Browse entries in the PDBbind-CN Database
HEADER 4PMT_COMPLEX COMPND 4PMT_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 32 CYS VAL HIS HIS ILE LYS ARG ARG ASP ILE VAL LEU LYS SEQRES 2 A 32 TRP GLU LEU GLY GLU GLY ALA PHE GLY LYS VAL PHE LEU SEQRES 3 A 32 ALA GLU CYS HIS ASN LEU SEQRES 1 A 10 ASP LYS MET LEU VAL ALA VAL LYS ALA LEU SEQRES 1 A 114 ASP PHE GLN ARG GLU ALA GLU LEU LEU THR MET LEU GLN SEQRES 2 A 114 HIS GLN HIS ILE VAL ARG PHE PHE GLY VAL CYS THR GLU SEQRES 3 A 114 GLY ARG PRO LEU LEU MET VAL PHE GLU TYR MET ARG HIS SEQRES 4 A 114 GLY ASP LEU ASN ARG PHE LEU ARG SER HIS GLY PRO ASP SEQRES 5 A 114 ALA LYS LEU LEU ALA GLY GLY GLU ASP VAL ALA PRO GLY SEQRES 6 A 114 PRO LEU GLY LEU GLY GLN LEU LEU ALA VAL ALA SER GLN SEQRES 7 A 114 VAL ALA ALA GLY MET VAL TYR LEU ALA GLY LEU HIS PHE SEQRES 8 A 114 VAL HIS ARG ASP LEU ALA THR ARG ASN CYS LEU VAL GLY SEQRES 9 A 114 GLN GLY LEU VAL VAL LYS ILE GLY ASP PHE SEQRES 1 A 12 SER ARG ASP ILE TYR SER THR ASP TYR TYR ARG VAL SEQRES 1 A 105 THR MET LEU PRO ILE ARG TRP MET PRO PRO GLU SER ILE SEQRES 2 A 105 LEU TYR ARG LYS PHE THR THR GLU SER ASP VAL TRP SER SEQRES 3 A 105 PHE GLY VAL VAL LEU TRP GLU ILE PHE THR TYR GLY LYS SEQRES 4 A 105 GLN PRO TRP TYR GLN LEU SER ASN THR GLU ALA ILE ASP SEQRES 5 A 105 CYS ILE THR GLN GLY ARG GLU LEU GLU ARG PRO ARG ALA SEQRES 6 A 105 CYS PRO PRO GLU VAL TYR ALA ILE MET ARG GLY CYS TRP SEQRES 7 A 105 GLN ARG GLU PRO GLN GLN ARG HIS SER ILE LYS ASP VAL SEQRES 8 A 105 HIS ALA ARG LEU GLN ALA LEU ALA GLN ALA HIS HIS HIS SEQRES 9 A 105 HIS HET UNN A 370 54 ATOM 1 N CYS A 501 47.026 -43.214 -14.928 1.00 77.46 N ATOM 2 CA CYS A 501 47.293 -42.709 -13.581 1.00 77.29 C ATOM 3 C CYS A 501 46.049 -42.795 -12.686 1.00 77.72 C ATOM 4 O CYS A 501 46.174 -42.977 -11.472 1.00 77.35 O ATOM 5 CB CYS A 501 47.846 -41.288 -13.637 1.00 78.43 C ATOM 6 SG CYS A 501 48.554 -40.703 -12.075 1.00 82.85 S ATOM 7 HN3 CYS A 501 46.268 -42.651 -15.364 1.00 0.00 H ATOM 8 HN2 CYS A 501 46.731 -44.210 -14.871 1.00 0.00 H ATOM 9 HN1 CYS A 501 47.890 -43.139 -15.502 1.00 0.00 H ATOM 10 N VAL A 502 44.856 -42.667 -13.292 1.00 71.60 N ATOM 11 CA VAL A 502 43.555 -42.736 -12.619 1.00 70.53 C ATOM 12 C VAL A 502 43.344 -44.154 -12.057 1.00 72.92 C ATOM 13 O VAL A 502 43.499 -45.133 -12.787 1.00 72.86 O ATOM 14 CB VAL A 502 42.400 -42.324 -13.577 1.00 74.23 C ATOM 15 CG1 VAL A 502 41.062 -42.263 -12.846 1.00 74.08 C ATOM 16 CG2 VAL A 502 42.694 -40.996 -14.272 1.00 74.00 C ATOM 17 H VAL A 502 44.856 -42.506 -14.320 1.00 0.00 H ATOM 18 N HIS A 503 43.001 -44.255 -10.763 1.00 67.56 N ATOM 19 CA HIS A 503 42.748 -45.525 -10.081 1.00 66.35 C ATOM 20 C HIS A 503 41.385 -46.081 -10.508 1.00 66.29 C ATOM 21 O HIS A 503 40.398 -45.348 -10.502 1.00 64.70 O ATOM 22 CB HIS A 503 42.828 -45.333 -8.557 1.00 67.67 C ATOM 23 CG HIS A 503 42.606 -46.581 -7.758 1.00 71.83 C ATOM 24 ND1 HIS A 503 43.620 -47.506 -7.560 1.00 73.85 N ATOM 25 CD2 HIS A 503 41.496 -47.007 -7.108 1.00 73.96 C ATOM 26 CE1 HIS A 503 43.093 -48.463 -6.813 1.00 73.34 C ATOM 27 NE2 HIS A 503 41.819 -48.205 -6.513 1.00 73.77 N ATOM 28 H HIS A 503 42.910 -43.378 -10.212 1.00 0.00 H ATOM 29 N HIS A 504 41.337 -47.369 -10.911 1.00 61.17 N ATOM 30 CA HIS A 504 40.087 -48.011 -11.333 1.00 59.64 C ATOM 31 C HIS A 504 39.510 -48.865 -10.212 1.00 61.48 C ATOM 32 O HIS A 504 40.244 -49.611 -9.568 1.00 61.03 O ATOM 33 CB HIS A 504 40.260 -48.800 -12.638 1.00 59.89 C ATOM 34 CG HIS A 504 40.375 -47.917 -13.838 1.00 62.93 C ATOM 35 ND1 HIS A 504 39.334 -47.781 -14.736 1.00 64.56 N ATOM 36 CD2 HIS A 504 41.400 -47.124 -14.233 1.00 64.18 C ATOM 37 CE1 HIS A 504 39.758 -46.918 -15.648 1.00 63.75 C ATOM 38 NE2 HIS A 504 40.993 -46.496 -15.385 1.00 63.93 N ATOM 39 H HIS A 504 42.216 -47.925 -10.923 1.00 0.00 H ATOM 40 N ILE A 505 38.201 -48.713 -9.957 1.00 56.73 N ATOM 41 CA ILE A 505 37.472 -49.430 -8.908 1.00 55.79 C ATOM 42 C ILE A 505 36.465 -50.388 -9.570 1.00 59.84 C ATOM 43 O ILE A 505 35.804 -50.013 -10.542 1.00 59.79 O ATOM 44 CB ILE A 505 36.797 -48.431 -7.902 1.00 58.01 C ATOM 45 CG1 ILE A 505 37.829 -47.457 -7.286 1.00 58.12 C ATOM 46 CG2 ILE A 505 36.015 -49.153 -6.780 1.00 57.33 C ATOM 47 CD1 ILE A 505 37.273 -46.049 -6.952 1.00 62.78 C ATOM 48 H ILE A 505 37.668 -48.040 -10.544 1.00 0.00 H ATOM 49 N LYS A 506 36.363 -51.623 -9.046 1.00 56.63 N ATOM 50 CA LYS A 506 35.432 -52.643 -9.544 1.00 56.95 C ATOM 51 C LYS A 506 33.984 -52.258 -9.158 1.00 60.27 C ATOM 52 O LYS A 506 33.753 -51.867 -8.010 1.00 59.80 O ATOM 53 CB LYS A 506 35.804 -54.026 -8.965 1.00 59.29 C ATOM 54 H LYS A 506 36.978 -51.869 -8.244 1.00 0.00 H ATOM 55 N ARG A 507 33.027 -52.354 -10.112 1.00 56.55 N ATOM 56 CA ARG A 507 31.608 -52.023 -9.884 1.00 57.31 C ATOM 57 C ARG A 507 30.997 -52.734 -8.662 1.00 63.49 C ATOM 58 O ARG A 507 30.233 -52.114 -7.911 1.00 63.88 O ATOM 59 CB ARG A 507 30.763 -52.265 -11.139 1.00 57.20 C ATOM 60 CG ARG A 507 29.431 -51.510 -11.133 1.00 64.67 C ATOM 61 CD ARG A 507 28.829 -51.418 -12.519 1.00 72.17 C ATOM 62 NE ARG A 507 29.609 -50.530 -13.381 1.00 83.51 N ATOM 63 CZ ARG A 507 29.308 -49.258 -13.625 1.00 98.89 C ATOM 64 NH1 ARG A 507 28.224 -48.708 -13.088 1.00 79.69 N ATOM 65 NH2 ARG A 507 30.083 -48.527 -14.415 1.00 88.33 N ATOM 66 HE ARG A 507 30.459 -50.921 -13.835 1.00 0.00 H ATOM 67 HH12 ARG A 507 27.995 -47.713 -13.283 1.00 0.00 H ATOM 68 HH11 ARG A 507 27.605 -49.273 -12.472 1.00 0.00 H ATOM 69 HH22 ARG A 507 29.843 -47.533 -14.603 1.00 0.00 H ATOM 70 HH21 ARG A 507 30.930 -48.948 -14.847 1.00 0.00 H ATOM 71 H ARG A 507 33.309 -52.680 -11.059 1.00 0.00 H ATOM 72 N ARG A 508 31.363 -54.021 -8.460 1.00 59.98 N ATOM 73 CA ARG A 508 30.935 -54.894 -7.358 1.00 59.37 C ATOM 74 C ARG A 508 31.328 -54.286 -5.988 1.00 60.05 C ATOM 75 O ARG A 508 30.646 -54.523 -4.986 1.00 59.06 O ATOM 76 CB ARG A 508 31.568 -56.294 -7.564 1.00 62.59 C ATOM 77 CG ARG A 508 31.306 -57.343 -6.470 1.00 80.32 C ATOM 78 CD ARG A 508 32.294 -58.505 -6.531 1.00 95.97 C ATOM 79 NE ARG A 508 33.680 -58.081 -6.297 1.00105.98 N ATOM 80 CZ ARG A 508 34.733 -58.896 -6.305 1.00119.71 C ATOM 81 NH1 ARG A 508 34.575 -60.195 -6.532 1.00103.97 N ATOM 82 NH2 ARG A 508 35.949 -58.418 -6.084 1.00108.38 N ATOM 83 HE ARG A 508 33.852 -57.072 -6.112 1.00 0.00 H ATOM 84 HH12 ARG A 508 35.401 -60.826 -6.537 1.00 0.00 H ATOM 85 HH11 ARG A 508 33.625 -60.581 -6.705 1.00 0.00 H ATOM 86 HH22 ARG A 508 36.769 -59.058 -6.091 1.00 0.00 H ATOM 87 HH21 ARG A 508 36.084 -57.403 -5.903 1.00 0.00 H ATOM 88 H ARG A 508 32.015 -54.435 -9.157 1.00 0.00 H ATOM 89 N ASP A 509 32.421 -53.500 -5.953 1.00 55.13 N ATOM 90 CA ASP A 509 32.887 -52.857 -4.721 1.00 54.29 C ATOM 91 C ASP A 509 32.134 -51.544 -4.410 1.00 53.59 C ATOM 92 O ASP A 509 32.328 -50.981 -3.333 1.00 52.40 O ATOM 93 CB ASP A 509 34.417 -52.668 -4.739 1.00 56.98 C ATOM 94 CG ASP A 509 35.204 -53.972 -4.673 1.00 73.42 C ATOM 95 OD1 ASP A 509 34.772 -54.962 -5.307 1.00 75.79 O ATOM 96 OD2 ASP A 509 36.255 -54.001 -3.995 1.00 78.89 O ATOM 97 H ASP A 509 32.954 -53.344 -6.832 1.00 0.00 H ATOM 98 N ILE A 510 31.261 -51.082 -5.341 1.00 48.20 N ATOM 99 CA ILE A 510 30.439 -49.863 -5.186 1.00 46.65 C ATOM 100 C ILE A 510 28.950 -50.227 -4.961 1.00 48.80 C ATOM 101 O ILE A 510 28.276 -50.694 -5.885 1.00 48.38 O ATOM 102 CB ILE A 510 30.628 -48.827 -6.346 1.00 48.76 C ATOM 103 CG1 ILE A 510 32.087 -48.322 -6.435 1.00 47.95 C ATOM 104 CG2 ILE A 510 29.642 -47.637 -6.189 1.00 49.81 C ATOM 105 CD1 ILE A 510 32.483 -47.803 -7.805 1.00 54.53 C ATOM 106 H ILE A 510 31.164 -51.623 -6.224 1.00 0.00 H ATOM 107 N VAL A 511 28.450 -49.994 -3.738 1.00 44.11 N ATOM 108 CA VAL A 511 27.049 -50.253 -3.375 1.00 42.69 C ATOM 109 C VAL A 511 26.338 -48.886 -3.160 1.00 43.83 C ATOM 110 O VAL A 511 26.570 -48.215 -2.155 1.00 42.01 O ATOM 111 CB VAL A 511 26.919 -51.202 -2.148 1.00 46.34 C ATOM 112 CG1 VAL A 511 25.453 -51.434 -1.777 1.00 46.19 C ATOM 113 CG2 VAL A 511 27.630 -52.535 -2.394 1.00 46.05 C ATOM 114 H VAL A 511 29.086 -49.611 -3.010 1.00 0.00 H ATOM 115 N LEU A 512 25.494 -48.484 -4.120 1.00 40.17 N ATOM 116 CA LEU A 512 24.742 -47.225 -4.070 1.00 39.78 C ATOM 117 C LEU A 512 23.687 -47.309 -2.984 1.00 45.87 C ATOM 118 O LEU A 512 22.924 -48.282 -2.940 1.00 45.18 O ATOM 119 CB LEU A 512 24.097 -46.914 -5.427 1.00 39.32 C ATOM 120 CG LEU A 512 25.041 -46.732 -6.617 1.00 42.93 C ATOM 121 CD1 LEU A 512 24.261 -46.503 -7.894 1.00 43.27 C ATOM 122 CD2 LEU A 512 26.043 -45.612 -6.378 1.00 43.57 C ATOM 123 H LEU A 512 25.364 -49.100 -4.948 1.00 0.00 H ATOM 124 N LYS A 513 23.665 -46.307 -2.083 1.00 42.14 N ATOM 125 CA LYS A 513 22.733 -46.287 -0.961 1.00 41.52 C ATOM 126 C LYS A 513 21.484 -45.475 -1.240 1.00 47.34 C ATOM 127 O LYS A 513 20.368 -45.988 -1.074 1.00 46.77 O ATOM 128 CB LYS A 513 23.437 -45.847 0.328 1.00 42.94 C ATOM 129 CG LYS A 513 24.538 -46.829 0.794 1.00 48.85 C ATOM 130 CD LYS A 513 23.958 -48.163 1.293 1.00 61.06 C ATOM 131 CE LYS A 513 25.018 -49.146 1.719 1.00 76.31 C ATOM 132 NZ LYS A 513 24.464 -50.206 2.605 1.00 85.55 N ATOM 133 HZ1 LYS A 513 24.062 -49.768 3.458 1.00 0.00 H ATOM 134 HZ2 LYS A 513 23.720 -50.726 2.098 1.00 0.00 H ATOM 135 HZ3 LYS A 513 25.224 -50.862 2.876 1.00 0.00 H ATOM 136 H LYS A 513 24.336 -45.520 -2.191 1.00 0.00 H ATOM 137 N TRP A 514 21.663 -44.211 -1.646 1.00 44.98 N ATOM 138 CA TRP A 514 20.577 -43.286 -1.966 1.00 45.00 C ATOM 139 C TRP A 514 21.098 -42.024 -2.578 1.00 51.50 C ATOM 140 O TRP A 514 22.231 -41.617 -2.300 1.00 51.68 O ATOM 141 CB TRP A 514 19.649 -42.988 -0.754 1.00 42.47 C ATOM 142 CG TRP A 514 20.247 -42.250 0.406 1.00 42.16 C ATOM 143 CD1 TRP A 514 20.443 -40.901 0.505 1.00 44.89 C ATOM 144 CD2 TRP A 514 20.589 -42.799 1.686 1.00 41.46 C ATOM 145 NE1 TRP A 514 20.933 -40.584 1.750 1.00 43.96 N ATOM 146 CE2 TRP A 514 21.031 -41.729 2.497 1.00 44.96 C ATOM 147 CE3 TRP A 514 20.610 -44.101 2.213 1.00 42.50 C ATOM 148 CZ2 TRP A 514 21.454 -41.915 3.819 1.00 44.06 C ATOM 149 CZ3 TRP A 514 21.042 -44.289 3.515 1.00 44.37 C ATOM 150 CH2 TRP A 514 21.450 -43.202 4.308 1.00 45.05 C ATOM 151 HE1 TRP A 514 21.188 -39.629 2.073 1.00 0.00 H ATOM 152 H TRP A 514 22.639 -43.865 -1.740 1.00 0.00 H ATOM 153 N GLU A 515 20.280 -41.405 -3.421 1.00 49.52 N ATOM 154 CA GLU A 515 20.649 -40.163 -4.084 1.00 49.93 C ATOM 155 C GLU A 515 20.732 -39.006 -3.065 1.00 52.00 C ATOM 156 O GLU A 515 19.861 -38.874 -2.200 1.00 49.72 O ATOM 157 CB GLU A 515 19.642 -39.854 -5.192 1.00 51.53 C ATOM 158 CG GLU A 515 20.183 -38.966 -6.295 1.00 63.39 C ATOM 159 CD GLU A 515 19.205 -38.754 -7.435 1.00 82.37 C ATOM 160 OE1 GLU A 515 18.006 -38.520 -7.157 1.00 70.09 O ATOM 161 OE2 GLU A 515 19.638 -38.822 -8.608 1.00 81.81 O ATOM 162 H GLU A 515 19.346 -41.821 -3.614 1.00 0.00 H ATOM 163 N LEU A 516 21.818 -38.210 -3.158 1.00 49.26 N ATOM 164 CA LEU A 516 22.091 -37.034 -2.313 1.00 48.20 C ATOM 165 C LEU A 516 21.538 -35.783 -3.020 1.00 50.09 C ATOM 166 O LEU A 516 21.051 -34.845 -2.368 1.00 47.78 O ATOM 167 CB LEU A 516 23.603 -36.876 -2.076 1.00 47.90 C ATOM 168 CG LEU A 516 24.294 -37.931 -1.213 1.00 52.17 C ATOM 169 CD1 LEU A 516 25.790 -37.738 -1.247 1.00 53.26 C ATOM 170 CD2 LEU A 516 23.784 -37.915 0.231 1.00 51.54 C ATOM 171 H LEU A 516 22.521 -38.446 -3.887 1.00 0.00 H ATOM 172 N GLY A 517 21.610 -35.823 -4.347 1.00 45.78 N ATOM 173 CA GLY A 517 21.136 -34.782 -5.241 1.00 46.31 C ATOM 174 C GLY A 517 21.431 -35.123 -6.683 1.00 52.75 C ATOM 175 O GLY A 517 22.132 -36.097 -6.952 1.00 50.39 O ATOM 176 H GLY A 517 22.040 -36.666 -4.778 1.00 0.00 H ATOM 177 N GLU A 518 20.897 -34.326 -7.620 1.00 54.32 N ATOM 178 CA GLU A 518 21.100 -34.509 -9.063 1.00 56.69 C ATOM 179 C GLU A 518 21.339 -33.155 -9.711 1.00 66.69 C ATOM 180 O GLU A 518 20.671 -32.175 -9.367 1.00 67.24 O ATOM 181 CB GLU A 518 19.884 -35.212 -9.701 1.00 58.10 C ATOM 182 CG GLU A 518 19.996 -35.483 -11.198 1.00 63.65 C ATOM 183 CD GLU A 518 18.829 -36.229 -11.822 1.00 76.32 C ATOM 184 OE1 GLU A 518 18.065 -36.888 -11.076 1.00 57.53 O ATOM 185 OE2 GLU A 518 18.687 -36.162 -13.066 1.00 62.99 O ATOM 186 H GLU A 518 20.304 -33.531 -7.306 1.00 0.00 H ATOM 187 N GLY A 519 22.286 -33.121 -10.639 1.00 66.68 N ATOM 188 CA GLY A 519 22.647 -31.914 -11.367 1.00 67.79 C ATOM 189 C GLY A 519 22.263 -32.004 -12.821 1.00 74.56 C ATOM 190 O GLY A 519 21.279 -32.667 -13.157 1.00 75.56 O ATOM 191 H GLY A 519 22.796 -34.001 -10.857 1.00 0.00 H ATOM 192 N ALA A 520 23.047 -31.346 -13.693 1.00 72.04 N ATOM 193 CA ALA A 520 22.808 -31.312 -15.135 1.00 71.97 C ATOM 194 C ALA A 520 23.308 -32.546 -15.892 1.00 75.11 C ATOM 195 O ALA A 520 22.480 -33.287 -16.422 1.00 75.06 O ATOM 196 CB ALA A 520 23.387 -30.036 -15.738 1.00 72.87 C ATOM 197 H ALA A 520 23.871 -30.832 -13.320 1.00 0.00 H ATOM 198 N PHE A 521 24.646 -32.770 -15.943 1.00 70.57 N ATOM 199 CA PHE A 521 25.266 -33.883 -16.673 1.00 69.28 C ATOM 200 C PHE A 521 25.494 -35.175 -15.843 1.00 70.12 C ATOM 201 O PHE A 521 26.232 -36.063 -16.290 1.00 69.21 O ATOM 202 CB PHE A 521 26.579 -33.415 -17.328 1.00 71.19 C ATOM 203 H PHE A 521 25.270 -32.113 -15.434 1.00 0.00 H ATOM 204 N GLY A 522 24.846 -35.279 -14.676 1.00 64.34 N ATOM 205 CA GLY A 522 24.979 -36.447 -13.812 1.00 62.77 C ATOM 206 C GLY A 522 24.230 -36.416 -12.496 1.00 63.34 C ATOM 207 O GLY A 522 23.619 -35.403 -12.142 1.00 64.33 O ATOM 208 H GLY A 522 24.226 -34.500 -14.375 1.00 0.00 H ATOM 209 N LYS A 523 24.270 -37.548 -11.762 1.00 55.09 N ATOM 210 CA LYS A 523 23.618 -37.707 -10.455 1.00 52.80 C ATOM 211 C LYS A 523 24.673 -37.931 -9.360 1.00 52.33 C ATOM 212 O LYS A 523 25.803 -38.276 -9.687 1.00 53.26 O ATOM 213 CB LYS A 523 22.585 -38.847 -10.482 1.00 54.68 C ATOM 214 H LYS A 523 24.796 -38.359 -12.146 1.00 0.00 H ATOM 215 N VAL A 524 24.327 -37.704 -8.080 1.00 44.78 N ATOM 216 CA VAL A 524 25.264 -37.892 -6.965 1.00 43.72 C ATOM 217 C VAL A 524 24.608 -38.762 -5.929 1.00 47.30 C ATOM 218 O VAL A 524 23.552 -38.415 -5.371 1.00 46.56 O ATOM 219 CB VAL A 524 25.861 -36.574 -6.355 1.00 46.85 C ATOM 220 CG1 VAL A 524 26.774 -36.875 -5.164 1.00 45.97 C ATOM 221 CG2 VAL A 524 26.613 -35.757 -7.405 1.00 46.46 C ATOM 222 H VAL A 524 23.360 -37.383 -7.872 1.00 0.00 H ATOM 223 N PHE A 525 25.244 -39.903 -5.664 1.00 43.21 N ATOM 224 CA PHE A 525 24.724 -40.855 -4.700 1.00 42.63 C ATOM 225 C PHE A 525 25.629 -41.006 -3.496 1.00 43.21 C ATOM 226 O PHE A 525 26.845 -40.871 -3.611 1.00 43.28 O ATOM 227 CB PHE A 525 24.602 -42.245 -5.370 1.00 44.37 C ATOM 228 CG PHE A 525 23.723 -42.333 -6.597 1.00 45.63 C ATOM 229 CD1 PHE A 525 22.378 -42.667 -6.487 1.00 47.63 C ATOM 230 CD2 PHE A 525 24.250 -42.123 -7.865 1.00 47.52 C ATOM 231 CE1 PHE A 525 21.573 -42.757 -7.619 1.00 48.00 C ATOM 232 CE2 PHE A 525 23.443 -42.222 -8.997 1.00 49.75 C ATOM 233 CZ PHE A 525 22.109 -42.533 -8.865 1.00 47.23 C ATOM 234 H PHE A 525 26.133 -40.116 -6.159 1.00 0.00 H ATOM 235 N LEU A 526 25.033 -41.310 -2.347 1.00 37.90 N ATOM 236 CA LEU A 526 25.775 -41.661 -1.157 1.00 38.39 C ATOM 237 C LEU A 526 25.991 -43.158 -1.420 1.00 41.32 C ATOM 238 O LEU A 526 25.069 -43.845 -1.881 1.00 38.85 O ATOM 239 CB LEU A 526 24.977 -41.465 0.140 1.00 38.63 C ATOM 240 CG LEU A 526 25.665 -41.944 1.423 1.00 44.80 C ATOM 241 CD1 LEU A 526 26.885 -41.074 1.791 1.00 45.25 C ATOM 242 CD2 LEU A 526 24.703 -41.989 2.569 1.00 47.77 C ATOM 243 H LEU A 526 23.994 -41.295 -2.303 1.00 0.00 H ATOM 244 N ALA A 527 27.207 -43.640 -1.207 1.00 38.85 N ATOM 245 CA ALA A 527 27.502 -45.042 -1.449 1.00 38.94 C ATOM 246 C ALA A 527 28.455 -45.580 -0.441 1.00 44.15 C ATOM 247 O ALA A 527 29.031 -44.834 0.337 1.00 42.11 O ATOM 248 CB ALA A 527 28.074 -45.225 -2.851 1.00 39.19 C ATOM 249 H ALA A 527 27.958 -43.008 -0.863 1.00 0.00 H ATOM 250 N GLU A 528 28.616 -46.892 -0.461 1.00 44.66 N ATOM 251 CA GLU A 528 29.580 -47.594 0.354 1.00 46.40 C ATOM 252 C GLU A 528 30.559 -48.204 -0.634 1.00 51.89 C ATOM 253 O GLU A 528 30.144 -48.755 -1.655 1.00 51.33 O ATOM 254 CB GLU A 528 28.921 -48.646 1.251 1.00 48.26 C ATOM 255 CG GLU A 528 28.564 -48.070 2.612 1.00 61.53 C ATOM 256 CD GLU A 528 28.104 -49.054 3.667 1.00 89.74 C ATOM 257 OE1 GLU A 528 28.009 -48.643 4.846 1.00 87.51 O ATOM 258 OE2 GLU A 528 27.834 -50.229 3.322 1.00 88.02 O ATOM 259 H GLU A 528 28.014 -47.450 -1.100 1.00 0.00 H ATOM 260 N CYS A 529 31.849 -48.040 -0.371 1.00 51.19 N ATOM 261 CA CYS A 529 32.898 -48.568 -1.232 1.00 52.30 C ATOM 262 C CYS A 529 33.765 -49.548 -0.460 1.00 59.44 C ATOM 263 O CYS A 529 34.249 -49.230 0.630 1.00 58.52 O ATOM 264 CB CYS A 529 33.723 -47.449 -1.860 1.00 52.43 C ATOM 265 SG CYS A 529 34.553 -47.922 -3.398 1.00 56.06 S ATOM 266 H CYS A 529 32.122 -47.514 0.484 1.00 0.00 H ATOM 267 N HIS A 530 33.929 -50.748 -1.020 1.00 59.93 N ATOM 268 CA HIS A 530 34.716 -51.835 -0.433 1.00 61.80 C ATOM 269 C HIS A 530 36.092 -51.895 -1.085 1.00 67.51 C ATOM 270 O HIS A 530 36.216 -51.598 -2.275 1.00 66.82 O ATOM 271 CB HIS A 530 33.991 -53.184 -0.607 1.00 63.49 C ATOM 272 CG HIS A 530 32.592 -53.197 -0.070 1.00 67.62 C ATOM 273 ND1 HIS A 530 31.504 -52.937 -0.886 1.00 69.75 N ATOM 274 CD2 HIS A 530 32.149 -53.436 1.187 1.00 69.78 C ATOM 275 CE1 HIS A 530 30.441 -53.020 -0.103 1.00 69.31 C ATOM 276 NE2 HIS A 530 30.780 -53.319 1.153 1.00 69.66 N ATOM 277 H HIS A 530 33.467 -50.923 -1.935 1.00 0.00 H ATOM 278 N ASN A 531 37.121 -52.283 -0.298 1.00 66.01 N ATOM 279 CA ASN A 531 38.533 -52.419 -0.702 1.00 66.31 C ATOM 280 C ASN A 531 39.076 -51.096 -1.273 1.00 71.38 C ATOM 281 O ASN A 531 39.437 -51.012 -2.453 1.00 71.26 O ATOM 282 CB ASN A 531 38.746 -53.617 -1.656 1.00 66.76 C ATOM 283 CG ASN A 531 37.992 -54.889 -1.304 1.00 86.90 C ATOM 284 OD1 ASN A 531 37.579 -55.130 -0.155 1.00 73.33 O ATOM 285 ND2 ASN A 531 37.796 -55.737 -2.304 1.00 80.98 N ATOM 286 HD22 ASN A 531 38.152 -55.511 -3.255 1.00 0.00 H ATOM 287 HD21 ASN A 531 37.287 -56.628 -2.138 1.00 0.00 H ATOM 288 H ASN A 531 36.894 -52.508 0.692 1.00 0.00 H ATOM 289 N LEU A 532 39.094 -50.054 -0.413 1.00 67.98 N ATOM 290 CA LEU A 532 39.538 -48.700 -0.742 1.00 82.85 C ATOM 291 C LEU A 532 40.529 -48.197 0.303 1.00110.02 C ATOM 292 O LEU A 532 41.673 -47.902 -0.032 1.00 74.78 O ATOM 293 CB LEU A 532 38.309 -47.769 -0.798 1.00 82.59 C ATOM 294 CG LEU A 532 38.393 -46.524 -1.675 1.00 86.63 C ATOM 295 CD1 LEU A 532 38.183 -46.869 -3.146 1.00 86.43 C ATOM 296 CD2 LEU A 532 37.355 -45.506 -1.251 1.00 88.31 C ATOM 297 H LEU A 532 38.767 -50.228 0.559 1.00 0.00 H TER 298 LEU A 532 ATOM 299 N ASP A 537 37.921 -51.507 3.333 1.00 80.28 N ATOM 300 CA ASP A 537 36.982 -52.588 3.637 1.00 79.88 C ATOM 301 C ASP A 537 35.520 -52.164 3.470 1.00 80.42 C ATOM 302 O ASP A 537 34.774 -52.838 2.764 1.00 80.20 O ATOM 303 CB ASP A 537 37.246 -53.185 5.038 1.00 82.24 C ATOM 304 CG ASP A 537 37.340 -52.165 6.157 1.00 95.92 C ATOM 305 OD1 ASP A 537 38.253 -51.307 6.105 1.00 96.92 O ATOM 306 OD2 ASP A 537 36.505 -52.226 7.088 1.00102.66 O ATOM 307 HN3 ASP A 537 37.745 -50.707 3.973 1.00 0.00 H ATOM 308 HN2 ASP A 537 37.788 -51.200 2.348 1.00 0.00 H ATOM 309 HN1 ASP A 537 38.895 -51.849 3.462 1.00 0.00 H ATOM 310 N LYS A 538 35.117 -51.055 4.124 1.00 74.16 N ATOM 311 CA LYS A 538 33.768 -50.473 4.082 1.00 72.23 C ATOM 312 C LYS A 538 33.930 -48.971 4.330 1.00 71.19 C ATOM 313 O LYS A 538 34.293 -48.550 5.436 1.00 70.37 O ATOM 314 CB LYS A 538 32.847 -51.117 5.138 1.00 74.75 C ATOM 315 CG LYS A 538 31.373 -51.122 4.756 1.00 87.72 C ATOM 316 CD LYS A 538 30.486 -51.280 5.987 1.00 96.72 C ATOM 317 CE LYS A 538 29.199 -52.008 5.693 1.00105.64 C ATOM 318 NZ LYS A 538 28.197 -51.816 6.774 1.00114.50 N ATOM 319 HZ1 LYS A 538 28.581 -52.179 7.670 1.00 0.00 H ATOM 320 HZ2 LYS A 538 27.985 -50.803 6.872 1.00 0.00 H ATOM 321 HZ3 LYS A 538 27.327 -52.332 6.534 1.00 0.00 H ATOM 322 H LYS A 538 35.824 -50.568 4.711 1.00 0.00 H ATOM 323 N MET A 539 33.705 -48.166 3.286 1.00 63.74 N ATOM 324 CA MET A 539 33.870 -46.722 3.397 1.00 60.90 C ATOM 325 C MET A 539 32.715 -45.948 2.807 1.00 54.67 C ATOM 326 O MET A 539 32.260 -46.248 1.706 1.00 52.30 O ATOM 327 CB MET A 539 35.178 -46.290 2.711 1.00 63.82 C ATOM 328 CG MET A 539 36.054 -45.431 3.581 1.00 68.37 C ATOM 329 SD MET A 539 37.350 -44.591 2.638 1.00 73.45 S ATOM 330 CE MET A 539 36.480 -43.161 2.137 1.00 70.08 C ATOM 331 H MET A 539 33.407 -48.578 2.379 1.00 0.00 H ATOM 332 N LEU A 540 32.269 -44.921 3.527 1.00 45.79 N ATOM 333 CA LEU A 540 31.200 -44.053 3.058 1.00 43.41 C ATOM 334 C LEU A 540 31.810 -43.092 2.008 1.00 43.08 C ATOM 335 O LEU A 540 32.800 -42.415 2.297 1.00 41.93 O ATOM 336 CB LEU A 540 30.603 -43.292 4.248 1.00 43.16 C ATOM 337 CG LEU A 540 29.117 -43.009 4.194 1.00 47.26 C ATOM 338 CD1 LEU A 540 28.309 -44.288 4.019 1.00 46.75 C ATOM 339 CD2 LEU A 540 28.669 -42.228 5.419 1.00 48.11 C ATOM 340 H LEU A 540 32.699 -44.733 4.455 1.00 0.00 H ATOM 341 N VAL A 541 31.256 -43.088 0.778 1.00 36.45 N ATOM 342 CA VAL A 541 31.740 -42.260 -0.341 1.00 35.05 C ATOM 343 C VAL A 541 30.586 -41.569 -1.088 1.00 37.36 C ATOM 344 O VAL A 541 29.429 -41.926 -0.907 1.00 36.47 O ATOM 345 CB VAL A 541 32.597 -43.084 -1.370 1.00 37.79 C ATOM 346 CG1 VAL A 541 33.883 -43.641 -0.763 1.00 37.40 C ATOM 347 CG2 VAL A 541 31.778 -44.173 -2.062 1.00 37.08 C ATOM 348 H VAL A 541 30.437 -43.707 0.609 1.00 0.00 H ATOM 349 N ALA A 542 30.928 -40.634 -1.979 1.00 33.55 N ATOM 350 CA ALA A 542 29.979 -39.957 -2.839 1.00 34.13 C ATOM 351 C ALA A 542 30.365 -40.383 -4.243 1.00 40.17 C ATOM 352 O ALA A 542 31.544 -40.391 -4.582 1.00 41.57 O ATOM 353 CB ALA A 542 30.075 -38.453 -2.681 1.00 34.79 C ATOM 354 H ALA A 542 31.933 -40.378 -2.060 1.00 0.00 H ATOM 355 N VAL A 543 29.379 -40.793 -5.038 1.00 37.40 N ATOM 356 CA VAL A 543 29.602 -41.280 -6.393 1.00 37.35 C ATOM 357 C VAL A 543 28.859 -40.429 -7.401 1.00 42.96 C ATOM 358 O VAL A 543 27.643 -40.285 -7.322 1.00 42.03 O ATOM 359 CB VAL A 543 29.214 -42.798 -6.512 1.00 40.13 C ATOM 360 CG1 VAL A 543 29.325 -43.297 -7.953 1.00 39.98 C ATOM 361 CG2 VAL A 543 30.050 -43.661 -5.572 1.00 39.02 C ATOM 362 H VAL A 543 28.405 -40.764 -4.675 1.00 0.00 H ATOM 363 N LYS A 544 29.589 -39.901 -8.367 1.00 42.99 N ATOM 364 CA LYS A 544 29.008 -39.108 -9.431 1.00 44.41 C ATOM 365 C LYS A 544 28.833 -40.029 -10.659 1.00 50.48 C ATOM 366 O LYS A 544 29.805 -40.616 -11.134 1.00 50.26 O ATOM 367 CB LYS A 544 29.896 -37.877 -9.731 1.00 47.15 C ATOM 368 CG LYS A 544 29.285 -36.875 -10.721 1.00 57.50 C ATOM 369 CD LYS A 544 29.889 -35.460 -10.617 1.00 68.47 C ATOM 370 CE LYS A 544 31.377 -35.391 -10.893 1.00 82.10 C ATOM 371 NZ LYS A 544 31.847 -34.005 -11.139 1.00 93.94 N ATOM 372 HZ1 LYS A 544 31.350 -33.613 -11.964 1.00 0.00 H ATOM 373 HZ2 LYS A 544 31.649 -33.419 -10.303 1.00 0.00 H ATOM 374 HZ3 LYS A 544 32.871 -34.015 -11.322 1.00 0.00 H ATOM 375 H LYS A 544 30.617 -40.060 -8.364 1.00 0.00 H ATOM 376 N ALA A 545 27.585 -40.171 -11.137 1.00 47.96 N ATOM 377 CA ALA A 545 27.236 -41.005 -12.289 1.00 47.40 C ATOM 378 C ALA A 545 26.968 -40.137 -13.525 1.00 51.31 C ATOM 379 O ALA A 545 26.059 -39.306 -13.504 1.00 51.38 O ATOM 380 CB ALA A 545 26.004 -41.844 -11.966 1.00 47.78 C ATOM 381 H ALA A 545 26.819 -39.656 -10.658 1.00 0.00 H ATOM 382 N LEU A 546 27.740 -40.335 -14.598 1.00 47.97 N ATOM 383 CA LEU A 546 27.555 -39.574 -15.838 1.00 79.13 C ATOM 384 C LEU A 546 26.371 -40.110 -16.653 1.00104.69 C ATOM 385 O LEU A 546 26.325 -41.294 -16.991 1.00 69.68 O ATOM 386 CB LEU A 546 28.846 -39.566 -16.677 1.00 79.28 C ATOM 387 CG LEU A 546 28.995 -38.416 -17.676 1.00 84.18 C ATOM 388 CD1 LEU A 546 29.424 -37.125 -16.979 1.00 84.54 C ATOM 389 CD2 LEU A 546 29.989 -38.771 -18.766 1.00 86.32 C ATOM 390 H LEU A 546 28.494 -41.050 -14.552 1.00 0.00 H TER 391 LEU A 546 ATOM 392 N ASP A 556 35.217 -34.865 -22.089 1.00 81.76 N ATOM 393 CA ASP A 556 36.055 -36.007 -21.742 1.00 81.60 C ATOM 394 C ASP A 556 35.946 -36.326 -20.261 1.00 85.19 C ATOM 395 O ASP A 556 36.017 -35.430 -19.410 1.00 85.46 O ATOM 396 CB ASP A 556 37.530 -35.773 -22.134 1.00 83.82 C ATOM 397 CG ASP A 556 38.362 -37.032 -22.387 1.00 95.95 C ATOM 398 OD1 ASP A 556 39.218 -37.005 -23.301 1.00 96.46 O ATOM 399 OD2 ASP A 556 38.160 -38.040 -21.669 1.00102.34 O ATOM 400 HN3 ASP A 556 35.522 -34.034 -21.543 1.00 0.00 H ATOM 401 HN2 ASP A 556 34.225 -35.083 -21.865 1.00 0.00 H ATOM 402 HN1 ASP A 556 35.308 -34.666 -23.106 1.00 0.00 H ATOM 403 N PHE A 557 35.767 -37.618 -19.967 1.00 80.08 N ATOM 404 CA PHE A 557 35.643 -38.164 -18.622 1.00 78.93 C ATOM 405 C PHE A 557 37.045 -38.453 -18.083 1.00 82.13 C ATOM 406 O PHE A 557 37.331 -38.129 -16.929 1.00 81.34 O ATOM 407 CB PHE A 557 34.791 -39.447 -18.680 1.00 80.23 C ATOM 408 CG PHE A 557 34.523 -40.148 -17.372 1.00 80.87 C ATOM 409 CD1 PHE A 557 33.449 -39.777 -16.574 1.00 83.27 C ATOM 410 CD2 PHE A 557 35.321 -41.205 -16.957 1.00 82.35 C ATOM 411 CE1 PHE A 557 33.194 -40.435 -15.371 1.00 83.79 C ATOM 412 CE2 PHE A 557 35.063 -41.865 -15.756 1.00 84.78 C ATOM 413 CZ PHE A 557 34.002 -41.476 -14.972 1.00 82.61 C ATOM 414 H PHE A 557 35.712 -38.286 -20.762 1.00 0.00 H ATOM 415 N GLN A 558 37.913 -39.053 -18.932 1.00 78.56 N ATOM 416 CA GLN A 558 39.296 -39.413 -18.612 1.00 78.39 C ATOM 417 C GLN A 558 40.141 -38.199 -18.231 1.00 81.80 C ATOM 418 O GLN A 558 40.988 -38.322 -17.349 1.00 81.30 O ATOM 419 CB GLN A 558 39.955 -40.184 -19.772 1.00 79.75 C ATOM 420 CG GLN A 558 40.318 -41.635 -19.442 1.00 97.41 C ATOM 421 CD GLN A 558 41.520 -41.787 -18.532 1.00116.55 C ATOM 422 OE1 GLN A 558 42.628 -41.316 -18.824 1.00111.22 O ATOM 423 NE2 GLN A 558 41.328 -42.463 -17.408 1.00108.12 N ATOM 424 HE22 GLN A 558 40.388 -42.848 -17.187 1.00 0.00 H ATOM 425 HE21 GLN A 558 42.118 -42.608 -16.747 1.00 0.00 H ATOM 426 H GLN A 558 37.570 -39.276 -19.888 1.00 0.00 H ATOM 427 N ARG A 559 39.907 -37.035 -18.883 1.00 77.60 N ATOM 428 CA ARG A 559 40.644 -35.795 -18.618 1.00 76.50 C ATOM 429 C ARG A 559 40.272 -35.185 -17.257 1.00 76.43 C ATOM 430 O ARG A 559 41.164 -34.752 -16.525 1.00 75.97 O ATOM 431 CB ARG A 559 40.481 -34.789 -19.777 1.00 77.84 C ATOM 432 CG ARG A 559 41.577 -33.719 -19.832 1.00 89.68 C ATOM 433 CD ARG A 559 41.883 -33.285 -21.253 1.00102.45 C ATOM 434 NE ARG A 559 43.107 -33.908 -21.765 1.00114.37 N ATOM 435 CZ ARG A 559 43.479 -33.906 -23.043 1.00130.89 C ATOM 436 NH1 ARG A 559 42.722 -33.317 -23.961 1.00118.93 N ATOM 437 NH2 ARG A 559 44.609 -34.495 -23.412 1.00117.86 N ATOM 438 HE ARG A 559 43.729 -34.385 -21.081 1.00 0.00 H ATOM 439 HH12 ARG A 559 43.018 -33.319 -24.958 1.00 0.00 H ATOM 440 HH11 ARG A 559 41.833 -32.854 -23.683 1.00 0.00 H ATOM 441 HH22 ARG A 559 44.895 -34.491 -24.412 1.00 0.00 H ATOM 442 HH21 ARG A 559 45.209 -34.961 -22.701 1.00 0.00 H ATOM 443 H ARG A 559 39.164 -37.020 -19.611 1.00 0.00 H ATOM 444 N GLU A 560 38.969 -35.168 -16.915 1.00 69.94 N ATOM 445 CA GLU A 560 38.472 -34.638 -15.639 1.00 68.66 C ATOM 446 C GLU A 560 38.918 -35.539 -14.467 1.00 70.10 C ATOM 447 O GLU A 560 39.189 -35.042 -13.366 1.00 69.74 O ATOM 448 CB GLU A 560 36.944 -34.520 -15.666 1.00 69.92 C ATOM 449 CG GLU A 560 36.388 -33.606 -14.588 1.00 78.68 C ATOM 450 CD GLU A 560 35.065 -34.052 -14.003 1.00 95.92 C ATOM 451 OE1 GLU A 560 34.045 -34.038 -14.730 1.00 86.79 O ATOM 452 OE2 GLU A 560 35.050 -34.412 -12.805 1.00 91.16 O ATOM 453 H GLU A 560 38.278 -35.551 -17.591 1.00 0.00 H ATOM 454 N ALA A 561 38.990 -36.863 -14.718 1.00 63.44 N ATOM 455 CA ALA A 561 39.412 -37.853 -13.742 1.00 61.39 C ATOM 456 C ALA A 561 40.907 -37.710 -13.519 1.00 62.22 C ATOM 457 O ALA A 561 41.344 -37.840 -12.384 1.00 61.64 O ATOM 458 CB ALA A 561 39.083 -39.251 -14.231 1.00 61.90 C ATOM 459 H ALA A 561 38.727 -37.195 -15.668 1.00 0.00 H ATOM 460 N GLU A 562 41.681 -37.414 -14.593 1.00 57.17 N ATOM 461 CA GLU A 562 43.144 -37.212 -14.575 1.00 56.27 C ATOM 462 C GLU A 562 43.517 -36.021 -13.702 1.00 57.67 C ATOM 463 O GLU A 562 44.480 -36.094 -12.942 1.00 56.97 O ATOM 464 CB GLU A 562 43.673 -36.963 -15.995 1.00 57.70 C ATOM 465 CG GLU A 562 44.061 -38.213 -16.757 1.00 70.73 C ATOM 466 CD GLU A 562 44.395 -37.924 -18.206 1.00 96.90 C ATOM 467 OE1 GLU A 562 43.458 -37.891 -19.036 1.00 84.60 O ATOM 468 OE2 GLU A 562 45.593 -37.718 -18.510 1.00 96.83 O ATOM 469 H GLU A 562 41.201 -37.321 -15.511 1.00 0.00 H ATOM 470 N LEU A 563 42.737 -34.926 -13.827 1.00 53.03 N ATOM 471 CA LEU A 563 42.865 -33.666 -13.102 1.00 51.86 C ATOM 472 C LEU A 563 42.648 -33.898 -11.622 1.00 52.40 C ATOM 473 O LEU A 563 43.461 -33.463 -10.813 1.00 52.30 O ATOM 474 CB LEU A 563 41.786 -32.700 -13.625 1.00 52.09 C ATOM 475 CG LEU A 563 42.223 -31.364 -14.188 1.00 56.79 C ATOM 476 CD1 LEU A 563 43.354 -31.514 -15.201 1.00 57.22 C ATOM 477 CD2 LEU A 563 41.041 -30.667 -14.831 1.00 59.08 C ATOM 478 H LEU A 563 41.960 -34.987 -14.515 1.00 0.00 H ATOM 479 N LEU A 564 41.551 -34.583 -11.268 1.00 47.26 N ATOM 480 CA LEU A 564 41.200 -34.892 -9.884 1.00 46.61 C ATOM 481 C LEU A 564 42.214 -35.820 -9.225 1.00 48.87 C ATOM 482 O LEU A 564 42.434 -35.715 -8.020 1.00 49.06 O ATOM 483 CB LEU A 564 39.770 -35.448 -9.784 1.00 46.74 C ATOM 484 CG LEU A 564 38.649 -34.405 -9.821 1.00 51.71 C ATOM 485 CD1 LEU A 564 37.363 -35.010 -10.351 1.00 51.93 C ATOM 486 CD2 LEU A 564 38.429 -33.757 -8.441 1.00 53.25 C ATOM 487 H LEU A 564 40.914 -34.913 -12.021 1.00 0.00 H ATOM 488 N THR A 565 42.855 -36.701 -10.018 1.00 44.53 N ATOM 489 CA THR A 565 43.882 -37.633 -9.548 1.00 44.08 C ATOM 490 C THR A 565 45.157 -36.855 -9.230 1.00 48.79 C ATOM 491 O THR A 565 45.769 -37.072 -8.187 1.00 48.00 O ATOM 492 CB THR A 565 44.131 -38.726 -10.606 1.00 47.22 C ATOM 493 OG1 THR A 565 42.895 -39.369 -10.891 1.00 41.87 O ATOM 494 CG2 THR A 565 45.189 -39.768 -10.169 1.00 44.96 C ATOM 495 HG1 THR A 565 42.250 -38.703 -11.238 1.00 0.00 H ATOM 496 H THR A 565 42.605 -36.720 -11.027 1.00 0.00 H ATOM 497 N MET A 566 45.547 -35.952 -10.141 1.00 47.22 N ATOM 498 CA MET A 566 46.740 -35.113 -10.058 1.00 47.95 C ATOM 499 C MET A 566 46.701 -34.142 -8.870 1.00 48.03 C ATOM 500 O MET A 566 47.724 -33.924 -8.209 1.00 47.14 O ATOM 501 CB MET A 566 46.839 -34.336 -11.372 1.00 51.97 C ATOM 502 CG MET A 566 48.148 -33.627 -11.604 1.00 58.42 C ATOM 503 SD MET A 566 47.978 -32.611 -13.095 1.00 65.63 S ATOM 504 CE MET A 566 47.777 -33.920 -14.389 1.00 62.11 C ATOM 505 H MET A 566 44.946 -35.839 -10.982 1.00 0.00 H ATOM 506 N LEU A 567 45.530 -33.548 -8.612 1.00 42.45 N ATOM 507 CA LEU A 567 45.365 -32.571 -7.537 1.00 41.67 C ATOM 508 C LEU A 567 45.190 -33.264 -6.192 1.00 45.77 C ATOM 509 O LEU A 567 44.415 -34.210 -6.087 1.00 48.11 O ATOM 510 CB LEU A 567 44.231 -31.583 -7.856 1.00 41.15 C ATOM 511 CG LEU A 567 44.377 -30.810 -9.179 1.00 45.95 C ATOM 512 CD1 LEU A 567 43.110 -30.099 -9.540 1.00 46.25 C ATOM 513 CD2 LEU A 567 45.562 -29.850 -9.164 1.00 48.93 C ATOM 514 H LEU A 567 44.706 -33.791 -9.198 1.00 0.00 H ATOM 515 N GLN A 568 45.973 -32.841 -5.193 1.00 39.40 N ATOM 516 CA GLN A 568 45.988 -33.419 -3.859 1.00 38.67 C ATOM 517 C GLN A 568 46.285 -32.319 -2.864 1.00 39.09 C ATOM 518 O GLN A 568 47.423 -31.854 -2.756 1.00 38.40 O ATOM 519 CB GLN A 568 47.053 -34.539 -3.785 1.00 40.68 C ATOM 520 CG GLN A 568 46.902 -35.460 -2.576 1.00 70.19 C ATOM 521 CD GLN A 568 47.510 -36.824 -2.796 1.00 95.53 C ATOM 522 OE1 GLN A 568 47.410 -37.421 -3.880 1.00 91.76 O ATOM 523 NE2 GLN A 568 48.145 -37.350 -1.761 1.00 89.93 N ATOM 524 HE22 GLN A 568 48.210 -36.822 -0.867 1.00 0.00 H ATOM 525 HE21 GLN A 568 48.579 -38.292 -1.841 1.00 0.00 H ATOM 526 H GLN A 568 46.614 -32.045 -5.384 1.00 0.00 H ATOM 527 N HIS A 569 45.240 -31.877 -2.153 1.00 32.46 N ATOM 528 CA HIS A 569 45.366 -30.803 -1.177 1.00 30.27 C ATOM 529 C HIS A 569 44.221 -30.913 -0.192 1.00 33.20 C ATOM 530 O HIS A 569 43.187 -31.482 -0.537 1.00 33.45 O ATOM 531 CB HIS A 569 45.366 -29.435 -1.909 1.00 29.41 C ATOM 532 CG HIS A 569 45.650 -28.256 -1.037 1.00 31.62 C ATOM 533 ND1 HIS A 569 44.625 -27.469 -0.537 1.00 32.61 N ATOM 534 CD2 HIS A 569 46.838 -27.748 -0.623 1.00 33.18 C ATOM 535 CE1 HIS A 569 45.214 -26.524 0.183 1.00 32.27 C ATOM 536 NE2 HIS A 569 46.549 -26.638 0.141 1.00 32.80 N ATOM 537 H HIS A 569 44.308 -32.315 -2.302 1.00 0.00 H ATOM 538 N GLN A 570 44.399 -30.375 1.030 1.00 31.02 N ATOM 539 CA GLN A 570 43.377 -30.392 2.077 1.00 32.08 C ATOM 540 C GLN A 570 42.126 -29.611 1.688 1.00 35.17 C ATOM 541 O GLN A 570 41.067 -29.874 2.236 1.00 34.04 O ATOM 542 CB GLN A 570 43.925 -29.942 3.444 1.00 34.34 C ATOM 543 CG GLN A 570 44.597 -28.569 3.462 1.00 61.04 C ATOM 544 CD GLN A 570 45.852 -28.511 4.312 1.00 91.67 C ATOM 545 OE1 GLN A 570 45.976 -29.172 5.352 1.00 89.11 O ATOM 546 NE2 GLN A 570 46.817 -27.707 3.881 1.00 85.60 N ATOM 547 HE22 GLN A 570 46.688 -27.163 3.004 1.00 0.00 H ATOM 548 HE21 GLN A 570 47.702 -27.622 4.420 1.00 0.00 H ATOM 549 H GLN A 570 45.312 -29.923 1.241 1.00 0.00 H ATOM 550 N HIS A 571 42.228 -28.680 0.716 1.00 30.83 N ATOM 551 CA HIS A 571 41.047 -27.932 0.336 1.00 29.55 C ATOM 552 C HIS A 571 40.591 -28.214 -1.094 1.00 31.02 C ATOM 553 O HIS A 571 39.934 -27.373 -1.719 1.00 29.73 O ATOM 554 CB HIS A 571 41.220 -26.446 0.656 1.00 29.91 C ATOM 555 CG HIS A 571 41.309 -26.258 2.136 1.00 32.65 C ATOM 556 ND1 HIS A 571 40.200 -26.433 2.952 1.00 34.12 N ATOM 557 CD2 HIS A 571 42.392 -26.009 2.915 1.00 33.53 C ATOM 558 CE1 HIS A 571 40.638 -26.255 4.192 1.00 33.49 C ATOM 559 NE2 HIS A 571 41.948 -25.982 4.215 1.00 33.63 N ATOM 560 H HIS A 571 43.139 -28.503 0.248 1.00 0.00 H ATOM 561 N ILE A 572 40.887 -29.440 -1.581 1.00 26.69 N ATOM 562 CA ILE A 572 40.441 -29.970 -2.878 1.00 26.79 C ATOM 563 C ILE A 572 39.773 -31.288 -2.480 1.00 30.75 C ATOM 564 O ILE A 572 40.399 -32.046 -1.746 1.00 29.87 O ATOM 565 CB ILE A 572 41.586 -30.227 -3.925 1.00 29.95 C ATOM 566 CG1 ILE A 572 42.365 -28.921 -4.339 1.00 31.19 C ATOM 567 CG2 ILE A 572 41.059 -30.995 -5.179 1.00 30.16 C ATOM 568 CD1 ILE A 572 41.596 -27.742 -4.760 1.00 39.11 C ATOM 569 H ILE A 572 41.478 -30.059 -0.990 1.00 0.00 H ATOM 570 N VAL A 573 38.537 -31.570 -2.939 1.00 28.99 N ATOM 571 CA VAL A 573 37.832 -32.829 -2.604 1.00 29.33 C ATOM 572 C VAL A 573 38.694 -34.079 -2.916 1.00 34.67 C ATOM 573 O VAL A 573 39.250 -34.204 -4.016 1.00 32.25 O ATOM 574 CB VAL A 573 36.404 -32.925 -3.240 1.00 32.93 C ATOM 575 CG1 VAL A 573 36.468 -33.118 -4.756 1.00 33.75 C ATOM 576 CG2 VAL A 573 35.566 -34.036 -2.609 1.00 31.62 C ATOM 577 H VAL A 573 38.061 -30.877 -3.551 1.00 0.00 H ATOM 578 N ARG A 574 38.783 -35.011 -1.945 1.00 32.70 N ATOM 579 CA ARG A 574 39.539 -36.246 -2.148 1.00 32.37 C ATOM 580 C ARG A 574 38.851 -37.078 -3.216 1.00 34.32 C ATOM 581 O ARG A 574 37.641 -37.271 -3.173 1.00 32.17 O ATOM 582 CB ARG A 574 39.642 -37.053 -0.845 1.00 35.66 C ATOM 583 CG ARG A 574 40.812 -36.688 0.041 1.00 53.42 C ATOM 584 CD ARG A 574 41.308 -37.920 0.796 1.00 72.20 C ATOM 585 NE ARG A 574 40.410 -38.292 1.893 1.00 86.44 N ATOM 586 CZ ARG A 574 40.463 -39.440 2.562 1.00 99.44 C ATOM 587 NH1 ARG A 574 41.373 -40.358 2.253 1.00 85.18 N ATOM 588 NH2 ARG A 574 39.602 -39.683 3.543 1.00 84.06 N ATOM 589 HE ARG A 574 39.677 -37.607 2.169 1.00 0.00 H ATOM 590 HH12 ARG A 574 41.408 -41.253 2.781 1.00 0.00 H ATOM 591 HH11 ARG A 574 42.050 -40.181 1.483 1.00 0.00 H ATOM 592 HH22 ARG A 574 39.647 -40.582 4.064 1.00 0.00 H ATOM 593 HH21 ARG A 574 38.882 -38.974 3.791 1.00 0.00 H ATOM 594 H ARG A 574 38.305 -34.848 -1.036 1.00 0.00 H ATOM 595 N PHE A 575 39.626 -37.543 -4.186 1.00 33.17 N ATOM 596 CA PHE A 575 39.161 -38.365 -5.298 1.00 34.12 C ATOM 597 C PHE A 575 39.736 -39.789 -5.120 1.00 40.37 C ATOM 598 O PHE A 575 40.923 -39.929 -4.840 1.00 39.72 O ATOM 599 CB PHE A 575 39.610 -37.730 -6.629 1.00 35.66 C ATOM 600 CG PHE A 575 39.102 -38.420 -7.877 1.00 37.12 C ATOM 601 CD1 PHE A 575 37.755 -38.379 -8.216 1.00 39.77 C ATOM 602 CD2 PHE A 575 39.977 -39.088 -8.728 1.00 39.63 C ATOM 603 CE1 PHE A 575 37.290 -38.997 -9.387 1.00 40.86 C ATOM 604 CE2 PHE A 575 39.510 -39.712 -9.891 1.00 41.91 C ATOM 605 CZ PHE A 575 38.173 -39.658 -10.214 1.00 39.46 C ATOM 606 H PHE A 575 40.638 -37.305 -4.152 1.00 0.00 H ATOM 607 N PHE A 576 38.896 -40.833 -5.228 1.00 38.68 N ATOM 608 CA PHE A 576 39.382 -42.207 -5.040 1.00 38.57 C ATOM 609 C PHE A 576 39.593 -42.953 -6.361 1.00 44.83 C ATOM 610 O PHE A 576 40.414 -43.862 -6.415 1.00 44.36 O ATOM 611 CB PHE A 576 38.494 -43.000 -4.059 1.00 39.27 C ATOM 612 CG PHE A 576 38.485 -42.396 -2.677 1.00 40.00 C ATOM 613 CD1 PHE A 576 39.617 -42.446 -1.871 1.00 41.34 C ATOM 614 CD2 PHE A 576 37.350 -41.762 -2.184 1.00 40.74 C ATOM 615 CE1 PHE A 576 39.613 -41.873 -0.602 1.00 41.69 C ATOM 616 CE2 PHE A 576 37.348 -41.200 -0.908 1.00 42.65 C ATOM 617 CZ PHE A 576 38.480 -41.247 -0.131 1.00 40.04 C ATOM 618 H PHE A 576 37.893 -40.667 -5.447 1.00 0.00 H ATOM 619 N GLY A 577 38.881 -42.545 -7.405 1.00 43.84 N ATOM 620 CA GLY A 577 38.995 -43.150 -8.726 1.00 43.57 C ATOM 621 C GLY A 577 37.706 -43.233 -9.512 1.00 47.83 C ATOM 622 O GLY A 577 36.709 -42.600 -9.158 1.00 44.79 O ATOM 623 H GLY A 577 38.213 -41.759 -7.274 1.00 0.00 H ATOM 624 N VAL A 578 37.733 -44.017 -10.607 1.00 47.95 N ATOM 625 CA VAL A 578 36.593 -44.215 -11.509 1.00 49.61 C ATOM 626 C VAL A 578 36.183 -45.696 -11.678 1.00 58.07 C ATOM 627 O VAL A 578 36.895 -46.608 -11.260 1.00 56.92 O ATOM 628 CB VAL A 578 36.818 -43.551 -12.902 1.00 53.79 C ATOM 629 CG1 VAL A 578 37.064 -42.051 -12.786 1.00 53.54 C ATOM 630 CG2 VAL A 578 37.935 -44.244 -13.691 1.00 53.85 C ATOM 631 H VAL A 578 38.619 -44.514 -10.827 1.00 0.00 H ATOM 632 N CYS A 579 35.029 -45.906 -12.309 1.00 59.62 N ATOM 633 CA CYS A 579 34.489 -47.209 -12.652 1.00 62.10 C ATOM 634 C CYS A 579 34.049 -47.085 -14.094 1.00 68.42 C ATOM 635 O CYS A 579 33.085 -46.371 -14.390 1.00 67.21 O ATOM 636 CB CYS A 579 33.337 -47.621 -11.740 1.00 63.60 C ATOM 637 SG CYS A 579 32.607 -49.231 -12.162 1.00 68.14 S ATOM 638 H CYS A 579 34.471 -45.070 -12.577 1.00 0.00 H ATOM 639 N THR A 580 34.810 -47.732 -14.997 1.00 68.02 N ATOM 640 CA THR A 580 34.569 -47.740 -16.443 1.00 68.79 C ATOM 641 C THR A 580 34.037 -49.110 -16.911 1.00 75.86 C ATOM 642 O THR A 580 33.954 -49.363 -18.119 1.00 76.35 O ATOM 643 CB THR A 580 35.811 -47.253 -17.209 1.00 74.26 C ATOM 644 OG1 THR A 580 36.972 -47.893 -16.676 1.00 74.18 O ATOM 645 CG2 THR A 580 35.972 -45.735 -17.157 1.00 71.12 C ATOM 646 HG1 THR A 580 37.062 -47.665 -15.717 1.00 0.00 H ATOM 647 H THR A 580 35.629 -48.265 -14.642 1.00 0.00 H ATOM 648 N GLU A 581 33.655 -49.976 -15.942 1.00 73.68 N ATOM 649 CA GLU A 581 33.082 -51.307 -16.159 1.00 73.77 C ATOM 650 C GLU A 581 31.625 -51.158 -16.657 1.00 79.38 C ATOM 651 O GLU A 581 30.674 -51.305 -15.880 1.00 79.23 O ATOM 652 CB GLU A 581 33.106 -52.121 -14.850 1.00 75.09 C ATOM 653 CG GLU A 581 34.458 -52.700 -14.470 1.00 87.37 C ATOM 654 CD GLU A 581 34.446 -53.665 -13.297 1.00110.57 C ATOM 655 OE1 GLU A 581 33.345 -54.060 -12.850 1.00102.93 O ATOM 656 OE2 GLU A 581 35.547 -54.032 -12.828 1.00108.29 O ATOM 657 H GLU A 581 33.779 -49.669 -14.956 1.00 0.00 H ATOM 658 N GLY A 582 31.472 -50.845 -17.940 1.00 76.74 N ATOM 659 CA GLY A 582 30.163 -50.682 -18.564 1.00 76.77 C ATOM 660 C GLY A 582 29.565 -49.291 -18.503 1.00 80.86 C ATOM 661 O GLY A 582 30.228 -48.308 -18.851 1.00 81.36 O ATOM 662 H GLY A 582 32.322 -50.711 -18.524 1.00 0.00 H ATOM 663 N ARG A 583 28.284 -49.209 -18.084 1.00 76.00 N ATOM 664 CA ARG A 583 27.524 -47.963 -17.996 1.00 75.05 C ATOM 665 C ARG A 583 26.585 -47.927 -16.775 1.00 78.15 C ATOM 666 O ARG A 583 25.996 -48.955 -16.440 1.00 78.29 O ATOM 667 CB ARG A 583 26.728 -47.738 -19.292 1.00 74.55 C ATOM 668 H ARG A 583 27.807 -50.090 -17.806 1.00 0.00 H ATOM 669 N PRO A 584 26.411 -46.766 -16.094 1.00 73.46 N ATOM 670 CA PRO A 584 27.027 -45.454 -16.363 1.00 72.18 C ATOM 671 C PRO A 584 28.446 -45.316 -15.820 1.00 71.76 C ATOM 672 O PRO A 584 28.859 -46.083 -14.946 1.00 70.52 O ATOM 673 CB PRO A 584 26.056 -44.483 -15.683 1.00 74.16 C ATOM 674 CG PRO A 584 25.566 -45.252 -14.487 1.00 79.08 C ATOM 675 CD PRO A 584 25.512 -46.702 -14.922 1.00 74.90 C ATOM 676 N LEU A 585 29.191 -44.325 -16.347 1.00 65.61 N ATOM 677 CA LEU A 585 30.556 -44.033 -15.902 1.00 63.50 C ATOM 678 C LEU A 585 30.436 -43.440 -14.494 1.00 61.31 C ATOM 679 O LEU A 585 29.561 -42.600 -14.256 1.00 60.32 O ATOM 680 CB LEU A 585 31.241 -43.031 -16.849 1.00 63.74 C ATOM 681 CG LEU A 585 31.444 -43.456 -18.306 1.00 68.55 C ATOM 682 CD1 LEU A 585 31.597 -42.240 -19.194 1.00 68.58 C ATOM 683 CD2 LEU A 585 32.649 -44.390 -18.460 1.00 70.30 C ATOM 684 H LEU A 585 28.779 -43.742 -17.103 1.00 0.00 H ATOM 685 N LEU A 586 31.263 -43.919 -13.557 1.00 54.05 N ATOM 686 CA LEU A 586 31.219 -43.458 -12.173 1.00 51.89 C ATOM 687 C LEU A 586 32.488 -42.755 -11.748 1.00 52.00 C ATOM 688 O LEU A 586 33.566 -43.105 -12.212 1.00 50.75 O ATOM 689 CB LEU A 586 30.941 -44.631 -11.201 1.00 51.66 C ATOM 690 CG LEU A 586 29.700 -45.514 -11.442 1.00 55.45 C ATOM 691 CD1 LEU A 586 29.589 -46.576 -10.361 1.00 55.27 C ATOM 692 CD2 LEU A 586 28.409 -44.695 -11.502 1.00 55.86 C ATOM 693 H LEU A 586 31.960 -44.643 -13.824 1.00 0.00 H ATOM 694 N MET A 587 32.354 -41.773 -10.847 1.00 47.54 N ATOM 695 CA MET A 587 33.473 -41.034 -10.267 1.00 46.87 C ATOM 696 C MET A 587 33.297 -41.148 -8.756 1.00 45.45 C ATOM 697 O MET A 587 32.214 -40.860 -8.245 1.00 45.21 O ATOM 698 CB MET A 587 33.510 -39.579 -10.758 1.00 50.22 C ATOM 699 CG MET A 587 34.342 -39.406 -12.009 1.00 55.71 C ATOM 700 SD MET A 587 34.635 -37.686 -12.526 1.00 61.69 S ATOM 701 CE MET A 587 33.127 -37.340 -13.387 1.00 58.30 C ATOM 702 H MET A 587 31.393 -41.521 -10.541 1.00 0.00 H ATOM 703 N VAL A 588 34.334 -41.604 -8.046 1.00 38.72 N ATOM 704 CA VAL A 588 34.259 -41.819 -6.597 1.00 37.52 C ATOM 705 C VAL A 588 35.032 -40.750 -5.818 1.00 39.05 C ATOM 706 O VAL A 588 36.221 -40.561 -6.044 1.00 38.91 O ATOM 707 CB VAL A 588 34.683 -43.274 -6.216 1.00 40.43 C ATOM 708 CG1 VAL A 588 34.503 -43.537 -4.722 1.00 39.57 C ATOM 709 CG2 VAL A 588 33.895 -44.302 -7.034 1.00 40.11 C ATOM 710 H VAL A 588 35.226 -41.814 -8.539 1.00 0.00 H ATOM 711 N PHE A 589 34.344 -40.078 -4.879 1.00 33.89 N ATOM 712 CA PHE A 589 34.928 -39.019 -4.048 1.00 33.23 C ATOM 713 C PHE A 589 34.641 -39.282 -2.602 1.00 34.87 C ATOM 714 O PHE A 589 33.794 -40.117 -2.284 1.00 34.80 O ATOM 715 CB PHE A 589 34.248 -37.666 -4.359 1.00 35.05 C ATOM 716 CG PHE A 589 34.275 -37.188 -5.780 1.00 37.20 C ATOM 717 CD1 PHE A 589 33.281 -37.569 -6.679 1.00 41.04 C ATOM 718 CD2 PHE A 589 35.271 -36.326 -6.218 1.00 40.63 C ATOM 719 CE1 PHE A 589 33.304 -37.122 -8.002 1.00 42.30 C ATOM 720 CE2 PHE A 589 35.292 -35.875 -7.541 1.00 44.09 C ATOM 721 CZ PHE A 589 34.313 -36.285 -8.428 1.00 42.24 C ATOM 722 H PHE A 589 33.344 -40.322 -4.734 1.00 0.00 H ATOM 723 N GLU A 590 35.290 -38.520 -1.719 1.00 30.08 N ATOM 724 CA GLU A 590 34.991 -38.582 -0.304 1.00 30.17 C ATOM 725 C GLU A 590 33.601 -37.905 -0.188 1.00 35.96 C ATOM 726 O GLU A 590 33.250 -37.035 -1.013 1.00 35.48 O ATOM 727 CB GLU A 590 36.036 -37.821 0.532 1.00 31.33 C ATOM 728 CG GLU A 590 36.002 -36.308 0.353 1.00 36.30 C ATOM 729 CD GLU A 590 36.962 -35.522 1.208 1.00 40.25 C ATOM 730 OE1 GLU A 590 36.996 -35.754 2.435 1.00 38.20 O ATOM 731 OE2 GLU A 590 37.685 -34.668 0.650 1.00 40.20 O ATOM 732 H GLU A 590 36.027 -37.867 -2.055 1.00 0.00 H ATOM 733 N TYR A 591 32.820 -38.323 0.803 1.00 31.67 N ATOM 734 CA TYR A 591 31.496 -37.787 1.044 1.00 30.87 C ATOM 735 C TYR A 591 31.594 -36.452 1.838 1.00 33.73 C ATOM 736 O TYR A 591 32.232 -36.397 2.889 1.00 33.37 O ATOM 737 CB TYR A 591 30.642 -38.863 1.744 1.00 32.04 C ATOM 738 CG TYR A 591 29.334 -38.385 2.334 1.00 34.46 C ATOM 739 CD1 TYR A 591 28.371 -37.770 1.541 1.00 36.42 C ATOM 740 CD2 TYR A 591 29.033 -38.606 3.677 1.00 35.07 C ATOM 741 CE1 TYR A 591 27.158 -37.341 2.081 1.00 38.77 C ATOM 742 CE2 TYR A 591 27.819 -38.193 4.222 1.00 35.95 C ATOM 743 CZ TYR A 591 26.884 -37.562 3.420 1.00 40.32 C ATOM 744 OH TYR A 591 25.696 -37.144 3.952 1.00 40.95 O ATOM 745 HH TYR A 591 25.151 -36.717 3.244 1.00 0.00 H ATOM 746 H TYR A 591 33.176 -39.069 1.434 1.00 0.00 H ATOM 747 N MET A 592 30.974 -35.381 1.315 1.00 28.86 N ATOM 748 CA MET A 592 30.987 -34.055 1.965 1.00 28.29 C ATOM 749 C MET A 592 29.535 -33.830 2.409 1.00 33.15 C ATOM 750 O MET A 592 28.690 -33.431 1.615 1.00 32.83 O ATOM 751 CB MET A 592 31.474 -32.958 0.988 1.00 29.90 C ATOM 752 CG MET A 592 32.918 -33.156 0.483 1.00 32.75 C ATOM 753 SD MET A 592 34.183 -33.093 1.772 1.00 35.78 S ATOM 754 CE MET A 592 34.323 -31.360 2.053 1.00 32.21 C ATOM 755 H MET A 592 30.464 -35.490 0.415 1.00 0.00 H ATOM 756 N ARG A 593 29.271 -34.159 3.668 1.00 32.18 N ATOM 757 CA ARG A 593 27.993 -34.196 4.373 1.00 33.44 C ATOM 758 C ARG A 593 27.062 -32.999 4.175 1.00 39.83 C ATOM 759 O ARG A 593 25.864 -33.203 3.965 1.00 39.30 O ATOM 760 CB ARG A 593 28.244 -34.402 5.868 1.00 35.25 C ATOM 761 CG ARG A 593 27.317 -35.424 6.492 1.00 57.94 C ATOM 762 CD ARG A 593 26.534 -34.847 7.650 1.00 76.74 C ATOM 763 NE ARG A 593 25.192 -35.428 7.712 1.00 92.37 N ATOM 764 CZ ARG A 593 24.070 -34.772 7.430 1.00110.38 C ATOM 765 NH1 ARG A 593 22.898 -35.389 7.508 1.00 98.41 N ATOM 766 NH2 ARG A 593 24.109 -33.493 7.076 1.00 98.87 N ATOM 767 HE ARG A 593 25.110 -36.425 7.997 1.00 0.00 H ATOM 768 HH12 ARG A 593 22.023 -34.873 7.287 1.00 0.00 H ATOM 769 HH11 ARG A 593 22.855 -36.389 7.790 1.00 0.00 H ATOM 770 HH22 ARG A 593 23.227 -32.987 6.857 1.00 0.00 H ATOM 771 HH21 ARG A 593 25.021 -32.997 7.018 1.00 0.00 H ATOM 772 H ARG A 593 30.098 -34.431 4.237 1.00 0.00 H ATOM 773 N HIS A 594 27.596 -31.769 4.239 1.00 37.11 N ATOM 774 CA HIS A 594 26.751 -30.583 4.129 1.00 38.48 C ATOM 775 C HIS A 594 26.524 -30.080 2.701 1.00 40.75 C ATOM 776 O HIS A 594 25.933 -29.018 2.558 1.00 41.54 O ATOM 777 CB HIS A 594 27.255 -29.465 5.058 1.00 40.28 C ATOM 778 CG HIS A 594 27.189 -29.850 6.502 1.00 44.84 C ATOM 779 ND1 HIS A 594 28.294 -29.774 7.318 1.00 47.76 N ATOM 780 CD2 HIS A 594 26.155 -30.351 7.216 1.00 47.41 C ATOM 781 CE1 HIS A 594 27.897 -30.210 8.506 1.00 47.47 C ATOM 782 NE2 HIS A 594 26.618 -30.572 8.487 1.00 47.63 N ATOM 783 H HIS A 594 28.622 -31.660 4.368 1.00 0.00 H ATOM 784 N GLY A 595 26.927 -30.858 1.683 1.00 34.80 N ATOM 785 CA GLY A 595 26.697 -30.562 0.266 1.00 34.00 C ATOM 786 C GLY A 595 27.392 -29.357 -0.368 1.00 35.59 C ATOM 787 O GLY A 595 28.455 -28.939 0.089 1.00 33.67 O ATOM 788 H GLY A 595 27.439 -31.733 1.917 1.00 0.00 H ATOM 789 N ASP A 596 26.803 -28.799 -1.451 1.00 31.13 N ATOM 790 CA ASP A 596 27.423 -27.658 -2.137 1.00 30.88 C ATOM 791 C ASP A 596 27.390 -26.382 -1.278 1.00 31.08 C ATOM 792 O ASP A 596 26.418 -26.128 -0.556 1.00 29.39 O ATOM 793 CB ASP A 596 26.872 -27.435 -3.556 1.00 32.93 C ATOM 794 CG ASP A 596 25.605 -26.614 -3.648 1.00 42.43 C ATOM 795 OD1 ASP A 596 25.707 -25.367 -3.739 1.00 40.77 O ATOM 796 OD2 ASP A 596 24.513 -27.214 -3.636 1.00 52.79 O ATOM 797 H ASP A 596 25.902 -29.182 -1.801 1.00 0.00 H ATOM 798 N LEU A 597 28.487 -25.605 -1.341 1.00 25.80 N ATOM 799 CA LEU A 597 28.638 -24.375 -0.575 1.00 23.14 C ATOM 800 C LEU A 597 27.546 -23.314 -0.884 1.00 25.48 C ATOM 801 O LEU A 597 27.133 -22.618 0.030 1.00 25.61 O ATOM 802 CB LEU A 597 30.075 -23.799 -0.719 1.00 22.43 C ATOM 803 CG LEU A 597 30.388 -22.465 0.023 1.00 24.92 C ATOM 804 CD1 LEU A 597 30.292 -22.622 1.557 1.00 23.70 C ATOM 805 CD2 LEU A 597 31.769 -21.901 -0.378 1.00 23.26 C ATOM 806 H LEU A 597 29.265 -25.897 -1.967 1.00 0.00 H ATOM 807 N ASN A 598 27.061 -23.201 -2.119 1.00 23.36 N ATOM 808 CA ASN A 598 26.025 -22.196 -2.373 1.00 24.12 C ATOM 809 C ASN A 598 24.747 -22.443 -1.564 1.00 29.21 C ATOM 810 O ASN A 598 24.258 -21.514 -0.912 1.00 28.63 O ATOM 811 CB ASN A 598 25.703 -22.046 -3.852 1.00 23.37 C ATOM 812 CG ASN A 598 24.791 -20.871 -4.097 1.00 33.41 C ATOM 813 OD1 ASN A 598 23.593 -21.008 -4.236 1.00 30.74 O ATOM 814 ND2 ASN A 598 25.342 -19.688 -4.132 1.00 31.33 N ATOM 815 HD22 ASN A 598 26.370 -19.589 -4.011 1.00 0.00 H ATOM 816 HD21 ASN A 598 24.753 -18.844 -4.281 1.00 0.00 H ATOM 817 H ASN A 598 27.409 -23.812 -2.885 1.00 0.00 H ATOM 818 N ARG A 599 24.232 -23.697 -1.590 1.00 26.31 N ATOM 819 CA ARG A 599 23.038 -24.106 -0.843 1.00 26.80 C ATOM 820 C ARG A 599 23.320 -24.011 0.638 1.00 27.60 C ATOM 821 O ARG A 599 22.459 -23.563 1.389 1.00 27.58 O ATOM 822 CB ARG A 599 22.592 -25.531 -1.242 1.00 32.31 C ATOM 823 CG ARG A 599 21.224 -25.935 -0.678 1.00 46.78 C ATOM 824 CD ARG A 599 21.266 -27.357 -0.153 1.00 62.93 C ATOM 825 NE ARG A 599 19.929 -27.901 0.089 1.00 77.54 N ATOM 826 CZ ARG A 599 19.303 -27.878 1.262 1.00 93.52 C ATOM 827 NH1 ARG A 599 19.887 -27.334 2.325 1.00 79.59 N ATOM 828 NH2 ARG A 599 18.089 -28.399 1.383 1.00 80.04 N ATOM 829 HE ARG A 599 19.433 -28.337 -0.714 1.00 0.00 H ATOM 830 HH12 ARG A 599 19.392 -27.319 3.240 1.00 0.00 H ATOM 831 HH11 ARG A 599 20.839 -26.923 2.242 1.00 0.00 H ATOM 832 HH22 ARG A 599 17.604 -28.379 2.303 1.00 0.00 H ATOM 833 HH21 ARG A 599 17.623 -28.828 0.558 1.00 0.00 H ATOM 834 H ARG A 599 24.712 -24.411 -2.174 1.00 0.00 H ATOM 835 N PHE A 600 24.540 -24.395 1.068 1.00 24.59 N ATOM 836 CA PHE A 600 24.917 -24.267 2.474 1.00 25.06 C ATOM 837 C PHE A 600 24.821 -22.789 2.933 1.00 31.32 C ATOM 838 O PHE A 600 24.300 -22.531 4.011 1.00 29.74 O ATOM 839 CB PHE A 600 26.341 -24.813 2.726 1.00 26.58 C ATOM 840 CG PHE A 600 26.732 -24.781 4.187 1.00 27.94 C ATOM 841 CD1 PHE A 600 26.369 -25.819 5.045 1.00 29.13 C ATOM 842 CD2 PHE A 600 27.467 -23.714 4.707 1.00 29.43 C ATOM 843 CE1 PHE A 600 26.732 -25.791 6.396 1.00 29.45 C ATOM 844 CE2 PHE A 600 27.817 -23.675 6.065 1.00 31.87 C ATOM 845 CZ PHE A 600 27.452 -24.718 6.898 1.00 29.83 C ATOM 846 H PHE A 600 25.222 -24.788 0.389 1.00 0.00 H ATOM 847 N LEU A 601 25.331 -21.822 2.123 1.00 27.82 N ATOM 848 CA LEU A 601 25.277 -20.398 2.505 1.00 25.85 C ATOM 849 C LEU A 601 23.827 -19.864 2.632 1.00 30.37 C ATOM 850 O LEU A 601 23.492 -19.174 3.608 1.00 28.94 O ATOM 851 CB LEU A 601 26.078 -19.534 1.505 1.00 24.14 C ATOM 852 CG LEU A 601 27.611 -19.667 1.535 1.00 24.76 C ATOM 853 CD1 LEU A 601 28.211 -19.107 0.268 1.00 22.64 C ATOM 854 CD2 LEU A 601 28.208 -19.000 2.803 1.00 24.95 C ATOM 855 H LEU A 601 25.767 -22.092 1.218 1.00 0.00 H ATOM 856 N ARG A 602 22.990 -20.201 1.635 1.00 27.99 N ATOM 857 CA ARG A 602 21.586 -19.809 1.523 1.00 28.56 C ATOM 858 C ARG A 602 20.730 -20.363 2.647 1.00 35.52 C ATOM 859 O ARG A 602 19.850 -19.652 3.146 1.00 36.99 O ATOM 860 CB ARG A 602 21.015 -20.266 0.194 1.00 26.66 C ATOM 861 CG ARG A 602 21.601 -19.559 -1.021 1.00 30.40 C ATOM 862 CD ARG A 602 20.830 -20.026 -2.228 1.00 26.66 C ATOM 863 NE ARG A 602 21.259 -19.416 -3.484 1.00 32.85 N ATOM 864 CZ ARG A 602 20.730 -18.302 -3.983 1.00 44.89 C ATOM 865 NH1 ARG A 602 19.777 -17.656 -3.321 1.00 33.15 N ATOM 866 NH2 ARG A 602 21.154 -17.823 -5.143 1.00 30.86 N ATOM 867 HE ARG A 602 22.021 -19.879 -4.019 1.00 0.00 H ATOM 868 HH12 ARG A 602 19.368 -16.786 -3.717 1.00 0.00 H ATOM 869 HH11 ARG A 602 19.440 -18.020 -2.407 1.00 0.00 H ATOM 870 HH22 ARG A 602 20.738 -16.952 -5.529 1.00 0.00 H ATOM 871 HH21 ARG A 602 21.903 -18.318 -5.667 1.00 0.00 H ATOM 872 H ARG A 602 23.377 -20.795 0.874 1.00 0.00 H ATOM 873 N SER A 603 20.973 -21.630 3.044 1.00 31.26 N ATOM 874 CA SER A 603 20.198 -22.280 4.106 1.00 30.61 C ATOM 875 C SER A 603 20.698 -21.931 5.506 1.00 37.31 C ATOM 876 O SER A 603 20.039 -22.270 6.492 1.00 35.99 O ATOM 877 CB SER A 603 20.124 -23.788 3.885 1.00 30.98 C ATOM 878 OG SER A 603 21.420 -24.356 3.907 1.00 33.91 O ATOM 879 HG SER A 603 21.969 -23.952 3.189 1.00 0.00 H ATOM 880 H SER A 603 21.736 -22.164 2.581 1.00 0.00 H ATOM 881 N HIS A 604 21.850 -21.240 5.597 1.00 35.34 N ATOM 882 CA HIS A 604 22.415 -20.805 6.872 1.00 35.85 C ATOM 883 C HIS A 604 22.590 -19.268 6.870 1.00 41.75 C ATOM 884 O HIS A 604 23.533 -18.740 7.439 1.00 42.59 O ATOM 885 CB HIS A 604 23.710 -21.571 7.199 1.00 36.95 C ATOM 886 CG HIS A 604 23.536 -23.055 7.311 1.00 40.49 C ATOM 887 ND1 HIS A 604 23.444 -23.679 8.542 1.00 42.93 N ATOM 888 CD2 HIS A 604 23.453 -23.996 6.340 1.00 42.95 C ATOM 889 CE1 HIS A 604 23.313 -24.972 8.283 1.00 42.55 C ATOM 890 NE2 HIS A 604 23.303 -25.209 6.969 1.00 43.06 N ATOM 891 H HIS A 604 22.360 -21.006 4.721 1.00 0.00 H ATOM 892 N GLY A 605 21.653 -18.580 6.234 1.00 40.72 N ATOM 893 CA GLY A 605 21.619 -17.128 6.108 1.00 42.37 C ATOM 894 C GLY A 605 20.691 -16.441 7.098 1.00 49.90 C ATOM 895 O GLY A 605 20.233 -17.084 8.043 1.00 47.79 O ATOM 896 H GLY A 605 20.882 -19.118 5.790 1.00 0.00 H ATOM 897 N PRO A 606 20.375 -15.134 6.923 1.00 52.40 N ATOM 898 CA PRO A 606 19.484 -14.452 7.888 1.00 54.82 C ATOM 899 C PRO A 606 18.115 -15.111 8.096 1.00 64.12 C ATOM 900 O PRO A 606 17.551 -14.982 9.185 1.00 64.26 O ATOM 901 CB PRO A 606 19.369 -13.028 7.334 1.00 56.63 C ATOM 902 CG PRO A 606 20.558 -12.861 6.448 1.00 60.28 C ATOM 903 CD PRO A 606 20.803 -14.212 5.852 1.00 55.06 C ATOM 904 N ASP A 607 17.607 -15.841 7.077 1.00 64.34 N ATOM 905 CA ASP A 607 16.327 -16.564 7.121 1.00 65.80 C ATOM 906 C ASP A 607 16.531 -18.099 7.281 1.00 72.25 C ATOM 907 O ASP A 607 15.831 -18.898 6.659 1.00 71.88 O ATOM 908 CB ASP A 607 15.454 -16.212 5.900 1.00 67.92 C ATOM 909 CG ASP A 607 16.139 -16.440 4.564 1.00 82.59 C ATOM 910 OD1 ASP A 607 16.829 -15.513 4.085 1.00 84.80 O ATOM 911 OD2 ASP A 607 15.984 -17.543 3.999 1.00 89.05 O ATOM 912 H ASP A 607 18.162 -15.895 6.199 1.00 0.00 H ATOM 913 N ALA A 608 17.489 -18.501 8.131 1.00 70.94 N ATOM 914 CA ALA A 608 17.801 -19.911 8.394 1.00 71.54 C ATOM 915 C ALA A 608 16.886 -20.539 9.442 1.00 78.95 C ATOM 916 O ALA A 608 16.575 -21.719 9.320 1.00 78.69 O ATOM 917 CB ALA A 608 19.247 -20.060 8.832 1.00 71.98 C ATOM 918 H ALA A 608 18.040 -17.774 8.630 1.00 0.00 H ATOM 919 N LYS A 609 16.479 -19.772 10.478 1.00 77.57 N ATOM 920 CA LYS A 609 15.630 -20.259 11.569 1.00 78.21 C ATOM 921 C LYS A 609 14.207 -20.604 11.132 1.00 83.61 C ATOM 922 O LYS A 609 13.806 -21.765 11.242 1.00 82.96 O ATOM 923 CB LYS A 609 15.629 -19.275 12.751 1.00 80.98 C ATOM 924 H LYS A 609 16.786 -18.779 10.502 1.00 0.00 H ATOM 925 N LEU A 610 13.460 -19.605 10.620 1.00 81.74 N ATOM 926 CA LEU A 610 12.067 -19.725 10.169 1.00 82.39 C ATOM 927 C LEU A 610 11.840 -20.714 9.011 1.00 87.86 C ATOM 928 O LEU A 610 10.693 -21.072 8.720 1.00 87.94 O ATOM 929 CB LEU A 610 11.534 -18.333 9.791 1.00 82.48 C ATOM 930 H LEU A 610 13.908 -18.670 10.537 1.00 0.00 H ATOM 931 N LEU A 611 12.925 -21.156 8.365 1.00 85.01 N ATOM 932 CA LEU A 611 12.889 -22.051 7.215 1.00 85.03 C ATOM 933 C LEU A 611 13.513 -23.434 7.460 1.00 89.11 C ATOM 934 O LEU A 611 13.212 -24.375 6.717 1.00 88.65 O ATOM 935 CB LEU A 611 13.579 -21.350 6.037 1.00 85.14 C ATOM 936 CG LEU A 611 12.779 -20.300 5.255 1.00 90.25 C ATOM 937 CD1 LEU A 611 12.654 -18.968 6.000 1.00 90.39 C ATOM 938 CD2 LEU A 611 13.433 -20.024 3.955 1.00 93.29 C ATOM 939 H LEU A 611 13.855 -20.840 8.706 1.00 0.00 H ATOM 940 N ALA A 612 14.380 -23.561 8.488 1.00 85.75 N ATOM 941 CA ALA A 612 15.044 -24.824 8.818 1.00 85.69 C ATOM 942 C ALA A 612 14.098 -25.829 9.455 1.00 90.49 C ATOM 943 O ALA A 612 12.999 -25.469 9.898 1.00 90.14 O ATOM 944 CB ALA A 612 16.224 -24.580 9.741 1.00 86.42 C ATOM 945 H ALA A 612 14.585 -22.725 9.071 1.00 0.00 H ATOM 946 N GLY A 613 14.545 -27.082 9.491 1.00 87.02 N ATOM 947 CA GLY A 613 13.796 -28.179 10.080 1.00 86.88 C ATOM 948 C GLY A 613 13.895 -28.198 11.590 1.00 90.62 C ATOM 949 O GLY A 613 14.729 -27.499 12.181 1.00 89.97 O ATOM 950 H GLY A 613 15.477 -27.286 9.077 1.00 0.00 H ATOM 951 N GLY A 614 13.036 -29.007 12.198 1.00 86.85 N ATOM 952 CA GLY A 614 12.968 -29.171 13.641 1.00 86.43 C ATOM 953 C GLY A 614 14.212 -29.765 14.277 1.00 89.45 C ATOM 954 O GLY A 614 14.564 -29.384 15.394 1.00 89.32 O ATOM 955 H GLY A 614 12.375 -29.554 11.610 1.00 0.00 H ATOM 956 N GLU A 615 14.881 -30.701 13.579 1.00 84.79 N ATOM 957 CA GLU A 615 16.099 -31.373 14.055 1.00 84.13 C ATOM 958 C GLU A 615 17.391 -30.557 13.843 1.00 85.67 C ATOM 959 O GLU A 615 18.407 -30.857 14.473 1.00 84.90 O ATOM 960 CB GLU A 615 16.237 -32.754 13.391 1.00 85.60 C ATOM 961 H GLU A 615 14.513 -30.966 12.643 1.00 0.00 H ATOM 962 N ASP A 616 17.352 -29.541 12.960 1.00 80.43 N ATOM 963 CA ASP A 616 18.491 -28.682 12.611 1.00 79.35 C ATOM 964 C ASP A 616 19.147 -27.982 13.813 1.00 79.66 C ATOM 965 O ASP A 616 18.516 -27.181 14.506 1.00 79.22 O ATOM 966 CB ASP A 616 18.096 -27.664 11.519 1.00 81.47 C ATOM 967 CG ASP A 616 17.676 -28.282 10.187 1.00 92.57 C ATOM 968 OD1 ASP A 616 17.487 -29.523 10.132 1.00 92.72 O ATOM 969 OD2 ASP A 616 17.534 -27.526 9.202 1.00 99.34 O ATOM 970 H ASP A 616 16.445 -29.350 12.489 1.00 0.00 H ATOM 971 N VAL A 617 20.428 -28.304 14.043 1.00 73.49 N ATOM 972 CA VAL A 617 21.254 -27.759 15.121 1.00 72.19 C ATOM 973 C VAL A 617 21.490 -26.257 14.908 1.00 74.06 C ATOM 974 O VAL A 617 21.895 -25.838 13.819 1.00 73.54 O ATOM 975 CB VAL A 617 22.563 -28.578 15.312 1.00 75.71 C ATOM 976 CG1 VAL A 617 23.534 -27.883 16.258 1.00 75.18 C ATOM 977 CG2 VAL A 617 22.252 -29.985 15.812 1.00 75.46 C ATOM 978 H VAL A 617 20.870 -28.996 13.405 1.00 0.00 H ATOM 979 N ALA A 618 21.211 -25.466 15.968 1.00 69.52 N ATOM 980 CA ALA A 618 21.317 -24.005 16.050 1.00 68.86 C ATOM 981 C ALA A 618 21.031 -23.291 14.704 1.00 70.77 C ATOM 982 O ALA A 618 21.962 -22.816 14.040 1.00 69.89 O ATOM 983 CB ALA A 618 22.659 -23.579 16.646 1.00 69.58 C ATOM 984 H ALA A 618 20.882 -25.951 16.827 1.00 0.00 H ATOM 985 N PRO A 619 19.742 -23.260 14.262 1.00 65.77 N ATOM 986 CA PRO A 619 19.427 -22.570 13.004 1.00 64.65 C ATOM 987 C PRO A 619 19.583 -21.065 13.216 1.00 64.93 C ATOM 988 O PRO A 619 19.216 -20.520 14.264 1.00 64.54 O ATOM 989 CB PRO A 619 17.981 -22.986 12.713 1.00 66.47 C ATOM 990 CG PRO A 619 17.397 -23.297 14.030 1.00 70.89 C ATOM 991 CD PRO A 619 18.518 -23.768 14.917 1.00 66.76 C ATOM 992 N GLY A 620 20.172 -20.425 12.229 1.00 58.77 N ATOM 993 CA GLY A 620 20.447 -18.999 12.262 1.00 57.21 C ATOM 994 C GLY A 620 21.558 -18.672 11.292 1.00 56.52 C ATOM 995 O GLY A 620 22.128 -19.582 10.674 1.00 55.54 O ATOM 996 H GLY A 620 20.454 -20.965 11.386 1.00 0.00 H ATOM 997 N PRO A 621 21.875 -17.378 11.097 1.00 48.76 N ATOM 998 CA PRO A 621 22.918 -17.052 10.129 1.00 46.05 C ATOM 999 C PRO A 621 24.299 -17.439 10.594 1.00 44.56 C ATOM 1000 O PRO A 621 24.567 -17.498 11.800 1.00 44.03 O ATOM 1001 CB PRO A 621 22.784 -15.542 9.944 1.00 48.23 C ATOM 1002 CG PRO A 621 22.172 -15.056 11.201 1.00 53.73 C ATOM 1003 CD PRO A 621 21.295 -16.163 11.711 1.00 49.62 C ATOM 1004 N LEU A 622 25.182 -17.714 9.623 1.00 36.64 N ATOM 1005 CA LEU A 622 26.573 -17.996 9.923 1.00 34.33 C ATOM 1006 C LEU A 622 27.118 -16.649 10.422 1.00 36.43 C ATOM 1007 O LEU A 622 26.737 -15.592 9.884 1.00 36.42 O ATOM 1008 CB LEU A 622 27.339 -18.405 8.652 1.00 33.13 C ATOM 1009 CG LEU A 622 26.979 -19.741 8.026 1.00 35.09 C ATOM 1010 CD1 LEU A 622 27.472 -19.813 6.575 1.00 35.46 C ATOM 1011 CD2 LEU A 622 27.518 -20.914 8.843 1.00 33.14 C ATOM 1012 H LEU A 622 24.863 -17.725 8.633 1.00 0.00 H ATOM 1013 N GLY A 623 27.950 -16.690 11.455 1.00 30.90 N ATOM 1014 CA GLY A 623 28.555 -15.477 11.987 1.00 30.54 C ATOM 1015 C GLY A 623 29.746 -15.066 11.137 1.00 33.81 C ATOM 1016 O GLY A 623 30.141 -15.802 10.227 1.00 32.23 O ATOM 1017 H GLY A 623 28.174 -17.606 11.893 1.00 0.00 H ATOM 1018 N LEU A 624 30.340 -13.895 11.436 1.00 30.94 N ATOM 1019 CA LEU A 624 31.496 -13.352 10.723 1.00 29.33 C ATOM 1020 C LEU A 624 32.680 -14.306 10.748 1.00 32.08 C ATOM 1021 O LEU A 624 33.306 -14.523 9.712 1.00 31.49 O ATOM 1022 CB LEU A 624 31.846 -11.945 11.234 1.00 29.24 C ATOM 1023 CG LEU A 624 33.144 -11.295 10.715 1.00 33.90 C ATOM 1024 CD1 LEU A 624 33.123 -11.153 9.166 1.00 33.34 C ATOM 1025 CD2 LEU A 624 33.369 -9.924 11.375 1.00 36.42 C ATOM 1026 H LEU A 624 29.951 -13.341 12.225 1.00 0.00 H ATOM 1027 N GLY A 625 32.933 -14.925 11.900 1.00 29.86 N ATOM 1028 CA GLY A 625 34.011 -15.892 12.069 1.00 28.09 C ATOM 1029 C GLY A 625 33.908 -17.078 11.134 1.00 30.01 C ATOM 1030 O GLY A 625 34.905 -17.494 10.540 1.00 27.80 O ATOM 1031 H GLY A 625 32.331 -14.708 12.720 1.00 0.00 H ATOM 1032 N GLN A 626 32.693 -17.642 10.999 1.00 27.36 N ATOM 1033 CA GLN A 626 32.432 -18.789 10.117 1.00 25.52 C ATOM 1034 C GLN A 626 32.567 -18.385 8.641 1.00 28.94 C ATOM 1035 O GLN A 626 33.127 -19.152 7.873 1.00 27.52 O ATOM 1036 CB GLN A 626 31.032 -19.363 10.371 1.00 26.35 C ATOM 1037 CG GLN A 626 30.912 -20.098 11.722 1.00 27.95 C ATOM 1038 CD GLN A 626 29.471 -20.279 12.087 1.00 33.99 C ATOM 1039 OE1 GLN A 626 28.766 -19.310 12.333 1.00 34.72 O ATOM 1040 NE2 GLN A 626 29.000 -21.522 12.114 1.00 26.22 N ATOM 1041 HE22 GLN A 626 29.630 -22.321 11.899 1.00 0.00 H ATOM 1042 HE21 GLN A 626 28.002 -21.695 12.350 1.00 0.00 H ATOM 1043 H GLN A 626 31.901 -17.247 11.545 1.00 0.00 H ATOM 1044 N LEU A 627 32.064 -17.179 8.254 1.00 25.51 N ATOM 1045 CA LEU A 627 32.148 -16.672 6.867 1.00 25.07 C ATOM 1046 C LEU A 627 33.616 -16.490 6.447 1.00 30.14 C ATOM 1047 O LEU A 627 33.974 -16.876 5.348 1.00 29.60 O ATOM 1048 CB LEU A 627 31.379 -15.348 6.711 1.00 24.32 C ATOM 1049 CG LEU A 627 29.844 -15.416 6.868 1.00 26.90 C ATOM 1050 CD1 LEU A 627 29.224 -13.998 6.834 1.00 27.48 C ATOM 1051 CD2 LEU A 627 29.208 -16.336 5.793 1.00 24.28 C ATOM 1052 H LEU A 627 31.598 -16.586 8.970 1.00 0.00 H ATOM 1053 N LEU A 628 34.464 -15.959 7.353 1.00 27.87 N ATOM 1054 CA LEU A 628 35.909 -15.768 7.131 1.00 27.09 C ATOM 1055 C LEU A 628 36.618 -17.108 7.022 1.00 29.72 C ATOM 1056 O LEU A 628 37.496 -17.259 6.172 1.00 28.81 O ATOM 1057 CB LEU A 628 36.538 -14.893 8.246 1.00 26.59 C ATOM 1058 CG LEU A 628 36.172 -13.402 8.201 1.00 31.44 C ATOM 1059 CD1 LEU A 628 36.547 -12.694 9.515 1.00 32.69 C ATOM 1060 CD2 LEU A 628 36.837 -12.693 6.993 1.00 33.52 C ATOM 1061 H LEU A 628 34.071 -15.665 8.270 1.00 0.00 H ATOM 1062 N ALA A 629 36.220 -18.107 7.846 1.00 26.83 N ATOM 1063 CA ALA A 629 36.836 -19.445 7.786 1.00 26.41 C ATOM 1064 C ALA A 629 36.466 -20.130 6.467 1.00 29.55 C ATOM 1065 O ALA A 629 37.274 -20.879 5.928 1.00 28.85 O ATOM 1066 CB ALA A 629 36.376 -20.301 8.964 1.00 27.11 C ATOM 1067 H ALA A 629 35.463 -17.926 8.536 1.00 0.00 H ATOM 1068 N VAL A 630 35.227 -19.902 5.963 1.00 24.44 N ATOM 1069 CA VAL A 630 34.792 -20.471 4.690 1.00 23.02 C ATOM 1070 C VAL A 630 35.657 -19.831 3.565 1.00 25.61 C ATOM 1071 O VAL A 630 36.174 -20.543 2.705 1.00 24.18 O ATOM 1072 CB VAL A 630 33.270 -20.246 4.441 1.00 26.04 C ATOM 1073 CG1 VAL A 630 32.902 -20.494 2.969 1.00 24.64 C ATOM 1074 CG2 VAL A 630 32.413 -21.112 5.383 1.00 25.43 C ATOM 1075 H VAL A 630 34.567 -19.304 6.500 1.00 0.00 H ATOM 1076 N ALA A 631 35.796 -18.494 3.605 1.00 22.06 N ATOM 1077 CA ALA A 631 36.541 -17.711 2.619 1.00 22.69 C ATOM 1078 C ALA A 631 38.005 -18.078 2.588 1.00 28.29 C ATOM 1079 O ALA A 631 38.579 -18.257 1.520 1.00 27.22 O ATOM 1080 CB ALA A 631 36.348 -16.227 2.896 1.00 22.67 C ATOM 1081 H ALA A 631 35.344 -17.982 4.389 1.00 0.00 H ATOM 1082 N SER A 632 38.598 -18.245 3.772 1.00 27.26 N ATOM 1083 CA SER A 632 39.992 -18.616 3.905 1.00 26.98 C ATOM 1084 C SER A 632 40.291 -20.015 3.363 1.00 28.75 C ATOM 1085 O SER A 632 41.357 -20.208 2.796 1.00 29.44 O ATOM 1086 CB SER A 632 40.450 -18.454 5.351 1.00 30.98 C ATOM 1087 OG SER A 632 41.798 -18.872 5.470 1.00 46.04 O ATOM 1088 HG SER A 632 41.872 -19.823 5.205 1.00 0.00 H ATOM 1089 H SER A 632 38.036 -18.103 4.635 1.00 0.00 H ATOM 1090 N GLN A 633 39.367 -20.983 3.515 1.00 23.51 N ATOM 1091 CA GLN A 633 39.597 -22.349 3.015 1.00 23.89 C ATOM 1092 C GLN A 633 39.515 -22.434 1.479 1.00 27.41 C ATOM 1093 O GLN A 633 40.280 -23.188 0.881 1.00 27.89 O ATOM 1094 CB GLN A 633 38.616 -23.340 3.666 1.00 25.16 C ATOM 1095 CG GLN A 633 38.854 -23.501 5.186 1.00 26.17 C ATOM 1096 CD GLN A 633 37.785 -24.381 5.745 1.00 32.39 C ATOM 1097 OE1 GLN A 633 37.802 -25.604 5.587 1.00 27.42 O ATOM 1098 NE2 GLN A 633 36.805 -23.772 6.360 1.00 27.66 N ATOM 1099 HE22 GLN A 633 36.825 -22.739 6.474 1.00 0.00 H ATOM 1100 HE21 GLN A 633 36.005 -24.321 6.735 1.00 0.00 H ATOM 1101 H GLN A 633 38.472 -20.761 3.996 1.00 0.00 H ATOM 1102 N VAL A 634 38.589 -21.674 0.848 1.00 23.34 N ATOM 1103 CA VAL A 634 38.480 -21.644 -0.620 1.00 23.35 C ATOM 1104 C VAL A 634 39.781 -20.998 -1.149 1.00 26.63 C ATOM 1105 O VAL A 634 40.367 -21.537 -2.076 1.00 26.33 O ATOM 1106 CB VAL A 634 37.226 -20.871 -1.122 1.00 26.64 C ATOM 1107 CG1 VAL A 634 37.194 -20.830 -2.663 1.00 25.85 C ATOM 1108 CG2 VAL A 634 35.934 -21.472 -0.556 1.00 25.67 C ATOM 1109 H VAL A 634 37.937 -21.096 1.416 1.00 0.00 H ATOM 1110 N ALA A 635 40.251 -19.877 -0.518 1.00 24.63 N ATOM 1111 CA ALA A 635 41.506 -19.195 -0.903 1.00 25.25 C ATOM 1112 C ALA A 635 42.692 -20.143 -0.780 1.00 29.42 C ATOM 1113 O ALA A 635 43.506 -20.170 -1.702 1.00 28.76 O ATOM 1114 CB ALA A 635 41.730 -17.942 -0.072 1.00 25.69 C ATOM 1115 H ALA A 635 39.698 -19.486 0.271 1.00 0.00 H ATOM 1116 N ALA A 636 42.763 -20.973 0.313 1.00 26.45 N ATOM 1117 CA ALA A 636 43.849 -21.970 0.487 1.00 26.67 C ATOM 1118 C ALA A 636 43.902 -22.947 -0.689 1.00 29.16 C ATOM 1119 O ALA A 636 44.985 -23.290 -1.160 1.00 28.24 O ATOM 1120 CB ALA A 636 43.694 -22.741 1.810 1.00 27.26 C ATOM 1121 H ALA A 636 42.028 -20.900 1.046 1.00 0.00 H ATOM 1122 N GLY A 637 42.731 -23.375 -1.165 1.00 26.46 N ATOM 1123 CA GLY A 637 42.646 -24.273 -2.313 1.00 25.51 C ATOM 1124 C GLY A 637 43.131 -23.573 -3.576 1.00 30.10 C ATOM 1125 O GLY A 637 43.838 -24.163 -4.393 1.00 29.87 O ATOM 1126 H GLY A 637 41.853 -23.060 -0.705 1.00 0.00 H ATOM 1127 N MET A 638 42.768 -22.295 -3.732 1.00 27.39 N ATOM 1128 CA MET A 638 43.185 -21.497 -4.893 1.00 26.48 C ATOM 1129 C MET A 638 44.690 -21.218 -4.869 1.00 30.42 C ATOM 1130 O MET A 638 45.305 -21.201 -5.929 1.00 30.53 O ATOM 1131 CB MET A 638 42.346 -20.219 -5.027 1.00 27.75 C ATOM 1132 CG MET A 638 40.882 -20.496 -5.406 1.00 30.72 C ATOM 1133 SD MET A 638 40.622 -21.627 -6.812 1.00 34.29 S ATOM 1134 CE MET A 638 41.111 -20.597 -8.152 1.00 31.31 C ATOM 1135 H MET A 638 42.170 -21.851 -3.006 1.00 0.00 H ATOM 1136 N VAL A 639 45.289 -21.040 -3.661 1.00 27.77 N ATOM 1137 CA VAL A 639 46.739 -20.841 -3.483 1.00 27.55 C ATOM 1138 C VAL A 639 47.467 -22.072 -4.035 1.00 32.97 C ATOM 1139 O VAL A 639 48.467 -21.930 -4.745 1.00 34.36 O ATOM 1140 CB VAL A 639 47.133 -20.560 -1.996 1.00 31.06 C ATOM 1141 CG1 VAL A 639 48.652 -20.756 -1.760 1.00 30.80 C ATOM 1142 CG2 VAL A 639 46.697 -19.157 -1.574 1.00 29.55 C ATOM 1143 H VAL A 639 44.688 -21.045 -2.812 1.00 0.00 H ATOM 1144 N TYR A 640 46.943 -23.280 -3.721 1.00 28.58 N ATOM 1145 CA TYR A 640 47.501 -24.546 -4.166 1.00 27.85 C ATOM 1146 C TYR A 640 47.449 -24.638 -5.685 1.00 30.83 C ATOM 1147 O TYR A 640 48.471 -24.961 -6.303 1.00 28.39 O ATOM 1148 CB TYR A 640 46.772 -25.741 -3.505 1.00 28.78 C ATOM 1149 CG TYR A 640 47.127 -27.073 -4.121 1.00 30.42 C ATOM 1150 CD1 TYR A 640 48.368 -27.663 -3.890 1.00 31.76 C ATOM 1151 CD2 TYR A 640 46.229 -27.740 -4.953 1.00 30.84 C ATOM 1152 CE1 TYR A 640 48.712 -28.879 -4.482 1.00 31.21 C ATOM 1153 CE2 TYR A 640 46.558 -28.963 -5.537 1.00 31.51 C ATOM 1154 CZ TYR A 640 47.802 -29.528 -5.296 1.00 36.71 C ATOM 1155 OH TYR A 640 48.136 -30.734 -5.869 1.00 38.12 O ATOM 1156 HH TYR A 640 49.052 -30.987 -5.593 1.00 0.00 H ATOM 1157 H TYR A 640 46.090 -23.304 -3.126 1.00 0.00 H ATOM 1158 N LEU A 641 46.271 -24.341 -6.286 1.00 27.72 N ATOM 1159 CA LEU A 641 46.130 -24.373 -7.751 1.00 28.64 C ATOM 1160 C LEU A 641 47.104 -23.385 -8.476 1.00 34.22 C ATOM 1161 O LEU A 641 47.736 -23.774 -9.463 1.00 34.65 O ATOM 1162 CB LEU A 641 44.667 -24.155 -8.206 1.00 28.20 C ATOM 1163 CG LEU A 641 43.607 -25.199 -7.776 1.00 32.47 C ATOM 1164 CD1 LEU A 641 42.216 -24.768 -8.209 1.00 32.07 C ATOM 1165 CD2 LEU A 641 43.898 -26.591 -8.337 1.00 35.28 C ATOM 1166 H LEU A 641 45.450 -24.085 -5.700 1.00 0.00 H ATOM 1167 N ALA A 642 47.230 -22.135 -7.986 1.00 31.24 N ATOM 1168 CA ALA A 642 48.132 -21.144 -8.596 1.00 32.08 C ATOM 1169 C ALA A 642 49.631 -21.550 -8.508 1.00 38.85 C ATOM 1170 O ALA A 642 50.417 -21.175 -9.379 1.00 39.61 O ATOM 1171 CB ALA A 642 47.921 -19.775 -7.971 1.00 32.39 C ATOM 1172 H ALA A 642 46.673 -21.863 -7.151 1.00 0.00 H ATOM 1173 N GLY A 643 49.993 -22.314 -7.478 1.00 34.70 N ATOM 1174 CA GLY A 643 51.352 -22.804 -7.275 1.00 35.29 C ATOM 1175 C GLY A 643 51.744 -23.846 -8.311 1.00 40.53 C ATOM 1176 O GLY A 643 52.924 -24.015 -8.602 1.00 40.03 O ATOM 1177 H GLY A 643 49.267 -22.575 -6.781 1.00 0.00 H ATOM 1178 N LEU A 644 50.742 -24.546 -8.874 1.00 38.05 N ATOM 1179 CA LEU A 644 50.886 -25.563 -9.909 1.00 37.24 C ATOM 1180 C LEU A 644 50.672 -24.959 -11.284 1.00 40.32 C ATOM 1181 O LEU A 644 50.701 -25.698 -12.275 1.00 40.09 O ATOM 1182 CB LEU A 644 49.841 -26.679 -9.682 1.00 37.43 C ATOM 1183 CG LEU A 644 50.021 -27.583 -8.442 1.00 42.84 C ATOM 1184 CD1 LEU A 644 49.020 -28.687 -8.466 1.00 43.07 C ATOM 1185 CD2 LEU A 644 51.439 -28.211 -8.388 1.00 45.55 C ATOM 1186 H LEU A 644 49.778 -24.343 -8.541 1.00 0.00 H ATOM 1187 N HIS A 645 50.415 -23.626 -11.353 1.00 36.73 N ATOM 1188 CA HIS A 645 50.129 -22.874 -12.592 1.00 37.96 C ATOM 1189 C HIS A 645 48.883 -23.469 -13.259 1.00 38.10 C ATOM 1190 O HIS A 645 48.789 -23.574 -14.486 1.00 37.36 O ATOM 1191 CB HIS A 645 51.336 -22.822 -13.564 1.00 40.65 C ATOM 1192 CG HIS A 645 52.564 -22.250 -12.945 1.00 45.77 C ATOM 1193 ND1 HIS A 645 52.850 -20.899 -13.027 1.00 48.95 N ATOM 1194 CD2 HIS A 645 53.538 -22.864 -12.239 1.00 49.13 C ATOM 1195 CE1 HIS A 645 53.987 -20.731 -12.371 1.00 48.95 C ATOM 1196 NE2 HIS A 645 54.439 -21.886 -11.877 1.00 49.57 N ATOM 1197 H HIS A 645 50.420 -23.092 -10.461 1.00 0.00 H ATOM 1198 N PHE A 646 47.932 -23.874 -12.414 1.00 31.54 N ATOM 1199 CA PHE A 646 46.670 -24.450 -12.825 1.00 31.45 C ATOM 1200 C PHE A 646 45.616 -23.348 -12.736 1.00 31.99 C ATOM 1201 O PHE A 646 45.527 -22.658 -11.726 1.00 30.42 O ATOM 1202 CB PHE A 646 46.325 -25.637 -11.902 1.00 34.56 C ATOM 1203 CG PHE A 646 45.101 -26.410 -12.297 1.00 38.16 C ATOM 1204 CD1 PHE A 646 45.213 -27.628 -12.962 1.00 43.07 C ATOM 1205 CD2 PHE A 646 43.828 -25.934 -11.994 1.00 41.19 C ATOM 1206 CE1 PHE A 646 44.072 -28.350 -13.322 1.00 44.48 C ATOM 1207 CE2 PHE A 646 42.687 -26.650 -12.367 1.00 44.69 C ATOM 1208 CZ PHE A 646 42.817 -27.857 -13.021 1.00 43.41 C ATOM 1209 H PHE A 646 48.110 -23.769 -11.395 1.00 0.00 H ATOM 1210 N VAL A 647 44.827 -23.189 -13.797 1.00 29.56 N ATOM 1211 CA VAL A 647 43.736 -22.221 -13.916 1.00 29.09 C ATOM 1212 C VAL A 647 42.447 -23.027 -13.800 1.00 32.74 C ATOM 1213 O VAL A 647 42.259 -24.002 -14.538 1.00 32.29 O ATOM 1214 CB VAL A 647 43.801 -21.402 -15.251 1.00 32.14 C ATOM 1215 CG1 VAL A 647 42.703 -20.329 -15.281 1.00 31.18 C ATOM 1216 CG2 VAL A 647 45.188 -20.765 -15.448 1.00 31.68 C ATOM 1217 H VAL A 647 45.002 -23.808 -14.614 1.00 0.00 H ATOM 1218 N HIS A 648 41.576 -22.650 -12.851 1.00 27.35 N ATOM 1219 CA HIS A 648 40.312 -23.352 -12.594 1.00 25.30 C ATOM 1220 C HIS A 648 39.268 -23.031 -13.680 1.00 28.93 C ATOM 1221 O HIS A 648 38.660 -23.960 -14.252 1.00 27.97 O ATOM 1222 CB HIS A 648 39.792 -23.013 -11.185 1.00 25.53 C ATOM 1223 CG HIS A 648 38.610 -23.831 -10.781 1.00 28.46 C ATOM 1224 ND1 HIS A 648 37.381 -23.655 -11.367 1.00 30.02 N ATOM 1225 CD2 HIS A 648 38.513 -24.802 -9.844 1.00 30.25 C ATOM 1226 CE1 HIS A 648 36.578 -24.543 -10.799 1.00 29.54 C ATOM 1227 NE2 HIS A 648 37.214 -25.240 -9.868 1.00 30.20 N ATOM 1228 H HIS A 648 41.808 -21.820 -12.269 1.00 0.00 H ATOM 1229 N ARG A 649 39.048 -21.708 -13.953 1.00 25.05 N ATOM 1230 CA ARG A 649 38.137 -21.159 -14.983 1.00 25.06 C ATOM 1231 C ARG A 649 36.678 -21.107 -14.573 1.00 29.89 C ATOM 1232 O ARG A 649 35.884 -20.432 -15.250 1.00 30.29 O ATOM 1233 CB ARG A 649 38.260 -21.876 -16.355 1.00 24.32 C ATOM 1234 CG ARG A 649 39.685 -22.161 -16.843 1.00 25.91 C ATOM 1235 CD ARG A 649 39.669 -23.290 -17.874 1.00 33.91 C ATOM 1236 NE ARG A 649 38.779 -22.970 -19.001 1.00 30.45 N ATOM 1237 CZ ARG A 649 39.148 -22.317 -20.097 1.00 40.22 C ATOM 1238 NH1 ARG A 649 40.408 -21.939 -20.260 1.00 34.95 N ATOM 1239 NH2 ARG A 649 38.263 -22.047 -21.040 1.00 37.27 N ATOM 1240 HE ARG A 649 37.788 -23.278 -18.934 1.00 0.00 H ATOM 1241 HH12 ARG A 649 40.690 -21.428 -21.121 1.00 0.00 H ATOM 1242 HH11 ARG A 649 41.114 -22.153 -19.527 1.00 0.00 H ATOM 1243 HH22 ARG A 649 38.556 -21.535 -21.897 1.00 0.00 H ATOM 1244 HH21 ARG A 649 37.274 -22.346 -20.926 1.00 0.00 H ATOM 1245 H ARG A 649 39.574 -21.019 -13.379 1.00 0.00 H ATOM 1246 N ASP A 650 36.294 -21.816 -13.498 1.00 24.75 N ATOM 1247 CA ASP A 650 34.893 -21.781 -13.076 1.00 25.26 C ATOM 1248 C ASP A 650 34.750 -21.783 -11.555 1.00 30.23 C ATOM 1249 O ASP A 650 33.956 -22.539 -10.990 1.00 29.63 O ATOM 1250 CB ASP A 650 34.056 -22.886 -13.752 1.00 26.84 C ATOM 1251 CG ASP A 650 32.545 -22.779 -13.543 1.00 33.30 C ATOM 1252 OD1 ASP A 650 32.053 -21.652 -13.223 1.00 31.07 O ATOM 1253 OD2 ASP A 650 31.853 -23.816 -13.685 1.00 33.71 O ATOM 1254 H ASP A 650 36.987 -22.385 -12.970 1.00 0.00 H ATOM 1255 N LEU A 651 35.531 -20.942 -10.884 1.00 27.06 N ATOM 1256 CA LEU A 651 35.419 -20.857 -9.437 1.00 26.27 C ATOM 1257 C LEU A 651 34.144 -20.116 -9.055 1.00 27.99 C ATOM 1258 O LEU A 651 33.927 -18.992 -9.496 1.00 26.52 O ATOM 1259 CB LEU A 651 36.654 -20.194 -8.806 1.00 26.35 C ATOM 1260 CG LEU A 651 36.659 -20.146 -7.263 1.00 31.49 C ATOM 1261 CD1 LEU A 651 36.821 -21.551 -6.635 1.00 31.03 C ATOM 1262 CD2 LEU A 651 37.736 -19.207 -6.758 1.00 33.46 C ATOM 1263 H LEU A 651 36.218 -20.348 -11.391 1.00 0.00 H ATOM 1264 N ALA A 652 33.305 -20.763 -8.214 1.00 23.02 N ATOM 1265 CA ALA A 652 32.046 -20.235 -7.699 1.00 21.77 C ATOM 1266 C ALA A 652 31.652 -21.157 -6.537 1.00 25.93 C ATOM 1267 O ALA A 652 32.088 -22.313 -6.518 1.00 26.00 O ATOM 1268 CB ALA A 652 30.964 -20.248 -8.798 1.00 21.81 C ATOM 1269 H ALA A 652 33.581 -21.718 -7.908 1.00 0.00 H ATOM 1270 N THR A 653 30.861 -20.656 -5.568 1.00 22.99 N ATOM 1271 CA THR A 653 30.433 -21.449 -4.392 1.00 22.72 C ATOM 1272 C THR A 653 29.654 -22.721 -4.815 1.00 26.72 C ATOM 1273 O THR A 653 29.751 -23.724 -4.125 1.00 26.30 O ATOM 1274 CB THR A 653 29.691 -20.606 -3.347 1.00 23.01 C ATOM 1275 OG1 THR A 653 28.420 -20.192 -3.854 1.00 24.39 O ATOM 1276 CG2 THR A 653 30.532 -19.398 -2.825 1.00 19.71 C ATOM 1277 HG1 THR A 653 28.553 -19.650 -4.672 1.00 0.00 H ATOM 1278 H THR A 653 30.537 -19.671 -5.649 1.00 0.00 H ATOM 1279 N ARG A 654 28.945 -22.705 -5.972 1.00 24.28 N ATOM 1280 CA ARG A 654 28.235 -23.904 -6.474 1.00 24.21 C ATOM 1281 C ARG A 654 29.258 -25.053 -6.775 1.00 27.69 C ATOM 1282 O ARG A 654 28.871 -26.217 -6.791 1.00 27.65 O ATOM 1283 CB ARG A 654 27.389 -23.578 -7.736 1.00 23.20 C ATOM 1284 CG ARG A 654 28.238 -23.284 -8.991 1.00 26.06 C ATOM 1285 CD ARG A 654 27.458 -23.007 -10.279 1.00 30.88 C ATOM 1286 NE ARG A 654 28.368 -22.429 -11.276 1.00 27.36 N ATOM 1287 CZ ARG A 654 28.645 -21.131 -11.356 1.00 35.06 C ATOM 1288 NH1 ARG A 654 28.057 -20.269 -10.539 1.00 27.53 N ATOM 1289 NH2 ARG A 654 29.519 -20.686 -12.248 1.00 24.87 N ATOM 1290 HE ARG A 654 28.821 -23.071 -11.958 1.00 0.00 H ATOM 1291 HH12 ARG A 654 28.278 -19.255 -10.606 1.00 0.00 H ATOM 1292 HH11 ARG A 654 27.375 -20.607 -9.830 1.00 0.00 H ATOM 1293 HH22 ARG A 654 29.731 -19.670 -12.306 1.00 0.00 H ATOM 1294 HH21 ARG A 654 29.992 -21.353 -12.890 1.00 0.00 H ATOM 1295 H ARG A 654 28.899 -21.824 -6.523 1.00 0.00 H ATOM 1296 N ASN A 655 30.543 -24.720 -7.017 1.00 25.05 N ATOM 1297 CA ASN A 655 31.569 -25.726 -7.329 1.00 25.35 C ATOM 1298 C ASN A 655 32.412 -26.106 -6.136 1.00 28.36 C ATOM 1299 O ASN A 655 33.411 -26.810 -6.293 1.00 27.37 O ATOM 1300 CB ASN A 655 32.435 -25.310 -8.538 1.00 26.76 C ATOM 1301 CG ASN A 655 31.637 -25.303 -9.825 1.00 38.84 C ATOM 1302 OD1 ASN A 655 30.667 -26.041 -9.994 1.00 28.31 O ATOM 1303 ND2 ASN A 655 32.006 -24.461 -10.759 1.00 31.64 N ATOM 1304 HD22 ASN A 655 32.827 -23.842 -10.606 1.00 0.00 H ATOM 1305 HD21 ASN A 655 31.477 -24.412 -11.653 1.00 0.00 H ATOM 1306 H ASN A 655 30.817 -23.717 -6.982 1.00 0.00 H ATOM 1307 N CYS A 656 31.990 -25.664 -4.932 1.00 25.50 N ATOM 1308 CA CYS A 656 32.659 -25.974 -3.669 1.00 24.79 C ATOM 1309 C CYS A 656 31.741 -26.883 -2.839 1.00 28.27 C ATOM 1310 O CYS A 656 30.520 -26.834 -2.990 1.00 25.28 O ATOM 1311 CB CYS A 656 32.999 -24.697 -2.897 1.00 24.43 C ATOM 1312 SG CYS A 656 34.202 -23.623 -3.727 1.00 27.60 S ATOM 1313 H CYS A 656 31.139 -25.068 -4.901 1.00 0.00 H ATOM 1314 N LEU A 657 32.341 -27.654 -1.913 1.00 26.82 N ATOM 1315 CA LEU A 657 31.623 -28.569 -1.031 1.00 25.88 C ATOM 1316 C LEU A 657 31.921 -28.292 0.429 1.00 29.82 C ATOM 1317 O LEU A 657 32.986 -27.757 0.760 1.00 28.55 O ATOM 1318 CB LEU A 657 31.949 -30.023 -1.414 1.00 25.70 C ATOM 1319 CG LEU A 657 31.498 -30.432 -2.813 1.00 28.99 C ATOM 1320 CD1 LEU A 657 32.371 -31.586 -3.347 1.00 30.27 C ATOM 1321 CD2 LEU A 657 30.011 -30.753 -2.849 1.00 29.26 C ATOM 1322 H LEU A 657 33.375 -27.594 -1.821 1.00 0.00 H ATOM 1323 N VAL A 658 30.967 -28.633 1.306 1.00 26.93 N ATOM 1324 CA VAL A 658 31.084 -28.390 2.755 1.00 27.39 C ATOM 1325 C VAL A 658 30.906 -29.719 3.487 1.00 31.74 C ATOM 1326 O VAL A 658 29.892 -30.378 3.305 1.00 28.28 O ATOM 1327 CB VAL A 658 30.030 -27.369 3.267 1.00 30.99 C ATOM 1328 CG1 VAL A 658 30.213 -27.076 4.766 1.00 31.20 C ATOM 1329 CG2 VAL A 658 30.049 -26.089 2.448 1.00 29.73 C ATOM 1330 H VAL A 658 30.104 -29.090 0.948 1.00 0.00 H ATOM 1331 N GLY A 659 31.902 -30.092 4.270 1.00 31.20 N ATOM 1332 CA GLY A 659 31.898 -31.312 5.066 1.00 32.32 C ATOM 1333 C GLY A 659 31.640 -30.968 6.514 1.00 39.33 C ATOM 1334 O GLY A 659 31.616 -29.784 6.872 1.00 38.30 O ATOM 1335 H GLY A 659 32.740 -29.478 4.321 1.00 0.00 H ATOM 1336 N GLN A 660 31.443 -31.992 7.367 1.00 38.93 N ATOM 1337 CA GLN A 660 31.193 -31.780 8.801 1.00 38.33 C ATOM 1338 C GLN A 660 32.308 -30.964 9.464 1.00 38.81 C ATOM 1339 O GLN A 660 33.472 -31.142 9.133 1.00 38.89 O ATOM 1340 CB GLN A 660 30.991 -33.118 9.523 1.00 40.66 C ATOM 1341 CG GLN A 660 30.189 -32.979 10.823 1.00 49.25 C ATOM 1342 CD GLN A 660 29.582 -34.304 11.194 1.00 80.81 C ATOM 1343 OE1 GLN A 660 28.526 -34.705 10.679 1.00 79.42 O ATOM 1344 NE2 GLN A 660 30.244 -35.019 12.088 1.00 75.61 N ATOM 1345 HE22 GLN A 660 31.126 -34.651 12.498 1.00 0.00 H ATOM 1346 HE21 GLN A 660 29.883 -35.949 12.381 1.00 0.00 H ATOM 1347 H GLN A 660 31.469 -32.965 6.999 1.00 0.00 H ATOM 1348 N GLY A 661 31.931 -30.055 10.363 1.00 34.79 N ATOM 1349 CA GLY A 661 32.876 -29.196 11.063 1.00 34.23 C ATOM 1350 C GLY A 661 33.334 -28.013 10.231 1.00 36.71 C ATOM 1351 O GLY A 661 34.448 -27.526 10.421 1.00 35.81 O ATOM 1352 H GLY A 661 30.918 -29.955 10.574 1.00 0.00 H ATOM 1353 N LEU A 662 32.474 -27.535 9.313 1.00 33.09 N ATOM 1354 CA LEU A 662 32.744 -26.395 8.420 1.00 32.63 C ATOM 1355 C LEU A 662 34.053 -26.570 7.603 1.00 34.33 C ATOM 1356 O LEU A 662 34.848 -25.634 7.495 1.00 32.56 O ATOM 1357 CB LEU A 662 32.744 -25.055 9.202 1.00 32.12 C ATOM 1358 CG LEU A 662 32.349 -23.795 8.403 1.00 35.93 C ATOM 1359 CD1 LEU A 662 30.879 -23.759 8.127 1.00 34.55 C ATOM 1360 CD2 LEU A 662 32.763 -22.529 9.133 1.00 37.25 C ATOM 1361 H LEU A 662 31.550 -28.005 9.228 1.00 0.00 H ATOM 1362 N VAL A 663 34.283 -27.784 7.074 1.00 30.28 N ATOM 1363 CA VAL A 663 35.449 -28.080 6.243 1.00 30.58 C ATOM 1364 C VAL A 663 34.980 -27.721 4.816 1.00 32.74 C ATOM 1365 O VAL A 663 33.956 -28.227 4.357 1.00 31.10 O ATOM 1366 CB VAL A 663 35.927 -29.555 6.366 1.00 35.34 C ATOM 1367 CG1 VAL A 663 37.014 -29.874 5.331 1.00 35.04 C ATOM 1368 CG2 VAL A 663 36.423 -29.855 7.781 1.00 35.08 C ATOM 1369 H VAL A 663 33.602 -28.546 7.264 1.00 0.00 H ATOM 1370 N VAL A 664 35.707 -26.819 4.141 1.00 29.20 N ATOM 1371 CA VAL A 664 35.324 -26.357 2.806 1.00 27.42 C ATOM 1372 C VAL A 664 36.378 -26.718 1.782 1.00 30.22 C ATOM 1373 O VAL A 664 37.561 -26.430 1.977 1.00 28.79 O ATOM 1374 CB VAL A 664 34.939 -24.844 2.777 1.00 30.61 C ATOM 1375 CG1 VAL A 664 34.504 -24.410 1.366 1.00 29.54 C ATOM 1376 CG2 VAL A 664 33.821 -24.539 3.792 1.00 30.53 C ATOM 1377 H VAL A 664 36.569 -26.436 4.579 1.00 0.00 H ATOM 1378 N LYS A 665 35.942 -27.341 0.672 1.00 26.49 N ATOM 1379 CA LYS A 665 36.870 -27.746 -0.383 1.00 26.12 C ATOM 1380 C LYS A 665 36.333 -27.431 -1.771 1.00 28.51 C ATOM 1381 O LYS A 665 35.128 -27.437 -1.979 1.00 26.78 O ATOM 1382 CB LYS A 665 37.152 -29.273 -0.295 1.00 26.63 C ATOM 1383 CG LYS A 665 37.710 -29.754 1.050 1.00 28.40 C ATOM 1384 CD LYS A 665 37.993 -31.259 1.064 1.00 31.26 C ATOM 1385 CE LYS A 665 38.448 -31.734 2.442 1.00 32.04 C ATOM 1386 NZ LYS A 665 39.082 -33.080 2.379 1.00 35.29 N ATOM 1387 HZ1 LYS A 665 38.397 -33.767 2.005 1.00 0.00 H ATOM 1388 HZ2 LYS A 665 39.913 -33.042 1.755 1.00 0.00 H ATOM 1389 HZ3 LYS A 665 39.377 -33.368 3.334 1.00 0.00 H ATOM 1390 H LYS A 665 34.927 -27.538 0.562 1.00 0.00 H ATOM 1391 N ILE A 666 37.243 -27.238 -2.734 1.00 26.22 N ATOM 1392 CA ILE A 666 36.860 -27.042 -4.136 1.00 26.06 C ATOM 1393 C ILE A 666 36.560 -28.461 -4.587 1.00 31.56 C ATOM 1394 O ILE A 666 37.375 -29.356 -4.356 1.00 30.01 O ATOM 1395 CB ILE A 666 37.986 -26.374 -4.962 1.00 28.19 C ATOM 1396 CG1 ILE A 666 38.252 -24.948 -4.423 1.00 28.78 C ATOM 1397 CG2 ILE A 666 37.621 -26.371 -6.466 1.00 25.90 C ATOM 1398 CD1 ILE A 666 39.694 -24.410 -4.620 1.00 38.15 C ATOM 1399 H ILE A 666 38.251 -27.227 -2.480 1.00 0.00 H ATOM 1400 N GLY A 667 35.387 -28.681 -5.164 1.00 30.81 N ATOM 1401 CA GLY A 667 35.024 -30.038 -5.537 1.00 32.37 C ATOM 1402 C GLY A 667 34.906 -30.380 -7.003 1.00 41.19 C ATOM 1403 O GLY A 667 34.905 -31.563 -7.351 1.00 43.07 O ATOM 1404 H GLY A 667 34.734 -27.892 -5.348 1.00 0.00 H ATOM 1405 N ASP A 668 34.797 -29.363 -7.861 1.00 37.56 N ATOM 1406 CA ASP A 668 34.591 -29.528 -9.295 1.00 38.01 C ATOM 1407 C ASP A 668 35.449 -28.566 -10.110 1.00 40.81 C ATOM 1408 O ASP A 668 35.658 -27.427 -9.696 1.00 38.17 O ATOM 1409 CB ASP A 668 33.109 -29.239 -9.600 1.00 40.06 C ATOM 1410 CG ASP A 668 32.440 -30.165 -10.579 1.00 61.17 C ATOM 1411 OD1 ASP A 668 32.450 -31.401 -10.336 1.00 63.96 O ATOM 1412 OD2 ASP A 668 31.868 -29.662 -11.571 1.00 69.56 O ATOM 1413 H ASP A 668 34.863 -28.396 -7.484 1.00 0.00 H ATOM 1414 N PHE A 669 35.906 -29.056 -11.282 1.00 36.75 N ATOM 1415 CA PHE A 669 36.732 -28.448 -12.329 1.00 62.50 C ATOM 1416 C PHE A 669 36.212 -29.068 -13.635 1.00126.14 C ATOM 1417 O PHE A 669 36.012 -30.290 -13.706 1.00 96.39 O ATOM 1418 CB PHE A 669 38.227 -28.844 -12.185 1.00 64.12 C ATOM 1419 CG PHE A 669 38.799 -28.947 -10.789 1.00 65.62 C ATOM 1420 CD1 PHE A 669 39.545 -27.907 -10.246 1.00 68.00 C ATOM 1421 CD2 PHE A 669 38.628 -30.101 -10.030 1.00 67.02 C ATOM 1422 CE1 PHE A 669 40.074 -28.003 -8.954 1.00 68.20 C ATOM 1423 CE2 PHE A 669 39.158 -30.193 -8.740 1.00 69.34 C ATOM 1424 CZ PHE A 669 39.875 -29.144 -8.211 1.00 67.03 C ATOM 1425 H PHE A 669 35.622 -30.037 -11.476 1.00 0.00 H TER 1426 PHE A 669 ATOM 1427 N SER A 672 29.575 -30.164 -14.708 1.00 61.74 N ATOM 1428 CA SER A 672 29.065 -28.839 -14.363 1.00 61.42 C ATOM 1429 C SER A 672 27.571 -28.827 -13.999 1.00 65.52 C ATOM 1430 O SER A 672 26.788 -29.653 -14.475 1.00 66.06 O ATOM 1431 CB SER A 672 29.384 -27.800 -15.439 1.00 64.41 C ATOM 1432 OG SER A 672 29.522 -28.345 -16.742 1.00 72.34 O ATOM 1433 HG SER A 672 29.727 -27.618 -17.382 1.00 0.00 H ATOM 1434 HN3 SER A 672 29.053 -30.532 -15.529 1.00 0.00 H ATOM 1435 HN2 SER A 672 29.448 -30.805 -13.899 1.00 0.00 H ATOM 1436 HN1 SER A 672 30.586 -30.095 -14.941 1.00 0.00 H ATOM 1437 N ARG A 673 27.198 -27.875 -13.126 1.00 60.69 N ATOM 1438 CA ARG A 673 25.855 -27.666 -12.593 1.00 59.47 C ATOM 1439 C ARG A 673 25.636 -26.173 -12.278 1.00 60.86 C ATOM 1440 O ARG A 673 26.586 -25.397 -12.345 1.00 59.70 O ATOM 1441 CB ARG A 673 25.669 -28.541 -11.324 1.00 58.46 C ATOM 1442 CG ARG A 673 26.144 -27.956 -9.963 1.00 63.88 C ATOM 1443 CD ARG A 673 27.644 -27.662 -9.742 1.00 67.35 C ATOM 1444 NE ARG A 673 28.615 -28.707 -10.119 1.00 78.42 N ATOM 1445 CZ ARG A 673 28.505 -30.013 -9.880 1.00 92.48 C ATOM 1446 NH1 ARG A 673 27.428 -30.498 -9.275 1.00 82.75 N ATOM 1447 NH2 ARG A 673 29.462 -30.847 -10.267 1.00 76.29 N ATOM 1448 HE ARG A 673 29.470 -28.393 -10.621 1.00 0.00 H ATOM 1449 HH12 ARG A 673 27.350 -31.519 -9.092 1.00 0.00 H ATOM 1450 HH11 ARG A 673 26.662 -29.857 -8.984 1.00 0.00 H ATOM 1451 HH22 ARG A 673 29.372 -31.866 -10.078 1.00 0.00 H ATOM 1452 HH21 ARG A 673 30.302 -30.482 -10.759 1.00 0.00 H ATOM 1453 H ARG A 673 27.939 -27.223 -12.798 1.00 0.00 H ATOM 1454 N ASP A 674 24.397 -25.787 -11.924 1.00 56.61 N ATOM 1455 CA ASP A 674 24.035 -24.410 -11.561 1.00 56.63 C ATOM 1456 C ASP A 674 22.867 -24.365 -10.560 1.00 60.47 C ATOM 1457 O ASP A 674 22.203 -25.387 -10.338 1.00 59.30 O ATOM 1458 CB ASP A 674 23.768 -23.531 -12.810 1.00 58.40 C ATOM 1459 CG ASP A 674 22.791 -24.089 -13.843 1.00 70.71 C ATOM 1460 OD1 ASP A 674 21.648 -24.446 -13.459 1.00 70.23 O ATOM 1461 OD2 ASP A 674 23.159 -24.146 -15.035 1.00 78.52 O ATOM 1462 H ASP A 674 23.648 -26.509 -11.906 1.00 0.00 H ATOM 1463 N ILE A 675 22.631 -23.183 -9.946 1.00 57.16 N ATOM 1464 CA ILE A 675 21.529 -22.976 -8.998 1.00 56.70 C ATOM 1465 C ILE A 675 20.366 -22.434 -9.826 1.00 60.03 C ATOM 1466 O ILE A 675 19.284 -23.034 -9.861 1.00 58.92 O ATOM 1467 CB ILE A 675 21.966 -22.106 -7.773 1.00 59.64 C ATOM 1468 CG1 ILE A 675 22.621 -22.994 -6.701 1.00 60.23 C ATOM 1469 CG2 ILE A 675 20.803 -21.325 -7.143 1.00 60.02 C ATOM 1470 CD1 ILE A 675 24.006 -23.290 -6.881 1.00 63.71 C ATOM 1471 H ILE A 675 23.261 -22.382 -10.156 1.00 0.00 H ATOM 1472 N TYR A 676 20.618 -21.312 -10.518 1.00 56.39 N ATOM 1473 CA TYR A 676 19.686 -20.678 -11.438 1.00 55.61 C ATOM 1474 C TYR A 676 20.282 -20.996 -12.806 1.00 56.17 C ATOM 1475 O TYR A 676 21.511 -21.121 -12.932 1.00 55.68 O ATOM 1476 CB TYR A 676 19.609 -19.152 -11.207 1.00 57.29 C ATOM 1477 CG TYR A 676 19.076 -18.723 -9.850 1.00 59.97 C ATOM 1478 CD1 TYR A 676 19.417 -17.491 -9.302 1.00 62.07 C ATOM 1479 CD2 TYR A 676 18.209 -19.542 -9.125 1.00 60.97 C ATOM 1480 CE1 TYR A 676 18.922 -17.087 -8.061 1.00 64.10 C ATOM 1481 CE2 TYR A 676 17.720 -19.155 -7.877 1.00 61.80 C ATOM 1482 CZ TYR A 676 18.070 -17.922 -7.353 1.00 70.87 C ATOM 1483 OH TYR A 676 17.579 -17.540 -6.126 1.00 73.44 O ATOM 1484 HH TYR A 676 17.923 -16.640 -5.900 1.00 0.00 H ATOM 1485 H TYR A 676 21.547 -20.863 -10.387 1.00 0.00 H ATOM 1486 N SER A 677 19.437 -21.162 -13.825 1.00 49.93 N ATOM 1487 CA SER A 677 19.949 -21.472 -15.166 1.00 48.49 C ATOM 1488 C SER A 677 20.790 -20.310 -15.720 1.00 45.99 C ATOM 1489 O SER A 677 21.689 -20.532 -16.539 1.00 44.62 O ATOM 1490 CB SER A 677 18.811 -21.856 -16.107 1.00 53.49 C ATOM 1491 OG SER A 677 18.987 -23.190 -16.566 1.00 63.52 O ATOM 1492 HG SER A 677 18.244 -23.429 -17.175 1.00 0.00 H ATOM 1493 H SER A 677 18.413 -21.072 -13.669 1.00 0.00 H ATOM 1494 N THR A 678 20.540 -19.089 -15.192 1.00 39.82 N ATOM 1495 CA THR A 678 21.218 -17.837 -15.561 1.00 38.59 C ATOM 1496 C THR A 678 22.689 -17.749 -15.095 1.00 36.17 C ATOM 1497 O THR A 678 23.347 -16.759 -15.428 1.00 35.95 O ATOM 1498 CB THR A 678 20.400 -16.618 -15.095 1.00 43.83 C ATOM 1499 OG1 THR A 678 20.263 -16.682 -13.674 1.00 37.72 O ATOM 1500 CG2 THR A 678 19.008 -16.550 -15.767 1.00 41.35 C ATOM 1501 HG1 THR A 678 19.739 -15.904 -13.359 1.00 0.00 H ATOM 1502 H THR A 678 19.803 -19.031 -14.460 1.00 0.00 H ATOM 1503 N ASP A 679 23.225 -18.759 -14.370 1.00 28.26 N ATOM 1504 CA ASP A 679 24.651 -18.756 -13.949 1.00 27.57 C ATOM 1505 C ASP A 679 25.592 -18.880 -15.121 1.00 31.95 C ATOM 1506 O ASP A 679 26.774 -18.531 -15.009 1.00 31.02 O ATOM 1507 CB ASP A 679 24.969 -19.917 -13.003 1.00 28.85 C ATOM 1508 CG ASP A 679 24.441 -19.754 -11.591 1.00 35.37 C ATOM 1509 OD1 ASP A 679 23.868 -18.672 -11.285 1.00 32.72 O ATOM 1510 OD2 ASP A 679 24.604 -20.705 -10.787 1.00 37.77 O ATOM 1511 H ASP A 679 22.621 -19.561 -14.099 1.00 0.00 H ATOM 1512 N TYR A 680 25.090 -19.451 -16.233 1.00 29.00 N ATOM 1513 CA TYR A 680 25.889 -19.644 -17.437 1.00 28.84 C ATOM 1514 C TYR A 680 25.269 -18.957 -18.631 1.00 33.29 C ATOM 1515 O TYR A 680 24.051 -18.928 -18.777 1.00 32.46 O ATOM 1516 CB TYR A 680 26.101 -21.133 -17.729 1.00 28.29 C ATOM 1517 CG TYR A 680 26.952 -21.808 -16.682 1.00 29.70 C ATOM 1518 CD1 TYR A 680 26.374 -22.425 -15.577 1.00 31.71 C ATOM 1519 CD2 TYR A 680 28.337 -21.839 -16.797 1.00 29.87 C ATOM 1520 CE1 TYR A 680 27.157 -23.035 -14.599 1.00 30.78 C ATOM 1521 CE2 TYR A 680 29.128 -22.452 -15.828 1.00 30.88 C ATOM 1522 CZ TYR A 680 28.528 -23.062 -14.739 1.00 34.43 C ATOM 1523 OH TYR A 680 29.285 -23.664 -13.774 1.00 35.32 O ATOM 1524 HH TYR A 680 29.889 -22.995 -13.364 1.00 0.00 H ATOM 1525 H TYR A 680 24.099 -19.765 -16.233 1.00 0.00 H ATOM 1526 N TYR A 681 26.114 -18.423 -19.491 1.00 31.09 N ATOM 1527 CA TYR A 681 25.662 -17.736 -20.688 1.00 32.14 C ATOM 1528 C TYR A 681 26.193 -18.466 -21.917 1.00 37.56 C ATOM 1529 O TYR A 681 27.387 -18.755 -21.979 1.00 35.75 O ATOM 1530 CB TYR A 681 26.159 -16.282 -20.661 1.00 33.29 C ATOM 1531 CG TYR A 681 25.950 -15.510 -21.945 1.00 36.45 C ATOM 1532 CD1 TYR A 681 24.706 -14.981 -22.268 1.00 37.70 C ATOM 1533 CD2 TYR A 681 27.008 -15.260 -22.808 1.00 39.55 C ATOM 1534 CE1 TYR A 681 24.516 -14.232 -23.427 1.00 39.24 C ATOM 1535 CE2 TYR A 681 26.830 -14.517 -23.977 1.00 41.77 C ATOM 1536 CZ TYR A 681 25.580 -14.004 -24.282 1.00 49.94 C ATOM 1537 OH TYR A 681 25.392 -13.277 -25.436 1.00 55.71 O ATOM 1538 HH TYR A 681 24.446 -12.990 -25.494 1.00 0.00 H ATOM 1539 H TYR A 681 27.135 -18.496 -19.307 1.00 0.00 H ATOM 1540 N ARG A 682 25.313 -18.729 -22.890 1.00 39.04 N ATOM 1541 CA ARG A 682 25.672 -19.395 -24.152 1.00 41.96 C ATOM 1542 C ARG A 682 26.270 -18.359 -25.108 1.00 48.58 C ATOM 1543 O ARG A 682 25.544 -17.519 -25.648 1.00 48.92 O ATOM 1544 CB ARG A 682 24.446 -20.099 -24.768 1.00 45.15 C ATOM 1545 CG ARG A 682 24.790 -21.083 -25.895 1.00 56.75 C ATOM 1546 CD ARG A 682 23.570 -21.867 -26.343 1.00 68.02 C ATOM 1547 NE ARG A 682 23.144 -22.826 -25.322 1.00 78.75 N ATOM 1548 CZ ARG A 682 23.523 -24.099 -25.278 1.00 96.37 C ATOM 1549 NH1 ARG A 682 24.335 -24.592 -26.207 1.00 87.17 N ATOM 1550 NH2 ARG A 682 23.091 -24.892 -24.306 1.00 81.78 N ATOM 1551 HE ARG A 682 22.500 -22.487 -24.579 1.00 0.00 H ATOM 1552 HH12 ARG A 682 24.627 -25.589 -26.166 1.00 0.00 H ATOM 1553 HH11 ARG A 682 24.678 -23.981 -26.975 1.00 0.00 H ATOM 1554 HH22 ARG A 682 23.390 -25.888 -24.275 1.00 0.00 H ATOM 1555 HH21 ARG A 682 22.453 -24.518 -23.575 1.00 0.00 H ATOM 1556 H ARG A 682 24.322 -18.448 -22.747 1.00 0.00 H ATOM 1557 N VAL A 683 27.602 -18.403 -25.288 1.00 46.69 N ATOM 1558 CA VAL A 683 28.332 -17.464 -26.149 1.00 72.22 C ATOM 1559 C VAL A 683 28.395 -17.926 -27.628 1.00 95.81 C ATOM 1560 O VAL A 683 27.753 -18.898 -28.031 1.00 57.12 O ATOM 1561 CB VAL A 683 29.733 -17.141 -25.561 1.00 76.14 C ATOM 1562 CG1 VAL A 683 30.761 -18.226 -25.890 1.00 75.86 C ATOM 1563 CG2 VAL A 683 30.221 -15.764 -26.007 1.00 75.99 C ATOM 1564 H VAL A 683 28.143 -19.140 -24.792 1.00 0.00 H TER 1565 VAL A 683 ATOM 1566 N THR A 687 29.348 -24.107 -25.754 1.00 50.10 N ATOM 1567 CA THR A 687 30.276 -23.287 -24.975 1.00 49.98 C ATOM 1568 C THR A 687 29.475 -22.333 -24.032 1.00 51.58 C ATOM 1569 O THR A 687 28.900 -21.320 -24.457 1.00 49.89 O ATOM 1570 CB THR A 687 31.346 -22.619 -25.872 1.00 62.64 C ATOM 1571 OG1 THR A 687 32.137 -21.722 -25.089 1.00 64.33 O ATOM 1572 CG2 THR A 687 30.759 -21.898 -27.086 1.00 64.87 C ATOM 1573 HG1 THR A 687 32.820 -21.297 -25.666 1.00 0.00 H ATOM 1574 HN3 THR A 687 28.738 -23.489 -26.326 1.00 0.00 H ATOM 1575 HN2 THR A 687 28.762 -24.673 -25.108 1.00 0.00 H ATOM 1576 HN1 THR A 687 29.887 -24.739 -26.379 1.00 0.00 H ATOM 1577 N MET A 688 29.431 -22.721 -22.741 1.00 47.00 N ATOM 1578 CA MET A 688 28.736 -22.023 -21.656 1.00 45.73 C ATOM 1579 C MET A 688 29.752 -21.252 -20.832 1.00 45.04 C ATOM 1580 O MET A 688 30.753 -21.826 -20.397 1.00 45.19 O ATOM 1581 CB MET A 688 28.005 -23.026 -20.742 1.00 48.46 C ATOM 1582 CG MET A 688 26.955 -23.867 -21.439 1.00 52.51 C ATOM 1583 SD MET A 688 25.768 -22.895 -22.379 1.00 57.06 S ATOM 1584 CE MET A 688 24.705 -22.279 -21.076 1.00 53.35 C ATOM 1585 H MET A 688 29.936 -23.595 -22.493 1.00 0.00 H ATOM 1586 N LEU A 689 29.509 -19.962 -20.612 1.00 36.68 N ATOM 1587 CA LEU A 689 30.452 -19.177 -19.834 1.00 35.21 C ATOM 1588 C LEU A 689 29.838 -18.624 -18.547 1.00 32.67 C ATOM 1589 O LEU A 689 28.749 -18.051 -18.597 1.00 29.87 O ATOM 1590 CB LEU A 689 31.090 -18.050 -20.678 1.00 35.99 C ATOM 1591 CG LEU A 689 32.024 -18.445 -21.843 1.00 42.04 C ATOM 1592 CD1 LEU A 689 32.481 -17.218 -22.597 1.00 43.41 C ATOM 1593 CD2 LEU A 689 33.271 -19.175 -21.353 1.00 44.91 C ATOM 1594 H LEU A 689 28.650 -19.519 -20.995 1.00 0.00 H ATOM 1595 N PRO A 690 30.529 -18.787 -17.384 1.00 27.25 N ATOM 1596 CA PRO A 690 30.007 -18.222 -16.113 1.00 25.58 C ATOM 1597 C PRO A 690 30.355 -16.712 -16.053 1.00 27.96 C ATOM 1598 O PRO A 690 31.140 -16.275 -15.205 1.00 24.71 O ATOM 1599 CB PRO A 690 30.774 -19.026 -15.055 1.00 25.97 C ATOM 1600 CG PRO A 690 32.092 -19.326 -15.691 1.00 30.51 C ATOM 1601 CD PRO A 690 31.834 -19.462 -17.180 1.00 28.03 C ATOM 1602 N ILE A 691 29.793 -15.923 -16.990 1.00 26.83 N ATOM 1603 CA ILE A 691 30.097 -14.492 -17.175 1.00 27.15 C ATOM 1604 C ILE A 691 30.007 -13.661 -15.854 1.00 29.00 C ATOM 1605 O ILE A 691 30.844 -12.794 -15.678 1.00 27.27 O ATOM 1606 CB ILE A 691 29.320 -13.821 -18.361 1.00 31.29 C ATOM 1607 CG1 ILE A 691 27.822 -13.746 -18.121 1.00 32.76 C ATOM 1608 CG2 ILE A 691 29.619 -14.459 -19.742 1.00 29.60 C ATOM 1609 CD1 ILE A 691 27.405 -12.367 -17.697 1.00 41.78 C ATOM 1610 H ILE A 691 29.095 -16.354 -17.629 1.00 0.00 H ATOM 1611 N ARG A 692 29.059 -13.938 -14.930 1.00 26.03 N ATOM 1612 CA ARG A 692 28.964 -13.156 -13.668 1.00 24.86 C ATOM 1613 C ARG A 692 30.197 -13.277 -12.784 1.00 27.01 C ATOM 1614 O ARG A 692 30.444 -12.374 -11.990 1.00 26.18 O ATOM 1615 CB ARG A 692 27.690 -13.494 -12.875 1.00 24.78 C ATOM 1616 CG ARG A 692 26.422 -13.302 -13.694 1.00 28.00 C ATOM 1617 CD ARG A 692 25.251 -14.135 -13.184 1.00 26.43 C ATOM 1618 NE ARG A 692 24.115 -14.056 -14.104 1.00 27.52 N ATOM 1619 CZ ARG A 692 23.181 -13.114 -14.078 1.00 36.48 C ATOM 1620 NH1 ARG A 692 23.215 -12.161 -13.164 1.00 26.88 N ATOM 1621 NH2 ARG A 692 22.205 -13.118 -14.971 1.00 31.90 N ATOM 1622 HE ARG A 692 24.034 -14.794 -14.833 1.00 0.00 H ATOM 1623 HH12 ARG A 692 22.479 -11.427 -13.151 1.00 0.00 H ATOM 1624 HH11 ARG A 692 23.978 -12.145 -12.457 1.00 0.00 H ATOM 1625 HH22 ARG A 692 21.475 -12.378 -14.947 1.00 0.00 H ATOM 1626 HH21 ARG A 692 22.168 -13.862 -15.697 1.00 0.00 H ATOM 1627 H ARG A 692 28.385 -14.711 -15.105 1.00 0.00 H ATOM 1628 N TRP A 693 30.999 -14.363 -12.955 1.00 22.31 N ATOM 1629 CA TRP A 693 32.219 -14.623 -12.181 1.00 22.10 C ATOM 1630 C TRP A 693 33.470 -14.203 -12.907 1.00 25.25 C ATOM 1631 O TRP A 693 34.562 -14.247 -12.341 1.00 25.12 O ATOM 1632 CB TRP A 693 32.303 -16.133 -11.821 1.00 20.54 C ATOM 1633 CG TRP A 693 31.348 -16.510 -10.734 1.00 21.84 C ATOM 1634 CD1 TRP A 693 31.617 -16.556 -9.395 1.00 24.38 C ATOM 1635 CD2 TRP A 693 29.932 -16.749 -10.868 1.00 21.94 C ATOM 1636 NE1 TRP A 693 30.467 -16.828 -8.690 1.00 23.56 N ATOM 1637 CE2 TRP A 693 29.415 -16.942 -9.566 1.00 24.72 C ATOM 1638 CE3 TRP A 693 29.053 -16.831 -11.963 1.00 23.43 C ATOM 1639 CZ2 TRP A 693 28.062 -17.227 -9.328 1.00 23.97 C ATOM 1640 CZ3 TRP A 693 27.710 -17.107 -11.727 1.00 24.84 C ATOM 1641 CH2 TRP A 693 27.229 -17.318 -10.426 1.00 25.02 C ATOM 1642 HE1 TRP A 693 30.404 -16.931 -7.657 1.00 0.00 H ATOM 1643 H TRP A 693 30.730 -15.055 -13.683 1.00 0.00 H ATOM 1644 N MET A 694 33.323 -13.776 -14.155 1.00 21.30 N ATOM 1645 CA MET A 694 34.462 -13.469 -15.014 1.00 20.91 C ATOM 1646 C MET A 694 34.876 -12.003 -15.146 1.00 24.95 C ATOM 1647 O MET A 694 34.007 -11.136 -15.235 1.00 24.76 O ATOM 1648 CB MET A 694 34.155 -14.009 -16.432 1.00 22.65 C ATOM 1649 CG MET A 694 34.249 -15.534 -16.553 1.00 25.45 C ATOM 1650 SD MET A 694 33.304 -16.176 -17.957 1.00 28.49 S ATOM 1651 CE MET A 694 34.250 -15.566 -19.321 1.00 25.74 C ATOM 1652 H MET A 694 32.362 -13.656 -14.534 1.00 0.00 H ATOM 1653 N PRO A 695 36.205 -11.744 -15.256 1.00 21.55 N ATOM 1654 CA PRO A 695 36.675 -10.367 -15.510 1.00 21.55 C ATOM 1655 C PRO A 695 36.456 -9.966 -16.985 1.00 29.63 C ATOM 1656 O PRO A 695 36.182 -10.851 -17.825 1.00 29.35 O ATOM 1657 CB PRO A 695 38.170 -10.453 -15.227 1.00 22.59 C ATOM 1658 CG PRO A 695 38.527 -11.876 -15.535 1.00 26.10 C ATOM 1659 CD PRO A 695 37.337 -12.699 -15.168 1.00 21.32 C ATOM 1660 N PRO A 696 36.620 -8.662 -17.340 1.00 27.02 N ATOM 1661 CA PRO A 696 36.414 -8.256 -18.748 1.00 26.60 C ATOM 1662 C PRO A 696 37.254 -8.990 -19.803 1.00 30.00 C ATOM 1663 O PRO A 696 36.689 -9.326 -20.831 1.00 29.71 O ATOM 1664 CB PRO A 696 36.706 -6.746 -18.742 1.00 27.88 C ATOM 1665 CG PRO A 696 36.427 -6.317 -17.296 1.00 32.63 C ATOM 1666 CD PRO A 696 36.922 -7.487 -16.478 1.00 28.41 C ATOM 1667 N GLU A 697 38.554 -9.263 -19.564 1.00 27.40 N ATOM 1668 CA GLU A 697 39.401 -9.960 -20.556 1.00 26.91 C ATOM 1669 C GLU A 697 38.922 -11.392 -20.878 1.00 31.32 C ATOM 1670 O GLU A 697 39.090 -11.839 -22.017 1.00 31.71 O ATOM 1671 CB GLU A 697 40.900 -9.937 -20.171 1.00 27.49 C ATOM 1672 CG GLU A 697 41.333 -10.885 -19.055 1.00 30.42 C ATOM 1673 CD GLU A 697 41.129 -10.432 -17.616 1.00 36.74 C ATOM 1674 OE1 GLU A 697 40.445 -9.408 -17.390 1.00 27.13 O ATOM 1675 OE2 GLU A 697 41.674 -11.100 -16.709 1.00 29.03 O ATOM 1676 H GLU A 697 38.972 -8.975 -18.656 1.00 0.00 H ATOM 1677 N SER A 698 38.302 -12.096 -19.883 1.00 25.53 N ATOM 1678 CA SER A 698 37.775 -13.457 -20.072 1.00 24.06 C ATOM 1679 C SER A 698 36.477 -13.432 -20.878 1.00 26.92 C ATOM 1680 O SER A 698 36.251 -14.299 -21.722 1.00 25.88 O ATOM 1681 CB SER A 698 37.538 -14.124 -18.712 1.00 24.38 C ATOM 1682 OG SER A 698 38.778 -14.195 -18.032 1.00 24.87 O ATOM 1683 HG SER A 698 39.416 -14.730 -18.567 1.00 0.00 H ATOM 1684 H SER A 698 38.198 -11.649 -18.950 1.00 0.00 H ATOM 1685 N ILE A 699 35.590 -12.481 -20.570 1.00 24.67 N ATOM 1686 CA ILE A 699 34.307 -12.327 -21.269 1.00 25.09 C ATOM 1687 C ILE A 699 34.564 -11.923 -22.726 1.00 28.97 C ATOM 1688 O ILE A 699 33.932 -12.447 -23.635 1.00 27.05 O ATOM 1689 CB ILE A 699 33.452 -11.230 -20.571 1.00 28.41 C ATOM 1690 CG1 ILE A 699 32.970 -11.690 -19.183 1.00 28.13 C ATOM 1691 CG2 ILE A 699 32.254 -10.773 -21.466 1.00 29.08 C ATOM 1692 CD1 ILE A 699 32.289 -10.611 -18.318 1.00 30.05 C ATOM 1693 H ILE A 699 35.818 -11.820 -19.800 1.00 0.00 H ATOM 1694 N LEU A 700 35.474 -10.975 -22.930 1.00 27.76 N ATOM 1695 CA LEU A 700 35.723 -10.438 -24.255 1.00 29.02 C ATOM 1696 C LEU A 700 36.549 -11.308 -25.159 1.00 32.79 C ATOM 1697 O LEU A 700 36.174 -11.447 -26.323 1.00 30.65 O ATOM 1698 CB LEU A 700 36.347 -9.034 -24.179 1.00 29.60 C ATOM 1699 CG LEU A 700 35.469 -7.882 -23.603 1.00 36.04 C ATOM 1700 CD1 LEU A 700 36.245 -6.607 -23.547 1.00 36.46 C ATOM 1701 CD2 LEU A 700 34.200 -7.660 -24.400 1.00 39.24 C ATOM 1702 H LEU A 700 36.019 -10.611 -22.123 1.00 0.00 H ATOM 1703 N TYR A 701 37.669 -11.879 -24.635 1.00 28.51 N ATOM 1704 CA TYR A 701 38.633 -12.657 -25.415 1.00 28.02 C ATOM 1705 C TYR A 701 38.893 -14.077 -24.950 1.00 29.20 C ATOM 1706 O TYR A 701 39.800 -14.698 -25.485 1.00 27.53 O ATOM 1707 CB TYR A 701 39.981 -11.895 -25.406 1.00 29.49 C ATOM 1708 CG TYR A 701 39.854 -10.491 -25.929 1.00 33.54 C ATOM 1709 CD1 TYR A 701 40.134 -9.396 -25.118 1.00 36.82 C ATOM 1710 CD2 TYR A 701 39.374 -10.249 -27.211 1.00 34.03 C ATOM 1711 CE1 TYR A 701 39.978 -8.095 -25.583 1.00 39.54 C ATOM 1712 CE2 TYR A 701 39.200 -8.952 -27.683 1.00 35.97 C ATOM 1713 CZ TYR A 701 39.503 -7.877 -26.866 1.00 45.26 C ATOM 1714 OH TYR A 701 39.334 -6.600 -27.342 1.00 48.21 O ATOM 1715 HH TYR A 701 39.593 -5.951 -26.641 1.00 0.00 H ATOM 1716 H TYR A 701 37.850 -11.755 -23.619 1.00 0.00 H ATOM 1717 N ARG A 702 38.164 -14.577 -23.936 1.00 25.86 N ATOM 1718 CA ARG A 702 38.372 -15.933 -23.398 1.00 27.06 C ATOM 1719 C ARG A 702 39.778 -16.119 -22.896 1.00 31.67 C ATOM 1720 O ARG A 702 40.365 -17.198 -23.034 1.00 33.12 O ATOM 1721 CB ARG A 702 37.943 -17.027 -24.405 1.00 30.36 C ATOM 1722 CG ARG A 702 36.645 -17.692 -23.990 1.00 41.99 C ATOM 1723 CD ARG A 702 35.802 -18.108 -25.170 1.00 53.75 C ATOM 1724 NE ARG A 702 36.263 -19.351 -25.776 1.00 59.81 N ATOM 1725 CZ ARG A 702 35.822 -19.823 -26.938 1.00 73.69 C ATOM 1726 NH1 ARG A 702 34.913 -19.149 -27.639 1.00 58.21 N ATOM 1727 NH2 ARG A 702 36.297 -20.963 -27.417 1.00 63.01 N ATOM 1728 HE ARG A 702 36.982 -19.904 -25.267 1.00 0.00 H ATOM 1729 HH12 ARG A 702 34.573 -19.525 -28.547 1.00 0.00 H ATOM 1730 HH11 ARG A 702 34.543 -18.246 -27.279 1.00 0.00 H ATOM 1731 HH22 ARG A 702 35.950 -21.330 -28.326 1.00 0.00 H ATOM 1732 HH21 ARG A 702 37.017 -21.491 -26.884 1.00 0.00 H ATOM 1733 H ARG A 702 37.423 -13.982 -23.514 1.00 0.00 H ATOM 1734 N LYS A 703 40.344 -15.037 -22.325 1.00 26.69 N ATOM 1735 CA LYS A 703 41.677 -15.052 -21.748 1.00 26.88 C ATOM 1736 C LYS A 703 41.508 -15.497 -20.280 1.00 31.44 C ATOM 1737 O LYS A 703 41.030 -14.728 -19.440 1.00 32.71 O ATOM 1738 CB LYS A 703 42.346 -13.663 -21.866 1.00 28.97 C ATOM 1739 CG LYS A 703 43.744 -13.560 -21.233 1.00 42.20 C ATOM 1740 CD LYS A 703 44.803 -14.394 -21.965 1.00 56.92 C ATOM 1741 CE LYS A 703 46.210 -14.110 -21.494 1.00 74.01 C ATOM 1742 NZ LYS A 703 46.692 -12.778 -21.947 1.00 88.24 N ATOM 1743 HZ1 LYS A 703 46.684 -12.743 -22.986 1.00 0.00 H ATOM 1744 HZ2 LYS A 703 46.067 -12.038 -21.569 1.00 0.00 H ATOM 1745 HZ3 LYS A 703 47.661 -12.625 -21.601 1.00 0.00 H ATOM 1746 H LYS A 703 39.801 -14.150 -22.296 1.00 0.00 H ATOM 1747 N PHE A 704 41.881 -16.748 -20.000 1.00 27.30 N ATOM 1748 CA PHE A 704 41.789 -17.401 -18.685 1.00 26.03 C ATOM 1749 C PHE A 704 43.164 -17.603 -18.131 1.00 30.51 C ATOM 1750 O PHE A 704 44.033 -18.189 -18.798 1.00 29.14 O ATOM 1751 CB PHE A 704 41.036 -18.736 -18.816 1.00 26.84 C ATOM 1752 CG PHE A 704 39.551 -18.573 -19.039 1.00 26.91 C ATOM 1753 CD1 PHE A 704 38.688 -18.357 -17.964 1.00 27.66 C ATOM 1754 CD2 PHE A 704 39.013 -18.635 -20.317 1.00 28.16 C ATOM 1755 CE1 PHE A 704 37.315 -18.215 -18.168 1.00 29.09 C ATOM 1756 CE2 PHE A 704 37.641 -18.488 -20.525 1.00 31.18 C ATOM 1757 CZ PHE A 704 36.797 -18.277 -19.451 1.00 30.50 C ATOM 1758 H PHE A 704 42.272 -17.312 -20.782 1.00 0.00 H ATOM 1759 N THR A 705 43.403 -17.046 -16.934 1.00 27.33 N ATOM 1760 CA THR A 705 44.697 -17.095 -16.251 1.00 26.64 C ATOM 1761 C THR A 705 44.482 -17.183 -14.729 1.00 29.07 C ATOM 1762 O THR A 705 43.365 -17.071 -14.262 1.00 27.43 O ATOM 1763 CB THR A 705 45.490 -15.775 -16.518 1.00 31.69 C ATOM 1764 OG1 THR A 705 44.735 -14.656 -16.024 1.00 29.88 O ATOM 1765 CG2 THR A 705 45.882 -15.568 -17.999 1.00 28.44 C ATOM 1766 HG1 THR A 705 43.862 -14.617 -16.489 1.00 0.00 H ATOM 1767 H THR A 705 42.621 -16.549 -16.462 1.00 0.00 H ATOM 1768 N THR A 706 45.561 -17.296 -13.962 1.00 26.66 N ATOM 1769 CA THR A 706 45.472 -17.283 -12.497 1.00 27.47 C ATOM 1770 C THR A 706 44.882 -15.913 -12.021 1.00 29.02 C ATOM 1771 O THR A 706 44.272 -15.871 -10.956 1.00 27.87 O ATOM 1772 CB THR A 706 46.836 -17.577 -11.880 1.00 38.02 C ATOM 1773 OG1 THR A 706 47.729 -16.578 -12.328 1.00 43.76 O ATOM 1774 CG2 THR A 706 47.377 -18.938 -12.294 1.00 32.35 C ATOM 1775 HG1 THR A 706 47.402 -15.690 -12.038 1.00 0.00 H ATOM 1776 H THR A 706 46.493 -17.396 -14.412 1.00 0.00 H ATOM 1777 N GLU A 707 45.021 -14.818 -12.849 1.00 24.47 N ATOM 1778 CA GLU A 707 44.476 -13.465 -12.578 1.00 24.10 C ATOM 1779 C GLU A 707 42.984 -13.404 -12.822 1.00 25.85 C ATOM 1780 O GLU A 707 42.296 -12.671 -12.120 1.00 26.01 O ATOM 1781 CB GLU A 707 45.218 -12.342 -13.339 1.00 25.71 C ATOM 1782 CG GLU A 707 46.663 -12.177 -12.918 1.00 30.25 C ATOM 1783 CD GLU A 707 47.639 -13.251 -13.364 1.00 50.71 C ATOM 1784 OE1 GLU A 707 47.477 -13.789 -14.485 1.00 39.59 O ATOM 1785 OE2 GLU A 707 48.570 -13.558 -12.583 1.00 49.57 O ATOM 1786 H GLU A 707 45.550 -14.952 -13.734 1.00 0.00 H ATOM 1787 N SER A 708 42.456 -14.171 -13.801 1.00 21.94 N ATOM 1788 CA SER A 708 41.008 -14.236 -14.012 1.00 21.04 C ATOM 1789 C SER A 708 40.394 -15.083 -12.858 1.00 26.26 C ATOM 1790 O SER A 708 39.273 -14.814 -12.430 1.00 26.59 O ATOM 1791 CB SER A 708 40.665 -14.813 -15.380 1.00 24.49 C ATOM 1792 OG SER A 708 41.220 -16.102 -15.571 1.00 29.15 O ATOM 1793 HG SER A 708 40.868 -16.717 -14.880 1.00 0.00 H ATOM 1794 H SER A 708 43.088 -14.724 -14.415 1.00 0.00 H ATOM 1795 N ASP A 709 41.164 -16.056 -12.307 1.00 23.10 N ATOM 1796 CA ASP A 709 40.715 -16.869 -11.154 1.00 21.33 C ATOM 1797 C ASP A 709 40.678 -16.020 -9.878 1.00 24.74 C ATOM 1798 O ASP A 709 39.777 -16.208 -9.061 1.00 22.85 O ATOM 1799 CB ASP A 709 41.650 -18.055 -10.922 1.00 21.82 C ATOM 1800 CG ASP A 709 41.293 -19.333 -11.659 1.00 28.11 C ATOM 1801 OD1 ASP A 709 40.191 -19.391 -12.282 1.00 29.36 O ATOM 1802 OD2 ASP A 709 42.084 -20.274 -11.598 1.00 28.74 O ATOM 1803 H ASP A 709 42.105 -16.237 -12.710 1.00 0.00 H ATOM 1804 N VAL A 710 41.646 -15.088 -9.696 1.00 23.76 N ATOM 1805 CA VAL A 710 41.631 -14.238 -8.493 1.00 25.02 C ATOM 1806 C VAL A 710 40.387 -13.303 -8.532 1.00 26.35 C ATOM 1807 O VAL A 710 39.744 -13.068 -7.490 1.00 25.33 O ATOM 1808 CB VAL A 710 42.967 -13.523 -8.198 1.00 31.25 C ATOM 1809 CG1 VAL A 710 43.042 -12.169 -8.884 1.00 31.83 C ATOM 1810 CG2 VAL A 710 43.170 -13.373 -6.692 1.00 31.49 C ATOM 1811 H VAL A 710 42.398 -14.973 -10.405 1.00 0.00 H ATOM 1812 N TRP A 711 40.004 -12.860 -9.747 1.00 21.59 N ATOM 1813 CA TRP A 711 38.810 -12.038 -9.942 1.00 21.76 C ATOM 1814 C TRP A 711 37.578 -12.865 -9.515 1.00 24.95 C ATOM 1815 O TRP A 711 36.723 -12.344 -8.791 1.00 24.16 O ATOM 1816 CB TRP A 711 38.671 -11.593 -11.420 1.00 20.00 C ATOM 1817 CG TRP A 711 37.400 -10.839 -11.711 1.00 20.12 C ATOM 1818 CD1 TRP A 711 36.135 -11.349 -11.764 1.00 22.54 C ATOM 1819 CD2 TRP A 711 37.290 -9.448 -12.045 1.00 20.28 C ATOM 1820 NE1 TRP A 711 35.241 -10.360 -12.101 1.00 22.89 N ATOM 1821 CE2 TRP A 711 35.928 -9.186 -12.302 1.00 25.02 C ATOM 1822 CE3 TRP A 711 38.227 -8.407 -12.212 1.00 22.63 C ATOM 1823 CZ2 TRP A 711 35.468 -7.917 -12.694 1.00 24.69 C ATOM 1824 CZ3 TRP A 711 37.767 -7.148 -12.592 1.00 24.91 C ATOM 1825 CH2 TRP A 711 36.405 -6.907 -12.803 1.00 25.42 C ATOM 1826 HE1 TRP A 711 34.212 -10.480 -12.190 1.00 0.00 H ATOM 1827 H TRP A 711 40.579 -13.112 -10.576 1.00 0.00 H ATOM 1828 N SER A 712 37.495 -14.135 -9.964 1.00 21.65 N ATOM 1829 CA SER A 712 36.375 -15.041 -9.606 1.00 22.45 C ATOM 1830 C SER A 712 36.370 -15.255 -8.096 1.00 23.47 C ATOM 1831 O SER A 712 35.296 -15.375 -7.506 1.00 23.59 O ATOM 1832 CB SER A 712 36.520 -16.395 -10.300 1.00 26.72 C ATOM 1833 OG SER A 712 36.497 -16.235 -11.709 1.00 30.06 O ATOM 1834 HG SER A 712 36.592 -17.120 -12.142 1.00 0.00 H ATOM 1835 H SER A 712 38.247 -14.494 -10.587 1.00 0.00 H ATOM 1836 N PHE A 713 37.567 -15.305 -7.469 1.00 19.85 N ATOM 1837 CA PHE A 713 37.645 -15.457 -6.007 1.00 20.18 C ATOM 1838 C PHE A 713 37.004 -14.233 -5.314 1.00 23.39 C ATOM 1839 O PHE A 713 36.288 -14.403 -4.331 1.00 25.00 O ATOM 1840 CB PHE A 713 39.077 -15.732 -5.481 1.00 21.37 C ATOM 1841 CG PHE A 713 39.017 -15.936 -3.974 1.00 22.71 C ATOM 1842 CD1 PHE A 713 38.537 -17.132 -3.434 1.00 25.44 C ATOM 1843 CD2 PHE A 713 39.309 -14.891 -3.101 1.00 23.68 C ATOM 1844 CE1 PHE A 713 38.433 -17.305 -2.042 1.00 26.74 C ATOM 1845 CE2 PHE A 713 39.176 -15.054 -1.706 1.00 26.82 C ATOM 1846 CZ PHE A 713 38.747 -16.256 -1.187 1.00 25.59 C ATOM 1847 H PHE A 713 38.442 -15.235 -8.026 1.00 0.00 H ATOM 1848 N GLY A 714 37.226 -13.029 -5.855 1.00 20.31 N ATOM 1849 CA GLY A 714 36.615 -11.809 -5.321 1.00 19.66 C ATOM 1850 C GLY A 714 35.098 -11.918 -5.403 1.00 23.64 C ATOM 1851 O GLY A 714 34.382 -11.542 -4.470 1.00 22.63 O ATOM 1852 H GLY A 714 37.853 -12.957 -6.682 1.00 0.00 H ATOM 1853 N VAL A 715 34.596 -12.489 -6.516 1.00 20.71 N ATOM 1854 CA VAL A 715 33.149 -12.733 -6.702 1.00 20.53 C ATOM 1855 C VAL A 715 32.645 -13.803 -5.691 1.00 23.33 C ATOM 1856 O VAL A 715 31.537 -13.666 -5.166 1.00 22.42 O ATOM 1857 CB VAL A 715 32.783 -13.056 -8.171 1.00 23.95 C ATOM 1858 CG1 VAL A 715 31.276 -13.249 -8.306 1.00 23.95 C ATOM 1859 CG2 VAL A 715 33.252 -11.924 -9.112 1.00 23.43 C ATOM 1860 H VAL A 715 35.251 -12.769 -7.273 1.00 0.00 H ATOM 1861 N VAL A 716 33.457 -14.856 -5.412 1.00 21.21 N ATOM 1862 CA VAL A 716 33.124 -15.911 -4.411 1.00 21.37 C ATOM 1863 C VAL A 716 32.976 -15.259 -3.024 1.00 24.86 C ATOM 1864 O VAL A 716 32.037 -15.570 -2.285 1.00 23.73 O ATOM 1865 CB VAL A 716 34.165 -17.076 -4.389 1.00 24.31 C ATOM 1866 CG1 VAL A 716 34.039 -17.912 -3.107 1.00 23.30 C ATOM 1867 CG2 VAL A 716 34.011 -17.969 -5.629 1.00 23.26 C ATOM 1868 H VAL A 716 34.359 -14.931 -5.924 1.00 0.00 H ATOM 1869 N LEU A 717 33.897 -14.333 -2.683 1.00 24.84 N ATOM 1870 CA LEU A 717 33.829 -13.569 -1.422 1.00 25.32 C ATOM 1871 C LEU A 717 32.494 -12.847 -1.322 1.00 28.61 C ATOM 1872 O LEU A 717 31.878 -12.838 -0.252 1.00 27.35 O ATOM 1873 CB LEU A 717 34.943 -12.510 -1.355 1.00 25.64 C ATOM 1874 CG LEU A 717 36.259 -12.974 -0.767 1.00 30.60 C ATOM 1875 CD1 LEU A 717 37.305 -11.823 -0.793 1.00 29.05 C ATOM 1876 CD2 LEU A 717 36.060 -13.547 0.674 1.00 29.57 C ATOM 1877 H LEU A 717 34.686 -14.151 -3.335 1.00 0.00 H ATOM 1878 N TRP A 718 32.039 -12.250 -2.456 1.00 24.93 N ATOM 1879 CA TRP A 718 30.756 -11.538 -2.536 1.00 23.63 C ATOM 1880 C TRP A 718 29.615 -12.537 -2.299 1.00 25.53 C ATOM 1881 O TRP A 718 28.673 -12.243 -1.564 1.00 23.56 O ATOM 1882 CB TRP A 718 30.623 -10.821 -3.888 1.00 22.05 C ATOM 1883 CG TRP A 718 29.457 -9.892 -3.966 1.00 22.88 C ATOM 1884 CD1 TRP A 718 29.438 -8.561 -3.650 1.00 25.51 C ATOM 1885 CD2 TRP A 718 28.123 -10.237 -4.354 1.00 22.93 C ATOM 1886 NE1 TRP A 718 28.175 -8.049 -3.851 1.00 25.03 N ATOM 1887 CE2 TRP A 718 27.349 -9.055 -4.291 1.00 26.05 C ATOM 1888 CE3 TRP A 718 27.503 -11.439 -4.773 1.00 24.41 C ATOM 1889 CZ2 TRP A 718 25.988 -9.036 -4.617 1.00 25.34 C ATOM 1890 CZ3 TRP A 718 26.149 -11.422 -5.063 1.00 26.03 C ATOM 1891 CH2 TRP A 718 25.408 -10.228 -4.994 1.00 26.84 C ATOM 1892 HE1 TRP A 718 27.892 -7.060 -3.695 1.00 0.00 H ATOM 1893 H TRP A 718 32.629 -12.300 -3.311 1.00 0.00 H ATOM 1894 N GLU A 719 29.712 -13.734 -2.899 1.00 22.17 N ATOM 1895 CA GLU A 719 28.699 -14.799 -2.693 1.00 21.50 C ATOM 1896 C GLU A 719 28.657 -15.203 -1.205 1.00 24.48 C ATOM 1897 O GLU A 719 27.594 -15.346 -0.649 1.00 24.82 O ATOM 1898 CB GLU A 719 29.060 -16.047 -3.494 1.00 21.78 C ATOM 1899 CG GLU A 719 28.881 -15.964 -5.002 1.00 19.44 C ATOM 1900 CD GLU A 719 29.108 -17.342 -5.578 1.00 29.21 C ATOM 1901 OE1 GLU A 719 30.255 -17.650 -5.970 1.00 25.02 O ATOM 1902 OE2 GLU A 719 28.139 -18.133 -5.598 1.00 26.81 O ATOM 1903 H GLU A 719 30.520 -13.920 -3.526 1.00 0.00 H ATOM 1904 N ILE A 720 29.818 -15.385 -0.577 1.00 22.32 N ATOM 1905 CA ILE A 720 29.899 -15.776 0.828 1.00 23.20 C ATOM 1906 C ILE A 720 29.221 -14.742 1.729 1.00 26.72 C ATOM 1907 O ILE A 720 28.342 -15.089 2.502 1.00 26.16 O ATOM 1908 CB ILE A 720 31.370 -16.081 1.254 1.00 25.87 C ATOM 1909 CG1 ILE A 720 31.933 -17.323 0.486 1.00 24.94 C ATOM 1910 CG2 ILE A 720 31.504 -16.239 2.803 1.00 28.02 C ATOM 1911 CD1 ILE A 720 33.486 -17.555 0.653 1.00 18.16 C ATOM 1912 H ILE A 720 30.701 -15.243 -1.108 1.00 0.00 H ATOM 1913 N PHE A 721 29.579 -13.472 1.563 1.00 24.04 N ATOM 1914 CA PHE A 721 29.082 -12.387 2.403 1.00 23.47 C ATOM 1915 C PHE A 721 27.650 -11.929 2.073 1.00 28.37 C ATOM 1916 O PHE A 721 27.099 -11.193 2.875 1.00 28.56 O ATOM 1917 CB PHE A 721 30.117 -11.240 2.455 1.00 24.21 C ATOM 1918 CG PHE A 721 31.236 -11.669 3.401 1.00 24.97 C ATOM 1919 CD1 PHE A 721 31.184 -11.354 4.758 1.00 27.10 C ATOM 1920 CD2 PHE A 721 32.320 -12.415 2.937 1.00 25.56 C ATOM 1921 CE1 PHE A 721 32.204 -11.765 5.631 1.00 27.77 C ATOM 1922 CE2 PHE A 721 33.327 -12.847 3.815 1.00 28.19 C ATOM 1923 CZ PHE A 721 33.260 -12.518 5.157 1.00 26.95 C ATOM 1924 H PHE A 721 30.245 -13.241 0.798 1.00 0.00 H ATOM 1925 N THR A 722 27.004 -12.427 0.976 1.00 25.24 N ATOM 1926 CA THR A 722 25.582 -12.135 0.687 1.00 23.93 C ATOM 1927 C THR A 722 24.779 -13.415 1.040 1.00 27.16 C ATOM 1928 O THR A 722 23.588 -13.467 0.764 1.00 26.47 O ATOM 1929 CB THR A 722 25.317 -11.827 -0.811 1.00 26.36 C ATOM 1930 OG1 THR A 722 25.817 -12.906 -1.636 1.00 27.04 O ATOM 1931 CG2 THR A 722 25.871 -10.485 -1.249 1.00 25.94 C ATOM 1932 HG1 THR A 722 26.791 -13.006 -1.491 1.00 0.00 H ATOM 1933 H THR A 722 27.533 -13.035 0.318 1.00 0.00 H ATOM 1934 N TYR A 723 25.437 -14.445 1.629 1.00 24.94 N ATOM 1935 CA TYR A 723 24.819 -15.747 1.969 1.00 25.00 C ATOM 1936 C TYR A 723 24.320 -16.469 0.718 1.00 28.90 C ATOM 1937 O TYR A 723 23.213 -17.004 0.689 1.00 28.84 O ATOM 1938 CB TYR A 723 23.720 -15.645 3.049 1.00 26.62 C ATOM 1939 CG TYR A 723 24.250 -15.118 4.362 1.00 27.40 C ATOM 1940 CD1 TYR A 723 24.847 -15.972 5.287 1.00 28.32 C ATOM 1941 CD2 TYR A 723 24.193 -13.759 4.665 1.00 27.45 C ATOM 1942 CE1 TYR A 723 25.332 -15.496 6.498 1.00 30.60 C ATOM 1943 CE2 TYR A 723 24.703 -13.265 5.869 1.00 27.94 C ATOM 1944 CZ TYR A 723 25.263 -14.140 6.784 1.00 35.03 C ATOM 1945 OH TYR A 723 25.755 -13.688 7.983 1.00 36.47 O ATOM 1946 HH TYR A 723 26.113 -14.452 8.501 1.00 0.00 H ATOM 1947 H TYR A 723 26.443 -14.311 1.857 1.00 0.00 H ATOM 1948 N GLY A 724 25.156 -16.468 -0.311 1.00 26.54 N ATOM 1949 CA GLY A 724 24.903 -17.179 -1.554 1.00 26.31 C ATOM 1950 C GLY A 724 24.079 -16.525 -2.629 1.00 30.17 C ATOM 1951 O GLY A 724 23.577 -17.242 -3.500 1.00 30.38 O ATOM 1952 H GLY A 724 26.041 -15.929 -0.224 1.00 0.00 H ATOM 1953 N LYS A 725 23.939 -15.187 -2.616 1.00 25.18 N ATOM 1954 CA LYS A 725 23.162 -14.532 -3.681 1.00 25.37 C ATOM 1955 C LYS A 725 23.920 -14.617 -5.011 1.00 27.01 C ATOM 1956 O LYS A 725 25.147 -14.664 -5.022 1.00 25.11 O ATOM 1957 CB LYS A 725 22.914 -13.046 -3.394 1.00 27.61 C ATOM 1958 CG LYS A 725 21.888 -12.760 -2.320 1.00 47.11 C ATOM 1959 CD LYS A 725 21.504 -11.294 -2.413 1.00 56.57 C ATOM 1960 CE LYS A 725 20.955 -10.739 -1.127 1.00 70.00 C ATOM 1961 NZ LYS A 725 20.648 -9.289 -1.268 1.00 81.16 N ATOM 1962 HZ1 LYS A 725 21.518 -8.774 -1.513 1.00 0.00 H ATOM 1963 HZ2 LYS A 725 19.942 -9.157 -2.020 1.00 0.00 H ATOM 1964 HZ3 LYS A 725 20.271 -8.927 -0.369 1.00 0.00 H ATOM 1965 H LYS A 725 24.376 -14.621 -1.861 1.00 0.00 H ATOM 1966 N GLN A 726 23.185 -14.628 -6.110 1.00 23.12 N ATOM 1967 CA GLN A 726 23.787 -14.668 -7.431 1.00 23.69 C ATOM 1968 C GLN A 726 24.345 -13.267 -7.721 1.00 28.53 C ATOM 1969 O GLN A 726 23.633 -12.280 -7.532 1.00 28.31 O ATOM 1970 CB GLN A 726 22.755 -15.067 -8.509 1.00 24.20 C ATOM 1971 CG GLN A 726 23.372 -15.108 -9.932 1.00 24.33 C ATOM 1972 CD GLN A 726 22.350 -15.218 -11.017 1.00 39.66 C ATOM 1973 OE1 GLN A 726 21.431 -14.398 -11.117 1.00 33.84 O ATOM 1974 NE2 GLN A 726 22.499 -16.227 -11.868 1.00 37.09 N ATOM 1975 HE22 GLN A 726 23.286 -16.896 -11.749 1.00 0.00 H ATOM 1976 HE21 GLN A 726 21.828 -16.348 -12.653 1.00 0.00 H ATOM 1977 H GLN A 726 22.149 -14.607 -6.026 1.00 0.00 H ATOM 1978 N PRO A 727 25.605 -13.174 -8.176 1.00 25.84 N ATOM 1979 CA PRO A 727 26.173 -11.855 -8.526 1.00 25.86 C ATOM 1980 C PRO A 727 25.383 -11.248 -9.677 1.00 30.28 C ATOM 1981 O PRO A 727 25.055 -11.970 -10.621 1.00 29.25 O ATOM 1982 CB PRO A 727 27.618 -12.187 -8.963 1.00 27.65 C ATOM 1983 CG PRO A 727 27.876 -13.579 -8.463 1.00 31.40 C ATOM 1984 CD PRO A 727 26.559 -14.267 -8.460 1.00 27.39 C ATOM 1985 N TRP A 728 25.015 -9.944 -9.572 1.00 27.44 N ATOM 1986 CA TRP A 728 24.258 -9.230 -10.610 1.00 27.39 C ATOM 1987 C TRP A 728 22.871 -9.855 -10.814 1.00 31.65 C ATOM 1988 O TRP A 728 22.368 -9.857 -11.940 1.00 29.68 O ATOM 1989 CB TRP A 728 25.053 -9.205 -11.948 1.00 26.32 C ATOM 1990 CG TRP A 728 26.425 -8.594 -11.849 1.00 28.15 C ATOM 1991 CD1 TRP A 728 27.621 -9.224 -12.024 1.00 30.54 C ATOM 1992 CD2 TRP A 728 26.733 -7.209 -11.599 1.00 28.51 C ATOM 1993 NE1 TRP A 728 28.658 -8.323 -11.873 1.00 29.34 N ATOM 1994 CE2 TRP A 728 28.142 -7.080 -11.634 1.00 31.07 C ATOM 1995 CE3 TRP A 728 25.952 -6.064 -11.324 1.00 30.09 C ATOM 1996 CZ2 TRP A 728 28.791 -5.859 -11.391 1.00 30.60 C ATOM 1997 CZ3 TRP A 728 26.598 -4.857 -11.095 1.00 31.31 C ATOM 1998 CH2 TRP A 728 28.001 -4.766 -11.134 1.00 31.73 C ATOM 1999 HE1 TRP A 728 29.670 -8.554 -11.932 1.00 0.00 H ATOM 2000 H TRP A 728 25.283 -9.424 -8.712 1.00 0.00 H ATOM 2001 N TYR A 729 22.268 -10.398 -9.734 1.00 30.28 N ATOM 2002 CA TYR A 729 20.961 -11.077 -9.778 1.00 32.77 C ATOM 2003 C TYR A 729 19.848 -10.270 -10.447 1.00 39.47 C ATOM 2004 O TYR A 729 18.957 -10.857 -11.064 1.00 38.62 O ATOM 2005 CB TYR A 729 20.508 -11.554 -8.381 1.00 34.39 C ATOM 2006 CG TYR A 729 20.414 -10.476 -7.320 1.00 37.64 C ATOM 2007 CD1 TYR A 729 19.209 -9.826 -7.063 1.00 39.61 C ATOM 2008 CD2 TYR A 729 21.519 -10.138 -6.538 1.00 38.73 C ATOM 2009 CE1 TYR A 729 19.113 -8.849 -6.070 1.00 41.83 C ATOM 2010 CE2 TYR A 729 21.436 -9.161 -5.546 1.00 39.35 C ATOM 2011 CZ TYR A 729 20.230 -8.520 -5.316 1.00 50.51 C ATOM 2012 OH TYR A 729 20.148 -7.559 -4.340 1.00 54.78 O ATOM 2013 HH TYR A 729 19.225 -7.203 -4.305 1.00 0.00 H ATOM 2014 H TYR A 729 22.755 -10.333 -8.817 1.00 0.00 H ATOM 2015 N GLN A 730 19.914 -8.930 -10.319 1.00 37.56 N ATOM 2016 CA GLN A 730 18.955 -7.964 -10.873 1.00 37.64 C ATOM 2017 C GLN A 730 19.070 -7.898 -12.388 1.00 40.22 C ATOM 2018 O GLN A 730 18.162 -7.381 -13.035 1.00 40.25 O ATOM 2019 CB GLN A 730 19.220 -6.545 -10.306 1.00 38.49 C ATOM 2020 CG GLN A 730 19.483 -6.490 -8.797 1.00 50.20 C ATOM 2021 CD GLN A 730 20.965 -6.518 -8.434 1.00 64.08 C ATOM 2022 OE1 GLN A 730 21.826 -7.058 -9.168 1.00 46.17 O ATOM 2023 NE2 GLN A 730 21.294 -5.930 -7.276 1.00 54.96 N ATOM 2024 HE22 GLN A 730 20.557 -5.490 -6.688 1.00 0.00 H ATOM 2025 HE21 GLN A 730 22.286 -5.913 -6.965 1.00 0.00 H ATOM 2026 H GLN A 730 20.716 -8.545 -9.780 1.00 0.00 H ATOM 2027 N LEU A 731 20.189 -8.404 -12.952 1.00 34.11 N ATOM 2028 CA LEU A 731 20.459 -8.351 -14.384 1.00 32.40 C ATOM 2029 C LEU A 731 20.435 -9.665 -15.129 1.00 38.54 C ATOM 2030 O LEU A 731 20.721 -10.733 -14.568 1.00 37.39 O ATOM 2031 CB LEU A 731 21.840 -7.701 -14.646 1.00 30.84 C ATOM 2032 CG LEU A 731 22.218 -6.399 -13.909 1.00 34.19 C ATOM 2033 CD1 LEU A 731 23.635 -5.986 -14.271 1.00 32.34 C ATOM 2034 CD2 LEU A 731 21.230 -5.255 -14.205 1.00 35.75 C ATOM 2035 H LEU A 731 20.893 -8.854 -12.333 1.00 0.00 H ATOM 2036 N SER A 732 20.163 -9.563 -16.451 1.00 35.00 N ATOM 2037 CA SER A 732 20.195 -10.706 -17.364 1.00 34.25 C ATOM 2038 C SER A 732 21.687 -10.869 -17.704 1.00 35.21 C ATOM 2039 O SER A 732 22.474 -9.953 -17.437 1.00 33.46 O ATOM 2040 CB SER A 732 19.393 -10.396 -18.631 1.00 38.34 C ATOM 2041 OG SER A 732 19.996 -9.340 -19.365 1.00 44.57 O ATOM 2042 HG SER A 732 20.031 -8.526 -18.802 1.00 0.00 H ATOM 2043 H SER A 732 19.920 -8.628 -16.836 1.00 0.00 H ATOM 2044 N ASN A 733 22.090 -11.996 -18.305 1.00 31.69 N ATOM 2045 CA ASN A 733 23.497 -12.168 -18.632 1.00 32.05 C ATOM 2046 C ASN A 733 24.049 -11.131 -19.630 1.00 35.43 C ATOM 2047 O ASN A 733 25.219 -10.769 -19.514 1.00 35.39 O ATOM 2048 CB ASN A 733 23.797 -13.578 -19.082 1.00 31.50 C ATOM 2049 CG ASN A 733 23.916 -14.550 -17.928 1.00 47.73 C ATOM 2050 OD1 ASN A 733 24.721 -14.380 -16.992 1.00 40.57 O ATOM 2051 ND2 ASN A 733 23.130 -15.604 -17.977 1.00 35.08 N ATOM 2052 HD22 ASN A 733 22.467 -15.722 -18.770 1.00 0.00 H ATOM 2053 HD21 ASN A 733 23.172 -16.319 -17.223 1.00 0.00 H ATOM 2054 H ASN A 733 21.403 -12.742 -18.536 1.00 0.00 H ATOM 2055 N THR A 734 23.227 -10.641 -20.589 1.00 31.22 N ATOM 2056 CA THR A 734 23.696 -9.653 -21.578 1.00 30.63 C ATOM 2057 C THR A 734 23.913 -8.275 -20.899 1.00 32.71 C ATOM 2058 O THR A 734 24.874 -7.582 -21.221 1.00 32.31 O ATOM 2059 CB THR A 734 22.799 -9.631 -22.832 1.00 42.07 C ATOM 2060 OG1 THR A 734 21.495 -9.186 -22.484 1.00 43.97 O ATOM 2061 CG2 THR A 734 22.700 -11.002 -23.497 1.00 42.69 C ATOM 2062 HG1 THR A 734 20.925 -9.174 -23.293 1.00 0.00 H ATOM 2063 H THR A 734 22.241 -10.970 -20.629 1.00 0.00 H ATOM 2064 N GLU A 735 23.045 -7.914 -19.950 1.00 30.09 N ATOM 2065 CA GLU A 735 23.172 -6.677 -19.161 1.00 31.02 C ATOM 2066 C GLU A 735 24.393 -6.825 -18.243 1.00 35.90 C ATOM 2067 O GLU A 735 25.142 -5.860 -18.099 1.00 35.60 O ATOM 2068 CB GLU A 735 21.922 -6.427 -18.298 1.00 31.79 C ATOM 2069 CG GLU A 735 20.663 -6.149 -19.101 1.00 39.29 C ATOM 2070 CD GLU A 735 19.388 -6.055 -18.289 1.00 60.44 C ATOM 2071 OE1 GLU A 735 19.148 -6.929 -17.423 1.00 47.33 O ATOM 2072 OE2 GLU A 735 18.616 -5.101 -18.531 1.00 68.00 O ATOM 2073 H GLU A 735 22.237 -8.540 -19.758 1.00 0.00 H ATOM 2074 N ALA A 736 24.612 -8.040 -17.636 1.00 31.82 N ATOM 2075 CA ALA A 736 25.792 -8.255 -16.771 1.00 30.59 C ATOM 2076 C ALA A 736 27.066 -8.138 -17.581 1.00 32.79 C ATOM 2077 O ALA A 736 27.998 -7.494 -17.111 1.00 31.18 O ATOM 2078 CB ALA A 736 25.714 -9.587 -16.024 1.00 31.17 C ATOM 2079 H ALA A 736 23.939 -8.818 -17.788 1.00 0.00 H ATOM 2080 N ILE A 737 27.108 -8.692 -18.831 1.00 30.65 N ATOM 2081 CA ILE A 737 28.306 -8.547 -19.702 1.00 30.34 C ATOM 2082 C ILE A 737 28.612 -7.035 -19.897 1.00 34.09 C ATOM 2083 O ILE A 737 29.768 -6.625 -19.785 1.00 34.11 O ATOM 2084 CB ILE A 737 28.115 -9.242 -21.097 1.00 32.90 C ATOM 2085 CG1 ILE A 737 28.183 -10.788 -20.977 1.00 33.47 C ATOM 2086 CG2 ILE A 737 29.138 -8.723 -22.151 1.00 29.98 C ATOM 2087 CD1 ILE A 737 27.500 -11.561 -22.148 1.00 31.34 C ATOM 2088 H ILE A 737 26.286 -9.225 -19.180 1.00 0.00 H ATOM 2089 N ASP A 738 27.574 -6.228 -20.202 1.00 32.60 N ATOM 2090 CA ASP A 738 27.738 -4.789 -20.420 1.00 32.83 C ATOM 2091 C ASP A 738 28.229 -4.083 -19.148 1.00 35.40 C ATOM 2092 O ASP A 738 29.155 -3.302 -19.216 1.00 32.95 O ATOM 2093 CB ASP A 738 26.435 -4.164 -20.944 1.00 34.92 C ATOM 2094 CG ASP A 738 26.077 -4.525 -22.380 1.00 42.42 C ATOM 2095 OD1 ASP A 738 26.976 -4.987 -23.124 1.00 42.54 O ATOM 2096 OD2 ASP A 738 24.908 -4.337 -22.760 1.00 47.38 O ATOM 2097 H ASP A 738 26.624 -6.643 -20.285 1.00 0.00 H ATOM 2098 N CYS A 739 27.626 -4.383 -17.996 1.00 33.95 N ATOM 2099 CA CYS A 739 28.044 -3.774 -16.738 1.00 35.28 C ATOM 2100 C CYS A 739 29.497 -4.137 -16.391 1.00 33.51 C ATOM 2101 O CYS A 739 30.294 -3.241 -16.095 1.00 31.02 O ATOM 2102 CB CYS A 739 27.076 -4.136 -15.621 1.00 37.92 C ATOM 2103 SG CYS A 739 25.490 -3.266 -15.738 1.00 44.05 S ATOM 2104 H CYS A 739 26.841 -5.066 -17.995 1.00 0.00 H ATOM 2105 N ILE A 740 29.859 -5.446 -16.486 1.00 27.65 N ATOM 2106 CA ILE A 740 31.211 -5.900 -16.175 1.00 26.60 C ATOM 2107 C ILE A 740 32.269 -5.249 -17.097 1.00 29.77 C ATOM 2108 O ILE A 740 33.242 -4.681 -16.599 1.00 28.25 O ATOM 2109 CB ILE A 740 31.330 -7.460 -16.131 1.00 28.86 C ATOM 2110 CG1 ILE A 740 30.458 -8.073 -14.989 1.00 27.68 C ATOM 2111 CG2 ILE A 740 32.797 -7.887 -16.014 1.00 27.56 C ATOM 2112 CD1 ILE A 740 29.934 -9.517 -15.269 1.00 26.52 C ATOM 2113 H ILE A 740 29.150 -6.144 -16.790 1.00 0.00 H ATOM 2114 N THR A 741 32.089 -5.336 -18.424 1.00 26.63 N ATOM 2115 CA THR A 741 33.060 -4.756 -19.366 1.00 26.36 C ATOM 2116 C THR A 741 33.168 -3.229 -19.215 1.00 29.01 C ATOM 2117 O THR A 741 34.254 -2.714 -19.407 1.00 28.77 O ATOM 2118 CB THR A 741 32.804 -5.201 -20.809 1.00 36.71 C ATOM 2119 OG1 THR A 741 31.518 -4.751 -21.198 1.00 33.10 O ATOM 2120 CG2 THR A 741 32.898 -6.725 -20.980 1.00 36.08 C ATOM 2121 HG1 THR A 741 30.836 -5.144 -20.597 1.00 0.00 H ATOM 2122 H THR A 741 31.247 -5.822 -18.794 1.00 0.00 H ATOM 2123 N GLN A 742 32.088 -2.537 -18.804 1.00 26.94 N ATOM 2124 CA GLN A 742 32.088 -1.079 -18.558 1.00 28.28 C ATOM 2125 C GLN A 742 32.817 -0.698 -17.239 1.00 33.81 C ATOM 2126 O GLN A 742 33.153 0.467 -17.042 1.00 33.57 O ATOM 2127 CB GLN A 742 30.652 -0.508 -18.569 1.00 29.23 C ATOM 2128 CG GLN A 742 30.054 -0.327 -19.989 1.00 35.95 C ATOM 2129 CD GLN A 742 30.813 0.677 -20.834 1.00 59.18 C ATOM 2130 OE1 GLN A 742 31.450 0.323 -21.826 1.00 58.85 O ATOM 2131 NE2 GLN A 742 30.771 1.951 -20.456 1.00 45.34 N ATOM 2132 HE22 GLN A 742 30.226 2.226 -19.614 1.00 0.00 H ATOM 2133 HE21 GLN A 742 31.283 2.673 -21.002 1.00 0.00 H ATOM 2134 H GLN A 742 31.202 -3.059 -18.651 1.00 0.00 H ATOM 2135 N GLY A 743 33.079 -1.687 -16.377 1.00 29.64 N ATOM 2136 CA GLY A 743 33.796 -1.476 -15.126 1.00 27.86 C ATOM 2137 C GLY A 743 32.946 -1.348 -13.879 1.00 30.07 C ATOM 2138 O GLY A 743 33.456 -0.909 -12.846 1.00 31.14 O ATOM 2139 H GLY A 743 32.757 -2.648 -16.610 1.00 0.00 H ATOM 2140 N ARG A 744 31.663 -1.727 -13.941 1.00 26.20 N ATOM 2141 CA ARG A 744 30.768 -1.651 -12.787 1.00 26.69 C ATOM 2142 C ARG A 744 31.176 -2.638 -11.688 1.00 31.32 C ATOM 2143 O ARG A 744 31.526 -3.772 -11.963 1.00 31.38 O ATOM 2144 CB ARG A 744 29.305 -1.851 -13.158 1.00 26.52 C ATOM 2145 CG ARG A 744 28.404 -1.293 -12.065 1.00 31.73 C ATOM 2146 CD ARG A 744 26.988 -1.086 -12.492 1.00 38.51 C ATOM 2147 NE ARG A 744 26.898 -0.357 -13.755 1.00 36.26 N ATOM 2148 CZ ARG A 744 25.747 0.007 -14.305 1.00 53.27 C ATOM 2149 NH1 ARG A 744 24.600 -0.261 -13.698 1.00 41.60 N ATOM 2150 NH2 ARG A 744 25.734 0.646 -15.465 1.00 47.25 N ATOM 2151 HE ARG A 744 27.780 -0.111 -14.247 1.00 0.00 H ATOM 2152 HH12 ARG A 744 23.701 0.027 -14.134 1.00 0.00 H ATOM 2153 HH11 ARG A 744 24.599 -0.759 -12.785 1.00 0.00 H ATOM 2154 HH22 ARG A 744 24.829 0.929 -15.892 1.00 0.00 H ATOM 2155 HH21 ARG A 744 26.629 0.864 -15.948 1.00 0.00 H ATOM 2156 H ARG A 744 31.290 -2.088 -14.842 1.00 0.00 H ATOM 2157 N GLU A 745 31.111 -2.202 -10.455 1.00 27.58 N ATOM 2158 CA GLU A 745 31.524 -3.041 -9.354 1.00 27.94 C ATOM 2159 C GLU A 745 30.323 -3.515 -8.537 1.00 30.67 C ATOM 2160 O GLU A 745 29.358 -2.765 -8.345 1.00 31.54 O ATOM 2161 CB GLU A 745 32.610 -2.249 -8.560 1.00 29.91 C ATOM 2162 CG GLU A 745 32.619 -2.343 -7.051 1.00 41.46 C ATOM 2163 CD GLU A 745 33.323 -1.163 -6.402 1.00 54.42 C ATOM 2164 OE1 GLU A 745 34.573 -1.173 -6.388 1.00 41.45 O ATOM 2165 OE2 GLU A 745 32.637 -0.235 -5.911 1.00 40.51 O ATOM 2166 H GLU A 745 30.758 -1.242 -10.266 1.00 0.00 H ATOM 2167 N LEU A 746 30.360 -4.777 -8.083 1.00 25.65 N ATOM 2168 CA LEU A 746 29.296 -5.321 -7.224 1.00 25.03 C ATOM 2169 C LEU A 746 29.305 -4.493 -5.930 1.00 28.26 C ATOM 2170 O LEU A 746 30.384 -4.159 -5.453 1.00 26.64 O ATOM 2171 CB LEU A 746 29.578 -6.812 -6.894 1.00 24.39 C ATOM 2172 CG LEU A 746 29.374 -7.825 -8.029 1.00 26.23 C ATOM 2173 CD1 LEU A 746 30.054 -9.150 -7.690 1.00 25.36 C ATOM 2174 CD2 LEU A 746 27.904 -8.055 -8.291 1.00 26.33 C ATOM 2175 H LEU A 746 31.161 -5.386 -8.345 1.00 0.00 H ATOM 2176 N GLU A 747 28.126 -4.166 -5.378 1.00 26.92 N ATOM 2177 CA GLU A 747 27.978 -3.365 -4.146 1.00 27.88 C ATOM 2178 C GLU A 747 28.440 -4.132 -2.927 1.00 32.34 C ATOM 2179 O GLU A 747 28.388 -5.371 -2.920 1.00 32.15 O ATOM 2180 CB GLU A 747 26.505 -2.943 -3.918 1.00 29.74 C ATOM 2181 CG GLU A 747 25.809 -2.252 -5.087 1.00 47.73 C ATOM 2182 CD GLU A 747 26.195 -0.818 -5.422 1.00 80.69 C ATOM 2183 OE1 GLU A 747 25.317 -0.082 -5.927 1.00 84.79 O ATOM 2184 OE2 GLU A 747 27.366 -0.430 -5.199 1.00 75.18 O ATOM 2185 H GLU A 747 27.260 -4.498 -5.849 1.00 0.00 H ATOM 2186 N ARG A 748 28.850 -3.410 -1.871 1.00 28.34 N ATOM 2187 CA ARG A 748 29.266 -4.075 -0.647 1.00 27.77 C ATOM 2188 C ARG A 748 28.076 -4.762 0.025 1.00 32.72 C ATOM 2189 O ARG A 748 27.055 -4.121 0.284 1.00 33.29 O ATOM 2190 CB ARG A 748 29.938 -3.106 0.331 1.00 28.30 C ATOM 2191 CG ARG A 748 30.438 -3.804 1.617 1.00 33.60 C ATOM 2192 CD ARG A 748 31.159 -2.882 2.601 1.00 39.83 C ATOM 2193 NE ARG A 748 30.338 -1.760 3.059 1.00 49.93 N ATOM 2194 CZ ARG A 748 29.461 -1.814 4.063 1.00 72.66 C ATOM 2195 NH1 ARG A 748 29.261 -2.953 4.722 1.00 56.48 N ATOM 2196 NH2 ARG A 748 28.765 -0.737 4.403 1.00 62.22 N ATOM 2197 HE ARG A 748 30.447 -0.852 2.564 1.00 0.00 H ATOM 2198 HH12 ARG A 748 28.576 -2.988 5.504 1.00 0.00 H ATOM 2199 HH11 ARG A 748 29.790 -3.808 4.455 1.00 0.00 H ATOM 2200 HH22 ARG A 748 28.083 -0.785 5.186 1.00 0.00 H ATOM 2201 HH21 ARG A 748 28.902 0.155 3.886 1.00 0.00 H ATOM 2202 H ARG A 748 28.870 -2.372 -1.929 1.00 0.00 H ATOM 2203 N PRO A 749 28.173 -6.073 0.306 1.00 28.84 N ATOM 2204 CA PRO A 749 27.058 -6.742 0.996 1.00 28.99 C ATOM 2205 C PRO A 749 26.886 -6.165 2.413 1.00 33.53 C ATOM 2206 O PRO A 749 27.866 -5.770 3.052 1.00 32.16 O ATOM 2207 CB PRO A 749 27.520 -8.205 1.073 1.00 30.10 C ATOM 2208 CG PRO A 749 28.561 -8.338 -0.044 1.00 33.63 C ATOM 2209 CD PRO A 749 29.273 -7.016 0.008 1.00 29.44 C ATOM 2210 N ARG A 750 25.644 -6.134 2.891 1.00 32.61 N ATOM 2211 CA ARG A 750 25.221 -5.688 4.227 1.00 34.17 C ATOM 2212 C ARG A 750 26.081 -6.350 5.319 1.00 38.54 C ATOM 2213 O ARG A 750 26.557 -5.650 6.223 1.00 38.71 O ATOM 2214 CB ARG A 750 23.738 -6.072 4.410 1.00 38.22 C ATOM 2215 CG ARG A 750 23.045 -5.525 5.655 1.00 59.80 C ATOM 2216 CD ARG A 750 21.531 -5.641 5.544 1.00 77.06 C ATOM 2217 NE ARG A 750 20.966 -4.585 4.696 1.00 98.45 N ATOM 2218 CZ ARG A 750 20.598 -4.743 3.426 1.00118.13 C ATOM 2219 NH1 ARG A 750 20.720 -5.925 2.831 1.00106.58 N ATOM 2220 NH2 ARG A 750 20.103 -3.720 2.741 1.00106.76 N ATOM 2221 HE ARG A 750 20.844 -3.643 5.119 1.00 0.00 H ATOM 2222 HH12 ARG A 750 20.430 -6.040 1.839 1.00 0.00 H ATOM 2223 HH11 ARG A 750 21.105 -6.735 3.358 1.00 0.00 H ATOM 2224 HH22 ARG A 750 19.817 -3.848 1.749 1.00 0.00 H ATOM 2225 HH21 ARG A 750 20.001 -2.790 3.196 1.00 0.00 H ATOM 2226 H ARG A 750 24.892 -6.460 2.251 1.00 0.00 H ATOM 2227 N ALA A 751 26.317 -7.687 5.220 1.00 33.95 N ATOM 2228 CA ALA A 751 27.120 -8.431 6.216 1.00 33.65 C ATOM 2229 C ALA A 751 28.644 -8.372 5.964 1.00 37.54 C ATOM 2230 O ALA A 751 29.432 -8.952 6.727 1.00 36.98 O ATOM 2231 CB ALA A 751 26.652 -9.888 6.288 1.00 34.38 C ATOM 2232 H ALA A 751 25.917 -8.206 4.412 1.00 0.00 H ATOM 2233 N CYS A 752 29.071 -7.666 4.913 1.00 32.28 N ATOM 2234 CA CYS A 752 30.493 -7.602 4.607 1.00 31.40 C ATOM 2235 C CYS A 752 31.230 -6.441 5.337 1.00 35.22 C ATOM 2236 O CYS A 752 30.915 -5.279 5.073 1.00 33.94 O ATOM 2237 CB CYS A 752 30.691 -7.542 3.093 1.00 30.96 C ATOM 2238 SG CYS A 752 32.408 -7.383 2.572 1.00 34.08 S ATOM 2239 H CYS A 752 28.387 -7.162 4.313 1.00 0.00 H ATOM 2240 N PRO A 753 32.216 -6.727 6.239 1.00 30.85 N ATOM 2241 CA PRO A 753 32.968 -5.620 6.884 1.00 30.73 C ATOM 2242 C PRO A 753 33.757 -4.833 5.822 1.00 34.68 C ATOM 2243 O PRO A 753 34.112 -5.436 4.810 1.00 33.60 O ATOM 2244 CB PRO A 753 33.950 -6.347 7.824 1.00 32.49 C ATOM 2245 CG PRO A 753 33.409 -7.734 7.967 1.00 36.88 C ATOM 2246 CD PRO A 753 32.736 -8.044 6.662 1.00 31.61 C ATOM 2247 N PRO A 754 34.038 -3.512 6.012 1.00 32.60 N ATOM 2248 CA PRO A 754 34.786 -2.748 4.976 1.00 31.67 C ATOM 2249 C PRO A 754 36.131 -3.359 4.588 1.00 33.35 C ATOM 2250 O PRO A 754 36.501 -3.288 3.422 1.00 32.39 O ATOM 2251 CB PRO A 754 34.963 -1.351 5.598 1.00 33.16 C ATOM 2252 CG PRO A 754 33.916 -1.256 6.652 1.00 38.39 C ATOM 2253 CD PRO A 754 33.678 -2.652 7.168 1.00 34.09 C ATOM 2254 N GLU A 755 36.846 -3.973 5.543 1.00 28.81 N ATOM 2255 CA GLU A 755 38.124 -4.613 5.251 1.00 30.23 C ATOM 2256 C GLU A 755 37.979 -5.822 4.303 1.00 33.21 C ATOM 2257 O GLU A 755 38.889 -6.086 3.518 1.00 32.15 O ATOM 2258 CB GLU A 755 38.903 -4.967 6.530 1.00 32.39 C ATOM 2259 CG GLU A 755 38.082 -5.725 7.566 1.00 51.14 C ATOM 2260 CD GLU A 755 37.431 -4.919 8.676 1.00 73.23 C ATOM 2261 OE1 GLU A 755 36.775 -3.890 8.385 1.00 45.78 O ATOM 2262 OE2 GLU A 755 37.565 -5.340 9.848 1.00 76.55 O ATOM 2263 H GLU A 755 36.480 -3.993 6.516 1.00 0.00 H ATOM 2264 N VAL A 756 36.827 -6.523 4.330 1.00 30.04 N ATOM 2265 CA VAL A 756 36.628 -7.668 3.425 1.00 28.41 C ATOM 2266 C VAL A 756 36.307 -7.131 2.007 1.00 31.96 C ATOM 2267 O VAL A 756 36.770 -7.693 1.016 1.00 30.87 O ATOM 2268 CB VAL A 756 35.613 -8.737 3.947 1.00 30.97 C ATOM 2269 CG1 VAL A 756 35.410 -9.865 2.923 1.00 30.27 C ATOM 2270 CG2 VAL A 756 36.053 -9.317 5.293 1.00 29.61 C ATOM 2271 H VAL A 756 36.074 -6.253 4.995 1.00 0.00 H ATOM 2272 N TYR A 757 35.539 -6.034 1.924 1.00 29.39 N ATOM 2273 CA TYR A 757 35.183 -5.391 0.659 1.00 27.62 C ATOM 2274 C TYR A 757 36.429 -4.830 -0.021 1.00 30.43 C ATOM 2275 O TYR A 757 36.529 -4.906 -1.244 1.00 29.97 O ATOM 2276 CB TYR A 757 34.123 -4.307 0.875 1.00 28.56 C ATOM 2277 CG TYR A 757 33.496 -3.793 -0.410 1.00 27.05 C ATOM 2278 CD1 TYR A 757 32.908 -4.670 -1.324 1.00 27.04 C ATOM 2279 CD2 TYR A 757 33.444 -2.433 -0.686 1.00 27.25 C ATOM 2280 CE1 TYR A 757 32.337 -4.205 -2.502 1.00 26.26 C ATOM 2281 CE2 TYR A 757 32.840 -1.952 -1.845 1.00 27.57 C ATOM 2282 CZ TYR A 757 32.310 -2.845 -2.761 1.00 32.93 C ATOM 2283 OH TYR A 757 31.724 -2.372 -3.905 1.00 32.48 O ATOM 2284 HH TYR A 757 31.399 -3.134 -4.447 1.00 0.00 H ATOM 2285 H TYR A 757 35.177 -5.618 2.806 1.00 0.00 H ATOM 2286 N ALA A 758 37.408 -4.331 0.767 1.00 28.29 N ATOM 2287 CA ALA A 758 38.698 -3.842 0.250 1.00 27.92 C ATOM 2288 C ALA A 758 39.456 -5.031 -0.400 1.00 29.74 C ATOM 2289 O ALA A 758 40.082 -4.848 -1.433 1.00 28.30 O ATOM 2290 CB ALA A 758 39.534 -3.231 1.374 1.00 28.50 C ATOM 2291 H ALA A 758 37.241 -4.290 1.793 1.00 0.00 H ATOM 2292 N ILE A 759 39.384 -6.243 0.194 1.00 26.56 N ATOM 2293 CA ILE A 759 40.009 -7.451 -0.384 1.00 26.56 C ATOM 2294 C ILE A 759 39.304 -7.767 -1.724 1.00 28.96 C ATOM 2295 O ILE A 759 39.990 -8.073 -2.695 1.00 29.67 O ATOM 2296 CB ILE A 759 40.003 -8.668 0.584 1.00 29.81 C ATOM 2297 CG1 ILE A 759 40.849 -8.376 1.845 1.00 30.27 C ATOM 2298 CG2 ILE A 759 40.470 -9.993 -0.119 1.00 28.46 C ATOM 2299 CD1 ILE A 759 40.494 -9.261 3.080 1.00 32.23 C ATOM 2300 H ILE A 759 38.868 -6.329 1.093 1.00 0.00 H ATOM 2301 N MET A 760 37.953 -7.662 -1.782 1.00 24.65 N ATOM 2302 CA MET A 760 37.214 -7.915 -3.034 1.00 24.38 C ATOM 2303 C MET A 760 37.707 -6.959 -4.126 1.00 27.82 C ATOM 2304 O MET A 760 38.030 -7.398 -5.225 1.00 26.31 O ATOM 2305 CB MET A 760 35.708 -7.745 -2.850 1.00 25.99 C ATOM 2306 CG MET A 760 35.043 -8.806 -1.988 1.00 28.35 C ATOM 2307 SD MET A 760 33.282 -8.393 -1.908 1.00 31.11 S ATOM 2308 CE MET A 760 32.832 -9.211 -0.438 1.00 27.63 C ATOM 2309 H MET A 760 37.426 -7.397 -0.925 1.00 0.00 H ATOM 2310 N ARG A 761 37.809 -5.650 -3.800 1.00 27.54 N ATOM 2311 CA ARG A 761 38.272 -4.601 -4.720 1.00 27.08 C ATOM 2312 C ARG A 761 39.706 -4.874 -5.204 1.00 29.35 C ATOM 2313 O ARG A 761 40.025 -4.600 -6.362 1.00 28.98 O ATOM 2314 CB ARG A 761 38.105 -3.204 -4.111 1.00 26.27 C ATOM 2315 CG ARG A 761 36.658 -2.752 -4.059 1.00 29.92 C ATOM 2316 CD ARG A 761 36.496 -1.474 -3.256 1.00 25.21 C ATOM 2317 NE ARG A 761 35.436 -0.622 -3.804 1.00 29.57 N ATOM 2318 CZ ARG A 761 34.960 0.476 -3.229 1.00 43.11 C ATOM 2319 NH1 ARG A 761 35.428 0.879 -2.051 1.00 24.57 N ATOM 2320 NH2 ARG A 761 34.003 1.172 -3.817 1.00 28.59 N ATOM 2321 HE ARG A 761 35.024 -0.900 -4.717 1.00 0.00 H ATOM 2322 HH12 ARG A 761 35.049 1.740 -1.608 1.00 0.00 H ATOM 2323 HH11 ARG A 761 36.173 0.333 -1.573 1.00 0.00 H ATOM 2324 HH22 ARG A 761 33.632 2.032 -3.364 1.00 0.00 H ATOM 2325 HH21 ARG A 761 33.621 0.860 -4.733 1.00 0.00 H ATOM 2326 H ARG A 761 37.542 -5.367 -2.835 1.00 0.00 H ATOM 2327 N GLY A 762 40.531 -5.465 -4.347 1.00 25.58 N ATOM 2328 CA GLY A 762 41.889 -5.848 -4.718 1.00 25.26 C ATOM 2329 C GLY A 762 41.897 -6.935 -5.789 1.00 30.00 C ATOM 2330 O GLY A 762 42.778 -6.946 -6.648 1.00 29.85 O ATOM 2331 H GLY A 762 40.198 -5.661 -3.381 1.00 0.00 H ATOM 2332 N CYS A 763 40.894 -7.853 -5.760 1.00 26.42 N ATOM 2333 CA CYS A 763 40.749 -8.955 -6.730 1.00 26.50 C ATOM 2334 C CYS A 763 40.171 -8.430 -8.048 1.00 30.40 C ATOM 2335 O CYS A 763 40.286 -9.096 -9.076 1.00 29.98 O ATOM 2336 CB CYS A 763 39.833 -10.046 -6.171 1.00 25.99 C ATOM 2337 SG CYS A 763 40.456 -10.870 -4.685 1.00 29.62 S ATOM 2338 H CYS A 763 40.183 -7.773 -5.005 1.00 0.00 H ATOM 2339 N TRP A 764 39.483 -7.285 -7.984 1.00 24.89 N ATOM 2340 CA TRP A 764 38.760 -6.690 -9.092 1.00 23.93 C ATOM 2341 C TRP A 764 39.445 -5.542 -9.808 1.00 28.91 C ATOM 2342 O TRP A 764 38.753 -4.757 -10.449 1.00 28.14 O ATOM 2343 CB TRP A 764 37.380 -6.251 -8.601 1.00 22.53 C ATOM 2344 CG TRP A 764 36.503 -7.370 -8.116 1.00 23.20 C ATOM 2345 CD1 TRP A 764 36.594 -8.699 -8.433 1.00 25.61 C ATOM 2346 CD2 TRP A 764 35.371 -7.237 -7.247 1.00 23.05 C ATOM 2347 NE1 TRP A 764 35.613 -9.407 -7.777 1.00 24.33 N ATOM 2348 CE2 TRP A 764 34.842 -8.534 -7.048 1.00 25.32 C ATOM 2349 CE3 TRP A 764 34.765 -6.143 -6.589 1.00 23.85 C ATOM 2350 CZ2 TRP A 764 33.709 -8.763 -6.268 1.00 24.65 C ATOM 2351 CZ3 TRP A 764 33.645 -6.374 -5.808 1.00 25.19 C ATOM 2352 CH2 TRP A 764 33.124 -7.670 -5.655 1.00 26.04 C ATOM 2353 HE1 TRP A 764 35.477 -10.437 -7.825 1.00 0.00 H ATOM 2354 H TRP A 764 39.465 -6.784 -7.073 1.00 0.00 H ATOM 2355 N GLN A 765 40.786 -5.441 -9.735 1.00 26.90 N ATOM 2356 CA GLN A 765 41.490 -4.382 -10.465 1.00 27.44 C ATOM 2357 C GLN A 765 41.285 -4.687 -11.949 1.00 32.59 C ATOM 2358 O GLN A 765 41.302 -5.867 -12.330 1.00 30.18 O ATOM 2359 CB GLN A 765 42.993 -4.347 -10.092 1.00 28.37 C ATOM 2360 CG GLN A 765 43.250 -3.991 -8.602 1.00 32.78 C ATOM 2361 CD GLN A 765 42.693 -2.632 -8.204 1.00 43.71 C ATOM 2362 OE1 GLN A 765 42.956 -1.619 -8.850 1.00 42.30 O ATOM 2363 NE2 GLN A 765 41.898 -2.575 -7.138 1.00 35.71 N ATOM 2364 HE22 GLN A 765 41.685 -3.440 -6.602 1.00 0.00 H ATOM 2365 HE21 GLN A 765 41.490 -1.665 -6.841 1.00 0.00 H ATOM 2366 H GLN A 765 41.325 -6.118 -9.158 1.00 0.00 H ATOM 2367 N ARG A 766 41.023 -3.644 -12.776 1.00 29.38 N ATOM 2368 CA ARG A 766 40.768 -3.824 -14.199 1.00 29.09 C ATOM 2369 C ARG A 766 41.908 -4.561 -14.914 1.00 31.78 C ATOM 2370 O ARG A 766 41.647 -5.507 -15.635 1.00 31.24 O ATOM 2371 CB ARG A 766 40.413 -2.485 -14.893 1.00 30.85 C ATOM 2372 CG ARG A 766 39.804 -2.688 -16.288 1.00 35.74 C ATOM 2373 CD ARG A 766 39.067 -1.449 -16.766 1.00 47.27 C ATOM 2374 NE ARG A 766 38.532 -1.596 -18.123 1.00 47.41 N ATOM 2375 CZ ARG A 766 37.335 -2.092 -18.414 1.00 51.31 C ATOM 2376 NH1 ARG A 766 36.526 -2.506 -17.448 1.00 31.05 N ATOM 2377 NH2 ARG A 766 36.939 -2.183 -19.674 1.00 42.48 N ATOM 2378 HE ARG A 766 39.133 -1.290 -18.915 1.00 0.00 H ATOM 2379 HH12 ARG A 766 35.590 -2.893 -17.684 1.00 0.00 H ATOM 2380 HH11 ARG A 766 36.828 -2.443 -16.455 1.00 0.00 H ATOM 2381 HH22 ARG A 766 36.001 -2.572 -19.897 1.00 0.00 H ATOM 2382 HH21 ARG A 766 37.566 -1.865 -20.440 1.00 0.00 H ATOM 2383 H ARG A 766 41.004 -2.682 -12.380 1.00 0.00 H ATOM 2384 N GLU A 767 43.152 -4.148 -14.699 1.00 29.08 N ATOM 2385 CA GLU A 767 44.305 -4.794 -15.325 1.00 29.13 C ATOM 2386 C GLU A 767 44.643 -6.074 -14.562 1.00 32.95 C ATOM 2387 O GLU A 767 44.894 -5.995 -13.358 1.00 32.49 O ATOM 2388 CB GLU A 767 45.551 -3.874 -15.331 1.00 29.78 C ATOM 2389 CG GLU A 767 45.336 -2.535 -16.022 1.00 29.75 C ATOM 2390 CD GLU A 767 46.463 -1.600 -15.656 1.00 42.60 C ATOM 2391 OE1 GLU A 767 46.349 -0.919 -14.613 1.00 36.03 O ATOM 2392 OE2 GLU A 767 47.478 -1.576 -16.384 1.00 38.47 O ATOM 2393 H GLU A 767 43.311 -3.339 -14.065 1.00 0.00 H ATOM 2394 N PRO A 768 44.686 -7.233 -15.261 1.00 30.08 N ATOM 2395 CA PRO A 768 45.030 -8.508 -14.594 1.00 28.64 C ATOM 2396 C PRO A 768 46.288 -8.479 -13.719 1.00 31.01 C ATOM 2397 O PRO A 768 46.233 -8.979 -12.597 1.00 26.95 O ATOM 2398 CB PRO A 768 45.161 -9.490 -15.768 1.00 29.58 C ATOM 2399 CG PRO A 768 44.285 -8.949 -16.805 1.00 34.39 C ATOM 2400 CD PRO A 768 44.387 -7.451 -16.699 1.00 30.74 C ATOM 2401 N GLN A 769 47.388 -7.846 -14.188 1.00 29.00 N ATOM 2402 CA GLN A 769 48.660 -7.740 -13.446 1.00 29.65 C ATOM 2403 C GLN A 769 48.590 -6.849 -12.159 1.00 30.95 C ATOM 2404 O GLN A 769 49.456 -6.964 -11.293 1.00 29.97 O ATOM 2405 CB GLN A 769 49.819 -7.289 -14.380 1.00 32.10 C ATOM 2406 CG GLN A 769 49.713 -5.838 -14.896 1.00 52.46 C ATOM 2407 CD GLN A 769 48.859 -5.604 -16.143 1.00 67.22 C ATOM 2408 OE1 GLN A 769 47.994 -6.417 -16.563 1.00 42.59 O ATOM 2409 NE2 GLN A 769 49.093 -4.449 -16.763 1.00 68.88 N ATOM 2410 HE22 GLN A 769 49.814 -3.797 -16.393 1.00 0.00 H ATOM 2411 HE21 GLN A 769 48.555 -4.199 -17.617 1.00 0.00 H ATOM 2412 H GLN A 769 47.334 -7.407 -15.129 1.00 0.00 H ATOM 2413 N GLN A 770 47.563 -5.997 -12.035 1.00 27.29 N ATOM 2414 CA GLN A 770 47.359 -5.117 -10.881 1.00 26.90 C ATOM 2415 C GLN A 770 46.559 -5.805 -9.758 1.00 30.86 C ATOM 2416 O GLN A 770 46.506 -5.292 -8.646 1.00 29.23 O ATOM 2417 CB GLN A 770 46.633 -3.823 -11.325 1.00 27.29 C ATOM 2418 CG GLN A 770 47.565 -2.786 -11.961 1.00 32.92 C ATOM 2419 CD GLN A 770 48.486 -2.181 -10.927 1.00 48.31 C ATOM 2420 OE1 GLN A 770 49.694 -2.362 -10.987 1.00 42.11 O ATOM 2421 NE2 GLN A 770 47.933 -1.467 -9.943 1.00 41.72 N ATOM 2422 HE22 GLN A 770 46.903 -1.329 -9.917 1.00 0.00 H ATOM 2423 HE21 GLN A 770 48.533 -1.049 -9.203 1.00 0.00 H ATOM 2424 H GLN A 770 46.867 -5.958 -12.807 1.00 0.00 H ATOM 2425 N ARG A 771 45.911 -6.938 -10.059 1.00 28.36 N ATOM 2426 CA ARG A 771 45.109 -7.667 -9.072 1.00 28.17 C ATOM 2427 C ARG A 771 46.005 -8.280 -7.997 1.00 31.51 C ATOM 2428 O ARG A 771 47.106 -8.700 -8.307 1.00 28.64 O ATOM 2429 CB ARG A 771 44.254 -8.763 -9.753 1.00 28.03 C ATOM 2430 CG ARG A 771 43.255 -8.213 -10.748 1.00 27.93 C ATOM 2431 CD ARG A 771 42.449 -9.249 -11.522 1.00 21.73 C ATOM 2432 NE ARG A 771 41.832 -8.551 -12.647 1.00 22.46 N ATOM 2433 CZ ARG A 771 41.522 -9.079 -13.821 1.00 35.28 C ATOM 2434 NH1 ARG A 771 41.697 -10.379 -14.039 1.00 25.32 N ATOM 2435 NH2 ARG A 771 41.013 -8.318 -14.781 1.00 20.90 N ATOM 2436 HE ARG A 771 41.615 -7.543 -12.513 1.00 0.00 H ATOM 2437 HH12 ARG A 771 41.452 -10.789 -14.963 1.00 0.00 H ATOM 2438 HH11 ARG A 771 42.079 -10.986 -13.286 1.00 0.00 H ATOM 2439 HH22 ARG A 771 40.771 -8.736 -15.702 1.00 0.00 H ATOM 2440 HH21 ARG A 771 40.856 -7.304 -14.613 1.00 0.00 H ATOM 2441 H ARG A 771 45.979 -7.313 -11.026 1.00 0.00 H ATOM 2442 N HIS A 772 45.533 -8.325 -6.734 1.00 31.42 N ATOM 2443 CA HIS A 772 46.286 -8.936 -5.629 1.00 33.01 C ATOM 2444 C HIS A 772 46.549 -10.423 -5.924 1.00 34.62 C ATOM 2445 O HIS A 772 45.747 -11.070 -6.612 1.00 33.18 O ATOM 2446 CB HIS A 772 45.486 -8.843 -4.312 1.00 35.55 C ATOM 2447 CG HIS A 772 45.368 -7.470 -3.707 1.00 41.15 C ATOM 2448 ND1 HIS A 772 46.096 -6.381 -4.192 1.00 44.18 N ATOM 2449 CD2 HIS A 772 44.592 -7.050 -2.675 1.00 44.56 C ATOM 2450 CE1 HIS A 772 45.735 -5.347 -3.447 1.00 43.95 C ATOM 2451 NE2 HIS A 772 44.838 -5.698 -2.518 1.00 44.62 N ATOM 2452 H HIS A 772 44.600 -7.911 -6.534 1.00 0.00 H ATOM 2453 N SER A 773 47.667 -10.973 -5.428 1.00 29.96 N ATOM 2454 CA SER A 773 47.911 -12.396 -5.656 1.00 29.02 C ATOM 2455 C SER A 773 46.996 -13.175 -4.692 1.00 30.19 C ATOM 2456 O SER A 773 46.638 -12.641 -3.650 1.00 28.31 O ATOM 2457 CB SER A 773 49.360 -12.752 -5.365 1.00 30.73 C ATOM 2458 OG SER A 773 49.627 -12.546 -3.993 1.00 35.23 O ATOM 2459 HG SER A 773 49.030 -13.121 -3.452 1.00 0.00 H ATOM 2460 H SER A 773 48.347 -10.398 -4.891 1.00 0.00 H ATOM 2461 N ILE A 774 46.653 -14.435 -5.024 1.00 27.85 N ATOM 2462 CA ILE A 774 45.816 -15.285 -4.171 1.00 27.78 C ATOM 2463 C ILE A 774 46.530 -15.569 -2.832 1.00 33.18 C ATOM 2464 O ILE A 774 45.861 -15.689 -1.799 1.00 31.65 O ATOM 2465 CB ILE A 774 45.302 -16.564 -4.918 1.00 30.55 C ATOM 2466 CG1 ILE A 774 44.219 -17.303 -4.109 1.00 30.74 C ATOM 2467 CG2 ILE A 774 46.447 -17.505 -5.359 1.00 30.19 C ATOM 2468 CD1 ILE A 774 42.871 -16.514 -3.889 1.00 28.73 C ATOM 2469 H ILE A 774 46.997 -14.822 -5.926 1.00 0.00 H ATOM 2470 N LYS A 775 47.891 -15.616 -2.841 1.00 31.09 N ATOM 2471 CA LYS A 775 48.670 -15.826 -1.616 1.00 30.83 C ATOM 2472 C LYS A 775 48.453 -14.675 -0.631 1.00 32.32 C ATOM 2473 O LYS A 775 48.301 -14.926 0.566 1.00 30.76 O ATOM 2474 CB LYS A 775 50.169 -15.962 -1.931 1.00 36.11 C ATOM 2475 CG LYS A 775 50.610 -17.397 -2.172 1.00 63.36 C ATOM 2476 CD LYS A 775 52.132 -17.515 -2.251 1.00 77.43 C ATOM 2477 CE LYS A 775 52.598 -18.927 -2.538 1.00 93.12 C ATOM 2478 NZ LYS A 775 52.433 -19.830 -1.364 1.00106.45 N ATOM 2479 HZ1 LYS A 775 52.990 -19.464 -0.566 1.00 0.00 H ATOM 2480 HZ2 LYS A 775 51.428 -19.871 -1.098 1.00 0.00 H ATOM 2481 HZ3 LYS A 775 52.766 -20.783 -1.612 1.00 0.00 H ATOM 2482 H LYS A 775 48.393 -15.499 -3.744 1.00 0.00 H ATOM 2483 N ASP A 776 48.451 -13.410 -1.124 1.00 30.33 N ATOM 2484 CA ASP A 776 48.227 -12.242 -0.256 1.00 30.27 C ATOM 2485 C ASP A 776 46.776 -12.179 0.198 1.00 32.08 C ATOM 2486 O ASP A 776 46.527 -11.852 1.351 1.00 31.77 O ATOM 2487 CB ASP A 776 48.636 -10.936 -0.951 1.00 33.27 C ATOM 2488 CG ASP A 776 50.135 -10.819 -1.213 1.00 52.68 C ATOM 2489 OD1 ASP A 776 50.919 -11.568 -0.574 1.00 55.45 O ATOM 2490 OD2 ASP A 776 50.525 -9.980 -2.041 1.00 58.03 O ATOM 2491 H ASP A 776 48.612 -13.262 -2.141 1.00 0.00 H ATOM 2492 N VAL A 777 45.819 -12.503 -0.710 1.00 26.81 N ATOM 2493 CA VAL A 777 44.396 -12.531 -0.384 1.00 25.93 C ATOM 2494 C VAL A 777 44.200 -13.556 0.766 1.00 29.41 C ATOM 2495 O VAL A 777 43.607 -13.218 1.781 1.00 28.00 O ATOM 2496 CB VAL A 777 43.523 -12.859 -1.630 1.00 28.79 C ATOM 2497 CG1 VAL A 777 42.111 -13.282 -1.220 1.00 27.68 C ATOM 2498 CG2 VAL A 777 43.475 -11.662 -2.598 1.00 28.35 C ATOM 2499 H VAL A 777 46.112 -12.741 -1.679 1.00 0.00 H ATOM 2500 N HIS A 778 44.729 -14.783 0.609 1.00 28.31 N ATOM 2501 CA HIS A 778 44.634 -15.825 1.632 1.00 30.01 C ATOM 2502 C HIS A 778 45.235 -15.366 2.975 1.00 35.68 C ATOM 2503 O HIS A 778 44.587 -15.520 4.019 1.00 34.84 O ATOM 2504 CB HIS A 778 45.310 -17.122 1.155 1.00 31.88 C ATOM 2505 CG HIS A 778 45.381 -18.163 2.220 1.00 36.24 C ATOM 2506 ND1 HIS A 778 44.235 -18.754 2.727 1.00 38.06 N ATOM 2507 CD2 HIS A 778 46.453 -18.637 2.895 1.00 38.98 C ATOM 2508 CE1 HIS A 778 44.649 -19.590 3.661 1.00 38.24 C ATOM 2509 NE2 HIS A 778 45.974 -19.562 3.796 1.00 38.86 N ATOM 2510 H HIS A 778 45.227 -15.000 -0.278 1.00 0.00 H ATOM 2511 N ALA A 779 46.460 -14.773 2.940 1.00 32.57 N ATOM 2512 CA ALA A 779 47.141 -14.276 4.137 1.00 31.83 C ATOM 2513 C ALA A 779 46.277 -13.235 4.849 1.00 34.52 C ATOM 2514 O ALA A 779 46.141 -13.292 6.066 1.00 34.36 O ATOM 2515 CB ALA A 779 48.503 -13.688 3.777 1.00 32.20 C ATOM 2516 H ALA A 779 46.934 -14.668 2.020 1.00 0.00 H ATOM 2517 N ARG A 780 45.655 -12.320 4.094 1.00 31.52 N ATOM 2518 CA ARG A 780 44.801 -11.292 4.686 1.00 31.94 C ATOM 2519 C ARG A 780 43.503 -11.889 5.294 1.00 35.95 C ATOM 2520 O ARG A 780 43.087 -11.459 6.364 1.00 35.52 O ATOM 2521 CB ARG A 780 44.530 -10.153 3.689 1.00 35.09 C ATOM 2522 CG ARG A 780 43.805 -8.956 4.307 1.00 57.03 C ATOM 2523 CD ARG A 780 44.682 -8.020 5.136 1.00 74.48 C ATOM 2524 NE ARG A 780 43.942 -7.373 6.227 1.00 82.71 N ATOM 2525 CZ ARG A 780 43.115 -6.339 6.077 1.00 97.36 C ATOM 2526 NH1 ARG A 780 42.891 -5.827 4.872 1.00 87.69 N ATOM 2527 NH2 ARG A 780 42.498 -5.818 7.129 1.00 81.35 N ATOM 2528 HE ARG A 780 44.073 -7.750 7.188 1.00 0.00 H ATOM 2529 HH12 ARG A 780 42.244 -5.020 4.762 1.00 0.00 H ATOM 2530 HH11 ARG A 780 43.362 -6.233 4.039 1.00 0.00 H ATOM 2531 HH22 ARG A 780 41.853 -5.011 7.007 1.00 0.00 H ATOM 2532 HH21 ARG A 780 42.659 -6.216 8.076 1.00 0.00 H ATOM 2533 H ARG A 780 45.783 -12.341 3.062 1.00 0.00 H ATOM 2534 N LEU A 781 42.899 -12.893 4.635 1.00 31.77 N ATOM 2535 CA LEU A 781 41.693 -13.561 5.141 1.00 30.80 C ATOM 2536 C LEU A 781 42.010 -14.308 6.433 1.00 36.82 C ATOM 2537 O LEU A 781 41.235 -14.221 7.391 1.00 36.95 O ATOM 2538 CB LEU A 781 41.076 -14.490 4.091 1.00 29.80 C ATOM 2539 CG LEU A 781 40.353 -13.767 2.950 1.00 32.62 C ATOM 2540 CD1 LEU A 781 40.087 -14.724 1.803 1.00 32.24 C ATOM 2541 CD2 LEU A 781 39.070 -13.021 3.449 1.00 28.24 C ATOM 2542 H LEU A 781 43.302 -13.210 3.730 1.00 0.00 H ATOM 2543 N GLN A 782 43.170 -14.994 6.463 1.00 35.25 N ATOM 2544 CA GLN A 782 43.698 -15.724 7.626 1.00 36.54 C ATOM 2545 C GLN A 782 43.965 -14.774 8.808 1.00 42.41 C ATOM 2546 O GLN A 782 43.615 -15.120 9.926 1.00 43.11 O ATOM 2547 CB GLN A 782 44.970 -16.499 7.262 1.00 38.07 C ATOM 2548 CG GLN A 782 44.811 -18.003 7.400 1.00 56.09 C ATOM 2549 CD GLN A 782 46.118 -18.760 7.243 1.00 84.75 C ATOM 2550 OE1 GLN A 782 47.151 -18.222 6.806 1.00 82.69 O ATOM 2551 NE2 GLN A 782 46.099 -20.043 7.595 1.00 73.27 N ATOM 2552 HE22 GLN A 782 45.223 -20.470 7.958 1.00 0.00 H ATOM 2553 HE21 GLN A 782 46.960 -20.619 7.507 1.00 0.00 H ATOM 2554 H GLN A 782 43.739 -15.008 5.592 1.00 0.00 H ATOM 2555 N ALA A 783 44.540 -13.576 8.558 1.00 39.93 N ATOM 2556 CA ALA A 783 44.799 -12.560 9.585 1.00 39.30 C ATOM 2557 C ALA A 783 43.476 -12.064 10.186 1.00 41.55 C ATOM 2558 O ALA A 783 43.369 -11.954 11.405 1.00 40.63 O ATOM 2559 CB ALA A 783 45.566 -11.385 8.993 1.00 40.12 C ATOM 2560 H ALA A 783 44.815 -13.361 7.578 1.00 0.00 H ATOM 2561 N LEU A 784 42.473 -11.761 9.336 1.00 36.80 N ATOM 2562 CA LEU A 784 41.157 -11.305 9.805 1.00 36.72 C ATOM 2563 C LEU A 784 40.440 -12.415 10.588 1.00 38.46 C ATOM 2564 O LEU A 784 39.782 -12.120 11.578 1.00 37.97 O ATOM 2565 CB LEU A 784 40.245 -10.845 8.645 1.00 36.83 C ATOM 2566 CG LEU A 784 40.662 -9.606 7.861 1.00 41.24 C ATOM 2567 CD1 LEU A 784 39.706 -9.368 6.701 1.00 40.35 C ATOM 2568 CD2 LEU A 784 40.733 -8.361 8.769 1.00 43.59 C ATOM 2569 H LEU A 784 42.637 -11.853 8.313 1.00 0.00 H ATOM 2570 N ALA A 785 40.544 -13.670 10.131 1.00 35.43 N ATOM 2571 CA ALA A 785 39.914 -14.809 10.795 1.00 36.75 C ATOM 2572 C ALA A 785 40.549 -15.005 12.197 1.00 45.30 C ATOM 2573 O ALA A 785 39.816 -15.216 13.161 1.00 46.21 O ATOM 2574 CB ALA A 785 40.068 -16.069 9.952 1.00 37.09 C ATOM 2575 H ALA A 785 41.097 -13.841 9.267 1.00 0.00 H ATOM 2576 N GLN A 786 41.894 -14.870 12.307 1.00 43.14 N ATOM 2577 CA GLN A 786 42.628 -15.017 13.569 1.00 43.91 C ATOM 2578 C GLN A 786 42.306 -13.902 14.567 1.00 49.35 C ATOM 2579 O GLN A 786 42.227 -14.167 15.769 1.00 50.08 O ATOM 2580 CB GLN A 786 44.143 -15.143 13.344 1.00 45.16 C ATOM 2581 CG GLN A 786 44.613 -16.461 12.686 1.00 68.85 C ATOM 2582 CD GLN A 786 44.250 -17.747 13.412 1.00100.77 C ATOM 2583 OE1 GLN A 786 43.646 -18.660 12.836 1.00 99.67 O ATOM 2584 NE2 GLN A 786 44.615 -17.864 14.685 1.00 95.85 N ATOM 2585 HE22 GLN A 786 45.122 -17.087 15.154 1.00 0.00 H ATOM 2586 HE21 GLN A 786 44.393 -18.733 15.212 1.00 0.00 H ATOM 2587 H GLN A 786 42.436 -14.650 11.447 1.00 0.00 H ATOM 2588 N ALA A 787 42.101 -12.668 14.070 1.00 44.90 N ATOM 2589 CA ALA A 787 41.763 -11.510 14.888 1.00 44.83 C ATOM 2590 C ALA A 787 40.319 -11.586 15.438 1.00 48.70 C ATOM 2591 O ALA A 787 40.009 -10.953 16.453 1.00 48.59 O ATOM 2592 CB ALA A 787 41.960 -10.231 14.086 1.00 45.56 C ATOM 2593 H ALA A 787 42.189 -12.533 13.043 1.00 0.00 H ATOM 2594 N HIS A 788 39.449 -12.366 14.781 1.00 44.83 N ATOM 2595 CA HIS A 788 38.047 -12.525 15.182 1.00 44.79 C ATOM 2596 C HIS A 788 37.749 -13.814 16.014 1.00 44.52 C ATOM 2597 O HIS A 788 36.692 -13.882 16.633 1.00 42.75 O ATOM 2598 CB HIS A 788 37.138 -12.447 13.931 1.00 46.37 C ATOM 2599 CG HIS A 788 35.701 -12.191 14.245 1.00 50.79 C ATOM 2600 ND1 HIS A 788 35.235 -10.910 14.499 1.00 53.38 N ATOM 2601 CD2 HIS A 788 34.668 -13.064 14.354 1.00 53.45 C ATOM 2602 CE1 HIS A 788 33.940 -11.043 14.765 1.00 53.20 C ATOM 2603 NE2 HIS A 788 33.550 -12.320 14.684 1.00 53.46 N ATOM 2604 H HIS A 788 39.785 -12.885 13.945 1.00 0.00 H ATOM 2605 N HIS A 789 38.671 -14.806 16.040 1.00 40.43 N ATOM 2606 CA HIS A 789 38.495 -16.097 16.734 1.00 41.54 C ATOM 2607 C HIS A 789 37.962 -16.020 18.164 1.00 42.73 C ATOM 2608 O HIS A 789 37.045 -16.768 18.518 1.00 41.87 O ATOM 2609 CB HIS A 789 39.785 -16.932 16.724 1.00 43.61 C ATOM 2610 CG HIS A 789 39.897 -17.859 15.553 1.00 48.16 C ATOM 2611 ND1 HIS A 789 41.027 -18.637 15.361 1.00 50.64 N ATOM 2612 CD2 HIS A 789 39.023 -18.101 14.546 1.00 50.35 C ATOM 2613 CE1 HIS A 789 40.804 -19.324 14.252 1.00 50.13 C ATOM 2614 NE2 HIS A 789 39.614 -19.027 13.723 1.00 50.46 N ATOM 2615 H HIS A 789 39.566 -14.647 15.535 1.00 0.00 H ATOM 2616 N HIS A 790 38.507 -15.102 18.958 1.00 37.08 N ATOM 2617 CA HIS A 790 38.119 -14.961 20.347 1.00 36.67 C ATOM 2618 C HIS A 790 37.012 -13.943 20.576 1.00 43.52 C ATOM 2619 O HIS A 790 36.666 -13.675 21.719 1.00 42.15 O ATOM 2620 CB HIS A 790 39.368 -14.690 21.196 1.00 35.81 C ATOM 2621 CG HIS A 790 40.295 -15.869 21.203 1.00 37.98 C ATOM 2622 ND1 HIS A 790 40.044 -16.983 21.997 1.00 38.96 N ATOM 2623 CD2 HIS A 790 41.403 -16.105 20.461 1.00 38.86 C ATOM 2624 CE1 HIS A 790 41.022 -17.838 21.745 1.00 37.77 C ATOM 2625 NE2 HIS A 790 41.856 -17.365 20.814 1.00 38.44 N ATOM 2626 H HIS A 790 39.233 -14.467 18.570 1.00 0.00 H ATOM 2627 N HIS A 791 36.410 -13.419 19.495 1.00 43.96 N ATOM 2628 CA HIS A 791 35.328 -12.432 19.578 1.00 78.11 C ATOM 2629 C HIS A 791 34.131 -12.821 18.712 1.00108.67 C ATOM 2630 O HIS A 791 33.580 -13.909 18.867 1.00 68.85 O ATOM 2631 CB HIS A 791 35.850 -11.038 19.201 1.00 79.00 C ATOM 2632 CG HIS A 791 37.101 -10.660 19.934 1.00 82.63 C ATOM 2633 ND1 HIS A 791 38.350 -10.809 19.352 1.00 84.62 N ATOM 2634 CD2 HIS A 791 37.258 -10.193 21.195 1.00 84.55 C ATOM 2635 CE1 HIS A 791 39.221 -10.407 20.264 1.00 84.14 C ATOM 2636 NE2 HIS A 791 38.611 -10.030 21.391 1.00 84.49 N ATOM 2637 H HIS A 791 36.727 -13.728 18.554 1.00 0.00 H TER 2638 HIS A 791 HETATM 2639 O HOH 1 34.423 1.097 -11.482 1.00 40.90 O HETATM 2640 O HOH 2 42.065 -3.149 -1.922 1.00 33.13 O HETATM 2641 O HOH 3 35.857 -1.138 1.998 1.00 32.43 O HETATM 2642 O HOH 4 36.658 0.476 -6.609 1.00 42.48 O HETATM 2643 O HOH 5 42.813 -18.600 -22.291 1.00 33.07 O HETATM 2644 O HOH 6 37.406 -17.511 11.511 1.00 42.60 O HETATM 2645 O HOH 7 39.567 -4.458 -25.737 1.00 50.14 O HETATM 2646 O HOH 8 18.940 -32.775 16.294 1.00 50.26 O HETATM 2647 O HOH 9 40.520 -6.460 -17.906 1.00 37.06 O HETATM 2648 O HOH 10 43.458 -22.282 -22.710 1.00 41.44 O HETATM 2649 O HOH 11 20.784 -15.801 0.509 1.00 47.56 O HETATM 2650 O HOH 12 26.015 -7.469 -23.697 1.00 54.87 O HETATM 2651 O HOH 13 36.504 -24.964 -15.584 1.00 39.56 O HETATM 2652 O HOH 14 27.816 -21.404 -29.115 1.00 70.39 O HETATM 2653 O HOH 15 19.235 -48.323 -0.222 1.00 45.01 O HETATM 2654 O HOH 16 23.572 -21.739 11.535 1.00 55.93 O HETATM 2655 O HOH 17 32.899 2.572 -18.827 1.00 44.83 O HETATM 2656 O HOH 18 22.030 -26.335 -4.454 1.00 52.50 O HETATM 2657 O HOH 19 18.313 -25.358 -11.019 1.00 71.12 O HETATM 2658 O HOH 20 45.190 -0.720 -10.295 1.00 31.69 O HETATM 2659 O HOH 21 31.779 -14.531 14.584 1.00 52.35 O HETATM 2660 O HOH 22 23.600 -1.822 -11.532 1.00 51.64 O HETATM 2661 O HOH 23 44.110 -1.816 -13.002 1.00 30.25 O HETATM 2662 O HOH 24 40.504 -1.287 -20.241 1.00 40.53 O HETATM 2663 O HOH 25 26.070 -21.910 12.572 1.00 45.37 O HETATM 2664 O HOH 26 24.676 -50.365 -6.487 1.00 60.98 O HETATM 2665 O HOH 27 31.199 -17.049 13.774 1.00 41.94 O HETATM 2666 O HOH 28 26.920 -24.126 -28.462 1.00 63.21 O HETATM 2667 O HOH 29 27.736 -20.266 -7.242 1.00 22.04 O HETATM 2668 O HOH 30 37.442 -19.016 -12.182 1.00 24.58 O HETATM 2669 O HOH 31 26.706 -15.879 -15.554 1.00 30.96 O HETATM 2670 O HOH 32 46.768 -15.059 -7.893 1.00 37.71 O HETATM 2671 O HOH 33 31.665 -34.702 5.939 1.00 36.51 O HETATM 2672 O HOH 34 32.420 -10.647 -12.857 1.00 24.24 O HETATM 2673 O HOH 35 43.005 -13.356 -17.481 1.00 32.26 O HETATM 2674 O HOH 36 32.997 -19.101 -12.315 1.00 26.49 O HETATM 2675 O HOH 37 25.010 -9.525 3.400 1.00 28.93 O HETATM 2676 O HOH 38 29.341 -26.224 -12.357 1.00 35.61 O HETATM 2677 O HOH 39 42.757 -33.613 -2.730 1.00 36.27 O HETATM 2678 O HOH 40 34.195 -40.183 2.650 1.00 37.41 O HETATM 2679 O HOH 41 50.922 -25.348 -5.219 1.00 34.21 O HETATM 2680 O HOH 42 49.684 -16.588 -5.287 1.00 46.45 O HETATM 2681 O HOH 43 31.838 -8.349 -11.436 1.00 30.46 O HETATM 2682 O HOH 44 39.561 -17.909 -14.606 1.00 24.20 O HETATM 2683 O HOH 45 24.179 -7.826 -7.675 1.00 30.94 O HETATM 2684 O HOH 46 34.974 -17.954 -14.065 1.00 26.65 O HETATM 2685 O HOH 47 32.565 -6.722 -9.252 1.00 30.84 O HETATM 2686 O HOH 48 22.397 -18.493 -8.998 1.00 40.92 O HETATM 2687 O HOH 49 44.549 -20.388 -10.586 1.00 31.68 O HETATM 2688 O HOH 50 50.270 -19.611 -4.927 1.00 45.09 O HETATM 2689 O HOH 51 47.359 -12.330 -16.772 1.00 40.11 O HETATM 2690 O HOH 52 42.133 -41.859 -9.449 1.00 43.15 O HETATM 2691 O HOH 53 34.304 -5.276 -10.407 1.00 34.76 O HETATM 2692 O HOH 54 41.395 -33.279 0.860 1.00 37.91 O HETATM 2693 O HOH 55 36.785 -3.511 -14.626 1.00 48.67 O HETATM 2694 O HOH 56 22.573 -18.135 -22.605 1.00 40.83 O HETATM 2695 O HOH 57 44.391 -19.603 -8.032 1.00 27.05 O HETATM 2696 O HOH 58 23.714 -18.661 -6.686 1.00 43.10 O HETATM 2697 O HOH 59 25.170 -20.356 -8.216 1.00 36.17 O HETATM 2698 O HOH 60 37.214 -16.375 -14.371 1.00 27.72 O HETATM 2699 O HOH 61 47.415 -23.513 0.073 1.00 54.08 O HETATM 2700 O HOH 62 49.133 -17.263 1.995 1.00 47.59 O HETATM 2701 O HOH 63 49.453 -9.111 -4.331 1.00 45.44 O HETATM 2702 O HOH 64 50.587 -32.869 -2.882 1.00 59.20 O HETATM 2703 O HOH 65 50.695 -31.602 -5.991 1.00 59.26 O HETATM 2704 O HOH 66 43.540 -21.470 5.784 1.00 46.70 O HETATM 2705 O HOH 67 34.357 -4.680 -14.198 1.00 38.73 O HETATM 2706 O HOH 68 44.601 -16.986 -8.499 1.00 32.78 O HETATM 2707 O HOH 69 42.015 -34.999 -5.016 1.00 36.82 O HETATM 2708 O HOH 70 28.712 -12.257 13.355 1.00 49.74 O HETATM 2709 O HOH 71 23.471 -7.645 1.076 1.00 50.03 O HETATM 2710 O HOH 72 44.786 -8.471 0.218 1.00 64.04 O HETATM 2711 O HOH 73 25.798 -17.088 -6.205 1.00 32.64 O HETATM 2712 O HOH 74 47.317 -29.846 1.872 1.00 50.20 O HETATM 2713 O HOH 75 45.114 -11.875 -18.185 1.00 42.22 O HETATM 2714 O HOH 76 33.547 0.118 2.328 1.00 41.59 O HETATM 2715 O HOH 77 34.630 -21.161 -17.645 1.00 38.92 O HETATM 2716 O HOH 78 36.840 -40.143 3.532 1.00 67.15 O HETATM 2717 O HOH 79 43.783 -35.678 -1.248 1.00 55.20 O HETATM 2718 O HOH 80 46.434 -12.457 -9.043 1.00 43.41 O HETATM 2719 O HOH 81 20.551 -12.451 -21.297 1.00 50.81 O HETATM 2720 O HOH 82 49.671 -24.687 -0.903 1.00 48.49 O HETATM 2721 O HOH 83 36.859 -49.304 1.714 1.00 58.50 O HETATM 2722 O HOH 84 28.836 -0.616 -1.951 1.00 46.79 O HETATM 2723 O HOH 85 22.611 -27.026 2.779 1.00 49.44 O HETATM 2724 O HOH 86 49.407 -16.155 -15.296 1.00 56.92 O HETATM 2725 O HOH 87 25.499 -5.451 -6.602 1.00 42.64 O HETATM 2726 O HOH 88 25.328 -33.853 0.195 1.00 40.65 O HETATM 2727 O HOH 89 52.794 -27.761 -12.382 1.00 64.26 O HETATM 2728 O HOH 90 35.142 -32.035 -11.484 1.00103.67 O HETATM 2729 O HOH 91 32.479 -23.861 -17.352 1.00 34.01 O HETATM 2730 O HOH 92 31.171 -25.071 -21.817 1.00 50.18 O HETATM 2731 O HOH 93 26.971 -49.770 -8.627 1.00 60.74 O HETATM 2732 O HOH 94 26.618 -32.923 -10.278 1.00 59.86 O HETATM 2733 O HOH 95 24.494 -27.530 0.844 1.00 39.46 O HETATM 2734 O HOH 96 19.418 -13.341 -12.587 1.00 52.07 O HETATM 2735 C2 UNN A 97 30.091 -34.975 -2.605 1.00 0.06 C HETATM 2736 N UNN A 97 29.660 -35.292 -1.344 1.00 -0.29 N HETATM 2737 C3 UNN A 97 28.405 -34.933 -1.069 1.00 0.06 C HETATM 2738 N1 UNN A 97 27.529 -34.287 -1.850 1.00 -0.25 N HETATM 2739 C UNN A 97 27.940 -33.963 -3.086 1.00 0.17 C HETATM 2740 N5 UNN A 97 27.170 -33.170 -3.878 1.00 -0.25 N HETATM 2741 C13 UNN A 97 25.827 -32.764 -3.839 1.00 0.06 C HETATM 2742 C18 UNN A 97 25.493 -31.667 -4.624 1.00 -0.05 C HETATM 2743 C17 UNN A 97 24.218 -31.133 -4.577 1.00 -0.05 C HETATM 2744 C16 UNN A 97 23.238 -31.701 -3.759 1.00 0.03 C HETATM 2745 N6 UNN A 97 21.924 -31.230 -3.796 1.00 -0.31 N HETATM 2746 C22 UNN A 97 21.204 -31.058 -5.062 1.00 0.05 C HETATM 2747 C21 UNN A 97 20.413 -29.773 -5.015 1.00 0.07 C HETATM 2748 O UNN A 97 19.542 -29.737 -3.882 1.00 -0.38 O HETATM 2749 C20 UNN A 97 20.284 -29.846 -2.663 1.00 0.07 C HETATM 2750 C19 UNN A 97 21.079 -31.129 -2.603 1.00 0.05 C HETATM 2751 H UNN A 97 21.712 -31.128 -1.703 1.00 0.05 H HETATM 2752 H UNN A 97 20.391 -31.986 -2.566 1.00 0.05 H HETATM 2753 H UNN A 97 19.583 -29.822 -1.816 1.00 0.06 H HETATM 2754 H UNN A 97 20.976 -28.994 -2.590 1.00 0.06 H HETATM 2755 H UNN A 97 19.811 -29.690 -5.932 1.00 0.06 H HETATM 2756 H UNN A 97 21.111 -28.925 -4.957 1.00 0.06 H HETATM 2757 H UNN A 97 20.519 -31.906 -5.214 1.00 0.05 H HETATM 2758 H UNN A 97 21.925 -31.016 -5.892 1.00 0.05 H HETATM 2759 C15 UNN A 97 23.586 -32.792 -2.959 1.00 -0.05 C HETATM 2760 C14 UNN A 97 24.866 -33.315 -2.998 1.00 -0.05 C HETATM 2761 H UNN A 97 25.122 -34.160 -2.369 1.00 0.05 H HETATM 2762 H UNN A 97 22.846 -33.233 -2.301 1.00 0.05 H HETATM 2763 H UNN A 97 23.977 -30.265 -5.181 1.00 0.05 H HETATM 2764 H UNN A 97 26.237 -31.227 -5.278 1.00 0.05 H HETATM 2765 H UNN A 97 27.684 -32.783 -4.682 1.00 0.22 H HETATM 2766 C1 UNN A 97 29.260 -34.323 -3.533 1.00 0.11 C HETATM 2767 N2 UNN A 97 29.690 -34.040 -4.794 1.00 -0.27 N HETATM 2768 C6 UNN A 97 30.918 -34.381 -5.143 1.00 0.12 C HETATM 2769 C5 UNN A 97 31.822 -35.036 -4.275 1.00 -0.00 C HETATM 2770 C4 UNN A 97 31.403 -35.319 -3.009 1.00 -0.03 C HETATM 2771 H UNN A 97 32.075 -35.807 -2.312 1.00 0.08 H HETATM 2772 H UNN A 97 32.818 -35.305 -4.606 1.00 0.07 H HETATM 2773 N3 UNN A 97 31.291 -34.058 -6.414 1.00 -0.29 N HETATM 2774 C7 UNN A 97 30.410 -33.361 -7.341 1.00 0.07 C HETATM 2775 C8 UNN A 97 30.149 -31.919 -6.963 1.00 0.01 C HETATM 2776 C9 UNN A 97 31.188 -31.018 -6.801 1.00 0.01 C HETATM 2777 N4 UNN A 97 31.024 -29.735 -6.434 1.00 -0.30 N HETATM 2778 C10 UNN A 97 29.771 -29.311 -6.216 1.00 0.00 C HETATM 2779 C11 UNN A 97 28.665 -30.128 -6.353 1.00 -0.04 C HETATM 2780 C12 UNN A 97 28.863 -31.447 -6.732 1.00 -0.04 C HETATM 2781 H UNN A 97 28.014 -32.110 -6.848 1.00 0.07 H HETATM 2782 H UNN A 97 27.667 -29.747 -6.169 1.00 0.07 H HETATM 2783 H UNN A 97 29.619 -28.280 -5.919 1.00 0.08 H HETATM 2784 H UNN A 97 32.197 -31.369 -6.981 1.00 0.08 H HETATM 2785 H UNN A 97 29.447 -33.892 -7.371 1.00 0.07 H HETATM 2786 H UNN A 97 30.871 -33.380 -8.340 1.00 0.07 H HETATM 2787 H UNN A 97 32.236 -34.318 -6.732 1.00 0.19 H HETATM 2788 H UNN A 97 28.046 -35.200 -0.082 1.00 0.10 H CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 299 300 307 308 309 CONECT 307 299 CONECT 308 299 CONECT 309 299 CONECT 392 393 400 401 402 CONECT 400 392 CONECT 401 392 CONECT 402 392 CONECT 1427 1428 1434 1435 1436 CONECT 1434 1427 CONECT 1435 1427 CONECT 1436 1427 CONECT 1566 1567 1574 1575 1576 CONECT 1574 1566 CONECT 1575 1566 CONECT 1576 1566 CONECT 2735 2736 2766 2770 CONECT 2736 2735 2737 CONECT 2737 2736 2738 2788 CONECT 2738 2737 2739 CONECT 2739 2738 2740 2766 CONECT 2740 2739 2741 2765 CONECT 2741 2740 2742 2760 CONECT 2742 2741 2743 2764 CONECT 2743 2742 2744 2763 CONECT 2744 2743 2745 2759 CONECT 2745 2744 2746 2750 CONECT 2746 2745 2747 2757 2758 CONECT 2747 2746 2748 2755 2756 CONECT 2748 2747 2749 CONECT 2749 2748 2750 2753 2754 CONECT 2750 2745 2749 2751 2752 CONECT 2751 2750 CONECT 2752 2750 CONECT 2753 2749 CONECT 2754 2749 CONECT 2755 2747 CONECT 2756 2747 CONECT 2757 2746 CONECT 2758 2746 CONECT 2759 2744 2760 2762 CONECT 2760 2741 2759 2761 CONECT 2761 2760 CONECT 2762 2759 CONECT 2763 2743 CONECT 2764 2742 CONECT 2765 2740 CONECT 2766 2735 2739 2767 CONECT 2767 2766 2768 CONECT 2768 2767 2769 2773 CONECT 2769 2768 2770 2772 CONECT 2770 2735 2769 2771 CONECT 2771 2770 CONECT 2772 2769 CONECT 2773 2768 2774 2787 CONECT 2774 2773 2775 2785 2786 CONECT 2775 2774 2776 2780 CONECT 2776 2775 2777 2784 CONECT 2777 2776 2778 CONECT 2778 2777 2779 2783 CONECT 2779 2778 2780 2782 CONECT 2780 2775 2779 2781 CONECT 2781 2780 CONECT 2782 2779 CONECT 2783 2778 CONECT 2784 2776 CONECT 2785 2774 CONECT 2786 2774 CONECT 2787 2773 CONECT 2788 2737 MASTER 0 0 0 0 0 0 0 0 2783 5 74 23 END
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Pocket-Ligand
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Related entries of code: 4pmt
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
4pmm
RCSB PDB
PDBbind
291aa, >4PMM_1|Chain... at 98%
4pmp
RCSB PDB
PDBbind
291aa, >4PMP_1|Chain... at 98%
4pms
RCSB PDB
PDBbind
291aa, >4PMS_1|Chain... at 98%
4yne
RCSB PDB
PDBbind
303aa, >4YNE_1|Chain... at 97%
4yps
RCSB PDB
PDBbind
303aa, >4YPS_1|Chain... at 97%
5h3q
RCSB PDB
PDBbind
324aa, >5H3Q_1|Chain... *
5wr7
RCSB PDB
PDBbind
304aa, >5WR7_1|Chain... at 100%
6dkb
RCSB PDB
PDBbind
320aa, >6DKB_1|Chain... at 99%
6dkg
RCSB PDB
PDBbind
320aa, >6DKG_1|Chain... at 99%
6dki
RCSB PDB
PDBbind
320aa, >6DKI_1|Chain... at 99%
6pl3
RCSB PDB
PDBbind
311aa, >6PL3_1|Chain... at 100%
6pl2
RCSB PDB
PDBbind
311aa, >6PL2_1|Chain... at 100%
6pl1
RCSB PDB
PDBbind
311aa, >6PL1_1|Chain... at 100%
6nss
RCSB PDB
PDBbind
311aa, >6NSS_1|Chain... at 100%
6nsp
RCSB PDB
PDBbind
297aa, >6NSP_1|Chain... at 100%
6npt
RCSB PDB
PDBbind
305aa, >6NPT_1|Chain... at 100%
6j5l
RCSB PDB
PDBbind
303aa, >6J5L_1|Chain... at 97%
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
4pmt
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
High affinity nerve growth factor receptor TrkA
Ligand Name
31Y
EC.Number
E.C.2.7.10.1
Resolution
2.1(Å)
Affinity (Kd/Ki/IC50)
IC50=997nM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) J.Med.Chem. Vol. 57: pp. 5800-5816
Ligand Properties
Formula
C
2
3
H
2
3
N
7
O
Molecular Weight
413.475
Exact Mass
413.196
No. of atoms
54
No. of bonds
58
Polar Surface Area
88.09
LOGP Value
2.92 (
Computed with XLOGP3
)
3.82 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 5
Canonical SMILES
O1CCN(CC1)c1ccc(cc1)Nc1ncnc2c1nc(NCc1cccnc1)cc2
InChI String
InChI=1S/C23H23N7O/c1-2-17(14-24-9-1)15-25-21-8-7-20-22(29-21)23(27-16-26-20)28-18-3-5-19(6-4-18)30-10-12-31-13-11-30/h1-9,14,16H,10-13,15H2,(H,25,29)(H,26,27,28)
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):
P04629
Entrez Gene ID
NCBI Entrez Gene ID:
4914
ASD
Information of known allosteric effects of PDB entries
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