USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 920 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 Set 1.1: B 53 ASN : amide:sc= -2.3! C(o=-2.3!,f=-3.8!) USER MOD Set 1.2: B 54 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 4 THR OG1 : rot 175:sc= 1.18 USER MOD Set 2.2: B 93 HIS : no HD1:sc= -0.513 K(o=0.67,f=-2!) USER MOD Single : A 1 GLY N :NH3+ -129:sc= 0.0913 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0121 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.104 K(o=-0.1,f=-0.73) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 92:sc= 0.588 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : B 31 MET CE :methyl 160:sc= -0.0791 (180deg=-0.521) USER MOD Single : B 34 SER OG : rot 62:sc= 0.736 USER MOD Single : B 35 ASN : amide:sc= 0.0679 K(o=0.068,f=-3.6!) USER MOD Single : B 38 GLN : amide:sc= -0.917 X(o=-0.92,f=-0.93) USER MOD Single : B 40 SER OG : rot 180:sc= -0.093 USER MOD Single : B 41 HIS : no HD1:sc= -0.0862 X(o=-0.086,f=-0.0025) USER MOD Single : B 43 SER OG : rot -160:sc= 0 USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 45 TYR OH : rot 180:sc= -0.0641 USER MOD Single : B 52 LYS NZ :NH3+ -174:sc=-0.00932 (180deg=-0.107) USER MOD Single : B 59 LYS NZ :NH3+ -171:sc= -0.0117 (180deg=-0.148) USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 66 HIS : no HD1:sc= -0.0123 X(o=-0.012,f=-0.00064) USER MOD Single : B 68 ASN : amide:sc= 1.11 K(o=1.1,f=-0.0028) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 70 TYR OH : rot 180:sc= 0 USER MOD Single : B 71 THR OG1 : rot 180:sc= 0 USER MOD Single : B 73 LYS NZ :NH3+ -169:sc=-0.00245 (180deg=-0.11) USER MOD Single : B 76 LYS NZ :NH3+ 173:sc= -0.0117 (180deg=-0.102) USER MOD Single : B 81 TYR OH : rot 180:sc= 0.952 USER MOD Single : B 84 GLN : amide:sc= 0.0809 X(o=0.081,f=0) USER MOD Single : B 87 SER OG : rot -160:sc= 0 USER MOD Single : B 89 GLN : amide:sc= -0.693! C(o=-0.69!,f=-3.7!) USER MOD Single : B 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 91 TYR OH : rot 31:sc= 1.17 USER MOD Single : B 94 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : B 97 THR OG1 : rot -140:sc= 1.26 USER MOD Single : B 102 THR OG1 : rot 154:sc= 1.22 USER MOD Single : B 103 THR OG1 : rot 178:sc= 1.28 USER MOD Single : B 104 THR OG1 : rot 180:sc= 0 USER MOD Single : B 105 SER OG : rot 180:sc= 0 USER MOD Single : B 106 THR OG1 : rot 180:sc= 0 USER MOD Single : B 107 SER OG : rot 180:sc= 0 USER MOD Single : B 108 THR OG1 : rot 180:sc= 0 USER MOD Single : B 111 SER OG : rot 180:sc= 0 USER MOD Single : B 113 SER OG : rot 180:sc= 0 USER MOD Single : B 114 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : B 115 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 118 HIS : no HD1:sc= -0.0637 X(o=-0.064,f=0) USER MOD Single : B 119 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 14.931 8.282 4.230 1.00 0.00 N ATOM 2 CA GLY A 1 14.501 8.504 5.631 1.00 0.00 C ATOM 3 C GLY A 1 13.082 9.017 5.706 1.00 0.00 C ATOM 4 O GLY A 1 12.406 9.127 4.684 1.00 0.00 O ATOM 0 H1 GLY A 1 15.327 7.325 4.136 1.00 0.00 H new ATOM 0 H2 GLY A 1 14.113 8.382 3.596 1.00 0.00 H new ATOM 0 H3 GLY A 1 15.655 8.983 3.974 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.580 7.570 6.188 1.00 0.00 H new ATOM 0 HA3 GLY A 1 15.172 9.218 6.109 1.00 0.00 H new ATOM 10 N SER A 2 12.631 9.340 6.910 1.00 0.00 N ATOM 11 CA SER A 2 11.272 9.818 7.119 1.00 0.00 C ATOM 12 C SER A 2 11.160 11.303 6.779 1.00 0.00 C ATOM 13 O SER A 2 11.087 12.162 7.661 1.00 0.00 O ATOM 14 CB SER A 2 10.850 9.559 8.565 1.00 0.00 C ATOM 15 OG SER A 2 10.992 8.184 8.891 1.00 0.00 O ATOM 0 H SER A 2 13.190 9.279 7.761 1.00 0.00 H new ATOM 0 HA SER A 2 10.602 9.274 6.454 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.457 10.162 9.240 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.814 9.866 8.707 1.00 0.00 H new ATOM 0 HG SER A 2 10.719 8.038 9.821 1.00 0.00 H new ATOM 21 N GLN A 3 11.148 11.589 5.486 1.00 0.00 N ATOM 22 CA GLN A 3 11.067 12.952 4.990 1.00 0.00 C ATOM 23 C GLN A 3 9.654 13.495 5.149 1.00 0.00 C ATOM 24 O GLN A 3 9.455 14.667 5.477 1.00 0.00 O ATOM 25 CB GLN A 3 11.467 12.983 3.515 1.00 0.00 C ATOM 26 CG GLN A 3 11.509 14.376 2.917 1.00 0.00 C ATOM 27 CD GLN A 3 11.605 14.352 1.407 1.00 0.00 C ATOM 28 OE1 GLN A 3 12.694 14.302 0.840 1.00 0.00 O ATOM 29 NE2 GLN A 3 10.462 14.402 0.744 1.00 0.00 N ATOM 0 H GLN A 3 11.194 10.882 4.752 1.00 0.00 H new ATOM 0 HA GLN A 3 11.747 13.577 5.568 1.00 0.00 H new ATOM 0 HB2 GLN A 3 12.449 12.522 3.405 1.00 0.00 H new ATOM 0 HB3 GLN A 3 10.764 12.375 2.946 1.00 0.00 H new ATOM 0 HG2 GLN A 3 10.614 14.923 3.213 1.00 0.00 H new ATOM 0 HG3 GLN A 3 12.363 14.918 3.324 1.00 0.00 H new ATOM 0 HE21 GLN A 3 9.579 14.443 1.253 1.00 0.00 H new ATOM 0 HE22 GLN A 3 10.464 14.400 -0.276 1.00 0.00 H new ATOM 38 N THR A 4 8.683 12.626 4.921 1.00 0.00 N ATOM 39 CA THR A 4 7.284 13.009 4.953 1.00 0.00 C ATOM 40 C THR A 4 6.807 13.295 6.375 1.00 0.00 C ATOM 41 O THR A 4 6.444 12.381 7.118 1.00 0.00 O ATOM 42 CB THR A 4 6.409 11.903 4.340 1.00 0.00 C ATOM 43 OG1 THR A 4 6.964 11.489 3.085 1.00 0.00 O ATOM 44 CG2 THR A 4 4.983 12.388 4.130 1.00 0.00 C ATOM 0 H THR A 4 8.842 11.641 4.710 1.00 0.00 H new ATOM 0 HA THR A 4 7.189 13.923 4.367 1.00 0.00 H new ATOM 0 HB THR A 4 6.388 11.061 5.031 1.00 0.00 H new ATOM 0 HG1 THR A 4 6.452 10.730 2.735 1.00 0.00 H new ATOM 0 HG21 THR A 4 4.386 11.586 3.695 1.00 0.00 H new ATOM 0 HG22 THR A 4 4.554 12.682 5.088 1.00 0.00 H new ATOM 0 HG23 THR A 4 4.986 13.245 3.456 1.00 0.00 H new ATOM 52 N THR A 5 6.823 14.565 6.752 1.00 0.00 N ATOM 53 CA THR A 5 6.304 14.983 8.041 1.00 0.00 C ATOM 54 C THR A 5 4.844 15.409 7.920 1.00 0.00 C ATOM 55 O THR A 5 4.161 15.646 8.921 1.00 0.00 O ATOM 56 CB THR A 5 7.140 16.132 8.629 1.00 0.00 C ATOM 57 OG1 THR A 5 7.486 17.068 7.597 1.00 0.00 O ATOM 58 CG2 THR A 5 8.402 15.598 9.287 1.00 0.00 C ATOM 0 H THR A 5 7.192 15.325 6.180 1.00 0.00 H new ATOM 0 HA THR A 5 6.368 14.130 8.717 1.00 0.00 H new ATOM 0 HB THR A 5 6.542 16.638 9.387 1.00 0.00 H new ATOM 0 HG1 THR A 5 8.017 17.797 7.981 1.00 0.00 H new ATOM 0 HG21 THR A 5 8.978 16.428 9.696 1.00 0.00 H new ATOM 0 HG22 THR A 5 8.131 14.913 10.091 1.00 0.00 H new ATOM 0 HG23 THR A 5 9.003 15.069 8.547 1.00 0.00 H new ATOM 66 N ALA A 6 4.375 15.497 6.682 1.00 0.00 N ATOM 67 CA ALA A 6 2.987 15.827 6.405 1.00 0.00 C ATOM 68 C ALA A 6 2.137 14.559 6.423 1.00 0.00 C ATOM 69 O ALA A 6 2.627 13.475 6.110 1.00 0.00 O ATOM 70 CB ALA A 6 2.875 16.535 5.065 1.00 0.00 C ATOM 0 H ALA A 6 4.943 15.343 5.849 1.00 0.00 H new ATOM 0 HA ALA A 6 2.618 16.501 7.178 1.00 0.00 H new ATOM 0 HB1 ALA A 6 1.831 16.777 4.868 1.00 0.00 H new ATOM 0 HB2 ALA A 6 3.463 17.453 5.088 1.00 0.00 H new ATOM 0 HB3 ALA A 6 3.251 15.883 4.277 1.00 0.00 H new ATOM 76 N PRO A 7 0.856 14.671 6.802 1.00 0.00 N ATOM 77 CA PRO A 7 -0.028 13.515 6.943 1.00 0.00 C ATOM 78 C PRO A 7 -0.656 13.061 5.623 1.00 0.00 C ATOM 79 O PRO A 7 -1.853 12.765 5.567 1.00 0.00 O ATOM 80 CB PRO A 7 -1.103 14.037 7.893 1.00 0.00 C ATOM 81 CG PRO A 7 -1.208 15.489 7.576 1.00 0.00 C ATOM 82 CD PRO A 7 0.167 15.932 7.141 1.00 0.00 C ATOM 0 HA PRO A 7 0.509 12.635 7.297 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -2.053 13.527 7.736 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -0.824 13.877 8.934 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -1.939 15.662 6.786 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -1.540 16.053 8.447 1.00 0.00 H new ATOM 0 HD2 PRO A 7 0.118 16.603 6.284 1.00 0.00 H new ATOM 0 HD3 PRO A 7 0.684 16.468 7.937 1.00 0.00 H new ATOM 90 N ASP A 8 0.144 12.994 4.564 1.00 0.00 N ATOM 91 CA ASP A 8 -0.347 12.518 3.271 1.00 0.00 C ATOM 92 C ASP A 8 -0.018 11.040 3.080 1.00 0.00 C ATOM 93 O ASP A 8 -0.044 10.519 1.966 1.00 0.00 O ATOM 94 CB ASP A 8 0.207 13.357 2.108 1.00 0.00 C ATOM 95 CG ASP A 8 1.721 13.397 2.046 1.00 0.00 C ATOM 96 OD1 ASP A 8 2.312 12.675 1.216 1.00 0.00 O ATOM 97 OD2 ASP A 8 2.323 14.187 2.802 1.00 0.00 O ATOM 0 H ASP A 8 1.129 13.261 4.572 1.00 0.00 H new ATOM 0 HA ASP A 8 -1.431 12.634 3.268 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -0.175 12.956 1.169 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -0.170 14.376 2.196 1.00 0.00 H new ATOM 102 N ALA A 9 0.273 10.370 4.185 1.00 0.00 N ATOM 103 CA ALA A 9 0.502 8.936 4.175 1.00 0.00 C ATOM 104 C ALA A 9 -0.788 8.195 4.507 1.00 0.00 C ATOM 105 O ALA A 9 -1.459 8.526 5.486 1.00 0.00 O ATOM 106 CB ALA A 9 1.587 8.570 5.168 1.00 0.00 C ATOM 0 H ALA A 9 0.356 10.802 5.105 1.00 0.00 H new ATOM 0 HA ALA A 9 0.829 8.641 3.178 1.00 0.00 H new ATOM 0 HB1 ALA A 9 1.748 7.492 5.150 1.00 0.00 H new ATOM 0 HB2 ALA A 9 2.512 9.080 4.900 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.282 8.874 6.169 1.00 0.00 H new ATOM 112 N PRO A 10 -1.168 7.204 3.684 1.00 0.00 N ATOM 113 CA PRO A 10 -2.368 6.395 3.922 1.00 0.00 C ATOM 114 C PRO A 10 -2.269 5.580 5.210 1.00 0.00 C ATOM 115 O PRO A 10 -1.293 4.857 5.423 1.00 0.00 O ATOM 116 CB PRO A 10 -2.428 5.452 2.712 1.00 0.00 C ATOM 117 CG PRO A 10 -1.535 6.061 1.688 1.00 0.00 C ATOM 118 CD PRO A 10 -0.474 6.802 2.449 1.00 0.00 C ATOM 0 HA PRO A 10 -3.253 7.021 4.034 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -2.093 4.450 2.979 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -3.447 5.358 2.338 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -1.094 5.295 1.050 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -2.091 6.736 1.037 1.00 0.00 H new ATOM 0 HD2 PRO A 10 0.388 6.169 2.659 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -0.108 7.665 1.893 1.00 0.00 H new ATOM 126 N PRO A 11 -3.262 5.724 6.104 1.00 0.00 N ATOM 127 CA PRO A 11 -3.388 4.895 7.311 1.00 0.00 C ATOM 128 C PRO A 11 -3.411 3.402 6.992 1.00 0.00 C ATOM 129 O PRO A 11 -3.656 3.004 5.850 1.00 0.00 O ATOM 130 CB PRO A 11 -4.735 5.327 7.897 1.00 0.00 C ATOM 131 CG PRO A 11 -4.935 6.712 7.397 1.00 0.00 C ATOM 132 CD PRO A 11 -4.323 6.742 6.028 1.00 0.00 C ATOM 0 HA PRO A 11 -2.544 5.032 7.987 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -5.539 4.668 7.570 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -4.721 5.297 8.987 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -5.995 6.965 7.358 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -4.458 7.438 8.055 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -5.054 6.503 5.256 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -3.919 7.726 5.790 1.00 0.00 H new ATOM 140 N ASP A 12 -3.167 2.595 8.021 1.00 0.00 N ATOM 141 CA ASP A 12 -3.090 1.139 7.894 1.00 0.00 C ATOM 142 C ASP A 12 -4.314 0.577 7.175 1.00 0.00 C ATOM 143 O ASP A 12 -5.437 0.688 7.673 1.00 0.00 O ATOM 144 CB ASP A 12 -2.968 0.509 9.285 1.00 0.00 C ATOM 145 CG ASP A 12 -2.844 -1.002 9.243 1.00 0.00 C ATOM 146 OD1 ASP A 12 -1.743 -1.504 8.928 1.00 0.00 O ATOM 147 OD2 ASP A 12 -3.833 -1.696 9.560 1.00 0.00 O ATOM 0 H ASP A 12 -3.016 2.932 8.972 1.00 0.00 H new ATOM 0 HA ASP A 12 -2.210 0.894 7.299 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -2.097 0.925 9.791 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -3.841 0.780 9.878 1.00 0.00 H new ATOM 152 N PRO A 13 -4.108 -0.021 5.988 1.00 0.00 N ATOM 153 CA PRO A 13 -5.193 -0.587 5.179 1.00 0.00 C ATOM 154 C PRO A 13 -5.924 -1.711 5.899 1.00 0.00 C ATOM 155 O PRO A 13 -5.312 -2.523 6.593 1.00 0.00 O ATOM 156 CB PRO A 13 -4.482 -1.130 3.933 1.00 0.00 C ATOM 157 CG PRO A 13 -3.173 -0.425 3.898 1.00 0.00 C ATOM 158 CD PRO A 13 -2.801 -0.187 5.332 1.00 0.00 C ATOM 0 HA PRO A 13 -5.956 0.159 4.955 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -4.347 -2.210 3.995 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -5.061 -0.932 3.031 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -2.418 -1.027 3.392 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -3.249 0.515 3.352 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -2.243 -1.026 5.749 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -2.177 0.699 5.446 1.00 0.00 H new ATOM 166 N THR A 14 -7.229 -1.756 5.722 1.00 0.00 N ATOM 167 CA THR A 14 -8.057 -2.748 6.378 1.00 0.00 C ATOM 168 C THR A 14 -8.371 -3.893 5.422 1.00 0.00 C ATOM 169 O THR A 14 -8.751 -3.665 4.273 1.00 0.00 O ATOM 170 CB THR A 14 -9.373 -2.116 6.862 1.00 0.00 C ATOM 171 OG1 THR A 14 -9.108 -0.840 7.464 1.00 0.00 O ATOM 172 CG2 THR A 14 -10.070 -3.018 7.869 1.00 0.00 C ATOM 0 H THR A 14 -7.743 -1.110 5.123 1.00 0.00 H new ATOM 0 HA THR A 14 -7.507 -3.134 7.236 1.00 0.00 H new ATOM 0 HB THR A 14 -10.027 -1.987 6.000 1.00 0.00 H new ATOM 0 HG1 THR A 14 -9.950 -0.441 7.769 1.00 0.00 H new ATOM 0 HG21 THR A 14 -10.998 -2.549 8.196 1.00 0.00 H new ATOM 0 HG22 THR A 14 -10.293 -3.978 7.404 1.00 0.00 H new ATOM 0 HG23 THR A 14 -9.419 -3.174 8.729 1.00 0.00 H new ATOM 180 N VAL A 15 -8.192 -5.116 5.891 1.00 0.00 N ATOM 181 CA VAL A 15 -8.466 -6.292 5.084 1.00 0.00 C ATOM 182 C VAL A 15 -9.763 -6.958 5.537 1.00 0.00 C ATOM 183 O VAL A 15 -9.834 -7.525 6.630 1.00 0.00 O ATOM 184 CB VAL A 15 -7.302 -7.305 5.161 1.00 0.00 C ATOM 185 CG1 VAL A 15 -7.655 -8.601 4.449 1.00 0.00 C ATOM 186 CG2 VAL A 15 -6.033 -6.707 4.569 1.00 0.00 C ATOM 0 H VAL A 15 -7.856 -5.321 6.832 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.572 -5.968 4.049 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.126 -7.532 6.212 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.817 -9.295 4.520 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.534 -9.045 4.916 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.867 -8.394 3.400 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.224 -7.435 4.632 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -6.206 -6.447 3.525 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.759 -5.811 5.126 1.00 0.00 H new ATOM 196 N ASP A 16 -10.784 -6.881 4.697 1.00 0.00 N ATOM 197 CA ASP A 16 -12.084 -7.459 5.018 1.00 0.00 C ATOM 198 C ASP A 16 -12.518 -8.454 3.957 1.00 0.00 C ATOM 199 O ASP A 16 -11.912 -8.534 2.886 1.00 0.00 O ATOM 200 CB ASP A 16 -13.159 -6.376 5.154 1.00 0.00 C ATOM 201 CG ASP A 16 -13.030 -5.562 6.425 1.00 0.00 C ATOM 202 OD1 ASP A 16 -13.100 -6.153 7.526 1.00 0.00 O ATOM 203 OD2 ASP A 16 -12.889 -4.327 6.331 1.00 0.00 O ATOM 0 H ASP A 16 -10.739 -6.424 3.786 1.00 0.00 H new ATOM 0 HA ASP A 16 -11.973 -7.974 5.972 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -13.102 -5.707 4.295 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -14.143 -6.845 5.129 1.00 0.00 H new ATOM 208 N GLN A 17 -13.570 -9.207 4.280 1.00 0.00 N ATOM 209 CA GLN A 17 -14.176 -10.169 3.360 1.00 0.00 C ATOM 210 C GLN A 17 -13.134 -11.117 2.780 1.00 0.00 C ATOM 211 O GLN A 17 -12.903 -11.145 1.568 1.00 0.00 O ATOM 212 CB GLN A 17 -14.926 -9.447 2.237 1.00 0.00 C ATOM 213 CG GLN A 17 -16.008 -8.503 2.736 1.00 0.00 C ATOM 214 CD GLN A 17 -17.027 -9.192 3.623 1.00 0.00 C ATOM 215 OE1 GLN A 17 -17.322 -10.378 3.461 1.00 0.00 O ATOM 216 NE2 GLN A 17 -17.562 -8.452 4.579 1.00 0.00 N ATOM 0 H GLN A 17 -14.027 -9.166 5.191 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.890 -10.764 3.929 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -14.211 -8.883 1.638 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -15.378 -10.188 1.578 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -15.544 -7.687 3.290 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -16.518 -8.059 1.881 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -17.290 -7.474 4.679 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -18.246 -8.859 5.217 1.00 0.00 H new ATOM 225 N VAL A 18 -12.501 -11.885 3.653 1.00 0.00 N ATOM 226 CA VAL A 18 -11.486 -12.832 3.229 1.00 0.00 C ATOM 227 C VAL A 18 -12.123 -14.077 2.612 1.00 0.00 C ATOM 228 O VAL A 18 -12.952 -14.749 3.230 1.00 0.00 O ATOM 229 CB VAL A 18 -10.546 -13.231 4.396 1.00 0.00 C ATOM 230 CG1 VAL A 18 -9.796 -12.012 4.910 1.00 0.00 C ATOM 231 CG2 VAL A 18 -11.313 -13.895 5.532 1.00 0.00 C ATOM 0 H VAL A 18 -12.673 -11.870 4.658 1.00 0.00 H new ATOM 0 HA VAL A 18 -10.882 -12.335 2.470 1.00 0.00 H new ATOM 0 HB VAL A 18 -9.829 -13.956 4.011 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -9.140 -12.307 5.729 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -9.200 -11.585 4.104 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -10.510 -11.269 5.266 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -10.621 -14.161 6.332 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -12.064 -13.205 5.916 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -11.803 -14.796 5.162 1.00 0.00 H new ATOM 241 N ASP A 19 -11.763 -14.350 1.369 1.00 0.00 N ATOM 242 CA ASP A 19 -12.226 -15.543 0.672 1.00 0.00 C ATOM 243 C ASP A 19 -11.166 -16.624 0.768 1.00 0.00 C ATOM 244 O ASP A 19 -10.220 -16.499 1.547 1.00 0.00 O ATOM 245 CB ASP A 19 -12.505 -15.256 -0.809 1.00 0.00 C ATOM 246 CG ASP A 19 -13.574 -14.212 -1.039 1.00 0.00 C ATOM 247 OD1 ASP A 19 -14.709 -14.395 -0.554 1.00 0.00 O ATOM 248 OD2 ASP A 19 -13.293 -13.214 -1.736 1.00 0.00 O ATOM 0 H ASP A 19 -11.145 -13.756 0.816 1.00 0.00 H new ATOM 0 HA ASP A 19 -13.153 -15.869 1.143 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -11.581 -14.928 -1.286 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -12.804 -16.183 -1.299 1.00 0.00 H new ATOM 253 N ASP A 20 -11.309 -17.669 -0.028 1.00 0.00 N ATOM 254 CA ASP A 20 -10.316 -18.731 -0.065 1.00 0.00 C ATOM 255 C ASP A 20 -9.011 -18.204 -0.644 1.00 0.00 C ATOM 256 O ASP A 20 -7.933 -18.510 -0.146 1.00 0.00 O ATOM 257 CB ASP A 20 -10.820 -19.917 -0.893 1.00 0.00 C ATOM 258 CG ASP A 20 -9.864 -21.096 -0.882 1.00 0.00 C ATOM 259 OD1 ASP A 20 -9.160 -21.313 -1.893 1.00 0.00 O ATOM 260 OD2 ASP A 20 -9.829 -21.829 0.131 1.00 0.00 O ATOM 0 H ASP A 20 -12.101 -17.806 -0.656 1.00 0.00 H new ATOM 0 HA ASP A 20 -10.140 -19.075 0.954 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -11.788 -20.237 -0.507 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -10.978 -19.594 -1.922 1.00 0.00 H new ATOM 265 N THR A 21 -9.115 -17.380 -1.684 1.00 0.00 N ATOM 266 CA THR A 21 -7.930 -16.868 -2.359 1.00 0.00 C ATOM 267 C THR A 21 -8.048 -15.388 -2.731 1.00 0.00 C ATOM 268 O THR A 21 -7.360 -14.917 -3.640 1.00 0.00 O ATOM 269 CB THR A 21 -7.633 -17.682 -3.632 1.00 0.00 C ATOM 270 OG1 THR A 21 -8.854 -17.940 -4.341 1.00 0.00 O ATOM 271 CG2 THR A 21 -6.945 -18.996 -3.294 1.00 0.00 C ATOM 0 H THR A 21 -10.000 -17.056 -2.073 1.00 0.00 H new ATOM 0 HA THR A 21 -7.111 -16.970 -1.647 1.00 0.00 H new ATOM 0 HB THR A 21 -6.962 -17.098 -4.262 1.00 0.00 H new ATOM 0 HG1 THR A 21 -8.659 -18.457 -5.151 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.747 -19.550 -4.212 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.004 -18.793 -2.783 1.00 0.00 H new ATOM 0 HG23 THR A 21 -7.590 -19.588 -2.645 1.00 0.00 H new ATOM 279 N SER A 22 -8.898 -14.650 -2.029 1.00 0.00 N ATOM 280 CA SER A 22 -9.076 -13.233 -2.317 1.00 0.00 C ATOM 281 C SER A 22 -9.513 -12.454 -1.081 1.00 0.00 C ATOM 282 O SER A 22 -10.105 -13.014 -0.163 1.00 0.00 O ATOM 283 CB SER A 22 -10.082 -13.045 -3.455 1.00 0.00 C ATOM 284 OG SER A 22 -11.184 -13.930 -3.326 1.00 0.00 O ATOM 0 H SER A 22 -9.470 -15.005 -1.263 1.00 0.00 H new ATOM 0 HA SER A 22 -8.110 -12.835 -2.628 1.00 0.00 H new ATOM 0 HB2 SER A 22 -10.439 -12.015 -3.460 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.587 -13.215 -4.411 1.00 0.00 H new ATOM 0 HG SER A 22 -11.899 -13.491 -2.819 1.00 0.00 H new ATOM 290 N ILE A 23 -9.196 -11.165 -1.059 1.00 0.00 N ATOM 291 CA ILE A 23 -9.574 -10.289 0.047 1.00 0.00 C ATOM 292 C ILE A 23 -10.021 -8.938 -0.482 1.00 0.00 C ATOM 293 O ILE A 23 -9.801 -8.618 -1.649 1.00 0.00 O ATOM 294 CB ILE A 23 -8.397 -10.021 1.011 1.00 0.00 C ATOM 295 CG1 ILE A 23 -7.293 -9.248 0.278 1.00 0.00 C ATOM 296 CG2 ILE A 23 -7.859 -11.321 1.583 1.00 0.00 C ATOM 297 CD1 ILE A 23 -6.308 -8.553 1.190 1.00 0.00 C ATOM 0 H ILE A 23 -8.674 -10.699 -1.801 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.376 -10.801 0.579 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.756 -9.417 1.844 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.749 -9.939 -0.366 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.756 -8.505 -0.371 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -7.031 -11.106 2.259 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -8.651 -11.833 2.130 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -7.509 -11.958 0.771 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.562 -8.031 0.590 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.837 -7.835 1.817 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.814 -9.291 1.822 1.00 0.00 H new ATOM 309 N VAL A 24 -10.628 -8.145 0.383 1.00 0.00 N ATOM 310 CA VAL A 24 -10.886 -6.754 0.074 1.00 0.00 C ATOM 311 C VAL A 24 -10.012 -5.876 0.961 1.00 0.00 C ATOM 312 O VAL A 24 -10.271 -5.730 2.158 1.00 0.00 O ATOM 313 CB VAL A 24 -12.370 -6.379 0.285 1.00 0.00 C ATOM 314 CG1 VAL A 24 -12.630 -4.944 -0.148 1.00 0.00 C ATOM 315 CG2 VAL A 24 -13.280 -7.337 -0.465 1.00 0.00 C ATOM 0 H VAL A 24 -10.950 -8.442 1.304 1.00 0.00 H new ATOM 0 HA VAL A 24 -10.650 -6.594 -0.978 1.00 0.00 H new ATOM 0 HB VAL A 24 -12.592 -6.460 1.349 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -13.681 -4.701 0.009 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -12.009 -4.268 0.441 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -12.386 -4.833 -1.205 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -14.320 -7.054 -0.302 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -13.055 -7.294 -1.531 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -13.119 -8.352 -0.101 1.00 0.00 H new ATOM 325 N VAL A 25 -8.968 -5.312 0.377 1.00 0.00 N ATOM 326 CA VAL A 25 -8.073 -4.429 1.107 1.00 0.00 C ATOM 327 C VAL A 25 -8.457 -2.977 0.843 1.00 0.00 C ATOM 328 O VAL A 25 -8.475 -2.519 -0.301 1.00 0.00 O ATOM 329 CB VAL A 25 -6.586 -4.693 0.750 1.00 0.00 C ATOM 330 CG1 VAL A 25 -6.367 -4.704 -0.753 1.00 0.00 C ATOM 331 CG2 VAL A 25 -5.668 -3.676 1.413 1.00 0.00 C ATOM 0 H VAL A 25 -8.719 -5.450 -0.602 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.180 -4.635 2.172 1.00 0.00 H new ATOM 0 HB VAL A 25 -6.335 -5.681 1.135 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.315 -4.892 -0.966 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.974 -5.489 -1.203 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.655 -3.739 -1.170 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.634 -3.889 1.143 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.932 -2.674 1.076 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.780 -3.736 2.496 1.00 0.00 H new ATOM 341 N ARG A 26 -8.809 -2.275 1.909 1.00 0.00 N ATOM 342 CA ARG A 26 -9.302 -0.911 1.800 1.00 0.00 C ATOM 343 C ARG A 26 -8.362 0.051 2.511 1.00 0.00 C ATOM 344 O ARG A 26 -7.911 -0.218 3.624 1.00 0.00 O ATOM 345 CB ARG A 26 -10.707 -0.818 2.399 1.00 0.00 C ATOM 346 CG ARG A 26 -11.614 -1.964 1.981 1.00 0.00 C ATOM 347 CD ARG A 26 -13.032 -1.780 2.487 1.00 0.00 C ATOM 348 NE ARG A 26 -13.734 -0.710 1.781 1.00 0.00 N ATOM 349 CZ ARG A 26 -15.054 -0.543 1.809 1.00 0.00 C ATOM 350 NH1 ARG A 26 -15.813 -1.345 2.548 1.00 0.00 N ATOM 351 NH2 ARG A 26 -15.610 0.432 1.103 1.00 0.00 N ATOM 0 H ARG A 26 -8.762 -2.630 2.864 1.00 0.00 H new ATOM 0 HA ARG A 26 -9.346 -0.635 0.746 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.631 -0.802 3.486 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -11.162 0.125 2.097 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.624 -2.040 0.894 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -11.212 -2.902 2.363 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -13.582 -2.713 2.369 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -13.010 -1.556 3.553 1.00 0.00 H new ATOM 0 HE ARG A 26 -13.179 -0.052 1.234 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -15.384 -2.091 3.096 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -16.824 -1.215 2.568 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -15.026 1.051 0.541 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -16.621 0.563 1.122 1.00 0.00 H new ATOM 365 N TRP A 27 -8.068 1.167 1.869 1.00 0.00 N ATOM 366 CA TRP A 27 -7.138 2.145 2.413 1.00 0.00 C ATOM 367 C TRP A 27 -7.760 3.535 2.426 1.00 0.00 C ATOM 368 O TRP A 27 -8.623 3.851 1.606 1.00 0.00 O ATOM 369 CB TRP A 27 -5.836 2.155 1.600 1.00 0.00 C ATOM 370 CG TRP A 27 -6.047 2.347 0.126 1.00 0.00 C ATOM 371 CD1 TRP A 27 -6.266 3.526 -0.528 1.00 0.00 C ATOM 372 CD2 TRP A 27 -6.055 1.326 -0.878 1.00 0.00 C ATOM 373 NE1 TRP A 27 -6.422 3.298 -1.873 1.00 0.00 N ATOM 374 CE2 TRP A 27 -6.291 1.957 -2.113 1.00 0.00 C ATOM 375 CE3 TRP A 27 -5.886 -0.062 -0.854 1.00 0.00 C ATOM 376 CZ2 TRP A 27 -6.363 1.250 -3.310 1.00 0.00 C ATOM 377 CZ3 TRP A 27 -5.957 -0.762 -2.042 1.00 0.00 C ATOM 378 CH2 TRP A 27 -6.193 -0.104 -3.255 1.00 0.00 C ATOM 0 H TRP A 27 -8.462 1.422 0.963 1.00 0.00 H new ATOM 0 HA TRP A 27 -6.909 1.861 3.440 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -5.191 2.951 1.973 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -5.309 1.215 1.763 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -6.310 4.496 -0.056 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -6.606 4.012 -2.578 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -5.703 -0.577 0.077 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -6.547 1.754 -4.248 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.828 -1.834 -2.035 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -6.242 -0.680 -4.167 1.00 0.00 H new ATOM 389 N SER A 28 -7.325 4.362 3.362 1.00 0.00 N ATOM 390 CA SER A 28 -7.799 5.730 3.445 1.00 0.00 C ATOM 391 C SER A 28 -6.748 6.677 2.873 1.00 0.00 C ATOM 392 O SER A 28 -5.649 6.788 3.410 1.00 0.00 O ATOM 393 CB SER A 28 -8.105 6.089 4.900 1.00 0.00 C ATOM 394 OG SER A 28 -8.967 5.128 5.489 1.00 0.00 O ATOM 0 H SER A 28 -6.643 4.107 4.076 1.00 0.00 H new ATOM 0 HA SER A 28 -8.715 5.829 2.862 1.00 0.00 H new ATOM 0 HB2 SER A 28 -7.176 6.146 5.468 1.00 0.00 H new ATOM 0 HB3 SER A 28 -8.568 7.075 4.946 1.00 0.00 H new ATOM 0 HG SER A 28 -9.147 5.377 6.419 1.00 0.00 H new ATOM 400 N ARG A 29 -7.069 7.330 1.769 1.00 0.00 N ATOM 401 CA ARG A 29 -6.138 8.258 1.151 1.00 0.00 C ATOM 402 C ARG A 29 -6.356 9.663 1.704 1.00 0.00 C ATOM 403 O ARG A 29 -7.482 10.029 2.048 1.00 0.00 O ATOM 404 CB ARG A 29 -6.251 8.204 -0.385 1.00 0.00 C ATOM 405 CG ARG A 29 -7.505 8.831 -0.974 1.00 0.00 C ATOM 406 CD ARG A 29 -7.355 10.334 -1.106 1.00 0.00 C ATOM 407 NE ARG A 29 -8.483 10.943 -1.809 1.00 0.00 N ATOM 408 CZ ARG A 29 -8.634 12.255 -1.992 1.00 0.00 C ATOM 409 NH1 ARG A 29 -7.770 13.113 -1.463 1.00 0.00 N ATOM 410 NH2 ARG A 29 -9.663 12.712 -2.694 1.00 0.00 N ATOM 0 H ARG A 29 -7.962 7.236 1.285 1.00 0.00 H new ATOM 0 HA ARG A 29 -5.118 7.964 1.399 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -5.382 8.703 -0.813 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -6.206 7.161 -0.698 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -7.708 8.396 -1.953 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -8.362 8.602 -0.340 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -7.266 10.777 -0.114 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -6.432 10.560 -1.640 1.00 0.00 H new ATOM 0 HE ARG A 29 -9.201 10.324 -2.184 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -6.983 12.770 -0.912 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -7.893 14.115 -1.608 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -10.338 12.060 -3.093 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -9.779 13.716 -2.834 1.00 0.00 H new ATOM 424 N PRO A 30 -5.281 10.453 1.826 1.00 0.00 N ATOM 425 CA PRO A 30 -5.360 11.829 2.330 1.00 0.00 C ATOM 426 C PRO A 30 -6.222 12.715 1.439 1.00 0.00 C ATOM 427 O PRO A 30 -7.324 13.112 1.876 1.00 0.00 O ATOM 428 CB PRO A 30 -3.904 12.307 2.318 1.00 0.00 C ATOM 429 CG PRO A 30 -3.208 11.401 1.360 1.00 0.00 C ATOM 430 CD PRO A 30 -3.900 10.075 1.480 1.00 0.00 C ATOM 431 OXT PRO A 30 -5.812 12.990 0.293 1.00 0.00 O ATOM 0 HA PRO A 30 -5.822 11.876 3.316 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -3.833 13.347 2.000 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -3.460 12.246 3.312 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -3.271 11.785 0.342 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -2.149 11.313 1.603 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -3.857 9.511 0.548 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -3.447 9.451 2.251 1.00 0.00 H new TER 439 PRO A 30 ATOM 440 N MET B 31 -17.269 25.769 -6.692 1.00 0.00 N ATOM 441 CA MET B 31 -17.591 27.190 -6.435 1.00 0.00 C ATOM 442 C MET B 31 -16.333 27.948 -6.038 1.00 0.00 C ATOM 443 O MET B 31 -15.431 27.377 -5.421 1.00 0.00 O ATOM 444 CB MET B 31 -18.646 27.322 -5.330 1.00 0.00 C ATOM 445 CG MET B 31 -20.000 26.728 -5.691 1.00 0.00 C ATOM 446 SD MET B 31 -19.988 24.925 -5.756 1.00 0.00 S ATOM 447 CE MET B 31 -19.732 24.523 -4.027 1.00 0.00 C ATOM 0 HA MET B 31 -17.996 27.617 -7.352 1.00 0.00 H new ATOM 0 HB2 MET B 31 -18.276 26.834 -4.428 1.00 0.00 H new ATOM 0 HB3 MET B 31 -18.776 28.377 -5.091 1.00 0.00 H new ATOM 0 HG2 MET B 31 -20.740 27.054 -4.960 1.00 0.00 H new ATOM 0 HG3 MET B 31 -20.315 27.118 -6.659 1.00 0.00 H new ATOM 0 HE1 MET B 31 -20.048 23.496 -3.841 1.00 0.00 H new ATOM 0 HE2 MET B 31 -18.675 24.627 -3.782 1.00 0.00 H new ATOM 0 HE3 MET B 31 -20.317 25.201 -3.405 1.00 0.00 H new ATOM 459 N ARG B 32 -16.270 29.224 -6.426 1.00 0.00 N ATOM 460 CA ARG B 32 -15.148 30.101 -6.083 1.00 0.00 C ATOM 461 C ARG B 32 -13.822 29.563 -6.613 1.00 0.00 C ATOM 462 O ARG B 32 -12.763 29.845 -6.051 1.00 0.00 O ATOM 463 CB ARG B 32 -15.067 30.300 -4.568 1.00 0.00 C ATOM 464 CG ARG B 32 -16.148 31.209 -3.998 1.00 0.00 C ATOM 465 CD ARG B 32 -15.857 32.679 -4.277 1.00 0.00 C ATOM 466 NE ARG B 32 -15.875 32.995 -5.705 1.00 0.00 N ATOM 467 CZ ARG B 32 -14.885 33.618 -6.348 1.00 0.00 C ATOM 468 NH1 ARG B 32 -13.781 33.983 -5.702 1.00 0.00 N ATOM 469 NH2 ARG B 32 -14.997 33.872 -7.645 1.00 0.00 N ATOM 0 H ARG B 32 -16.993 29.677 -6.985 1.00 0.00 H new ATOM 0 HA ARG B 32 -15.331 31.063 -6.562 1.00 0.00 H new ATOM 0 HB2 ARG B 32 -15.133 29.327 -4.081 1.00 0.00 H new ATOM 0 HB3 ARG B 32 -14.091 30.716 -4.319 1.00 0.00 H new ATOM 0 HG2 ARG B 32 -17.113 30.941 -4.429 1.00 0.00 H new ATOM 0 HG3 ARG B 32 -16.225 31.052 -2.922 1.00 0.00 H new ATOM 0 HD2 ARG B 32 -16.595 33.295 -3.763 1.00 0.00 H new ATOM 0 HD3 ARG B 32 -14.882 32.937 -3.864 1.00 0.00 H new ATOM 0 HE ARG B 32 -16.697 32.722 -6.244 1.00 0.00 H new ATOM 0 HH11 ARG B 32 -13.685 33.787 -4.706 1.00 0.00 H new ATOM 0 HH12 ARG B 32 -13.031 34.459 -6.203 1.00 0.00 H new ATOM 0 HH21 ARG B 32 -15.838 33.591 -8.149 1.00 0.00 H new ATOM 0 HH22 ARG B 32 -14.242 34.348 -8.139 1.00 0.00 H new ATOM 483 N GLY B 33 -13.885 28.789 -7.689 1.00 0.00 N ATOM 484 CA GLY B 33 -12.684 28.231 -8.283 1.00 0.00 C ATOM 485 C GLY B 33 -12.146 27.046 -7.502 1.00 0.00 C ATOM 486 O GLY B 33 -12.046 25.938 -8.036 1.00 0.00 O ATOM 0 H GLY B 33 -14.752 28.536 -8.164 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -12.899 27.921 -9.306 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -11.917 29.004 -8.339 1.00 0.00 H new ATOM 490 N SER B 34 -11.801 27.292 -6.238 1.00 0.00 N ATOM 491 CA SER B 34 -11.263 26.270 -5.348 1.00 0.00 C ATOM 492 C SER B 34 -9.917 25.760 -5.859 1.00 0.00 C ATOM 493 O SER B 34 -9.566 24.595 -5.667 1.00 0.00 O ATOM 494 CB SER B 34 -12.258 25.114 -5.187 1.00 0.00 C ATOM 495 OG SER B 34 -13.499 25.578 -4.676 1.00 0.00 O ATOM 0 H SER B 34 -11.888 28.211 -5.803 1.00 0.00 H new ATOM 0 HA SER B 34 -11.104 26.721 -4.369 1.00 0.00 H new ATOM 0 HB2 SER B 34 -12.416 24.629 -6.150 1.00 0.00 H new ATOM 0 HB3 SER B 34 -11.842 24.363 -4.516 1.00 0.00 H new ATOM 0 HG SER B 34 -13.895 26.216 -5.306 1.00 0.00 H new ATOM 501 N ASN B 35 -9.162 26.642 -6.500 1.00 0.00 N ATOM 502 CA ASN B 35 -7.867 26.272 -7.049 1.00 0.00 C ATOM 503 C ASN B 35 -6.804 26.297 -5.960 1.00 0.00 C ATOM 504 O ASN B 35 -6.666 27.278 -5.226 1.00 0.00 O ATOM 505 CB ASN B 35 -7.467 27.193 -8.215 1.00 0.00 C ATOM 506 CG ASN B 35 -7.246 28.644 -7.813 1.00 0.00 C ATOM 507 OD1 ASN B 35 -7.920 29.175 -6.932 1.00 0.00 O ATOM 508 ND2 ASN B 35 -6.290 29.294 -8.460 1.00 0.00 N ATOM 0 H ASN B 35 -9.424 27.616 -6.652 1.00 0.00 H new ATOM 0 HA ASN B 35 -7.946 25.258 -7.440 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -6.553 26.810 -8.670 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -8.244 27.153 -8.979 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -6.092 30.269 -8.233 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -5.752 28.820 -9.185 1.00 0.00 H new ATOM 515 N ALA B 36 -6.066 25.203 -5.848 1.00 0.00 N ATOM 516 CA ALA B 36 -5.039 25.070 -4.827 1.00 0.00 C ATOM 517 C ALA B 36 -4.187 23.838 -5.084 1.00 0.00 C ATOM 518 O ALA B 36 -4.719 22.747 -5.302 1.00 0.00 O ATOM 519 CB ALA B 36 -5.671 24.988 -3.445 1.00 0.00 C ATOM 0 H ALA B 36 -6.161 24.390 -6.456 1.00 0.00 H new ATOM 0 HA ALA B 36 -4.399 25.952 -4.869 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -4.889 24.889 -2.692 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -6.246 25.894 -3.253 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -6.332 24.122 -3.398 1.00 0.00 H new ATOM 525 N PRO B 37 -2.855 23.998 -5.080 1.00 0.00 N ATOM 526 CA PRO B 37 -1.925 22.880 -5.236 1.00 0.00 C ATOM 527 C PRO B 37 -1.863 22.020 -3.977 1.00 0.00 C ATOM 528 O PRO B 37 -0.889 22.062 -3.222 1.00 0.00 O ATOM 529 CB PRO B 37 -0.582 23.565 -5.496 1.00 0.00 C ATOM 530 CG PRO B 37 -0.701 24.896 -4.838 1.00 0.00 C ATOM 531 CD PRO B 37 -2.151 25.288 -4.941 1.00 0.00 C ATOM 0 HA PRO B 37 -2.221 22.200 -6.035 1.00 0.00 H new ATOM 0 HB2 PRO B 37 0.243 22.989 -5.078 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -0.390 23.667 -6.564 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -0.385 24.845 -3.796 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -0.063 25.631 -5.329 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -2.482 25.831 -4.056 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -2.330 25.936 -5.799 1.00 0.00 H new ATOM 539 N GLN B 38 -2.922 21.257 -3.750 1.00 0.00 N ATOM 540 CA GLN B 38 -3.010 20.388 -2.589 1.00 0.00 C ATOM 541 C GLN B 38 -1.969 19.281 -2.678 1.00 0.00 C ATOM 542 O GLN B 38 -1.961 18.503 -3.633 1.00 0.00 O ATOM 543 CB GLN B 38 -4.414 19.791 -2.476 1.00 0.00 C ATOM 544 CG GLN B 38 -5.501 20.839 -2.277 1.00 0.00 C ATOM 545 CD GLN B 38 -5.353 21.606 -0.974 1.00 0.00 C ATOM 546 OE1 GLN B 38 -5.691 22.788 -0.895 1.00 0.00 O ATOM 547 NE2 GLN B 38 -4.875 20.938 0.065 1.00 0.00 N ATOM 0 H GLN B 38 -3.738 21.223 -4.361 1.00 0.00 H new ATOM 0 HA GLN B 38 -2.812 20.980 -1.695 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -4.632 19.219 -3.378 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -4.437 19.091 -1.641 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -5.478 21.541 -3.110 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -6.476 20.352 -2.297 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -4.605 19.960 -0.038 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -4.777 21.402 0.968 1.00 0.00 H new ATOM 556 N PRO B 39 -1.075 19.197 -1.683 1.00 0.00 N ATOM 557 CA PRO B 39 0.009 18.212 -1.667 1.00 0.00 C ATOM 558 C PRO B 39 -0.471 16.822 -1.249 1.00 0.00 C ATOM 559 O PRO B 39 0.160 16.150 -0.430 1.00 0.00 O ATOM 560 CB PRO B 39 0.975 18.787 -0.634 1.00 0.00 C ATOM 561 CG PRO B 39 0.106 19.533 0.318 1.00 0.00 C ATOM 562 CD PRO B 39 -1.047 20.067 -0.491 1.00 0.00 C ATOM 0 HA PRO B 39 0.451 18.065 -2.652 1.00 0.00 H new ATOM 0 HB2 PRO B 39 1.531 17.997 -0.128 1.00 0.00 H new ATOM 0 HB3 PRO B 39 1.709 19.445 -1.100 1.00 0.00 H new ATOM 0 HG2 PRO B 39 -0.248 18.879 1.115 1.00 0.00 H new ATOM 0 HG3 PRO B 39 0.657 20.345 0.793 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -1.983 20.014 0.064 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -0.895 21.112 -0.762 1.00 0.00 H new ATOM 570 N SER B 40 -1.597 16.412 -1.811 1.00 0.00 N ATOM 571 CA SER B 40 -2.185 15.110 -1.534 1.00 0.00 C ATOM 572 C SER B 40 -3.050 14.669 -2.714 1.00 0.00 C ATOM 573 O SER B 40 -4.279 14.667 -2.638 1.00 0.00 O ATOM 574 CB SER B 40 -3.019 15.161 -0.250 1.00 0.00 C ATOM 575 OG SER B 40 -2.233 15.581 0.853 1.00 0.00 O ATOM 0 H SER B 40 -2.131 16.974 -2.474 1.00 0.00 H new ATOM 0 HA SER B 40 -1.384 14.385 -1.393 1.00 0.00 H new ATOM 0 HB2 SER B 40 -3.857 15.844 -0.384 1.00 0.00 H new ATOM 0 HB3 SER B 40 -3.440 14.176 -0.047 1.00 0.00 H new ATOM 0 HG SER B 40 -2.789 15.607 1.660 1.00 0.00 H new ATOM 581 N HIS B 41 -2.400 14.332 -3.817 1.00 0.00 N ATOM 582 CA HIS B 41 -3.101 13.882 -5.012 1.00 0.00 C ATOM 583 C HIS B 41 -2.437 12.623 -5.549 1.00 0.00 C ATOM 584 O HIS B 41 -1.339 12.682 -6.104 1.00 0.00 O ATOM 585 CB HIS B 41 -3.102 14.982 -6.081 1.00 0.00 C ATOM 586 CG HIS B 41 -3.931 14.657 -7.292 1.00 0.00 C ATOM 587 ND1 HIS B 41 -5.217 15.114 -7.469 1.00 0.00 N ATOM 588 CD2 HIS B 41 -3.643 13.922 -8.392 1.00 0.00 C ATOM 589 CE1 HIS B 41 -5.683 14.675 -8.623 1.00 0.00 C ATOM 590 NE2 HIS B 41 -4.747 13.948 -9.203 1.00 0.00 N ATOM 0 H HIS B 41 -1.385 14.361 -3.911 1.00 0.00 H new ATOM 0 HA HIS B 41 -4.136 13.658 -4.753 1.00 0.00 H new ATOM 0 HB2 HIS B 41 -3.473 15.906 -5.637 1.00 0.00 H new ATOM 0 HB3 HIS B 41 -2.075 15.169 -6.396 1.00 0.00 H new ATOM 0 HD2 HIS B 41 -2.714 13.409 -8.593 1.00 0.00 H new ATOM 0 HE1 HIS B 41 -6.665 14.877 -9.025 1.00 0.00 H new ATOM 0 HE2 HIS B 41 -4.831 13.482 -10.106 1.00 0.00 H new ATOM 599 N ILE B 42 -3.103 11.492 -5.382 1.00 0.00 N ATOM 600 CA ILE B 42 -2.537 10.209 -5.772 1.00 0.00 C ATOM 601 C ILE B 42 -2.829 9.916 -7.242 1.00 0.00 C ATOM 602 O ILE B 42 -3.962 10.051 -7.702 1.00 0.00 O ATOM 603 CB ILE B 42 -3.074 9.047 -4.897 1.00 0.00 C ATOM 604 CG1 ILE B 42 -2.680 9.226 -3.421 1.00 0.00 C ATOM 605 CG2 ILE B 42 -2.555 7.712 -5.407 1.00 0.00 C ATOM 606 CD1 ILE B 42 -3.511 10.247 -2.670 1.00 0.00 C ATOM 0 H ILE B 42 -4.038 11.435 -4.978 1.00 0.00 H new ATOM 0 HA ILE B 42 -1.460 10.279 -5.620 1.00 0.00 H new ATOM 0 HB ILE B 42 -4.162 9.061 -4.966 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -2.765 8.264 -2.916 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -1.632 9.521 -3.371 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -2.942 6.908 -4.781 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -2.885 7.562 -6.435 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -1.466 7.707 -5.371 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -3.166 10.309 -1.638 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -3.408 11.222 -3.147 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -4.558 9.945 -2.685 1.00 0.00 H new ATOM 618 N SER B 43 -1.791 9.535 -7.972 1.00 0.00 N ATOM 619 CA SER B 43 -1.920 9.195 -9.377 1.00 0.00 C ATOM 620 C SER B 43 -2.224 7.706 -9.542 1.00 0.00 C ATOM 621 O SER B 43 -2.971 7.308 -10.438 1.00 0.00 O ATOM 622 CB SER B 43 -0.632 9.555 -10.119 1.00 0.00 C ATOM 623 OG SER B 43 -0.269 10.907 -9.885 1.00 0.00 O ATOM 0 H SER B 43 -0.842 9.454 -7.608 1.00 0.00 H new ATOM 0 HA SER B 43 -2.747 9.765 -9.801 1.00 0.00 H new ATOM 0 HB2 SER B 43 0.174 8.897 -9.795 1.00 0.00 H new ATOM 0 HB3 SER B 43 -0.766 9.391 -11.188 1.00 0.00 H new ATOM 0 HG SER B 43 0.344 11.207 -10.588 1.00 0.00 H new ATOM 629 N LYS B 44 -1.641 6.889 -8.668 1.00 0.00 N ATOM 630 CA LYS B 44 -1.860 5.448 -8.696 1.00 0.00 C ATOM 631 C LYS B 44 -1.445 4.812 -7.371 1.00 0.00 C ATOM 632 O LYS B 44 -0.499 5.265 -6.722 1.00 0.00 O ATOM 633 CB LYS B 44 -1.082 4.799 -9.852 1.00 0.00 C ATOM 634 CG LYS B 44 0.424 5.021 -9.792 1.00 0.00 C ATOM 635 CD LYS B 44 1.140 4.300 -10.925 1.00 0.00 C ATOM 636 CE LYS B 44 2.647 4.506 -10.858 1.00 0.00 C ATOM 637 NZ LYS B 44 3.361 3.751 -11.919 1.00 0.00 N ATOM 0 H LYS B 44 -1.011 7.203 -7.930 1.00 0.00 H new ATOM 0 HA LYS B 44 -2.925 5.276 -8.851 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -1.280 3.727 -9.852 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -1.459 5.193 -10.796 1.00 0.00 H new ATOM 0 HG2 LYS B 44 0.638 6.088 -9.846 1.00 0.00 H new ATOM 0 HG3 LYS B 44 0.807 4.667 -8.835 1.00 0.00 H new ATOM 0 HD2 LYS B 44 0.916 3.234 -10.878 1.00 0.00 H new ATOM 0 HD3 LYS B 44 0.765 4.663 -11.882 1.00 0.00 H new ATOM 0 HE2 LYS B 44 2.872 5.568 -10.955 1.00 0.00 H new ATOM 0 HE3 LYS B 44 3.013 4.191 -9.881 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 4.384 3.920 -11.837 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 3.168 2.735 -11.812 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 3.032 4.069 -12.853 1.00 0.00 H new ATOM 651 N TYR B 45 -2.170 3.781 -6.969 1.00 0.00 N ATOM 652 CA TYR B 45 -1.826 3.010 -5.783 1.00 0.00 C ATOM 653 C TYR B 45 -1.237 1.676 -6.215 1.00 0.00 C ATOM 654 O TYR B 45 -1.847 0.959 -7.004 1.00 0.00 O ATOM 655 CB TYR B 45 -3.058 2.735 -4.915 1.00 0.00 C ATOM 656 CG TYR B 45 -3.879 3.952 -4.556 1.00 0.00 C ATOM 657 CD1 TYR B 45 -3.595 4.701 -3.422 1.00 0.00 C ATOM 658 CD2 TYR B 45 -4.957 4.334 -5.342 1.00 0.00 C ATOM 659 CE1 TYR B 45 -4.364 5.799 -3.082 1.00 0.00 C ATOM 660 CE2 TYR B 45 -5.724 5.431 -5.012 1.00 0.00 C ATOM 661 CZ TYR B 45 -5.427 6.159 -3.884 1.00 0.00 C ATOM 662 OH TYR B 45 -6.195 7.248 -3.554 1.00 0.00 O ATOM 0 H TYR B 45 -3.008 3.456 -7.451 1.00 0.00 H new ATOM 0 HA TYR B 45 -1.110 3.588 -5.199 1.00 0.00 H new ATOM 0 HB2 TYR B 45 -3.699 2.026 -5.438 1.00 0.00 H new ATOM 0 HB3 TYR B 45 -2.733 2.252 -3.994 1.00 0.00 H new ATOM 0 HD1 TYR B 45 -2.761 4.422 -2.796 1.00 0.00 H new ATOM 0 HD2 TYR B 45 -5.199 3.763 -6.226 1.00 0.00 H new ATOM 0 HE1 TYR B 45 -4.134 6.370 -2.195 1.00 0.00 H new ATOM 0 HE2 TYR B 45 -6.556 5.718 -5.638 1.00 0.00 H new ATOM 0 HH TYR B 45 -6.901 7.365 -4.223 1.00 0.00 H new ATOM 672 N ILE B 46 -0.061 1.345 -5.728 1.00 0.00 N ATOM 673 CA ILE B 46 0.534 0.057 -6.040 1.00 0.00 C ATOM 674 C ILE B 46 0.379 -0.884 -4.856 1.00 0.00 C ATOM 675 O ILE B 46 0.867 -0.604 -3.760 1.00 0.00 O ATOM 676 CB ILE B 46 2.032 0.163 -6.433 1.00 0.00 C ATOM 677 CG1 ILE B 46 2.207 0.907 -7.765 1.00 0.00 C ATOM 678 CG2 ILE B 46 2.661 -1.220 -6.527 1.00 0.00 C ATOM 679 CD1 ILE B 46 1.994 2.401 -7.675 1.00 0.00 C ATOM 0 H ILE B 46 0.500 1.941 -5.120 1.00 0.00 H new ATOM 0 HA ILE B 46 0.003 -0.336 -6.907 1.00 0.00 H new ATOM 0 HB ILE B 46 2.538 0.732 -5.652 1.00 0.00 H new ATOM 0 HG12 ILE B 46 3.211 0.717 -8.145 1.00 0.00 H new ATOM 0 HG13 ILE B 46 1.508 0.495 -8.493 1.00 0.00 H new ATOM 0 HG21 ILE B 46 3.711 -1.124 -6.804 1.00 0.00 H new ATOM 0 HG22 ILE B 46 2.584 -1.721 -5.562 1.00 0.00 H new ATOM 0 HG23 ILE B 46 2.139 -1.807 -7.283 1.00 0.00 H new ATOM 0 HD11 ILE B 46 2.136 2.849 -8.659 1.00 0.00 H new ATOM 0 HD12 ILE B 46 0.981 2.604 -7.327 1.00 0.00 H new ATOM 0 HD13 ILE B 46 2.711 2.829 -6.974 1.00 0.00 H new ATOM 691 N LEU B 47 -0.326 -1.979 -5.078 1.00 0.00 N ATOM 692 CA LEU B 47 -0.511 -2.989 -4.055 1.00 0.00 C ATOM 693 C LEU B 47 0.519 -4.093 -4.264 1.00 0.00 C ATOM 694 O LEU B 47 0.501 -4.783 -5.284 1.00 0.00 O ATOM 695 CB LEU B 47 -1.937 -3.564 -4.127 1.00 0.00 C ATOM 696 CG LEU B 47 -2.540 -4.080 -2.808 1.00 0.00 C ATOM 697 CD1 LEU B 47 -1.666 -5.146 -2.171 1.00 0.00 C ATOM 698 CD2 LEU B 47 -2.772 -2.937 -1.835 1.00 0.00 C ATOM 0 H LEU B 47 -0.782 -2.191 -5.965 1.00 0.00 H new ATOM 0 HA LEU B 47 -0.375 -2.545 -3.069 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -2.596 -2.792 -4.524 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.938 -4.384 -4.846 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.501 -4.535 -3.048 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -2.125 -5.485 -1.242 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.564 -5.989 -2.854 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.681 -4.730 -1.958 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -3.199 -3.327 -0.911 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.824 -2.446 -1.618 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -3.461 -2.217 -2.277 1.00 0.00 H new ATOM 710 N ARG B 48 1.435 -4.222 -3.321 1.00 0.00 N ATOM 711 CA ARG B 48 2.450 -5.263 -3.373 1.00 0.00 C ATOM 712 C ARG B 48 2.248 -6.261 -2.251 1.00 0.00 C ATOM 713 O ARG B 48 2.167 -5.880 -1.087 1.00 0.00 O ATOM 714 CB ARG B 48 3.848 -4.651 -3.272 1.00 0.00 C ATOM 715 CG ARG B 48 4.363 -4.104 -4.579 1.00 0.00 C ATOM 716 CD ARG B 48 5.654 -3.332 -4.389 1.00 0.00 C ATOM 717 NE ARG B 48 6.160 -2.829 -5.660 1.00 0.00 N ATOM 718 CZ ARG B 48 7.129 -1.927 -5.781 1.00 0.00 C ATOM 719 NH1 ARG B 48 7.660 -1.357 -4.705 1.00 0.00 N ATOM 720 NH2 ARG B 48 7.556 -1.584 -6.990 1.00 0.00 N ATOM 0 H ARG B 48 1.498 -3.615 -2.504 1.00 0.00 H new ATOM 0 HA ARG B 48 2.356 -5.781 -4.327 1.00 0.00 H new ATOM 0 HB2 ARG B 48 3.832 -3.850 -2.533 1.00 0.00 H new ATOM 0 HB3 ARG B 48 4.541 -5.408 -2.906 1.00 0.00 H new ATOM 0 HG2 ARG B 48 4.528 -4.924 -5.278 1.00 0.00 H new ATOM 0 HG3 ARG B 48 3.611 -3.453 -5.024 1.00 0.00 H new ATOM 0 HD2 ARG B 48 5.485 -2.499 -3.707 1.00 0.00 H new ATOM 0 HD3 ARG B 48 6.401 -3.977 -3.927 1.00 0.00 H new ATOM 0 HE ARG B 48 5.742 -3.194 -6.516 1.00 0.00 H new ATOM 0 HH11 ARG B 48 7.325 -1.610 -3.776 1.00 0.00 H new ATOM 0 HH12 ARG B 48 8.403 -0.666 -4.808 1.00 0.00 H new ATOM 0 HH21 ARG B 48 7.141 -2.012 -7.818 1.00 0.00 H new ATOM 0 HH22 ARG B 48 8.299 -0.893 -7.091 1.00 0.00 H new ATOM 734 N TRP B 49 2.156 -7.534 -2.598 1.00 0.00 N ATOM 735 CA TRP B 49 2.025 -8.574 -1.592 1.00 0.00 C ATOM 736 C TRP B 49 2.958 -9.740 -1.892 1.00 0.00 C ATOM 737 O TRP B 49 3.222 -10.062 -3.055 1.00 0.00 O ATOM 738 CB TRP B 49 0.572 -9.051 -1.465 1.00 0.00 C ATOM 739 CG TRP B 49 0.028 -9.766 -2.668 1.00 0.00 C ATOM 740 CD1 TRP B 49 -0.083 -11.117 -2.832 1.00 0.00 C ATOM 741 CD2 TRP B 49 -0.491 -9.175 -3.864 1.00 0.00 C ATOM 742 NE1 TRP B 49 -0.651 -11.400 -4.048 1.00 0.00 N ATOM 743 CE2 TRP B 49 -0.906 -10.226 -4.703 1.00 0.00 C ATOM 744 CE3 TRP B 49 -0.648 -7.860 -4.307 1.00 0.00 C ATOM 745 CZ2 TRP B 49 -1.468 -10.001 -5.956 1.00 0.00 C ATOM 746 CZ3 TRP B 49 -1.205 -7.638 -5.550 1.00 0.00 C ATOM 747 CH2 TRP B 49 -1.611 -8.703 -6.362 1.00 0.00 C ATOM 0 H TRP B 49 2.169 -7.870 -3.561 1.00 0.00 H new ATOM 0 HA TRP B 49 2.315 -8.145 -0.633 1.00 0.00 H new ATOM 0 HB2 TRP B 49 0.498 -9.714 -0.603 1.00 0.00 H new ATOM 0 HB3 TRP B 49 -0.061 -8.188 -1.258 1.00 0.00 H new ATOM 0 HD1 TRP B 49 0.231 -11.856 -2.109 1.00 0.00 H new ATOM 0 HE1 TRP B 49 -0.851 -12.334 -4.406 1.00 0.00 H new ATOM 0 HE3 TRP B 49 -0.339 -7.031 -3.688 1.00 0.00 H new ATOM 0 HZ2 TRP B 49 -1.780 -10.822 -6.585 1.00 0.00 H new ATOM 0 HZ3 TRP B 49 -1.330 -6.625 -5.902 1.00 0.00 H new ATOM 0 HH2 TRP B 49 -2.046 -8.496 -7.329 1.00 0.00 H new ATOM 758 N ARG B 50 3.471 -10.343 -0.834 1.00 0.00 N ATOM 759 CA ARG B 50 4.394 -11.461 -0.946 1.00 0.00 C ATOM 760 C ARG B 50 4.264 -12.354 0.283 1.00 0.00 C ATOM 761 O ARG B 50 4.243 -11.859 1.408 1.00 0.00 O ATOM 762 CB ARG B 50 5.829 -10.940 -1.059 1.00 0.00 C ATOM 763 CG ARG B 50 6.865 -12.026 -1.291 1.00 0.00 C ATOM 764 CD ARG B 50 8.274 -11.468 -1.215 1.00 0.00 C ATOM 765 NE ARG B 50 8.586 -10.953 0.118 1.00 0.00 N ATOM 766 CZ ARG B 50 9.660 -10.222 0.402 1.00 0.00 C ATOM 767 NH1 ARG B 50 10.538 -9.920 -0.550 1.00 0.00 N ATOM 768 NH2 ARG B 50 9.856 -9.795 1.642 1.00 0.00 N ATOM 0 H ARG B 50 3.260 -10.072 0.127 1.00 0.00 H new ATOM 0 HA ARG B 50 4.154 -12.039 -1.839 1.00 0.00 H new ATOM 0 HB2 ARG B 50 5.880 -10.222 -1.878 1.00 0.00 H new ATOM 0 HB3 ARG B 50 6.082 -10.401 -0.146 1.00 0.00 H new ATOM 0 HG2 ARG B 50 6.743 -12.813 -0.547 1.00 0.00 H new ATOM 0 HG3 ARG B 50 6.704 -12.482 -2.268 1.00 0.00 H new ATOM 0 HD2 ARG B 50 8.988 -12.248 -1.479 1.00 0.00 H new ATOM 0 HD3 ARG B 50 8.388 -10.670 -1.948 1.00 0.00 H new ATOM 0 HE ARG B 50 7.939 -11.168 0.877 1.00 0.00 H new ATOM 0 HH11 ARG B 50 10.389 -10.249 -1.504 1.00 0.00 H new ATOM 0 HH12 ARG B 50 11.360 -9.359 -0.326 1.00 0.00 H new ATOM 0 HH21 ARG B 50 9.184 -10.028 2.374 1.00 0.00 H new ATOM 0 HH22 ARG B 50 10.678 -9.234 1.864 1.00 0.00 H new ATOM 782 N PRO B 51 4.153 -13.674 0.090 1.00 0.00 N ATOM 783 CA PRO B 51 4.042 -14.620 1.203 1.00 0.00 C ATOM 784 C PRO B 51 5.337 -14.705 2.005 1.00 0.00 C ATOM 785 O PRO B 51 6.430 -14.600 1.452 1.00 0.00 O ATOM 786 CB PRO B 51 3.743 -15.952 0.512 1.00 0.00 C ATOM 787 CG PRO B 51 4.286 -15.802 -0.867 1.00 0.00 C ATOM 788 CD PRO B 51 4.133 -14.350 -1.221 1.00 0.00 C ATOM 0 HA PRO B 51 3.277 -14.326 1.922 1.00 0.00 H new ATOM 0 HB2 PRO B 51 4.217 -16.783 1.035 1.00 0.00 H new ATOM 0 HB3 PRO B 51 2.672 -16.156 0.495 1.00 0.00 H new ATOM 0 HG2 PRO B 51 5.332 -16.105 -0.909 1.00 0.00 H new ATOM 0 HG3 PRO B 51 3.743 -16.434 -1.570 1.00 0.00 H new ATOM 0 HD2 PRO B 51 4.944 -14.005 -1.863 1.00 0.00 H new ATOM 0 HD3 PRO B 51 3.202 -14.163 -1.755 1.00 0.00 H new ATOM 796 N LYS B 52 5.199 -14.896 3.311 1.00 0.00 N ATOM 797 CA LYS B 52 6.336 -14.926 4.231 1.00 0.00 C ATOM 798 C LYS B 52 7.279 -16.088 3.954 1.00 0.00 C ATOM 799 O LYS B 52 8.424 -16.090 4.408 1.00 0.00 O ATOM 800 CB LYS B 52 5.838 -15.014 5.670 1.00 0.00 C ATOM 801 CG LYS B 52 5.457 -13.673 6.278 1.00 0.00 C ATOM 802 CD LYS B 52 6.652 -12.733 6.378 1.00 0.00 C ATOM 803 CE LYS B 52 7.783 -13.324 7.210 1.00 0.00 C ATOM 804 NZ LYS B 52 7.352 -13.648 8.595 1.00 0.00 N ATOM 0 H LYS B 52 4.296 -15.035 3.765 1.00 0.00 H new ATOM 0 HA LYS B 52 6.894 -14.002 4.078 1.00 0.00 H new ATOM 0 HB2 LYS B 52 4.972 -15.675 5.704 1.00 0.00 H new ATOM 0 HB3 LYS B 52 6.613 -15.472 6.284 1.00 0.00 H new ATOM 0 HG2 LYS B 52 4.679 -13.208 5.672 1.00 0.00 H new ATOM 0 HG3 LYS B 52 5.036 -13.831 7.271 1.00 0.00 H new ATOM 0 HD2 LYS B 52 7.019 -12.508 5.377 1.00 0.00 H new ATOM 0 HD3 LYS B 52 6.333 -11.789 6.820 1.00 0.00 H new ATOM 0 HE2 LYS B 52 8.154 -14.228 6.726 1.00 0.00 H new ATOM 0 HE3 LYS B 52 8.613 -12.618 7.245 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 8.176 -13.951 9.153 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 6.928 -12.805 9.033 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 6.650 -14.415 8.570 1.00 0.00 H new ATOM 818 N ASN B 53 6.795 -17.081 3.229 1.00 0.00 N ATOM 819 CA ASN B 53 7.619 -18.222 2.855 1.00 0.00 C ATOM 820 C ASN B 53 8.485 -17.882 1.647 1.00 0.00 C ATOM 821 O ASN B 53 9.306 -18.690 1.215 1.00 0.00 O ATOM 822 CB ASN B 53 6.745 -19.439 2.549 1.00 0.00 C ATOM 823 CG ASN B 53 5.786 -19.184 1.405 1.00 0.00 C ATOM 824 OD1 ASN B 53 4.668 -18.713 1.610 1.00 0.00 O ATOM 825 ND2 ASN B 53 6.220 -19.481 0.195 1.00 0.00 N ATOM 0 H ASN B 53 5.835 -17.122 2.886 1.00 0.00 H new ATOM 0 HA ASN B 53 8.270 -18.463 3.696 1.00 0.00 H new ATOM 0 HB2 ASN B 53 7.382 -20.289 2.304 1.00 0.00 H new ATOM 0 HB3 ASN B 53 6.180 -19.711 3.440 1.00 0.00 H new ATOM 0 HD21 ASN B 53 5.621 -19.322 -0.615 1.00 0.00 H new ATOM 0 HD22 ASN B 53 7.155 -19.870 0.070 1.00 0.00 H new ATOM 832 N SER B 54 8.290 -16.691 1.101 1.00 0.00 N ATOM 833 CA SER B 54 9.068 -16.228 -0.034 1.00 0.00 C ATOM 834 C SER B 54 9.703 -14.875 0.269 1.00 0.00 C ATOM 835 O SER B 54 9.022 -13.938 0.677 1.00 0.00 O ATOM 836 CB SER B 54 8.178 -16.112 -1.275 1.00 0.00 C ATOM 837 OG SER B 54 7.522 -17.336 -1.558 1.00 0.00 O ATOM 0 H SER B 54 7.593 -16.024 1.431 1.00 0.00 H new ATOM 0 HA SER B 54 9.858 -16.954 -0.226 1.00 0.00 H new ATOM 0 HB2 SER B 54 7.437 -15.328 -1.121 1.00 0.00 H new ATOM 0 HB3 SER B 54 8.783 -15.815 -2.132 1.00 0.00 H new ATOM 0 HG SER B 54 6.960 -17.230 -2.354 1.00 0.00 H new ATOM 843 N VAL B 55 11.009 -14.780 0.088 1.00 0.00 N ATOM 844 CA VAL B 55 11.711 -13.525 0.255 1.00 0.00 C ATOM 845 C VAL B 55 12.056 -12.936 -1.119 1.00 0.00 C ATOM 846 O VAL B 55 12.791 -11.951 -1.237 1.00 0.00 O ATOM 847 CB VAL B 55 12.990 -13.733 1.097 1.00 0.00 C ATOM 848 CG1 VAL B 55 14.069 -14.456 0.302 1.00 0.00 C ATOM 849 CG2 VAL B 55 13.498 -12.413 1.638 1.00 0.00 C ATOM 0 H VAL B 55 11.605 -15.564 -0.176 1.00 0.00 H new ATOM 0 HA VAL B 55 11.066 -12.823 0.784 1.00 0.00 H new ATOM 0 HB VAL B 55 12.732 -14.368 1.945 1.00 0.00 H new ATOM 0 HG11 VAL B 55 14.954 -14.586 0.924 1.00 0.00 H new ATOM 0 HG12 VAL B 55 13.698 -15.433 -0.010 1.00 0.00 H new ATOM 0 HG13 VAL B 55 14.328 -13.868 -0.579 1.00 0.00 H new ATOM 0 HG21 VAL B 55 14.399 -12.584 2.227 1.00 0.00 H new ATOM 0 HG22 VAL B 55 13.728 -11.744 0.809 1.00 0.00 H new ATOM 0 HG23 VAL B 55 12.733 -11.959 2.268 1.00 0.00 H new ATOM 859 N GLY B 56 11.493 -13.548 -2.156 1.00 0.00 N ATOM 860 CA GLY B 56 11.787 -13.145 -3.517 1.00 0.00 C ATOM 861 C GLY B 56 10.945 -11.979 -4.002 1.00 0.00 C ATOM 862 O GLY B 56 10.966 -10.895 -3.411 1.00 0.00 O ATOM 0 H GLY B 56 10.833 -14.322 -2.075 1.00 0.00 H new ATOM 0 HA2 GLY B 56 12.841 -12.875 -3.587 1.00 0.00 H new ATOM 0 HA3 GLY B 56 11.631 -13.996 -4.180 1.00 0.00 H new ATOM 866 N ARG B 57 10.183 -12.214 -5.064 1.00 0.00 N ATOM 867 CA ARG B 57 9.485 -11.142 -5.769 1.00 0.00 C ATOM 868 C ARG B 57 8.128 -10.828 -5.151 1.00 0.00 C ATOM 869 O ARG B 57 7.436 -11.713 -4.644 1.00 0.00 O ATOM 870 CB ARG B 57 9.287 -11.510 -7.239 1.00 0.00 C ATOM 871 CG ARG B 57 10.577 -11.597 -8.037 1.00 0.00 C ATOM 872 CD ARG B 57 10.292 -11.863 -9.505 1.00 0.00 C ATOM 873 NE ARG B 57 11.507 -11.838 -10.318 1.00 0.00 N ATOM 874 CZ ARG B 57 11.528 -11.523 -11.614 1.00 0.00 C ATOM 875 NH1 ARG B 57 10.403 -11.202 -12.243 1.00 0.00 N ATOM 876 NH2 ARG B 57 12.674 -11.521 -12.280 1.00 0.00 N ATOM 0 H ARG B 57 10.032 -13.142 -5.459 1.00 0.00 H new ATOM 0 HA ARG B 57 10.111 -10.254 -5.684 1.00 0.00 H new ATOM 0 HB2 ARG B 57 8.772 -12.469 -7.296 1.00 0.00 H new ATOM 0 HB3 ARG B 57 8.635 -10.770 -7.703 1.00 0.00 H new ATOM 0 HG2 ARG B 57 11.136 -10.667 -7.934 1.00 0.00 H new ATOM 0 HG3 ARG B 57 11.205 -12.392 -7.635 1.00 0.00 H new ATOM 0 HD2 ARG B 57 9.808 -12.834 -9.609 1.00 0.00 H new ATOM 0 HD3 ARG B 57 9.592 -11.116 -9.878 1.00 0.00 H new ATOM 0 HE ARG B 57 12.391 -12.075 -9.868 1.00 0.00 H new ATOM 0 HH11 ARG B 57 9.519 -11.196 -11.735 1.00 0.00 H new ATOM 0 HH12 ARG B 57 10.424 -10.962 -13.234 1.00 0.00 H new ATOM 0 HH21 ARG B 57 13.542 -11.761 -11.802 1.00 0.00 H new ATOM 0 HH22 ARG B 57 12.688 -11.280 -13.271 1.00 0.00 H new ATOM 890 N TRP B 58 7.763 -9.553 -5.208 1.00 0.00 N ATOM 891 CA TRP B 58 6.448 -9.100 -4.778 1.00 0.00 C ATOM 892 C TRP B 58 5.495 -9.091 -5.963 1.00 0.00 C ATOM 893 O TRP B 58 5.899 -8.785 -7.089 1.00 0.00 O ATOM 894 CB TRP B 58 6.520 -7.682 -4.201 1.00 0.00 C ATOM 895 CG TRP B 58 7.389 -7.550 -2.991 1.00 0.00 C ATOM 896 CD1 TRP B 58 8.753 -7.525 -2.958 1.00 0.00 C ATOM 897 CD2 TRP B 58 6.950 -7.397 -1.638 1.00 0.00 C ATOM 898 NE1 TRP B 58 9.188 -7.377 -1.664 1.00 0.00 N ATOM 899 CE2 TRP B 58 8.101 -7.296 -0.837 1.00 0.00 C ATOM 900 CE3 TRP B 58 5.695 -7.338 -1.026 1.00 0.00 C ATOM 901 CZ2 TRP B 58 8.036 -7.139 0.542 1.00 0.00 C ATOM 902 CZ3 TRP B 58 5.633 -7.184 0.345 1.00 0.00 C ATOM 903 CH2 TRP B 58 6.797 -7.085 1.117 1.00 0.00 C ATOM 0 H TRP B 58 8.368 -8.808 -5.552 1.00 0.00 H new ATOM 0 HA TRP B 58 6.091 -9.784 -4.008 1.00 0.00 H new ATOM 0 HB2 TRP B 58 6.889 -7.007 -4.973 1.00 0.00 H new ATOM 0 HB3 TRP B 58 5.512 -7.355 -3.947 1.00 0.00 H new ATOM 0 HD1 TRP B 58 9.395 -7.609 -3.822 1.00 0.00 H new ATOM 0 HE1 TRP B 58 10.163 -7.334 -1.368 1.00 0.00 H new ATOM 0 HE3 TRP B 58 4.792 -7.411 -1.613 1.00 0.00 H new ATOM 0 HZ2 TRP B 58 8.933 -7.062 1.139 1.00 0.00 H new ATOM 0 HZ3 TRP B 58 4.669 -7.139 0.830 1.00 0.00 H new ATOM 0 HH2 TRP B 58 6.714 -6.964 2.187 1.00 0.00 H new ATOM 914 N LYS B 59 4.240 -9.421 -5.719 1.00 0.00 N ATOM 915 CA LYS B 59 3.226 -9.309 -6.753 1.00 0.00 C ATOM 916 C LYS B 59 2.691 -7.886 -6.765 1.00 0.00 C ATOM 917 O LYS B 59 2.352 -7.339 -5.716 1.00 0.00 O ATOM 918 CB LYS B 59 2.093 -10.306 -6.517 1.00 0.00 C ATOM 919 CG LYS B 59 2.565 -11.743 -6.384 1.00 0.00 C ATOM 920 CD LYS B 59 1.396 -12.711 -6.350 1.00 0.00 C ATOM 921 CE LYS B 59 1.855 -14.134 -6.089 1.00 0.00 C ATOM 922 NZ LYS B 59 2.848 -14.599 -7.095 1.00 0.00 N ATOM 0 H LYS B 59 3.900 -9.766 -4.822 1.00 0.00 H new ATOM 0 HA LYS B 59 3.672 -9.541 -7.720 1.00 0.00 H new ATOM 0 HB2 LYS B 59 1.555 -10.024 -5.612 1.00 0.00 H new ATOM 0 HB3 LYS B 59 1.385 -10.240 -7.343 1.00 0.00 H new ATOM 0 HG2 LYS B 59 3.220 -11.991 -7.219 1.00 0.00 H new ATOM 0 HG3 LYS B 59 3.155 -11.851 -5.474 1.00 0.00 H new ATOM 0 HD2 LYS B 59 0.694 -12.407 -5.574 1.00 0.00 H new ATOM 0 HD3 LYS B 59 0.861 -12.669 -7.299 1.00 0.00 H new ATOM 0 HE2 LYS B 59 2.294 -14.195 -5.093 1.00 0.00 H new ATOM 0 HE3 LYS B 59 0.992 -14.800 -6.099 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 3.018 -15.617 -6.970 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 2.481 -14.424 -8.052 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 3.741 -14.081 -6.967 1.00 0.00 H new ATOM 936 N GLU B 60 2.637 -7.284 -7.943 1.00 0.00 N ATOM 937 CA GLU B 60 2.285 -5.875 -8.056 1.00 0.00 C ATOM 938 C GLU B 60 0.978 -5.680 -8.808 1.00 0.00 C ATOM 939 O GLU B 60 0.792 -6.208 -9.906 1.00 0.00 O ATOM 940 CB GLU B 60 3.403 -5.108 -8.763 1.00 0.00 C ATOM 941 CG GLU B 60 4.725 -5.140 -8.021 1.00 0.00 C ATOM 942 CD GLU B 60 5.815 -4.377 -8.735 1.00 0.00 C ATOM 943 OE1 GLU B 60 6.598 -5.005 -9.475 1.00 0.00 O ATOM 944 OE2 GLU B 60 5.896 -3.143 -8.557 1.00 0.00 O ATOM 0 H GLU B 60 2.831 -7.746 -8.832 1.00 0.00 H new ATOM 0 HA GLU B 60 2.155 -5.487 -7.046 1.00 0.00 H new ATOM 0 HB2 GLU B 60 3.545 -5.526 -9.760 1.00 0.00 H new ATOM 0 HB3 GLU B 60 3.094 -4.071 -8.894 1.00 0.00 H new ATOM 0 HG2 GLU B 60 4.587 -4.721 -7.024 1.00 0.00 H new ATOM 0 HG3 GLU B 60 5.038 -6.176 -7.891 1.00 0.00 H new ATOM 951 N ALA B 61 0.075 -4.929 -8.202 1.00 0.00 N ATOM 952 CA ALA B 61 -1.158 -4.529 -8.854 1.00 0.00 C ATOM 953 C ALA B 61 -1.345 -3.025 -8.720 1.00 0.00 C ATOM 954 O ALA B 61 -1.259 -2.482 -7.620 1.00 0.00 O ATOM 955 CB ALA B 61 -2.344 -5.268 -8.258 1.00 0.00 C ATOM 0 H ALA B 61 0.176 -4.581 -7.248 1.00 0.00 H new ATOM 0 HA ALA B 61 -1.097 -4.786 -9.911 1.00 0.00 H new ATOM 0 HB1 ALA B 61 -3.259 -4.954 -8.761 1.00 0.00 H new ATOM 0 HB2 ALA B 61 -2.208 -6.341 -8.390 1.00 0.00 H new ATOM 0 HB3 ALA B 61 -2.418 -5.040 -7.195 1.00 0.00 H new ATOM 961 N THR B 62 -1.576 -2.353 -9.835 1.00 0.00 N ATOM 962 CA THR B 62 -1.741 -0.910 -9.827 1.00 0.00 C ATOM 963 C THR B 62 -3.220 -0.526 -9.851 1.00 0.00 C ATOM 964 O THR B 62 -3.978 -0.956 -10.723 1.00 0.00 O ATOM 965 CB THR B 62 -1.012 -0.263 -11.019 1.00 0.00 C ATOM 966 OG1 THR B 62 0.374 -0.639 -11.006 1.00 0.00 O ATOM 967 CG2 THR B 62 -1.122 1.253 -10.970 1.00 0.00 C ATOM 0 H THR B 62 -1.653 -2.783 -10.757 1.00 0.00 H new ATOM 0 HA THR B 62 -1.299 -0.536 -8.904 1.00 0.00 H new ATOM 0 HB THR B 62 -1.483 -0.617 -11.936 1.00 0.00 H new ATOM 0 HG1 THR B 62 0.832 -0.226 -11.767 1.00 0.00 H new ATOM 0 HG21 THR B 62 -0.598 1.684 -11.823 1.00 0.00 H new ATOM 0 HG22 THR B 62 -2.172 1.543 -11.005 1.00 0.00 H new ATOM 0 HG23 THR B 62 -0.674 1.621 -10.047 1.00 0.00 H new ATOM 975 N ILE B 63 -3.619 0.272 -8.876 1.00 0.00 N ATOM 976 CA ILE B 63 -4.992 0.734 -8.757 1.00 0.00 C ATOM 977 C ILE B 63 -5.059 2.227 -9.072 1.00 0.00 C ATOM 978 O ILE B 63 -4.241 3.002 -8.573 1.00 0.00 O ATOM 979 CB ILE B 63 -5.551 0.489 -7.329 1.00 0.00 C ATOM 980 CG1 ILE B 63 -5.513 -0.998 -6.963 1.00 0.00 C ATOM 981 CG2 ILE B 63 -6.971 1.011 -7.205 1.00 0.00 C ATOM 982 CD1 ILE B 63 -4.191 -1.463 -6.389 1.00 0.00 C ATOM 0 H ILE B 63 -3.000 0.619 -8.143 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.599 0.171 -9.466 1.00 0.00 H new ATOM 0 HB ILE B 63 -4.912 1.033 -6.634 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -6.302 -1.203 -6.240 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -5.736 -1.586 -7.854 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -7.339 0.827 -6.196 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -6.984 2.082 -7.407 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -7.611 0.499 -7.924 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -4.249 -2.526 -6.157 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -3.398 -1.293 -7.117 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -3.973 -0.905 -5.479 1.00 0.00 H new ATOM 994 N PRO B 64 -6.012 2.641 -9.931 1.00 0.00 N ATOM 995 CA PRO B 64 -6.212 4.054 -10.287 1.00 0.00 C ATOM 996 C PRO B 64 -6.273 4.962 -9.062 1.00 0.00 C ATOM 997 O PRO B 64 -6.891 4.612 -8.050 1.00 0.00 O ATOM 998 CB PRO B 64 -7.559 4.044 -11.006 1.00 0.00 C ATOM 999 CG PRO B 64 -7.651 2.686 -11.605 1.00 0.00 C ATOM 1000 CD PRO B 64 -6.960 1.760 -10.641 1.00 0.00 C ATOM 0 HA PRO B 64 -5.390 4.443 -10.887 1.00 0.00 H new ATOM 0 HB2 PRO B 64 -8.380 4.229 -10.313 1.00 0.00 H new ATOM 0 HB3 PRO B 64 -7.607 4.819 -11.771 1.00 0.00 H new ATOM 0 HG2 PRO B 64 -8.691 2.393 -11.750 1.00 0.00 H new ATOM 0 HG3 PRO B 64 -7.172 2.658 -12.584 1.00 0.00 H new ATOM 0 HD2 PRO B 64 -7.668 1.296 -9.954 1.00 0.00 H new ATOM 0 HD3 PRO B 64 -6.444 0.952 -11.161 1.00 0.00 H new ATOM 1008 N GLY B 65 -5.653 6.136 -9.172 1.00 0.00 N ATOM 1009 CA GLY B 65 -5.549 7.054 -8.047 1.00 0.00 C ATOM 1010 C GLY B 65 -6.851 7.761 -7.712 1.00 0.00 C ATOM 1011 O GLY B 65 -6.900 8.986 -7.632 1.00 0.00 O ATOM 0 H GLY B 65 -5.216 6.471 -10.031 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -5.209 6.503 -7.170 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -4.787 7.801 -8.269 1.00 0.00 H new ATOM 1015 N HIS B 66 -7.906 6.983 -7.527 1.00 0.00 N ATOM 1016 CA HIS B 66 -9.195 7.504 -7.091 1.00 0.00 C ATOM 1017 C HIS B 66 -10.049 6.377 -6.525 1.00 0.00 C ATOM 1018 O HIS B 66 -11.259 6.518 -6.358 1.00 0.00 O ATOM 1019 CB HIS B 66 -9.930 8.226 -8.233 1.00 0.00 C ATOM 1020 CG HIS B 66 -10.136 7.402 -9.470 1.00 0.00 C ATOM 1021 ND1 HIS B 66 -9.396 7.579 -10.618 1.00 0.00 N ATOM 1022 CD2 HIS B 66 -11.017 6.412 -9.744 1.00 0.00 C ATOM 1023 CE1 HIS B 66 -9.814 6.739 -11.542 1.00 0.00 C ATOM 1024 NE2 HIS B 66 -10.796 6.017 -11.040 1.00 0.00 N ATOM 0 H HIS B 66 -7.894 5.974 -7.674 1.00 0.00 H new ATOM 0 HA HIS B 66 -9.015 8.239 -6.307 1.00 0.00 H new ATOM 0 HB2 HIS B 66 -10.902 8.557 -7.868 1.00 0.00 H new ATOM 0 HB3 HIS B 66 -9.368 9.121 -8.499 1.00 0.00 H new ATOM 0 HD2 HIS B 66 -11.757 6.008 -9.069 1.00 0.00 H new ATOM 0 HE1 HIS B 66 -9.418 6.656 -12.543 1.00 0.00 H new ATOM 0 HE2 HIS B 66 -11.307 5.285 -11.533 1.00 0.00 H new ATOM 1033 N LEU B 67 -9.408 5.249 -6.243 1.00 0.00 N ATOM 1034 CA LEU B 67 -10.084 4.120 -5.625 1.00 0.00 C ATOM 1035 C LEU B 67 -9.533 3.913 -4.222 1.00 0.00 C ATOM 1036 O LEU B 67 -8.411 4.330 -3.927 1.00 0.00 O ATOM 1037 CB LEU B 67 -9.905 2.847 -6.460 1.00 0.00 C ATOM 1038 CG LEU B 67 -10.451 2.913 -7.893 1.00 0.00 C ATOM 1039 CD1 LEU B 67 -10.313 1.566 -8.579 1.00 0.00 C ATOM 1040 CD2 LEU B 67 -11.905 3.361 -7.898 1.00 0.00 C ATOM 0 H LEU B 67 -8.418 5.094 -6.434 1.00 0.00 H new ATOM 0 HA LEU B 67 -11.151 4.335 -5.571 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -8.842 2.610 -6.506 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -10.393 2.022 -5.942 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.864 3.647 -8.445 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -10.705 1.633 -9.594 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -9.261 1.282 -8.615 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -10.873 0.815 -8.022 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -12.270 3.400 -8.924 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -12.506 2.654 -7.326 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -11.982 4.350 -7.447 1.00 0.00 H new ATOM 1052 N ASN B 68 -10.311 3.280 -3.361 1.00 0.00 N ATOM 1053 CA ASN B 68 -9.919 3.120 -1.966 1.00 0.00 C ATOM 1054 C ASN B 68 -9.930 1.662 -1.530 1.00 0.00 C ATOM 1055 O ASN B 68 -9.667 1.359 -0.368 1.00 0.00 O ATOM 1056 CB ASN B 68 -10.832 3.938 -1.055 1.00 0.00 C ATOM 1057 CG ASN B 68 -10.474 5.410 -1.042 1.00 0.00 C ATOM 1058 OD1 ASN B 68 -10.946 6.189 -1.871 1.00 0.00 O ATOM 1059 ND2 ASN B 68 -9.639 5.801 -0.096 1.00 0.00 N ATOM 0 H ASN B 68 -11.214 2.869 -3.599 1.00 0.00 H new ATOM 0 HA ASN B 68 -8.896 3.486 -1.879 1.00 0.00 H new ATOM 0 HB2 ASN B 68 -11.865 3.822 -1.383 1.00 0.00 H new ATOM 0 HB3 ASN B 68 -10.774 3.545 -0.040 1.00 0.00 H new ATOM 0 HD21 ASN B 68 -9.362 6.781 -0.033 1.00 0.00 H new ATOM 0 HD22 ASN B 68 -9.271 5.123 0.571 1.00 0.00 H new ATOM 1066 N SER B 69 -10.224 0.759 -2.449 1.00 0.00 N ATOM 1067 CA SER B 69 -10.244 -0.656 -2.119 1.00 0.00 C ATOM 1068 C SER B 69 -9.871 -1.503 -3.326 1.00 0.00 C ATOM 1069 O SER B 69 -10.106 -1.112 -4.471 1.00 0.00 O ATOM 1070 CB SER B 69 -11.622 -1.057 -1.589 1.00 0.00 C ATOM 1071 OG SER B 69 -12.647 -0.719 -2.507 1.00 0.00 O ATOM 0 H SER B 69 -10.450 0.976 -3.420 1.00 0.00 H new ATOM 0 HA SER B 69 -9.503 -0.835 -1.340 1.00 0.00 H new ATOM 0 HB2 SER B 69 -11.642 -2.130 -1.398 1.00 0.00 H new ATOM 0 HB3 SER B 69 -11.806 -0.560 -0.637 1.00 0.00 H new ATOM 0 HG SER B 69 -13.515 -0.989 -2.142 1.00 0.00 H new ATOM 1077 N TYR B 70 -9.270 -2.654 -3.063 1.00 0.00 N ATOM 1078 CA TYR B 70 -8.883 -3.572 -4.119 1.00 0.00 C ATOM 1079 C TYR B 70 -9.110 -5.013 -3.679 1.00 0.00 C ATOM 1080 O TYR B 70 -8.823 -5.376 -2.538 1.00 0.00 O ATOM 1081 CB TYR B 70 -7.414 -3.351 -4.495 1.00 0.00 C ATOM 1082 CG TYR B 70 -6.922 -4.247 -5.610 1.00 0.00 C ATOM 1083 CD1 TYR B 70 -7.403 -4.106 -6.905 1.00 0.00 C ATOM 1084 CD2 TYR B 70 -5.971 -5.228 -5.367 1.00 0.00 C ATOM 1085 CE1 TYR B 70 -6.952 -4.919 -7.926 1.00 0.00 C ATOM 1086 CE2 TYR B 70 -5.513 -6.046 -6.382 1.00 0.00 C ATOM 1087 CZ TYR B 70 -6.007 -5.887 -7.660 1.00 0.00 C ATOM 1088 OH TYR B 70 -5.556 -6.701 -8.673 1.00 0.00 O ATOM 0 H TYR B 70 -9.040 -2.974 -2.122 1.00 0.00 H new ATOM 0 HA TYR B 70 -9.501 -3.379 -4.996 1.00 0.00 H new ATOM 0 HB2 TYR B 70 -7.278 -2.311 -4.792 1.00 0.00 H new ATOM 0 HB3 TYR B 70 -6.795 -3.514 -3.612 1.00 0.00 H new ATOM 0 HD1 TYR B 70 -8.142 -3.348 -7.117 1.00 0.00 H new ATOM 0 HD2 TYR B 70 -5.582 -5.354 -4.367 1.00 0.00 H new ATOM 0 HE1 TYR B 70 -7.337 -4.797 -8.927 1.00 0.00 H new ATOM 0 HE2 TYR B 70 -4.773 -6.805 -6.176 1.00 0.00 H new ATOM 0 HH TYR B 70 -4.892 -7.328 -8.318 1.00 0.00 H new ATOM 1098 N THR B 71 -9.647 -5.821 -4.577 1.00 0.00 N ATOM 1099 CA THR B 71 -9.848 -7.230 -4.306 1.00 0.00 C ATOM 1100 C THR B 71 -8.647 -8.034 -4.799 1.00 0.00 C ATOM 1101 O THR B 71 -8.513 -8.307 -5.995 1.00 0.00 O ATOM 1102 CB THR B 71 -11.142 -7.743 -4.969 1.00 0.00 C ATOM 1103 OG1 THR B 71 -12.255 -6.937 -4.550 1.00 0.00 O ATOM 1104 CG2 THR B 71 -11.401 -9.199 -4.607 1.00 0.00 C ATOM 0 H THR B 71 -9.952 -5.522 -5.503 1.00 0.00 H new ATOM 0 HA THR B 71 -9.947 -7.360 -3.228 1.00 0.00 H new ATOM 0 HB THR B 71 -11.023 -7.673 -6.050 1.00 0.00 H new ATOM 0 HG1 THR B 71 -13.075 -7.265 -4.975 1.00 0.00 H new ATOM 0 HG21 THR B 71 -12.320 -9.536 -5.088 1.00 0.00 H new ATOM 0 HG22 THR B 71 -10.567 -9.813 -4.948 1.00 0.00 H new ATOM 0 HG23 THR B 71 -11.502 -9.293 -3.526 1.00 0.00 H new ATOM 1112 N ILE B 72 -7.761 -8.382 -3.875 1.00 0.00 N ATOM 1113 CA ILE B 72 -6.553 -9.120 -4.216 1.00 0.00 C ATOM 1114 C ILE B 72 -6.877 -10.582 -4.469 1.00 0.00 C ATOM 1115 O ILE B 72 -7.332 -11.284 -3.569 1.00 0.00 O ATOM 1116 CB ILE B 72 -5.491 -9.046 -3.098 1.00 0.00 C ATOM 1117 CG1 ILE B 72 -5.173 -7.594 -2.744 1.00 0.00 C ATOM 1118 CG2 ILE B 72 -4.226 -9.779 -3.525 1.00 0.00 C ATOM 1119 CD1 ILE B 72 -4.138 -7.458 -1.647 1.00 0.00 C ATOM 0 H ILE B 72 -7.857 -8.165 -2.883 1.00 0.00 H new ATOM 0 HA ILE B 72 -6.149 -8.656 -5.116 1.00 0.00 H new ATOM 0 HB ILE B 72 -5.895 -9.530 -2.209 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -4.816 -7.079 -3.636 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -6.090 -7.094 -2.433 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -3.485 -9.720 -2.728 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -4.461 -10.824 -3.725 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -3.826 -9.318 -4.428 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -3.959 -6.402 -1.445 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -4.501 -7.944 -0.742 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -3.208 -7.930 -1.964 1.00 0.00 H new ATOM 1131 N LYS B 73 -6.654 -11.029 -5.690 1.00 0.00 N ATOM 1132 CA LYS B 73 -6.849 -12.424 -6.037 1.00 0.00 C ATOM 1133 C LYS B 73 -5.506 -13.127 -6.139 1.00 0.00 C ATOM 1134 O LYS B 73 -4.574 -12.615 -6.763 1.00 0.00 O ATOM 1135 CB LYS B 73 -7.609 -12.546 -7.357 1.00 0.00 C ATOM 1136 CG LYS B 73 -9.046 -12.065 -7.279 1.00 0.00 C ATOM 1137 CD LYS B 73 -9.707 -12.066 -8.646 1.00 0.00 C ATOM 1138 CE LYS B 73 -11.173 -11.677 -8.557 1.00 0.00 C ATOM 1139 NZ LYS B 73 -11.986 -12.721 -7.877 1.00 0.00 N ATOM 0 H LYS B 73 -6.336 -10.443 -6.462 1.00 0.00 H new ATOM 0 HA LYS B 73 -7.439 -12.899 -5.253 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -7.085 -11.974 -8.122 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -7.601 -13.588 -7.676 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -9.609 -12.706 -6.601 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -9.072 -11.058 -6.862 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -9.185 -11.372 -9.304 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -9.619 -13.056 -9.093 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -11.266 -10.735 -8.016 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -11.565 -11.508 -9.560 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -12.997 -12.509 -8.000 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -11.774 -13.651 -8.292 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -11.756 -12.734 -6.863 1.00 0.00 H new ATOM 1153 N GLY B 74 -5.408 -14.287 -5.515 1.00 0.00 N ATOM 1154 CA GLY B 74 -4.173 -15.041 -5.546 1.00 0.00 C ATOM 1155 C GLY B 74 -3.515 -15.118 -4.186 1.00 0.00 C ATOM 1156 O GLY B 74 -2.291 -15.198 -4.081 1.00 0.00 O ATOM 0 H GLY B 74 -6.163 -14.723 -4.985 1.00 0.00 H new ATOM 0 HA2 GLY B 74 -4.374 -16.049 -5.908 1.00 0.00 H new ATOM 0 HA3 GLY B 74 -3.485 -14.579 -6.255 1.00 0.00 H new ATOM 1160 N LEU B 75 -4.324 -15.075 -3.140 1.00 0.00 N ATOM 1161 CA LEU B 75 -3.821 -15.197 -1.780 1.00 0.00 C ATOM 1162 C LEU B 75 -4.108 -16.587 -1.232 1.00 0.00 C ATOM 1163 O LEU B 75 -5.254 -17.026 -1.211 1.00 0.00 O ATOM 1164 CB LEU B 75 -4.457 -14.138 -0.878 1.00 0.00 C ATOM 1165 CG LEU B 75 -4.087 -12.691 -1.210 1.00 0.00 C ATOM 1166 CD1 LEU B 75 -4.837 -11.734 -0.304 1.00 0.00 C ATOM 1167 CD2 LEU B 75 -2.591 -12.477 -1.077 1.00 0.00 C ATOM 0 H LEU B 75 -5.335 -14.956 -3.206 1.00 0.00 H new ATOM 0 HA LEU B 75 -2.742 -15.041 -1.797 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -5.541 -14.241 -0.933 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -4.169 -14.342 0.153 1.00 0.00 H new ATOM 0 HG LEU B 75 -4.373 -12.492 -2.243 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -4.564 -10.708 -0.552 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -5.910 -11.867 -0.443 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -4.577 -11.938 0.735 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -2.349 -11.442 -1.317 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -2.282 -12.694 -0.055 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -2.066 -13.141 -1.763 1.00 0.00 H new ATOM 1179 N LYS B 76 -3.065 -17.276 -0.803 1.00 0.00 N ATOM 1180 CA LYS B 76 -3.210 -18.611 -0.242 1.00 0.00 C ATOM 1181 C LYS B 76 -3.817 -18.551 1.160 1.00 0.00 C ATOM 1182 O LYS B 76 -3.371 -17.774 2.012 1.00 0.00 O ATOM 1183 CB LYS B 76 -1.853 -19.316 -0.200 1.00 0.00 C ATOM 1184 CG LYS B 76 -1.277 -19.621 -1.572 1.00 0.00 C ATOM 1185 CD LYS B 76 0.123 -20.201 -1.464 1.00 0.00 C ATOM 1186 CE LYS B 76 0.664 -20.642 -2.816 1.00 0.00 C ATOM 1187 NZ LYS B 76 0.696 -19.530 -3.801 1.00 0.00 N ATOM 0 H LYS B 76 -2.105 -16.933 -0.832 1.00 0.00 H new ATOM 0 HA LYS B 76 -3.885 -19.179 -0.882 1.00 0.00 H new ATOM 0 HB2 LYS B 76 -1.147 -18.693 0.349 1.00 0.00 H new ATOM 0 HB3 LYS B 76 -1.955 -20.248 0.356 1.00 0.00 H new ATOM 0 HG2 LYS B 76 -1.926 -20.325 -2.093 1.00 0.00 H new ATOM 0 HG3 LYS B 76 -1.251 -18.709 -2.169 1.00 0.00 H new ATOM 0 HD2 LYS B 76 0.791 -19.456 -1.032 1.00 0.00 H new ATOM 0 HD3 LYS B 76 0.111 -21.052 -0.783 1.00 0.00 H new ATOM 0 HE2 LYS B 76 1.670 -21.041 -2.689 1.00 0.00 H new ATOM 0 HE3 LYS B 76 0.047 -21.452 -3.205 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 1.180 -19.846 -4.666 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 -0.277 -19.244 -4.033 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 1.207 -18.721 -3.395 1.00 0.00 H new ATOM 1201 N PRO B 77 -4.851 -19.367 1.411 1.00 0.00 N ATOM 1202 CA PRO B 77 -5.525 -19.418 2.709 1.00 0.00 C ATOM 1203 C PRO B 77 -4.669 -20.094 3.774 1.00 0.00 C ATOM 1204 O PRO B 77 -4.296 -21.262 3.642 1.00 0.00 O ATOM 1205 CB PRO B 77 -6.783 -20.241 2.430 1.00 0.00 C ATOM 1206 CG PRO B 77 -6.428 -21.097 1.263 1.00 0.00 C ATOM 1207 CD PRO B 77 -5.450 -20.303 0.440 1.00 0.00 C ATOM 0 HA PRO B 77 -5.735 -18.422 3.099 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -7.060 -20.845 3.294 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -7.634 -19.598 2.205 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -5.986 -22.038 1.591 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -7.314 -21.347 0.680 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -4.695 -20.945 -0.014 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -5.948 -19.773 -0.372 1.00 0.00 H new ATOM 1215 N GLY B 78 -4.354 -19.352 4.823 1.00 0.00 N ATOM 1216 CA GLY B 78 -3.544 -19.893 5.891 1.00 0.00 C ATOM 1217 C GLY B 78 -2.068 -19.648 5.668 1.00 0.00 C ATOM 1218 O GLY B 78 -1.220 -20.336 6.234 1.00 0.00 O ATOM 0 H GLY B 78 -4.646 -18.383 4.954 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -3.846 -19.444 6.837 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -3.724 -20.965 5.974 1.00 0.00 H new ATOM 1222 N VAL B 79 -1.764 -18.678 4.821 1.00 0.00 N ATOM 1223 CA VAL B 79 -0.389 -18.288 4.557 1.00 0.00 C ATOM 1224 C VAL B 79 -0.197 -16.815 4.896 1.00 0.00 C ATOM 1225 O VAL B 79 -0.973 -15.965 4.453 1.00 0.00 O ATOM 1226 CB VAL B 79 -0.004 -18.540 3.081 1.00 0.00 C ATOM 1227 CG1 VAL B 79 1.392 -18.031 2.779 1.00 0.00 C ATOM 1228 CG2 VAL B 79 -0.092 -20.018 2.751 1.00 0.00 C ATOM 0 H VAL B 79 -2.458 -18.142 4.300 1.00 0.00 H new ATOM 0 HA VAL B 79 0.261 -18.898 5.184 1.00 0.00 H new ATOM 0 HB VAL B 79 -0.712 -17.991 2.460 1.00 0.00 H new ATOM 0 HG11 VAL B 79 1.631 -18.224 1.733 1.00 0.00 H new ATOM 0 HG12 VAL B 79 1.438 -16.959 2.970 1.00 0.00 H new ATOM 0 HG13 VAL B 79 2.112 -18.544 3.416 1.00 0.00 H new ATOM 0 HG21 VAL B 79 0.183 -20.175 1.708 1.00 0.00 H new ATOM 0 HG22 VAL B 79 0.590 -20.575 3.393 1.00 0.00 H new ATOM 0 HG23 VAL B 79 -1.112 -20.367 2.914 1.00 0.00 H new ATOM 1238 N VAL B 80 0.812 -16.520 5.701 1.00 0.00 N ATOM 1239 CA VAL B 80 1.080 -15.147 6.104 1.00 0.00 C ATOM 1240 C VAL B 80 1.698 -14.361 4.957 1.00 0.00 C ATOM 1241 O VAL B 80 2.655 -14.809 4.323 1.00 0.00 O ATOM 1242 CB VAL B 80 2.001 -15.084 7.340 1.00 0.00 C ATOM 1243 CG1 VAL B 80 2.179 -13.646 7.808 1.00 0.00 C ATOM 1244 CG2 VAL B 80 1.447 -15.947 8.463 1.00 0.00 C ATOM 0 H VAL B 80 1.457 -17.209 6.087 1.00 0.00 H new ATOM 0 HA VAL B 80 0.124 -14.697 6.372 1.00 0.00 H new ATOM 0 HB VAL B 80 2.979 -15.473 7.057 1.00 0.00 H new ATOM 0 HG11 VAL B 80 2.832 -13.626 8.681 1.00 0.00 H new ATOM 0 HG12 VAL B 80 2.624 -13.055 7.007 1.00 0.00 H new ATOM 0 HG13 VAL B 80 1.208 -13.226 8.072 1.00 0.00 H new ATOM 0 HG21 VAL B 80 2.110 -15.890 9.326 1.00 0.00 H new ATOM 0 HG22 VAL B 80 0.456 -15.589 8.742 1.00 0.00 H new ATOM 0 HG23 VAL B 80 1.377 -16.981 8.126 1.00 0.00 H new ATOM 1254 N TYR B 81 1.137 -13.192 4.687 1.00 0.00 N ATOM 1255 CA TYR B 81 1.601 -12.351 3.597 1.00 0.00 C ATOM 1256 C TYR B 81 2.122 -11.016 4.112 1.00 0.00 C ATOM 1257 O TYR B 81 1.679 -10.519 5.152 1.00 0.00 O ATOM 1258 CB TYR B 81 0.470 -12.092 2.595 1.00 0.00 C ATOM 1259 CG TYR B 81 0.233 -13.217 1.610 1.00 0.00 C ATOM 1260 CD1 TYR B 81 -0.552 -14.313 1.944 1.00 0.00 C ATOM 1261 CD2 TYR B 81 0.786 -13.171 0.338 1.00 0.00 C ATOM 1262 CE1 TYR B 81 -0.776 -15.333 1.037 1.00 0.00 C ATOM 1263 CE2 TYR B 81 0.568 -14.186 -0.574 1.00 0.00 C ATOM 1264 CZ TYR B 81 -0.213 -15.265 -0.220 1.00 0.00 C ATOM 1265 OH TYR B 81 -0.437 -16.274 -1.128 1.00 0.00 O ATOM 0 H TYR B 81 0.354 -12.803 5.213 1.00 0.00 H new ATOM 0 HA TYR B 81 2.414 -12.882 3.102 1.00 0.00 H new ATOM 0 HB2 TYR B 81 -0.452 -11.909 3.147 1.00 0.00 H new ATOM 0 HB3 TYR B 81 0.695 -11.181 2.040 1.00 0.00 H new ATOM 0 HD1 TYR B 81 -0.995 -14.370 2.928 1.00 0.00 H new ATOM 0 HD2 TYR B 81 1.398 -12.327 0.056 1.00 0.00 H new ATOM 0 HE1 TYR B 81 -1.389 -16.179 1.312 1.00 0.00 H new ATOM 0 HE2 TYR B 81 1.007 -14.134 -1.559 1.00 0.00 H new ATOM 0 HH TYR B 81 0.031 -16.071 -1.965 1.00 0.00 H new ATOM 1275 N GLU B 82 3.063 -10.454 3.374 1.00 0.00 N ATOM 1276 CA GLU B 82 3.514 -9.092 3.596 1.00 0.00 C ATOM 1277 C GLU B 82 2.872 -8.202 2.543 1.00 0.00 C ATOM 1278 O GLU B 82 2.801 -8.584 1.374 1.00 0.00 O ATOM 1279 CB GLU B 82 5.035 -8.985 3.465 1.00 0.00 C ATOM 1280 CG GLU B 82 5.818 -9.946 4.340 1.00 0.00 C ATOM 1281 CD GLU B 82 7.313 -9.801 4.142 1.00 0.00 C ATOM 1282 OE1 GLU B 82 7.880 -10.512 3.282 1.00 0.00 O ATOM 1283 OE2 GLU B 82 7.931 -8.965 4.837 1.00 0.00 O ATOM 0 H GLU B 82 3.535 -10.929 2.605 1.00 0.00 H new ATOM 0 HA GLU B 82 3.231 -8.786 4.603 1.00 0.00 H new ATOM 0 HB2 GLU B 82 5.309 -9.158 2.424 1.00 0.00 H new ATOM 0 HB3 GLU B 82 5.336 -7.966 3.709 1.00 0.00 H new ATOM 0 HG2 GLU B 82 5.571 -9.767 5.387 1.00 0.00 H new ATOM 0 HG3 GLU B 82 5.519 -10.969 4.113 1.00 0.00 H new ATOM 1290 N GLY B 83 2.397 -7.037 2.946 1.00 0.00 N ATOM 1291 CA GLY B 83 1.744 -6.151 2.008 1.00 0.00 C ATOM 1292 C GLY B 83 2.289 -4.742 2.063 1.00 0.00 C ATOM 1293 O GLY B 83 2.642 -4.243 3.130 1.00 0.00 O ATOM 0 H GLY B 83 2.451 -6.689 3.903 1.00 0.00 H new ATOM 0 HA2 GLY B 83 1.864 -6.544 0.998 1.00 0.00 H new ATOM 0 HA3 GLY B 83 0.674 -6.131 2.217 1.00 0.00 H new ATOM 1297 N GLN B 84 2.367 -4.104 0.907 1.00 0.00 N ATOM 1298 CA GLN B 84 2.815 -2.724 0.812 1.00 0.00 C ATOM 1299 C GLN B 84 1.892 -1.937 -0.108 1.00 0.00 C ATOM 1300 O GLN B 84 1.694 -2.311 -1.264 1.00 0.00 O ATOM 1301 CB GLN B 84 4.246 -2.645 0.274 1.00 0.00 C ATOM 1302 CG GLN B 84 5.278 -3.367 1.121 1.00 0.00 C ATOM 1303 CD GLN B 84 6.681 -3.196 0.574 1.00 0.00 C ATOM 1304 OE1 GLN B 84 7.393 -2.262 0.937 1.00 0.00 O ATOM 1305 NE2 GLN B 84 7.082 -4.088 -0.316 1.00 0.00 N ATOM 0 H GLN B 84 2.123 -4.526 0.011 1.00 0.00 H new ATOM 0 HA GLN B 84 2.792 -2.296 1.814 1.00 0.00 H new ATOM 0 HB2 GLN B 84 4.265 -3.061 -0.733 1.00 0.00 H new ATOM 0 HB3 GLN B 84 4.532 -1.596 0.191 1.00 0.00 H new ATOM 0 HG2 GLN B 84 5.238 -2.988 2.142 1.00 0.00 H new ATOM 0 HG3 GLN B 84 5.033 -4.428 1.165 1.00 0.00 H new ATOM 0 HE21 GLN B 84 6.461 -4.849 -0.591 1.00 0.00 H new ATOM 0 HE22 GLN B 84 8.012 -4.015 -0.727 1.00 0.00 H new ATOM 1314 N LEU B 85 1.318 -0.866 0.413 1.00 0.00 N ATOM 1315 CA LEU B 85 0.507 0.035 -0.390 1.00 0.00 C ATOM 1316 C LEU B 85 1.331 1.274 -0.721 1.00 0.00 C ATOM 1317 O LEU B 85 1.589 2.105 0.149 1.00 0.00 O ATOM 1318 CB LEU B 85 -0.780 0.408 0.373 1.00 0.00 C ATOM 1319 CG LEU B 85 -1.863 1.174 -0.414 1.00 0.00 C ATOM 1320 CD1 LEU B 85 -1.489 2.634 -0.602 1.00 0.00 C ATOM 1321 CD2 LEU B 85 -2.118 0.520 -1.764 1.00 0.00 C ATOM 0 H LEU B 85 1.399 -0.598 1.394 1.00 0.00 H new ATOM 0 HA LEU B 85 0.212 -0.452 -1.319 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -1.225 -0.510 0.756 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -0.499 1.010 1.237 1.00 0.00 H new ATOM 0 HG LEU B 85 -2.780 1.133 0.174 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -2.275 3.142 -1.161 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -1.372 3.108 0.373 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -0.551 2.701 -1.153 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -2.886 1.079 -2.300 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -1.197 0.518 -2.347 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -2.454 -0.506 -1.614 1.00 0.00 H new ATOM 1333 N ILE B 86 1.768 1.380 -1.966 1.00 0.00 N ATOM 1334 CA ILE B 86 2.575 2.516 -2.388 1.00 0.00 C ATOM 1335 C ILE B 86 1.720 3.505 -3.166 1.00 0.00 C ATOM 1336 O ILE B 86 1.311 3.236 -4.295 1.00 0.00 O ATOM 1337 CB ILE B 86 3.784 2.108 -3.272 1.00 0.00 C ATOM 1338 CG1 ILE B 86 4.593 0.970 -2.636 1.00 0.00 C ATOM 1339 CG2 ILE B 86 4.688 3.310 -3.511 1.00 0.00 C ATOM 1340 CD1 ILE B 86 4.045 -0.414 -2.915 1.00 0.00 C ATOM 0 H ILE B 86 1.579 0.697 -2.700 1.00 0.00 H new ATOM 0 HA ILE B 86 2.964 2.969 -1.476 1.00 0.00 H new ATOM 0 HB ILE B 86 3.390 1.751 -4.224 1.00 0.00 H new ATOM 0 HG12 ILE B 86 5.619 1.022 -2.999 1.00 0.00 H new ATOM 0 HG13 ILE B 86 4.629 1.124 -1.557 1.00 0.00 H new ATOM 0 HG21 ILE B 86 5.533 3.012 -4.132 1.00 0.00 H new ATOM 0 HG22 ILE B 86 4.125 4.094 -4.017 1.00 0.00 H new ATOM 0 HG23 ILE B 86 5.055 3.685 -2.556 1.00 0.00 H new ATOM 0 HD11 ILE B 86 4.675 -1.159 -2.430 1.00 0.00 H new ATOM 0 HD12 ILE B 86 3.029 -0.488 -2.526 1.00 0.00 H new ATOM 0 HD13 ILE B 86 4.036 -0.592 -3.990 1.00 0.00 H new ATOM 1352 N SER B 87 1.434 4.638 -2.553 1.00 0.00 N ATOM 1353 CA SER B 87 0.675 5.682 -3.215 1.00 0.00 C ATOM 1354 C SER B 87 1.611 6.634 -3.945 1.00 0.00 C ATOM 1355 O SER B 87 2.389 7.360 -3.319 1.00 0.00 O ATOM 1356 CB SER B 87 -0.168 6.450 -2.201 1.00 0.00 C ATOM 1357 OG SER B 87 -1.044 5.581 -1.511 1.00 0.00 O ATOM 0 H SER B 87 1.716 4.859 -1.598 1.00 0.00 H new ATOM 0 HA SER B 87 0.010 5.217 -3.943 1.00 0.00 H new ATOM 0 HB2 SER B 87 0.484 6.956 -1.489 1.00 0.00 H new ATOM 0 HB3 SER B 87 -0.743 7.223 -2.711 1.00 0.00 H new ATOM 0 HG SER B 87 -1.775 6.100 -1.115 1.00 0.00 H new ATOM 1363 N ILE B 88 1.551 6.611 -5.267 1.00 0.00 N ATOM 1364 CA ILE B 88 2.353 7.508 -6.078 1.00 0.00 C ATOM 1365 C ILE B 88 1.589 8.797 -6.317 1.00 0.00 C ATOM 1366 O ILE B 88 0.632 8.830 -7.087 1.00 0.00 O ATOM 1367 CB ILE B 88 2.731 6.879 -7.438 1.00 0.00 C ATOM 1368 CG1 ILE B 88 3.459 5.548 -7.232 1.00 0.00 C ATOM 1369 CG2 ILE B 88 3.590 7.842 -8.253 1.00 0.00 C ATOM 1370 CD1 ILE B 88 4.752 5.663 -6.455 1.00 0.00 C ATOM 0 H ILE B 88 0.954 5.979 -5.800 1.00 0.00 H new ATOM 0 HA ILE B 88 3.276 7.708 -5.534 1.00 0.00 H new ATOM 0 HB ILE B 88 1.814 6.684 -7.993 1.00 0.00 H new ATOM 0 HG12 ILE B 88 2.794 4.860 -6.710 1.00 0.00 H new ATOM 0 HG13 ILE B 88 3.671 5.108 -8.206 1.00 0.00 H new ATOM 0 HG21 ILE B 88 3.847 7.382 -9.207 1.00 0.00 H new ATOM 0 HG22 ILE B 88 3.035 8.763 -8.432 1.00 0.00 H new ATOM 0 HG23 ILE B 88 4.503 8.070 -7.703 1.00 0.00 H new ATOM 0 HD11 ILE B 88 5.204 4.677 -6.353 1.00 0.00 H new ATOM 0 HD12 ILE B 88 5.438 6.324 -6.985 1.00 0.00 H new ATOM 0 HD13 ILE B 88 4.547 6.072 -5.466 1.00 0.00 H new ATOM 1382 N GLN B 89 1.994 9.846 -5.628 1.00 0.00 N ATOM 1383 CA GLN B 89 1.349 11.139 -5.759 1.00 0.00 C ATOM 1384 C GLN B 89 1.926 11.915 -6.935 1.00 0.00 C ATOM 1385 O GLN B 89 3.088 11.751 -7.299 1.00 0.00 O ATOM 1386 CB GLN B 89 1.498 11.929 -4.461 1.00 0.00 C ATOM 1387 CG GLN B 89 0.592 11.427 -3.348 1.00 0.00 C ATOM 1388 CD GLN B 89 0.843 12.122 -2.028 1.00 0.00 C ATOM 1389 OE1 GLN B 89 0.288 13.189 -1.765 1.00 0.00 O ATOM 1390 NE2 GLN B 89 1.662 11.515 -1.186 1.00 0.00 N ATOM 0 H GLN B 89 2.771 9.828 -4.968 1.00 0.00 H new ATOM 0 HA GLN B 89 0.288 10.982 -5.953 1.00 0.00 H new ATOM 0 HB2 GLN B 89 2.535 11.877 -4.128 1.00 0.00 H new ATOM 0 HB3 GLN B 89 1.278 12.979 -4.655 1.00 0.00 H new ATOM 0 HG2 GLN B 89 -0.448 11.574 -3.639 1.00 0.00 H new ATOM 0 HG3 GLN B 89 0.739 10.354 -3.222 1.00 0.00 H new ATOM 0 HE21 GLN B 89 2.099 10.631 -1.448 1.00 0.00 H new ATOM 0 HE22 GLN B 89 1.856 11.930 -0.275 1.00 0.00 H new ATOM 1399 N GLN B 90 1.072 12.764 -7.508 1.00 0.00 N ATOM 1400 CA GLN B 90 1.357 13.514 -8.737 1.00 0.00 C ATOM 1401 C GLN B 90 2.661 14.303 -8.652 1.00 0.00 C ATOM 1402 O GLN B 90 3.292 14.582 -9.669 1.00 0.00 O ATOM 1403 CB GLN B 90 0.195 14.472 -9.020 1.00 0.00 C ATOM 1404 CG GLN B 90 0.288 15.186 -10.359 1.00 0.00 C ATOM 1405 CD GLN B 90 -0.729 16.300 -10.489 1.00 0.00 C ATOM 1406 OE1 GLN B 90 -1.854 16.089 -10.943 1.00 0.00 O ATOM 1407 NE2 GLN B 90 -0.338 17.497 -10.083 1.00 0.00 N ATOM 0 H GLN B 90 0.146 12.955 -7.126 1.00 0.00 H new ATOM 0 HA GLN B 90 1.469 12.793 -9.547 1.00 0.00 H new ATOM 0 HB2 GLN B 90 -0.740 13.912 -8.983 1.00 0.00 H new ATOM 0 HB3 GLN B 90 0.152 15.217 -8.226 1.00 0.00 H new ATOM 0 HG2 GLN B 90 1.290 15.596 -10.480 1.00 0.00 H new ATOM 0 HG3 GLN B 90 0.139 14.466 -11.163 1.00 0.00 H new ATOM 0 HE21 GLN B 90 0.604 17.628 -9.713 1.00 0.00 H new ATOM 0 HE22 GLN B 90 -0.978 18.289 -10.140 1.00 0.00 H new ATOM 1416 N TYR B 91 3.061 14.645 -7.435 1.00 0.00 N ATOM 1417 CA TYR B 91 4.256 15.451 -7.211 1.00 0.00 C ATOM 1418 C TYR B 91 5.508 14.575 -7.168 1.00 0.00 C ATOM 1419 O TYR B 91 6.599 15.047 -6.840 1.00 0.00 O ATOM 1420 CB TYR B 91 4.117 16.229 -5.898 1.00 0.00 C ATOM 1421 CG TYR B 91 2.890 17.113 -5.845 1.00 0.00 C ATOM 1422 CD1 TYR B 91 1.644 16.587 -5.522 1.00 0.00 C ATOM 1423 CD2 TYR B 91 2.976 18.469 -6.125 1.00 0.00 C ATOM 1424 CE1 TYR B 91 0.521 17.389 -5.483 1.00 0.00 C ATOM 1425 CE2 TYR B 91 1.856 19.278 -6.085 1.00 0.00 C ATOM 1426 CZ TYR B 91 0.632 18.731 -5.766 1.00 0.00 C ATOM 1427 OH TYR B 91 -0.486 19.530 -5.734 1.00 0.00 O ATOM 0 H TYR B 91 2.572 14.375 -6.581 1.00 0.00 H new ATOM 0 HA TYR B 91 4.359 16.151 -8.040 1.00 0.00 H new ATOM 0 HB2 TYR B 91 4.082 15.523 -5.069 1.00 0.00 H new ATOM 0 HB3 TYR B 91 5.005 16.845 -5.755 1.00 0.00 H new ATOM 0 HD1 TYR B 91 1.553 15.534 -5.298 1.00 0.00 H new ATOM 0 HD2 TYR B 91 3.934 18.899 -6.378 1.00 0.00 H new ATOM 0 HE1 TYR B 91 -0.440 16.965 -5.232 1.00 0.00 H new ATOM 0 HE2 TYR B 91 1.940 20.333 -6.302 1.00 0.00 H new ATOM 0 HH TYR B 91 -1.117 19.184 -5.068 1.00 0.00 H new ATOM 1437 N GLY B 92 5.340 13.298 -7.493 1.00 0.00 N ATOM 1438 CA GLY B 92 6.443 12.358 -7.440 1.00 0.00 C ATOM 1439 C GLY B 92 6.702 11.894 -6.026 1.00 0.00 C ATOM 1440 O GLY B 92 7.750 11.321 -5.725 1.00 0.00 O ATOM 0 H GLY B 92 4.453 12.895 -7.794 1.00 0.00 H new ATOM 0 HA2 GLY B 92 6.221 11.498 -8.072 1.00 0.00 H new ATOM 0 HA3 GLY B 92 7.342 12.826 -7.842 1.00 0.00 H new ATOM 1444 N HIS B 93 5.737 12.149 -5.160 1.00 0.00 N ATOM 1445 CA HIS B 93 5.855 11.817 -3.752 1.00 0.00 C ATOM 1446 C HIS B 93 5.328 10.406 -3.507 1.00 0.00 C ATOM 1447 O HIS B 93 4.170 10.109 -3.805 1.00 0.00 O ATOM 1448 CB HIS B 93 5.081 12.844 -2.917 1.00 0.00 C ATOM 1449 CG HIS B 93 5.306 12.729 -1.444 1.00 0.00 C ATOM 1450 ND1 HIS B 93 6.085 13.610 -0.729 1.00 0.00 N ATOM 1451 CD2 HIS B 93 4.839 11.834 -0.552 1.00 0.00 C ATOM 1452 CE1 HIS B 93 6.087 13.255 0.540 1.00 0.00 C ATOM 1453 NE2 HIS B 93 5.338 12.180 0.674 1.00 0.00 N ATOM 0 H HIS B 93 4.853 12.590 -5.412 1.00 0.00 H new ATOM 0 HA HIS B 93 6.903 11.846 -3.454 1.00 0.00 H new ATOM 0 HB2 HIS B 93 5.364 13.846 -3.240 1.00 0.00 H new ATOM 0 HB3 HIS B 93 4.016 12.733 -3.121 1.00 0.00 H new ATOM 0 HD2 HIS B 93 4.190 10.997 -0.765 1.00 0.00 H new ATOM 0 HE1 HIS B 93 6.614 13.760 1.336 1.00 0.00 H new ATOM 0 HE2 HIS B 93 5.159 11.686 1.548 1.00 0.00 H new ATOM 1462 N GLN B 94 6.179 9.541 -2.974 1.00 0.00 N ATOM 1463 CA GLN B 94 5.814 8.148 -2.753 1.00 0.00 C ATOM 1464 C GLN B 94 5.593 7.870 -1.274 1.00 0.00 C ATOM 1465 O GLN B 94 6.487 8.085 -0.457 1.00 0.00 O ATOM 1466 CB GLN B 94 6.915 7.223 -3.273 1.00 0.00 C ATOM 1467 CG GLN B 94 7.283 7.462 -4.725 1.00 0.00 C ATOM 1468 CD GLN B 94 8.398 6.552 -5.198 1.00 0.00 C ATOM 1469 OE1 GLN B 94 9.257 6.138 -4.419 1.00 0.00 O ATOM 1470 NE2 GLN B 94 8.395 6.235 -6.481 1.00 0.00 N ATOM 0 H GLN B 94 7.128 9.779 -2.686 1.00 0.00 H new ATOM 0 HA GLN B 94 4.886 7.959 -3.293 1.00 0.00 H new ATOM 0 HB2 GLN B 94 7.805 7.351 -2.657 1.00 0.00 H new ATOM 0 HB3 GLN B 94 6.592 6.188 -3.156 1.00 0.00 H new ATOM 0 HG2 GLN B 94 6.403 7.308 -5.350 1.00 0.00 H new ATOM 0 HG3 GLN B 94 7.587 8.501 -4.853 1.00 0.00 H new ATOM 0 HE21 GLN B 94 7.666 6.598 -7.094 1.00 0.00 H new ATOM 0 HE22 GLN B 94 9.122 5.627 -6.858 1.00 0.00 H new ATOM 1479 N GLU B 95 4.405 7.397 -0.934 1.00 0.00 N ATOM 1480 CA GLU B 95 4.121 6.966 0.426 1.00 0.00 C ATOM 1481 C GLU B 95 3.845 5.472 0.455 1.00 0.00 C ATOM 1482 O GLU B 95 2.902 4.993 -0.176 1.00 0.00 O ATOM 1483 CB GLU B 95 2.937 7.732 1.018 1.00 0.00 C ATOM 1484 CG GLU B 95 3.264 9.173 1.365 1.00 0.00 C ATOM 1485 CD GLU B 95 4.486 9.289 2.254 1.00 0.00 C ATOM 1486 OE1 GLU B 95 4.414 8.896 3.433 1.00 0.00 O ATOM 1487 OE2 GLU B 95 5.534 9.771 1.779 1.00 0.00 O ATOM 0 H GLU B 95 3.622 7.302 -1.580 1.00 0.00 H new ATOM 0 HA GLU B 95 4.998 7.181 1.036 1.00 0.00 H new ATOM 0 HB2 GLU B 95 2.111 7.716 0.307 1.00 0.00 H new ATOM 0 HB3 GLU B 95 2.594 7.219 1.916 1.00 0.00 H new ATOM 0 HG2 GLU B 95 3.431 9.736 0.447 1.00 0.00 H new ATOM 0 HG3 GLU B 95 2.409 9.626 1.866 1.00 0.00 H new ATOM 1494 N VAL B 96 4.683 4.740 1.170 1.00 0.00 N ATOM 1495 CA VAL B 96 4.549 3.298 1.264 1.00 0.00 C ATOM 1496 C VAL B 96 3.986 2.905 2.623 1.00 0.00 C ATOM 1497 O VAL B 96 4.624 3.115 3.657 1.00 0.00 O ATOM 1498 CB VAL B 96 5.906 2.590 1.053 1.00 0.00 C ATOM 1499 CG1 VAL B 96 5.740 1.078 1.098 1.00 0.00 C ATOM 1500 CG2 VAL B 96 6.544 3.029 -0.258 1.00 0.00 C ATOM 0 H VAL B 96 5.467 5.125 1.696 1.00 0.00 H new ATOM 0 HA VAL B 96 3.865 2.982 0.477 1.00 0.00 H new ATOM 0 HB VAL B 96 6.571 2.879 1.866 1.00 0.00 H new ATOM 0 HG11 VAL B 96 6.708 0.601 0.947 1.00 0.00 H new ATOM 0 HG12 VAL B 96 5.338 0.785 2.068 1.00 0.00 H new ATOM 0 HG13 VAL B 96 5.054 0.764 0.311 1.00 0.00 H new ATOM 0 HG21 VAL B 96 7.498 2.519 -0.387 1.00 0.00 H new ATOM 0 HG22 VAL B 96 5.883 2.777 -1.087 1.00 0.00 H new ATOM 0 HG23 VAL B 96 6.708 4.106 -0.240 1.00 0.00 H new ATOM 1510 N THR B 97 2.781 2.368 2.625 1.00 0.00 N ATOM 1511 CA THR B 97 2.168 1.886 3.847 1.00 0.00 C ATOM 1512 C THR B 97 2.276 0.367 3.923 1.00 0.00 C ATOM 1513 O THR B 97 1.647 -0.353 3.145 1.00 0.00 O ATOM 1514 CB THR B 97 0.691 2.314 3.938 1.00 0.00 C ATOM 1515 OG1 THR B 97 0.584 3.733 3.751 1.00 0.00 O ATOM 1516 CG2 THR B 97 0.099 1.938 5.288 1.00 0.00 C ATOM 0 H THR B 97 2.206 2.254 1.790 1.00 0.00 H new ATOM 0 HA THR B 97 2.701 2.328 4.689 1.00 0.00 H new ATOM 0 HB THR B 97 0.137 1.795 3.156 1.00 0.00 H new ATOM 0 HG1 THR B 97 -0.081 4.096 4.372 1.00 0.00 H new ATOM 0 HG21 THR B 97 -0.944 2.251 5.328 1.00 0.00 H new ATOM 0 HG22 THR B 97 0.160 0.858 5.424 1.00 0.00 H new ATOM 0 HG23 THR B 97 0.657 2.435 6.081 1.00 0.00 H new ATOM 1524 N ARG B 98 3.093 -0.111 4.847 1.00 0.00 N ATOM 1525 CA ARG B 98 3.341 -1.538 4.982 1.00 0.00 C ATOM 1526 C ARG B 98 2.336 -2.175 5.931 1.00 0.00 C ATOM 1527 O ARG B 98 2.149 -1.715 7.055 1.00 0.00 O ATOM 1528 CB ARG B 98 4.762 -1.781 5.488 1.00 0.00 C ATOM 1529 CG ARG B 98 5.837 -1.218 4.573 1.00 0.00 C ATOM 1530 CD ARG B 98 7.230 -1.477 5.123 1.00 0.00 C ATOM 1531 NE ARG B 98 7.478 -2.901 5.344 1.00 0.00 N ATOM 1532 CZ ARG B 98 8.556 -3.549 4.903 1.00 0.00 C ATOM 1533 NH1 ARG B 98 9.498 -2.903 4.220 1.00 0.00 N ATOM 1534 NH2 ARG B 98 8.696 -4.846 5.155 1.00 0.00 N ATOM 0 H ARG B 98 3.597 0.470 5.517 1.00 0.00 H new ATOM 0 HA ARG B 98 3.228 -1.998 4.000 1.00 0.00 H new ATOM 0 HB2 ARG B 98 4.868 -1.335 6.477 1.00 0.00 H new ATOM 0 HB3 ARG B 98 4.920 -2.853 5.603 1.00 0.00 H new ATOM 0 HG2 ARG B 98 5.746 -1.667 3.584 1.00 0.00 H new ATOM 0 HG3 ARG B 98 5.687 -0.145 4.451 1.00 0.00 H new ATOM 0 HD2 ARG B 98 7.972 -1.084 4.429 1.00 0.00 H new ATOM 0 HD3 ARG B 98 7.355 -0.938 6.062 1.00 0.00 H new ATOM 0 HE ARG B 98 6.782 -3.432 5.868 1.00 0.00 H new ATOM 0 HH11 ARG B 98 9.398 -1.906 4.031 1.00 0.00 H new ATOM 0 HH12 ARG B 98 10.320 -3.405 3.886 1.00 0.00 H new ATOM 0 HH21 ARG B 98 7.980 -5.343 5.685 1.00 0.00 H new ATOM 0 HH22 ARG B 98 9.520 -5.345 4.819 1.00 0.00 H new ATOM 1548 N PHE B 99 1.703 -3.240 5.473 1.00 0.00 N ATOM 1549 CA PHE B 99 0.706 -3.947 6.262 1.00 0.00 C ATOM 1550 C PHE B 99 0.916 -5.451 6.141 1.00 0.00 C ATOM 1551 O PHE B 99 1.817 -5.903 5.430 1.00 0.00 O ATOM 1552 CB PHE B 99 -0.713 -3.558 5.815 1.00 0.00 C ATOM 1553 CG PHE B 99 -1.022 -3.853 4.370 1.00 0.00 C ATOM 1554 CD1 PHE B 99 -1.668 -5.026 4.010 1.00 0.00 C ATOM 1555 CD2 PHE B 99 -0.678 -2.951 3.374 1.00 0.00 C ATOM 1556 CE1 PHE B 99 -1.963 -5.294 2.687 1.00 0.00 C ATOM 1557 CE2 PHE B 99 -0.969 -3.216 2.049 1.00 0.00 C ATOM 1558 CZ PHE B 99 -1.612 -4.388 1.706 1.00 0.00 C ATOM 0 H PHE B 99 1.863 -3.639 4.548 1.00 0.00 H new ATOM 0 HA PHE B 99 0.820 -3.662 7.308 1.00 0.00 H new ATOM 0 HB2 PHE B 99 -1.433 -4.084 6.441 1.00 0.00 H new ATOM 0 HB3 PHE B 99 -0.856 -2.492 5.992 1.00 0.00 H new ATOM 0 HD1 PHE B 99 -1.944 -5.739 4.773 1.00 0.00 H new ATOM 0 HD2 PHE B 99 -0.177 -2.031 3.637 1.00 0.00 H new ATOM 0 HE1 PHE B 99 -2.468 -6.211 2.421 1.00 0.00 H new ATOM 0 HE2 PHE B 99 -0.693 -2.507 1.283 1.00 0.00 H new ATOM 0 HZ PHE B 99 -1.840 -4.596 0.671 1.00 0.00 H new ATOM 1568 N ASP B 100 0.096 -6.224 6.835 1.00 0.00 N ATOM 1569 CA ASP B 100 0.221 -7.677 6.820 1.00 0.00 C ATOM 1570 C ASP B 100 -1.144 -8.346 6.752 1.00 0.00 C ATOM 1571 O ASP B 100 -2.163 -7.743 7.097 1.00 0.00 O ATOM 1572 CB ASP B 100 0.997 -8.175 8.047 1.00 0.00 C ATOM 1573 CG ASP B 100 0.561 -7.511 9.340 1.00 0.00 C ATOM 1574 OD1 ASP B 100 -0.500 -7.876 9.888 1.00 0.00 O ATOM 1575 OD2 ASP B 100 1.295 -6.623 9.823 1.00 0.00 O ATOM 0 H ASP B 100 -0.664 -5.872 7.417 1.00 0.00 H new ATOM 0 HA ASP B 100 0.780 -7.949 5.924 1.00 0.00 H new ATOM 0 HB2 ASP B 100 0.867 -9.253 8.138 1.00 0.00 H new ATOM 0 HB3 ASP B 100 2.061 -7.994 7.894 1.00 0.00 H new ATOM 1580 N PHE B 101 -1.152 -9.591 6.293 1.00 0.00 N ATOM 1581 CA PHE B 101 -2.381 -10.357 6.143 1.00 0.00 C ATOM 1582 C PHE B 101 -2.190 -11.780 6.676 1.00 0.00 C ATOM 1583 O PHE B 101 -1.081 -12.321 6.633 1.00 0.00 O ATOM 1584 CB PHE B 101 -2.816 -10.371 4.667 1.00 0.00 C ATOM 1585 CG PHE B 101 -3.934 -11.330 4.360 1.00 0.00 C ATOM 1586 CD1 PHE B 101 -5.165 -11.208 4.983 1.00 0.00 C ATOM 1587 CD2 PHE B 101 -3.747 -12.356 3.448 1.00 0.00 C ATOM 1588 CE1 PHE B 101 -6.187 -12.094 4.706 1.00 0.00 C ATOM 1589 CE2 PHE B 101 -4.768 -13.244 3.165 1.00 0.00 C ATOM 1590 CZ PHE B 101 -5.989 -13.114 3.796 1.00 0.00 C ATOM 0 H PHE B 101 -0.310 -10.096 6.015 1.00 0.00 H new ATOM 0 HA PHE B 101 -3.170 -9.883 6.727 1.00 0.00 H new ATOM 0 HB2 PHE B 101 -3.127 -9.366 4.382 1.00 0.00 H new ATOM 0 HB3 PHE B 101 -1.955 -10.625 4.049 1.00 0.00 H new ATOM 0 HD1 PHE B 101 -5.327 -10.411 5.693 1.00 0.00 H new ATOM 0 HD2 PHE B 101 -2.793 -12.463 2.953 1.00 0.00 H new ATOM 0 HE1 PHE B 101 -7.141 -11.989 5.201 1.00 0.00 H new ATOM 0 HE2 PHE B 101 -4.611 -14.039 2.451 1.00 0.00 H new ATOM 0 HZ PHE B 101 -6.787 -13.808 3.579 1.00 0.00 H new ATOM 1600 N THR B 102 -3.283 -12.359 7.181 1.00 0.00 N ATOM 1601 CA THR B 102 -3.279 -13.684 7.802 1.00 0.00 C ATOM 1602 C THR B 102 -2.545 -13.629 9.141 1.00 0.00 C ATOM 1603 O THR B 102 -1.904 -14.590 9.570 1.00 0.00 O ATOM 1604 CB THR B 102 -2.644 -14.762 6.893 1.00 0.00 C ATOM 1605 OG1 THR B 102 -3.033 -14.560 5.528 1.00 0.00 O ATOM 1606 CG2 THR B 102 -3.075 -16.159 7.321 1.00 0.00 C ATOM 0 H THR B 102 -4.202 -11.917 7.170 1.00 0.00 H new ATOM 0 HA THR B 102 -4.319 -13.970 7.961 1.00 0.00 H new ATOM 0 HB THR B 102 -1.562 -14.673 6.987 1.00 0.00 H new ATOM 0 HG1 THR B 102 -2.350 -14.937 4.934 1.00 0.00 H new ATOM 0 HG21 THR B 102 -2.615 -16.899 6.666 1.00 0.00 H new ATOM 0 HG22 THR B 102 -2.759 -16.338 8.349 1.00 0.00 H new ATOM 0 HG23 THR B 102 -4.160 -16.241 7.255 1.00 0.00 H new ATOM 1614 N THR B 103 -2.644 -12.483 9.793 1.00 0.00 N ATOM 1615 CA THR B 103 -2.008 -12.276 11.081 1.00 0.00 C ATOM 1616 C THR B 103 -3.042 -12.216 12.200 1.00 0.00 C ATOM 1617 O THR B 103 -2.805 -12.699 13.310 1.00 0.00 O ATOM 1618 CB THR B 103 -1.178 -10.985 11.065 1.00 0.00 C ATOM 1619 OG1 THR B 103 -1.934 -9.937 10.440 1.00 0.00 O ATOM 1620 CG2 THR B 103 0.132 -11.191 10.318 1.00 0.00 C ATOM 0 H THR B 103 -3.163 -11.676 9.447 1.00 0.00 H new ATOM 0 HA THR B 103 -1.348 -13.123 11.269 1.00 0.00 H new ATOM 0 HB THR B 103 -0.946 -10.708 12.093 1.00 0.00 H new ATOM 0 HG1 THR B 103 -1.415 -9.106 10.454 1.00 0.00 H new ATOM 0 HG21 THR B 103 0.702 -10.262 10.320 1.00 0.00 H new ATOM 0 HG22 THR B 103 0.711 -11.974 10.808 1.00 0.00 H new ATOM 0 HG23 THR B 103 -0.078 -11.485 9.290 1.00 0.00 H new ATOM 1628 N THR B 104 -4.193 -11.626 11.903 1.00 0.00 N ATOM 1629 CA THR B 104 -5.275 -11.539 12.866 1.00 0.00 C ATOM 1630 C THR B 104 -6.043 -12.860 12.916 1.00 0.00 C ATOM 1631 O THR B 104 -7.138 -12.986 12.367 1.00 0.00 O ATOM 1632 CB THR B 104 -6.234 -10.382 12.516 1.00 0.00 C ATOM 1633 OG1 THR B 104 -5.477 -9.194 12.242 1.00 0.00 O ATOM 1634 CG2 THR B 104 -7.199 -10.108 13.661 1.00 0.00 C ATOM 0 H THR B 104 -4.398 -11.200 10.999 1.00 0.00 H new ATOM 0 HA THR B 104 -4.843 -11.340 13.847 1.00 0.00 H new ATOM 0 HB THR B 104 -6.809 -10.670 11.636 1.00 0.00 H new ATOM 0 HG1 THR B 104 -6.088 -8.461 12.018 1.00 0.00 H new ATOM 0 HG21 THR B 104 -7.864 -9.288 13.388 1.00 0.00 H new ATOM 0 HG22 THR B 104 -7.789 -11.002 13.861 1.00 0.00 H new ATOM 0 HG23 THR B 104 -6.636 -9.837 14.554 1.00 0.00 H new ATOM 1642 N SER B 105 -5.441 -13.851 13.553 1.00 0.00 N ATOM 1643 CA SER B 105 -6.051 -15.160 13.681 1.00 0.00 C ATOM 1644 C SER B 105 -6.719 -15.301 15.044 1.00 0.00 C ATOM 1645 O SER B 105 -6.064 -15.629 16.037 1.00 0.00 O ATOM 1646 CB SER B 105 -4.985 -16.239 13.499 1.00 0.00 C ATOM 1647 OG SER B 105 -4.194 -15.971 12.352 1.00 0.00 O ATOM 0 H SER B 105 -4.524 -13.770 13.992 1.00 0.00 H new ATOM 0 HA SER B 105 -6.814 -15.277 12.911 1.00 0.00 H new ATOM 0 HB2 SER B 105 -4.350 -16.283 14.384 1.00 0.00 H new ATOM 0 HB3 SER B 105 -5.461 -17.215 13.400 1.00 0.00 H new ATOM 0 HG SER B 105 -3.515 -16.671 12.252 1.00 0.00 H new ATOM 1653 N THR B 106 -8.017 -15.039 15.090 1.00 0.00 N ATOM 1654 CA THR B 106 -8.776 -15.116 16.329 1.00 0.00 C ATOM 1655 C THR B 106 -9.108 -16.571 16.671 1.00 0.00 C ATOM 1656 O THR B 106 -10.270 -16.948 16.831 1.00 0.00 O ATOM 1657 CB THR B 106 -10.075 -14.295 16.222 1.00 0.00 C ATOM 1658 OG1 THR B 106 -9.814 -13.080 15.506 1.00 0.00 O ATOM 1659 CG2 THR B 106 -10.625 -13.956 17.600 1.00 0.00 C ATOM 0 H THR B 106 -8.570 -14.769 14.276 1.00 0.00 H new ATOM 0 HA THR B 106 -8.161 -14.699 17.126 1.00 0.00 H new ATOM 0 HB THR B 106 -10.815 -14.894 15.692 1.00 0.00 H new ATOM 0 HG1 THR B 106 -10.640 -12.558 15.436 1.00 0.00 H new ATOM 0 HG21 THR B 106 -11.542 -13.376 17.493 1.00 0.00 H new ATOM 0 HG22 THR B 106 -10.839 -14.877 18.143 1.00 0.00 H new ATOM 0 HG23 THR B 106 -9.889 -13.372 18.152 1.00 0.00 H new ATOM 1667 N SER B 107 -8.070 -17.384 16.790 1.00 0.00 N ATOM 1668 CA SER B 107 -8.228 -18.800 17.062 1.00 0.00 C ATOM 1669 C SER B 107 -8.288 -19.054 18.565 1.00 0.00 C ATOM 1670 O SER B 107 -7.496 -19.822 19.105 1.00 0.00 O ATOM 1671 CB SER B 107 -7.062 -19.570 16.443 1.00 0.00 C ATOM 1672 OG SER B 107 -6.862 -19.184 15.092 1.00 0.00 O ATOM 0 H SER B 107 -7.100 -17.081 16.701 1.00 0.00 H new ATOM 0 HA SER B 107 -9.164 -19.144 16.621 1.00 0.00 H new ATOM 0 HB2 SER B 107 -6.154 -19.386 17.017 1.00 0.00 H new ATOM 0 HB3 SER B 107 -7.260 -20.641 16.494 1.00 0.00 H new ATOM 0 HG SER B 107 -6.110 -19.688 14.716 1.00 0.00 H new ATOM 1678 N THR B 108 -9.223 -18.394 19.234 1.00 0.00 N ATOM 1679 CA THR B 108 -9.381 -18.546 20.671 1.00 0.00 C ATOM 1680 C THR B 108 -9.958 -19.924 20.999 1.00 0.00 C ATOM 1681 O THR B 108 -11.080 -20.238 20.605 1.00 0.00 O ATOM 1682 CB THR B 108 -10.304 -17.452 21.241 1.00 0.00 C ATOM 1683 OG1 THR B 108 -9.887 -16.164 20.767 1.00 0.00 O ATOM 1684 CG2 THR B 108 -10.277 -17.462 22.761 1.00 0.00 C ATOM 0 H THR B 108 -9.884 -17.748 18.803 1.00 0.00 H new ATOM 0 HA THR B 108 -8.397 -18.448 21.129 1.00 0.00 H new ATOM 0 HB THR B 108 -11.321 -17.655 20.905 1.00 0.00 H new ATOM 0 HG1 THR B 108 -10.479 -15.474 21.132 1.00 0.00 H new ATOM 0 HG21 THR B 108 -10.936 -16.682 23.142 1.00 0.00 H new ATOM 0 HG22 THR B 108 -10.616 -18.432 23.125 1.00 0.00 H new ATOM 0 HG23 THR B 108 -9.260 -17.280 23.108 1.00 0.00 H new ATOM 1692 N PRO B 109 -9.197 -20.763 21.723 1.00 0.00 N ATOM 1693 CA PRO B 109 -9.613 -22.131 22.057 1.00 0.00 C ATOM 1694 C PRO B 109 -10.625 -22.184 23.203 1.00 0.00 C ATOM 1695 O PRO B 109 -10.415 -22.880 24.200 1.00 0.00 O ATOM 1696 CB PRO B 109 -8.301 -22.793 22.470 1.00 0.00 C ATOM 1697 CG PRO B 109 -7.479 -21.684 23.030 1.00 0.00 C ATOM 1698 CD PRO B 109 -7.860 -20.447 22.262 1.00 0.00 C ATOM 0 HA PRO B 109 -10.119 -22.618 21.224 1.00 0.00 H new ATOM 0 HB2 PRO B 109 -8.468 -23.575 23.210 1.00 0.00 H new ATOM 0 HB3 PRO B 109 -7.808 -23.261 21.618 1.00 0.00 H new ATOM 0 HG2 PRO B 109 -7.673 -21.556 24.095 1.00 0.00 H new ATOM 0 HG3 PRO B 109 -6.415 -21.896 22.923 1.00 0.00 H new ATOM 0 HD2 PRO B 109 -7.886 -19.569 22.907 1.00 0.00 H new ATOM 0 HD3 PRO B 109 -7.147 -20.236 21.465 1.00 0.00 H new ATOM 1706 N GLY B 110 -11.725 -21.455 23.048 1.00 0.00 N ATOM 1707 CA GLY B 110 -12.746 -21.411 24.078 1.00 0.00 C ATOM 1708 C GLY B 110 -12.203 -20.911 25.401 1.00 0.00 C ATOM 1709 O GLY B 110 -12.211 -21.637 26.397 1.00 0.00 O ATOM 0 H GLY B 110 -11.928 -20.891 22.223 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -13.560 -20.763 23.753 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -13.167 -22.407 24.213 1.00 0.00 H new ATOM 1713 N SER B 111 -11.727 -19.676 25.415 1.00 0.00 N ATOM 1714 CA SER B 111 -11.134 -19.108 26.613 1.00 0.00 C ATOM 1715 C SER B 111 -12.224 -18.545 27.519 1.00 0.00 C ATOM 1716 O SER B 111 -12.486 -17.340 27.532 1.00 0.00 O ATOM 1717 CB SER B 111 -10.120 -18.021 26.247 1.00 0.00 C ATOM 1718 OG SER B 111 -9.388 -17.592 27.384 1.00 0.00 O ATOM 0 H SER B 111 -11.740 -19.049 24.611 1.00 0.00 H new ATOM 0 HA SER B 111 -10.607 -19.896 27.151 1.00 0.00 H new ATOM 0 HB2 SER B 111 -9.432 -18.402 25.492 1.00 0.00 H new ATOM 0 HB3 SER B 111 -10.639 -17.171 25.805 1.00 0.00 H new ATOM 0 HG SER B 111 -8.748 -16.899 27.119 1.00 0.00 H new ATOM 1724 N ARG B 112 -12.861 -19.431 28.265 1.00 0.00 N ATOM 1725 CA ARG B 112 -13.934 -19.044 29.160 1.00 0.00 C ATOM 1726 C ARG B 112 -13.379 -18.554 30.489 1.00 0.00 C ATOM 1727 O ARG B 112 -12.855 -19.333 31.286 1.00 0.00 O ATOM 1728 CB ARG B 112 -14.887 -20.214 29.399 1.00 0.00 C ATOM 1729 CG ARG B 112 -15.971 -19.902 30.418 1.00 0.00 C ATOM 1730 CD ARG B 112 -16.837 -21.111 30.698 1.00 0.00 C ATOM 1731 NE ARG B 112 -17.805 -20.849 31.762 1.00 0.00 N ATOM 1732 CZ ARG B 112 -18.705 -21.737 32.176 1.00 0.00 C ATOM 1733 NH1 ARG B 112 -18.770 -22.931 31.600 1.00 0.00 N ATOM 1734 NH2 ARG B 112 -19.542 -21.429 33.159 1.00 0.00 N ATOM 0 H ARG B 112 -12.651 -20.429 28.267 1.00 0.00 H new ATOM 0 HA ARG B 112 -14.485 -18.231 28.688 1.00 0.00 H new ATOM 0 HB2 ARG B 112 -15.354 -20.493 28.455 1.00 0.00 H new ATOM 0 HB3 ARG B 112 -14.315 -21.077 29.739 1.00 0.00 H new ATOM 0 HG2 ARG B 112 -15.512 -19.560 31.345 1.00 0.00 H new ATOM 0 HG3 ARG B 112 -16.593 -19.086 30.050 1.00 0.00 H new ATOM 0 HD2 ARG B 112 -17.365 -21.399 29.789 1.00 0.00 H new ATOM 0 HD3 ARG B 112 -16.205 -21.953 30.980 1.00 0.00 H new ATOM 0 HE ARG B 112 -17.789 -19.934 32.212 1.00 0.00 H new ATOM 0 HH11 ARG B 112 -18.130 -23.167 30.841 1.00 0.00 H new ATOM 0 HH12 ARG B 112 -19.459 -23.613 31.916 1.00 0.00 H new ATOM 0 HH21 ARG B 112 -19.496 -20.510 33.599 1.00 0.00 H new ATOM 0 HH22 ARG B 112 -20.231 -22.112 33.475 1.00 0.00 H new ATOM 1748 N SER B 113 -13.489 -17.259 30.716 1.00 0.00 N ATOM 1749 CA SER B 113 -13.093 -16.673 31.982 1.00 0.00 C ATOM 1750 C SER B 113 -14.330 -16.307 32.795 1.00 0.00 C ATOM 1751 O SER B 113 -14.246 -16.014 33.989 1.00 0.00 O ATOM 1752 CB SER B 113 -12.231 -15.438 31.731 1.00 0.00 C ATOM 1753 OG SER B 113 -11.120 -15.758 30.908 1.00 0.00 O ATOM 0 H SER B 113 -13.851 -16.590 30.036 1.00 0.00 H new ATOM 0 HA SER B 113 -12.509 -17.398 32.549 1.00 0.00 H new ATOM 0 HB2 SER B 113 -12.830 -14.661 31.255 1.00 0.00 H new ATOM 0 HB3 SER B 113 -11.881 -15.034 32.681 1.00 0.00 H new ATOM 0 HG SER B 113 -10.582 -14.953 30.758 1.00 0.00 H new ATOM 1759 N HIS B 114 -15.481 -16.343 32.134 1.00 0.00 N ATOM 1760 CA HIS B 114 -16.741 -15.972 32.760 1.00 0.00 C ATOM 1761 C HIS B 114 -17.262 -17.096 33.651 1.00 0.00 C ATOM 1762 O HIS B 114 -17.678 -18.149 33.160 1.00 0.00 O ATOM 1763 CB HIS B 114 -17.784 -15.626 31.688 1.00 0.00 C ATOM 1764 CG HIS B 114 -19.063 -15.070 32.237 1.00 0.00 C ATOM 1765 ND1 HIS B 114 -20.166 -15.845 32.522 1.00 0.00 N ATOM 1766 CD2 HIS B 114 -19.413 -13.799 32.545 1.00 0.00 C ATOM 1767 CE1 HIS B 114 -21.135 -15.078 32.982 1.00 0.00 C ATOM 1768 NE2 HIS B 114 -20.706 -13.833 33.007 1.00 0.00 N ATOM 0 H HIS B 114 -15.566 -16.628 31.158 1.00 0.00 H new ATOM 0 HA HIS B 114 -16.564 -15.095 33.383 1.00 0.00 H new ATOM 0 HB2 HIS B 114 -17.353 -14.902 30.997 1.00 0.00 H new ATOM 0 HB3 HIS B 114 -18.008 -16.523 31.111 1.00 0.00 H new ATOM 0 HD2 HIS B 114 -18.791 -12.922 32.446 1.00 0.00 H new ATOM 0 HE1 HIS B 114 -22.115 -15.414 33.287 1.00 0.00 H new ATOM 0 HE2 HIS B 114 -21.246 -13.026 33.319 1.00 0.00 H new ATOM 1777 N HIS B 115 -17.218 -16.872 34.957 1.00 0.00 N ATOM 1778 CA HIS B 115 -17.815 -17.792 35.919 1.00 0.00 C ATOM 1779 C HIS B 115 -18.343 -17.013 37.122 1.00 0.00 C ATOM 1780 O HIS B 115 -18.410 -17.525 38.242 1.00 0.00 O ATOM 1781 CB HIS B 115 -16.823 -18.889 36.351 1.00 0.00 C ATOM 1782 CG HIS B 115 -15.560 -18.391 36.987 1.00 0.00 C ATOM 1783 ND1 HIS B 115 -14.391 -18.194 36.282 1.00 0.00 N ATOM 1784 CD2 HIS B 115 -15.279 -18.069 38.271 1.00 0.00 C ATOM 1785 CE1 HIS B 115 -13.449 -17.774 37.107 1.00 0.00 C ATOM 1786 NE2 HIS B 115 -13.963 -17.692 38.317 1.00 0.00 N ATOM 0 H HIS B 115 -16.773 -16.057 35.378 1.00 0.00 H new ATOM 0 HA HIS B 115 -18.651 -18.299 35.436 1.00 0.00 H new ATOM 0 HB2 HIS B 115 -17.326 -19.556 37.052 1.00 0.00 H new ATOM 0 HB3 HIS B 115 -16.561 -19.484 35.477 1.00 0.00 H new ATOM 0 HD2 HIS B 115 -15.965 -18.103 39.105 1.00 0.00 H new ATOM 0 HE1 HIS B 115 -12.431 -17.538 36.836 1.00 0.00 H new ATOM 0 HE2 HIS B 115 -13.461 -17.395 39.154 1.00 0.00 H new ATOM 1795 N HIS B 116 -18.706 -15.763 36.871 1.00 0.00 N ATOM 1796 CA HIS B 116 -19.324 -14.918 37.879 1.00 0.00 C ATOM 1797 C HIS B 116 -20.510 -14.189 37.265 1.00 0.00 C ATOM 1798 O HIS B 116 -20.355 -13.440 36.302 1.00 0.00 O ATOM 1799 CB HIS B 116 -18.317 -13.905 38.437 1.00 0.00 C ATOM 1800 CG HIS B 116 -18.855 -13.076 39.564 1.00 0.00 C ATOM 1801 ND1 HIS B 116 -18.795 -13.470 40.880 1.00 0.00 N ATOM 1802 CD2 HIS B 116 -19.474 -11.870 39.565 1.00 0.00 C ATOM 1803 CE1 HIS B 116 -19.354 -12.549 41.641 1.00 0.00 C ATOM 1804 NE2 HIS B 116 -19.774 -11.566 40.869 1.00 0.00 N ATOM 0 H HIS B 116 -18.580 -15.309 35.966 1.00 0.00 H new ATOM 0 HA HIS B 116 -19.664 -15.545 38.703 1.00 0.00 H new ATOM 0 HB2 HIS B 116 -17.431 -14.439 38.782 1.00 0.00 H new ATOM 0 HB3 HIS B 116 -17.997 -13.243 37.632 1.00 0.00 H new ATOM 0 HD2 HIS B 116 -19.691 -11.261 38.700 1.00 0.00 H new ATOM 0 HE1 HIS B 116 -19.451 -12.593 42.716 1.00 0.00 H new ATOM 0 HE2 HIS B 116 -20.244 -10.719 41.188 1.00 0.00 H new ATOM 1813 N HIS B 117 -21.688 -14.411 37.818 1.00 0.00 N ATOM 1814 CA HIS B 117 -22.894 -13.787 37.298 1.00 0.00 C ATOM 1815 C HIS B 117 -23.030 -12.366 37.821 1.00 0.00 C ATOM 1816 O HIS B 117 -23.063 -12.140 39.032 1.00 0.00 O ATOM 1817 CB HIS B 117 -24.134 -14.605 37.670 1.00 0.00 C ATOM 1818 CG HIS B 117 -24.246 -15.899 36.928 1.00 0.00 C ATOM 1819 ND1 HIS B 117 -24.131 -17.129 37.536 1.00 0.00 N ATOM 1820 CD2 HIS B 117 -24.473 -16.151 35.617 1.00 0.00 C ATOM 1821 CE1 HIS B 117 -24.282 -18.081 36.634 1.00 0.00 C ATOM 1822 NE2 HIS B 117 -24.491 -17.514 35.462 1.00 0.00 N ATOM 0 H HIS B 117 -21.837 -15.017 38.625 1.00 0.00 H new ATOM 0 HA HIS B 117 -22.814 -13.754 36.211 1.00 0.00 H new ATOM 0 HB2 HIS B 117 -24.115 -14.811 38.740 1.00 0.00 H new ATOM 0 HB3 HIS B 117 -25.024 -14.007 37.476 1.00 0.00 H new ATOM 0 HD2 HIS B 117 -24.614 -15.416 34.838 1.00 0.00 H new ATOM 0 HE1 HIS B 117 -24.241 -19.143 36.824 1.00 0.00 H new ATOM 0 HE2 HIS B 117 -24.642 -18.009 34.583 1.00 0.00 H new ATOM 1831 N HIS B 118 -23.081 -11.409 36.905 1.00 0.00 N ATOM 1832 CA HIS B 118 -23.264 -10.014 37.278 1.00 0.00 C ATOM 1833 C HIS B 118 -24.730 -9.744 37.600 1.00 0.00 C ATOM 1834 O HIS B 118 -25.604 -10.527 37.222 1.00 0.00 O ATOM 1835 CB HIS B 118 -22.775 -9.071 36.165 1.00 0.00 C ATOM 1836 CG HIS B 118 -23.571 -9.135 34.892 1.00 0.00 C ATOM 1837 ND1 HIS B 118 -23.188 -9.880 33.800 1.00 0.00 N ATOM 1838 CD2 HIS B 118 -24.729 -8.526 34.539 1.00 0.00 C ATOM 1839 CE1 HIS B 118 -24.072 -9.726 32.833 1.00 0.00 C ATOM 1840 NE2 HIS B 118 -25.017 -8.911 33.256 1.00 0.00 N ATOM 0 H HIS B 118 -22.999 -11.572 35.902 1.00 0.00 H new ATOM 0 HA HIS B 118 -22.665 -9.819 38.167 1.00 0.00 H new ATOM 0 HB2 HIS B 118 -22.796 -8.048 36.540 1.00 0.00 H new ATOM 0 HB3 HIS B 118 -21.735 -9.306 35.939 1.00 0.00 H new ATOM 0 HD2 HIS B 118 -25.316 -7.861 35.155 1.00 0.00 H new ATOM 0 HE1 HIS B 118 -24.028 -10.190 31.859 1.00 0.00 H new ATOM 0 HE2 HIS B 118 -25.830 -8.615 32.716 1.00 0.00 H new ATOM 1849 N HIS B 119 -24.985 -8.630 38.281 1.00 0.00 N ATOM 1850 CA HIS B 119 -26.334 -8.245 38.689 1.00 0.00 C ATOM 1851 C HIS B 119 -26.891 -9.259 39.685 1.00 0.00 C ATOM 1852 O HIS B 119 -27.622 -10.180 39.268 1.00 0.00 O ATOM 1853 CB HIS B 119 -27.260 -8.096 37.471 1.00 0.00 C ATOM 1854 CG HIS B 119 -28.635 -7.598 37.804 1.00 0.00 C ATOM 1855 ND1 HIS B 119 -28.897 -6.288 38.148 1.00 0.00 N ATOM 1856 CD2 HIS B 119 -29.829 -8.238 37.838 1.00 0.00 C ATOM 1857 CE1 HIS B 119 -30.188 -6.145 38.381 1.00 0.00 C ATOM 1858 NE2 HIS B 119 -30.775 -7.312 38.200 1.00 0.00 N ATOM 1859 OXT HIS B 119 -26.579 -9.132 40.887 1.00 0.00 O ATOM 0 H HIS B 119 -24.263 -7.968 38.566 1.00 0.00 H new ATOM 0 HA HIS B 119 -26.283 -7.273 39.179 1.00 0.00 H new ATOM 0 HB2 HIS B 119 -26.799 -7.410 36.760 1.00 0.00 H new ATOM 0 HB3 HIS B 119 -27.346 -9.062 36.973 1.00 0.00 H new ATOM 0 HD2 HIS B 119 -30.003 -9.281 37.621 1.00 0.00 H new ATOM 0 HE1 HIS B 119 -30.680 -5.228 38.671 1.00 0.00 H new ATOM 0 HE2 HIS B 119 -31.772 -7.497 38.311 1.00 0.00 H new TER 1868 HIS B 119