USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 923 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= -0.687 K(o=-0.69,f=-4.2!) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 ASN : amide:sc= -0.0303 K(o=-0.03,f=-2.1!) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 THR OG1 : rot 17:sc= 0.0918 USER MOD Single : A 36 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : A 38 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 46 MET CE :methyl 173:sc= 0 (180deg=-0.0427) USER MOD Single : A 49 ASN : amide:sc= -2.03! C(o=-2!,f=-4.3!) USER MOD Single : A 52 LYS NZ :NH3+ 146:sc= -0.079 (180deg=-0.751) USER MOD Single : A 58 GLN : amide:sc=-0.00694 K(o=-0.0069,f=-0.84) USER MOD Single : A 59 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.116) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 79 THR OG1 : rot -109:sc= 0.741 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ -169:sc= -1.56 (180deg=-1.86) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -127:sc= -1.36 (180deg=-3.6!) USER MOD Single : A 92 ASN : amide:sc= -2.66! C(o=-2.7!,f=-13!) USER MOD Single : A 94 LYS NZ :NH3+ 134:sc= -0.0457 (180deg=-0.515) USER MOD Single : A 95 MET CE :methyl -168:sc= -0.183 (180deg=-0.342) USER MOD Single : A 96 MET CE :methyl 154:sc= -0.203 (180deg=-1.32!) USER MOD Single : A 103 CYS SG : rot -45:sc= -1.63! USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 74:sc= 0.255 USER MOD Single : A 116 THR OG1 : rot 17:sc= -0.466 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 53.338 85.010 56.188 1.00 0.00 N ATOM 2 CA MET A 1 52.674 83.675 56.242 1.00 0.00 C ATOM 3 C MET A 1 52.455 83.281 57.698 1.00 0.00 C ATOM 4 O MET A 1 53.403 82.950 58.411 1.00 0.00 O ATOM 5 CB MET A 1 53.561 82.639 55.547 1.00 0.00 C ATOM 6 CG MET A 1 52.844 81.287 55.525 1.00 0.00 C ATOM 7 SD MET A 1 53.876 80.070 54.669 1.00 0.00 S ATOM 8 CE MET A 1 54.866 79.564 56.098 1.00 0.00 C ATOM 0 H1 MET A 1 53.489 85.283 55.196 1.00 0.00 H new ATOM 0 H2 MET A 1 52.734 85.717 56.653 1.00 0.00 H new ATOM 0 H3 MET A 1 54.254 84.962 56.677 1.00 0.00 H new ATOM 0 HA MET A 1 51.711 83.719 55.734 1.00 0.00 H new ATOM 0 HB2 MET A 1 53.786 82.960 54.530 1.00 0.00 H new ATOM 0 HB3 MET A 1 54.513 82.550 56.070 1.00 0.00 H new ATOM 0 HG2 MET A 1 52.640 80.955 56.543 1.00 0.00 H new ATOM 0 HG3 MET A 1 51.882 81.382 55.022 1.00 0.00 H new ATOM 0 HE1 MET A 1 55.584 78.803 55.792 1.00 0.00 H new ATOM 0 HE2 MET A 1 55.400 80.427 56.495 1.00 0.00 H new ATOM 0 HE3 MET A 1 54.211 79.157 56.868 1.00 0.00 H new ATOM 18 N SER A 2 51.200 83.316 58.133 1.00 0.00 N ATOM 19 CA SER A 2 50.870 82.958 59.509 1.00 0.00 C ATOM 20 C SER A 2 51.131 81.475 59.753 1.00 0.00 C ATOM 21 O SER A 2 50.844 80.636 58.899 1.00 0.00 O ATOM 22 CB SER A 2 49.401 83.274 59.790 1.00 0.00 C ATOM 23 OG SER A 2 49.062 82.812 61.091 1.00 0.00 O ATOM 0 H SER A 2 50.401 83.586 57.559 1.00 0.00 H new ATOM 0 HA SER A 2 51.501 83.541 60.180 1.00 0.00 H new ATOM 0 HB2 SER A 2 49.227 84.348 59.716 1.00 0.00 H new ATOM 0 HB3 SER A 2 48.765 82.796 59.045 1.00 0.00 H new ATOM 0 HG SER A 2 48.121 83.015 61.275 1.00 0.00 H new ATOM 29 N ALA A 3 51.674 81.161 60.924 1.00 0.00 N ATOM 30 CA ALA A 3 51.967 79.776 61.270 1.00 0.00 C ATOM 31 C ALA A 3 50.675 78.981 61.419 1.00 0.00 C ATOM 32 O ALA A 3 49.674 79.494 61.918 1.00 0.00 O ATOM 33 CB ALA A 3 52.754 79.718 62.581 1.00 0.00 C ATOM 0 H ALA A 3 51.918 81.841 61.644 1.00 0.00 H new ATOM 0 HA ALA A 3 52.564 79.339 60.469 1.00 0.00 H new ATOM 0 HB1 ALA A 3 52.968 78.679 62.831 1.00 0.00 H new ATOM 0 HB2 ALA A 3 53.690 80.264 62.468 1.00 0.00 H new ATOM 0 HB3 ALA A 3 52.165 80.169 63.379 1.00 0.00 H new ATOM 39 N THR A 4 50.704 77.722 60.982 1.00 0.00 N ATOM 40 CA THR A 4 49.527 76.856 61.068 1.00 0.00 C ATOM 41 C THR A 4 49.699 75.837 62.189 1.00 0.00 C ATOM 42 O THR A 4 50.712 75.140 62.261 1.00 0.00 O ATOM 43 CB THR A 4 49.322 76.123 59.740 1.00 0.00 C ATOM 44 OG1 THR A 4 48.490 74.992 59.950 1.00 0.00 O ATOM 45 CG2 THR A 4 50.673 75.669 59.185 1.00 0.00 C ATOM 0 H THR A 4 51.524 77.280 60.567 1.00 0.00 H new ATOM 0 HA THR A 4 48.655 77.475 61.281 1.00 0.00 H new ATOM 0 HB THR A 4 48.850 76.796 59.025 1.00 0.00 H new ATOM 0 HG1 THR A 4 48.356 74.522 59.100 1.00 0.00 H new ATOM 0 HG21 THR A 4 50.521 75.148 58.240 1.00 0.00 H new ATOM 0 HG22 THR A 4 51.310 76.538 59.022 1.00 0.00 H new ATOM 0 HG23 THR A 4 51.152 74.997 59.897 1.00 0.00 H new ATOM 53 N ALA A 5 48.702 75.758 63.062 1.00 0.00 N ATOM 54 CA ALA A 5 48.748 74.822 64.180 1.00 0.00 C ATOM 55 C ALA A 5 48.421 73.411 63.707 1.00 0.00 C ATOM 56 O ALA A 5 49.230 72.766 63.039 1.00 0.00 O ATOM 57 CB ALA A 5 47.754 75.252 65.263 1.00 0.00 C ATOM 0 H ALA A 5 47.856 76.327 63.019 1.00 0.00 H new ATOM 0 HA ALA A 5 49.755 74.826 64.596 1.00 0.00 H new ATOM 0 HB1 ALA A 5 47.794 74.548 66.094 1.00 0.00 H new ATOM 0 HB2 ALA A 5 48.013 76.249 65.619 1.00 0.00 H new ATOM 0 HB3 ALA A 5 46.746 75.265 64.847 1.00 0.00 H new ATOM 63 N ALA A 6 47.230 72.933 64.053 1.00 0.00 N ATOM 64 CA ALA A 6 46.805 71.597 63.658 1.00 0.00 C ATOM 65 C ALA A 6 45.282 71.506 63.664 1.00 0.00 C ATOM 66 O ALA A 6 44.613 72.217 64.414 1.00 0.00 O ATOM 67 CB ALA A 6 47.385 70.559 64.620 1.00 0.00 C ATOM 0 H ALA A 6 46.545 73.450 64.604 1.00 0.00 H new ATOM 0 HA ALA A 6 47.170 71.398 62.650 1.00 0.00 H new ATOM 0 HB1 ALA A 6 47.063 69.563 64.318 1.00 0.00 H new ATOM 0 HB2 ALA A 6 48.474 70.610 64.598 1.00 0.00 H new ATOM 0 HB3 ALA A 6 47.033 70.763 65.631 1.00 0.00 H new ATOM 73 N THR A 7 44.741 70.624 62.826 1.00 0.00 N ATOM 74 CA THR A 7 43.291 70.441 62.738 1.00 0.00 C ATOM 75 C THR A 7 42.926 68.985 62.977 1.00 0.00 C ATOM 76 O THR A 7 43.475 68.083 62.345 1.00 0.00 O ATOM 77 CB THR A 7 42.795 70.877 61.359 1.00 0.00 C ATOM 78 OG1 THR A 7 43.093 72.253 61.170 1.00 0.00 O ATOM 79 CG2 THR A 7 41.284 70.664 61.272 1.00 0.00 C ATOM 0 H THR A 7 45.281 70.026 62.200 1.00 0.00 H new ATOM 0 HA THR A 7 42.815 71.054 63.504 1.00 0.00 H new ATOM 0 HB THR A 7 43.288 70.287 60.587 1.00 0.00 H new ATOM 0 HG1 THR A 7 42.779 72.537 60.286 1.00 0.00 H new ATOM 0 HG21 THR A 7 40.929 70.974 60.289 1.00 0.00 H new ATOM 0 HG22 THR A 7 41.056 69.609 61.424 1.00 0.00 H new ATOM 0 HG23 THR A 7 40.788 71.257 62.041 1.00 0.00 H new ATOM 87 N VAL A 8 41.996 68.760 63.902 1.00 0.00 N ATOM 88 CA VAL A 8 41.575 67.400 64.219 1.00 0.00 C ATOM 89 C VAL A 8 40.558 66.894 63.191 1.00 0.00 C ATOM 90 O VAL A 8 39.491 67.486 63.039 1.00 0.00 O ATOM 91 CB VAL A 8 40.960 67.347 65.614 1.00 0.00 C ATOM 92 CG1 VAL A 8 40.652 65.888 65.970 1.00 0.00 C ATOM 93 CG2 VAL A 8 41.968 67.911 66.611 1.00 0.00 C ATOM 0 H VAL A 8 41.526 69.490 64.437 1.00 0.00 H new ATOM 0 HA VAL A 8 42.455 66.758 64.189 1.00 0.00 H new ATOM 0 HB VAL A 8 40.040 67.931 65.645 1.00 0.00 H new ATOM 0 HG11 VAL A 8 40.212 65.842 66.966 1.00 0.00 H new ATOM 0 HG12 VAL A 8 39.951 65.477 65.244 1.00 0.00 H new ATOM 0 HG13 VAL A 8 41.574 65.307 65.953 1.00 0.00 H new ATOM 0 HG21 VAL A 8 41.543 67.880 67.614 1.00 0.00 H new ATOM 0 HG22 VAL A 8 42.879 67.314 66.584 1.00 0.00 H new ATOM 0 HG23 VAL A 8 42.202 68.942 66.348 1.00 0.00 H new ATOM 103 N PRO A 9 40.855 65.831 62.475 1.00 0.00 N ATOM 104 CA PRO A 9 39.926 65.286 61.448 1.00 0.00 C ATOM 105 C PRO A 9 38.747 64.527 62.067 1.00 0.00 C ATOM 106 O PRO A 9 38.777 64.177 63.248 1.00 0.00 O ATOM 107 CB PRO A 9 40.819 64.350 60.619 1.00 0.00 C ATOM 108 CG PRO A 9 41.905 63.910 61.548 1.00 0.00 C ATOM 109 CD PRO A 9 42.098 65.041 62.561 1.00 0.00 C ATOM 0 HA PRO A 9 39.460 66.074 60.856 1.00 0.00 H new ATOM 0 HB2 PRO A 9 40.253 63.497 60.245 1.00 0.00 H new ATOM 0 HB3 PRO A 9 41.230 64.866 59.751 1.00 0.00 H new ATOM 0 HG2 PRO A 9 41.633 62.982 62.051 1.00 0.00 H new ATOM 0 HG3 PRO A 9 42.828 63.718 61.001 1.00 0.00 H new ATOM 0 HD2 PRO A 9 42.251 64.651 63.567 1.00 0.00 H new ATOM 0 HD3 PRO A 9 42.971 65.647 62.318 1.00 0.00 H new ATOM 117 N PRO A 10 37.729 64.246 61.286 1.00 0.00 N ATOM 118 CA PRO A 10 36.536 63.487 61.771 1.00 0.00 C ATOM 119 C PRO A 10 36.927 62.174 62.454 1.00 0.00 C ATOM 120 O PRO A 10 37.836 61.474 62.006 1.00 0.00 O ATOM 121 CB PRO A 10 35.730 63.215 60.486 1.00 0.00 C ATOM 122 CG PRO A 10 36.147 64.276 59.519 1.00 0.00 C ATOM 123 CD PRO A 10 37.593 64.635 59.866 1.00 0.00 C ATOM 0 HA PRO A 10 35.976 64.043 62.523 1.00 0.00 H new ATOM 0 HB2 PRO A 10 35.942 62.221 60.093 1.00 0.00 H new ATOM 0 HB3 PRO A 10 34.658 63.259 60.679 1.00 0.00 H new ATOM 0 HG2 PRO A 10 36.072 63.917 58.493 1.00 0.00 H new ATOM 0 HG3 PRO A 10 35.500 65.150 59.599 1.00 0.00 H new ATOM 0 HD2 PRO A 10 38.300 64.096 59.235 1.00 0.00 H new ATOM 0 HD3 PRO A 10 37.785 65.698 59.724 1.00 0.00 H new ATOM 131 N ALA A 11 36.231 61.850 63.538 1.00 0.00 N ATOM 132 CA ALA A 11 36.508 60.623 64.275 1.00 0.00 C ATOM 133 C ALA A 11 36.226 59.402 63.403 1.00 0.00 C ATOM 134 O ALA A 11 36.951 58.410 63.457 1.00 0.00 O ATOM 135 CB ALA A 11 35.645 60.569 65.538 1.00 0.00 C ATOM 0 H ALA A 11 35.475 62.416 63.924 1.00 0.00 H new ATOM 0 HA ALA A 11 37.561 60.616 64.557 1.00 0.00 H new ATOM 0 HB1 ALA A 11 35.857 59.650 66.084 1.00 0.00 H new ATOM 0 HB2 ALA A 11 35.872 61.427 66.170 1.00 0.00 H new ATOM 0 HB3 ALA A 11 34.591 60.591 65.260 1.00 0.00 H new ATOM 141 N ALA A 12 35.166 59.483 62.604 1.00 0.00 N ATOM 142 CA ALA A 12 34.798 58.376 61.728 1.00 0.00 C ATOM 143 C ALA A 12 34.822 57.055 62.493 1.00 0.00 C ATOM 144 O ALA A 12 35.533 56.123 62.118 1.00 0.00 O ATOM 145 CB ALA A 12 35.766 58.303 60.545 1.00 0.00 C ATOM 0 H ALA A 12 34.552 60.295 62.545 1.00 0.00 H new ATOM 0 HA ALA A 12 33.787 58.549 61.359 1.00 0.00 H new ATOM 0 HB1 ALA A 12 35.485 57.474 59.895 1.00 0.00 H new ATOM 0 HB2 ALA A 12 35.724 59.236 59.982 1.00 0.00 H new ATOM 0 HB3 ALA A 12 36.780 58.147 60.914 1.00 0.00 H new ATOM 151 N PRO A 13 34.059 56.964 63.553 1.00 0.00 N ATOM 152 CA PRO A 13 33.985 55.730 64.390 1.00 0.00 C ATOM 153 C PRO A 13 33.263 54.590 63.671 1.00 0.00 C ATOM 154 O PRO A 13 32.443 54.823 62.785 1.00 0.00 O ATOM 155 CB PRO A 13 33.214 56.188 65.640 1.00 0.00 C ATOM 156 CG PRO A 13 32.382 57.344 65.181 1.00 0.00 C ATOM 157 CD PRO A 13 33.180 58.028 64.065 1.00 0.00 C ATOM 0 HA PRO A 13 34.970 55.326 64.623 1.00 0.00 H new ATOM 0 HB2 PRO A 13 32.591 55.386 66.035 1.00 0.00 H new ATOM 0 HB3 PRO A 13 33.896 56.484 66.437 1.00 0.00 H new ATOM 0 HG2 PRO A 13 31.413 57.005 64.815 1.00 0.00 H new ATOM 0 HG3 PRO A 13 32.189 58.035 66.002 1.00 0.00 H new ATOM 0 HD2 PRO A 13 32.524 58.414 63.285 1.00 0.00 H new ATOM 0 HD3 PRO A 13 33.755 58.872 64.445 1.00 0.00 H new ATOM 165 N ALA A 14 33.578 53.361 64.066 1.00 0.00 N ATOM 166 CA ALA A 14 32.952 52.194 63.458 1.00 0.00 C ATOM 167 C ALA A 14 33.263 52.133 61.968 1.00 0.00 C ATOM 168 O ALA A 14 32.875 53.017 61.206 1.00 0.00 O ATOM 169 CB ALA A 14 31.438 52.250 63.666 1.00 0.00 C ATOM 0 H ALA A 14 34.256 53.149 64.797 1.00 0.00 H new ATOM 0 HA ALA A 14 33.352 51.299 63.935 1.00 0.00 H new ATOM 0 HB1 ALA A 14 30.975 51.375 63.209 1.00 0.00 H new ATOM 0 HB2 ALA A 14 31.218 52.262 64.733 1.00 0.00 H new ATOM 0 HB3 ALA A 14 31.040 53.153 63.204 1.00 0.00 H new ATOM 175 N GLY A 15 33.966 51.083 61.559 1.00 0.00 N ATOM 176 CA GLY A 15 34.323 50.915 60.156 1.00 0.00 C ATOM 177 C GLY A 15 34.938 49.543 59.915 1.00 0.00 C ATOM 178 O GLY A 15 35.214 48.801 60.855 1.00 0.00 O ATOM 0 H GLY A 15 34.298 50.340 62.174 1.00 0.00 H new ATOM 0 HA2 GLY A 15 33.436 51.035 59.534 1.00 0.00 H new ATOM 0 HA3 GLY A 15 35.028 51.692 59.860 1.00 0.00 H new ATOM 182 N GLU A 16 35.153 49.209 58.644 1.00 0.00 N ATOM 183 CA GLU A 16 35.738 47.920 58.290 1.00 0.00 C ATOM 184 C GLU A 16 36.444 48.010 56.941 1.00 0.00 C ATOM 185 O GLU A 16 35.822 48.315 55.923 1.00 0.00 O ATOM 186 CB GLU A 16 34.646 46.851 58.227 1.00 0.00 C ATOM 187 CG GLU A 16 35.284 45.480 57.989 1.00 0.00 C ATOM 188 CD GLU A 16 34.210 44.399 57.983 1.00 0.00 C ATOM 189 OE1 GLU A 16 33.045 44.750 57.911 1.00 0.00 O ATOM 190 OE2 GLU A 16 34.570 43.235 58.050 1.00 0.00 O ATOM 0 H GLU A 16 34.933 49.808 57.849 1.00 0.00 H new ATOM 0 HA GLU A 16 36.467 47.648 59.053 1.00 0.00 H new ATOM 0 HB2 GLU A 16 34.077 46.842 59.157 1.00 0.00 H new ATOM 0 HB3 GLU A 16 33.944 47.081 57.426 1.00 0.00 H new ATOM 0 HG2 GLU A 16 35.818 45.478 57.039 1.00 0.00 H new ATOM 0 HG3 GLU A 16 36.018 45.271 58.768 1.00 0.00 H new ATOM 197 N GLY A 17 37.746 47.742 56.941 1.00 0.00 N ATOM 198 CA GLY A 17 38.529 47.794 55.710 1.00 0.00 C ATOM 199 C GLY A 17 38.417 46.484 54.938 1.00 0.00 C ATOM 200 O GLY A 17 37.820 45.519 55.419 1.00 0.00 O ATOM 0 H GLY A 17 38.279 47.488 57.773 1.00 0.00 H new ATOM 0 HA2 GLY A 17 38.181 48.618 55.088 1.00 0.00 H new ATOM 0 HA3 GLY A 17 39.574 47.993 55.947 1.00 0.00 H new ATOM 204 N GLY A 18 38.991 46.457 53.739 1.00 0.00 N ATOM 205 CA GLY A 18 38.948 45.259 52.906 1.00 0.00 C ATOM 206 C GLY A 18 37.555 44.641 52.919 1.00 0.00 C ATOM 207 O GLY A 18 37.329 43.609 53.551 1.00 0.00 O ATOM 0 H GLY A 18 39.488 47.245 53.324 1.00 0.00 H new ATOM 0 HA2 GLY A 18 39.229 45.511 51.884 1.00 0.00 H new ATOM 0 HA3 GLY A 18 39.676 44.533 53.267 1.00 0.00 H new ATOM 211 N PRO A 19 36.623 45.257 52.245 1.00 0.00 N ATOM 212 CA PRO A 19 35.217 44.765 52.183 1.00 0.00 C ATOM 213 C PRO A 19 35.137 43.302 51.728 1.00 0.00 C ATOM 214 O PRO A 19 36.040 42.804 51.057 1.00 0.00 O ATOM 215 CB PRO A 19 34.540 45.700 51.163 1.00 0.00 C ATOM 216 CG PRO A 19 35.378 46.939 51.146 1.00 0.00 C ATOM 217 CD PRO A 19 36.808 46.493 51.467 1.00 0.00 C ATOM 0 HA PRO A 19 34.736 44.783 53.161 1.00 0.00 H new ATOM 0 HB2 PRO A 19 34.498 45.240 50.176 1.00 0.00 H new ATOM 0 HB3 PRO A 19 33.514 45.923 51.455 1.00 0.00 H new ATOM 0 HG2 PRO A 19 35.332 47.427 50.172 1.00 0.00 H new ATOM 0 HG3 PRO A 19 35.021 47.660 51.881 1.00 0.00 H new ATOM 0 HD2 PRO A 19 37.384 46.312 50.559 1.00 0.00 H new ATOM 0 HD3 PRO A 19 37.344 47.250 52.040 1.00 0.00 H new ATOM 225 N PRO A 20 34.069 42.622 52.065 1.00 0.00 N ATOM 226 CA PRO A 20 33.862 41.198 51.668 1.00 0.00 C ATOM 227 C PRO A 20 33.615 41.054 50.165 1.00 0.00 C ATOM 228 O PRO A 20 33.207 42.006 49.501 1.00 0.00 O ATOM 229 CB PRO A 20 32.629 40.768 52.481 1.00 0.00 C ATOM 230 CG PRO A 20 31.885 42.035 52.759 1.00 0.00 C ATOM 231 CD PRO A 20 32.944 43.135 52.866 1.00 0.00 C ATOM 0 HA PRO A 20 34.738 40.581 51.868 1.00 0.00 H new ATOM 0 HB2 PRO A 20 32.013 40.064 51.921 1.00 0.00 H new ATOM 0 HB3 PRO A 20 32.920 40.271 53.406 1.00 0.00 H new ATOM 0 HG2 PRO A 20 31.176 42.253 51.961 1.00 0.00 H new ATOM 0 HG3 PRO A 20 31.311 41.955 53.682 1.00 0.00 H new ATOM 0 HD2 PRO A 20 32.576 44.084 52.476 1.00 0.00 H new ATOM 0 HD3 PRO A 20 33.237 43.308 53.901 1.00 0.00 H new ATOM 239 N ALA A 21 33.866 39.856 49.646 1.00 0.00 N ATOM 240 CA ALA A 21 33.665 39.585 48.228 1.00 0.00 C ATOM 241 C ALA A 21 34.656 40.379 47.389 1.00 0.00 C ATOM 242 O ALA A 21 34.287 41.355 46.740 1.00 0.00 O ATOM 243 CB ALA A 21 32.230 39.947 47.826 1.00 0.00 C ATOM 0 H ALA A 21 34.208 39.060 50.185 1.00 0.00 H new ATOM 0 HA ALA A 21 33.830 38.523 48.048 1.00 0.00 H new ATOM 0 HB1 ALA A 21 32.087 39.742 46.765 1.00 0.00 H new ATOM 0 HB2 ALA A 21 31.528 39.351 48.409 1.00 0.00 H new ATOM 0 HB3 ALA A 21 32.054 41.005 48.018 1.00 0.00 H new ATOM 249 N PRO A 22 35.902 39.982 47.395 1.00 0.00 N ATOM 250 CA PRO A 22 36.958 40.680 46.629 1.00 0.00 C ATOM 251 C PRO A 22 36.490 41.023 45.207 1.00 0.00 C ATOM 252 O PRO A 22 36.415 40.143 44.351 1.00 0.00 O ATOM 253 CB PRO A 22 38.124 39.681 46.617 1.00 0.00 C ATOM 254 CG PRO A 22 37.946 38.870 47.860 1.00 0.00 C ATOM 255 CD PRO A 22 36.434 38.820 48.128 1.00 0.00 C ATOM 0 HA PRO A 22 37.234 41.637 47.072 1.00 0.00 H new ATOM 0 HB2 PRO A 22 38.097 39.052 45.727 1.00 0.00 H new ATOM 0 HB3 PRO A 22 39.085 40.195 46.615 1.00 0.00 H new ATOM 0 HG2 PRO A 22 38.352 37.867 47.731 1.00 0.00 H new ATOM 0 HG3 PRO A 22 38.475 39.322 48.699 1.00 0.00 H new ATOM 0 HD2 PRO A 22 35.996 37.888 47.770 1.00 0.00 H new ATOM 0 HD3 PRO A 22 36.215 38.886 49.194 1.00 0.00 H new ATOM 263 N PRO A 23 36.213 42.284 44.929 1.00 0.00 N ATOM 264 CA PRO A 23 35.784 42.726 43.571 1.00 0.00 C ATOM 265 C PRO A 23 36.747 42.249 42.476 1.00 0.00 C ATOM 266 O PRO A 23 36.311 41.791 41.418 1.00 0.00 O ATOM 267 CB PRO A 23 35.748 44.268 43.655 1.00 0.00 C ATOM 268 CG PRO A 23 35.652 44.588 45.120 1.00 0.00 C ATOM 269 CD PRO A 23 36.275 43.414 45.880 1.00 0.00 C ATOM 0 HA PRO A 23 34.817 42.302 43.299 1.00 0.00 H new ATOM 0 HB2 PRO A 23 36.644 44.706 43.216 1.00 0.00 H new ATOM 0 HB3 PRO A 23 34.895 44.671 43.109 1.00 0.00 H new ATOM 0 HG2 PRO A 23 36.177 45.516 45.347 1.00 0.00 H new ATOM 0 HG3 PRO A 23 34.613 44.730 45.416 1.00 0.00 H new ATOM 0 HD2 PRO A 23 37.302 43.631 46.173 1.00 0.00 H new ATOM 0 HD3 PRO A 23 35.723 43.195 46.794 1.00 0.00 H new ATOM 277 N PRO A 24 38.045 42.364 42.695 1.00 0.00 N ATOM 278 CA PRO A 24 39.062 41.950 41.690 1.00 0.00 C ATOM 279 C PRO A 24 39.291 40.441 41.688 1.00 0.00 C ATOM 280 O PRO A 24 39.949 39.905 40.795 1.00 0.00 O ATOM 281 CB PRO A 24 40.323 42.720 42.116 1.00 0.00 C ATOM 282 CG PRO A 24 40.191 42.940 43.592 1.00 0.00 C ATOM 283 CD PRO A 24 38.694 42.882 43.925 1.00 0.00 C ATOM 0 HA PRO A 24 38.754 42.175 40.669 1.00 0.00 H new ATOM 0 HB2 PRO A 24 41.224 42.152 41.885 1.00 0.00 H new ATOM 0 HB3 PRO A 24 40.399 43.669 41.585 1.00 0.00 H new ATOM 0 HG2 PRO A 24 40.739 42.177 44.146 1.00 0.00 H new ATOM 0 HG3 PRO A 24 40.612 43.904 43.877 1.00 0.00 H new ATOM 0 HD2 PRO A 24 38.504 42.228 44.776 1.00 0.00 H new ATOM 0 HD3 PRO A 24 38.310 43.868 44.188 1.00 0.00 H new ATOM 291 N ASN A 25 38.747 39.761 42.689 1.00 0.00 N ATOM 292 CA ASN A 25 38.907 38.315 42.788 1.00 0.00 C ATOM 293 C ASN A 25 40.372 37.926 42.616 1.00 0.00 C ATOM 294 O ASN A 25 40.869 37.819 41.494 1.00 0.00 O ATOM 295 CB ASN A 25 38.064 37.620 41.722 1.00 0.00 C ATOM 296 CG ASN A 25 38.080 36.114 41.953 1.00 0.00 C ATOM 297 OD1 ASN A 25 38.746 35.633 42.869 1.00 0.00 O ATOM 298 ND2 ASN A 25 37.382 35.338 41.171 1.00 0.00 N ATOM 0 H ASN A 25 38.196 40.182 43.437 1.00 0.00 H new ATOM 0 HA ASN A 25 38.572 37.999 43.776 1.00 0.00 H new ATOM 0 HB2 ASN A 25 37.040 37.992 41.756 1.00 0.00 H new ATOM 0 HB3 ASN A 25 38.454 37.849 40.730 1.00 0.00 H new ATOM 0 HD21 ASN A 25 37.387 34.329 41.318 1.00 0.00 H new ATOM 0 HD22 ASN A 25 36.831 35.740 40.413 1.00 0.00 H new ATOM 305 N LEU A 26 41.058 37.719 43.733 1.00 0.00 N ATOM 306 CA LEU A 26 42.467 37.346 43.696 1.00 0.00 C ATOM 307 C LEU A 26 42.642 35.997 43.012 1.00 0.00 C ATOM 308 O LEU A 26 43.571 35.804 42.227 1.00 0.00 O ATOM 309 CB LEU A 26 43.025 37.273 45.119 1.00 0.00 C ATOM 310 CG LEU A 26 43.049 38.680 45.739 1.00 0.00 C ATOM 311 CD1 LEU A 26 43.346 38.567 47.238 1.00 0.00 C ATOM 312 CD2 LEU A 26 44.127 39.554 45.062 1.00 0.00 C ATOM 0 H LEU A 26 40.665 37.802 44.671 1.00 0.00 H new ATOM 0 HA LEU A 26 43.011 38.103 43.131 1.00 0.00 H new ATOM 0 HB2 LEU A 26 42.412 36.608 45.727 1.00 0.00 H new ATOM 0 HB3 LEU A 26 44.031 36.854 45.104 1.00 0.00 H new ATOM 0 HG LEU A 26 42.077 39.149 45.587 1.00 0.00 H new ATOM 0 HD11 LEU A 26 43.364 39.563 47.681 1.00 0.00 H new ATOM 0 HD12 LEU A 26 42.571 37.970 47.718 1.00 0.00 H new ATOM 0 HD13 LEU A 26 44.315 38.088 47.382 1.00 0.00 H new ATOM 0 HD21 LEU A 26 44.128 40.546 45.514 1.00 0.00 H new ATOM 0 HD22 LEU A 26 45.106 39.093 45.195 1.00 0.00 H new ATOM 0 HD23 LEU A 26 43.909 39.641 43.998 1.00 0.00 H new ATOM 324 N THR A 27 41.744 35.065 43.312 1.00 0.00 N ATOM 325 CA THR A 27 41.816 33.739 42.716 1.00 0.00 C ATOM 326 C THR A 27 41.270 33.770 41.292 1.00 0.00 C ATOM 327 O THR A 27 40.125 34.157 41.063 1.00 0.00 O ATOM 328 CB THR A 27 41.000 32.751 43.551 1.00 0.00 C ATOM 329 OG1 THR A 27 41.411 32.831 44.908 1.00 0.00 O ATOM 330 CG2 THR A 27 41.224 31.331 43.030 1.00 0.00 C ATOM 0 H THR A 27 40.966 35.202 43.957 1.00 0.00 H new ATOM 0 HA THR A 27 42.859 33.423 42.692 1.00 0.00 H new ATOM 0 HB THR A 27 39.941 32.998 43.476 1.00 0.00 H new ATOM 0 HG1 THR A 27 40.888 32.200 45.446 1.00 0.00 H new ATOM 0 HG21 THR A 27 40.642 30.629 43.626 1.00 0.00 H new ATOM 0 HG22 THR A 27 40.908 31.272 41.988 1.00 0.00 H new ATOM 0 HG23 THR A 27 42.282 31.079 43.103 1.00 0.00 H new ATOM 338 N SER A 28 42.101 33.356 40.336 1.00 0.00 N ATOM 339 CA SER A 28 41.699 33.333 38.930 1.00 0.00 C ATOM 340 C SER A 28 41.279 31.926 38.522 1.00 0.00 C ATOM 341 O SER A 28 41.252 31.011 39.345 1.00 0.00 O ATOM 342 CB SER A 28 42.859 33.798 38.048 1.00 0.00 C ATOM 343 OG SER A 28 43.039 35.198 38.212 1.00 0.00 O ATOM 0 H SER A 28 43.053 33.033 40.508 1.00 0.00 H new ATOM 0 HA SER A 28 40.853 34.007 38.799 1.00 0.00 H new ATOM 0 HB2 SER A 28 43.772 33.268 38.318 1.00 0.00 H new ATOM 0 HB3 SER A 28 42.653 33.566 37.003 1.00 0.00 H new ATOM 0 HG SER A 28 43.783 35.500 37.650 1.00 0.00 H new ATOM 349 N ASN A 29 40.950 31.761 37.244 1.00 0.00 N ATOM 350 CA ASN A 29 40.529 30.462 36.728 1.00 0.00 C ATOM 351 C ASN A 29 41.741 29.634 36.310 1.00 0.00 C ATOM 352 O ASN A 29 41.661 28.822 35.389 1.00 0.00 O ATOM 353 CB ASN A 29 39.600 30.651 35.527 1.00 0.00 C ATOM 354 CG ASN A 29 38.241 31.160 35.996 1.00 0.00 C ATOM 355 OD1 ASN A 29 37.916 31.067 37.179 1.00 0.00 O ATOM 356 ND2 ASN A 29 37.422 31.691 35.132 1.00 0.00 N ATOM 0 H ASN A 29 40.967 32.507 36.549 1.00 0.00 H new ATOM 0 HA ASN A 29 39.996 29.934 37.519 1.00 0.00 H new ATOM 0 HB2 ASN A 29 40.040 31.358 34.824 1.00 0.00 H new ATOM 0 HB3 ASN A 29 39.481 29.706 34.996 1.00 0.00 H new ATOM 0 HD21 ASN A 29 36.510 32.030 35.436 1.00 0.00 H new ATOM 0 HD22 ASN A 29 37.694 31.767 34.152 1.00 0.00 H new ATOM 363 N ARG A 30 42.860 29.845 36.995 1.00 0.00 N ATOM 364 CA ARG A 30 44.084 29.111 36.693 1.00 0.00 C ATOM 365 C ARG A 30 43.950 27.649 37.105 1.00 0.00 C ATOM 366 O ARG A 30 44.884 27.059 37.648 1.00 0.00 O ATOM 367 CB ARG A 30 45.265 29.744 37.433 1.00 0.00 C ATOM 368 CG ARG A 30 45.608 31.091 36.794 1.00 0.00 C ATOM 369 CD ARG A 30 46.683 31.791 37.624 1.00 0.00 C ATOM 370 NE ARG A 30 46.127 32.219 38.903 1.00 0.00 N ATOM 371 CZ ARG A 30 46.872 32.856 39.799 1.00 0.00 C ATOM 372 NH1 ARG A 30 48.124 33.113 39.542 1.00 0.00 N ATOM 373 NH2 ARG A 30 46.350 33.228 40.936 1.00 0.00 N ATOM 0 H ARG A 30 42.945 30.515 37.759 1.00 0.00 H new ATOM 0 HA ARG A 30 44.258 29.158 35.618 1.00 0.00 H new ATOM 0 HB2 ARG A 30 45.016 29.882 38.485 1.00 0.00 H new ATOM 0 HB3 ARG A 30 46.129 29.081 37.394 1.00 0.00 H new ATOM 0 HG2 ARG A 30 45.961 30.942 35.774 1.00 0.00 H new ATOM 0 HG3 ARG A 30 44.716 31.715 36.735 1.00 0.00 H new ATOM 0 HD2 ARG A 30 47.522 31.116 37.791 1.00 0.00 H new ATOM 0 HD3 ARG A 30 47.070 32.653 37.080 1.00 0.00 H new ATOM 0 HE ARG A 30 45.148 32.025 39.113 1.00 0.00 H new ATOM 0 HH11 ARG A 30 48.532 32.825 38.653 1.00 0.00 H new ATOM 0 HH12 ARG A 30 48.696 33.602 40.230 1.00 0.00 H new ATOM 0 HH21 ARG A 30 45.370 33.029 41.136 1.00 0.00 H new ATOM 0 HH22 ARG A 30 46.922 33.717 41.624 1.00 0.00 H new ATOM 387 N ARG A 31 42.779 27.069 36.846 1.00 0.00 N ATOM 388 CA ARG A 31 42.527 25.678 37.194 1.00 0.00 C ATOM 389 C ARG A 31 43.020 24.748 36.090 1.00 0.00 C ATOM 390 O ARG A 31 42.794 23.539 36.135 1.00 0.00 O ATOM 391 CB ARG A 31 41.030 25.455 37.418 1.00 0.00 C ATOM 392 CG ARG A 31 40.579 26.218 38.666 1.00 0.00 C ATOM 393 CD ARG A 31 39.071 26.048 38.852 1.00 0.00 C ATOM 394 NE ARG A 31 38.352 26.740 37.788 1.00 0.00 N ATOM 395 CZ ARG A 31 37.052 26.539 37.593 1.00 0.00 C ATOM 396 NH1 ARG A 31 36.397 25.713 38.362 1.00 0.00 N ATOM 397 NH2 ARG A 31 36.431 27.168 36.633 1.00 0.00 N ATOM 0 H ARG A 31 41.994 27.542 36.398 1.00 0.00 H new ATOM 0 HA ARG A 31 43.069 25.453 38.112 1.00 0.00 H new ATOM 0 HB2 ARG A 31 40.467 25.795 36.548 1.00 0.00 H new ATOM 0 HB3 ARG A 31 40.824 24.391 37.535 1.00 0.00 H new ATOM 0 HG2 ARG A 31 41.108 25.846 39.543 1.00 0.00 H new ATOM 0 HG3 ARG A 31 40.827 27.275 38.568 1.00 0.00 H new ATOM 0 HD2 ARG A 31 38.813 24.989 38.846 1.00 0.00 H new ATOM 0 HD3 ARG A 31 38.770 26.444 39.822 1.00 0.00 H new ATOM 0 HE ARG A 31 38.855 27.389 37.183 1.00 0.00 H new ATOM 0 HH11 ARG A 31 36.882 25.222 39.113 1.00 0.00 H new ATOM 0 HH12 ARG A 31 35.400 25.559 38.212 1.00 0.00 H new ATOM 0 HH21 ARG A 31 36.943 27.814 36.032 1.00 0.00 H new ATOM 0 HH22 ARG A 31 35.434 27.014 36.484 1.00 0.00 H new ATOM 411 N LEU A 32 43.696 25.322 35.097 1.00 0.00 N ATOM 412 CA LEU A 32 44.219 24.539 33.985 1.00 0.00 C ATOM 413 C LEU A 32 45.426 23.719 34.426 1.00 0.00 C ATOM 414 O LEU A 32 46.318 23.430 33.630 1.00 0.00 O ATOM 415 CB LEU A 32 44.623 25.468 32.839 1.00 0.00 C ATOM 416 CG LEU A 32 43.422 26.323 32.422 1.00 0.00 C ATOM 417 CD1 LEU A 32 43.866 27.347 31.371 1.00 0.00 C ATOM 418 CD2 LEU A 32 42.309 25.432 31.838 1.00 0.00 C ATOM 0 H LEU A 32 43.893 26.321 35.041 1.00 0.00 H new ATOM 0 HA LEU A 32 43.438 23.859 33.645 1.00 0.00 H new ATOM 0 HB2 LEU A 32 45.448 26.109 33.151 1.00 0.00 H new ATOM 0 HB3 LEU A 32 44.977 24.883 31.991 1.00 0.00 H new ATOM 0 HG LEU A 32 43.034 26.841 33.299 1.00 0.00 H new ATOM 0 HD11 LEU A 32 43.013 27.956 31.073 1.00 0.00 H new ATOM 0 HD12 LEU A 32 44.640 27.988 31.792 1.00 0.00 H new ATOM 0 HD13 LEU A 32 44.261 26.826 30.499 1.00 0.00 H new ATOM 0 HD21 LEU A 32 41.462 26.053 31.546 1.00 0.00 H new ATOM 0 HD22 LEU A 32 42.688 24.901 30.965 1.00 0.00 H new ATOM 0 HD23 LEU A 32 41.988 24.711 32.590 1.00 0.00 H new ATOM 430 N GLN A 33 45.446 23.345 35.701 1.00 0.00 N ATOM 431 CA GLN A 33 46.548 22.559 36.239 1.00 0.00 C ATOM 432 C GLN A 33 46.645 21.222 35.514 1.00 0.00 C ATOM 433 O GLN A 33 47.730 20.658 35.370 1.00 0.00 O ATOM 434 CB GLN A 33 46.332 22.318 37.734 1.00 0.00 C ATOM 435 CG GLN A 33 46.429 23.648 38.484 1.00 0.00 C ATOM 436 CD GLN A 33 46.113 23.440 39.962 1.00 0.00 C ATOM 437 OE1 GLN A 33 44.988 23.081 40.310 1.00 0.00 O ATOM 438 NE2 GLN A 33 47.042 23.644 40.854 1.00 0.00 N ATOM 0 H GLN A 33 44.716 23.572 36.376 1.00 0.00 H new ATOM 0 HA GLN A 33 47.477 23.110 36.092 1.00 0.00 H new ATOM 0 HB2 GLN A 33 45.356 21.863 37.903 1.00 0.00 H new ATOM 0 HB3 GLN A 33 47.078 21.620 38.112 1.00 0.00 H new ATOM 0 HG2 GLN A 33 47.430 24.065 38.373 1.00 0.00 H new ATOM 0 HG3 GLN A 33 45.734 24.369 38.053 1.00 0.00 H new ATOM 0 HE21 GLN A 33 47.973 23.941 40.562 1.00 0.00 H new ATOM 0 HE22 GLN A 33 46.838 23.506 41.844 1.00 0.00 H new ATOM 447 N GLN A 34 45.502 20.716 35.065 1.00 0.00 N ATOM 448 CA GLN A 34 45.469 19.443 34.365 1.00 0.00 C ATOM 449 C GLN A 34 46.306 19.499 33.092 1.00 0.00 C ATOM 450 O GLN A 34 47.007 18.542 32.772 1.00 0.00 O ATOM 451 CB GLN A 34 44.029 19.078 34.004 1.00 0.00 C ATOM 452 CG GLN A 34 43.232 18.816 35.282 1.00 0.00 C ATOM 453 CD GLN A 34 41.779 18.505 34.939 1.00 0.00 C ATOM 454 OE1 GLN A 34 41.062 19.366 34.429 1.00 0.00 O ATOM 455 NE2 GLN A 34 41.302 17.315 35.185 1.00 0.00 N ATOM 0 H GLN A 34 44.593 21.166 35.173 1.00 0.00 H new ATOM 0 HA GLN A 34 45.885 18.685 35.028 1.00 0.00 H new ATOM 0 HB2 GLN A 34 43.569 19.887 33.436 1.00 0.00 H new ATOM 0 HB3 GLN A 34 44.016 18.194 33.367 1.00 0.00 H new ATOM 0 HG2 GLN A 34 43.671 17.982 35.829 1.00 0.00 H new ATOM 0 HG3 GLN A 34 43.281 19.687 35.935 1.00 0.00 H new ATOM 0 HE21 GLN A 34 41.899 16.604 35.608 1.00 0.00 H new ATOM 0 HE22 GLN A 34 40.333 17.096 34.955 1.00 0.00 H new ATOM 464 N THR A 35 46.222 20.627 32.378 1.00 0.00 N ATOM 465 CA THR A 35 46.967 20.817 31.139 1.00 0.00 C ATOM 466 C THR A 35 46.648 19.705 30.138 1.00 0.00 C ATOM 467 O THR A 35 45.994 19.941 29.122 1.00 0.00 O ATOM 468 CB THR A 35 48.461 20.835 31.444 1.00 0.00 C ATOM 469 OG1 THR A 35 48.791 22.027 32.144 1.00 0.00 O ATOM 470 CG2 THR A 35 49.265 20.766 30.138 1.00 0.00 C ATOM 0 H THR A 35 45.641 21.423 32.643 1.00 0.00 H new ATOM 0 HA THR A 35 46.674 21.768 30.694 1.00 0.00 H new ATOM 0 HB THR A 35 48.708 19.971 32.061 1.00 0.00 H new ATOM 0 HG1 THR A 35 47.975 22.426 32.512 1.00 0.00 H new ATOM 0 HG21 THR A 35 50.331 20.779 30.366 1.00 0.00 H new ATOM 0 HG22 THR A 35 49.019 19.846 29.607 1.00 0.00 H new ATOM 0 HG23 THR A 35 49.017 21.623 29.512 1.00 0.00 H new ATOM 478 N GLN A 36 47.118 18.498 30.430 1.00 0.00 N ATOM 479 CA GLN A 36 46.884 17.362 29.550 1.00 0.00 C ATOM 480 C GLN A 36 45.403 17.255 29.206 1.00 0.00 C ATOM 481 O GLN A 36 45.020 16.564 28.262 1.00 0.00 O ATOM 482 CB GLN A 36 47.350 16.070 30.228 1.00 0.00 C ATOM 483 CG GLN A 36 48.876 16.074 30.343 1.00 0.00 C ATOM 484 CD GLN A 36 49.350 14.807 31.048 1.00 0.00 C ATOM 485 OE1 GLN A 36 48.539 13.947 31.390 1.00 0.00 O ATOM 486 NE2 GLN A 36 50.622 14.637 31.282 1.00 0.00 N ATOM 0 H GLN A 36 47.661 18.282 31.266 1.00 0.00 H new ATOM 0 HA GLN A 36 47.451 17.511 28.631 1.00 0.00 H new ATOM 0 HB2 GLN A 36 46.901 15.984 31.217 1.00 0.00 H new ATOM 0 HB3 GLN A 36 47.021 15.205 29.652 1.00 0.00 H new ATOM 0 HG2 GLN A 36 49.323 16.137 29.351 1.00 0.00 H new ATOM 0 HG3 GLN A 36 49.205 16.953 30.897 1.00 0.00 H new ATOM 0 HE21 GLN A 36 51.293 15.351 30.998 1.00 0.00 H new ATOM 0 HE22 GLN A 36 50.946 13.790 31.749 1.00 0.00 H new ATOM 495 N ALA A 37 44.572 17.946 29.976 1.00 0.00 N ATOM 496 CA ALA A 37 43.138 17.929 29.736 1.00 0.00 C ATOM 497 C ALA A 37 42.806 18.642 28.427 1.00 0.00 C ATOM 498 O ALA A 37 41.818 18.322 27.771 1.00 0.00 O ATOM 499 CB ALA A 37 42.395 18.601 30.892 1.00 0.00 C ATOM 0 H ALA A 37 44.865 18.521 30.766 1.00 0.00 H new ATOM 0 HA ALA A 37 42.817 16.890 29.664 1.00 0.00 H new ATOM 0 HB1 ALA A 37 41.323 18.580 30.697 1.00 0.00 H new ATOM 0 HB2 ALA A 37 42.606 18.068 31.819 1.00 0.00 H new ATOM 0 HB3 ALA A 37 42.726 19.635 30.985 1.00 0.00 H new ATOM 505 N GLN A 38 43.635 19.619 28.063 1.00 0.00 N ATOM 506 CA GLN A 38 43.413 20.382 26.837 1.00 0.00 C ATOM 507 C GLN A 38 43.558 19.493 25.606 1.00 0.00 C ATOM 508 O GLN A 38 42.666 19.433 24.762 1.00 0.00 O ATOM 509 CB GLN A 38 44.420 21.533 26.755 1.00 0.00 C ATOM 510 CG GLN A 38 44.124 22.552 27.857 1.00 0.00 C ATOM 511 CD GLN A 38 45.175 23.657 27.839 1.00 0.00 C ATOM 512 OE1 GLN A 38 46.030 23.688 26.954 1.00 0.00 O ATOM 513 NE2 GLN A 38 45.166 24.567 28.774 1.00 0.00 N ATOM 0 H GLN A 38 44.459 19.899 28.594 1.00 0.00 H new ATOM 0 HA GLN A 38 42.398 20.779 26.861 1.00 0.00 H new ATOM 0 HB2 GLN A 38 45.435 21.150 26.863 1.00 0.00 H new ATOM 0 HB3 GLN A 38 44.362 22.012 25.778 1.00 0.00 H new ATOM 0 HG2 GLN A 38 43.132 22.980 27.712 1.00 0.00 H new ATOM 0 HG3 GLN A 38 44.119 22.058 28.829 1.00 0.00 H new ATOM 0 HE21 GLN A 38 44.456 24.539 29.506 1.00 0.00 H new ATOM 0 HE22 GLN A 38 45.869 25.306 28.773 1.00 0.00 H new ATOM 522 N VAL A 39 44.689 18.803 25.513 1.00 0.00 N ATOM 523 CA VAL A 39 44.946 17.915 24.384 1.00 0.00 C ATOM 524 C VAL A 39 43.992 16.726 24.410 1.00 0.00 C ATOM 525 O VAL A 39 43.701 16.129 23.375 1.00 0.00 O ATOM 526 CB VAL A 39 46.392 17.423 24.419 1.00 0.00 C ATOM 527 CG1 VAL A 39 46.643 16.671 25.724 1.00 0.00 C ATOM 528 CG2 VAL A 39 46.638 16.484 23.237 1.00 0.00 C ATOM 0 H VAL A 39 45.440 18.840 26.202 1.00 0.00 H new ATOM 0 HA VAL A 39 44.782 18.474 23.463 1.00 0.00 H new ATOM 0 HB VAL A 39 47.068 18.276 24.355 1.00 0.00 H new ATOM 0 HG11 VAL A 39 47.675 16.320 25.749 1.00 0.00 H new ATOM 0 HG12 VAL A 39 46.466 17.338 26.568 1.00 0.00 H new ATOM 0 HG13 VAL A 39 45.968 15.818 25.788 1.00 0.00 H new ATOM 0 HG21 VAL A 39 47.669 16.132 23.260 1.00 0.00 H new ATOM 0 HG22 VAL A 39 45.962 15.631 23.303 1.00 0.00 H new ATOM 0 HG23 VAL A 39 46.458 17.018 22.304 1.00 0.00 H new ATOM 538 N ASP A 40 43.513 16.385 25.599 1.00 0.00 N ATOM 539 CA ASP A 40 42.595 15.260 25.749 1.00 0.00 C ATOM 540 C ASP A 40 41.295 15.522 24.996 1.00 0.00 C ATOM 541 O ASP A 40 40.697 14.608 24.432 1.00 0.00 O ATOM 542 CB ASP A 40 42.288 15.032 27.228 1.00 0.00 C ATOM 543 CG ASP A 40 43.506 14.437 27.928 1.00 0.00 C ATOM 544 OD1 ASP A 40 44.439 14.062 27.236 1.00 0.00 O ATOM 545 OD2 ASP A 40 43.488 14.363 29.147 1.00 0.00 O ATOM 0 H ASP A 40 43.742 16.866 26.469 1.00 0.00 H new ATOM 0 HA ASP A 40 43.070 14.372 25.333 1.00 0.00 H new ATOM 0 HB2 ASP A 40 42.011 15.975 27.700 1.00 0.00 H new ATOM 0 HB3 ASP A 40 41.435 14.361 27.332 1.00 0.00 H new ATOM 550 N GLU A 41 40.861 16.779 24.993 1.00 0.00 N ATOM 551 CA GLU A 41 39.626 17.148 24.310 1.00 0.00 C ATOM 552 C GLU A 41 39.688 16.756 22.838 1.00 0.00 C ATOM 553 O GLU A 41 38.658 16.558 22.199 1.00 0.00 O ATOM 554 CB GLU A 41 39.397 18.657 24.425 1.00 0.00 C ATOM 555 CG GLU A 41 39.091 19.017 25.879 1.00 0.00 C ATOM 556 CD GLU A 41 38.978 20.529 26.030 1.00 0.00 C ATOM 557 OE1 GLU A 41 39.114 21.216 25.032 1.00 0.00 O ATOM 558 OE2 GLU A 41 38.756 20.978 27.143 1.00 0.00 O ATOM 0 H GLU A 41 41.342 17.553 25.452 1.00 0.00 H new ATOM 0 HA GLU A 41 38.801 16.616 24.782 1.00 0.00 H new ATOM 0 HB2 GLU A 41 40.280 19.197 24.084 1.00 0.00 H new ATOM 0 HB3 GLU A 41 38.570 18.960 23.782 1.00 0.00 H new ATOM 0 HG2 GLU A 41 38.161 18.542 26.192 1.00 0.00 H new ATOM 0 HG3 GLU A 41 39.878 18.636 26.530 1.00 0.00 H new ATOM 565 N VAL A 42 40.903 16.643 22.309 1.00 0.00 N ATOM 566 CA VAL A 42 41.086 16.276 20.908 1.00 0.00 C ATOM 567 C VAL A 42 40.494 14.897 20.635 1.00 0.00 C ATOM 568 O VAL A 42 40.171 14.564 19.496 1.00 0.00 O ATOM 569 CB VAL A 42 42.575 16.269 20.558 1.00 0.00 C ATOM 570 CG1 VAL A 42 42.760 15.858 19.096 1.00 0.00 C ATOM 571 CG2 VAL A 42 43.157 17.669 20.776 1.00 0.00 C ATOM 0 H VAL A 42 41.769 16.799 22.824 1.00 0.00 H new ATOM 0 HA VAL A 42 40.571 17.012 20.290 1.00 0.00 H new ATOM 0 HB VAL A 42 43.093 15.556 21.199 1.00 0.00 H new ATOM 0 HG11 VAL A 42 43.822 15.854 18.851 1.00 0.00 H new ATOM 0 HG12 VAL A 42 42.349 14.860 18.944 1.00 0.00 H new ATOM 0 HG13 VAL A 42 42.241 16.566 18.450 1.00 0.00 H new ATOM 0 HG21 VAL A 42 44.218 17.665 20.527 1.00 0.00 H new ATOM 0 HG22 VAL A 42 42.637 18.383 20.137 1.00 0.00 H new ATOM 0 HG23 VAL A 42 43.031 17.957 21.820 1.00 0.00 H new ATOM 581 N VAL A 43 40.354 14.101 21.689 1.00 0.00 N ATOM 582 CA VAL A 43 39.799 12.760 21.551 1.00 0.00 C ATOM 583 C VAL A 43 38.367 12.824 21.026 1.00 0.00 C ATOM 584 O VAL A 43 37.980 12.049 20.152 1.00 0.00 O ATOM 585 CB VAL A 43 39.818 12.043 22.905 1.00 0.00 C ATOM 586 CG1 VAL A 43 39.104 10.694 22.784 1.00 0.00 C ATOM 587 CG2 VAL A 43 41.268 11.813 23.335 1.00 0.00 C ATOM 0 H VAL A 43 40.615 14.358 22.641 1.00 0.00 H new ATOM 0 HA VAL A 43 40.411 12.206 20.839 1.00 0.00 H new ATOM 0 HB VAL A 43 39.307 12.657 23.647 1.00 0.00 H new ATOM 0 HG11 VAL A 43 39.119 10.186 23.749 1.00 0.00 H new ATOM 0 HG12 VAL A 43 38.071 10.855 22.475 1.00 0.00 H new ATOM 0 HG13 VAL A 43 39.613 10.078 22.042 1.00 0.00 H new ATOM 0 HG21 VAL A 43 41.285 11.303 24.298 1.00 0.00 H new ATOM 0 HG22 VAL A 43 41.775 11.200 22.590 1.00 0.00 H new ATOM 0 HG23 VAL A 43 41.778 12.772 23.423 1.00 0.00 H new ATOM 597 N ASP A 44 37.580 13.747 21.572 1.00 0.00 N ATOM 598 CA ASP A 44 36.190 13.893 21.157 1.00 0.00 C ATOM 599 C ASP A 44 36.111 14.167 19.657 1.00 0.00 C ATOM 600 O ASP A 44 35.268 13.607 18.959 1.00 0.00 O ATOM 601 CB ASP A 44 35.537 15.048 21.938 1.00 0.00 C ATOM 602 CG ASP A 44 35.021 14.561 23.290 1.00 0.00 C ATOM 603 OD1 ASP A 44 34.503 13.457 23.346 1.00 0.00 O ATOM 604 OD2 ASP A 44 35.150 15.301 24.252 1.00 0.00 O ATOM 0 H ASP A 44 37.879 14.400 22.297 1.00 0.00 H new ATOM 0 HA ASP A 44 35.657 12.967 21.370 1.00 0.00 H new ATOM 0 HB2 ASP A 44 36.262 15.849 22.087 1.00 0.00 H new ATOM 0 HB3 ASP A 44 34.714 15.466 21.358 1.00 0.00 H new ATOM 609 N ILE A 45 36.995 15.025 19.166 1.00 0.00 N ATOM 610 CA ILE A 45 37.011 15.359 17.745 1.00 0.00 C ATOM 611 C ILE A 45 37.334 14.125 16.909 1.00 0.00 C ATOM 612 O ILE A 45 36.717 13.888 15.871 1.00 0.00 O ATOM 613 CB ILE A 45 38.042 16.460 17.476 1.00 0.00 C ATOM 614 CG1 ILE A 45 37.542 17.787 18.063 1.00 0.00 C ATOM 615 CG2 ILE A 45 38.258 16.620 15.965 1.00 0.00 C ATOM 616 CD1 ILE A 45 37.461 17.702 19.592 1.00 0.00 C ATOM 0 H ILE A 45 37.705 15.500 19.723 1.00 0.00 H new ATOM 0 HA ILE A 45 36.022 15.720 17.462 1.00 0.00 H new ATOM 0 HB ILE A 45 38.986 16.185 17.945 1.00 0.00 H new ATOM 0 HG12 ILE A 45 38.213 18.595 17.773 1.00 0.00 H new ATOM 0 HG13 ILE A 45 36.560 18.025 17.654 1.00 0.00 H new ATOM 0 HG21 ILE A 45 38.992 17.405 15.784 1.00 0.00 H new ATOM 0 HG22 ILE A 45 38.620 15.680 15.548 1.00 0.00 H new ATOM 0 HG23 ILE A 45 37.315 16.889 15.489 1.00 0.00 H new ATOM 0 HD11 ILE A 45 37.105 18.652 19.991 1.00 0.00 H new ATOM 0 HD12 ILE A 45 36.771 16.907 19.876 1.00 0.00 H new ATOM 0 HD13 ILE A 45 38.450 17.486 19.997 1.00 0.00 H new ATOM 628 N MET A 46 38.312 13.355 17.360 1.00 0.00 N ATOM 629 CA MET A 46 38.719 12.161 16.635 1.00 0.00 C ATOM 630 C MET A 46 37.561 11.174 16.543 1.00 0.00 C ATOM 631 O MET A 46 37.362 10.532 15.513 1.00 0.00 O ATOM 632 CB MET A 46 39.906 11.504 17.345 1.00 0.00 C ATOM 633 CG MET A 46 41.177 12.315 17.081 1.00 0.00 C ATOM 634 SD MET A 46 42.566 11.575 17.979 1.00 0.00 S ATOM 635 CE MET A 46 42.974 10.296 16.764 1.00 0.00 C ATOM 0 H MET A 46 38.835 13.533 18.217 1.00 0.00 H new ATOM 0 HA MET A 46 39.015 12.447 15.626 1.00 0.00 H new ATOM 0 HB2 MET A 46 39.715 11.447 18.417 1.00 0.00 H new ATOM 0 HB3 MET A 46 40.035 10.482 16.989 1.00 0.00 H new ATOM 0 HG2 MET A 46 41.392 12.337 16.013 1.00 0.00 H new ATOM 0 HG3 MET A 46 41.034 13.348 17.398 1.00 0.00 H new ATOM 0 HE1 MET A 46 43.893 9.792 17.062 1.00 0.00 H new ATOM 0 HE2 MET A 46 42.162 9.570 16.713 1.00 0.00 H new ATOM 0 HE3 MET A 46 43.113 10.755 15.785 1.00 0.00 H new ATOM 645 N ARG A 47 36.802 11.055 17.625 1.00 0.00 N ATOM 646 CA ARG A 47 35.667 10.140 17.651 1.00 0.00 C ATOM 647 C ARG A 47 34.613 10.563 16.632 1.00 0.00 C ATOM 648 O ARG A 47 34.012 9.726 15.960 1.00 0.00 O ATOM 649 CB ARG A 47 35.050 10.122 19.051 1.00 0.00 C ATOM 650 CG ARG A 47 36.001 9.410 20.016 1.00 0.00 C ATOM 651 CD ARG A 47 35.419 9.451 21.429 1.00 0.00 C ATOM 652 NE ARG A 47 36.307 8.766 22.360 1.00 0.00 N ATOM 653 CZ ARG A 47 36.061 8.761 23.667 1.00 0.00 C ATOM 654 NH1 ARG A 47 35.009 9.375 24.134 1.00 0.00 N ATOM 655 NH2 ARG A 47 36.870 8.139 24.480 1.00 0.00 N ATOM 0 H ARG A 47 36.949 11.576 18.490 1.00 0.00 H new ATOM 0 HA ARG A 47 36.020 9.141 17.394 1.00 0.00 H new ATOM 0 HB2 ARG A 47 34.864 11.141 19.392 1.00 0.00 H new ATOM 0 HB3 ARG A 47 34.087 9.612 19.030 1.00 0.00 H new ATOM 0 HG2 ARG A 47 36.148 8.377 19.702 1.00 0.00 H new ATOM 0 HG3 ARG A 47 36.979 9.891 20.000 1.00 0.00 H new ATOM 0 HD2 ARG A 47 35.280 10.486 21.743 1.00 0.00 H new ATOM 0 HD3 ARG A 47 34.436 8.980 21.439 1.00 0.00 H new ATOM 0 HE ARG A 47 37.131 8.282 22.003 1.00 0.00 H new ATOM 0 HH11 ARG A 47 34.376 9.858 23.497 1.00 0.00 H new ATOM 0 HH12 ARG A 47 34.820 9.372 25.136 1.00 0.00 H new ATOM 0 HH21 ARG A 47 37.691 7.657 24.113 1.00 0.00 H new ATOM 0 HH22 ARG A 47 36.682 8.135 25.482 1.00 0.00 H new ATOM 669 N VAL A 48 34.400 11.871 16.521 1.00 0.00 N ATOM 670 CA VAL A 48 33.423 12.404 15.580 1.00 0.00 C ATOM 671 C VAL A 48 33.836 12.090 14.146 1.00 0.00 C ATOM 672 O VAL A 48 33.000 11.754 13.307 1.00 0.00 O ATOM 673 CB VAL A 48 33.282 13.917 15.759 1.00 0.00 C ATOM 674 CG1 VAL A 48 32.349 14.479 14.681 1.00 0.00 C ATOM 675 CG2 VAL A 48 32.691 14.213 17.142 1.00 0.00 C ATOM 0 H VAL A 48 34.889 12.578 17.069 1.00 0.00 H new ATOM 0 HA VAL A 48 32.462 11.932 15.781 1.00 0.00 H new ATOM 0 HB VAL A 48 34.263 14.384 15.670 1.00 0.00 H new ATOM 0 HG11 VAL A 48 32.250 15.557 14.811 1.00 0.00 H new ATOM 0 HG12 VAL A 48 32.764 14.269 13.695 1.00 0.00 H new ATOM 0 HG13 VAL A 48 31.368 14.012 14.769 1.00 0.00 H new ATOM 0 HG21 VAL A 48 32.590 15.291 17.271 1.00 0.00 H new ATOM 0 HG22 VAL A 48 31.711 13.744 17.227 1.00 0.00 H new ATOM 0 HG23 VAL A 48 33.352 13.816 17.913 1.00 0.00 H new ATOM 685 N ASN A 49 35.131 12.211 13.870 1.00 0.00 N ATOM 686 CA ASN A 49 35.642 11.948 12.531 1.00 0.00 C ATOM 687 C ASN A 49 35.268 10.538 12.086 1.00 0.00 C ATOM 688 O ASN A 49 34.906 10.319 10.932 1.00 0.00 O ATOM 689 CB ASN A 49 37.167 12.099 12.519 1.00 0.00 C ATOM 690 CG ASN A 49 37.714 11.746 11.140 1.00 0.00 C ATOM 691 OD1 ASN A 49 36.955 11.369 10.247 1.00 0.00 O ATOM 692 ND2 ASN A 49 38.995 11.839 10.914 1.00 0.00 N ATOM 0 H ASN A 49 35.840 12.487 14.550 1.00 0.00 H new ATOM 0 HA ASN A 49 35.198 12.666 11.842 1.00 0.00 H new ATOM 0 HB2 ASN A 49 37.442 13.122 12.778 1.00 0.00 H new ATOM 0 HB3 ASN A 49 37.611 11.449 13.273 1.00 0.00 H new ATOM 0 HD21 ASN A 49 39.370 11.599 9.996 1.00 0.00 H new ATOM 0 HD22 ASN A 49 39.622 12.152 11.655 1.00 0.00 H new ATOM 699 N VAL A 50 35.349 9.590 13.009 1.00 0.00 N ATOM 700 CA VAL A 50 35.009 8.205 12.702 1.00 0.00 C ATOM 701 C VAL A 50 33.532 8.081 12.352 1.00 0.00 C ATOM 702 O VAL A 50 33.150 7.322 11.460 1.00 0.00 O ATOM 703 CB VAL A 50 35.345 7.301 13.891 1.00 0.00 C ATOM 704 CG1 VAL A 50 34.866 5.874 13.603 1.00 0.00 C ATOM 705 CG2 VAL A 50 36.860 7.295 14.110 1.00 0.00 C ATOM 0 H VAL A 50 35.645 9.751 13.972 1.00 0.00 H new ATOM 0 HA VAL A 50 35.597 7.889 11.841 1.00 0.00 H new ATOM 0 HB VAL A 50 34.847 7.676 14.785 1.00 0.00 H new ATOM 0 HG11 VAL A 50 35.106 5.232 14.450 1.00 0.00 H new ATOM 0 HG12 VAL A 50 33.788 5.877 13.444 1.00 0.00 H new ATOM 0 HG13 VAL A 50 35.363 5.497 12.709 1.00 0.00 H new ATOM 0 HG21 VAL A 50 37.103 6.652 14.956 1.00 0.00 H new ATOM 0 HG22 VAL A 50 37.356 6.919 13.215 1.00 0.00 H new ATOM 0 HG23 VAL A 50 37.202 8.309 14.315 1.00 0.00 H new ATOM 715 N ASP A 51 32.710 8.820 13.071 1.00 0.00 N ATOM 716 CA ASP A 51 31.266 8.791 12.850 1.00 0.00 C ATOM 717 C ASP A 51 30.922 9.260 11.439 1.00 0.00 C ATOM 718 O ASP A 51 29.777 9.149 11.001 1.00 0.00 O ATOM 719 CB ASP A 51 30.555 9.684 13.872 1.00 0.00 C ATOM 720 CG ASP A 51 29.043 9.507 13.753 1.00 0.00 C ATOM 721 OD1 ASP A 51 28.587 8.382 13.862 1.00 0.00 O ATOM 722 OD2 ASP A 51 28.363 10.501 13.553 1.00 0.00 O ATOM 0 H ASP A 51 33.011 9.450 13.815 1.00 0.00 H new ATOM 0 HA ASP A 51 30.928 7.762 12.970 1.00 0.00 H new ATOM 0 HB2 ASP A 51 30.882 9.429 14.880 1.00 0.00 H new ATOM 0 HB3 ASP A 51 30.822 10.727 13.705 1.00 0.00 H new ATOM 727 N LYS A 52 31.917 9.784 10.735 1.00 0.00 N ATOM 728 CA LYS A 52 31.708 10.270 9.378 1.00 0.00 C ATOM 729 C LYS A 52 31.315 9.124 8.458 1.00 0.00 C ATOM 730 O LYS A 52 30.784 9.339 7.368 1.00 0.00 O ATOM 731 CB LYS A 52 32.995 10.919 8.863 1.00 0.00 C ATOM 732 CG LYS A 52 33.375 12.120 9.745 1.00 0.00 C ATOM 733 CD LYS A 52 32.578 13.362 9.323 1.00 0.00 C ATOM 734 CE LYS A 52 33.046 14.567 10.138 1.00 0.00 C ATOM 735 NZ LYS A 52 34.475 14.851 9.823 1.00 0.00 N ATOM 0 H LYS A 52 32.872 9.883 11.079 1.00 0.00 H new ATOM 0 HA LYS A 52 30.903 11.005 9.389 1.00 0.00 H new ATOM 0 HB2 LYS A 52 33.804 10.189 8.863 1.00 0.00 H new ATOM 0 HB3 LYS A 52 32.859 11.245 7.832 1.00 0.00 H new ATOM 0 HG2 LYS A 52 33.175 11.889 10.791 1.00 0.00 H new ATOM 0 HG3 LYS A 52 34.443 12.319 9.661 1.00 0.00 H new ATOM 0 HD2 LYS A 52 32.717 13.553 8.259 1.00 0.00 H new ATOM 0 HD3 LYS A 52 31.512 13.195 9.480 1.00 0.00 H new ATOM 0 HE2 LYS A 52 32.431 15.437 9.908 1.00 0.00 H new ATOM 0 HE3 LYS A 52 32.929 14.367 11.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 34.642 15.877 9.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 35.085 14.373 10.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 34.696 14.502 8.869 1.00 0.00 H new ATOM 749 N VAL A 53 31.578 7.903 8.906 1.00 0.00 N ATOM 750 CA VAL A 53 31.245 6.732 8.112 1.00 0.00 C ATOM 751 C VAL A 53 29.736 6.623 7.926 1.00 0.00 C ATOM 752 O VAL A 53 29.252 6.346 6.829 1.00 0.00 O ATOM 753 CB VAL A 53 31.769 5.468 8.796 1.00 0.00 C ATOM 754 CG1 VAL A 53 33.291 5.556 8.934 1.00 0.00 C ATOM 755 CG2 VAL A 53 31.135 5.335 10.186 1.00 0.00 C ATOM 0 H VAL A 53 32.016 7.701 9.805 1.00 0.00 H new ATOM 0 HA VAL A 53 31.715 6.835 7.134 1.00 0.00 H new ATOM 0 HB VAL A 53 31.508 4.597 8.195 1.00 0.00 H new ATOM 0 HG11 VAL A 53 33.665 4.656 9.421 1.00 0.00 H new ATOM 0 HG12 VAL A 53 33.741 5.647 7.946 1.00 0.00 H new ATOM 0 HG13 VAL A 53 33.552 6.428 9.534 1.00 0.00 H new ATOM 0 HG21 VAL A 53 31.509 4.434 10.672 1.00 0.00 H new ATOM 0 HG22 VAL A 53 31.393 6.206 10.788 1.00 0.00 H new ATOM 0 HG23 VAL A 53 30.051 5.270 10.087 1.00 0.00 H new ATOM 765 N LEU A 54 28.997 6.839 9.010 1.00 0.00 N ATOM 766 CA LEU A 54 27.543 6.755 8.953 1.00 0.00 C ATOM 767 C LEU A 54 26.984 7.812 8.014 1.00 0.00 C ATOM 768 O LEU A 54 26.083 7.541 7.219 1.00 0.00 O ATOM 769 CB LEU A 54 26.951 6.939 10.357 1.00 0.00 C ATOM 770 CG LEU A 54 25.416 6.839 10.303 1.00 0.00 C ATOM 771 CD1 LEU A 54 24.993 5.442 9.815 1.00 0.00 C ATOM 772 CD2 LEU A 54 24.845 7.098 11.703 1.00 0.00 C ATOM 0 H LEU A 54 29.376 7.071 9.928 1.00 0.00 H new ATOM 0 HA LEU A 54 27.268 5.771 8.574 1.00 0.00 H new ATOM 0 HB2 LEU A 54 27.349 6.179 11.030 1.00 0.00 H new ATOM 0 HB3 LEU A 54 27.246 7.908 10.760 1.00 0.00 H new ATOM 0 HG LEU A 54 25.029 7.583 9.607 1.00 0.00 H new ATOM 0 HD11 LEU A 54 23.905 5.383 9.781 1.00 0.00 H new ATOM 0 HD12 LEU A 54 25.398 5.267 8.818 1.00 0.00 H new ATOM 0 HD13 LEU A 54 25.376 4.686 10.500 1.00 0.00 H new ATOM 0 HD21 LEU A 54 23.758 7.029 11.671 1.00 0.00 H new ATOM 0 HD22 LEU A 54 25.236 6.355 12.398 1.00 0.00 H new ATOM 0 HD23 LEU A 54 25.135 8.095 12.036 1.00 0.00 H new ATOM 784 N GLU A 55 27.518 9.017 8.118 1.00 0.00 N ATOM 785 CA GLU A 55 27.065 10.120 7.280 1.00 0.00 C ATOM 786 C GLU A 55 28.083 11.256 7.286 1.00 0.00 C ATOM 787 O GLU A 55 28.635 11.602 8.329 1.00 0.00 O ATOM 788 CB GLU A 55 25.713 10.638 7.781 1.00 0.00 C ATOM 789 CG GLU A 55 25.204 11.733 6.842 1.00 0.00 C ATOM 790 CD GLU A 55 23.803 12.169 7.256 1.00 0.00 C ATOM 791 OE1 GLU A 55 23.195 11.466 8.046 1.00 0.00 O ATOM 792 OE2 GLU A 55 23.357 13.196 6.774 1.00 0.00 O ATOM 0 H GLU A 55 28.263 9.259 8.771 1.00 0.00 H new ATOM 0 HA GLU A 55 26.957 9.753 6.259 1.00 0.00 H new ATOM 0 HB2 GLU A 55 24.993 9.821 7.827 1.00 0.00 H new ATOM 0 HB3 GLU A 55 25.815 11.031 8.793 1.00 0.00 H new ATOM 0 HG2 GLU A 55 25.881 12.587 6.866 1.00 0.00 H new ATOM 0 HG3 GLU A 55 25.191 11.366 5.816 1.00 0.00 H new ATOM 799 N ARG A 56 28.322 11.833 6.112 1.00 0.00 N ATOM 800 CA ARG A 56 29.272 12.934 5.993 1.00 0.00 C ATOM 801 C ARG A 56 28.771 14.162 6.745 1.00 0.00 C ATOM 802 O ARG A 56 29.543 14.851 7.409 1.00 0.00 O ATOM 803 CB ARG A 56 29.478 13.282 4.517 1.00 0.00 C ATOM 804 CG ARG A 56 30.272 12.165 3.838 1.00 0.00 C ATOM 805 CD ARG A 56 30.382 12.454 2.340 1.00 0.00 C ATOM 806 NE ARG A 56 29.075 12.322 1.706 1.00 0.00 N ATOM 807 CZ ARG A 56 28.921 12.515 0.401 1.00 0.00 C ATOM 808 NH1 ARG A 56 29.950 12.827 -0.338 1.00 0.00 N ATOM 809 NH2 ARG A 56 27.740 12.390 -0.142 1.00 0.00 N ATOM 0 H ARG A 56 27.875 11.560 5.237 1.00 0.00 H new ATOM 0 HA ARG A 56 30.220 12.622 6.430 1.00 0.00 H new ATOM 0 HB2 ARG A 56 28.514 13.410 4.024 1.00 0.00 H new ATOM 0 HB3 ARG A 56 30.010 14.229 4.426 1.00 0.00 H new ATOM 0 HG2 ARG A 56 31.266 12.092 4.279 1.00 0.00 H new ATOM 0 HG3 ARG A 56 29.780 11.206 3.999 1.00 0.00 H new ATOM 0 HD2 ARG A 56 30.771 13.460 2.184 1.00 0.00 H new ATOM 0 HD3 ARG A 56 31.089 11.764 1.880 1.00 0.00 H new ATOM 0 HE ARG A 56 28.265 12.077 2.275 1.00 0.00 H new ATOM 0 HH11 ARG A 56 30.873 12.923 0.087 1.00 0.00 H new ATOM 0 HH12 ARG A 56 29.832 12.975 -1.340 1.00 0.00 H new ATOM 0 HH21 ARG A 56 26.936 12.144 0.436 1.00 0.00 H new ATOM 0 HH22 ARG A 56 27.621 12.538 -1.144 1.00 0.00 H new ATOM 823 N ASP A 57 27.473 14.430 6.636 1.00 0.00 N ATOM 824 CA ASP A 57 26.882 15.580 7.314 1.00 0.00 C ATOM 825 C ASP A 57 27.691 16.842 7.035 1.00 0.00 C ATOM 826 O ASP A 57 28.126 17.528 7.959 1.00 0.00 O ATOM 827 CB ASP A 57 26.821 15.326 8.822 1.00 0.00 C ATOM 828 CG ASP A 57 25.757 14.279 9.131 1.00 0.00 C ATOM 829 OD1 ASP A 57 24.715 14.319 8.497 1.00 0.00 O ATOM 830 OD2 ASP A 57 26.001 13.453 9.994 1.00 0.00 O ATOM 0 H ASP A 57 26.816 13.873 6.090 1.00 0.00 H new ATOM 0 HA ASP A 57 25.871 15.722 6.932 1.00 0.00 H new ATOM 0 HB2 ASP A 57 27.792 14.987 9.182 1.00 0.00 H new ATOM 0 HB3 ASP A 57 26.593 16.254 9.347 1.00 0.00 H new ATOM 835 N GLN A 58 27.895 17.142 5.755 1.00 0.00 N ATOM 836 CA GLN A 58 28.657 18.321 5.369 1.00 0.00 C ATOM 837 C GLN A 58 28.053 19.578 5.989 1.00 0.00 C ATOM 838 O GLN A 58 26.923 19.954 5.679 1.00 0.00 O ATOM 839 CB GLN A 58 28.671 18.460 3.846 1.00 0.00 C ATOM 840 CG GLN A 58 29.506 17.333 3.238 1.00 0.00 C ATOM 841 CD GLN A 58 29.452 17.406 1.716 1.00 0.00 C ATOM 842 OE1 GLN A 58 28.415 17.743 1.147 1.00 0.00 O ATOM 843 NE2 GLN A 58 30.515 17.111 1.020 1.00 0.00 N ATOM 0 H GLN A 58 27.545 16.588 4.974 1.00 0.00 H new ATOM 0 HA GLN A 58 29.678 18.204 5.733 1.00 0.00 H new ATOM 0 HB2 GLN A 58 27.653 18.423 3.458 1.00 0.00 H new ATOM 0 HB3 GLN A 58 29.085 19.427 3.562 1.00 0.00 H new ATOM 0 HG2 GLN A 58 30.539 17.411 3.578 1.00 0.00 H new ATOM 0 HG3 GLN A 58 29.131 16.368 3.577 1.00 0.00 H new ATOM 0 HE21 GLN A 58 31.374 16.832 1.494 1.00 0.00 H new ATOM 0 HE22 GLN A 58 30.487 17.160 0.002 1.00 0.00 H new ATOM 852 N LYS A 59 28.815 20.219 6.869 1.00 0.00 N ATOM 853 CA LYS A 59 28.345 21.429 7.533 1.00 0.00 C ATOM 854 C LYS A 59 28.124 22.541 6.521 1.00 0.00 C ATOM 855 O LYS A 59 27.118 23.248 6.575 1.00 0.00 O ATOM 856 CB LYS A 59 29.374 21.883 8.567 1.00 0.00 C ATOM 857 CG LYS A 59 29.580 20.784 9.614 1.00 0.00 C ATOM 858 CD LYS A 59 28.340 20.657 10.513 1.00 0.00 C ATOM 859 CE LYS A 59 28.704 19.881 11.777 1.00 0.00 C ATOM 860 NZ LYS A 59 29.108 18.496 11.407 1.00 0.00 N ATOM 0 H LYS A 59 29.754 19.924 7.137 1.00 0.00 H new ATOM 0 HA LYS A 59 27.399 21.208 8.027 1.00 0.00 H new ATOM 0 HB2 LYS A 59 30.320 22.111 8.076 1.00 0.00 H new ATOM 0 HB3 LYS A 59 29.037 22.800 9.051 1.00 0.00 H new ATOM 0 HG2 LYS A 59 29.776 19.833 9.118 1.00 0.00 H new ATOM 0 HG3 LYS A 59 30.455 21.012 10.222 1.00 0.00 H new ATOM 0 HD2 LYS A 59 27.966 21.646 10.776 1.00 0.00 H new ATOM 0 HD3 LYS A 59 27.540 20.146 9.977 1.00 0.00 H new ATOM 0 HE2 LYS A 59 29.518 20.381 12.303 1.00 0.00 H new ATOM 0 HE3 LYS A 59 27.854 19.854 12.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 29.176 17.913 12.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 28.399 18.087 10.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 30.032 18.520 10.931 1.00 0.00 H new ATOM 874 N LEU A 60 29.069 22.692 5.604 1.00 0.00 N ATOM 875 CA LEU A 60 28.971 23.725 4.581 1.00 0.00 C ATOM 876 C LEU A 60 29.127 25.115 5.197 1.00 0.00 C ATOM 877 O LEU A 60 29.414 26.086 4.496 1.00 0.00 O ATOM 878 CB LEU A 60 27.611 23.626 3.869 1.00 0.00 C ATOM 879 CG LEU A 60 27.706 24.243 2.458 1.00 0.00 C ATOM 880 CD1 LEU A 60 28.190 23.186 1.457 1.00 0.00 C ATOM 881 CD2 LEU A 60 26.327 24.757 2.025 1.00 0.00 C ATOM 0 H LEU A 60 29.909 22.116 5.547 1.00 0.00 H new ATOM 0 HA LEU A 60 29.774 23.572 3.860 1.00 0.00 H new ATOM 0 HB2 LEU A 60 27.304 22.583 3.798 1.00 0.00 H new ATOM 0 HB3 LEU A 60 26.849 24.144 4.451 1.00 0.00 H new ATOM 0 HG LEU A 60 28.414 25.071 2.480 1.00 0.00 H new ATOM 0 HD11 LEU A 60 28.255 23.629 0.463 1.00 0.00 H new ATOM 0 HD12 LEU A 60 29.173 22.824 1.757 1.00 0.00 H new ATOM 0 HD13 LEU A 60 27.487 22.354 1.438 1.00 0.00 H new ATOM 0 HD21 LEU A 60 26.397 25.192 1.028 1.00 0.00 H new ATOM 0 HD22 LEU A 60 25.618 23.929 2.010 1.00 0.00 H new ATOM 0 HD23 LEU A 60 25.984 25.516 2.729 1.00 0.00 H new ATOM 893 N SER A 61 28.930 25.201 6.507 1.00 0.00 N ATOM 894 CA SER A 61 29.045 26.469 7.208 1.00 0.00 C ATOM 895 C SER A 61 30.455 27.030 7.079 1.00 0.00 C ATOM 896 O SER A 61 30.643 28.238 6.941 1.00 0.00 O ATOM 897 CB SER A 61 28.694 26.281 8.683 1.00 0.00 C ATOM 898 OG SER A 61 27.304 26.014 8.804 1.00 0.00 O ATOM 0 H SER A 61 28.690 24.408 7.102 1.00 0.00 H new ATOM 0 HA SER A 61 28.349 27.177 6.758 1.00 0.00 H new ATOM 0 HB2 SER A 61 29.272 25.459 9.104 1.00 0.00 H new ATOM 0 HB3 SER A 61 28.955 27.176 9.248 1.00 0.00 H new ATOM 0 HG SER A 61 27.076 25.891 9.749 1.00 0.00 H new ATOM 904 N GLU A 62 31.446 26.145 7.133 1.00 0.00 N ATOM 905 CA GLU A 62 32.836 26.564 7.032 1.00 0.00 C ATOM 906 C GLU A 62 33.078 27.330 5.734 1.00 0.00 C ATOM 907 O GLU A 62 33.704 28.389 5.736 1.00 0.00 O ATOM 908 CB GLU A 62 33.753 25.338 7.080 1.00 0.00 C ATOM 909 CG GLU A 62 33.710 24.722 8.480 1.00 0.00 C ATOM 910 CD GLU A 62 34.512 23.425 8.504 1.00 0.00 C ATOM 911 OE1 GLU A 62 35.128 23.114 7.498 1.00 0.00 O ATOM 912 OE2 GLU A 62 34.493 22.759 9.526 1.00 0.00 O ATOM 0 H GLU A 62 31.312 25.140 7.245 1.00 0.00 H new ATOM 0 HA GLU A 62 33.058 27.222 7.872 1.00 0.00 H new ATOM 0 HB2 GLU A 62 33.436 24.604 6.339 1.00 0.00 H new ATOM 0 HB3 GLU A 62 34.774 25.625 6.829 1.00 0.00 H new ATOM 0 HG2 GLU A 62 34.117 25.424 9.208 1.00 0.00 H new ATOM 0 HG3 GLU A 62 32.677 24.526 8.769 1.00 0.00 H new ATOM 919 N LEU A 63 32.578 26.788 4.627 1.00 0.00 N ATOM 920 CA LEU A 63 32.748 27.431 3.333 1.00 0.00 C ATOM 921 C LEU A 63 32.047 28.785 3.313 1.00 0.00 C ATOM 922 O LEU A 63 32.578 29.763 2.784 1.00 0.00 O ATOM 923 CB LEU A 63 32.174 26.538 2.232 1.00 0.00 C ATOM 924 CG LEU A 63 32.753 25.124 2.364 1.00 0.00 C ATOM 925 CD1 LEU A 63 32.125 24.217 1.303 1.00 0.00 C ATOM 926 CD2 LEU A 63 34.278 25.162 2.175 1.00 0.00 C ATOM 0 H LEU A 63 32.056 25.912 4.602 1.00 0.00 H new ATOM 0 HA LEU A 63 33.813 27.585 3.158 1.00 0.00 H new ATOM 0 HB2 LEU A 63 31.087 26.505 2.306 1.00 0.00 H new ATOM 0 HB3 LEU A 63 32.415 26.951 1.252 1.00 0.00 H new ATOM 0 HG LEU A 63 32.528 24.734 3.357 1.00 0.00 H new ATOM 0 HD11 LEU A 63 32.535 23.211 1.395 1.00 0.00 H new ATOM 0 HD12 LEU A 63 31.045 24.183 1.446 1.00 0.00 H new ATOM 0 HD13 LEU A 63 32.347 24.610 0.311 1.00 0.00 H new ATOM 0 HD21 LEU A 63 34.682 24.154 2.270 1.00 0.00 H new ATOM 0 HD22 LEU A 63 34.512 25.555 1.186 1.00 0.00 H new ATOM 0 HD23 LEU A 63 34.723 25.804 2.935 1.00 0.00 H new ATOM 938 N ASP A 64 30.850 28.834 3.888 1.00 0.00 N ATOM 939 CA ASP A 64 30.083 30.071 3.933 1.00 0.00 C ATOM 940 C ASP A 64 30.696 31.038 4.941 1.00 0.00 C ATOM 941 O ASP A 64 31.189 30.627 5.992 1.00 0.00 O ATOM 942 CB ASP A 64 28.631 29.772 4.323 1.00 0.00 C ATOM 943 CG ASP A 64 27.883 29.163 3.141 1.00 0.00 C ATOM 944 OD1 ASP A 64 28.421 29.182 2.046 1.00 0.00 O ATOM 945 OD2 ASP A 64 26.780 28.686 3.350 1.00 0.00 O ATOM 0 H ASP A 64 30.393 28.035 4.327 1.00 0.00 H new ATOM 0 HA ASP A 64 30.104 30.530 2.945 1.00 0.00 H new ATOM 0 HB2 ASP A 64 28.608 29.086 5.170 1.00 0.00 H new ATOM 0 HB3 ASP A 64 28.136 30.689 4.642 1.00 0.00 H new ATOM 950 N ASP A 65 30.663 32.327 4.612 1.00 0.00 N ATOM 951 CA ASP A 65 31.217 33.357 5.491 1.00 0.00 C ATOM 952 C ASP A 65 30.324 34.595 5.490 1.00 0.00 C ATOM 953 O ASP A 65 29.136 34.514 5.801 1.00 0.00 O ATOM 954 CB ASP A 65 32.626 33.731 5.024 1.00 0.00 C ATOM 955 CG ASP A 65 32.580 34.265 3.597 1.00 0.00 C ATOM 956 OD1 ASP A 65 31.488 34.528 3.121 1.00 0.00 O ATOM 957 OD2 ASP A 65 33.635 34.400 3.001 1.00 0.00 O ATOM 0 H ASP A 65 30.260 32.684 3.746 1.00 0.00 H new ATOM 0 HA ASP A 65 31.265 32.964 6.506 1.00 0.00 H new ATOM 0 HB2 ASP A 65 33.050 34.484 5.689 1.00 0.00 H new ATOM 0 HB3 ASP A 65 33.278 32.859 5.073 1.00 0.00 H new ATOM 962 N ARG A 66 30.904 35.737 5.141 1.00 0.00 N ATOM 963 CA ARG A 66 30.155 36.986 5.106 1.00 0.00 C ATOM 964 C ARG A 66 29.038 36.909 4.070 1.00 0.00 C ATOM 965 O ARG A 66 27.949 37.444 4.276 1.00 0.00 O ATOM 966 CB ARG A 66 31.094 38.143 4.762 1.00 0.00 C ATOM 967 CG ARG A 66 32.018 38.421 5.949 1.00 0.00 C ATOM 968 CD ARG A 66 33.016 39.517 5.572 1.00 0.00 C ATOM 969 NE ARG A 66 33.867 39.840 6.715 1.00 0.00 N ATOM 970 CZ ARG A 66 34.981 39.157 6.965 1.00 0.00 C ATOM 971 NH1 ARG A 66 35.335 38.173 6.183 1.00 0.00 N ATOM 972 NH2 ARG A 66 35.720 39.472 7.993 1.00 0.00 N ATOM 0 H ARG A 66 31.886 35.824 4.879 1.00 0.00 H new ATOM 0 HA ARG A 66 29.713 37.155 6.088 1.00 0.00 H new ATOM 0 HB2 ARG A 66 31.683 37.897 3.879 1.00 0.00 H new ATOM 0 HB3 ARG A 66 30.516 39.035 4.521 1.00 0.00 H new ATOM 0 HG2 ARG A 66 31.432 38.730 6.815 1.00 0.00 H new ATOM 0 HG3 ARG A 66 32.549 37.512 6.231 1.00 0.00 H new ATOM 0 HD2 ARG A 66 33.630 39.187 4.734 1.00 0.00 H new ATOM 0 HD3 ARG A 66 32.481 40.408 5.244 1.00 0.00 H new ATOM 0 HE ARG A 66 33.601 40.606 7.334 1.00 0.00 H new ATOM 0 HH11 ARG A 66 34.757 37.927 5.379 1.00 0.00 H new ATOM 0 HH12 ARG A 66 36.189 37.650 6.376 1.00 0.00 H new ATOM 0 HH21 ARG A 66 35.443 40.241 8.604 1.00 0.00 H new ATOM 0 HH22 ARG A 66 36.574 38.949 8.186 1.00 0.00 H new ATOM 986 N ALA A 67 29.316 36.241 2.956 1.00 0.00 N ATOM 987 CA ALA A 67 28.327 36.101 1.894 1.00 0.00 C ATOM 988 C ALA A 67 27.059 35.447 2.431 1.00 0.00 C ATOM 989 O ALA A 67 27.118 34.542 3.262 1.00 0.00 O ATOM 990 CB ALA A 67 28.897 35.250 0.758 1.00 0.00 C ATOM 0 H ALA A 67 30.211 35.791 2.766 1.00 0.00 H new ATOM 0 HA ALA A 67 28.082 37.094 1.517 1.00 0.00 H new ATOM 0 HB1 ALA A 67 28.152 35.150 -0.031 1.00 0.00 H new ATOM 0 HB2 ALA A 67 29.789 35.730 0.356 1.00 0.00 H new ATOM 0 HB3 ALA A 67 29.157 34.262 1.138 1.00 0.00 H new ATOM 996 N ASP A 68 25.909 35.916 1.951 1.00 0.00 N ATOM 997 CA ASP A 68 24.627 35.376 2.385 1.00 0.00 C ATOM 998 C ASP A 68 23.565 35.586 1.312 1.00 0.00 C ATOM 999 O ASP A 68 22.447 36.009 1.608 1.00 0.00 O ATOM 1000 CB ASP A 68 24.188 36.051 3.684 1.00 0.00 C ATOM 1001 CG ASP A 68 24.035 37.553 3.464 1.00 0.00 C ATOM 1002 OD1 ASP A 68 24.487 38.030 2.436 1.00 0.00 O ATOM 1003 OD2 ASP A 68 23.467 38.204 4.325 1.00 0.00 O ATOM 0 H ASP A 68 25.841 36.666 1.264 1.00 0.00 H new ATOM 0 HA ASP A 68 24.744 34.306 2.556 1.00 0.00 H new ATOM 0 HB2 ASP A 68 23.243 35.626 4.023 1.00 0.00 H new ATOM 0 HB3 ASP A 68 24.922 35.863 4.468 1.00 0.00 H new ATOM 1008 N ALA A 69 23.918 35.290 0.065 1.00 0.00 N ATOM 1009 CA ALA A 69 22.981 35.453 -1.045 1.00 0.00 C ATOM 1010 C ALA A 69 23.347 34.524 -2.197 1.00 0.00 C ATOM 1011 O ALA A 69 23.513 34.965 -3.334 1.00 0.00 O ATOM 1012 CB ALA A 69 23.001 36.902 -1.533 1.00 0.00 C ATOM 0 H ALA A 69 24.838 34.939 -0.203 1.00 0.00 H new ATOM 0 HA ALA A 69 21.981 35.200 -0.692 1.00 0.00 H new ATOM 0 HB1 ALA A 69 22.301 37.017 -2.360 1.00 0.00 H new ATOM 0 HB2 ALA A 69 22.711 37.565 -0.717 1.00 0.00 H new ATOM 0 HB3 ALA A 69 24.005 37.159 -1.870 1.00 0.00 H new ATOM 1018 N LEU A 70 23.472 33.236 -1.895 1.00 0.00 N ATOM 1019 CA LEU A 70 23.823 32.253 -2.912 1.00 0.00 C ATOM 1020 C LEU A 70 22.590 31.840 -3.706 1.00 0.00 C ATOM 1021 O LEU A 70 21.545 31.522 -3.137 1.00 0.00 O ATOM 1022 CB LEU A 70 24.453 31.022 -2.246 1.00 0.00 C ATOM 1023 CG LEU A 70 25.921 31.314 -1.886 1.00 0.00 C ATOM 1024 CD1 LEU A 70 26.788 31.419 -3.162 1.00 0.00 C ATOM 1025 CD2 LEU A 70 25.997 32.629 -1.092 1.00 0.00 C ATOM 0 H LEU A 70 23.336 32.851 -0.960 1.00 0.00 H new ATOM 0 HA LEU A 70 24.542 32.701 -3.598 1.00 0.00 H new ATOM 0 HB2 LEU A 70 23.895 30.758 -1.348 1.00 0.00 H new ATOM 0 HB3 LEU A 70 24.398 30.166 -2.918 1.00 0.00 H new ATOM 0 HG LEU A 70 26.305 30.494 -1.279 1.00 0.00 H new ATOM 0 HD11 LEU A 70 27.821 31.626 -2.884 1.00 0.00 H new ATOM 0 HD12 LEU A 70 26.741 30.479 -3.712 1.00 0.00 H new ATOM 0 HD13 LEU A 70 26.413 32.226 -3.791 1.00 0.00 H new ATOM 0 HD21 LEU A 70 27.035 32.839 -0.835 1.00 0.00 H new ATOM 0 HD22 LEU A 70 25.601 33.444 -1.698 1.00 0.00 H new ATOM 0 HD23 LEU A 70 25.409 32.537 -0.179 1.00 0.00 H new ATOM 1037 N GLN A 71 22.722 31.848 -5.027 1.00 0.00 N ATOM 1038 CA GLN A 71 21.620 31.476 -5.894 1.00 0.00 C ATOM 1039 C GLN A 71 21.222 30.024 -5.657 1.00 0.00 C ATOM 1040 O GLN A 71 20.036 29.694 -5.632 1.00 0.00 O ATOM 1041 CB GLN A 71 22.012 31.669 -7.361 1.00 0.00 C ATOM 1042 CG GLN A 71 22.129 33.163 -7.668 1.00 0.00 C ATOM 1043 CD GLN A 71 22.552 33.365 -9.119 1.00 0.00 C ATOM 1044 OE1 GLN A 71 23.660 32.990 -9.503 1.00 0.00 O ATOM 1045 NE2 GLN A 71 21.727 33.934 -9.956 1.00 0.00 N ATOM 0 H GLN A 71 23.579 32.107 -5.516 1.00 0.00 H new ATOM 0 HA GLN A 71 20.770 32.118 -5.663 1.00 0.00 H new ATOM 0 HB2 GLN A 71 22.960 31.170 -7.563 1.00 0.00 H new ATOM 0 HB3 GLN A 71 21.266 31.211 -8.011 1.00 0.00 H new ATOM 0 HG2 GLN A 71 21.174 33.656 -7.487 1.00 0.00 H new ATOM 0 HG3 GLN A 71 22.857 33.624 -7.001 1.00 0.00 H new ATOM 0 HE21 GLN A 71 20.809 34.244 -9.636 1.00 0.00 H new ATOM 0 HE22 GLN A 71 22.000 34.068 -10.930 1.00 0.00 H new ATOM 1054 N ALA A 72 22.219 29.164 -5.481 1.00 0.00 N ATOM 1055 CA ALA A 72 21.958 27.749 -5.243 1.00 0.00 C ATOM 1056 C ALA A 72 23.211 27.053 -4.721 1.00 0.00 C ATOM 1057 O ALA A 72 23.168 25.887 -4.331 1.00 0.00 O ATOM 1058 CB ALA A 72 21.504 27.078 -6.540 1.00 0.00 C ATOM 0 H ALA A 72 23.207 29.418 -5.498 1.00 0.00 H new ATOM 0 HA ALA A 72 21.171 27.665 -4.494 1.00 0.00 H new ATOM 0 HB1 ALA A 72 21.311 26.021 -6.355 1.00 0.00 H new ATOM 0 HB2 ALA A 72 20.592 27.556 -6.897 1.00 0.00 H new ATOM 0 HB3 ALA A 72 22.285 27.177 -7.294 1.00 0.00 H new ATOM 1064 N GLY A 73 24.325 27.777 -4.718 1.00 0.00 N ATOM 1065 CA GLY A 73 25.585 27.223 -4.240 1.00 0.00 C ATOM 1066 C GLY A 73 26.231 26.340 -5.298 1.00 0.00 C ATOM 1067 O GLY A 73 27.235 25.676 -5.043 1.00 0.00 O ATOM 0 H GLY A 73 24.381 28.743 -5.039 1.00 0.00 H new ATOM 0 HA2 GLY A 73 26.264 28.033 -3.973 1.00 0.00 H new ATOM 0 HA3 GLY A 73 25.410 26.642 -3.334 1.00 0.00 H new ATOM 1071 N ALA A 74 25.646 26.338 -6.488 1.00 0.00 N ATOM 1072 CA ALA A 74 26.169 25.533 -7.588 1.00 0.00 C ATOM 1073 C ALA A 74 26.553 24.140 -7.096 1.00 0.00 C ATOM 1074 O ALA A 74 27.599 23.607 -7.468 1.00 0.00 O ATOM 1075 CB ALA A 74 27.393 26.216 -8.199 1.00 0.00 C ATOM 0 H ALA A 74 24.814 26.881 -6.718 1.00 0.00 H new ATOM 0 HA ALA A 74 25.391 25.437 -8.346 1.00 0.00 H new ATOM 0 HB1 ALA A 74 27.777 25.609 -9.019 1.00 0.00 H new ATOM 0 HB2 ALA A 74 27.111 27.199 -8.576 1.00 0.00 H new ATOM 0 HB3 ALA A 74 28.165 26.328 -7.438 1.00 0.00 H new ATOM 1081 N SER A 75 25.704 23.559 -6.254 1.00 0.00 N ATOM 1082 CA SER A 75 25.969 22.234 -5.716 1.00 0.00 C ATOM 1083 C SER A 75 25.982 21.198 -6.833 1.00 0.00 C ATOM 1084 O SER A 75 25.084 21.169 -7.675 1.00 0.00 O ATOM 1085 CB SER A 75 24.897 21.864 -4.689 1.00 0.00 C ATOM 1086 OG SER A 75 25.138 20.548 -4.211 1.00 0.00 O ATOM 0 H SER A 75 24.834 23.983 -5.933 1.00 0.00 H new ATOM 0 HA SER A 75 26.946 22.246 -5.233 1.00 0.00 H new ATOM 0 HB2 SER A 75 24.911 22.572 -3.861 1.00 0.00 H new ATOM 0 HB3 SER A 75 23.907 21.923 -5.142 1.00 0.00 H new ATOM 0 HG SER A 75 24.454 20.309 -3.552 1.00 0.00 H new ATOM 1092 N GLN A 76 27.005 20.345 -6.835 1.00 0.00 N ATOM 1093 CA GLN A 76 27.129 19.301 -7.854 1.00 0.00 C ATOM 1094 C GLN A 76 26.716 17.949 -7.287 1.00 0.00 C ATOM 1095 O GLN A 76 26.421 17.018 -8.034 1.00 0.00 O ATOM 1096 CB GLN A 76 28.576 19.230 -8.349 1.00 0.00 C ATOM 1097 CG GLN A 76 28.919 20.515 -9.107 1.00 0.00 C ATOM 1098 CD GLN A 76 30.384 20.498 -9.526 1.00 0.00 C ATOM 1099 OE1 GLN A 76 31.072 19.494 -9.337 1.00 0.00 O ATOM 1100 NE2 GLN A 76 30.907 21.556 -10.080 1.00 0.00 N ATOM 0 H GLN A 76 27.757 20.355 -6.146 1.00 0.00 H new ATOM 0 HA GLN A 76 26.470 19.548 -8.687 1.00 0.00 H new ATOM 0 HB2 GLN A 76 29.254 19.100 -7.506 1.00 0.00 H new ATOM 0 HB3 GLN A 76 28.707 18.365 -8.999 1.00 0.00 H new ATOM 0 HG2 GLN A 76 28.282 20.609 -9.986 1.00 0.00 H new ATOM 0 HG3 GLN A 76 28.723 21.382 -8.477 1.00 0.00 H new ATOM 0 HE21 GLN A 76 30.335 22.386 -10.235 1.00 0.00 H new ATOM 0 HE22 GLN A 76 31.888 21.554 -10.358 1.00 0.00 H new ATOM 1109 N PHE A 77 26.698 17.846 -5.963 1.00 0.00 N ATOM 1110 CA PHE A 77 26.318 16.600 -5.306 1.00 0.00 C ATOM 1111 C PHE A 77 24.839 16.300 -5.534 1.00 0.00 C ATOM 1112 O PHE A 77 24.447 15.147 -5.705 1.00 0.00 O ATOM 1113 CB PHE A 77 26.596 16.689 -3.807 1.00 0.00 C ATOM 1114 CG PHE A 77 28.085 16.773 -3.577 1.00 0.00 C ATOM 1115 CD1 PHE A 77 28.866 15.610 -3.605 1.00 0.00 C ATOM 1116 CD2 PHE A 77 28.688 18.013 -3.335 1.00 0.00 C ATOM 1117 CE1 PHE A 77 30.248 15.690 -3.391 1.00 0.00 C ATOM 1118 CE2 PHE A 77 30.068 18.092 -3.120 1.00 0.00 C ATOM 1119 CZ PHE A 77 30.848 16.930 -3.148 1.00 0.00 C ATOM 0 H PHE A 77 26.940 18.605 -5.326 1.00 0.00 H new ATOM 0 HA PHE A 77 26.911 15.793 -5.736 1.00 0.00 H new ATOM 0 HB2 PHE A 77 26.102 17.565 -3.386 1.00 0.00 H new ATOM 0 HB3 PHE A 77 26.187 15.816 -3.298 1.00 0.00 H new ATOM 0 HD1 PHE A 77 28.403 14.652 -3.791 1.00 0.00 H new ATOM 0 HD2 PHE A 77 28.087 18.910 -3.314 1.00 0.00 H new ATOM 0 HE1 PHE A 77 30.851 14.794 -3.414 1.00 0.00 H new ATOM 0 HE2 PHE A 77 30.532 19.049 -2.932 1.00 0.00 H new ATOM 0 HZ PHE A 77 31.913 16.991 -2.982 1.00 0.00 H new ATOM 1129 N GLU A 78 24.021 17.348 -5.524 1.00 0.00 N ATOM 1130 CA GLU A 78 22.586 17.189 -5.722 1.00 0.00 C ATOM 1131 C GLU A 78 22.299 16.460 -7.030 1.00 0.00 C ATOM 1132 O GLU A 78 21.219 15.896 -7.213 1.00 0.00 O ATOM 1133 CB GLU A 78 21.905 18.559 -5.739 1.00 0.00 C ATOM 1134 CG GLU A 78 22.544 19.440 -6.820 1.00 0.00 C ATOM 1135 CD GLU A 78 21.804 20.769 -6.913 1.00 0.00 C ATOM 1136 OE1 GLU A 78 20.767 20.895 -6.280 1.00 0.00 O ATOM 1137 OE2 GLU A 78 22.279 21.640 -7.622 1.00 0.00 O ATOM 0 H GLU A 78 24.326 18.311 -5.382 1.00 0.00 H new ATOM 0 HA GLU A 78 22.191 16.597 -4.897 1.00 0.00 H new ATOM 0 HB2 GLU A 78 20.839 18.444 -5.934 1.00 0.00 H new ATOM 0 HB3 GLU A 78 22.001 19.036 -4.764 1.00 0.00 H new ATOM 0 HG2 GLU A 78 23.594 19.615 -6.585 1.00 0.00 H new ATOM 0 HG3 GLU A 78 22.513 18.929 -7.782 1.00 0.00 H new ATOM 1144 N THR A 79 23.268 16.478 -7.939 1.00 0.00 N ATOM 1145 CA THR A 79 23.101 15.818 -9.228 1.00 0.00 C ATOM 1146 C THR A 79 22.898 14.316 -9.041 1.00 0.00 C ATOM 1147 O THR A 79 22.024 13.717 -9.662 1.00 0.00 O ATOM 1148 CB THR A 79 24.335 16.058 -10.102 1.00 0.00 C ATOM 1149 OG1 THR A 79 25.468 15.454 -9.493 1.00 0.00 O ATOM 1150 CG2 THR A 79 24.573 17.562 -10.249 1.00 0.00 C ATOM 0 H THR A 79 24.169 16.938 -7.809 1.00 0.00 H new ATOM 0 HA THR A 79 22.220 16.236 -9.715 1.00 0.00 H new ATOM 0 HB THR A 79 24.175 15.620 -11.087 1.00 0.00 H new ATOM 0 HG1 THR A 79 26.068 16.151 -9.154 1.00 0.00 H new ATOM 0 HG21 THR A 79 25.452 17.732 -10.871 1.00 0.00 H new ATOM 0 HG22 THR A 79 23.703 18.024 -10.715 1.00 0.00 H new ATOM 0 HG23 THR A 79 24.734 18.003 -9.265 1.00 0.00 H new ATOM 1158 N SER A 80 23.712 13.717 -8.177 1.00 0.00 N ATOM 1159 CA SER A 80 23.609 12.286 -7.916 1.00 0.00 C ATOM 1160 C SER A 80 22.244 11.942 -7.326 1.00 0.00 C ATOM 1161 O SER A 80 21.618 10.957 -7.717 1.00 0.00 O ATOM 1162 CB SER A 80 24.709 11.852 -6.947 1.00 0.00 C ATOM 1163 OG SER A 80 25.976 12.170 -7.506 1.00 0.00 O ATOM 0 H SER A 80 24.443 14.195 -7.651 1.00 0.00 H new ATOM 0 HA SER A 80 23.726 11.756 -8.861 1.00 0.00 H new ATOM 0 HB2 SER A 80 24.585 12.355 -5.988 1.00 0.00 H new ATOM 0 HB3 SER A 80 24.641 10.781 -6.756 1.00 0.00 H new ATOM 0 HG SER A 80 26.685 11.895 -6.887 1.00 0.00 H new ATOM 1169 N ALA A 81 21.791 12.762 -6.383 1.00 0.00 N ATOM 1170 CA ALA A 81 20.500 12.538 -5.742 1.00 0.00 C ATOM 1171 C ALA A 81 19.364 12.697 -6.746 1.00 0.00 C ATOM 1172 O ALA A 81 18.366 11.979 -6.688 1.00 0.00 O ATOM 1173 CB ALA A 81 20.307 13.527 -4.591 1.00 0.00 C ATOM 0 H ALA A 81 22.295 13.583 -6.047 1.00 0.00 H new ATOM 0 HA ALA A 81 20.485 11.520 -5.353 1.00 0.00 H new ATOM 0 HB1 ALA A 81 19.340 13.352 -4.119 1.00 0.00 H new ATOM 0 HB2 ALA A 81 21.100 13.389 -3.856 1.00 0.00 H new ATOM 0 HB3 ALA A 81 20.343 14.546 -4.977 1.00 0.00 H new ATOM 1179 N ALA A 82 19.519 13.645 -7.664 1.00 0.00 N ATOM 1180 CA ALA A 82 18.495 13.892 -8.671 1.00 0.00 C ATOM 1181 C ALA A 82 18.204 12.619 -9.456 1.00 0.00 C ATOM 1182 O ALA A 82 17.062 12.358 -9.829 1.00 0.00 O ATOM 1183 CB ALA A 82 18.959 14.993 -9.629 1.00 0.00 C ATOM 0 H ALA A 82 20.337 14.250 -7.731 1.00 0.00 H new ATOM 0 HA ALA A 82 17.583 14.212 -8.167 1.00 0.00 H new ATOM 0 HB1 ALA A 82 18.188 15.172 -10.379 1.00 0.00 H new ATOM 0 HB2 ALA A 82 19.140 15.910 -9.069 1.00 0.00 H new ATOM 0 HB3 ALA A 82 19.880 14.682 -10.122 1.00 0.00 H new ATOM 1189 N LYS A 83 19.243 11.831 -9.710 1.00 0.00 N ATOM 1190 CA LYS A 83 19.077 10.595 -10.456 1.00 0.00 C ATOM 1191 C LYS A 83 18.153 9.635 -9.717 1.00 0.00 C ATOM 1192 O LYS A 83 17.222 9.080 -10.301 1.00 0.00 O ATOM 1193 CB LYS A 83 20.443 9.934 -10.648 1.00 0.00 C ATOM 1194 CG LYS A 83 21.308 10.782 -11.602 1.00 0.00 C ATOM 1195 CD LYS A 83 21.042 10.378 -13.066 1.00 0.00 C ATOM 1196 CE LYS A 83 21.941 9.201 -13.450 1.00 0.00 C ATOM 1197 NZ LYS A 83 21.632 8.776 -14.841 1.00 0.00 N ATOM 0 H LYS A 83 20.199 12.026 -9.413 1.00 0.00 H new ATOM 0 HA LYS A 83 18.633 10.830 -11.423 1.00 0.00 H new ATOM 0 HB2 LYS A 83 20.944 9.829 -9.686 1.00 0.00 H new ATOM 0 HB3 LYS A 83 20.317 8.930 -11.053 1.00 0.00 H new ATOM 0 HG2 LYS A 83 21.085 11.840 -11.463 1.00 0.00 H new ATOM 0 HG3 LYS A 83 22.363 10.645 -11.366 1.00 0.00 H new ATOM 0 HD2 LYS A 83 19.995 10.104 -13.193 1.00 0.00 H new ATOM 0 HD3 LYS A 83 21.232 11.224 -13.727 1.00 0.00 H new ATOM 0 HE2 LYS A 83 22.989 9.489 -13.370 1.00 0.00 H new ATOM 0 HE3 LYS A 83 21.785 8.371 -12.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 22.242 7.976 -15.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 20.635 8.485 -14.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 21.802 9.569 -15.492 1.00 0.00 H new ATOM 1211 N LEU A 84 18.412 9.449 -8.430 1.00 0.00 N ATOM 1212 CA LEU A 84 17.595 8.557 -7.617 1.00 0.00 C ATOM 1213 C LEU A 84 16.183 9.116 -7.475 1.00 0.00 C ATOM 1214 O LEU A 84 15.203 8.375 -7.508 1.00 0.00 O ATOM 1215 CB LEU A 84 18.231 8.380 -6.233 1.00 0.00 C ATOM 1216 CG LEU A 84 19.368 7.356 -6.316 1.00 0.00 C ATOM 1217 CD1 LEU A 84 20.445 7.863 -7.279 1.00 0.00 C ATOM 1218 CD2 LEU A 84 19.976 7.164 -4.925 1.00 0.00 C ATOM 0 H LEU A 84 19.177 9.901 -7.928 1.00 0.00 H new ATOM 0 HA LEU A 84 17.539 7.586 -8.109 1.00 0.00 H new ATOM 0 HB2 LEU A 84 18.614 9.335 -5.873 1.00 0.00 H new ATOM 0 HB3 LEU A 84 17.480 8.047 -5.517 1.00 0.00 H new ATOM 0 HG LEU A 84 18.978 6.405 -6.680 1.00 0.00 H new ATOM 0 HD11 LEU A 84 21.253 7.134 -7.337 1.00 0.00 H new ATOM 0 HD12 LEU A 84 20.011 8.004 -8.269 1.00 0.00 H new ATOM 0 HD13 LEU A 84 20.839 8.813 -6.917 1.00 0.00 H new ATOM 0 HD21 LEU A 84 20.786 6.436 -4.979 1.00 0.00 H new ATOM 0 HD22 LEU A 84 20.367 8.115 -4.564 1.00 0.00 H new ATOM 0 HD23 LEU A 84 19.209 6.803 -4.239 1.00 0.00 H new ATOM 1230 N LYS A 85 16.092 10.430 -7.312 1.00 0.00 N ATOM 1231 CA LYS A 85 14.799 11.084 -7.159 1.00 0.00 C ATOM 1232 C LYS A 85 13.936 10.859 -8.393 1.00 0.00 C ATOM 1233 O LYS A 85 12.709 10.831 -8.306 1.00 0.00 O ATOM 1234 CB LYS A 85 14.992 12.585 -6.931 1.00 0.00 C ATOM 1235 CG LYS A 85 13.639 13.236 -6.642 1.00 0.00 C ATOM 1236 CD LYS A 85 13.839 14.721 -6.336 1.00 0.00 C ATOM 1237 CE LYS A 85 12.485 15.367 -6.033 1.00 0.00 C ATOM 1238 NZ LYS A 85 12.688 16.800 -5.677 1.00 0.00 N ATOM 0 H LYS A 85 16.893 11.061 -7.282 1.00 0.00 H new ATOM 0 HA LYS A 85 14.295 10.651 -6.295 1.00 0.00 H new ATOM 0 HB2 LYS A 85 15.673 12.752 -6.097 1.00 0.00 H new ATOM 0 HB3 LYS A 85 15.447 13.042 -7.810 1.00 0.00 H new ATOM 0 HG2 LYS A 85 12.976 13.117 -7.499 1.00 0.00 H new ATOM 0 HG3 LYS A 85 13.159 12.742 -5.797 1.00 0.00 H new ATOM 0 HD2 LYS A 85 14.509 14.841 -5.485 1.00 0.00 H new ATOM 0 HD3 LYS A 85 14.309 15.218 -7.185 1.00 0.00 H new ATOM 0 HE2 LYS A 85 11.829 15.286 -6.900 1.00 0.00 H new ATOM 0 HE3 LYS A 85 11.995 14.843 -5.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 11.769 17.240 -5.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 13.299 16.866 -4.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 13.138 17.295 -6.473 1.00 0.00 H new ATOM 1252 N ARG A 86 14.582 10.706 -9.542 1.00 0.00 N ATOM 1253 CA ARG A 86 13.858 10.493 -10.788 1.00 0.00 C ATOM 1254 C ARG A 86 12.981 9.252 -10.697 1.00 0.00 C ATOM 1255 O ARG A 86 11.820 9.267 -11.110 1.00 0.00 O ATOM 1256 CB ARG A 86 14.849 10.335 -11.944 1.00 0.00 C ATOM 1257 CG ARG A 86 14.084 10.207 -13.262 1.00 0.00 C ATOM 1258 CD ARG A 86 15.074 10.205 -14.428 1.00 0.00 C ATOM 1259 NE ARG A 86 15.955 9.045 -14.344 1.00 0.00 N ATOM 1260 CZ ARG A 86 16.957 8.879 -15.203 1.00 0.00 C ATOM 1261 NH1 ARG A 86 17.160 9.758 -16.146 1.00 0.00 N ATOM 1262 NH2 ARG A 86 17.736 7.837 -15.102 1.00 0.00 N ATOM 0 H ARG A 86 15.597 10.725 -9.637 1.00 0.00 H new ATOM 0 HA ARG A 86 13.221 11.359 -10.967 1.00 0.00 H new ATOM 0 HB2 ARG A 86 15.518 11.194 -11.982 1.00 0.00 H new ATOM 0 HB3 ARG A 86 15.471 9.454 -11.786 1.00 0.00 H new ATOM 0 HG2 ARG A 86 13.498 9.288 -13.267 1.00 0.00 H new ATOM 0 HG3 ARG A 86 13.381 11.034 -13.369 1.00 0.00 H new ATOM 0 HD2 ARG A 86 14.532 10.191 -15.374 1.00 0.00 H new ATOM 0 HD3 ARG A 86 15.665 11.121 -14.413 1.00 0.00 H new ATOM 0 HE ARG A 86 15.800 8.350 -13.614 1.00 0.00 H new ATOM 0 HH11 ARG A 86 16.550 10.572 -16.224 1.00 0.00 H new ATOM 0 HH12 ARG A 86 17.928 9.631 -16.805 1.00 0.00 H new ATOM 0 HH21 ARG A 86 17.576 7.150 -14.365 1.00 0.00 H new ATOM 0 HH22 ARG A 86 18.505 7.709 -15.760 1.00 0.00 H new ATOM 1276 N LYS A 87 13.541 8.181 -10.153 1.00 0.00 N ATOM 1277 CA LYS A 87 12.804 6.923 -10.006 1.00 0.00 C ATOM 1278 C LYS A 87 12.316 6.750 -8.573 1.00 0.00 C ATOM 1279 O LYS A 87 11.143 6.460 -8.337 1.00 0.00 O ATOM 1280 CB LYS A 87 13.702 5.747 -10.385 1.00 0.00 C ATOM 1281 CG LYS A 87 14.224 5.928 -11.817 1.00 0.00 C ATOM 1282 CD LYS A 87 13.055 5.901 -12.814 1.00 0.00 C ATOM 1283 CE LYS A 87 13.582 5.603 -14.218 1.00 0.00 C ATOM 1284 NZ LYS A 87 14.552 6.664 -14.612 1.00 0.00 N ATOM 0 H LYS A 87 14.500 8.152 -9.806 1.00 0.00 H new ATOM 0 HA LYS A 87 11.940 6.951 -10.670 1.00 0.00 H new ATOM 0 HB2 LYS A 87 14.539 5.678 -9.690 1.00 0.00 H new ATOM 0 HB3 LYS A 87 13.145 4.813 -10.307 1.00 0.00 H new ATOM 0 HG2 LYS A 87 14.761 6.873 -11.900 1.00 0.00 H new ATOM 0 HG3 LYS A 87 14.934 5.136 -12.056 1.00 0.00 H new ATOM 0 HD2 LYS A 87 12.330 5.143 -12.519 1.00 0.00 H new ATOM 0 HD3 LYS A 87 12.535 6.859 -12.806 1.00 0.00 H new ATOM 0 HE2 LYS A 87 14.065 4.626 -14.239 1.00 0.00 H new ATOM 0 HE3 LYS A 87 12.757 5.566 -14.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 14.772 6.575 -15.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 14.136 7.600 -14.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 15.426 6.559 -14.058 1.00 0.00 H new ATOM 1298 N TYR A 88 13.222 6.926 -7.621 1.00 0.00 N ATOM 1299 CA TYR A 88 12.872 6.784 -6.215 1.00 0.00 C ATOM 1300 C TYR A 88 12.152 5.463 -5.974 1.00 0.00 C ATOM 1301 O TYR A 88 11.602 5.233 -4.898 1.00 0.00 O ATOM 1302 CB TYR A 88 11.969 7.943 -5.783 1.00 0.00 C ATOM 1303 CG TYR A 88 11.777 7.897 -4.284 1.00 0.00 C ATOM 1304 CD1 TYR A 88 12.776 8.392 -3.438 1.00 0.00 C ATOM 1305 CD2 TYR A 88 10.599 7.367 -3.743 1.00 0.00 C ATOM 1306 CE1 TYR A 88 12.599 8.350 -2.048 1.00 0.00 C ATOM 1307 CE2 TYR A 88 10.424 7.325 -2.355 1.00 0.00 C ATOM 1308 CZ TYR A 88 11.422 7.819 -1.508 1.00 0.00 C ATOM 1309 OH TYR A 88 11.250 7.780 -0.139 1.00 0.00 O ATOM 0 H TYR A 88 14.198 7.166 -7.795 1.00 0.00 H new ATOM 0 HA TYR A 88 13.790 6.798 -5.628 1.00 0.00 H new ATOM 0 HB2 TYR A 88 12.414 8.894 -6.075 1.00 0.00 H new ATOM 0 HB3 TYR A 88 11.005 7.875 -6.287 1.00 0.00 H new ATOM 0 HD1 TYR A 88 13.682 8.806 -3.855 1.00 0.00 H new ATOM 0 HD2 TYR A 88 9.826 6.991 -4.397 1.00 0.00 H new ATOM 0 HE1 TYR A 88 13.371 8.727 -1.394 1.00 0.00 H new ATOM 0 HE2 TYR A 88 9.518 6.911 -1.938 1.00 0.00 H new ATOM 0 HH TYR A 88 10.379 7.383 0.070 1.00 0.00 H new ATOM 1319 N TRP A 89 12.159 4.596 -6.984 1.00 0.00 N ATOM 1320 CA TRP A 89 11.502 3.297 -6.867 1.00 0.00 C ATOM 1321 C TRP A 89 12.174 2.271 -7.774 1.00 0.00 C ATOM 1322 O TRP A 89 12.808 1.328 -7.300 1.00 0.00 O ATOM 1323 CB TRP A 89 10.019 3.426 -7.244 1.00 0.00 C ATOM 1324 CG TRP A 89 9.251 2.277 -6.670 1.00 0.00 C ATOM 1325 CD1 TRP A 89 8.946 2.130 -5.362 1.00 0.00 C ATOM 1326 CD2 TRP A 89 8.690 1.121 -7.356 1.00 0.00 C ATOM 1327 NE1 TRP A 89 8.233 0.957 -5.199 1.00 0.00 N ATOM 1328 CE2 TRP A 89 8.046 0.300 -6.398 1.00 0.00 C ATOM 1329 CE3 TRP A 89 8.672 0.711 -8.700 1.00 0.00 C ATOM 1330 CZ2 TRP A 89 7.414 -0.888 -6.762 1.00 0.00 C ATOM 1331 CZ3 TRP A 89 8.036 -0.485 -9.069 1.00 0.00 C ATOM 1332 CH2 TRP A 89 7.406 -1.281 -8.103 1.00 0.00 C ATOM 0 H TRP A 89 12.608 4.767 -7.884 1.00 0.00 H new ATOM 0 HA TRP A 89 11.587 2.959 -5.834 1.00 0.00 H new ATOM 0 HB2 TRP A 89 9.619 4.368 -6.868 1.00 0.00 H new ATOM 0 HB3 TRP A 89 9.910 3.444 -8.328 1.00 0.00 H new ATOM 0 HD1 TRP A 89 9.215 2.817 -4.573 1.00 0.00 H new ATOM 0 HE1 TRP A 89 7.887 0.618 -4.301 1.00 0.00 H new ATOM 0 HE3 TRP A 89 9.150 1.319 -9.453 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 6.934 -1.500 -6.013 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 8.032 -0.794 -10.104 1.00 0.00 H new ATOM 0 HH2 TRP A 89 6.915 -2.197 -8.395 1.00 0.00 H new ATOM 1343 N TRP A 90 12.024 2.456 -9.082 1.00 0.00 N ATOM 1344 CA TRP A 90 12.616 1.533 -10.043 1.00 0.00 C ATOM 1345 C TRP A 90 14.131 1.497 -9.891 1.00 0.00 C ATOM 1346 O TRP A 90 14.722 0.424 -9.803 1.00 0.00 O ATOM 1347 CB TRP A 90 12.260 1.963 -11.466 1.00 0.00 C ATOM 1348 CG TRP A 90 10.779 1.888 -11.655 1.00 0.00 C ATOM 1349 CD1 TRP A 90 9.924 2.923 -11.492 1.00 0.00 C ATOM 1350 CD2 TRP A 90 9.968 0.743 -12.043 1.00 0.00 C ATOM 1351 NE1 TRP A 90 8.638 2.484 -11.751 1.00 0.00 N ATOM 1352 CE2 TRP A 90 8.613 1.148 -12.096 1.00 0.00 C ATOM 1353 CE3 TRP A 90 10.272 -0.597 -12.348 1.00 0.00 C ATOM 1354 CZ2 TRP A 90 7.596 0.258 -12.442 1.00 0.00 C ATOM 1355 CZ3 TRP A 90 9.251 -1.495 -12.696 1.00 0.00 C ATOM 1356 CH2 TRP A 90 7.916 -1.069 -12.742 1.00 0.00 C ATOM 0 H TRP A 90 11.503 3.228 -9.497 1.00 0.00 H new ATOM 0 HA TRP A 90 12.218 0.537 -9.851 1.00 0.00 H new ATOM 0 HB2 TRP A 90 12.609 2.979 -11.648 1.00 0.00 H new ATOM 0 HB3 TRP A 90 12.762 1.319 -12.188 1.00 0.00 H new ATOM 0 HD1 TRP A 90 10.200 3.927 -11.206 1.00 0.00 H new ATOM 0 HE1 TRP A 90 7.809 3.076 -11.694 1.00 0.00 H new ATOM 0 HE3 TRP A 90 11.297 -0.936 -12.314 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 6.569 0.592 -12.478 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 9.495 -2.521 -12.930 1.00 0.00 H new ATOM 0 HH2 TRP A 90 7.135 -1.766 -13.009 1.00 0.00 H new ATOM 1367 N LYS A 91 14.750 2.678 -9.851 1.00 0.00 N ATOM 1368 CA LYS A 91 16.199 2.768 -9.702 1.00 0.00 C ATOM 1369 C LYS A 91 16.905 1.846 -10.695 1.00 0.00 C ATOM 1370 O LYS A 91 16.909 0.627 -10.536 1.00 0.00 O ATOM 1371 CB LYS A 91 16.596 2.388 -8.277 1.00 0.00 C ATOM 1372 CG LYS A 91 16.082 3.451 -7.305 1.00 0.00 C ATOM 1373 CD LYS A 91 16.351 2.995 -5.867 1.00 0.00 C ATOM 1374 CE LYS A 91 17.863 2.913 -5.608 1.00 0.00 C ATOM 1375 NZ LYS A 91 18.361 1.574 -6.035 1.00 0.00 N ATOM 0 H LYS A 91 14.273 3.577 -9.919 1.00 0.00 H new ATOM 0 HA LYS A 91 16.503 3.795 -9.905 1.00 0.00 H new ATOM 0 HB2 LYS A 91 16.181 1.413 -8.020 1.00 0.00 H new ATOM 0 HB3 LYS A 91 17.680 2.303 -8.200 1.00 0.00 H new ATOM 0 HG2 LYS A 91 16.577 4.404 -7.495 1.00 0.00 H new ATOM 0 HG3 LYS A 91 15.014 3.611 -7.454 1.00 0.00 H new ATOM 0 HD2 LYS A 91 15.892 3.692 -5.165 1.00 0.00 H new ATOM 0 HD3 LYS A 91 15.892 2.021 -5.695 1.00 0.00 H new ATOM 0 HE2 LYS A 91 18.381 3.699 -6.157 1.00 0.00 H new ATOM 0 HE3 LYS A 91 18.072 3.072 -4.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 18.885 1.133 -5.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 17.555 0.971 -6.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 18.991 1.683 -6.855 1.00 0.00 H new ATOM 1389 N ASN A 92 17.507 2.438 -11.720 1.00 0.00 N ATOM 1390 CA ASN A 92 18.209 1.656 -12.730 1.00 0.00 C ATOM 1391 C ASN A 92 19.388 0.911 -12.112 1.00 0.00 C ATOM 1392 O ASN A 92 19.850 -0.096 -12.649 1.00 0.00 O ATOM 1393 CB ASN A 92 18.710 2.575 -13.845 1.00 0.00 C ATOM 1394 CG ASN A 92 19.476 3.749 -13.247 1.00 0.00 C ATOM 1395 OD1 ASN A 92 19.265 4.103 -12.087 1.00 0.00 O ATOM 1396 ND2 ASN A 92 20.360 4.379 -13.973 1.00 0.00 N ATOM 0 H ASN A 92 17.524 3.446 -11.873 1.00 0.00 H new ATOM 0 HA ASN A 92 17.513 0.926 -13.145 1.00 0.00 H new ATOM 0 HB2 ASN A 92 19.355 2.018 -14.525 1.00 0.00 H new ATOM 0 HB3 ASN A 92 17.868 2.941 -14.432 1.00 0.00 H new ATOM 0 HD21 ASN A 92 20.877 5.165 -13.579 1.00 0.00 H new ATOM 0 HD22 ASN A 92 20.534 4.085 -14.934 1.00 0.00 H new ATOM 1403 N LEU A 93 19.865 1.410 -10.979 1.00 0.00 N ATOM 1404 CA LEU A 93 20.987 0.787 -10.287 1.00 0.00 C ATOM 1405 C LEU A 93 20.585 -0.581 -9.742 1.00 0.00 C ATOM 1406 O LEU A 93 21.414 -1.486 -9.634 1.00 0.00 O ATOM 1407 CB LEU A 93 21.467 1.689 -9.138 1.00 0.00 C ATOM 1408 CG LEU A 93 22.386 2.785 -9.689 1.00 0.00 C ATOM 1409 CD1 LEU A 93 21.597 3.678 -10.647 1.00 0.00 C ATOM 1410 CD2 LEU A 93 22.918 3.629 -8.529 1.00 0.00 C ATOM 0 H LEU A 93 19.494 2.242 -10.520 1.00 0.00 H new ATOM 0 HA LEU A 93 21.802 0.654 -10.999 1.00 0.00 H new ATOM 0 HB2 LEU A 93 20.611 2.138 -8.634 1.00 0.00 H new ATOM 0 HB3 LEU A 93 21.999 1.095 -8.395 1.00 0.00 H new ATOM 0 HG LEU A 93 23.220 2.328 -10.222 1.00 0.00 H new ATOM 0 HD11 LEU A 93 22.250 4.458 -11.039 1.00 0.00 H new ATOM 0 HD12 LEU A 93 21.213 3.077 -11.472 1.00 0.00 H new ATOM 0 HD13 LEU A 93 20.764 4.137 -10.114 1.00 0.00 H new ATOM 0 HD21 LEU A 93 23.572 4.410 -8.917 1.00 0.00 H new ATOM 0 HD22 LEU A 93 22.083 4.086 -7.999 1.00 0.00 H new ATOM 0 HD23 LEU A 93 23.479 2.993 -7.844 1.00 0.00 H new ATOM 1422 N LYS A 94 19.313 -0.720 -9.387 1.00 0.00 N ATOM 1423 CA LYS A 94 18.820 -1.976 -8.837 1.00 0.00 C ATOM 1424 C LYS A 94 19.078 -3.123 -9.809 1.00 0.00 C ATOM 1425 O LYS A 94 19.486 -4.211 -9.403 1.00 0.00 O ATOM 1426 CB LYS A 94 17.320 -1.867 -8.558 1.00 0.00 C ATOM 1427 CG LYS A 94 16.835 -3.140 -7.864 1.00 0.00 C ATOM 1428 CD LYS A 94 15.354 -2.996 -7.508 1.00 0.00 C ATOM 1429 CE LYS A 94 14.872 -4.263 -6.799 1.00 0.00 C ATOM 1430 NZ LYS A 94 15.612 -4.422 -5.514 1.00 0.00 N ATOM 0 H LYS A 94 18.610 0.015 -9.469 1.00 0.00 H new ATOM 0 HA LYS A 94 19.349 -2.179 -7.906 1.00 0.00 H new ATOM 0 HB2 LYS A 94 17.118 -0.999 -7.930 1.00 0.00 H new ATOM 0 HB3 LYS A 94 16.776 -1.719 -9.491 1.00 0.00 H new ATOM 0 HG2 LYS A 94 16.981 -4.001 -8.517 1.00 0.00 H new ATOM 0 HG3 LYS A 94 17.421 -3.321 -6.963 1.00 0.00 H new ATOM 0 HD2 LYS A 94 15.207 -2.129 -6.865 1.00 0.00 H new ATOM 0 HD3 LYS A 94 14.767 -2.827 -8.411 1.00 0.00 H new ATOM 0 HE2 LYS A 94 13.800 -4.202 -6.609 1.00 0.00 H new ATOM 0 HE3 LYS A 94 15.034 -5.133 -7.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 14.942 -4.657 -4.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 16.310 -5.187 -5.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 16.101 -3.534 -5.283 1.00 0.00 H new ATOM 1444 N MET A 95 18.848 -2.873 -11.090 1.00 0.00 N ATOM 1445 CA MET A 95 19.068 -3.894 -12.108 1.00 0.00 C ATOM 1446 C MET A 95 20.547 -4.258 -12.191 1.00 0.00 C ATOM 1447 O MET A 95 20.900 -5.426 -12.349 1.00 0.00 O ATOM 1448 CB MET A 95 18.586 -3.387 -13.470 1.00 0.00 C ATOM 1449 CG MET A 95 17.057 -3.419 -13.516 1.00 0.00 C ATOM 1450 SD MET A 95 16.482 -2.832 -15.132 1.00 0.00 S ATOM 1451 CE MET A 95 16.640 -1.057 -14.816 1.00 0.00 C ATOM 0 H MET A 95 18.512 -1.979 -11.449 1.00 0.00 H new ATOM 0 HA MET A 95 18.502 -4.784 -11.832 1.00 0.00 H new ATOM 0 HB2 MET A 95 18.944 -2.371 -13.639 1.00 0.00 H new ATOM 0 HB3 MET A 95 18.997 -4.007 -14.267 1.00 0.00 H new ATOM 0 HG2 MET A 95 16.699 -4.433 -13.338 1.00 0.00 H new ATOM 0 HG3 MET A 95 16.647 -2.793 -12.724 1.00 0.00 H new ATOM 0 HE1 MET A 95 16.137 -0.500 -15.607 1.00 0.00 H new ATOM 0 HE2 MET A 95 16.183 -0.816 -13.856 1.00 0.00 H new ATOM 0 HE3 MET A 95 17.695 -0.784 -14.794 1.00 0.00 H new ATOM 1461 N MET A 96 21.408 -3.251 -12.087 1.00 0.00 N ATOM 1462 CA MET A 96 22.846 -3.482 -12.158 1.00 0.00 C ATOM 1463 C MET A 96 23.307 -4.347 -10.988 1.00 0.00 C ATOM 1464 O MET A 96 24.131 -5.245 -11.156 1.00 0.00 O ATOM 1465 CB MET A 96 23.588 -2.144 -12.130 1.00 0.00 C ATOM 1466 CG MET A 96 23.434 -1.443 -13.481 1.00 0.00 C ATOM 1467 SD MET A 96 24.212 0.190 -13.403 1.00 0.00 S ATOM 1468 CE MET A 96 25.914 -0.374 -13.157 1.00 0.00 C ATOM 0 H MET A 96 21.139 -2.276 -11.955 1.00 0.00 H new ATOM 0 HA MET A 96 23.069 -4.003 -13.089 1.00 0.00 H new ATOM 0 HB2 MET A 96 23.191 -1.513 -11.334 1.00 0.00 H new ATOM 0 HB3 MET A 96 24.643 -2.307 -11.912 1.00 0.00 H new ATOM 0 HG2 MET A 96 23.895 -2.040 -14.268 1.00 0.00 H new ATOM 0 HG3 MET A 96 22.378 -1.343 -13.733 1.00 0.00 H new ATOM 0 HE1 MET A 96 26.605 0.382 -13.530 1.00 0.00 H new ATOM 0 HE2 MET A 96 26.093 -0.537 -12.094 1.00 0.00 H new ATOM 0 HE3 MET A 96 26.070 -1.307 -13.699 1.00 0.00 H new ATOM 1478 N ILE A 97 22.770 -4.070 -9.805 1.00 0.00 N ATOM 1479 CA ILE A 97 23.134 -4.830 -8.616 1.00 0.00 C ATOM 1480 C ILE A 97 22.710 -6.287 -8.766 1.00 0.00 C ATOM 1481 O ILE A 97 23.464 -7.202 -8.431 1.00 0.00 O ATOM 1482 CB ILE A 97 22.460 -4.221 -7.382 1.00 0.00 C ATOM 1483 CG1 ILE A 97 23.051 -2.835 -7.112 1.00 0.00 C ATOM 1484 CG2 ILE A 97 22.704 -5.119 -6.167 1.00 0.00 C ATOM 1485 CD1 ILE A 97 22.192 -2.108 -6.076 1.00 0.00 C ATOM 0 H ILE A 97 22.086 -3.330 -9.645 1.00 0.00 H new ATOM 0 HA ILE A 97 24.216 -4.789 -8.494 1.00 0.00 H new ATOM 0 HB ILE A 97 21.388 -4.135 -7.561 1.00 0.00 H new ATOM 0 HG12 ILE A 97 24.075 -2.929 -6.750 1.00 0.00 H new ATOM 0 HG13 ILE A 97 23.091 -2.258 -8.036 1.00 0.00 H new ATOM 0 HG21 ILE A 97 22.224 -4.684 -5.291 1.00 0.00 H new ATOM 0 HG22 ILE A 97 22.287 -6.108 -6.356 1.00 0.00 H new ATOM 0 HG23 ILE A 97 23.776 -5.206 -5.988 1.00 0.00 H new ATOM 0 HD11 ILE A 97 22.612 -1.121 -5.883 1.00 0.00 H new ATOM 0 HD12 ILE A 97 21.176 -2.002 -6.456 1.00 0.00 H new ATOM 0 HD13 ILE A 97 22.175 -2.682 -5.150 1.00 0.00 H new ATOM 1497 N ILE A 98 21.498 -6.494 -9.270 1.00 0.00 N ATOM 1498 CA ILE A 98 20.979 -7.842 -9.459 1.00 0.00 C ATOM 1499 C ILE A 98 21.833 -8.598 -10.468 1.00 0.00 C ATOM 1500 O ILE A 98 22.137 -9.773 -10.278 1.00 0.00 O ATOM 1501 CB ILE A 98 19.529 -7.783 -9.951 1.00 0.00 C ATOM 1502 CG1 ILE A 98 18.640 -7.225 -8.838 1.00 0.00 C ATOM 1503 CG2 ILE A 98 19.052 -9.193 -10.320 1.00 0.00 C ATOM 1504 CD1 ILE A 98 17.261 -6.890 -9.408 1.00 0.00 C ATOM 0 H ILE A 98 20.861 -5.750 -9.553 1.00 0.00 H new ATOM 0 HA ILE A 98 21.012 -8.365 -8.503 1.00 0.00 H new ATOM 0 HB ILE A 98 19.470 -7.139 -10.828 1.00 0.00 H new ATOM 0 HG12 ILE A 98 18.546 -7.954 -8.033 1.00 0.00 H new ATOM 0 HG13 ILE A 98 19.094 -6.332 -8.408 1.00 0.00 H new ATOM 0 HG21 ILE A 98 18.021 -9.148 -10.670 1.00 0.00 H new ATOM 0 HG22 ILE A 98 19.686 -9.596 -11.110 1.00 0.00 H new ATOM 0 HG23 ILE A 98 19.110 -9.838 -9.443 1.00 0.00 H new ATOM 0 HD11 ILE A 98 16.627 -6.492 -8.616 1.00 0.00 H new ATOM 0 HD12 ILE A 98 17.365 -6.146 -10.198 1.00 0.00 H new ATOM 0 HD13 ILE A 98 16.807 -7.793 -9.817 1.00 0.00 H new ATOM 1516 N LEU A 99 22.210 -7.920 -11.542 1.00 0.00 N ATOM 1517 CA LEU A 99 23.020 -8.549 -12.576 1.00 0.00 C ATOM 1518 C LEU A 99 24.338 -9.046 -11.992 1.00 0.00 C ATOM 1519 O LEU A 99 24.815 -10.124 -12.346 1.00 0.00 O ATOM 1520 CB LEU A 99 23.300 -7.548 -13.704 1.00 0.00 C ATOM 1521 CG LEU A 99 24.233 -8.180 -14.753 1.00 0.00 C ATOM 1522 CD1 LEU A 99 23.614 -9.481 -15.292 1.00 0.00 C ATOM 1523 CD2 LEU A 99 24.444 -7.189 -15.902 1.00 0.00 C ATOM 0 H LEU A 99 21.971 -6.944 -11.720 1.00 0.00 H new ATOM 0 HA LEU A 99 22.470 -9.400 -12.977 1.00 0.00 H new ATOM 0 HB2 LEU A 99 22.364 -7.246 -14.174 1.00 0.00 H new ATOM 0 HB3 LEU A 99 23.757 -6.647 -13.296 1.00 0.00 H new ATOM 0 HG LEU A 99 25.192 -8.413 -14.291 1.00 0.00 H new ATOM 0 HD11 LEU A 99 24.281 -9.921 -16.033 1.00 0.00 H new ATOM 0 HD12 LEU A 99 23.470 -10.183 -14.471 1.00 0.00 H new ATOM 0 HD13 LEU A 99 22.652 -9.262 -15.754 1.00 0.00 H new ATOM 0 HD21 LEU A 99 25.104 -7.632 -16.648 1.00 0.00 H new ATOM 0 HD22 LEU A 99 23.484 -6.954 -16.361 1.00 0.00 H new ATOM 0 HD23 LEU A 99 24.895 -6.275 -15.516 1.00 0.00 H new ATOM 1535 N GLY A 100 24.927 -8.251 -11.111 1.00 0.00 N ATOM 1536 CA GLY A 100 26.196 -8.618 -10.498 1.00 0.00 C ATOM 1537 C GLY A 100 26.065 -9.915 -9.708 1.00 0.00 C ATOM 1538 O GLY A 100 27.003 -10.707 -9.633 1.00 0.00 O ATOM 0 H GLY A 100 24.550 -7.354 -10.806 1.00 0.00 H new ATOM 0 HA2 GLY A 100 26.957 -8.733 -11.270 1.00 0.00 H new ATOM 0 HA3 GLY A 100 26.530 -7.818 -9.838 1.00 0.00 H new ATOM 1542 N VAL A 101 24.897 -10.128 -9.118 1.00 0.00 N ATOM 1543 CA VAL A 101 24.662 -11.335 -8.337 1.00 0.00 C ATOM 1544 C VAL A 101 24.712 -12.575 -9.229 1.00 0.00 C ATOM 1545 O VAL A 101 25.296 -13.593 -8.861 1.00 0.00 O ATOM 1546 CB VAL A 101 23.299 -11.253 -7.643 1.00 0.00 C ATOM 1547 CG1 VAL A 101 22.991 -12.578 -6.942 1.00 0.00 C ATOM 1548 CG2 VAL A 101 23.325 -10.125 -6.609 1.00 0.00 C ATOM 0 H VAL A 101 24.104 -9.488 -9.164 1.00 0.00 H new ATOM 0 HA VAL A 101 25.447 -11.415 -7.585 1.00 0.00 H new ATOM 0 HB VAL A 101 22.528 -11.054 -8.387 1.00 0.00 H new ATOM 0 HG11 VAL A 101 22.020 -12.513 -6.451 1.00 0.00 H new ATOM 0 HG12 VAL A 101 22.972 -13.383 -7.677 1.00 0.00 H new ATOM 0 HG13 VAL A 101 23.761 -12.784 -6.198 1.00 0.00 H new ATOM 0 HG21 VAL A 101 22.356 -10.064 -6.113 1.00 0.00 H new ATOM 0 HG22 VAL A 101 24.099 -10.327 -5.869 1.00 0.00 H new ATOM 0 HG23 VAL A 101 23.538 -9.179 -7.107 1.00 0.00 H new ATOM 1558 N ILE A 102 24.078 -12.488 -10.394 1.00 0.00 N ATOM 1559 CA ILE A 102 24.036 -13.617 -11.320 1.00 0.00 C ATOM 1560 C ILE A 102 25.434 -13.963 -11.808 1.00 0.00 C ATOM 1561 O ILE A 102 25.827 -15.130 -11.860 1.00 0.00 O ATOM 1562 CB ILE A 102 23.147 -13.266 -12.519 1.00 0.00 C ATOM 1563 CG1 ILE A 102 21.821 -12.667 -12.025 1.00 0.00 C ATOM 1564 CG2 ILE A 102 22.852 -14.533 -13.319 1.00 0.00 C ATOM 1565 CD1 ILE A 102 21.228 -13.544 -10.924 1.00 0.00 C ATOM 0 H ILE A 102 23.589 -11.654 -10.719 1.00 0.00 H new ATOM 0 HA ILE A 102 23.625 -14.481 -10.797 1.00 0.00 H new ATOM 0 HB ILE A 102 23.664 -12.541 -13.148 1.00 0.00 H new ATOM 0 HG12 ILE A 102 21.987 -11.658 -11.647 1.00 0.00 H new ATOM 0 HG13 ILE A 102 21.118 -12.586 -12.854 1.00 0.00 H new ATOM 0 HG21 ILE A 102 22.220 -14.286 -14.172 1.00 0.00 H new ATOM 0 HG22 ILE A 102 23.788 -14.965 -13.674 1.00 0.00 H new ATOM 0 HG23 ILE A 102 22.338 -15.253 -12.683 1.00 0.00 H new ATOM 0 HD11 ILE A 102 20.288 -13.111 -10.580 1.00 0.00 H new ATOM 0 HD12 ILE A 102 21.045 -14.545 -11.315 1.00 0.00 H new ATOM 0 HD13 ILE A 102 21.927 -13.603 -10.090 1.00 0.00 H new ATOM 1577 N CYS A 103 26.176 -12.939 -12.162 1.00 0.00 N ATOM 1578 CA CYS A 103 27.540 -13.130 -12.649 1.00 0.00 C ATOM 1579 C CYS A 103 28.417 -13.739 -11.560 1.00 0.00 C ATOM 1580 O CYS A 103 29.194 -14.652 -11.817 1.00 0.00 O ATOM 1581 CB CYS A 103 28.140 -11.798 -13.115 1.00 0.00 C ATOM 1582 SG CYS A 103 28.723 -10.840 -11.692 1.00 0.00 S ATOM 0 H CYS A 103 25.869 -11.967 -12.126 1.00 0.00 H new ATOM 0 HA CYS A 103 27.503 -13.814 -13.497 1.00 0.00 H new ATOM 0 HB2 CYS A 103 28.967 -11.984 -13.801 1.00 0.00 H new ATOM 0 HB3 CYS A 103 27.392 -11.227 -13.665 1.00 0.00 H new ATOM 0 HG CYS A 103 27.822 -10.862 -10.755 1.00 0.00 H new ATOM 1588 N ALA A 104 28.284 -13.221 -10.345 1.00 0.00 N ATOM 1589 CA ALA A 104 29.079 -13.710 -9.225 1.00 0.00 C ATOM 1590 C ALA A 104 28.948 -15.221 -9.091 1.00 0.00 C ATOM 1591 O ALA A 104 29.909 -15.904 -8.748 1.00 0.00 O ATOM 1592 CB ALA A 104 28.618 -13.042 -7.929 1.00 0.00 C ATOM 0 H ALA A 104 27.638 -12.467 -10.111 1.00 0.00 H new ATOM 0 HA ALA A 104 30.124 -13.463 -9.412 1.00 0.00 H new ATOM 0 HB1 ALA A 104 29.216 -13.412 -7.096 1.00 0.00 H new ATOM 0 HB2 ALA A 104 28.741 -11.962 -8.013 1.00 0.00 H new ATOM 0 HB3 ALA A 104 27.568 -13.275 -7.753 1.00 0.00 H new ATOM 1598 N ILE A 105 27.754 -15.732 -9.367 1.00 0.00 N ATOM 1599 CA ILE A 105 27.501 -17.165 -9.280 1.00 0.00 C ATOM 1600 C ILE A 105 28.364 -17.917 -10.291 1.00 0.00 C ATOM 1601 O ILE A 105 28.910 -18.973 -9.998 1.00 0.00 O ATOM 1602 CB ILE A 105 26.023 -17.458 -9.540 1.00 0.00 C ATOM 1603 CG1 ILE A 105 25.183 -16.877 -8.401 1.00 0.00 C ATOM 1604 CG2 ILE A 105 25.805 -18.972 -9.606 1.00 0.00 C ATOM 1605 CD1 ILE A 105 23.698 -16.930 -8.775 1.00 0.00 C ATOM 0 H ILE A 105 26.947 -15.177 -9.652 1.00 0.00 H new ATOM 0 HA ILE A 105 27.758 -17.502 -8.276 1.00 0.00 H new ATOM 0 HB ILE A 105 25.724 -17.005 -10.485 1.00 0.00 H new ATOM 0 HG12 ILE A 105 25.357 -17.440 -7.484 1.00 0.00 H new ATOM 0 HG13 ILE A 105 25.482 -15.847 -8.205 1.00 0.00 H new ATOM 0 HG21 ILE A 105 24.751 -19.180 -9.791 1.00 0.00 H new ATOM 0 HG22 ILE A 105 26.405 -19.391 -10.414 1.00 0.00 H new ATOM 0 HG23 ILE A 105 26.103 -19.424 -8.660 1.00 0.00 H new ATOM 0 HD11 ILE A 105 23.103 -16.515 -7.961 1.00 0.00 H new ATOM 0 HD12 ILE A 105 23.530 -16.348 -9.681 1.00 0.00 H new ATOM 0 HD13 ILE A 105 23.403 -17.965 -8.949 1.00 0.00 H new ATOM 1617 N ILE A 106 28.466 -17.374 -11.491 1.00 0.00 N ATOM 1618 CA ILE A 106 29.258 -18.013 -12.537 1.00 0.00 C ATOM 1619 C ILE A 106 30.734 -18.073 -12.144 1.00 0.00 C ATOM 1620 O ILE A 106 31.409 -19.073 -12.384 1.00 0.00 O ATOM 1621 CB ILE A 106 29.110 -17.247 -13.852 1.00 0.00 C ATOM 1622 CG1 ILE A 106 27.671 -17.389 -14.351 1.00 0.00 C ATOM 1623 CG2 ILE A 106 30.071 -17.824 -14.900 1.00 0.00 C ATOM 1624 CD1 ILE A 106 27.428 -16.407 -15.499 1.00 0.00 C ATOM 0 H ILE A 106 28.017 -16.501 -11.768 1.00 0.00 H new ATOM 0 HA ILE A 106 28.889 -19.031 -12.666 1.00 0.00 H new ATOM 0 HB ILE A 106 29.346 -16.195 -13.690 1.00 0.00 H new ATOM 0 HG12 ILE A 106 27.491 -18.410 -14.688 1.00 0.00 H new ATOM 0 HG13 ILE A 106 26.972 -17.194 -13.538 1.00 0.00 H new ATOM 0 HG21 ILE A 106 29.962 -17.275 -15.835 1.00 0.00 H new ATOM 0 HG22 ILE A 106 31.097 -17.732 -14.543 1.00 0.00 H new ATOM 0 HG23 ILE A 106 29.838 -18.876 -15.067 1.00 0.00 H new ATOM 0 HD11 ILE A 106 26.402 -16.509 -15.854 1.00 0.00 H new ATOM 0 HD12 ILE A 106 27.591 -15.388 -15.147 1.00 0.00 H new ATOM 0 HD13 ILE A 106 28.118 -16.623 -16.315 1.00 0.00 H new ATOM 1636 N LEU A 107 31.238 -16.986 -11.567 1.00 0.00 N ATOM 1637 CA LEU A 107 32.649 -16.922 -11.184 1.00 0.00 C ATOM 1638 C LEU A 107 33.016 -18.023 -10.196 1.00 0.00 C ATOM 1639 O LEU A 107 34.017 -18.718 -10.375 1.00 0.00 O ATOM 1640 CB LEU A 107 32.938 -15.548 -10.553 1.00 0.00 C ATOM 1641 CG LEU A 107 33.383 -14.540 -11.628 1.00 0.00 C ATOM 1642 CD1 LEU A 107 34.805 -14.884 -12.126 1.00 0.00 C ATOM 1643 CD2 LEU A 107 32.389 -14.557 -12.808 1.00 0.00 C ATOM 0 H LEU A 107 30.700 -16.146 -11.355 1.00 0.00 H new ATOM 0 HA LEU A 107 33.252 -17.064 -12.081 1.00 0.00 H new ATOM 0 HB2 LEU A 107 32.045 -15.179 -10.048 1.00 0.00 H new ATOM 0 HB3 LEU A 107 33.715 -15.646 -9.795 1.00 0.00 H new ATOM 0 HG LEU A 107 33.398 -13.541 -11.191 1.00 0.00 H new ATOM 0 HD11 LEU A 107 35.108 -14.164 -12.886 1.00 0.00 H new ATOM 0 HD12 LEU A 107 35.503 -14.845 -11.290 1.00 0.00 H new ATOM 0 HD13 LEU A 107 34.808 -15.886 -12.554 1.00 0.00 H new ATOM 0 HD21 LEU A 107 32.710 -13.841 -13.565 1.00 0.00 H new ATOM 0 HD22 LEU A 107 32.358 -15.556 -13.243 1.00 0.00 H new ATOM 0 HD23 LEU A 107 31.396 -14.286 -12.451 1.00 0.00 H new ATOM 1655 N ILE A 108 32.210 -18.186 -9.166 1.00 0.00 N ATOM 1656 CA ILE A 108 32.480 -19.211 -8.171 1.00 0.00 C ATOM 1657 C ILE A 108 32.368 -20.598 -8.795 1.00 0.00 C ATOM 1658 O ILE A 108 33.155 -21.490 -8.485 1.00 0.00 O ATOM 1659 CB ILE A 108 31.509 -19.063 -6.999 1.00 0.00 C ATOM 1660 CG1 ILE A 108 30.084 -19.014 -7.533 1.00 0.00 C ATOM 1661 CG2 ILE A 108 31.811 -17.769 -6.245 1.00 0.00 C ATOM 1662 CD1 ILE A 108 29.093 -18.936 -6.375 1.00 0.00 C ATOM 0 H ILE A 108 31.372 -17.631 -8.995 1.00 0.00 H new ATOM 0 HA ILE A 108 33.497 -19.089 -7.799 1.00 0.00 H new ATOM 0 HB ILE A 108 31.621 -19.911 -6.323 1.00 0.00 H new ATOM 0 HG12 ILE A 108 29.961 -18.150 -8.186 1.00 0.00 H new ATOM 0 HG13 ILE A 108 29.882 -19.900 -8.136 1.00 0.00 H new ATOM 0 HG21 ILE A 108 31.118 -17.664 -5.410 1.00 0.00 H new ATOM 0 HG22 ILE A 108 32.833 -17.798 -5.867 1.00 0.00 H new ATOM 0 HG23 ILE A 108 31.697 -16.920 -6.919 1.00 0.00 H new ATOM 0 HD11 ILE A 108 28.077 -18.901 -6.768 1.00 0.00 H new ATOM 0 HD12 ILE A 108 29.207 -19.814 -5.739 1.00 0.00 H new ATOM 0 HD13 ILE A 108 29.287 -18.037 -5.790 1.00 0.00 H new ATOM 1674 N ILE A 109 31.393 -20.768 -9.681 1.00 0.00 N ATOM 1675 CA ILE A 109 31.200 -22.050 -10.346 1.00 0.00 C ATOM 1676 C ILE A 109 32.415 -22.397 -11.198 1.00 0.00 C ATOM 1677 O ILE A 109 32.877 -23.538 -11.201 1.00 0.00 O ATOM 1678 CB ILE A 109 29.937 -22.012 -11.221 1.00 0.00 C ATOM 1679 CG1 ILE A 109 28.692 -21.997 -10.328 1.00 0.00 C ATOM 1680 CG2 ILE A 109 29.893 -23.233 -12.143 1.00 0.00 C ATOM 1681 CD1 ILE A 109 27.458 -21.694 -11.178 1.00 0.00 C ATOM 0 H ILE A 109 30.730 -20.042 -9.953 1.00 0.00 H new ATOM 0 HA ILE A 109 31.077 -22.819 -9.583 1.00 0.00 H new ATOM 0 HB ILE A 109 29.959 -21.109 -11.832 1.00 0.00 H new ATOM 0 HG12 ILE A 109 28.577 -22.960 -9.831 1.00 0.00 H new ATOM 0 HG13 ILE A 109 28.801 -21.246 -9.546 1.00 0.00 H new ATOM 0 HG21 ILE A 109 28.993 -23.193 -12.757 1.00 0.00 H new ATOM 0 HG22 ILE A 109 30.772 -23.234 -12.787 1.00 0.00 H new ATOM 0 HG23 ILE A 109 29.882 -24.142 -11.542 1.00 0.00 H new ATOM 0 HD11 ILE A 109 26.572 -21.683 -10.543 1.00 0.00 H new ATOM 0 HD12 ILE A 109 27.575 -20.721 -11.655 1.00 0.00 H new ATOM 0 HD13 ILE A 109 27.346 -22.462 -11.944 1.00 0.00 H new ATOM 1693 N ILE A 110 32.920 -21.413 -11.925 1.00 0.00 N ATOM 1694 CA ILE A 110 34.072 -21.636 -12.785 1.00 0.00 C ATOM 1695 C ILE A 110 35.286 -22.022 -11.953 1.00 0.00 C ATOM 1696 O ILE A 110 36.038 -22.923 -12.320 1.00 0.00 O ATOM 1697 CB ILE A 110 34.375 -20.366 -13.596 1.00 0.00 C ATOM 1698 CG1 ILE A 110 33.234 -20.112 -14.612 1.00 0.00 C ATOM 1699 CG2 ILE A 110 35.715 -20.526 -14.336 1.00 0.00 C ATOM 1700 CD1 ILE A 110 33.469 -20.906 -15.908 1.00 0.00 C ATOM 0 H ILE A 110 32.555 -20.461 -11.938 1.00 0.00 H new ATOM 0 HA ILE A 110 33.844 -22.452 -13.471 1.00 0.00 H new ATOM 0 HB ILE A 110 34.445 -19.515 -12.919 1.00 0.00 H new ATOM 0 HG12 ILE A 110 32.279 -20.400 -14.172 1.00 0.00 H new ATOM 0 HG13 ILE A 110 33.173 -19.048 -14.838 1.00 0.00 H new ATOM 0 HG21 ILE A 110 35.924 -19.623 -14.909 1.00 0.00 H new ATOM 0 HG22 ILE A 110 36.513 -20.690 -13.612 1.00 0.00 H new ATOM 0 HG23 ILE A 110 35.658 -21.379 -15.012 1.00 0.00 H new ATOM 0 HD11 ILE A 110 32.655 -20.712 -16.606 1.00 0.00 H new ATOM 0 HD12 ILE A 110 34.413 -20.598 -16.357 1.00 0.00 H new ATOM 0 HD13 ILE A 110 33.505 -21.971 -15.680 1.00 0.00 H new ATOM 1712 N ILE A 111 35.479 -21.332 -10.841 1.00 0.00 N ATOM 1713 CA ILE A 111 36.617 -21.614 -9.981 1.00 0.00 C ATOM 1714 C ILE A 111 36.536 -23.035 -9.438 1.00 0.00 C ATOM 1715 O ILE A 111 37.529 -23.760 -9.420 1.00 0.00 O ATOM 1716 CB ILE A 111 36.646 -20.612 -8.816 1.00 0.00 C ATOM 1717 CG1 ILE A 111 36.991 -19.199 -9.341 1.00 0.00 C ATOM 1718 CG2 ILE A 111 37.682 -21.054 -7.768 1.00 0.00 C ATOM 1719 CD1 ILE A 111 38.514 -19.017 -9.454 1.00 0.00 C ATOM 0 H ILE A 111 34.871 -20.581 -10.515 1.00 0.00 H new ATOM 0 HA ILE A 111 37.531 -21.517 -10.566 1.00 0.00 H new ATOM 0 HB ILE A 111 35.662 -20.583 -8.349 1.00 0.00 H new ATOM 0 HG12 ILE A 111 36.528 -19.045 -10.316 1.00 0.00 H new ATOM 0 HG13 ILE A 111 36.579 -18.446 -8.670 1.00 0.00 H new ATOM 0 HG21 ILE A 111 37.696 -20.338 -6.946 1.00 0.00 H new ATOM 0 HG22 ILE A 111 37.416 -22.040 -7.386 1.00 0.00 H new ATOM 0 HG23 ILE A 111 38.669 -21.097 -8.228 1.00 0.00 H new ATOM 0 HD11 ILE A 111 38.734 -18.016 -9.825 1.00 0.00 H new ATOM 0 HD12 ILE A 111 38.970 -19.149 -8.473 1.00 0.00 H new ATOM 0 HD13 ILE A 111 38.919 -19.757 -10.144 1.00 0.00 H new ATOM 1731 N VAL A 112 35.350 -23.428 -8.998 1.00 0.00 N ATOM 1732 CA VAL A 112 35.154 -24.762 -8.461 1.00 0.00 C ATOM 1733 C VAL A 112 35.308 -25.800 -9.563 1.00 0.00 C ATOM 1734 O VAL A 112 35.928 -26.846 -9.366 1.00 0.00 O ATOM 1735 CB VAL A 112 33.766 -24.872 -7.825 1.00 0.00 C ATOM 1736 CG1 VAL A 112 33.505 -26.321 -7.406 1.00 0.00 C ATOM 1737 CG2 VAL A 112 33.703 -23.963 -6.592 1.00 0.00 C ATOM 0 H VAL A 112 34.514 -22.844 -9.003 1.00 0.00 H new ATOM 0 HA VAL A 112 35.909 -24.948 -7.697 1.00 0.00 H new ATOM 0 HB VAL A 112 33.009 -24.565 -8.547 1.00 0.00 H new ATOM 0 HG11 VAL A 112 32.516 -26.396 -6.954 1.00 0.00 H new ATOM 0 HG12 VAL A 112 33.553 -26.967 -8.282 1.00 0.00 H new ATOM 0 HG13 VAL A 112 34.259 -26.632 -6.683 1.00 0.00 H new ATOM 0 HG21 VAL A 112 32.716 -24.038 -6.135 1.00 0.00 H new ATOM 0 HG22 VAL A 112 34.461 -24.273 -5.872 1.00 0.00 H new ATOM 0 HG23 VAL A 112 33.887 -22.931 -6.891 1.00 0.00 H new ATOM 1747 N TYR A 113 34.728 -25.508 -10.719 1.00 0.00 N ATOM 1748 CA TYR A 113 34.791 -26.428 -11.845 1.00 0.00 C ATOM 1749 C TYR A 113 36.234 -26.677 -12.259 1.00 0.00 C ATOM 1750 O TYR A 113 36.621 -27.807 -12.563 1.00 0.00 O ATOM 1751 CB TYR A 113 33.999 -25.869 -13.032 1.00 0.00 C ATOM 1752 CG TYR A 113 34.135 -26.801 -14.215 1.00 0.00 C ATOM 1753 CD1 TYR A 113 33.394 -27.988 -14.258 1.00 0.00 C ATOM 1754 CD2 TYR A 113 34.997 -26.475 -15.269 1.00 0.00 C ATOM 1755 CE1 TYR A 113 33.519 -28.852 -15.353 1.00 0.00 C ATOM 1756 CE2 TYR A 113 35.122 -27.339 -16.364 1.00 0.00 C ATOM 1757 CZ TYR A 113 34.381 -28.527 -16.406 1.00 0.00 C ATOM 1758 OH TYR A 113 34.504 -29.377 -17.486 1.00 0.00 O ATOM 0 H TYR A 113 34.212 -24.647 -10.901 1.00 0.00 H new ATOM 0 HA TYR A 113 34.350 -27.375 -11.535 1.00 0.00 H new ATOM 0 HB2 TYR A 113 32.949 -25.758 -12.762 1.00 0.00 H new ATOM 0 HB3 TYR A 113 34.367 -24.877 -13.293 1.00 0.00 H new ATOM 0 HD1 TYR A 113 32.726 -28.237 -13.447 1.00 0.00 H new ATOM 0 HD2 TYR A 113 35.565 -25.557 -15.238 1.00 0.00 H new ATOM 0 HE1 TYR A 113 32.950 -29.769 -15.385 1.00 0.00 H new ATOM 0 HE2 TYR A 113 35.789 -27.090 -17.176 1.00 0.00 H new ATOM 0 HH TYR A 113 35.142 -29.001 -18.127 1.00 0.00 H new ATOM 1768 N PHE A 114 37.021 -25.618 -12.269 1.00 0.00 N ATOM 1769 CA PHE A 114 38.424 -25.719 -12.650 1.00 0.00 C ATOM 1770 C PHE A 114 39.167 -26.673 -11.723 1.00 0.00 C ATOM 1771 O PHE A 114 39.949 -27.513 -12.171 1.00 0.00 O ATOM 1772 CB PHE A 114 39.086 -24.338 -12.604 1.00 0.00 C ATOM 1773 CG PHE A 114 40.529 -24.455 -13.036 1.00 0.00 C ATOM 1774 CD1 PHE A 114 40.856 -24.458 -14.398 1.00 0.00 C ATOM 1775 CD2 PHE A 114 41.540 -24.561 -12.073 1.00 0.00 C ATOM 1776 CE1 PHE A 114 42.195 -24.568 -14.797 1.00 0.00 C ATOM 1777 CE2 PHE A 114 42.878 -24.671 -12.472 1.00 0.00 C ATOM 1778 CZ PHE A 114 43.205 -24.674 -13.834 1.00 0.00 C ATOM 0 H PHE A 114 36.717 -24.677 -12.019 1.00 0.00 H new ATOM 0 HA PHE A 114 38.473 -26.108 -13.667 1.00 0.00 H new ATOM 0 HB2 PHE A 114 38.555 -23.647 -13.258 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.030 -23.930 -11.595 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.076 -24.376 -15.141 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.288 -24.558 -11.023 1.00 0.00 H new ATOM 0 HE1 PHE A 114 42.447 -24.571 -15.847 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.658 -24.754 -11.729 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.237 -24.758 -14.141 1.00 0.00 H new ATOM 1788 N SER A 115 38.914 -26.536 -10.431 1.00 0.00 N ATOM 1789 CA SER A 115 39.556 -27.382 -9.437 1.00 0.00 C ATOM 1790 C SER A 115 39.049 -28.810 -9.544 1.00 0.00 C ATOM 1791 O SER A 115 39.790 -29.765 -9.307 1.00 0.00 O ATOM 1792 CB SER A 115 39.302 -26.840 -8.028 1.00 0.00 C ATOM 1793 OG SER A 115 39.678 -25.469 -7.977 1.00 0.00 O ATOM 0 H SER A 115 38.268 -25.847 -10.046 1.00 0.00 H new ATOM 0 HA SER A 115 40.629 -27.377 -9.627 1.00 0.00 H new ATOM 0 HB2 SER A 115 38.249 -26.950 -7.768 1.00 0.00 H new ATOM 0 HB3 SER A 115 39.873 -27.413 -7.297 1.00 0.00 H new ATOM 0 HG SER A 115 39.009 -24.929 -8.448 1.00 0.00 H new ATOM 1799 N THR A 116 37.780 -28.945 -9.892 1.00 0.00 N ATOM 1800 CA THR A 116 37.171 -30.260 -10.026 1.00 0.00 C ATOM 1801 C THR A 116 38.071 -31.191 -10.832 1.00 0.00 C ATOM 1802 O THR A 116 38.290 -30.908 -11.998 1.00 0.00 O ATOM 1803 CB THR A 116 35.810 -30.141 -10.713 1.00 0.00 C ATOM 1804 OG1 THR A 116 35.068 -29.088 -10.114 1.00 0.00 O ATOM 1805 CG2 THR A 116 35.046 -31.453 -10.559 1.00 0.00 C ATOM 1806 OXT THR A 116 38.527 -32.174 -10.272 1.00 0.00 O ATOM 0 H THR A 116 37.153 -28.164 -10.086 1.00 0.00 H new ATOM 0 HA THR A 116 37.037 -30.678 -9.028 1.00 0.00 H new ATOM 0 HB THR A 116 35.955 -29.927 -11.772 1.00 0.00 H new ATOM 0 HG1 THR A 116 35.673 -28.510 -9.604 1.00 0.00 H new ATOM 0 HG21 THR A 116 34.076 -31.369 -11.049 1.00 0.00 H new ATOM 0 HG22 THR A 116 35.615 -32.261 -11.018 1.00 0.00 H new ATOM 0 HG23 THR A 116 34.901 -31.667 -9.500 1.00 0.00 H new TER 1814 THR A 116