM 1765 O HOH 182 -47.306 12.292 5.531 1.00 34.36 O HETATM 1766 O HOH 183 -31.252 20.306 -2.249 1.00 42.28 O HETATM 1767 O HOH 184 -36.002 40.237 4.021 1.00 41.77 O HETATM 1768 O HOH 185 -61.679 14.299 21.521 1.00 37.90 O HETATM 1769 O HOH 186 -51.589 15.645 9.249 1.00 28.06 O HETATM 1770 O HOH 187 -39.971 15.511 28.860 1.00 49.00 O HETATM 1771 O HOH 188 -31.445 25.319 22.687 1.00 32.89 O HETATM 1772 O HOH 189 -51.066 13.180 8.229 1.00 36.90 O HETATM 1773 O HOH 190 -53.277 11.890 15.370 1.00 36.63 O HETATM 1774 O HOH 191 -12.189 2.721 9.703 1.00 38.97 O HETATM 1775 O HOH 192 -54.189 20.808 13.169 1.00 43.46 O HETATM 1776 O HOH 193 -37.156 3.558 27.712 1.00 47.41 O HETATM 1777 O HOH 194 -32.395 10.409 23.161 1.00 44.82 O HETATM 1778 O HOH 195 -32.934 4.732 11.560 1.00 39.35 O HETATM 1779 O HOH 196 -31.867 10.556 26.423 1.00 46.43 O HETATM 1780 O HOH 197 -54.160 23.209 11.758 1.00 52.11 O HETATM 1781 O HOH 198 -42.918 6.508 8.259 1.00 39.56 O HETATM 1782 O HOH 199 -49.511 8.904 14.993 1.00 41.65 O HETATM 1783 O HOH 200 -45.309 31.897 1.450 1.00 48.47 O HETATM 1784 O HOH 201 -47.969 9.489 9.550 1.00 46.49 O HETATM 1785 O HOH 202 -28.705 24.071 -0.489 1.00 36.66 O HETATM 1786 O HOH 203 -33.577 36.897 14.586 1.00 38.20 O HETATM 1787 O HOH 204 -37.435 4.466 13.932 1.00 38.25 O HETATM 1788 O HOH 205 -41.568 22.380 -1.984 1.00 41.53 O HETATM 1789 O HOH 206 -48.540 12.303 8.541 1.00 31.77 O HETATM 1790 O HOH 207 -58.278 19.565 15.553 1.00 47.53 O HETATM 1791 O HOH 208 -54.974 22.184 14.982 1.00 38.99 O HETATM 1792 O HOH 209 -24.615 14.248 9.822 1.00 38.04 O HETATM 1793 O HOH 210 -31.165 4.436 13.542 1.00 52.15 O HETATM 1794 O HOH 211 -28.852 23.340 22.797 1.00 52.33 O HETATM 1795 O HOH 212 -36.628 13.245 28.959 1.00 36.19 O HETATM 1796 O HOH 213 -33.978 29.115 23.509 1.00 46.32 O HETATM 1797 O HOH 214 -34.802 31.824 27.488 1.00 48.22 O HETATM 1798 O HOH 215 -52.631 17.468 7.535 1.00 45.45 O HETATM 1799 O HOH 216 -47.610 33.877 0.166 1.00 57.84 O HETATM 1800 C3 WNN A 217 -48.470 30.312 6.451 1.00 -0.06 C HETATM 1801 C2 WNN A 217 -47.100 30.175 6.346 1.00 -0.06 C HETATM 1802 C1 WNN A 217 -46.264 30.664 7.327 1.00 -0.05 C HETATM 1803 C6 WNN A 217 -46.786 31.298 8.431 1.00 0.03 C HETATM 1804 C5 WNN A 217 -48.157 31.429 8.525 1.00 0.07 C HETATM 1805 C4 WNN A 217 -49.002 30.942 7.554 1.00 -0.05 C HETATM 1806 H4 WNN A 217 -50.075 31.053 7.656 1.00 0.07 H HETATM 1807 C10 WNN A 217 -48.747 32.098 9.687 1.00 0.24 C HETATM 1808 N9 WNN A 217 -47.836 32.552 10.600 1.00 -0.19 N HETATM 1809 C8 WNN A 217 -46.487 32.373 10.413 1.00 0.24 C HETATM 1810 C12 WNN A 217 -45.661 32.919 11.520 1.00 0.28 C HETATM 1811 N14 WNN A 217 -44.357 32.524 11.456 1.00 -0.27 N HETATM 1812 C15 WNN A 217 -43.493 32.889 12.534 1.00 0.06 C HETATM 1813 C16 WNN A 217 -43.673 32.162 13.826 1.00 -0.03 C HETATM 1814 C17 WNN A 217 -44.467 31.048 14.038 1.00 -0.07 C HETATM 1815 C18 WNN A 217 -44.536 30.486 15.299 1.00 -0.08 C HETATM 1816 C19 WNN A 217 -43.823 30.999 16.364 1.00 -0.04 C HETATM 1817 C20 WNN A 217 -43.030 32.105 16.127 1.00 0.08 C HETATM 1818 C21 WNN A 217 -42.965 32.664 14.880 1.00 -0.03 C HETATM 1819 H8 WNN A 217 -42.333 33.531 14.724 1.00 0.05 H HETATM 1820 O22 WNN A 217 -42.247 32.768 17.050 1.00 -0.32 O HETATM 1821 C23 WNN A 217 -42.102 32.069 18.265 1.00 0.08 C HETATM 1822 C24 WNN A 217 -41.201 32.949 19.114 1.00 0.04 C HETATM 1823 S25 WNN A 217 -39.492 32.942 18.490 1.00 -0.03 S HETATM 1824 C26 WNN A 217 -38.973 31.422 19.212 1.00 0.21 C HETATM 1825 N27 WNN A 217 -39.020 31.245 20.567 1.00 -0.29 N HETATM 1826 C28 WNN A 217 -38.572 30.021 20.714 1.00 0.05 C HETATM 1827 N29 WNN A 217 -38.275 29.502 19.496 1.00 -0.20 N HETATM 1828 N30 WNN A 217 -38.518 30.372 18.504 1.00 -0.18 N HETATM 1829 H16 WNN A 217 -38.392 30.266 17.487 1.00 0.26 H HETATM 1830 H9 WNN A 217 -38.456 29.503 21.665 1.00 0.08 H HETATM 1831 H14 WNN A 217 -41.206 32.575 20.148 1.00 0.04 H HETATM 1832 H15 WNN A 217 -41.585 33.980 19.095 1.00 0.04 H HETATM 1833 H12 WNN A 217 -43.079 31.931 18.752 1.00 0.06 H HETATM 1834 H13 WNN A 217 -41.636 31.088 18.094 1.00 0.06 H HETATM 1835 H7 WNN A 217 -43.883 30.551 17.349 1.00 0.05 H HETATM 1836 H3 WNN A 217 -45.167 29.619 15.456 1.00 0.06 H HETATM 1837 H5 WNN A 217 -45.032 30.618 13.219 1.00 0.05 H HETATM 1838 H10 WNN A 217 -42.458 32.721 12.201 1.00 0.07 H HETATM 1839 H11 WNN A 217 -43.645 33.960 12.732 1.00 0.07 H HETATM 1840 H18 WNN A 217 -44.016 31.995 10.679 1.00 0.19 H HETATM 1841 O13 WNN A 217 -46.189 33.591 12.391 1.00 -0.36 O HETATM 1842 N7 WNN A 217 -45.921 31.783 9.408 1.00 -0.27 N HETATM 1843 H17 WNN A 217 -48.158 33.024 11.421 1.00 0.25 H HETATM 1844 O11 WNN A 217 -49.960 32.212 9.775 1.00 -0.39 O HETATM 1845 H6 WNN A 217 -45.191 30.549 7.228 1.00 0.06 H HETATM 1846 H2 WNN A 217 -46.677 29.677 5.481 1.00 0.06 H HETATM 1847 H1 WNN A 217 -49.120 29.928 5.673 1.00 0.06 H CONECT 1 2 14 15 16 CONECT 14 1 CONECT 15 1 CONECT 16 1 CONECT 604 603 1587 CONECT 703 701 702 1585 CONECT 717 715 1585 CONECT 770 769 1586 CONECT 776 775 1586 CONECT 788 787 1586 CONECT 801 800 1586 CONECT 831 829 830 1585 CONECT 880 879 1587 CONECT 905 904 1587 CONECT 918 917 1587 CONECT 933 932 935 1585 CONECT 965 964 1588 CONECT 980 979 1588 CONECT 1147 1145 1146 1584 CONECT 1185 1183 1184 1584 CONECT 1236 1234 1235 1584 CONECT 1384 1385 1394 1395 1396 CONECT 1394 1384 CONECT 1395 1384 CONECT 1396 1384 CONECT 1584 1147 1185 1236 CONECT 1585 703 717 831 933 CONECT 1586 770 776 788 801 CONECT 1587 604 880 905 918 CONECT 1588 965 980 CONECT 1800 1801 1805 1847 CONECT 1801 1800 1802 1846 CONECT 1802 1801 1803 1845 CONECT 1803 1802 1804 1842 CONECT 1804 1803 1805 1807 CONECT 1805 1800 1804 1806 CONECT 1806 1805 CONECT 1807 1804 1808 1844 CONECT 1808 1807 1809 1843 CONECT 1809 1808 1810 1842 CONECT 1810 1809 1811 1841 CONECT 1811 1810 1812 1840 CONECT 1812 1811 1813 1838 1839 CONECT 1813 1812 1814 1818 CONECT 1814 1813 1815 1837 CONECT 1815 1814 1816 1836 CONECT 1816 1815 1817 1835 CONECT 1817 1816 1818 1820 CONECT 1818 1813 1817 1819 CONECT 1819 1818 CONECT 1820 1817 1821 CONECT 1821 1820 1822 1833 1834 CONECT 1822 1821 1823 1831 1832 CONECT 1823 1822 1824 CONECT 1824 1823 1825 1828 CONECT 1825 1824 1826 CONECT 1826 1825 1827 1830 CONECT 1827 1826 1828 CONECT 1828 1824 1827 1829 CONECT 1829 1828 CONECT 1830 1826 CONECT 1831 1822 CONECT 1832 1822 CONECT 1833 1821 CONECT 1834 1821 CONECT 1835 1816 CONECT 1836 1815 CONECT 1837 1814 CONECT 1838 1812 CONECT 1839 1812 CONECT 1840 1811 CONECT 1841 1810 CONECT 1842 1803 1809 CONECT 1843 1808 CONECT 1844 1807 CONECT 1845 1802 CONECT 1846 1801 CONECT 1847 1800 MASTER 0 0 0 0 0 0 0 0 1845 2 78 14 END
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Structure:
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Ligand 3D
Protein
Pocket-Ligand
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Related entries of code: 5b5p
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1eub
RCSB PDB
PDBbind
171aa, >1EUB_1|Chain... at 100%
1fls
RCSB PDB
PDBbind
165aa, >1FLS_1|Chain... at 100%
1xuc
RCSB PDB
PDBbind
171aa, >1XUC_1|Chains... at 100%
1xud
RCSB PDB
PDBbind
171aa, >1XUD_1|Chains... at 100%
1xur
RCSB PDB
PDBbind
171aa, >1XUR_1|Chains... at 100%
1you
RCSB PDB
PDBbind
168aa, >1YOU_1|Chains... at 100%
1ztq
RCSB PDB
PDBbind
165aa, >1ZTQ_1|Chains... at 100%
2d1n
RCSB PDB
PDBbind
166aa, >2D1N_1|Chains... at 100%
2ow9
RCSB PDB
PDBbind
170aa, >2OW9_1|Chains... at 98%
2ozr
RCSB PDB
PDBbind
170aa, >2OZR_1|Chains... at 98%
2pjt
RCSB PDB
PDBbind
165aa, >2PJT_1|Chains... at 100%
2yig
RCSB PDB
PDBbind
171aa, >2YIG_1|Chains... at 100%
3elm
RCSB PDB
PDBbind
171aa, >3ELM_1|Chains... at 100%
3i7g
RCSB PDB
PDBbind
171aa, >3I7G_1|Chains... at 100%
3i7i
RCSB PDB
PDBbind
171aa, >3I7I_1|Chains... at 100%
3kec
RCSB PDB
PDBbind
167aa, >3KEC_1|Chains... at 100%
3kej
RCSB PDB
PDBbind
167aa, >3KEJ_1|Chains... at 100%
3kek
RCSB PDB
PDBbind
167aa, >3KEK_1|Chains... at 100%
3kry
RCSB PDB
PDBbind
164aa, >3KRY_1|Chains... at 100%
3ljz
RCSB PDB
PDBbind
164aa, >3LJZ_1|Chains... at 99%
3tvc
RCSB PDB
PDBbind
169aa, >3TVC_1|Chain... at 100%
3wv1
RCSB PDB
PDBbind
171aa, >3WV1_1|Chains... at 100%
3wv2
RCSB PDB
PDBbind
171aa, >3WV2_1|Chains... at 100%
3wv3
RCSB PDB
PDBbind
171aa, >3WV3_1|Chains... at 100%
3zxh
RCSB PDB
PDBbind
171aa, >3ZXH_1|Chains... at 100%
456c
RCSB PDB
PDBbind
168aa, >456C_1|Chains... at 100%
4a7b
RCSB PDB
PDBbind
169aa, >4A7B_1|Chains... at 100%
4jpa
RCSB PDB
PDBbind
173aa, >4JPA_1|Chains... *
4l19
RCSB PDB
PDBbind
171aa, >4L19_1|Chains... at 100%
5b5o
RCSB PDB
PDBbind
172aa, >5B5O_1|Chains... at 100%
5bot
RCSB PDB
PDBbind
171aa, >5BOT_1|Chains... at 100%
5boy
RCSB PDB
PDBbind
171aa, >5BOY_1|Chains... at 100%
5bpa
RCSB PDB
PDBbind
171aa, >5BPA_1|Chains... at 100%
5uwk
RCSB PDB
PDBbind
172aa, >5UWK_1|Chains... at 99%
5uwl
RCSB PDB
PDBbind
172aa, >5UWL_1|Chains... at 99%
5uwm
RCSB PDB
PDBbind
172aa, >5UWM_1|Chains... at 99%
5uwn
RCSB PDB
PDBbind
172aa, >5UWN_1|Chains... at 99%
830c
RCSB PDB
PDBbind
168aa, >830C_1|Chains... at 100%
6hv2
RCSB PDB
PDBbind
168aa, >6HV2_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5b5p
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Matrix Metalloproteinase 13
Ligand Name
WNN
EC.Number
E.C.-.-.-.-
Resolution
1.6(Å)
Affinity (Kd/Ki/IC50)
IC50=0.2nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Med. Chem. Vol. 60: pp. 608-626
Ligand Properties
Formula
C
2
0
H
1
8
N
6
O
3
S
Molecular Weight
422.460
Exact Mass
422.116
No. of atoms
48
No. of bonds
51
Polar Surface Area
150.95
LOGP Value
2.47 (
Computed with XLOGP3
)
2.53 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 4
Canonical SMILES
O=C(c1nc2ccccc2c(=O)[nH]1)NCc1cccc(c1)OCCSc1ncn[nH]1
InChI String
InChI=1S/C20H18N6O3S/c27-18-15-6-1-2-7-16(15)24-17(25-18)19(28)21-11-13-4-3-5-14(10-13)29-8-9-30-20-22-12-23-26-20/h1-7,10,12H,8-9,11H2,(H,21,28)(H,22,23,26)(H,24,25,27)
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P45452
Entrez Gene ID
NCBI Entrez Gene ID:
4322
ASD
Information of known allosteric effects of PDB entries
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