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 113 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 115 HIS : no HD1:sc= -0.325 X(o=-0.33,f=-0.22) USER MOD Set 2.1: B 53 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Set 2.2: B 54 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 38 GLN : amide:sc= -0.357 X(o=-0.72,f=-0.64) USER MOD Set 3.2: B 41 HIS : no HD1:sc= -0.362 K(o=-0.72,f=0.0095) USER MOD Single : A 1 GLY N :NH3+ -156:sc= 1.29 (180deg=1.09) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.0554 K(o=-0.055,f=-0.59) USER MOD Single : A 21 THR OG1 : rot -81:sc= 0.82 USER MOD Single : A 22 SER OG : rot 81:sc= 0.229 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : B 31 MET CE :methyl 161:sc= -0.0809 (180deg=-0.545) USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 35 ASN : amide:sc= -1.15 K(o=-1.1,f=-2.7) USER MOD Single : B 40 SER OG : rot -127:sc= 1.23 USER MOD Single : B 43 SER OG : rot 180: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= 0.976 USER MOD Single : B 52 LYS NZ :NH3+ 154:sc= 1.23 (180deg=0.486) USER MOD Single : B 59 LYS NZ :NH3+ 169:sc= -0.0347 (180deg=-0.186) USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 66 HIS : no HD1:sc= -0.0673 X(o=-0.067,f=-0.013) USER MOD Single : B 68 ASN : amide:sc= -0.656 K(o=-0.66,f=-7.8!) 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+ 180:sc= 0 (180deg=0) USER MOD Single : B 76 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0486) USER MOD Single : B 81 TYR OH : rot 120:sc= 0.261 USER MOD Single : B 84 GLN : amide:sc= -0.826 K(o=-0.83,f=-6.8!) USER MOD Single : B 87 SER OG : rot -140:sc= 0 USER MOD Single : B 89 GLN : amide:sc= -3.55! C(o=-3.5!,f=-2.2!) USER MOD Single : B 90 GLN : amide:sc= -1.1 K(o=-1.1,f=0) USER MOD Single : B 91 TYR OH : rot 180:sc= 0 USER MOD Single : B 93 HIS : no HD1:sc= -0.0163 X(o=-0.016,f=0) USER MOD Single : B 94 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : B 97 THR OG1 : rot -164:sc= 1.22 USER MOD Single : B 102 THR OG1 : rot 180:sc= 0 USER MOD Single : B 103 THR OG1 : rot 180:sc= -0.374 USER MOD Single : B 104 THR OG1 : rot -21:sc= 0.73 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 34:sc= 0.116 USER MOD Single : B 111 SER OG : rot 180:sc= 0 USER MOD Single : B 114 HIS : no HE2:sc= -0.0108 K(o=-0.011,f=-0.82) USER MOD Single : B 116 HIS : no HD1:sc= 0 X(o=0,f=-0.016) USER MOD Single : B 117 HIS : no HD1:sc= 0 X(o=0,f=-0.21) USER MOD Single : B 118 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 119 HIS : no HD1:sc= 0 X(o=0,f=-0.18) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -7.046 14.721 6.719 1.00 0.00 N ATOM 2 CA GLY A 1 -6.053 15.082 7.760 1.00 0.00 C ATOM 3 C GLY A 1 -5.979 14.041 8.855 1.00 0.00 C ATOM 4 O GLY A 1 -6.314 12.878 8.634 1.00 0.00 O ATOM 0 H1 GLY A 1 -6.801 15.195 5.826 1.00 0.00 H new ATOM 0 H2 GLY A 1 -7.041 13.691 6.577 1.00 0.00 H new ATOM 0 H3 GLY A 1 -7.993 15.024 7.023 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -5.071 15.196 7.301 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -6.316 16.047 8.194 1.00 0.00 H new ATOM 10 N SER A 2 -5.545 14.453 10.035 1.00 0.00 N ATOM 11 CA SER A 2 -5.429 13.549 11.165 1.00 0.00 C ATOM 12 C SER A 2 -5.733 14.285 12.468 1.00 0.00 C ATOM 13 O SER A 2 -6.659 13.920 13.197 1.00 0.00 O ATOM 14 CB SER A 2 -4.027 12.935 11.201 1.00 0.00 C ATOM 15 OG SER A 2 -3.857 12.086 12.322 1.00 0.00 O ATOM 0 H SER A 2 -5.266 15.414 10.235 1.00 0.00 H new ATOM 0 HA SER A 2 -6.157 12.745 11.053 1.00 0.00 H new ATOM 0 HB2 SER A 2 -3.854 12.369 10.286 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.282 13.730 11.230 1.00 0.00 H new ATOM 0 HG SER A 2 -2.952 11.710 12.313 1.00 0.00 H new ATOM 21 N GLN A 3 -4.963 15.330 12.747 1.00 0.00 N ATOM 22 CA GLN A 3 -5.148 16.132 13.953 1.00 0.00 C ATOM 23 C GLN A 3 -4.318 17.408 13.862 1.00 0.00 C ATOM 24 O GLN A 3 -4.855 18.504 13.714 1.00 0.00 O ATOM 25 CB GLN A 3 -4.754 15.338 15.203 1.00 0.00 C ATOM 26 CG GLN A 3 -5.032 16.073 16.506 1.00 0.00 C ATOM 27 CD GLN A 3 -4.622 15.277 17.730 1.00 0.00 C ATOM 28 OE1 GLN A 3 -4.628 14.046 17.716 1.00 0.00 O ATOM 29 NE2 GLN A 3 -4.268 15.973 18.799 1.00 0.00 N ATOM 0 H GLN A 3 -4.198 15.645 12.150 1.00 0.00 H new ATOM 0 HA GLN A 3 -6.203 16.394 14.032 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -5.295 14.392 15.207 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -3.692 15.098 15.151 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -4.499 17.024 16.502 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -6.096 16.303 16.568 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -4.277 16.993 18.770 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -3.987 15.490 19.652 1.00 0.00 H new ATOM 38 N THR A 4 -3.003 17.255 13.939 1.00 0.00 N ATOM 39 CA THR A 4 -2.095 18.385 13.831 1.00 0.00 C ATOM 40 C THR A 4 -1.167 18.212 12.634 1.00 0.00 C ATOM 41 O THR A 4 -0.291 19.037 12.376 1.00 0.00 O ATOM 42 CB THR A 4 -1.261 18.553 15.116 1.00 0.00 C ATOM 43 OG1 THR A 4 -0.761 17.278 15.541 1.00 0.00 O ATOM 44 CG2 THR A 4 -2.092 19.171 16.230 1.00 0.00 C ATOM 0 H THR A 4 -2.542 16.356 14.076 1.00 0.00 H new ATOM 0 HA THR A 4 -2.698 19.282 13.690 1.00 0.00 H new ATOM 0 HB THR A 4 -0.428 19.220 14.896 1.00 0.00 H new ATOM 0 HG1 THR A 4 -0.230 17.390 16.357 1.00 0.00 H new ATOM 0 HG21 THR A 4 -1.479 19.278 17.125 1.00 0.00 H new ATOM 0 HG22 THR A 4 -2.450 20.151 15.916 1.00 0.00 H new ATOM 0 HG23 THR A 4 -2.944 18.527 16.449 1.00 0.00 H new ATOM 52 N THR A 5 -1.372 17.127 11.906 1.00 0.00 N ATOM 53 CA THR A 5 -0.592 16.833 10.721 1.00 0.00 C ATOM 54 C THR A 5 -1.484 16.221 9.649 1.00 0.00 C ATOM 55 O THR A 5 -2.269 15.316 9.931 1.00 0.00 O ATOM 56 CB THR A 5 0.571 15.871 11.048 1.00 0.00 C ATOM 57 OG1 THR A 5 1.447 16.482 12.006 1.00 0.00 O ATOM 58 CG2 THR A 5 1.359 15.503 9.797 1.00 0.00 C ATOM 0 H THR A 5 -2.083 16.428 12.121 1.00 0.00 H new ATOM 0 HA THR A 5 -0.170 17.767 10.351 1.00 0.00 H new ATOM 0 HB THR A 5 0.146 14.956 11.462 1.00 0.00 H new ATOM 0 HG1 THR A 5 2.183 15.869 12.213 1.00 0.00 H new ATOM 0 HG21 THR A 5 2.170 14.825 10.064 1.00 0.00 H new ATOM 0 HG22 THR A 5 0.698 15.014 9.081 1.00 0.00 H new ATOM 0 HG23 THR A 5 1.774 16.406 9.350 1.00 0.00 H new ATOM 66 N ALA A 6 -1.379 16.734 8.433 1.00 0.00 N ATOM 67 CA ALA A 6 -2.160 16.226 7.320 1.00 0.00 C ATOM 68 C ALA A 6 -1.276 15.408 6.387 1.00 0.00 C ATOM 69 O ALA A 6 -0.603 15.961 5.516 1.00 0.00 O ATOM 70 CB ALA A 6 -2.815 17.373 6.568 1.00 0.00 C ATOM 0 H ALA A 6 -0.757 17.506 8.193 1.00 0.00 H new ATOM 0 HA ALA A 6 -2.945 15.578 7.709 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -3.397 16.977 5.736 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -3.472 17.922 7.242 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -2.046 18.044 6.186 1.00 0.00 H new ATOM 76 N PRO A 7 -1.254 14.079 6.564 1.00 0.00 N ATOM 77 CA PRO A 7 -0.421 13.187 5.760 1.00 0.00 C ATOM 78 C PRO A 7 -0.962 13.028 4.347 1.00 0.00 C ATOM 79 O PRO A 7 -2.156 13.204 4.105 1.00 0.00 O ATOM 80 CB PRO A 7 -0.489 11.842 6.503 1.00 0.00 C ATOM 81 CG PRO A 7 -1.201 12.117 7.788 1.00 0.00 C ATOM 82 CD PRO A 7 -2.043 13.334 7.550 1.00 0.00 C ATOM 0 HA PRO A 7 0.593 13.572 5.651 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -1.023 11.097 5.913 1.00 0.00 H new ATOM 0 HB3 PRO A 7 0.510 11.447 6.687 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -1.819 11.268 8.080 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -0.491 12.288 8.597 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -3.031 13.076 7.168 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -2.195 13.907 8.465 1.00 0.00 H new ATOM 90 N ASP A 8 -0.079 12.713 3.415 1.00 0.00 N ATOM 91 CA ASP A 8 -0.481 12.460 2.038 1.00 0.00 C ATOM 92 C ASP A 8 -0.514 10.962 1.786 1.00 0.00 C ATOM 93 O ASP A 8 -0.857 10.504 0.696 1.00 0.00 O ATOM 94 CB ASP A 8 0.481 13.130 1.051 1.00 0.00 C ATOM 95 CG ASP A 8 0.567 14.633 1.222 1.00 0.00 C ATOM 96 OD1 ASP A 8 -0.386 15.340 0.832 1.00 0.00 O ATOM 97 OD2 ASP A 8 1.598 15.118 1.733 1.00 0.00 O ATOM 0 H ASP A 8 0.923 12.626 3.585 1.00 0.00 H new ATOM 0 HA ASP A 8 -1.474 12.882 1.885 1.00 0.00 H new ATOM 0 HB2 ASP A 8 1.475 12.700 1.175 1.00 0.00 H new ATOM 0 HB3 ASP A 8 0.161 12.905 0.034 1.00 0.00 H new ATOM 102 N ALA A 9 -0.147 10.206 2.813 1.00 0.00 N ATOM 103 CA ALA A 9 -0.100 8.757 2.731 1.00 0.00 C ATOM 104 C ALA A 9 -1.329 8.133 3.372 1.00 0.00 C ATOM 105 O ALA A 9 -1.668 8.453 4.515 1.00 0.00 O ATOM 106 CB ALA A 9 1.150 8.240 3.418 1.00 0.00 C ATOM 0 H ALA A 9 0.125 10.581 3.722 1.00 0.00 H new ATOM 0 HA ALA A 9 -0.081 8.478 1.678 1.00 0.00 H new ATOM 0 HB1 ALA A 9 1.178 7.152 3.352 1.00 0.00 H new ATOM 0 HB2 ALA A 9 2.032 8.656 2.930 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.140 8.540 4.466 1.00 0.00 H new ATOM 112 N PRO A 10 -2.017 7.243 2.640 1.00 0.00 N ATOM 113 CA PRO A 10 -3.145 6.480 3.181 1.00 0.00 C ATOM 114 C PRO A 10 -2.732 5.665 4.403 1.00 0.00 C ATOM 115 O PRO A 10 -1.749 4.920 4.355 1.00 0.00 O ATOM 116 CB PRO A 10 -3.538 5.547 2.028 1.00 0.00 C ATOM 117 CG PRO A 10 -3.009 6.205 0.802 1.00 0.00 C ATOM 118 CD PRO A 10 -1.757 6.917 1.227 1.00 0.00 C ATOM 0 HA PRO A 10 -3.959 7.125 3.513 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -3.108 4.554 2.160 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -4.619 5.421 1.973 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -2.797 5.471 0.025 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -3.736 6.905 0.389 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -0.877 6.284 1.115 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -1.582 7.814 0.633 1.00 0.00 H new ATOM 126 N PRO A 11 -3.454 5.831 5.525 1.00 0.00 N ATOM 127 CA PRO A 11 -3.205 5.075 6.759 1.00 0.00 C ATOM 128 C PRO A 11 -3.313 3.564 6.555 1.00 0.00 C ATOM 129 O PRO A 11 -3.697 3.106 5.477 1.00 0.00 O ATOM 130 CB PRO A 11 -4.300 5.561 7.712 1.00 0.00 C ATOM 131 CG PRO A 11 -4.724 6.882 7.171 1.00 0.00 C ATOM 132 CD PRO A 11 -4.554 6.794 5.683 1.00 0.00 C ATOM 0 HA PRO A 11 -2.194 5.240 7.131 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -5.135 4.861 7.743 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -3.924 5.654 8.731 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -5.760 7.097 7.433 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -4.117 7.687 7.586 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -5.465 6.448 5.194 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -4.306 7.762 5.248 1.00 0.00 H new ATOM 140 N ASP A 12 -3.002 2.811 7.612 1.00 0.00 N ATOM 141 CA ASP A 12 -2.930 1.344 7.558 1.00 0.00 C ATOM 142 C ASP A 12 -4.103 0.733 6.796 1.00 0.00 C ATOM 143 O ASP A 12 -5.257 0.842 7.219 1.00 0.00 O ATOM 144 CB ASP A 12 -2.897 0.759 8.973 1.00 0.00 C ATOM 145 CG ASP A 12 -1.617 1.080 9.710 1.00 0.00 C ATOM 146 OD1 ASP A 12 -0.698 0.231 9.720 1.00 0.00 O ATOM 147 OD2 ASP A 12 -1.518 2.185 10.280 1.00 0.00 O ATOM 0 H ASP A 12 -2.792 3.199 8.532 1.00 0.00 H new ATOM 0 HA ASP A 12 -2.012 1.095 7.026 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -3.744 1.145 9.540 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -3.017 -0.323 8.917 1.00 0.00 H new ATOM 152 N PRO A 13 -3.819 0.089 5.651 1.00 0.00 N ATOM 153 CA PRO A 13 -4.823 -0.625 4.876 1.00 0.00 C ATOM 154 C PRO A 13 -5.158 -1.972 5.502 1.00 0.00 C ATOM 155 O PRO A 13 -4.305 -2.858 5.599 1.00 0.00 O ATOM 156 CB PRO A 13 -4.165 -0.829 3.501 1.00 0.00 C ATOM 157 CG PRO A 13 -2.873 -0.077 3.549 1.00 0.00 C ATOM 158 CD PRO A 13 -2.507 0.033 5.000 1.00 0.00 C ATOM 0 HA PRO A 13 -5.762 -0.074 4.824 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -3.994 -1.887 3.303 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -4.805 -0.455 2.702 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -2.097 -0.600 2.990 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -2.980 0.910 3.098 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -1.922 -0.823 5.338 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -1.914 0.925 5.203 1.00 0.00 H new ATOM 166 N THR A 14 -6.392 -2.117 5.939 1.00 0.00 N ATOM 167 CA THR A 14 -6.851 -3.366 6.515 1.00 0.00 C ATOM 168 C THR A 14 -7.739 -4.080 5.510 1.00 0.00 C ATOM 169 O THR A 14 -8.556 -3.449 4.837 1.00 0.00 O ATOM 170 CB THR A 14 -7.630 -3.119 7.813 1.00 0.00 C ATOM 171 OG1 THR A 14 -6.959 -2.110 8.584 1.00 0.00 O ATOM 172 CG2 THR A 14 -7.736 -4.395 8.635 1.00 0.00 C ATOM 0 H THR A 14 -7.099 -1.382 5.906 1.00 0.00 H new ATOM 0 HA THR A 14 -5.984 -3.983 6.752 1.00 0.00 H new ATOM 0 HB THR A 14 -8.637 -2.789 7.556 1.00 0.00 H new ATOM 0 HG1 THR A 14 -7.455 -1.948 9.414 1.00 0.00 H new ATOM 0 HG21 THR A 14 -8.293 -4.193 9.550 1.00 0.00 H new ATOM 0 HG22 THR A 14 -8.255 -5.159 8.056 1.00 0.00 H new ATOM 0 HG23 THR A 14 -6.737 -4.748 8.889 1.00 0.00 H new ATOM 180 N VAL A 15 -7.572 -5.383 5.384 1.00 0.00 N ATOM 181 CA VAL A 15 -8.281 -6.115 4.365 1.00 0.00 C ATOM 182 C VAL A 15 -9.534 -6.784 4.927 1.00 0.00 C ATOM 183 O VAL A 15 -9.557 -7.243 6.073 1.00 0.00 O ATOM 184 CB VAL A 15 -7.356 -7.141 3.677 1.00 0.00 C ATOM 185 CG1 VAL A 15 -5.940 -6.591 3.554 1.00 0.00 C ATOM 186 CG2 VAL A 15 -7.352 -8.467 4.402 1.00 0.00 C ATOM 0 H VAL A 15 -6.957 -5.947 5.971 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.607 -5.400 3.609 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.750 -7.317 2.676 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.304 -7.330 3.066 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.955 -5.677 2.961 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -5.547 -6.373 4.547 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -6.689 -9.162 3.886 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -7.002 -8.322 5.424 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -8.363 -8.875 4.419 1.00 0.00 H new ATOM 196 N ASP A 16 -10.581 -6.806 4.117 1.00 0.00 N ATOM 197 CA ASP A 16 -11.860 -7.372 4.518 1.00 0.00 C ATOM 198 C ASP A 16 -12.306 -8.437 3.534 1.00 0.00 C ATOM 199 O ASP A 16 -11.732 -8.569 2.451 1.00 0.00 O ATOM 200 CB ASP A 16 -12.945 -6.292 4.589 1.00 0.00 C ATOM 201 CG ASP A 16 -12.726 -5.289 5.701 1.00 0.00 C ATOM 202 OD1 ASP A 16 -12.667 -4.075 5.413 1.00 0.00 O ATOM 203 OD2 ASP A 16 -12.631 -5.705 6.873 1.00 0.00 O ATOM 0 H ASP A 16 -10.569 -6.434 3.167 1.00 0.00 H new ATOM 0 HA ASP A 16 -11.722 -7.813 5.505 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -12.984 -5.764 3.636 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -13.914 -6.771 4.728 1.00 0.00 H new ATOM 208 N GLN A 17 -13.330 -9.187 3.933 1.00 0.00 N ATOM 209 CA GLN A 17 -14.005 -10.144 3.058 1.00 0.00 C ATOM 210 C GLN A 17 -13.025 -11.137 2.437 1.00 0.00 C ATOM 211 O GLN A 17 -12.688 -11.043 1.254 1.00 0.00 O ATOM 212 CB GLN A 17 -14.778 -9.403 1.961 1.00 0.00 C ATOM 213 CG GLN A 17 -15.736 -8.345 2.492 1.00 0.00 C ATOM 214 CD GLN A 17 -16.747 -8.902 3.476 1.00 0.00 C ATOM 215 OE1 GLN A 17 -17.145 -10.066 3.394 1.00 0.00 O ATOM 216 NE2 GLN A 17 -17.177 -8.070 4.412 1.00 0.00 N ATOM 0 H GLN A 17 -13.717 -9.149 4.876 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.705 -10.714 3.670 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -14.066 -8.929 1.285 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -15.341 -10.128 1.374 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -15.163 -7.554 2.976 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -16.265 -7.889 1.655 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -16.823 -7.114 4.446 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -17.862 -8.385 5.099 1.00 0.00 H new ATOM 225 N VAL A 18 -12.577 -12.089 3.237 1.00 0.00 N ATOM 226 CA VAL A 18 -11.639 -13.099 2.771 1.00 0.00 C ATOM 227 C VAL A 18 -12.381 -14.262 2.117 1.00 0.00 C ATOM 228 O VAL A 18 -13.258 -14.880 2.729 1.00 0.00 O ATOM 229 CB VAL A 18 -10.760 -13.624 3.925 1.00 0.00 C ATOM 230 CG1 VAL A 18 -9.747 -14.642 3.420 1.00 0.00 C ATOM 231 CG2 VAL A 18 -10.057 -12.471 4.624 1.00 0.00 C ATOM 0 H VAL A 18 -12.848 -12.185 4.216 1.00 0.00 H new ATOM 0 HA VAL A 18 -10.991 -12.628 2.032 1.00 0.00 H new ATOM 0 HB VAL A 18 -11.408 -14.123 4.645 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -9.140 -14.996 4.254 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -10.272 -15.485 2.969 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -9.103 -14.175 2.675 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -9.441 -12.859 5.435 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -9.426 -11.943 3.909 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -10.800 -11.784 5.029 1.00 0.00 H new ATOM 241 N ASP A 19 -12.034 -14.541 0.868 1.00 0.00 N ATOM 242 CA ASP A 19 -12.641 -15.632 0.113 1.00 0.00 C ATOM 243 C ASP A 19 -11.760 -16.871 0.182 1.00 0.00 C ATOM 244 O ASP A 19 -10.913 -16.991 1.068 1.00 0.00 O ATOM 245 CB ASP A 19 -12.834 -15.241 -1.356 1.00 0.00 C ATOM 246 CG ASP A 19 -13.669 -13.996 -1.542 1.00 0.00 C ATOM 247 OD1 ASP A 19 -14.862 -14.012 -1.174 1.00 0.00 O ATOM 248 OD2 ASP A 19 -13.139 -12.998 -2.078 1.00 0.00 O ATOM 0 H ASP A 19 -11.326 -14.020 0.350 1.00 0.00 H new ATOM 0 HA ASP A 19 -13.614 -15.843 0.556 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -11.857 -15.086 -1.814 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -13.306 -16.069 -1.885 1.00 0.00 H new ATOM 253 N ASP A 20 -11.965 -17.790 -0.756 1.00 0.00 N ATOM 254 CA ASP A 20 -11.131 -18.981 -0.866 1.00 0.00 C ATOM 255 C ASP A 20 -9.676 -18.597 -1.094 1.00 0.00 C ATOM 256 O ASP A 20 -8.782 -19.093 -0.413 1.00 0.00 O ATOM 257 CB ASP A 20 -11.611 -19.873 -2.015 1.00 0.00 C ATOM 258 CG ASP A 20 -10.684 -21.048 -2.267 1.00 0.00 C ATOM 259 OD1 ASP A 20 -10.861 -22.105 -1.623 1.00 0.00 O ATOM 260 OD2 ASP A 20 -9.772 -20.920 -3.112 1.00 0.00 O ATOM 0 H ASP A 20 -12.706 -17.732 -1.455 1.00 0.00 H new ATOM 0 HA ASP A 20 -11.211 -19.534 0.070 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -12.610 -20.245 -1.788 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -11.691 -19.277 -2.924 1.00 0.00 H new ATOM 265 N THR A 21 -9.448 -17.715 -2.057 1.00 0.00 N ATOM 266 CA THR A 21 -8.103 -17.276 -2.390 1.00 0.00 C ATOM 267 C THR A 21 -8.078 -15.813 -2.833 1.00 0.00 C ATOM 268 O THR A 21 -7.325 -15.442 -3.731 1.00 0.00 O ATOM 269 CB THR A 21 -7.489 -18.161 -3.495 1.00 0.00 C ATOM 270 OG1 THR A 21 -8.523 -18.650 -4.363 1.00 0.00 O ATOM 271 CG2 THR A 21 -6.722 -19.333 -2.901 1.00 0.00 C ATOM 0 H THR A 21 -10.182 -17.289 -2.623 1.00 0.00 H new ATOM 0 HA THR A 21 -7.506 -17.371 -1.483 1.00 0.00 H new ATOM 0 HB THR A 21 -6.790 -17.550 -4.066 1.00 0.00 H new ATOM 0 HG1 THR A 21 -8.957 -19.425 -3.950 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.302 -19.937 -3.705 1.00 0.00 H new ATOM 0 HG22 THR A 21 -5.917 -18.958 -2.269 1.00 0.00 H new ATOM 0 HG23 THR A 21 -7.398 -19.944 -2.303 1.00 0.00 H new ATOM 279 N SER A 22 -8.893 -14.980 -2.199 1.00 0.00 N ATOM 280 CA SER A 22 -8.927 -13.562 -2.526 1.00 0.00 C ATOM 281 C SER A 22 -9.393 -12.731 -1.335 1.00 0.00 C ATOM 282 O SER A 22 -10.109 -13.225 -0.465 1.00 0.00 O ATOM 283 CB SER A 22 -9.826 -13.314 -3.742 1.00 0.00 C ATOM 284 OG SER A 22 -11.079 -13.967 -3.609 1.00 0.00 O ATOM 0 H SER A 22 -9.536 -15.261 -1.459 1.00 0.00 H new ATOM 0 HA SER A 22 -7.912 -13.250 -2.774 1.00 0.00 H new ATOM 0 HB2 SER A 22 -9.985 -12.243 -3.865 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.325 -13.667 -4.643 1.00 0.00 H new ATOM 0 HG SER A 22 -11.670 -13.429 -3.041 1.00 0.00 H new ATOM 290 N ILE A 23 -8.963 -11.475 -1.299 1.00 0.00 N ATOM 291 CA ILE A 23 -9.335 -10.548 -0.233 1.00 0.00 C ATOM 292 C ILE A 23 -9.704 -9.196 -0.828 1.00 0.00 C ATOM 293 O ILE A 23 -9.423 -8.930 -1.998 1.00 0.00 O ATOM 294 CB ILE A 23 -8.174 -10.309 0.761 1.00 0.00 C ATOM 295 CG1 ILE A 23 -7.040 -9.563 0.052 1.00 0.00 C ATOM 296 CG2 ILE A 23 -7.675 -11.625 1.339 1.00 0.00 C ATOM 297 CD1 ILE A 23 -6.013 -8.962 0.982 1.00 0.00 C ATOM 0 H ILE A 23 -8.348 -11.070 -2.005 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.176 -10.998 0.294 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.537 -9.701 1.590 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.538 -10.251 -0.628 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.470 -8.768 -0.558 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.859 -11.431 2.035 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -8.489 -12.123 1.865 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -7.319 -12.265 0.532 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.247 -8.453 0.398 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.498 -8.247 1.646 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.552 -9.752 1.575 1.00 0.00 H new ATOM 309 N VAL A 24 -10.317 -8.344 -0.023 1.00 0.00 N ATOM 310 CA VAL A 24 -10.527 -6.960 -0.406 1.00 0.00 C ATOM 311 C VAL A 24 -9.711 -6.056 0.509 1.00 0.00 C ATOM 312 O VAL A 24 -10.067 -5.849 1.668 1.00 0.00 O ATOM 313 CB VAL A 24 -12.015 -6.556 -0.326 1.00 0.00 C ATOM 314 CG1 VAL A 24 -12.221 -5.140 -0.845 1.00 0.00 C ATOM 315 CG2 VAL A 24 -12.886 -7.539 -1.093 1.00 0.00 C ATOM 0 H VAL A 24 -10.677 -8.588 0.900 1.00 0.00 H new ATOM 0 HA VAL A 24 -10.207 -6.849 -1.442 1.00 0.00 H new ATOM 0 HB VAL A 24 -12.314 -6.582 0.722 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -13.277 -4.878 -0.779 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -11.636 -4.444 -0.244 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -11.898 -5.083 -1.884 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -13.930 -7.233 -1.022 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -12.583 -7.554 -2.140 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.771 -8.536 -0.668 1.00 0.00 H new ATOM 325 N VAL A 25 -8.619 -5.522 -0.008 1.00 0.00 N ATOM 326 CA VAL A 25 -7.752 -4.662 0.782 1.00 0.00 C ATOM 327 C VAL A 25 -8.194 -3.210 0.651 1.00 0.00 C ATOM 328 O VAL A 25 -8.321 -2.681 -0.455 1.00 0.00 O ATOM 329 CB VAL A 25 -6.258 -4.833 0.398 1.00 0.00 C ATOM 330 CG1 VAL A 25 -6.082 -4.904 -1.105 1.00 0.00 C ATOM 331 CG2 VAL A 25 -5.400 -3.720 0.982 1.00 0.00 C ATOM 0 H VAL A 25 -8.311 -5.667 -0.969 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.843 -4.962 1.826 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.922 -5.777 0.827 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.025 -5.024 -1.342 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.640 -5.754 -1.497 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.454 -3.985 -1.559 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.360 -3.872 0.693 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.745 -2.758 0.603 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.480 -3.732 2.069 1.00 0.00 H new ATOM 341 N ARG A 26 -8.461 -2.590 1.791 1.00 0.00 N ATOM 342 CA ARG A 26 -9.027 -1.253 1.827 1.00 0.00 C ATOM 343 C ARG A 26 -8.127 -0.312 2.616 1.00 0.00 C ATOM 344 O ARG A 26 -7.718 -0.625 3.734 1.00 0.00 O ATOM 345 CB ARG A 26 -10.412 -1.302 2.472 1.00 0.00 C ATOM 346 CG ARG A 26 -11.356 -2.292 1.809 1.00 0.00 C ATOM 347 CD ARG A 26 -12.616 -2.501 2.630 1.00 0.00 C ATOM 348 NE ARG A 26 -13.413 -1.282 2.752 1.00 0.00 N ATOM 349 CZ ARG A 26 -14.295 -1.070 3.729 1.00 0.00 C ATOM 350 NH1 ARG A 26 -14.421 -1.947 4.722 1.00 0.00 N ATOM 351 NH2 ARG A 26 -15.033 0.034 3.727 1.00 0.00 N ATOM 0 H ARG A 26 -8.292 -2.998 2.711 1.00 0.00 H new ATOM 0 HA ARG A 26 -9.110 -0.880 0.806 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.305 -1.564 3.525 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.857 -0.308 2.435 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.624 -1.931 0.816 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -10.847 -3.246 1.674 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -13.221 -3.282 2.169 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -12.343 -2.854 3.625 1.00 0.00 H new ATOM 0 HE ARG A 26 -13.287 -0.552 2.050 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -13.841 -2.786 4.738 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -15.097 -1.780 5.467 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -14.925 0.718 2.979 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -15.708 0.197 4.474 1.00 0.00 H new ATOM 365 N TRP A 27 -7.819 0.834 2.031 1.00 0.00 N ATOM 366 CA TRP A 27 -7.005 1.836 2.699 1.00 0.00 C ATOM 367 C TRP A 27 -7.847 3.049 3.072 1.00 0.00 C ATOM 368 O TRP A 27 -8.797 3.407 2.371 1.00 0.00 O ATOM 369 CB TRP A 27 -5.810 2.245 1.824 1.00 0.00 C ATOM 370 CG TRP A 27 -6.127 2.379 0.363 1.00 0.00 C ATOM 371 CD1 TRP A 27 -6.600 3.487 -0.281 1.00 0.00 C ATOM 372 CD2 TRP A 27 -5.980 1.365 -0.639 1.00 0.00 C ATOM 373 NE1 TRP A 27 -6.760 3.219 -1.619 1.00 0.00 N ATOM 374 CE2 TRP A 27 -6.386 1.925 -1.862 1.00 0.00 C ATOM 375 CE3 TRP A 27 -5.544 0.037 -0.618 1.00 0.00 C ATOM 376 CZ2 TRP A 27 -6.371 1.203 -3.053 1.00 0.00 C ATOM 377 CZ3 TRP A 27 -5.530 -0.678 -1.799 1.00 0.00 C ATOM 378 CH2 TRP A 27 -5.939 -0.094 -3.003 1.00 0.00 C ATOM 0 H TRP A 27 -8.121 1.094 1.092 1.00 0.00 H new ATOM 0 HA TRP A 27 -6.613 1.399 3.617 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -5.418 3.195 2.187 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -5.017 1.507 1.945 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -6.816 4.434 0.192 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -7.102 3.878 -2.318 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -5.224 -0.422 0.306 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -6.689 1.651 -3.983 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.198 -1.706 -1.793 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -5.913 -0.679 -3.911 1.00 0.00 H new ATOM 389 N SER A 28 -7.507 3.658 4.198 1.00 0.00 N ATOM 390 CA SER A 28 -8.223 4.821 4.693 1.00 0.00 C ATOM 391 C SER A 28 -7.746 6.077 3.974 1.00 0.00 C ATOM 392 O SER A 28 -6.651 6.102 3.412 1.00 0.00 O ATOM 393 CB SER A 28 -7.994 4.956 6.200 1.00 0.00 C ATOM 394 OG SER A 28 -8.253 3.730 6.864 1.00 0.00 O ATOM 0 H SER A 28 -6.731 3.361 4.790 1.00 0.00 H new ATOM 0 HA SER A 28 -9.289 4.696 4.501 1.00 0.00 H new ATOM 0 HB2 SER A 28 -6.966 5.266 6.389 1.00 0.00 H new ATOM 0 HB3 SER A 28 -8.641 5.735 6.602 1.00 0.00 H new ATOM 0 HG SER A 28 -8.098 3.840 7.825 1.00 0.00 H new ATOM 400 N ARG A 29 -8.567 7.118 3.990 1.00 0.00 N ATOM 401 CA ARG A 29 -8.217 8.366 3.328 1.00 0.00 C ATOM 402 C ARG A 29 -7.378 9.243 4.247 1.00 0.00 C ATOM 403 O ARG A 29 -7.739 9.462 5.406 1.00 0.00 O ATOM 404 CB ARG A 29 -9.472 9.123 2.890 1.00 0.00 C ATOM 405 CG ARG A 29 -10.326 8.374 1.880 1.00 0.00 C ATOM 406 CD ARG A 29 -9.512 7.947 0.669 1.00 0.00 C ATOM 407 NE ARG A 29 -8.825 9.069 0.031 1.00 0.00 N ATOM 408 CZ ARG A 29 -8.128 8.967 -1.099 1.00 0.00 C ATOM 409 NH1 ARG A 29 -8.073 7.810 -1.749 1.00 0.00 N ATOM 410 NH2 ARG A 29 -7.494 10.028 -1.585 1.00 0.00 N ATOM 0 H ARG A 29 -9.476 7.123 4.452 1.00 0.00 H new ATOM 0 HA ARG A 29 -7.632 8.121 2.442 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -10.077 9.342 3.770 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -9.175 10.080 2.461 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -10.764 7.495 2.353 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -11.152 9.009 1.559 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -8.777 7.202 0.974 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -10.170 7.468 -0.056 1.00 0.00 H new ATOM 0 HE ARG A 29 -8.883 9.984 0.478 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -8.566 6.995 -1.383 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -7.538 7.736 -2.614 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -7.541 10.920 -1.093 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -6.960 9.951 -2.451 1.00 0.00 H new ATOM 424 N PRO A 30 -6.234 9.730 3.749 1.00 0.00 N ATOM 425 CA PRO A 30 -5.376 10.646 4.498 1.00 0.00 C ATOM 426 C PRO A 30 -5.995 12.039 4.612 1.00 0.00 C ATOM 427 O PRO A 30 -6.664 12.310 5.627 1.00 0.00 O ATOM 428 CB PRO A 30 -4.086 10.684 3.675 1.00 0.00 C ATOM 429 CG PRO A 30 -4.500 10.334 2.287 1.00 0.00 C ATOM 430 CD PRO A 30 -5.683 9.414 2.418 1.00 0.00 C ATOM 431 OXT PRO A 30 -5.826 12.855 3.679 1.00 0.00 O ATOM 0 HA PRO A 30 -5.219 10.320 5.526 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -3.624 11.671 3.712 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -3.353 9.974 4.058 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -4.764 11.229 1.723 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -3.686 9.847 1.750 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -6.415 9.591 1.630 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.385 8.368 2.347 1.00 0.00 H new TER 439 PRO A 30 ATOM 440 N MET B 31 -14.236 29.807 -19.634 1.00 0.00 N ATOM 441 CA MET B 31 -12.777 29.710 -19.403 1.00 0.00 C ATOM 442 C MET B 31 -12.480 28.976 -18.099 1.00 0.00 C ATOM 443 O MET B 31 -11.328 28.657 -17.810 1.00 0.00 O ATOM 444 CB MET B 31 -12.143 31.105 -19.374 1.00 0.00 C ATOM 445 CG MET B 31 -12.611 31.969 -18.213 1.00 0.00 C ATOM 446 SD MET B 31 -11.906 33.629 -18.237 1.00 0.00 S ATOM 447 CE MET B 31 -12.642 34.289 -19.730 1.00 0.00 C ATOM 0 HA MET B 31 -12.344 29.142 -20.227 1.00 0.00 H new ATOM 0 HB2 MET B 31 -11.059 31.000 -19.323 1.00 0.00 H new ATOM 0 HB3 MET B 31 -12.370 31.616 -20.310 1.00 0.00 H new ATOM 0 HG2 MET B 31 -13.698 32.042 -18.238 1.00 0.00 H new ATOM 0 HG3 MET B 31 -12.345 31.481 -17.275 1.00 0.00 H new ATOM 0 HE1 MET B 31 -12.587 35.377 -19.712 1.00 0.00 H new ATOM 0 HE2 MET B 31 -12.102 33.913 -20.599 1.00 0.00 H new ATOM 0 HE3 MET B 31 -13.685 33.979 -19.789 1.00 0.00 H new ATOM 459 N ARG B 32 -13.516 28.705 -17.312 1.00 0.00 N ATOM 460 CA ARG B 32 -13.335 28.029 -16.037 1.00 0.00 C ATOM 461 C ARG B 32 -13.909 26.620 -16.070 1.00 0.00 C ATOM 462 O ARG B 32 -15.124 26.434 -16.155 1.00 0.00 O ATOM 463 CB ARG B 32 -13.974 28.831 -14.900 1.00 0.00 C ATOM 464 CG ARG B 32 -13.205 30.091 -14.540 1.00 0.00 C ATOM 465 CD ARG B 32 -13.786 30.768 -13.310 1.00 0.00 C ATOM 466 NE ARG B 32 -12.970 31.902 -12.878 1.00 0.00 N ATOM 467 CZ ARG B 32 -13.050 32.467 -11.675 1.00 0.00 C ATOM 468 NH1 ARG B 32 -13.926 32.023 -10.783 1.00 0.00 N ATOM 469 NH2 ARG B 32 -12.250 33.479 -11.365 1.00 0.00 N ATOM 0 H ARG B 32 -14.483 28.942 -17.534 1.00 0.00 H new ATOM 0 HA ARG B 32 -12.263 27.956 -15.855 1.00 0.00 H new ATOM 0 HB2 ARG B 32 -14.990 29.104 -15.185 1.00 0.00 H new ATOM 0 HB3 ARG B 32 -14.050 28.197 -14.017 1.00 0.00 H new ATOM 0 HG2 ARG B 32 -12.160 29.841 -14.359 1.00 0.00 H new ATOM 0 HG3 ARG B 32 -13.226 30.784 -15.381 1.00 0.00 H new ATOM 0 HD2 ARG B 32 -14.798 31.110 -13.527 1.00 0.00 H new ATOM 0 HD3 ARG B 32 -13.862 30.044 -12.498 1.00 0.00 H new ATOM 0 HE ARG B 32 -12.296 32.285 -13.541 1.00 0.00 H new ATOM 0 HH11 ARG B 32 -14.543 31.245 -11.017 1.00 0.00 H new ATOM 0 HH12 ARG B 32 -13.983 32.460 -9.863 1.00 0.00 H new ATOM 0 HH21 ARG B 32 -11.575 33.823 -12.048 1.00 0.00 H new ATOM 0 HH22 ARG B 32 -12.310 33.913 -10.444 1.00 0.00 H new ATOM 483 N GLY B 33 -13.027 25.633 -16.017 1.00 0.00 N ATOM 484 CA GLY B 33 -13.455 24.251 -15.950 1.00 0.00 C ATOM 485 C GLY B 33 -12.982 23.588 -14.674 1.00 0.00 C ATOM 486 O GLY B 33 -13.654 23.654 -13.644 1.00 0.00 O ATOM 0 H GLY B 33 -12.016 25.766 -16.019 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -14.542 24.202 -16.006 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -13.067 23.706 -16.811 1.00 0.00 H new ATOM 490 N SER B 34 -11.815 22.967 -14.729 1.00 0.00 N ATOM 491 CA SER B 34 -11.225 22.354 -13.554 1.00 0.00 C ATOM 492 C SER B 34 -10.292 23.360 -12.888 1.00 0.00 C ATOM 493 O SER B 34 -9.083 23.370 -13.133 1.00 0.00 O ATOM 494 CB SER B 34 -10.471 21.075 -13.938 1.00 0.00 C ATOM 495 OG SER B 34 -10.128 20.315 -12.789 1.00 0.00 O ATOM 0 H SER B 34 -11.258 22.875 -15.578 1.00 0.00 H new ATOM 0 HA SER B 34 -12.010 22.074 -12.851 1.00 0.00 H new ATOM 0 HB2 SER B 34 -11.088 20.472 -14.605 1.00 0.00 H new ATOM 0 HB3 SER B 34 -9.567 21.335 -14.489 1.00 0.00 H new ATOM 0 HG SER B 34 -9.650 19.505 -13.063 1.00 0.00 H new ATOM 501 N ASN B 35 -10.868 24.220 -12.061 1.00 0.00 N ATOM 502 CA ASN B 35 -10.128 25.324 -11.465 1.00 0.00 C ATOM 503 C ASN B 35 -9.351 24.868 -10.244 1.00 0.00 C ATOM 504 O ASN B 35 -8.160 25.151 -10.119 1.00 0.00 O ATOM 505 CB ASN B 35 -11.070 26.461 -11.066 1.00 0.00 C ATOM 506 CG ASN B 35 -11.930 26.944 -12.214 1.00 0.00 C ATOM 507 OD1 ASN B 35 -11.506 27.780 -13.010 1.00 0.00 O ATOM 508 ND2 ASN B 35 -13.153 26.441 -12.289 1.00 0.00 N ATOM 0 H ASN B 35 -11.849 24.175 -11.786 1.00 0.00 H new ATOM 0 HA ASN B 35 -9.427 25.685 -12.217 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -11.714 26.124 -10.253 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -10.482 27.295 -10.683 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -13.785 26.746 -13.029 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -13.463 25.749 -11.607 1.00 0.00 H new ATOM 515 N ALA B 36 -10.031 24.158 -9.354 1.00 0.00 N ATOM 516 CA ALA B 36 -9.434 23.725 -8.099 1.00 0.00 C ATOM 517 C ALA B 36 -8.402 22.629 -8.335 1.00 0.00 C ATOM 518 O ALA B 36 -8.747 21.519 -8.745 1.00 0.00 O ATOM 519 CB ALA B 36 -10.514 23.243 -7.144 1.00 0.00 C ATOM 0 H ALA B 36 -11.001 23.869 -9.479 1.00 0.00 H new ATOM 0 HA ALA B 36 -8.923 24.577 -7.651 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -10.056 22.922 -6.209 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -11.213 24.055 -6.945 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -11.049 22.406 -7.592 1.00 0.00 H new ATOM 525 N PRO B 37 -7.121 22.931 -8.090 1.00 0.00 N ATOM 526 CA PRO B 37 -6.042 21.973 -8.265 1.00 0.00 C ATOM 527 C PRO B 37 -5.857 21.092 -7.035 1.00 0.00 C ATOM 528 O PRO B 37 -6.152 21.501 -5.909 1.00 0.00 O ATOM 529 CB PRO B 37 -4.827 22.871 -8.476 1.00 0.00 C ATOM 530 CG PRO B 37 -5.117 24.096 -7.675 1.00 0.00 C ATOM 531 CD PRO B 37 -6.620 24.238 -7.621 1.00 0.00 C ATOM 0 HA PRO B 37 -6.224 21.278 -9.084 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -3.912 22.385 -8.138 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -4.690 23.111 -9.530 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -4.701 24.009 -6.671 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -4.662 24.974 -8.133 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -6.964 24.458 -6.610 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -6.967 25.051 -8.259 1.00 0.00 H new ATOM 539 N GLN B 38 -5.387 19.881 -7.254 1.00 0.00 N ATOM 540 CA GLN B 38 -5.135 18.950 -6.168 1.00 0.00 C ATOM 541 C GLN B 38 -3.634 18.828 -5.941 1.00 0.00 C ATOM 542 O GLN B 38 -2.909 18.340 -6.804 1.00 0.00 O ATOM 543 CB GLN B 38 -5.740 17.588 -6.503 1.00 0.00 C ATOM 544 CG GLN B 38 -7.243 17.633 -6.721 1.00 0.00 C ATOM 545 CD GLN B 38 -7.820 16.284 -7.094 1.00 0.00 C ATOM 546 OE1 GLN B 38 -7.311 15.241 -6.684 1.00 0.00 O ATOM 547 NE2 GLN B 38 -8.884 16.297 -7.876 1.00 0.00 N ATOM 0 H GLN B 38 -5.170 19.515 -8.181 1.00 0.00 H new ATOM 0 HA GLN B 38 -5.600 19.320 -5.254 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -5.262 17.197 -7.401 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -5.518 16.891 -5.695 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -7.727 17.992 -5.813 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -7.470 18.351 -7.509 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -9.273 17.185 -8.193 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -9.317 15.419 -8.163 1.00 0.00 H new ATOM 556 N PRO B 39 -3.152 19.296 -4.773 1.00 0.00 N ATOM 557 CA PRO B 39 -1.723 19.293 -4.445 1.00 0.00 C ATOM 558 C PRO B 39 -1.144 17.883 -4.368 1.00 0.00 C ATOM 559 O PRO B 39 -0.209 17.555 -5.096 1.00 0.00 O ATOM 560 CB PRO B 39 -1.654 19.986 -3.078 1.00 0.00 C ATOM 561 CG PRO B 39 -3.031 19.889 -2.515 1.00 0.00 C ATOM 562 CD PRO B 39 -3.968 19.871 -3.689 1.00 0.00 C ATOM 0 HA PRO B 39 -1.135 19.796 -5.213 1.00 0.00 H new ATOM 0 HB2 PRO B 39 -0.928 19.499 -2.427 1.00 0.00 H new ATOM 0 HB3 PRO B 39 -1.344 21.026 -3.180 1.00 0.00 H new ATOM 0 HG2 PRO B 39 -3.143 18.986 -1.915 1.00 0.00 H new ATOM 0 HG3 PRO B 39 -3.244 20.735 -1.861 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -4.852 19.266 -3.488 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -4.318 20.873 -3.938 1.00 0.00 H new ATOM 570 N SER B 40 -1.703 17.053 -3.496 1.00 0.00 N ATOM 571 CA SER B 40 -1.252 15.680 -3.363 1.00 0.00 C ATOM 572 C SER B 40 -1.542 14.924 -4.652 1.00 0.00 C ATOM 573 O SER B 40 -0.622 14.499 -5.356 1.00 0.00 O ATOM 574 CB SER B 40 -1.964 15.003 -2.191 1.00 0.00 C ATOM 575 OG SER B 40 -2.073 15.882 -1.083 1.00 0.00 O ATOM 0 H SER B 40 -2.468 17.310 -2.873 1.00 0.00 H new ATOM 0 HA SER B 40 -0.179 15.673 -3.172 1.00 0.00 H new ATOM 0 HB2 SER B 40 -2.958 14.680 -2.502 1.00 0.00 H new ATOM 0 HB3 SER B 40 -1.416 14.108 -1.897 1.00 0.00 H new ATOM 0 HG SER B 40 -1.715 15.445 -0.282 1.00 0.00 H new ATOM 581 N HIS B 41 -2.837 14.801 -4.952 1.00 0.00 N ATOM 582 CA HIS B 41 -3.324 14.139 -6.159 1.00 0.00 C ATOM 583 C HIS B 41 -2.603 12.820 -6.407 1.00 0.00 C ATOM 584 O HIS B 41 -1.724 12.731 -7.269 1.00 0.00 O ATOM 585 CB HIS B 41 -3.181 15.055 -7.377 1.00 0.00 C ATOM 586 CG HIS B 41 -3.856 14.522 -8.604 1.00 0.00 C ATOM 587 ND1 HIS B 41 -3.183 13.879 -9.618 1.00 0.00 N ATOM 588 CD2 HIS B 41 -5.157 14.532 -8.969 1.00 0.00 C ATOM 589 CE1 HIS B 41 -4.039 13.516 -10.551 1.00 0.00 C ATOM 590 NE2 HIS B 41 -5.245 13.899 -10.183 1.00 0.00 N ATOM 0 H HIS B 41 -3.582 15.162 -4.357 1.00 0.00 H new ATOM 0 HA HIS B 41 -4.381 13.921 -6.004 1.00 0.00 H new ATOM 0 HB2 HIS B 41 -3.598 16.033 -7.138 1.00 0.00 H new ATOM 0 HB3 HIS B 41 -2.122 15.203 -7.589 1.00 0.00 H new ATOM 0 HD2 HIS B 41 -5.976 14.959 -8.409 1.00 0.00 H new ATOM 0 HE1 HIS B 41 -3.794 12.993 -11.463 1.00 0.00 H new ATOM 0 HE2 HIS B 41 -6.103 13.749 -10.714 1.00 0.00 H new ATOM 599 N ILE B 42 -2.964 11.802 -5.646 1.00 0.00 N ATOM 600 CA ILE B 42 -2.399 10.484 -5.853 1.00 0.00 C ATOM 601 C ILE B 42 -2.899 9.937 -7.181 1.00 0.00 C ATOM 602 O ILE B 42 -4.101 9.749 -7.374 1.00 0.00 O ATOM 603 CB ILE B 42 -2.736 9.489 -4.714 1.00 0.00 C ATOM 604 CG1 ILE B 42 -2.111 9.923 -3.378 1.00 0.00 C ATOM 605 CG2 ILE B 42 -2.247 8.095 -5.081 1.00 0.00 C ATOM 606 CD1 ILE B 42 -2.819 11.078 -2.698 1.00 0.00 C ATOM 0 H ILE B 42 -3.641 11.863 -4.885 1.00 0.00 H new ATOM 0 HA ILE B 42 -1.314 10.591 -5.858 1.00 0.00 H new ATOM 0 HB ILE B 42 -3.819 9.479 -4.591 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -2.103 9.069 -2.701 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -1.072 10.202 -3.551 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -2.488 7.401 -4.275 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -2.735 7.768 -5.999 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -1.168 8.116 -5.232 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -2.311 11.317 -1.764 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -2.804 11.950 -3.352 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -3.852 10.799 -2.488 1.00 0.00 H new ATOM 618 N SER B 43 -1.975 9.716 -8.097 1.00 0.00 N ATOM 619 CA SER B 43 -2.315 9.314 -9.448 1.00 0.00 C ATOM 620 C SER B 43 -2.608 7.819 -9.506 1.00 0.00 C ATOM 621 O SER B 43 -3.450 7.371 -10.287 1.00 0.00 O ATOM 622 CB SER B 43 -1.166 9.680 -10.392 1.00 0.00 C ATOM 623 OG SER B 43 -1.530 9.500 -11.751 1.00 0.00 O ATOM 0 H SER B 43 -0.974 9.809 -7.927 1.00 0.00 H new ATOM 0 HA SER B 43 -3.215 9.842 -9.763 1.00 0.00 H new ATOM 0 HB2 SER B 43 -0.875 10.717 -10.227 1.00 0.00 H new ATOM 0 HB3 SER B 43 -0.296 9.065 -10.163 1.00 0.00 H new ATOM 0 HG SER B 43 -0.775 9.744 -12.327 1.00 0.00 H new ATOM 629 N LYS B 44 -1.926 7.051 -8.662 1.00 0.00 N ATOM 630 CA LYS B 44 -2.100 5.607 -8.637 1.00 0.00 C ATOM 631 C LYS B 44 -1.583 5.020 -7.331 1.00 0.00 C ATOM 632 O LYS B 44 -0.670 5.570 -6.705 1.00 0.00 O ATOM 633 CB LYS B 44 -1.372 4.959 -9.821 1.00 0.00 C ATOM 634 CG LYS B 44 0.122 5.239 -9.841 1.00 0.00 C ATOM 635 CD LYS B 44 0.792 4.614 -11.050 1.00 0.00 C ATOM 636 CE LYS B 44 2.272 4.959 -11.101 1.00 0.00 C ATOM 637 NZ LYS B 44 2.933 4.396 -12.305 1.00 0.00 N ATOM 0 H LYS B 44 -1.248 7.407 -7.987 1.00 0.00 H new ATOM 0 HA LYS B 44 -3.167 5.396 -8.715 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -1.531 3.881 -9.789 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -1.814 5.319 -10.750 1.00 0.00 H new ATOM 0 HG2 LYS B 44 0.291 6.316 -9.847 1.00 0.00 H new ATOM 0 HG3 LYS B 44 0.578 4.850 -8.930 1.00 0.00 H new ATOM 0 HD2 LYS B 44 0.670 3.531 -11.017 1.00 0.00 H new ATOM 0 HD3 LYS B 44 0.304 4.963 -11.960 1.00 0.00 H new ATOM 0 HE2 LYS B 44 2.392 6.042 -11.095 1.00 0.00 H new ATOM 0 HE3 LYS B 44 2.764 4.578 -10.206 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 3.940 4.654 -12.301 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 2.841 3.360 -12.299 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 2.481 4.779 -13.160 1.00 0.00 H new ATOM 651 N TYR B 45 -2.181 3.913 -6.922 1.00 0.00 N ATOM 652 CA TYR B 45 -1.727 3.171 -5.758 1.00 0.00 C ATOM 653 C TYR B 45 -1.135 1.846 -6.218 1.00 0.00 C ATOM 654 O TYR B 45 -1.788 1.093 -6.942 1.00 0.00 O ATOM 655 CB TYR B 45 -2.886 2.888 -4.794 1.00 0.00 C ATOM 656 CG TYR B 45 -3.745 4.087 -4.465 1.00 0.00 C ATOM 657 CD1 TYR B 45 -4.946 4.297 -5.127 1.00 0.00 C ATOM 658 CD2 TYR B 45 -3.362 5.001 -3.493 1.00 0.00 C ATOM 659 CE1 TYR B 45 -5.740 5.384 -4.833 1.00 0.00 C ATOM 660 CE2 TYR B 45 -4.153 6.092 -3.192 1.00 0.00 C ATOM 661 CZ TYR B 45 -5.341 6.279 -3.866 1.00 0.00 C ATOM 662 OH TYR B 45 -6.130 7.369 -3.581 1.00 0.00 O ATOM 0 H TYR B 45 -2.992 3.505 -7.386 1.00 0.00 H new ATOM 0 HA TYR B 45 -0.980 3.769 -5.236 1.00 0.00 H new ATOM 0 HB2 TYR B 45 -3.519 2.113 -5.227 1.00 0.00 H new ATOM 0 HB3 TYR B 45 -2.478 2.485 -3.867 1.00 0.00 H new ATOM 0 HD1 TYR B 45 -5.264 3.597 -5.885 1.00 0.00 H new ATOM 0 HD2 TYR B 45 -2.431 4.857 -2.964 1.00 0.00 H new ATOM 0 HE1 TYR B 45 -6.671 5.533 -5.359 1.00 0.00 H new ATOM 0 HE2 TYR B 45 -3.843 6.795 -2.433 1.00 0.00 H new ATOM 0 HH TYR B 45 -5.709 7.902 -2.875 1.00 0.00 H new ATOM 672 N ILE B 46 0.094 1.570 -5.829 1.00 0.00 N ATOM 673 CA ILE B 46 0.729 0.314 -6.185 1.00 0.00 C ATOM 674 C ILE B 46 0.638 -0.662 -5.019 1.00 0.00 C ATOM 675 O ILE B 46 1.152 -0.398 -3.933 1.00 0.00 O ATOM 676 CB ILE B 46 2.214 0.494 -6.603 1.00 0.00 C ATOM 677 CG1 ILE B 46 2.336 1.315 -7.895 1.00 0.00 C ATOM 678 CG2 ILE B 46 2.886 -0.860 -6.788 1.00 0.00 C ATOM 679 CD1 ILE B 46 2.103 2.800 -7.714 1.00 0.00 C ATOM 0 H ILE B 46 0.672 2.195 -5.268 1.00 0.00 H new ATOM 0 HA ILE B 46 0.195 -0.082 -7.048 1.00 0.00 H new ATOM 0 HB ILE B 46 2.716 1.037 -5.802 1.00 0.00 H new ATOM 0 HG12 ILE B 46 3.330 1.164 -8.315 1.00 0.00 H new ATOM 0 HG13 ILE B 46 1.621 0.933 -8.623 1.00 0.00 H new ATOM 0 HG21 ILE B 46 3.926 -0.713 -7.081 1.00 0.00 H new ATOM 0 HG22 ILE B 46 2.848 -1.416 -5.851 1.00 0.00 H new ATOM 0 HG23 ILE B 46 2.366 -1.421 -7.565 1.00 0.00 H new ATOM 0 HD11 ILE B 46 2.208 3.305 -8.674 1.00 0.00 H new ATOM 0 HD12 ILE B 46 1.098 2.966 -7.325 1.00 0.00 H new ATOM 0 HD13 ILE B 46 2.835 3.200 -7.012 1.00 0.00 H new ATOM 691 N LEU B 47 -0.037 -1.775 -5.250 1.00 0.00 N ATOM 692 CA LEU B 47 -0.204 -2.800 -4.235 1.00 0.00 C ATOM 693 C LEU B 47 0.768 -3.939 -4.521 1.00 0.00 C ATOM 694 O LEU B 47 0.668 -4.600 -5.553 1.00 0.00 O ATOM 695 CB LEU B 47 -1.656 -3.318 -4.252 1.00 0.00 C ATOM 696 CG LEU B 47 -2.198 -3.931 -2.946 1.00 0.00 C ATOM 697 CD1 LEU B 47 -1.345 -5.093 -2.467 1.00 0.00 C ATOM 698 CD2 LEU B 47 -2.315 -2.876 -1.859 1.00 0.00 C ATOM 0 H LEU B 47 -0.482 -1.993 -6.141 1.00 0.00 H new ATOM 0 HA LEU B 47 0.004 -2.385 -3.249 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -2.307 -2.490 -4.533 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.738 -4.069 -5.038 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.193 -4.320 -3.164 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -1.763 -5.495 -1.544 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.331 -5.872 -3.229 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.328 -4.747 -2.284 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -2.700 -3.334 -0.948 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.333 -2.446 -1.662 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -2.996 -2.091 -2.186 1.00 0.00 H new ATOM 710 N ARG B 48 1.723 -4.142 -3.630 1.00 0.00 N ATOM 711 CA ARG B 48 2.659 -5.252 -3.763 1.00 0.00 C ATOM 712 C ARG B 48 2.483 -6.221 -2.608 1.00 0.00 C ATOM 713 O ARG B 48 2.424 -5.802 -1.453 1.00 0.00 O ATOM 714 CB ARG B 48 4.107 -4.758 -3.785 1.00 0.00 C ATOM 715 CG ARG B 48 4.438 -3.834 -4.929 1.00 0.00 C ATOM 716 CD ARG B 48 5.848 -3.296 -4.780 1.00 0.00 C ATOM 717 NE ARG B 48 6.211 -2.429 -5.888 1.00 0.00 N ATOM 718 CZ ARG B 48 6.922 -1.309 -5.763 1.00 0.00 C ATOM 719 NH1 ARG B 48 7.355 -0.919 -4.570 1.00 0.00 N ATOM 720 NH2 ARG B 48 7.205 -0.580 -6.834 1.00 0.00 N ATOM 0 H ARG B 48 1.873 -3.557 -2.808 1.00 0.00 H new ATOM 0 HA ARG B 48 2.447 -5.754 -4.707 1.00 0.00 H new ATOM 0 HB2 ARG B 48 4.316 -4.243 -2.847 1.00 0.00 H new ATOM 0 HB3 ARG B 48 4.771 -5.621 -3.829 1.00 0.00 H new ATOM 0 HG2 ARG B 48 4.343 -4.367 -5.875 1.00 0.00 H new ATOM 0 HG3 ARG B 48 3.727 -3.008 -4.956 1.00 0.00 H new ATOM 0 HD2 ARG B 48 5.930 -2.744 -3.844 1.00 0.00 H new ATOM 0 HD3 ARG B 48 6.551 -4.127 -4.723 1.00 0.00 H new ATOM 0 HE ARG B 48 5.901 -2.695 -6.823 1.00 0.00 H new ATOM 0 HH11 ARG B 48 7.144 -1.478 -3.743 1.00 0.00 H new ATOM 0 HH12 ARG B 48 7.899 -0.061 -4.480 1.00 0.00 H new ATOM 0 HH21 ARG B 48 6.878 -0.877 -7.754 1.00 0.00 H new ATOM 0 HH22 ARG B 48 7.749 0.277 -6.738 1.00 0.00 H new ATOM 734 N TRP B 49 2.393 -7.504 -2.916 1.00 0.00 N ATOM 735 CA TRP B 49 2.283 -8.516 -1.879 1.00 0.00 C ATOM 736 C TRP B 49 3.216 -9.688 -2.161 1.00 0.00 C ATOM 737 O TRP B 49 3.495 -10.017 -3.316 1.00 0.00 O ATOM 738 CB TRP B 49 0.832 -8.992 -1.714 1.00 0.00 C ATOM 739 CG TRP B 49 0.253 -9.710 -2.901 1.00 0.00 C ATOM 740 CD1 TRP B 49 0.121 -11.059 -3.051 1.00 0.00 C ATOM 741 CD2 TRP B 49 -0.289 -9.120 -4.089 1.00 0.00 C ATOM 742 NE1 TRP B 49 -0.482 -11.345 -4.252 1.00 0.00 N ATOM 743 CE2 TRP B 49 -0.740 -10.170 -4.909 1.00 0.00 C ATOM 744 CE3 TRP B 49 -0.442 -7.807 -4.534 1.00 0.00 C ATOM 745 CZ2 TRP B 49 -1.332 -9.945 -6.150 1.00 0.00 C ATOM 746 CZ3 TRP B 49 -1.027 -7.583 -5.764 1.00 0.00 C ATOM 747 CH2 TRP B 49 -1.469 -8.647 -6.559 1.00 0.00 C ATOM 0 H TRP B 49 2.394 -7.868 -3.869 1.00 0.00 H new ATOM 0 HA TRP B 49 2.589 -8.061 -0.937 1.00 0.00 H new ATOM 0 HB2 TRP B 49 0.780 -9.653 -0.849 1.00 0.00 H new ATOM 0 HB3 TRP B 49 0.206 -8.127 -1.492 1.00 0.00 H new ATOM 0 HD1 TRP B 49 0.444 -11.796 -2.330 1.00 0.00 H new ATOM 0 HE1 TRP B 49 -0.702 -12.279 -4.598 1.00 0.00 H new ATOM 0 HE3 TRP B 49 -0.108 -6.979 -3.926 1.00 0.00 H new ATOM 0 HZ2 TRP B 49 -1.670 -10.765 -6.766 1.00 0.00 H new ATOM 0 HZ3 TRP B 49 -1.146 -6.570 -6.119 1.00 0.00 H new ATOM 0 HH2 TRP B 49 -1.927 -8.439 -7.514 1.00 0.00 H new ATOM 758 N ARG B 50 3.713 -10.290 -1.091 1.00 0.00 N ATOM 759 CA ARG B 50 4.651 -11.399 -1.187 1.00 0.00 C ATOM 760 C ARG B 50 4.444 -12.355 -0.019 1.00 0.00 C ATOM 761 O ARG B 50 4.211 -11.912 1.107 1.00 0.00 O ATOM 762 CB ARG B 50 6.088 -10.868 -1.162 1.00 0.00 C ATOM 763 CG ARG B 50 7.150 -11.951 -1.275 1.00 0.00 C ATOM 764 CD ARG B 50 8.540 -11.409 -0.983 1.00 0.00 C ATOM 765 NE ARG B 50 8.671 -10.940 0.399 1.00 0.00 N ATOM 766 CZ ARG B 50 9.834 -10.808 1.035 1.00 0.00 C ATOM 767 NH1 ARG B 50 10.973 -11.088 0.416 1.00 0.00 N ATOM 768 NH2 ARG B 50 9.860 -10.374 2.289 1.00 0.00 N ATOM 0 H ARG B 50 3.479 -10.025 -0.134 1.00 0.00 H new ATOM 0 HA ARG B 50 4.477 -11.929 -2.123 1.00 0.00 H new ATOM 0 HB2 ARG B 50 6.217 -10.160 -1.981 1.00 0.00 H new ATOM 0 HB3 ARG B 50 6.244 -10.316 -0.235 1.00 0.00 H new ATOM 0 HG2 ARG B 50 6.921 -12.759 -0.580 1.00 0.00 H new ATOM 0 HG3 ARG B 50 7.129 -12.378 -2.278 1.00 0.00 H new ATOM 0 HD2 ARG B 50 9.279 -12.187 -1.173 1.00 0.00 H new ATOM 0 HD3 ARG B 50 8.759 -10.588 -1.666 1.00 0.00 H new ATOM 0 HE ARG B 50 7.819 -10.700 0.905 1.00 0.00 H new ATOM 0 HH11 ARG B 50 10.962 -11.407 -0.553 1.00 0.00 H new ATOM 0 HH12 ARG B 50 11.860 -10.985 0.909 1.00 0.00 H new ATOM 0 HH21 ARG B 50 8.989 -10.141 2.766 1.00 0.00 H new ATOM 0 HH22 ARG B 50 10.751 -10.273 2.775 1.00 0.00 H new ATOM 782 N PRO B 51 4.497 -13.676 -0.272 1.00 0.00 N ATOM 783 CA PRO B 51 4.472 -14.682 0.792 1.00 0.00 C ATOM 784 C PRO B 51 5.567 -14.421 1.818 1.00 0.00 C ATOM 785 O PRO B 51 6.750 -14.465 1.498 1.00 0.00 O ATOM 786 CB PRO B 51 4.714 -16.013 0.060 1.00 0.00 C ATOM 787 CG PRO B 51 5.160 -15.642 -1.317 1.00 0.00 C ATOM 788 CD PRO B 51 4.566 -14.294 -1.603 1.00 0.00 C ATOM 0 HA PRO B 51 3.534 -14.675 1.347 1.00 0.00 H new ATOM 0 HB2 PRO B 51 5.472 -16.608 0.570 1.00 0.00 H new ATOM 0 HB3 PRO B 51 3.805 -16.613 0.029 1.00 0.00 H new ATOM 0 HG2 PRO B 51 6.248 -15.608 -1.378 1.00 0.00 H new ATOM 0 HG3 PRO B 51 4.823 -16.378 -2.047 1.00 0.00 H new ATOM 0 HD2 PRO B 51 5.188 -13.715 -2.285 1.00 0.00 H new ATOM 0 HD3 PRO B 51 3.581 -14.376 -2.062 1.00 0.00 H new ATOM 796 N LYS B 52 5.155 -14.154 3.049 1.00 0.00 N ATOM 797 CA LYS B 52 6.059 -13.705 4.105 1.00 0.00 C ATOM 798 C LYS B 52 7.156 -14.730 4.413 1.00 0.00 C ATOM 799 O LYS B 52 8.255 -14.362 4.824 1.00 0.00 O ATOM 800 CB LYS B 52 5.232 -13.383 5.356 1.00 0.00 C ATOM 801 CG LYS B 52 6.033 -13.084 6.610 1.00 0.00 C ATOM 802 CD LYS B 52 6.896 -11.851 6.464 1.00 0.00 C ATOM 803 CE LYS B 52 7.512 -11.462 7.792 1.00 0.00 C ATOM 804 NZ LYS B 52 8.273 -10.192 7.696 1.00 0.00 N ATOM 0 H LYS B 52 4.183 -14.242 3.347 1.00 0.00 H new ATOM 0 HA LYS B 52 6.576 -12.809 3.762 1.00 0.00 H new ATOM 0 HB2 LYS B 52 4.596 -12.525 5.139 1.00 0.00 H new ATOM 0 HB3 LYS B 52 4.571 -14.226 5.560 1.00 0.00 H new ATOM 0 HG2 LYS B 52 5.351 -12.949 7.450 1.00 0.00 H new ATOM 0 HG3 LYS B 52 6.665 -13.940 6.847 1.00 0.00 H new ATOM 0 HD2 LYS B 52 7.684 -12.038 5.734 1.00 0.00 H new ATOM 0 HD3 LYS B 52 6.296 -11.025 6.081 1.00 0.00 H new ATOM 0 HE2 LYS B 52 6.727 -11.359 8.541 1.00 0.00 H new ATOM 0 HE3 LYS B 52 8.175 -12.258 8.132 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 8.301 -9.733 8.629 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 9.243 -10.392 7.379 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 7.809 -9.560 7.013 1.00 0.00 H new ATOM 818 N ASN B 53 6.877 -16.006 4.189 1.00 0.00 N ATOM 819 CA ASN B 53 7.852 -17.053 4.486 1.00 0.00 C ATOM 820 C ASN B 53 8.845 -17.213 3.333 1.00 0.00 C ATOM 821 O ASN B 53 9.830 -17.945 3.440 1.00 0.00 O ATOM 822 CB ASN B 53 7.149 -18.393 4.764 1.00 0.00 C ATOM 823 CG ASN B 53 6.941 -19.240 3.514 1.00 0.00 C ATOM 824 OD1 ASN B 53 7.788 -20.062 3.162 1.00 0.00 O ATOM 825 ND2 ASN B 53 5.813 -19.065 2.845 1.00 0.00 N ATOM 0 H ASN B 53 5.993 -16.342 3.806 1.00 0.00 H new ATOM 0 HA ASN B 53 8.399 -16.755 5.380 1.00 0.00 H new ATOM 0 HB2 ASN B 53 7.738 -18.961 5.484 1.00 0.00 H new ATOM 0 HB3 ASN B 53 6.181 -18.198 5.226 1.00 0.00 H new ATOM 0 HD21 ASN B 53 5.624 -19.620 2.010 1.00 0.00 H new ATOM 0 HD22 ASN B 53 5.133 -18.375 3.164 1.00 0.00 H new ATOM 832 N SER B 54 8.596 -16.512 2.239 1.00 0.00 N ATOM 833 CA SER B 54 9.389 -16.682 1.035 1.00 0.00 C ATOM 834 C SER B 54 10.031 -15.369 0.594 1.00 0.00 C ATOM 835 O SER B 54 9.416 -14.309 0.661 1.00 0.00 O ATOM 836 CB SER B 54 8.504 -17.229 -0.082 1.00 0.00 C ATOM 837 OG SER B 54 7.824 -18.401 0.336 1.00 0.00 O ATOM 0 H SER B 54 7.851 -15.820 2.161 1.00 0.00 H new ATOM 0 HA SER B 54 10.192 -17.386 1.253 1.00 0.00 H new ATOM 0 HB2 SER B 54 7.780 -16.471 -0.381 1.00 0.00 H new ATOM 0 HB3 SER B 54 9.113 -17.451 -0.958 1.00 0.00 H new ATOM 0 HG SER B 54 7.262 -18.732 -0.396 1.00 0.00 H new ATOM 843 N VAL B 55 11.270 -15.452 0.134 1.00 0.00 N ATOM 844 CA VAL B 55 11.976 -14.300 -0.390 1.00 0.00 C ATOM 845 C VAL B 55 11.751 -14.199 -1.907 1.00 0.00 C ATOM 846 O VAL B 55 12.602 -13.731 -2.666 1.00 0.00 O ATOM 847 CB VAL B 55 13.483 -14.406 -0.057 1.00 0.00 C ATOM 848 CG1 VAL B 55 14.136 -15.544 -0.825 1.00 0.00 C ATOM 849 CG2 VAL B 55 14.197 -13.093 -0.313 1.00 0.00 C ATOM 0 H VAL B 55 11.810 -16.317 0.115 1.00 0.00 H new ATOM 0 HA VAL B 55 11.589 -13.394 0.076 1.00 0.00 H new ATOM 0 HB VAL B 55 13.571 -14.628 1.006 1.00 0.00 H new ATOM 0 HG11 VAL B 55 15.195 -15.594 -0.571 1.00 0.00 H new ATOM 0 HG12 VAL B 55 13.654 -16.485 -0.560 1.00 0.00 H new ATOM 0 HG13 VAL B 55 14.028 -15.370 -1.896 1.00 0.00 H new ATOM 0 HG21 VAL B 55 15.254 -13.200 -0.069 1.00 0.00 H new ATOM 0 HG22 VAL B 55 14.092 -12.821 -1.363 1.00 0.00 H new ATOM 0 HG23 VAL B 55 13.759 -12.313 0.309 1.00 0.00 H new ATOM 859 N GLY B 56 10.575 -14.639 -2.335 1.00 0.00 N ATOM 860 CA GLY B 56 10.251 -14.666 -3.747 1.00 0.00 C ATOM 861 C GLY B 56 9.950 -13.291 -4.310 1.00 0.00 C ATOM 862 O GLY B 56 10.153 -12.275 -3.644 1.00 0.00 O ATOM 0 H GLY B 56 9.834 -14.980 -1.723 1.00 0.00 H new ATOM 0 HA2 GLY B 56 11.084 -15.104 -4.297 1.00 0.00 H new ATOM 0 HA3 GLY B 56 9.389 -15.314 -3.904 1.00 0.00 H new ATOM 866 N ARG B 57 9.452 -13.263 -5.532 1.00 0.00 N ATOM 867 CA ARG B 57 9.168 -12.013 -6.219 1.00 0.00 C ATOM 868 C ARG B 57 7.891 -11.380 -5.686 1.00 0.00 C ATOM 869 O ARG B 57 6.932 -12.076 -5.346 1.00 0.00 O ATOM 870 CB ARG B 57 9.036 -12.259 -7.722 1.00 0.00 C ATOM 871 CG ARG B 57 10.305 -12.794 -8.361 1.00 0.00 C ATOM 872 CD ARG B 57 10.096 -13.120 -9.827 1.00 0.00 C ATOM 873 NE ARG B 57 9.009 -14.080 -10.019 1.00 0.00 N ATOM 874 CZ ARG B 57 9.109 -15.203 -10.727 1.00 0.00 C ATOM 875 NH1 ARG B 57 10.257 -15.543 -11.300 1.00 0.00 N ATOM 876 NH2 ARG B 57 8.052 -15.995 -10.844 1.00 0.00 N ATOM 0 H ARG B 57 9.234 -14.099 -6.075 1.00 0.00 H new ATOM 0 HA ARG B 57 9.996 -11.328 -6.037 1.00 0.00 H new ATOM 0 HB2 ARG B 57 8.225 -12.966 -7.897 1.00 0.00 H new ATOM 0 HB3 ARG B 57 8.757 -11.326 -8.212 1.00 0.00 H new ATOM 0 HG2 ARG B 57 11.102 -12.057 -8.261 1.00 0.00 H new ATOM 0 HG3 ARG B 57 10.631 -13.689 -7.831 1.00 0.00 H new ATOM 0 HD2 ARG B 57 9.874 -12.204 -10.375 1.00 0.00 H new ATOM 0 HD3 ARG B 57 11.018 -13.526 -10.244 1.00 0.00 H new ATOM 0 HE ARG B 57 8.112 -13.875 -9.580 1.00 0.00 H new ATOM 0 HH11 ARG B 57 11.075 -14.941 -11.200 1.00 0.00 H new ATOM 0 HH12 ARG B 57 10.322 -16.406 -11.840 1.00 0.00 H new ATOM 0 HH21 ARG B 57 7.173 -15.742 -10.394 1.00 0.00 H new ATOM 0 HH22 ARG B 57 8.118 -16.858 -11.384 1.00 0.00 H new ATOM 890 N TRP B 58 7.892 -10.057 -5.606 1.00 0.00 N ATOM 891 CA TRP B 58 6.718 -9.317 -5.181 1.00 0.00 C ATOM 892 C TRP B 58 5.724 -9.217 -6.325 1.00 0.00 C ATOM 893 O TRP B 58 6.098 -8.923 -7.462 1.00 0.00 O ATOM 894 CB TRP B 58 7.101 -7.911 -4.706 1.00 0.00 C ATOM 895 CG TRP B 58 7.858 -7.893 -3.412 1.00 0.00 C ATOM 896 CD1 TRP B 58 9.189 -8.131 -3.237 1.00 0.00 C ATOM 897 CD2 TRP B 58 7.324 -7.612 -2.113 1.00 0.00 C ATOM 898 NE1 TRP B 58 9.516 -8.021 -1.909 1.00 0.00 N ATOM 899 CE2 TRP B 58 8.389 -7.703 -1.198 1.00 0.00 C ATOM 900 CE3 TRP B 58 6.050 -7.296 -1.634 1.00 0.00 C ATOM 901 CZ2 TRP B 58 8.219 -7.486 0.167 1.00 0.00 C ATOM 902 CZ3 TRP B 58 5.881 -7.082 -0.279 1.00 0.00 C ATOM 903 CH2 TRP B 58 6.961 -7.178 0.608 1.00 0.00 C ATOM 0 H TRP B 58 8.698 -9.474 -5.832 1.00 0.00 H new ATOM 0 HA TRP B 58 6.261 -9.852 -4.349 1.00 0.00 H new ATOM 0 HB2 TRP B 58 7.705 -7.430 -5.476 1.00 0.00 H new ATOM 0 HB3 TRP B 58 6.194 -7.316 -4.594 1.00 0.00 H new ATOM 0 HD1 TRP B 58 9.884 -8.371 -4.028 1.00 0.00 H new ATOM 0 HE1 TRP B 58 10.447 -8.154 -1.515 1.00 0.00 H new ATOM 0 HE3 TRP B 58 5.212 -7.220 -2.311 1.00 0.00 H new ATOM 0 HZ2 TRP B 58 9.050 -7.558 0.853 1.00 0.00 H new ATOM 0 HZ3 TRP B 58 4.901 -6.837 0.102 1.00 0.00 H new ATOM 0 HH2 TRP B 58 6.797 -7.005 1.661 1.00 0.00 H new ATOM 914 N LYS B 59 4.468 -9.481 -6.026 1.00 0.00 N ATOM 915 CA LYS B 59 3.412 -9.357 -7.011 1.00 0.00 C ATOM 916 C LYS B 59 2.849 -7.947 -6.961 1.00 0.00 C ATOM 917 O LYS B 59 2.513 -7.450 -5.888 1.00 0.00 O ATOM 918 CB LYS B 59 2.324 -10.393 -6.742 1.00 0.00 C ATOM 919 CG LYS B 59 2.857 -11.820 -6.708 1.00 0.00 C ATOM 920 CD LYS B 59 1.787 -12.819 -6.296 1.00 0.00 C ATOM 921 CE LYS B 59 0.628 -12.845 -7.276 1.00 0.00 C ATOM 922 NZ LYS B 59 1.062 -13.194 -8.654 1.00 0.00 N ATOM 0 H LYS B 59 4.153 -9.784 -5.105 1.00 0.00 H new ATOM 0 HA LYS B 59 3.810 -9.541 -8.009 1.00 0.00 H new ATOM 0 HB2 LYS B 59 1.843 -10.168 -5.790 1.00 0.00 H new ATOM 0 HB3 LYS B 59 1.557 -10.315 -7.513 1.00 0.00 H new ATOM 0 HG2 LYS B 59 3.242 -12.087 -7.692 1.00 0.00 H new ATOM 0 HG3 LYS B 59 3.694 -11.878 -6.012 1.00 0.00 H new ATOM 0 HD2 LYS B 59 2.227 -13.814 -6.228 1.00 0.00 H new ATOM 0 HD3 LYS B 59 1.417 -12.565 -5.303 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -0.115 -13.567 -6.938 1.00 0.00 H new ATOM 0 HE3 LYS B 59 0.142 -11.869 -7.287 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 0.226 -13.382 -9.244 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 1.601 -12.402 -9.059 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 1.663 -14.042 -8.624 1.00 0.00 H new ATOM 936 N GLU B 60 2.764 -7.299 -8.112 1.00 0.00 N ATOM 937 CA GLU B 60 2.409 -5.888 -8.160 1.00 0.00 C ATOM 938 C GLU B 60 1.068 -5.667 -8.847 1.00 0.00 C ATOM 939 O GLU B 60 0.800 -6.227 -9.912 1.00 0.00 O ATOM 940 CB GLU B 60 3.486 -5.091 -8.898 1.00 0.00 C ATOM 941 CG GLU B 60 4.902 -5.394 -8.444 1.00 0.00 C ATOM 942 CD GLU B 60 5.918 -4.466 -9.072 1.00 0.00 C ATOM 943 OE1 GLU B 60 6.352 -4.731 -10.215 1.00 0.00 O ATOM 944 OE2 GLU B 60 6.293 -3.465 -8.425 1.00 0.00 O ATOM 0 H GLU B 60 2.935 -7.725 -9.023 1.00 0.00 H new ATOM 0 HA GLU B 60 2.332 -5.541 -7.130 1.00 0.00 H new ATOM 0 HB2 GLU B 60 3.407 -5.296 -9.966 1.00 0.00 H new ATOM 0 HB3 GLU B 60 3.292 -4.027 -8.762 1.00 0.00 H new ATOM 0 HG2 GLU B 60 4.959 -5.310 -7.359 1.00 0.00 H new ATOM 0 HG3 GLU B 60 5.150 -6.425 -8.697 1.00 0.00 H new ATOM 951 N ALA B 61 0.234 -4.851 -8.227 1.00 0.00 N ATOM 952 CA ALA B 61 -1.015 -4.416 -8.825 1.00 0.00 C ATOM 953 C ALA B 61 -1.093 -2.895 -8.799 1.00 0.00 C ATOM 954 O ALA B 61 -0.568 -2.259 -7.886 1.00 0.00 O ATOM 955 CB ALA B 61 -2.199 -5.023 -8.092 1.00 0.00 C ATOM 0 H ALA B 61 0.404 -4.472 -7.295 1.00 0.00 H new ATOM 0 HA ALA B 61 -1.049 -4.756 -9.860 1.00 0.00 H new ATOM 0 HB1 ALA B 61 -3.126 -4.685 -8.555 1.00 0.00 H new ATOM 0 HB2 ALA B 61 -2.142 -6.110 -8.146 1.00 0.00 H new ATOM 0 HB3 ALA B 61 -2.180 -4.710 -7.048 1.00 0.00 H new ATOM 961 N THR B 62 -1.728 -2.312 -9.798 1.00 0.00 N ATOM 962 CA THR B 62 -1.831 -0.865 -9.887 1.00 0.00 C ATOM 963 C THR B 62 -3.291 -0.423 -9.845 1.00 0.00 C ATOM 964 O THR B 62 -4.103 -0.830 -10.677 1.00 0.00 O ATOM 965 CB THR B 62 -1.155 -0.346 -11.169 1.00 0.00 C ATOM 966 OG1 THR B 62 0.180 -0.866 -11.245 1.00 0.00 O ATOM 967 CG2 THR B 62 -1.111 1.175 -11.191 1.00 0.00 C ATOM 0 H THR B 62 -2.181 -2.817 -10.560 1.00 0.00 H new ATOM 0 HA THR B 62 -1.315 -0.439 -9.027 1.00 0.00 H new ATOM 0 HB THR B 62 -1.738 -0.682 -12.027 1.00 0.00 H new ATOM 0 HG1 THR B 62 0.613 -0.539 -12.061 1.00 0.00 H new ATOM 0 HG21 THR B 62 -0.628 1.512 -12.108 1.00 0.00 H new ATOM 0 HG22 THR B 62 -2.126 1.569 -11.150 1.00 0.00 H new ATOM 0 HG23 THR B 62 -0.547 1.535 -10.331 1.00 0.00 H new ATOM 975 N ILE B 63 -3.617 0.394 -8.857 1.00 0.00 N ATOM 976 CA ILE B 63 -4.975 0.874 -8.665 1.00 0.00 C ATOM 977 C ILE B 63 -5.052 2.362 -8.991 1.00 0.00 C ATOM 978 O ILE B 63 -4.210 3.138 -8.539 1.00 0.00 O ATOM 979 CB ILE B 63 -5.455 0.653 -7.204 1.00 0.00 C ATOM 980 CG1 ILE B 63 -5.435 -0.833 -6.825 1.00 0.00 C ATOM 981 CG2 ILE B 63 -6.854 1.218 -7.003 1.00 0.00 C ATOM 982 CD1 ILE B 63 -4.073 -1.356 -6.415 1.00 0.00 C ATOM 0 H ILE B 63 -2.950 0.742 -8.168 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.623 0.308 -9.334 1.00 0.00 H new ATOM 0 HB ILE B 63 -4.761 1.183 -6.552 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -6.135 -0.996 -6.006 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -5.795 -1.417 -7.672 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -7.169 1.052 -5.973 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -6.848 2.288 -7.212 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -7.548 0.720 -7.680 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -4.150 -2.414 -6.164 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -3.371 -1.229 -7.239 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -3.717 -0.802 -5.547 1.00 0.00 H new ATOM 994 N PRO B 64 -6.043 2.771 -9.805 1.00 0.00 N ATOM 995 CA PRO B 64 -6.287 4.185 -10.113 1.00 0.00 C ATOM 996 C PRO B 64 -6.366 5.038 -8.850 1.00 0.00 C ATOM 997 O PRO B 64 -6.955 4.620 -7.847 1.00 0.00 O ATOM 998 CB PRO B 64 -7.639 4.163 -10.826 1.00 0.00 C ATOM 999 CG PRO B 64 -7.721 2.809 -11.438 1.00 0.00 C ATOM 1000 CD PRO B 64 -6.993 1.884 -10.503 1.00 0.00 C ATOM 0 HA PRO B 64 -5.485 4.622 -10.708 1.00 0.00 H new ATOM 0 HB2 PRO B 64 -8.458 4.332 -10.127 1.00 0.00 H new ATOM 0 HB3 PRO B 64 -7.700 4.944 -11.584 1.00 0.00 H new ATOM 0 HG2 PRO B 64 -8.759 2.500 -11.562 1.00 0.00 H new ATOM 0 HG3 PRO B 64 -7.265 2.801 -12.428 1.00 0.00 H new ATOM 0 HD2 PRO B 64 -7.676 1.400 -9.805 1.00 0.00 H new ATOM 0 HD3 PRO B 64 -6.477 1.091 -11.045 1.00 0.00 H new ATOM 1008 N GLY B 65 -5.797 6.236 -8.913 1.00 0.00 N ATOM 1009 CA GLY B 65 -5.682 7.087 -7.742 1.00 0.00 C ATOM 1010 C GLY B 65 -6.990 7.736 -7.322 1.00 0.00 C ATOM 1011 O GLY B 65 -7.038 8.936 -7.058 1.00 0.00 O ATOM 0 H GLY B 65 -5.408 6.638 -9.766 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -5.298 6.495 -6.911 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -4.948 7.868 -7.943 1.00 0.00 H new ATOM 1015 N HIS B 66 -8.045 6.942 -7.253 1.00 0.00 N ATOM 1016 CA HIS B 66 -9.334 7.410 -6.770 1.00 0.00 C ATOM 1017 C HIS B 66 -10.169 6.235 -6.277 1.00 0.00 C ATOM 1018 O HIS B 66 -11.389 6.329 -6.164 1.00 0.00 O ATOM 1019 CB HIS B 66 -10.088 8.203 -7.851 1.00 0.00 C ATOM 1020 CG HIS B 66 -10.318 7.462 -9.135 1.00 0.00 C ATOM 1021 ND1 HIS B 66 -9.661 7.769 -10.305 1.00 0.00 N ATOM 1022 CD2 HIS B 66 -11.156 6.443 -9.435 1.00 0.00 C ATOM 1023 CE1 HIS B 66 -10.085 6.975 -11.268 1.00 0.00 C ATOM 1024 NE2 HIS B 66 -10.990 6.160 -10.766 1.00 0.00 N ATOM 0 H HIS B 66 -8.033 5.960 -7.528 1.00 0.00 H new ATOM 0 HA HIS B 66 -9.156 8.088 -5.935 1.00 0.00 H new ATOM 0 HB2 HIS B 66 -11.053 8.510 -7.448 1.00 0.00 H new ATOM 0 HB3 HIS B 66 -9.529 9.113 -8.069 1.00 0.00 H new ATOM 0 HD2 HIS B 66 -11.830 5.945 -8.753 1.00 0.00 H new ATOM 0 HE1 HIS B 66 -9.748 6.990 -12.294 1.00 0.00 H new ATOM 0 HE2 HIS B 66 -11.487 5.435 -11.284 1.00 0.00 H new ATOM 1033 N LEU B 67 -9.501 5.124 -5.998 1.00 0.00 N ATOM 1034 CA LEU B 67 -10.156 3.952 -5.436 1.00 0.00 C ATOM 1035 C LEU B 67 -9.569 3.668 -4.064 1.00 0.00 C ATOM 1036 O LEU B 67 -8.411 3.996 -3.806 1.00 0.00 O ATOM 1037 CB LEU B 67 -9.978 2.729 -6.344 1.00 0.00 C ATOM 1038 CG LEU B 67 -10.497 2.884 -7.776 1.00 0.00 C ATOM 1039 CD1 LEU B 67 -10.326 1.589 -8.549 1.00 0.00 C ATOM 1040 CD2 LEU B 67 -11.956 3.309 -7.778 1.00 0.00 C ATOM 0 H LEU B 67 -8.499 5.010 -6.153 1.00 0.00 H new ATOM 0 HA LEU B 67 -11.224 4.153 -5.352 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -8.917 2.482 -6.386 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -10.484 1.881 -5.883 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.911 3.662 -8.266 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -10.701 1.719 -9.564 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -9.270 1.323 -8.583 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -10.885 0.794 -8.055 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -12.303 3.413 -8.806 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -12.555 2.555 -7.267 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -12.057 4.264 -7.262 1.00 0.00 H new ATOM 1052 N ASN B 68 -10.358 3.071 -3.185 1.00 0.00 N ATOM 1053 CA ASN B 68 -9.913 2.824 -1.817 1.00 0.00 C ATOM 1054 C ASN B 68 -9.956 1.342 -1.482 1.00 0.00 C ATOM 1055 O ASN B 68 -9.890 0.961 -0.313 1.00 0.00 O ATOM 1056 CB ASN B 68 -10.779 3.590 -0.814 1.00 0.00 C ATOM 1057 CG ASN B 68 -10.728 5.092 -1.003 1.00 0.00 C ATOM 1058 OD1 ASN B 68 -9.729 5.646 -1.463 1.00 0.00 O ATOM 1059 ND2 ASN B 68 -11.805 5.766 -0.637 1.00 0.00 N ATOM 0 H ASN B 68 -11.304 2.749 -3.389 1.00 0.00 H new ATOM 0 HA ASN B 68 -8.883 3.174 -1.746 1.00 0.00 H new ATOM 0 HB2 ASN B 68 -11.812 3.254 -0.905 1.00 0.00 H new ATOM 0 HB3 ASN B 68 -10.453 3.347 0.197 1.00 0.00 H new ATOM 0 HD21 ASN B 68 -11.828 6.781 -0.732 1.00 0.00 H new ATOM 0 HD22 ASN B 68 -12.613 5.271 -0.260 1.00 0.00 H new ATOM 1066 N SER B 69 -10.071 0.507 -2.501 1.00 0.00 N ATOM 1067 CA SER B 69 -10.165 -0.926 -2.287 1.00 0.00 C ATOM 1068 C SER B 69 -9.721 -1.697 -3.522 1.00 0.00 C ATOM 1069 O SER B 69 -9.967 -1.271 -4.651 1.00 0.00 O ATOM 1070 CB SER B 69 -11.601 -1.300 -1.914 1.00 0.00 C ATOM 1071 OG SER B 69 -12.533 -0.698 -2.798 1.00 0.00 O ATOM 0 H SER B 69 -10.101 0.795 -3.479 1.00 0.00 H new ATOM 0 HA SER B 69 -9.498 -1.196 -1.468 1.00 0.00 H new ATOM 0 HB2 SER B 69 -11.717 -2.383 -1.942 1.00 0.00 H new ATOM 0 HB3 SER B 69 -11.808 -0.984 -0.892 1.00 0.00 H new ATOM 0 HG SER B 69 -13.443 -0.954 -2.539 1.00 0.00 H new ATOM 1077 N TYR B 70 -9.054 -2.821 -3.300 1.00 0.00 N ATOM 1078 CA TYR B 70 -8.641 -3.700 -4.384 1.00 0.00 C ATOM 1079 C TYR B 70 -8.866 -5.153 -3.985 1.00 0.00 C ATOM 1080 O TYR B 70 -8.676 -5.521 -2.826 1.00 0.00 O ATOM 1081 CB TYR B 70 -7.165 -3.467 -4.734 1.00 0.00 C ATOM 1082 CG TYR B 70 -6.657 -4.343 -5.864 1.00 0.00 C ATOM 1083 CD1 TYR B 70 -7.010 -4.087 -7.183 1.00 0.00 C ATOM 1084 CD2 TYR B 70 -5.828 -5.428 -5.607 1.00 0.00 C ATOM 1085 CE1 TYR B 70 -6.553 -4.887 -8.214 1.00 0.00 C ATOM 1086 CE2 TYR B 70 -5.365 -6.232 -6.632 1.00 0.00 C ATOM 1087 CZ TYR B 70 -5.731 -5.957 -7.933 1.00 0.00 C ATOM 1088 OH TYR B 70 -5.274 -6.760 -8.956 1.00 0.00 O ATOM 0 H TYR B 70 -8.786 -3.147 -2.371 1.00 0.00 H new ATOM 0 HA TYR B 70 -9.241 -3.476 -5.266 1.00 0.00 H new ATOM 0 HB2 TYR B 70 -7.027 -2.421 -5.008 1.00 0.00 H new ATOM 0 HB3 TYR B 70 -6.558 -3.647 -3.847 1.00 0.00 H new ATOM 0 HD1 TYR B 70 -7.653 -3.248 -7.407 1.00 0.00 H new ATOM 0 HD2 TYR B 70 -5.540 -5.647 -4.589 1.00 0.00 H new ATOM 0 HE1 TYR B 70 -6.839 -4.675 -9.234 1.00 0.00 H new ATOM 0 HE2 TYR B 70 -4.720 -7.071 -6.415 1.00 0.00 H new ATOM 0 HH TYR B 70 -4.705 -7.468 -8.587 1.00 0.00 H new ATOM 1098 N THR B 71 -9.282 -5.968 -4.940 1.00 0.00 N ATOM 1099 CA THR B 71 -9.505 -7.379 -4.684 1.00 0.00 C ATOM 1100 C THR B 71 -8.273 -8.189 -5.080 1.00 0.00 C ATOM 1101 O THR B 71 -8.055 -8.470 -6.258 1.00 0.00 O ATOM 1102 CB THR B 71 -10.735 -7.888 -5.457 1.00 0.00 C ATOM 1103 OG1 THR B 71 -11.847 -7.019 -5.213 1.00 0.00 O ATOM 1104 CG2 THR B 71 -11.098 -9.307 -5.038 1.00 0.00 C ATOM 0 H THR B 71 -9.472 -5.676 -5.899 1.00 0.00 H new ATOM 0 HA THR B 71 -9.689 -7.505 -3.617 1.00 0.00 H new ATOM 0 HB THR B 71 -10.493 -7.895 -6.520 1.00 0.00 H new ATOM 0 HG1 THR B 71 -12.629 -7.342 -5.707 1.00 0.00 H new ATOM 0 HG21 THR B 71 -11.970 -9.640 -5.600 1.00 0.00 H new ATOM 0 HG22 THR B 71 -10.259 -9.972 -5.242 1.00 0.00 H new ATOM 0 HG23 THR B 71 -11.325 -9.325 -3.972 1.00 0.00 H new ATOM 1112 N ILE B 72 -7.458 -8.541 -4.094 1.00 0.00 N ATOM 1113 CA ILE B 72 -6.255 -9.324 -4.341 1.00 0.00 C ATOM 1114 C ILE B 72 -6.610 -10.793 -4.491 1.00 0.00 C ATOM 1115 O ILE B 72 -7.180 -11.394 -3.580 1.00 0.00 O ATOM 1116 CB ILE B 72 -5.221 -9.183 -3.204 1.00 0.00 C ATOM 1117 CG1 ILE B 72 -4.814 -7.723 -3.012 1.00 0.00 C ATOM 1118 CG2 ILE B 72 -3.996 -10.040 -3.496 1.00 0.00 C ATOM 1119 CD1 ILE B 72 -3.830 -7.517 -1.879 1.00 0.00 C ATOM 0 H ILE B 72 -7.609 -8.296 -3.115 1.00 0.00 H new ATOM 0 HA ILE B 72 -5.812 -8.939 -5.259 1.00 0.00 H new ATOM 0 HB ILE B 72 -5.682 -9.530 -2.280 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -4.374 -7.351 -3.937 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -5.706 -7.127 -2.821 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -3.275 -9.931 -2.686 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -4.294 -11.085 -3.578 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -3.541 -9.718 -4.433 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -3.584 -6.458 -1.799 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -4.275 -7.858 -0.944 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -2.922 -8.086 -2.078 1.00 0.00 H new ATOM 1131 N LYS B 73 -6.282 -11.361 -5.636 1.00 0.00 N ATOM 1132 CA LYS B 73 -6.565 -12.758 -5.898 1.00 0.00 C ATOM 1133 C LYS B 73 -5.271 -13.559 -5.926 1.00 0.00 C ATOM 1134 O LYS B 73 -4.294 -13.154 -6.558 1.00 0.00 O ATOM 1135 CB LYS B 73 -7.314 -12.898 -7.224 1.00 0.00 C ATOM 1136 CG LYS B 73 -8.607 -12.098 -7.271 1.00 0.00 C ATOM 1137 CD LYS B 73 -9.220 -12.105 -8.659 1.00 0.00 C ATOM 1138 CE LYS B 73 -10.441 -11.204 -8.731 1.00 0.00 C ATOM 1139 NZ LYS B 73 -10.975 -11.099 -10.115 1.00 0.00 N ATOM 0 H LYS B 73 -5.817 -10.873 -6.402 1.00 0.00 H new ATOM 0 HA LYS B 73 -7.195 -13.150 -5.099 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -6.664 -12.573 -8.037 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -7.539 -13.950 -7.397 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -9.318 -12.513 -6.557 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -8.411 -11.070 -6.965 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -8.479 -11.775 -9.387 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -9.501 -13.123 -8.929 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -11.217 -11.592 -8.071 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -10.180 -10.210 -8.367 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -11.807 -10.475 -10.120 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -10.243 -10.705 -10.740 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -11.248 -12.043 -10.454 1.00 0.00 H new ATOM 1153 N GLY B 74 -5.264 -14.682 -5.226 1.00 0.00 N ATOM 1154 CA GLY B 74 -4.080 -15.509 -5.161 1.00 0.00 C ATOM 1155 C GLY B 74 -3.499 -15.583 -3.761 1.00 0.00 C ATOM 1156 O GLY B 74 -2.320 -15.884 -3.592 1.00 0.00 O ATOM 0 H GLY B 74 -6.062 -15.036 -4.699 1.00 0.00 H new ATOM 0 HA2 GLY B 74 -4.324 -16.515 -5.503 1.00 0.00 H new ATOM 0 HA3 GLY B 74 -3.327 -15.114 -5.843 1.00 0.00 H new ATOM 1160 N LEU B 75 -4.314 -15.285 -2.756 1.00 0.00 N ATOM 1161 CA LEU B 75 -3.878 -15.382 -1.364 1.00 0.00 C ATOM 1162 C LEU B 75 -4.474 -16.611 -0.694 1.00 0.00 C ATOM 1163 O LEU B 75 -5.627 -16.952 -0.936 1.00 0.00 O ATOM 1164 CB LEU B 75 -4.275 -14.132 -0.575 1.00 0.00 C ATOM 1165 CG LEU B 75 -3.670 -12.820 -1.067 1.00 0.00 C ATOM 1166 CD1 LEU B 75 -4.008 -11.697 -0.105 1.00 0.00 C ATOM 1167 CD2 LEU B 75 -2.163 -12.951 -1.229 1.00 0.00 C ATOM 0 H LEU B 75 -5.278 -14.975 -2.876 1.00 0.00 H new ATOM 0 HA LEU B 75 -2.791 -15.468 -1.368 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -5.361 -14.041 -0.596 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -3.988 -14.275 0.467 1.00 0.00 H new ATOM 0 HG LEU B 75 -4.096 -12.584 -2.042 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -3.572 -10.765 -0.465 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -5.091 -11.589 -0.038 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -3.605 -11.929 0.881 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -1.751 -12.005 -1.580 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -1.715 -13.208 -0.269 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -1.942 -13.735 -1.954 1.00 0.00 H new ATOM 1179 N LYS B 76 -3.693 -17.274 0.147 1.00 0.00 N ATOM 1180 CA LYS B 76 -4.194 -18.412 0.906 1.00 0.00 C ATOM 1181 C LYS B 76 -4.514 -17.995 2.341 1.00 0.00 C ATOM 1182 O LYS B 76 -3.636 -17.518 3.062 1.00 0.00 O ATOM 1183 CB LYS B 76 -3.164 -19.544 0.925 1.00 0.00 C ATOM 1184 CG LYS B 76 -2.797 -20.079 -0.450 1.00 0.00 C ATOM 1185 CD LYS B 76 -1.799 -21.222 -0.342 1.00 0.00 C ATOM 1186 CE LYS B 76 -1.406 -21.769 -1.705 1.00 0.00 C ATOM 1187 NZ LYS B 76 -0.628 -20.786 -2.506 1.00 0.00 N ATOM 0 H LYS B 76 -2.714 -17.045 0.321 1.00 0.00 H new ATOM 0 HA LYS B 76 -5.104 -18.766 0.421 1.00 0.00 H new ATOM 0 HB2 LYS B 76 -2.259 -19.188 1.417 1.00 0.00 H new ATOM 0 HB3 LYS B 76 -3.553 -20.364 1.529 1.00 0.00 H new ATOM 0 HG2 LYS B 76 -3.696 -20.423 -0.962 1.00 0.00 H new ATOM 0 HG3 LYS B 76 -2.373 -19.277 -1.055 1.00 0.00 H new ATOM 0 HD2 LYS B 76 -0.907 -20.876 0.180 1.00 0.00 H new ATOM 0 HD3 LYS B 76 -2.229 -22.023 0.259 1.00 0.00 H new ATOM 0 HE2 LYS B 76 -0.815 -22.676 -1.573 1.00 0.00 H new ATOM 0 HE3 LYS B 76 -2.305 -22.051 -2.254 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 -0.282 -21.242 -3.374 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 -1.238 -19.982 -2.757 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 0.181 -20.446 -1.948 1.00 0.00 H new ATOM 1201 N PRO B 77 -5.772 -18.169 2.777 1.00 0.00 N ATOM 1202 CA PRO B 77 -6.182 -17.877 4.152 1.00 0.00 C ATOM 1203 C PRO B 77 -5.472 -18.779 5.155 1.00 0.00 C ATOM 1204 O PRO B 77 -5.625 -20.002 5.130 1.00 0.00 O ATOM 1205 CB PRO B 77 -7.689 -18.158 4.159 1.00 0.00 C ATOM 1206 CG PRO B 77 -8.091 -18.149 2.725 1.00 0.00 C ATOM 1207 CD PRO B 77 -6.897 -18.636 1.958 1.00 0.00 C ATOM 0 HA PRO B 77 -5.933 -16.856 4.442 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -7.909 -19.119 4.624 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -8.229 -17.399 4.725 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -8.953 -18.795 2.557 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -8.377 -17.147 2.406 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -6.898 -19.721 1.854 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -6.865 -18.219 0.951 1.00 0.00 H new ATOM 1215 N GLY B 78 -4.704 -18.170 6.039 1.00 0.00 N ATOM 1216 CA GLY B 78 -3.920 -18.926 6.990 1.00 0.00 C ATOM 1217 C GLY B 78 -2.444 -18.714 6.754 1.00 0.00 C ATOM 1218 O GLY B 78 -1.628 -18.850 7.666 1.00 0.00 O ATOM 0 H GLY B 78 -4.608 -17.157 6.116 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -4.178 -18.622 8.005 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -4.158 -19.986 6.904 1.00 0.00 H new ATOM 1222 N VAL B 79 -2.112 -18.361 5.523 1.00 0.00 N ATOM 1223 CA VAL B 79 -0.739 -18.079 5.149 1.00 0.00 C ATOM 1224 C VAL B 79 -0.461 -16.592 5.320 1.00 0.00 C ATOM 1225 O VAL B 79 -1.265 -15.752 4.921 1.00 0.00 O ATOM 1226 CB VAL B 79 -0.458 -18.501 3.689 1.00 0.00 C ATOM 1227 CG1 VAL B 79 0.982 -18.228 3.303 1.00 0.00 C ATOM 1228 CG2 VAL B 79 -0.773 -19.971 3.487 1.00 0.00 C ATOM 0 H VAL B 79 -2.783 -18.263 4.761 1.00 0.00 H new ATOM 0 HA VAL B 79 -0.081 -18.655 5.799 1.00 0.00 H new ATOM 0 HB VAL B 79 -1.106 -17.905 3.046 1.00 0.00 H new ATOM 0 HG11 VAL B 79 1.147 -18.536 2.270 1.00 0.00 H new ATOM 0 HG12 VAL B 79 1.189 -17.162 3.401 1.00 0.00 H new ATOM 0 HG13 VAL B 79 1.647 -18.789 3.959 1.00 0.00 H new ATOM 0 HG21 VAL B 79 -0.569 -20.248 2.453 1.00 0.00 H new ATOM 0 HG22 VAL B 79 -0.153 -20.571 4.153 1.00 0.00 H new ATOM 0 HG23 VAL B 79 -1.825 -20.152 3.710 1.00 0.00 H new ATOM 1238 N VAL B 80 0.663 -16.273 5.939 1.00 0.00 N ATOM 1239 CA VAL B 80 1.024 -14.888 6.178 1.00 0.00 C ATOM 1240 C VAL B 80 1.674 -14.267 4.940 1.00 0.00 C ATOM 1241 O VAL B 80 2.583 -14.840 4.338 1.00 0.00 O ATOM 1242 CB VAL B 80 1.954 -14.748 7.408 1.00 0.00 C ATOM 1243 CG1 VAL B 80 3.145 -15.690 7.310 1.00 0.00 C ATOM 1244 CG2 VAL B 80 2.413 -13.307 7.584 1.00 0.00 C ATOM 0 H VAL B 80 1.340 -16.954 6.284 1.00 0.00 H new ATOM 0 HA VAL B 80 0.103 -14.345 6.391 1.00 0.00 H new ATOM 0 HB VAL B 80 1.380 -15.029 8.291 1.00 0.00 H new ATOM 0 HG11 VAL B 80 3.779 -15.568 8.188 1.00 0.00 H new ATOM 0 HG12 VAL B 80 2.791 -16.720 7.258 1.00 0.00 H new ATOM 0 HG13 VAL B 80 3.719 -15.458 6.413 1.00 0.00 H new ATOM 0 HG21 VAL B 80 3.065 -13.237 8.455 1.00 0.00 H new ATOM 0 HG22 VAL B 80 2.958 -12.988 6.696 1.00 0.00 H new ATOM 0 HG23 VAL B 80 1.545 -12.664 7.728 1.00 0.00 H new ATOM 1254 N TYR B 81 1.180 -13.104 4.553 1.00 0.00 N ATOM 1255 CA TYR B 81 1.721 -12.372 3.420 1.00 0.00 C ATOM 1256 C TYR B 81 2.090 -10.960 3.843 1.00 0.00 C ATOM 1257 O TYR B 81 1.497 -10.411 4.773 1.00 0.00 O ATOM 1258 CB TYR B 81 0.704 -12.300 2.276 1.00 0.00 C ATOM 1259 CG TYR B 81 0.351 -13.632 1.653 1.00 0.00 C ATOM 1260 CD1 TYR B 81 1.081 -14.136 0.585 1.00 0.00 C ATOM 1261 CD2 TYR B 81 -0.723 -14.377 2.122 1.00 0.00 C ATOM 1262 CE1 TYR B 81 0.751 -15.344 0.003 1.00 0.00 C ATOM 1263 CE2 TYR B 81 -1.057 -15.586 1.548 1.00 0.00 C ATOM 1264 CZ TYR B 81 -0.319 -16.065 0.488 1.00 0.00 C ATOM 1265 OH TYR B 81 -0.657 -17.267 -0.092 1.00 0.00 O ATOM 0 H TYR B 81 0.396 -12.641 5.013 1.00 0.00 H new ATOM 0 HA TYR B 81 2.608 -12.901 3.072 1.00 0.00 H new ATOM 0 HB2 TYR B 81 -0.209 -11.837 2.650 1.00 0.00 H new ATOM 0 HB3 TYR B 81 1.099 -11.645 1.499 1.00 0.00 H new ATOM 0 HD1 TYR B 81 1.921 -13.574 0.203 1.00 0.00 H new ATOM 0 HD2 TYR B 81 -1.307 -14.003 2.950 1.00 0.00 H new ATOM 0 HE1 TYR B 81 1.328 -15.722 -0.828 1.00 0.00 H new ATOM 0 HE2 TYR B 81 -1.893 -16.154 1.928 1.00 0.00 H new ATOM 0 HH TYR B 81 -0.598 -17.981 0.577 1.00 0.00 H new ATOM 1275 N GLU B 82 3.060 -10.377 3.157 1.00 0.00 N ATOM 1276 CA GLU B 82 3.404 -8.980 3.365 1.00 0.00 C ATOM 1277 C GLU B 82 2.820 -8.146 2.242 1.00 0.00 C ATOM 1278 O GLU B 82 2.881 -8.541 1.077 1.00 0.00 O ATOM 1279 CB GLU B 82 4.918 -8.773 3.386 1.00 0.00 C ATOM 1280 CG GLU B 82 5.648 -9.557 4.454 1.00 0.00 C ATOM 1281 CD GLU B 82 7.084 -9.101 4.610 1.00 0.00 C ATOM 1282 OE1 GLU B 82 7.409 -8.486 5.650 1.00 0.00 O ATOM 1283 OE2 GLU B 82 7.896 -9.345 3.696 1.00 0.00 O ATOM 0 H GLU B 82 3.623 -10.850 2.451 1.00 0.00 H new ATOM 0 HA GLU B 82 2.996 -8.675 4.329 1.00 0.00 H new ATOM 0 HB2 GLU B 82 5.322 -9.048 2.412 1.00 0.00 H new ATOM 0 HB3 GLU B 82 5.124 -7.712 3.528 1.00 0.00 H new ATOM 0 HG2 GLU B 82 5.127 -9.446 5.405 1.00 0.00 H new ATOM 0 HG3 GLU B 82 5.630 -10.617 4.202 1.00 0.00 H new ATOM 1290 N GLY B 83 2.256 -7.006 2.593 1.00 0.00 N ATOM 1291 CA GLY B 83 1.686 -6.127 1.601 1.00 0.00 C ATOM 1292 C GLY B 83 2.144 -4.699 1.788 1.00 0.00 C ATOM 1293 O GLY B 83 2.333 -4.242 2.914 1.00 0.00 O ATOM 0 H GLY B 83 2.182 -6.672 3.554 1.00 0.00 H new ATOM 0 HA2 GLY B 83 1.967 -6.471 0.606 1.00 0.00 H new ATOM 0 HA3 GLY B 83 0.598 -6.171 1.658 1.00 0.00 H new ATOM 1297 N GLN B 84 2.338 -3.995 0.692 1.00 0.00 N ATOM 1298 CA GLN B 84 2.740 -2.601 0.747 1.00 0.00 C ATOM 1299 C GLN B 84 1.958 -1.781 -0.269 1.00 0.00 C ATOM 1300 O GLN B 84 1.814 -2.179 -1.427 1.00 0.00 O ATOM 1301 CB GLN B 84 4.247 -2.462 0.508 1.00 0.00 C ATOM 1302 CG GLN B 84 4.723 -3.118 -0.776 1.00 0.00 C ATOM 1303 CD GLN B 84 6.207 -2.939 -1.012 1.00 0.00 C ATOM 1304 OE1 GLN B 84 6.636 -1.975 -1.647 1.00 0.00 O ATOM 1305 NE2 GLN B 84 7.002 -3.863 -0.499 1.00 0.00 N ATOM 0 H GLN B 84 2.224 -4.365 -0.252 1.00 0.00 H new ATOM 0 HA GLN B 84 2.517 -2.219 1.743 1.00 0.00 H new ATOM 0 HB2 GLN B 84 4.506 -1.404 0.483 1.00 0.00 H new ATOM 0 HB3 GLN B 84 4.782 -2.901 1.350 1.00 0.00 H new ATOM 0 HG2 GLN B 84 4.491 -4.183 -0.742 1.00 0.00 H new ATOM 0 HG3 GLN B 84 4.173 -2.699 -1.618 1.00 0.00 H new ATOM 0 HE21 GLN B 84 6.605 -4.646 0.021 1.00 0.00 H new ATOM 0 HE22 GLN B 84 8.012 -3.793 -0.623 1.00 0.00 H new ATOM 1314 N LEU B 85 1.434 -0.654 0.185 1.00 0.00 N ATOM 1315 CA LEU B 85 0.677 0.244 -0.668 1.00 0.00 C ATOM 1316 C LEU B 85 1.511 1.489 -0.954 1.00 0.00 C ATOM 1317 O LEU B 85 1.727 2.319 -0.070 1.00 0.00 O ATOM 1318 CB LEU B 85 -0.652 0.607 0.019 1.00 0.00 C ATOM 1319 CG LEU B 85 -1.718 1.298 -0.851 1.00 0.00 C ATOM 1320 CD1 LEU B 85 -1.407 2.773 -1.046 1.00 0.00 C ATOM 1321 CD2 LEU B 85 -1.841 0.603 -2.198 1.00 0.00 C ATOM 0 H LEU B 85 1.521 -0.338 1.151 1.00 0.00 H new ATOM 0 HA LEU B 85 0.447 -0.241 -1.617 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -1.085 -0.307 0.425 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -0.430 1.258 0.865 1.00 0.00 H new ATOM 0 HG LEU B 85 -2.671 1.223 -0.327 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -2.180 3.229 -1.665 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -1.378 3.270 -0.076 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -0.440 2.879 -1.537 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -2.599 1.105 -2.799 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -0.883 0.642 -2.716 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -2.129 -0.437 -2.046 1.00 0.00 H new ATOM 1333 N ILE B 86 2.000 1.596 -2.181 1.00 0.00 N ATOM 1334 CA ILE B 86 2.820 2.731 -2.581 1.00 0.00 C ATOM 1335 C ILE B 86 1.977 3.727 -3.362 1.00 0.00 C ATOM 1336 O ILE B 86 1.473 3.415 -4.439 1.00 0.00 O ATOM 1337 CB ILE B 86 4.034 2.318 -3.455 1.00 0.00 C ATOM 1338 CG1 ILE B 86 4.830 1.172 -2.821 1.00 0.00 C ATOM 1339 CG2 ILE B 86 4.948 3.515 -3.682 1.00 0.00 C ATOM 1340 CD1 ILE B 86 4.262 -0.204 -3.092 1.00 0.00 C ATOM 0 H ILE B 86 1.843 0.909 -2.918 1.00 0.00 H new ATOM 0 HA ILE B 86 3.203 3.178 -1.664 1.00 0.00 H new ATOM 0 HB ILE B 86 3.645 1.967 -4.411 1.00 0.00 H new ATOM 0 HG12 ILE B 86 5.855 1.209 -3.191 1.00 0.00 H new ATOM 0 HG13 ILE B 86 4.874 1.328 -1.743 1.00 0.00 H new ATOM 0 HG21 ILE B 86 5.796 3.214 -4.296 1.00 0.00 H new ATOM 0 HG22 ILE B 86 4.394 4.304 -4.190 1.00 0.00 H new ATOM 0 HG23 ILE B 86 5.308 3.885 -2.722 1.00 0.00 H new ATOM 0 HD11 ILE B 86 4.885 -0.956 -2.608 1.00 0.00 H new ATOM 0 HD12 ILE B 86 3.248 -0.263 -2.697 1.00 0.00 H new ATOM 0 HD13 ILE B 86 4.244 -0.385 -4.167 1.00 0.00 H new ATOM 1352 N SER B 87 1.812 4.917 -2.817 1.00 0.00 N ATOM 1353 CA SER B 87 1.033 5.950 -3.476 1.00 0.00 C ATOM 1354 C SER B 87 1.944 6.907 -4.239 1.00 0.00 C ATOM 1355 O SER B 87 2.909 7.431 -3.681 1.00 0.00 O ATOM 1356 CB SER B 87 0.210 6.719 -2.446 1.00 0.00 C ATOM 1357 OG SER B 87 -0.568 5.834 -1.660 1.00 0.00 O ATOM 0 H SER B 87 2.207 5.194 -1.918 1.00 0.00 H new ATOM 0 HA SER B 87 0.359 5.474 -4.189 1.00 0.00 H new ATOM 0 HB2 SER B 87 0.873 7.297 -1.802 1.00 0.00 H new ATOM 0 HB3 SER B 87 -0.442 7.431 -2.953 1.00 0.00 H new ATOM 0 HG SER B 87 -1.453 6.226 -1.506 1.00 0.00 H new ATOM 1363 N ILE B 88 1.645 7.109 -5.515 1.00 0.00 N ATOM 1364 CA ILE B 88 2.395 8.048 -6.339 1.00 0.00 C ATOM 1365 C ILE B 88 1.624 9.356 -6.474 1.00 0.00 C ATOM 1366 O ILE B 88 0.552 9.394 -7.082 1.00 0.00 O ATOM 1367 CB ILE B 88 2.678 7.475 -7.748 1.00 0.00 C ATOM 1368 CG1 ILE B 88 3.441 6.148 -7.649 1.00 0.00 C ATOM 1369 CG2 ILE B 88 3.459 8.477 -8.590 1.00 0.00 C ATOM 1370 CD1 ILE B 88 4.786 6.256 -6.961 1.00 0.00 C ATOM 0 H ILE B 88 0.886 6.634 -6.003 1.00 0.00 H new ATOM 0 HA ILE B 88 3.350 8.227 -5.845 1.00 0.00 H new ATOM 0 HB ILE B 88 1.722 7.287 -8.237 1.00 0.00 H new ATOM 0 HG12 ILE B 88 2.826 5.427 -7.110 1.00 0.00 H new ATOM 0 HG13 ILE B 88 3.590 5.751 -8.653 1.00 0.00 H new ATOM 0 HG21 ILE B 88 3.647 8.054 -9.577 1.00 0.00 H new ATOM 0 HG22 ILE B 88 2.880 9.395 -8.693 1.00 0.00 H new ATOM 0 HG23 ILE B 88 4.409 8.699 -8.103 1.00 0.00 H new ATOM 0 HD11 ILE B 88 5.260 5.275 -6.932 1.00 0.00 H new ATOM 0 HD12 ILE B 88 5.421 6.950 -7.511 1.00 0.00 H new ATOM 0 HD13 ILE B 88 4.646 6.621 -5.944 1.00 0.00 H new ATOM 1382 N GLN B 89 2.161 10.420 -5.892 1.00 0.00 N ATOM 1383 CA GLN B 89 1.498 11.719 -5.912 1.00 0.00 C ATOM 1384 C GLN B 89 1.837 12.501 -7.175 1.00 0.00 C ATOM 1385 O GLN B 89 2.593 12.032 -8.026 1.00 0.00 O ATOM 1386 CB GLN B 89 1.903 12.546 -4.693 1.00 0.00 C ATOM 1387 CG GLN B 89 1.576 11.897 -3.360 1.00 0.00 C ATOM 1388 CD GLN B 89 2.090 12.713 -2.193 1.00 0.00 C ATOM 1389 OE1 GLN B 89 2.172 13.941 -2.262 1.00 0.00 O ATOM 1390 NE2 GLN B 89 2.465 12.041 -1.121 1.00 0.00 N ATOM 0 H GLN B 89 3.054 10.410 -5.400 1.00 0.00 H new ATOM 0 HA GLN B 89 0.424 11.532 -5.892 1.00 0.00 H new ATOM 0 HB2 GLN B 89 2.975 12.736 -4.738 1.00 0.00 H new ATOM 0 HB3 GLN B 89 1.405 13.514 -4.744 1.00 0.00 H new ATOM 0 HG2 GLN B 89 0.496 11.776 -3.271 1.00 0.00 H new ATOM 0 HG3 GLN B 89 2.013 10.899 -3.325 1.00 0.00 H new ATOM 0 HE21 GLN B 89 2.382 11.025 -1.101 1.00 0.00 H new ATOM 0 HE22 GLN B 89 2.838 12.538 -0.312 1.00 0.00 H new ATOM 1399 N GLN B 90 1.284 13.701 -7.281 1.00 0.00 N ATOM 1400 CA GLN B 90 1.575 14.587 -8.398 1.00 0.00 C ATOM 1401 C GLN B 90 3.037 15.026 -8.367 1.00 0.00 C ATOM 1402 O GLN B 90 3.716 15.053 -9.396 1.00 0.00 O ATOM 1403 CB GLN B 90 0.658 15.809 -8.341 1.00 0.00 C ATOM 1404 CG GLN B 90 0.865 16.786 -9.486 1.00 0.00 C ATOM 1405 CD GLN B 90 -0.090 17.962 -9.433 1.00 0.00 C ATOM 1406 OE1 GLN B 90 -0.474 18.507 -10.468 1.00 0.00 O ATOM 1407 NE2 GLN B 90 -0.475 18.369 -8.234 1.00 0.00 N ATOM 0 H GLN B 90 0.627 14.085 -6.602 1.00 0.00 H new ATOM 0 HA GLN B 90 1.397 14.048 -9.329 1.00 0.00 H new ATOM 0 HB2 GLN B 90 -0.379 15.474 -8.345 1.00 0.00 H new ATOM 0 HB3 GLN B 90 0.821 16.330 -7.397 1.00 0.00 H new ATOM 0 HG2 GLN B 90 1.890 17.155 -9.462 1.00 0.00 H new ATOM 0 HG3 GLN B 90 0.737 16.262 -10.433 1.00 0.00 H new ATOM 0 HE21 GLN B 90 -0.135 17.891 -7.400 1.00 0.00 H new ATOM 0 HE22 GLN B 90 -1.112 19.161 -8.144 1.00 0.00 H new ATOM 1416 N TYR B 91 3.523 15.336 -7.172 1.00 0.00 N ATOM 1417 CA TYR B 91 4.891 15.812 -6.997 1.00 0.00 C ATOM 1418 C TYR B 91 5.886 14.656 -6.967 1.00 0.00 C ATOM 1419 O TYR B 91 7.057 14.847 -6.655 1.00 0.00 O ATOM 1420 CB TYR B 91 5.013 16.626 -5.708 1.00 0.00 C ATOM 1421 CG TYR B 91 4.144 17.860 -5.685 1.00 0.00 C ATOM 1422 CD1 TYR B 91 4.374 18.913 -6.562 1.00 0.00 C ATOM 1423 CD2 TYR B 91 3.100 17.976 -4.781 1.00 0.00 C ATOM 1424 CE1 TYR B 91 3.586 20.046 -6.536 1.00 0.00 C ATOM 1425 CE2 TYR B 91 2.306 19.105 -4.751 1.00 0.00 C ATOM 1426 CZ TYR B 91 2.553 20.135 -5.629 1.00 0.00 C ATOM 1427 OH TYR B 91 1.764 21.262 -5.597 1.00 0.00 O ATOM 0 H TYR B 91 2.989 15.266 -6.306 1.00 0.00 H new ATOM 0 HA TYR B 91 5.128 16.447 -7.851 1.00 0.00 H new ATOM 0 HB2 TYR B 91 4.750 15.991 -4.862 1.00 0.00 H new ATOM 0 HB3 TYR B 91 6.053 16.922 -5.573 1.00 0.00 H new ATOM 0 HD1 TYR B 91 5.182 18.844 -7.275 1.00 0.00 H new ATOM 0 HD2 TYR B 91 2.904 17.170 -4.089 1.00 0.00 H new ATOM 0 HE1 TYR B 91 3.778 20.857 -7.222 1.00 0.00 H new ATOM 0 HE2 TYR B 91 1.495 19.179 -4.042 1.00 0.00 H new ATOM 0 HH TYR B 91 1.081 21.164 -4.901 1.00 0.00 H new ATOM 1437 N GLY B 92 5.412 13.456 -7.274 1.00 0.00 N ATOM 1438 CA GLY B 92 6.290 12.303 -7.317 1.00 0.00 C ATOM 1439 C GLY B 92 6.637 11.772 -5.941 1.00 0.00 C ATOM 1440 O GLY B 92 7.482 10.888 -5.810 1.00 0.00 O ATOM 0 H GLY B 92 4.435 13.260 -7.494 1.00 0.00 H new ATOM 0 HA2 GLY B 92 5.814 11.512 -7.896 1.00 0.00 H new ATOM 0 HA3 GLY B 92 7.208 12.572 -7.839 1.00 0.00 H new ATOM 1444 N HIS B 93 5.996 12.315 -4.912 1.00 0.00 N ATOM 1445 CA HIS B 93 6.198 11.823 -3.554 1.00 0.00 C ATOM 1446 C HIS B 93 5.652 10.412 -3.441 1.00 0.00 C ATOM 1447 O HIS B 93 4.468 10.180 -3.692 1.00 0.00 O ATOM 1448 CB HIS B 93 5.510 12.721 -2.520 1.00 0.00 C ATOM 1449 CG HIS B 93 6.116 14.083 -2.382 1.00 0.00 C ATOM 1450 ND1 HIS B 93 5.456 15.142 -1.796 1.00 0.00 N ATOM 1451 CD2 HIS B 93 7.330 14.557 -2.747 1.00 0.00 C ATOM 1452 CE1 HIS B 93 6.234 16.207 -1.810 1.00 0.00 C ATOM 1453 NE2 HIS B 93 7.376 15.878 -2.381 1.00 0.00 N ATOM 0 H HIS B 93 5.337 13.090 -4.991 1.00 0.00 H new ATOM 0 HA HIS B 93 7.268 11.831 -3.348 1.00 0.00 H new ATOM 0 HB2 HIS B 93 4.460 12.830 -2.793 1.00 0.00 H new ATOM 0 HB3 HIS B 93 5.538 12.225 -1.550 1.00 0.00 H new ATOM 0 HD2 HIS B 93 8.116 13.999 -3.235 1.00 0.00 H new ATOM 0 HE1 HIS B 93 5.979 17.182 -1.420 1.00 0.00 H new ATOM 0 HE2 HIS B 93 8.167 16.505 -2.527 1.00 0.00 H new ATOM 1462 N GLN B 94 6.514 9.473 -3.091 1.00 0.00 N ATOM 1463 CA GLN B 94 6.099 8.090 -2.963 1.00 0.00 C ATOM 1464 C GLN B 94 5.848 7.761 -1.505 1.00 0.00 C ATOM 1465 O GLN B 94 6.756 7.837 -0.672 1.00 0.00 O ATOM 1466 CB GLN B 94 7.167 7.154 -3.531 1.00 0.00 C ATOM 1467 CG GLN B 94 7.572 7.485 -4.957 1.00 0.00 C ATOM 1468 CD GLN B 94 8.607 6.525 -5.505 1.00 0.00 C ATOM 1469 OE1 GLN B 94 9.412 5.965 -4.759 1.00 0.00 O ATOM 1470 NE2 GLN B 94 8.602 6.339 -6.814 1.00 0.00 N ATOM 0 H GLN B 94 7.500 9.643 -2.892 1.00 0.00 H new ATOM 0 HA GLN B 94 5.178 7.949 -3.528 1.00 0.00 H new ATOM 0 HB2 GLN B 94 8.050 7.195 -2.893 1.00 0.00 H new ATOM 0 HB3 GLN B 94 6.796 6.130 -3.496 1.00 0.00 H new ATOM 0 HG2 GLN B 94 6.689 7.465 -5.596 1.00 0.00 H new ATOM 0 HG3 GLN B 94 7.968 8.500 -4.992 1.00 0.00 H new ATOM 0 HE21 GLN B 94 7.918 6.823 -7.395 1.00 0.00 H new ATOM 0 HE22 GLN B 94 9.283 5.712 -7.243 1.00 0.00 H new ATOM 1479 N GLU B 95 4.623 7.378 -1.206 1.00 0.00 N ATOM 1480 CA GLU B 95 4.235 7.044 0.151 1.00 0.00 C ATOM 1481 C GLU B 95 3.956 5.554 0.249 1.00 0.00 C ATOM 1482 O GLU B 95 3.023 5.053 -0.377 1.00 0.00 O ATOM 1483 CB GLU B 95 2.991 7.833 0.552 1.00 0.00 C ATOM 1484 CG GLU B 95 3.130 9.340 0.389 1.00 0.00 C ATOM 1485 CD GLU B 95 4.183 9.947 1.296 1.00 0.00 C ATOM 1486 OE1 GLU B 95 5.339 10.098 0.858 1.00 0.00 O ATOM 1487 OE2 GLU B 95 3.853 10.295 2.450 1.00 0.00 O ATOM 0 H GLU B 95 3.872 7.290 -1.891 1.00 0.00 H new ATOM 0 HA GLU B 95 5.049 7.304 0.828 1.00 0.00 H new ATOM 0 HB2 GLU B 95 2.148 7.490 -0.047 1.00 0.00 H new ATOM 0 HB3 GLU B 95 2.753 7.612 1.592 1.00 0.00 H new ATOM 0 HG2 GLU B 95 3.380 9.565 -0.648 1.00 0.00 H new ATOM 0 HG3 GLU B 95 2.169 9.811 0.594 1.00 0.00 H new ATOM 1494 N VAL B 96 4.770 4.849 1.015 1.00 0.00 N ATOM 1495 CA VAL B 96 4.632 3.407 1.139 1.00 0.00 C ATOM 1496 C VAL B 96 4.076 3.037 2.504 1.00 0.00 C ATOM 1497 O VAL B 96 4.760 3.158 3.523 1.00 0.00 O ATOM 1498 CB VAL B 96 5.981 2.687 0.929 1.00 0.00 C ATOM 1499 CG1 VAL B 96 5.792 1.177 0.925 1.00 0.00 C ATOM 1500 CG2 VAL B 96 6.650 3.157 -0.356 1.00 0.00 C ATOM 0 H VAL B 96 5.533 5.250 1.560 1.00 0.00 H new ATOM 0 HA VAL B 96 3.940 3.083 0.362 1.00 0.00 H new ATOM 0 HB VAL B 96 6.636 2.942 1.762 1.00 0.00 H new ATOM 0 HG11 VAL B 96 6.756 0.690 0.776 1.00 0.00 H new ATOM 0 HG12 VAL B 96 5.370 0.861 1.879 1.00 0.00 H new ATOM 0 HG13 VAL B 96 5.115 0.897 0.118 1.00 0.00 H new ATOM 0 HG21 VAL B 96 7.599 2.636 -0.484 1.00 0.00 H new ATOM 0 HG22 VAL B 96 6.001 2.941 -1.204 1.00 0.00 H new ATOM 0 HG23 VAL B 96 6.830 4.231 -0.301 1.00 0.00 H new ATOM 1510 N THR B 97 2.827 2.613 2.528 1.00 0.00 N ATOM 1511 CA THR B 97 2.207 2.144 3.753 1.00 0.00 C ATOM 1512 C THR B 97 2.161 0.621 3.753 1.00 0.00 C ATOM 1513 O THR B 97 1.541 0.008 2.882 1.00 0.00 O ATOM 1514 CB THR B 97 0.784 2.710 3.915 1.00 0.00 C ATOM 1515 OG1 THR B 97 0.802 4.132 3.730 1.00 0.00 O ATOM 1516 CG2 THR B 97 0.229 2.391 5.295 1.00 0.00 C ATOM 0 H THR B 97 2.219 2.584 1.709 1.00 0.00 H new ATOM 0 HA THR B 97 2.806 2.495 4.593 1.00 0.00 H new ATOM 0 HB THR B 97 0.145 2.247 3.163 1.00 0.00 H new ATOM 0 HG1 THR B 97 -0.027 4.518 4.083 1.00 0.00 H new ATOM 0 HG21 THR B 97 -0.777 2.801 5.386 1.00 0.00 H new ATOM 0 HG22 THR B 97 0.194 1.310 5.432 1.00 0.00 H new ATOM 0 HG23 THR B 97 0.871 2.833 6.057 1.00 0.00 H new ATOM 1524 N ARG B 98 2.834 0.011 4.714 1.00 0.00 N ATOM 1525 CA ARG B 98 2.942 -1.438 4.757 1.00 0.00 C ATOM 1526 C ARG B 98 1.869 -2.055 5.644 1.00 0.00 C ATOM 1527 O ARG B 98 1.380 -1.425 6.588 1.00 0.00 O ATOM 1528 CB ARG B 98 4.324 -1.857 5.251 1.00 0.00 C ATOM 1529 CG ARG B 98 5.462 -1.390 4.360 1.00 0.00 C ATOM 1530 CD ARG B 98 6.801 -1.877 4.881 1.00 0.00 C ATOM 1531 NE ARG B 98 7.913 -1.417 4.054 1.00 0.00 N ATOM 1532 CZ ARG B 98 9.103 -2.012 4.013 1.00 0.00 C ATOM 1533 NH1 ARG B 98 9.341 -3.078 4.771 1.00 0.00 N ATOM 1534 NH2 ARG B 98 10.055 -1.535 3.223 1.00 0.00 N ATOM 0 H ARG B 98 3.313 0.495 5.473 1.00 0.00 H new ATOM 0 HA ARG B 98 2.795 -1.805 3.741 1.00 0.00 H new ATOM 0 HB2 ARG B 98 4.476 -1.461 6.255 1.00 0.00 H new ATOM 0 HB3 ARG B 98 4.358 -2.944 5.328 1.00 0.00 H new ATOM 0 HG2 ARG B 98 5.308 -1.758 3.346 1.00 0.00 H new ATOM 0 HG3 ARG B 98 5.463 -0.301 4.308 1.00 0.00 H new ATOM 0 HD2 ARG B 98 6.941 -1.526 5.903 1.00 0.00 H new ATOM 0 HD3 ARG B 98 6.802 -2.966 4.915 1.00 0.00 H new ATOM 0 HE ARG B 98 7.769 -0.591 3.473 1.00 0.00 H new ATOM 0 HH11 ARG B 98 8.611 -3.441 5.385 1.00 0.00 H new ATOM 0 HH12 ARG B 98 10.253 -3.533 4.739 1.00 0.00 H new ATOM 0 HH21 ARG B 98 9.875 -0.713 2.647 1.00 0.00 H new ATOM 0 HH22 ARG B 98 10.967 -1.990 3.191 1.00 0.00 H new ATOM 1548 N PHE B 99 1.510 -3.286 5.321 1.00 0.00 N ATOM 1549 CA PHE B 99 0.547 -4.050 6.092 1.00 0.00 C ATOM 1550 C PHE B 99 0.844 -5.536 5.941 1.00 0.00 C ATOM 1551 O PHE B 99 1.645 -5.932 5.096 1.00 0.00 O ATOM 1552 CB PHE B 99 -0.889 -3.739 5.643 1.00 0.00 C ATOM 1553 CG PHE B 99 -1.170 -4.026 4.192 1.00 0.00 C ATOM 1554 CD1 PHE B 99 -1.704 -5.246 3.804 1.00 0.00 C ATOM 1555 CD2 PHE B 99 -0.912 -3.073 3.219 1.00 0.00 C ATOM 1556 CE1 PHE B 99 -1.970 -5.510 2.475 1.00 0.00 C ATOM 1557 CE2 PHE B 99 -1.176 -3.332 1.888 1.00 0.00 C ATOM 1558 CZ PHE B 99 -1.706 -4.552 1.515 1.00 0.00 C ATOM 0 H PHE B 99 1.881 -3.785 4.512 1.00 0.00 H new ATOM 0 HA PHE B 99 0.633 -3.769 7.142 1.00 0.00 H new ATOM 0 HB2 PHE B 99 -1.580 -4.319 6.255 1.00 0.00 H new ATOM 0 HB3 PHE B 99 -1.096 -2.687 5.838 1.00 0.00 H new ATOM 0 HD1 PHE B 99 -1.914 -5.998 4.550 1.00 0.00 H new ATOM 0 HD2 PHE B 99 -0.500 -2.117 3.505 1.00 0.00 H new ATOM 0 HE1 PHE B 99 -2.384 -6.465 2.186 1.00 0.00 H new ATOM 0 HE2 PHE B 99 -0.968 -2.581 1.140 1.00 0.00 H new ATOM 0 HZ PHE B 99 -1.914 -4.757 0.475 1.00 0.00 H new ATOM 1568 N ASP B 100 0.206 -6.352 6.758 1.00 0.00 N ATOM 1569 CA ASP B 100 0.423 -7.789 6.716 1.00 0.00 C ATOM 1570 C ASP B 100 -0.915 -8.502 6.677 1.00 0.00 C ATOM 1571 O ASP B 100 -1.921 -7.972 7.150 1.00 0.00 O ATOM 1572 CB ASP B 100 1.227 -8.264 7.937 1.00 0.00 C ATOM 1573 CG ASP B 100 2.635 -7.691 7.998 1.00 0.00 C ATOM 1574 OD1 ASP B 100 2.797 -6.549 8.483 1.00 0.00 O ATOM 1575 OD2 ASP B 100 3.590 -8.389 7.591 1.00 0.00 O ATOM 0 H ASP B 100 -0.468 -6.046 7.460 1.00 0.00 H new ATOM 0 HA ASP B 100 0.995 -8.024 5.819 1.00 0.00 H new ATOM 0 HB2 ASP B 100 0.691 -7.987 8.845 1.00 0.00 H new ATOM 0 HB3 ASP B 100 1.287 -9.352 7.922 1.00 0.00 H new ATOM 1580 N PHE B 101 -0.934 -9.692 6.108 1.00 0.00 N ATOM 1581 CA PHE B 101 -2.148 -10.489 6.049 1.00 0.00 C ATOM 1582 C PHE B 101 -1.874 -11.890 6.572 1.00 0.00 C ATOM 1583 O PHE B 101 -0.816 -12.458 6.315 1.00 0.00 O ATOM 1584 CB PHE B 101 -2.691 -10.541 4.613 1.00 0.00 C ATOM 1585 CG PHE B 101 -3.862 -11.471 4.440 1.00 0.00 C ATOM 1586 CD1 PHE B 101 -5.079 -11.193 5.039 1.00 0.00 C ATOM 1587 CD2 PHE B 101 -3.742 -12.623 3.679 1.00 0.00 C ATOM 1588 CE1 PHE B 101 -6.153 -12.048 4.885 1.00 0.00 C ATOM 1589 CE2 PHE B 101 -4.812 -13.480 3.520 1.00 0.00 C ATOM 1590 CZ PHE B 101 -6.020 -13.193 4.124 1.00 0.00 C ATOM 0 H PHE B 101 -0.120 -10.131 5.678 1.00 0.00 H new ATOM 0 HA PHE B 101 -2.906 -10.023 6.679 1.00 0.00 H new ATOM 0 HB2 PHE B 101 -2.988 -9.537 4.310 1.00 0.00 H new ATOM 0 HB3 PHE B 101 -1.890 -10.852 3.942 1.00 0.00 H new ATOM 0 HD1 PHE B 101 -5.190 -10.298 5.633 1.00 0.00 H new ATOM 0 HD2 PHE B 101 -2.799 -12.853 3.205 1.00 0.00 H new ATOM 0 HE1 PHE B 101 -7.096 -11.821 5.359 1.00 0.00 H new ATOM 0 HE2 PHE B 101 -4.705 -14.374 2.924 1.00 0.00 H new ATOM 0 HZ PHE B 101 -6.859 -13.862 4.002 1.00 0.00 H new ATOM 1600 N THR B 102 -2.820 -12.433 7.321 1.00 0.00 N ATOM 1601 CA THR B 102 -2.668 -13.758 7.896 1.00 0.00 C ATOM 1602 C THR B 102 -3.909 -14.604 7.622 1.00 0.00 C ATOM 1603 O THR B 102 -3.832 -15.658 6.994 1.00 0.00 O ATOM 1604 CB THR B 102 -2.427 -13.675 9.415 1.00 0.00 C ATOM 1605 OG1 THR B 102 -1.387 -12.727 9.698 1.00 0.00 O ATOM 1606 CG2 THR B 102 -2.044 -15.036 9.976 1.00 0.00 C ATOM 0 H THR B 102 -3.703 -11.975 7.545 1.00 0.00 H new ATOM 0 HA THR B 102 -1.802 -14.227 7.429 1.00 0.00 H new ATOM 0 HB THR B 102 -3.353 -13.350 9.890 1.00 0.00 H new ATOM 0 HG1 THR B 102 -1.242 -12.680 10.666 1.00 0.00 H new ATOM 0 HG21 THR B 102 -1.879 -14.953 11.050 1.00 0.00 H new ATOM 0 HG22 THR B 102 -2.848 -15.747 9.786 1.00 0.00 H new ATOM 0 HG23 THR B 102 -1.130 -15.384 9.494 1.00 0.00 H new ATOM 1614 N THR B 103 -5.054 -14.142 8.101 1.00 0.00 N ATOM 1615 CA THR B 103 -6.309 -14.843 7.885 1.00 0.00 C ATOM 1616 C THR B 103 -7.474 -13.861 7.918 1.00 0.00 C ATOM 1617 O THR B 103 -8.118 -13.615 6.901 1.00 0.00 O ATOM 1618 CB THR B 103 -6.533 -15.946 8.944 1.00 0.00 C ATOM 1619 OG1 THR B 103 -5.386 -16.802 9.002 1.00 0.00 O ATOM 1620 CG2 THR B 103 -7.769 -16.774 8.619 1.00 0.00 C ATOM 0 H THR B 103 -5.139 -13.282 8.643 1.00 0.00 H new ATOM 0 HA THR B 103 -6.256 -15.316 6.904 1.00 0.00 H new ATOM 0 HB THR B 103 -6.684 -15.465 9.910 1.00 0.00 H new ATOM 0 HG1 THR B 103 -5.532 -17.499 9.676 1.00 0.00 H new ATOM 0 HG21 THR B 103 -7.903 -17.543 9.380 1.00 0.00 H new ATOM 0 HG22 THR B 103 -8.646 -16.127 8.599 1.00 0.00 H new ATOM 0 HG23 THR B 103 -7.645 -17.246 7.645 1.00 0.00 H new ATOM 1628 N THR B 104 -7.731 -13.298 9.090 1.00 0.00 N ATOM 1629 CA THR B 104 -8.800 -12.327 9.269 1.00 0.00 C ATOM 1630 C THR B 104 -8.548 -11.517 10.539 1.00 0.00 C ATOM 1631 O THR B 104 -9.027 -11.864 11.618 1.00 0.00 O ATOM 1632 CB THR B 104 -10.188 -13.009 9.357 1.00 0.00 C ATOM 1633 OG1 THR B 104 -10.403 -13.849 8.214 1.00 0.00 O ATOM 1634 CG2 THR B 104 -11.302 -11.974 9.433 1.00 0.00 C ATOM 0 H THR B 104 -7.206 -13.501 9.941 1.00 0.00 H new ATOM 0 HA THR B 104 -8.804 -11.671 8.399 1.00 0.00 H new ATOM 0 HB THR B 104 -10.204 -13.613 10.264 1.00 0.00 H new ATOM 0 HG1 THR B 104 -9.818 -13.562 7.482 1.00 0.00 H new ATOM 0 HG21 THR B 104 -12.265 -12.480 9.494 1.00 0.00 H new ATOM 0 HG22 THR B 104 -11.162 -11.353 10.318 1.00 0.00 H new ATOM 0 HG23 THR B 104 -11.277 -11.347 8.542 1.00 0.00 H new ATOM 1642 N SER B 105 -7.775 -10.453 10.410 1.00 0.00 N ATOM 1643 CA SER B 105 -7.419 -9.626 11.554 1.00 0.00 C ATOM 1644 C SER B 105 -8.411 -8.479 11.734 1.00 0.00 C ATOM 1645 O SER B 105 -8.024 -7.313 11.824 1.00 0.00 O ATOM 1646 CB SER B 105 -6.001 -9.086 11.379 1.00 0.00 C ATOM 1647 OG SER B 105 -5.076 -10.148 11.201 1.00 0.00 O ATOM 0 H SER B 105 -7.380 -10.139 9.523 1.00 0.00 H new ATOM 0 HA SER B 105 -7.458 -10.242 12.452 1.00 0.00 H new ATOM 0 HB2 SER B 105 -5.965 -8.418 10.518 1.00 0.00 H new ATOM 0 HB3 SER B 105 -5.721 -8.496 12.252 1.00 0.00 H new ATOM 0 HG SER B 105 -4.174 -9.781 11.089 1.00 0.00 H new ATOM 1653 N THR B 106 -9.691 -8.820 11.778 1.00 0.00 N ATOM 1654 CA THR B 106 -10.736 -7.839 12.004 1.00 0.00 C ATOM 1655 C THR B 106 -11.822 -8.429 12.898 1.00 0.00 C ATOM 1656 O THR B 106 -12.818 -8.969 12.410 1.00 0.00 O ATOM 1657 CB THR B 106 -11.373 -7.365 10.680 1.00 0.00 C ATOM 1658 OG1 THR B 106 -10.351 -6.967 9.754 1.00 0.00 O ATOM 1659 CG2 THR B 106 -12.316 -6.196 10.926 1.00 0.00 C ATOM 0 H THR B 106 -10.029 -9.775 11.659 1.00 0.00 H new ATOM 0 HA THR B 106 -10.276 -6.979 12.490 1.00 0.00 H new ATOM 0 HB THR B 106 -11.941 -8.195 10.259 1.00 0.00 H new ATOM 0 HG1 THR B 106 -10.766 -6.670 8.917 1.00 0.00 H new ATOM 0 HG21 THR B 106 -12.754 -5.877 9.980 1.00 0.00 H new ATOM 0 HG22 THR B 106 -13.109 -6.505 11.608 1.00 0.00 H new ATOM 0 HG23 THR B 106 -11.761 -5.368 11.367 1.00 0.00 H new ATOM 1667 N SER B 107 -11.613 -8.346 14.202 1.00 0.00 N ATOM 1668 CA SER B 107 -12.576 -8.853 15.165 1.00 0.00 C ATOM 1669 C SER B 107 -13.799 -7.944 15.218 1.00 0.00 C ATOM 1670 O SER B 107 -13.882 -7.039 16.052 1.00 0.00 O ATOM 1671 CB SER B 107 -11.925 -8.957 16.545 1.00 0.00 C ATOM 1672 OG SER B 107 -10.738 -9.731 16.487 1.00 0.00 O ATOM 0 H SER B 107 -10.780 -7.930 14.619 1.00 0.00 H new ATOM 0 HA SER B 107 -12.900 -9.846 14.854 1.00 0.00 H new ATOM 0 HB2 SER B 107 -11.696 -7.959 16.920 1.00 0.00 H new ATOM 0 HB3 SER B 107 -12.624 -9.409 17.249 1.00 0.00 H new ATOM 0 HG SER B 107 -10.337 -9.783 17.380 1.00 0.00 H new ATOM 1678 N THR B 108 -14.730 -8.173 14.305 1.00 0.00 N ATOM 1679 CA THR B 108 -15.950 -7.393 14.234 1.00 0.00 C ATOM 1680 C THR B 108 -16.846 -7.679 15.434 1.00 0.00 C ATOM 1681 O THR B 108 -17.190 -8.832 15.698 1.00 0.00 O ATOM 1682 CB THR B 108 -16.717 -7.702 12.933 1.00 0.00 C ATOM 1683 OG1 THR B 108 -16.842 -9.122 12.765 1.00 0.00 O ATOM 1684 CG2 THR B 108 -16.004 -7.106 11.729 1.00 0.00 C ATOM 0 H THR B 108 -14.659 -8.903 13.596 1.00 0.00 H new ATOM 0 HA THR B 108 -15.673 -6.339 14.243 1.00 0.00 H new ATOM 0 HB THR B 108 -17.708 -7.254 13.006 1.00 0.00 H new ATOM 0 HG1 THR B 108 -16.932 -9.549 13.643 1.00 0.00 H new ATOM 0 HG21 THR B 108 -16.564 -7.337 10.823 1.00 0.00 H new ATOM 0 HG22 THR B 108 -15.934 -6.025 11.846 1.00 0.00 H new ATOM 0 HG23 THR B 108 -15.002 -7.528 11.654 1.00 0.00 H new ATOM 1692 N PRO B 109 -17.217 -6.634 16.189 1.00 0.00 N ATOM 1693 CA PRO B 109 -18.097 -6.778 17.347 1.00 0.00 C ATOM 1694 C PRO B 109 -19.479 -7.276 16.943 1.00 0.00 C ATOM 1695 O PRO B 109 -20.078 -6.767 15.989 1.00 0.00 O ATOM 1696 CB PRO B 109 -18.186 -5.364 17.928 1.00 0.00 C ATOM 1697 CG PRO B 109 -17.781 -4.458 16.816 1.00 0.00 C ATOM 1698 CD PRO B 109 -16.807 -5.234 15.977 1.00 0.00 C ATOM 0 HA PRO B 109 -17.715 -7.509 18.060 1.00 0.00 H new ATOM 0 HB2 PRO B 109 -19.197 -5.141 18.269 1.00 0.00 H new ATOM 0 HB3 PRO B 109 -17.527 -5.250 18.789 1.00 0.00 H new ATOM 0 HG2 PRO B 109 -18.646 -4.154 16.227 1.00 0.00 H new ATOM 0 HG3 PRO B 109 -17.323 -3.548 17.203 1.00 0.00 H new ATOM 0 HD2 PRO B 109 -16.868 -4.952 14.926 1.00 0.00 H new ATOM 0 HD3 PRO B 109 -15.778 -5.064 16.294 1.00 0.00 H new ATOM 1706 N GLY B 110 -19.973 -8.272 17.661 1.00 0.00 N ATOM 1707 CA GLY B 110 -21.269 -8.842 17.355 1.00 0.00 C ATOM 1708 C GLY B 110 -22.407 -7.965 17.827 1.00 0.00 C ATOM 1709 O GLY B 110 -23.109 -8.301 18.778 1.00 0.00 O ATOM 0 H GLY B 110 -19.496 -8.699 18.456 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -21.352 -8.993 16.279 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -21.351 -9.823 17.822 1.00 0.00 H new ATOM 1713 N SER B 111 -22.565 -6.824 17.180 1.00 0.00 N ATOM 1714 CA SER B 111 -23.638 -5.903 17.495 1.00 0.00 C ATOM 1715 C SER B 111 -24.097 -5.186 16.233 1.00 0.00 C ATOM 1716 O SER B 111 -23.405 -4.311 15.713 1.00 0.00 O ATOM 1717 CB SER B 111 -23.178 -4.894 18.548 1.00 0.00 C ATOM 1718 OG SER B 111 -22.860 -5.545 19.770 1.00 0.00 O ATOM 0 H SER B 111 -21.955 -6.512 16.425 1.00 0.00 H new ATOM 0 HA SER B 111 -24.479 -6.465 17.902 1.00 0.00 H new ATOM 0 HB2 SER B 111 -22.305 -4.353 18.182 1.00 0.00 H new ATOM 0 HB3 SER B 111 -23.962 -4.156 18.718 1.00 0.00 H new ATOM 0 HG SER B 111 -22.567 -4.881 20.428 1.00 0.00 H new ATOM 1724 N ARG B 112 -25.267 -5.573 15.746 1.00 0.00 N ATOM 1725 CA ARG B 112 -25.835 -5.006 14.528 1.00 0.00 C ATOM 1726 C ARG B 112 -26.496 -3.662 14.820 1.00 0.00 C ATOM 1727 O ARG B 112 -27.703 -3.494 14.642 1.00 0.00 O ATOM 1728 CB ARG B 112 -26.849 -5.984 13.932 1.00 0.00 C ATOM 1729 CG ARG B 112 -26.228 -7.292 13.467 1.00 0.00 C ATOM 1730 CD ARG B 112 -27.279 -8.372 13.271 1.00 0.00 C ATOM 1731 NE ARG B 112 -27.902 -8.758 14.538 1.00 0.00 N ATOM 1732 CZ ARG B 112 -28.898 -9.635 14.648 1.00 0.00 C ATOM 1733 NH1 ARG B 112 -29.408 -10.214 13.567 1.00 0.00 N ATOM 1734 NH2 ARG B 112 -29.385 -9.929 15.846 1.00 0.00 N ATOM 0 H ARG B 112 -25.850 -6.288 16.182 1.00 0.00 H new ATOM 0 HA ARG B 112 -25.035 -4.839 13.807 1.00 0.00 H new ATOM 0 HB2 ARG B 112 -27.615 -6.199 14.677 1.00 0.00 H new ATOM 0 HB3 ARG B 112 -27.349 -5.508 13.088 1.00 0.00 H new ATOM 0 HG2 ARG B 112 -25.694 -7.129 12.531 1.00 0.00 H new ATOM 0 HG3 ARG B 112 -25.493 -7.627 14.199 1.00 0.00 H new ATOM 0 HD2 ARG B 112 -28.045 -8.014 12.583 1.00 0.00 H new ATOM 0 HD3 ARG B 112 -26.820 -9.247 12.810 1.00 0.00 H new ATOM 0 HE ARG B 112 -27.550 -8.327 15.393 1.00 0.00 H new ATOM 0 HH11 ARG B 112 -29.037 -9.988 12.644 1.00 0.00 H new ATOM 0 HH12 ARG B 112 -30.171 -10.885 13.660 1.00 0.00 H new ATOM 0 HH21 ARG B 112 -28.997 -9.484 16.678 1.00 0.00 H new ATOM 0 HH22 ARG B 112 -30.148 -10.600 15.936 1.00 0.00 H new ATOM 1748 N SER B 113 -25.693 -2.713 15.275 1.00 0.00 N ATOM 1749 CA SER B 113 -26.184 -1.395 15.636 1.00 0.00 C ATOM 1750 C SER B 113 -25.053 -0.372 15.531 1.00 0.00 C ATOM 1751 O SER B 113 -24.749 0.347 16.483 1.00 0.00 O ATOM 1752 CB SER B 113 -26.760 -1.427 17.058 1.00 0.00 C ATOM 1753 OG SER B 113 -27.352 -0.188 17.414 1.00 0.00 O ATOM 0 H SER B 113 -24.688 -2.835 15.403 1.00 0.00 H new ATOM 0 HA SER B 113 -26.977 -1.102 14.948 1.00 0.00 H new ATOM 0 HB2 SER B 113 -27.504 -2.220 17.131 1.00 0.00 H new ATOM 0 HB3 SER B 113 -25.967 -1.668 17.766 1.00 0.00 H new ATOM 0 HG SER B 113 -27.709 -0.246 18.325 1.00 0.00 H new ATOM 1759 N HIS B 114 -24.428 -0.312 14.367 1.00 0.00 N ATOM 1760 CA HIS B 114 -23.308 0.593 14.152 1.00 0.00 C ATOM 1761 C HIS B 114 -23.783 1.957 13.667 1.00 0.00 C ATOM 1762 O HIS B 114 -23.640 2.303 12.494 1.00 0.00 O ATOM 1763 CB HIS B 114 -22.307 -0.008 13.163 1.00 0.00 C ATOM 1764 CG HIS B 114 -21.437 -1.062 13.769 1.00 0.00 C ATOM 1765 ND1 HIS B 114 -21.533 -2.402 13.458 1.00 0.00 N ATOM 1766 CD2 HIS B 114 -20.436 -0.961 14.673 1.00 0.00 C ATOM 1767 CE1 HIS B 114 -20.629 -3.074 14.145 1.00 0.00 C ATOM 1768 NE2 HIS B 114 -19.948 -2.224 14.890 1.00 0.00 N ATOM 0 H HIS B 114 -24.676 -0.878 13.556 1.00 0.00 H new ATOM 0 HA HIS B 114 -22.807 0.733 15.110 1.00 0.00 H new ATOM 0 HB2 HIS B 114 -22.851 -0.436 12.321 1.00 0.00 H new ATOM 0 HB3 HIS B 114 -21.678 0.788 12.765 1.00 0.00 H new ATOM 0 HD1 HIS B 114 -22.198 -2.809 12.801 1.00 0.00 H new ATOM 0 HD2 HIS B 114 -20.085 -0.052 15.139 1.00 0.00 H new ATOM 0 HE1 HIS B 114 -20.472 -4.142 14.104 1.00 0.00 H new ATOM 1777 N HIS B 115 -24.356 2.723 14.583 1.00 0.00 N ATOM 1778 CA HIS B 115 -24.751 4.093 14.292 1.00 0.00 C ATOM 1779 C HIS B 115 -23.965 5.053 15.184 1.00 0.00 C ATOM 1780 O HIS B 115 -24.382 5.378 16.297 1.00 0.00 O ATOM 1781 CB HIS B 115 -26.276 4.287 14.441 1.00 0.00 C ATOM 1782 CG HIS B 115 -26.840 3.981 15.800 1.00 0.00 C ATOM 1783 ND1 HIS B 115 -27.269 4.957 16.674 1.00 0.00 N ATOM 1784 CD2 HIS B 115 -27.065 2.801 16.425 1.00 0.00 C ATOM 1785 CE1 HIS B 115 -27.730 4.392 17.773 1.00 0.00 C ATOM 1786 NE2 HIS B 115 -27.617 3.086 17.648 1.00 0.00 N ATOM 0 H HIS B 115 -24.558 2.419 15.535 1.00 0.00 H new ATOM 0 HA HIS B 115 -24.513 4.315 13.252 1.00 0.00 H new ATOM 0 HB2 HIS B 115 -26.519 5.320 14.191 1.00 0.00 H new ATOM 0 HB3 HIS B 115 -26.778 3.655 13.708 1.00 0.00 H new ATOM 0 HD2 HIS B 115 -26.850 1.818 16.033 1.00 0.00 H new ATOM 0 HE1 HIS B 115 -28.132 4.912 18.630 1.00 0.00 H new ATOM 0 HE2 HIS B 115 -27.895 2.398 18.347 1.00 0.00 H new ATOM 1795 N HIS B 116 -22.803 5.475 14.687 1.00 0.00 N ATOM 1796 CA HIS B 116 -21.868 6.301 15.455 1.00 0.00 C ATOM 1797 C HIS B 116 -21.441 5.576 16.725 1.00 0.00 C ATOM 1798 O HIS B 116 -21.321 6.178 17.792 1.00 0.00 O ATOM 1799 CB HIS B 116 -22.475 7.668 15.799 1.00 0.00 C ATOM 1800 CG HIS B 116 -22.588 8.586 14.625 1.00 0.00 C ATOM 1801 ND1 HIS B 116 -23.792 9.056 14.147 1.00 0.00 N ATOM 1802 CD2 HIS B 116 -21.634 9.131 13.836 1.00 0.00 C ATOM 1803 CE1 HIS B 116 -23.573 9.846 13.113 1.00 0.00 C ATOM 1804 NE2 HIS B 116 -22.273 9.909 12.905 1.00 0.00 N ATOM 0 H HIS B 116 -22.483 5.256 13.744 1.00 0.00 H new ATOM 0 HA HIS B 116 -20.990 6.475 14.833 1.00 0.00 H new ATOM 0 HB2 HIS B 116 -23.465 7.518 16.229 1.00 0.00 H new ATOM 0 HB3 HIS B 116 -21.864 8.145 16.565 1.00 0.00 H new ATOM 0 HD2 HIS B 116 -20.568 8.981 13.923 1.00 0.00 H new ATOM 0 HE1 HIS B 116 -24.330 10.355 12.535 1.00 0.00 H new ATOM 0 HE2 HIS B 116 -21.816 10.449 12.170 1.00 0.00 H new ATOM 1813 N HIS B 117 -21.214 4.277 16.600 1.00 0.00 N ATOM 1814 CA HIS B 117 -20.833 3.460 17.739 1.00 0.00 C ATOM 1815 C HIS B 117 -19.477 2.808 17.493 1.00 0.00 C ATOM 1816 O HIS B 117 -19.390 1.620 17.174 1.00 0.00 O ATOM 1817 CB HIS B 117 -21.893 2.389 18.016 1.00 0.00 C ATOM 1818 CG HIS B 117 -21.688 1.674 19.318 1.00 0.00 C ATOM 1819 ND1 HIS B 117 -20.961 0.508 19.432 1.00 0.00 N ATOM 1820 CD2 HIS B 117 -22.111 1.974 20.566 1.00 0.00 C ATOM 1821 CE1 HIS B 117 -20.944 0.125 20.694 1.00 0.00 C ATOM 1822 NE2 HIS B 117 -21.635 0.998 21.403 1.00 0.00 N ATOM 0 H HIS B 117 -21.287 3.767 15.720 1.00 0.00 H new ATOM 0 HA HIS B 117 -20.759 4.106 18.614 1.00 0.00 H new ATOM 0 HB2 HIS B 117 -22.878 2.855 18.017 1.00 0.00 H new ATOM 0 HB3 HIS B 117 -21.885 1.661 17.205 1.00 0.00 H new ATOM 0 HD2 HIS B 117 -22.712 2.825 20.851 1.00 0.00 H new ATOM 0 HE1 HIS B 117 -20.449 -0.753 21.081 1.00 0.00 H new ATOM 0 HE2 HIS B 117 -21.790 0.954 22.410 1.00 0.00 H new ATOM 1831 N HIS B 118 -18.427 3.600 17.627 1.00 0.00 N ATOM 1832 CA HIS B 118 -17.070 3.108 17.465 1.00 0.00 C ATOM 1833 C HIS B 118 -16.373 3.040 18.821 1.00 0.00 C ATOM 1834 O HIS B 118 -15.853 4.039 19.316 1.00 0.00 O ATOM 1835 CB HIS B 118 -16.292 4.017 16.504 1.00 0.00 C ATOM 1836 CG HIS B 118 -14.874 3.589 16.274 1.00 0.00 C ATOM 1837 ND1 HIS B 118 -13.794 4.280 16.774 1.00 0.00 N ATOM 1838 CD2 HIS B 118 -14.362 2.544 15.583 1.00 0.00 C ATOM 1839 CE1 HIS B 118 -12.679 3.682 16.400 1.00 0.00 C ATOM 1840 NE2 HIS B 118 -12.995 2.624 15.676 1.00 0.00 N ATOM 0 H HIS B 118 -18.490 4.594 17.849 1.00 0.00 H new ATOM 0 HA HIS B 118 -17.103 2.104 17.042 1.00 0.00 H new ATOM 0 HB2 HIS B 118 -16.812 4.046 15.546 1.00 0.00 H new ATOM 0 HB3 HIS B 118 -16.295 5.033 16.899 1.00 0.00 H new ATOM 0 HD2 HIS B 118 -14.925 1.788 15.056 1.00 0.00 H new ATOM 0 HE1 HIS B 118 -11.677 4.003 16.645 1.00 0.00 H new ATOM 0 HE2 HIS B 118 -12.332 1.973 15.255 1.00 0.00 H new ATOM 1849 N HIS B 119 -16.383 1.866 19.425 1.00 0.00 N ATOM 1850 CA HIS B 119 -15.753 1.671 20.721 1.00 0.00 C ATOM 1851 C HIS B 119 -14.942 0.385 20.723 1.00 0.00 C ATOM 1852 O HIS B 119 -13.697 0.466 20.719 1.00 0.00 O ATOM 1853 CB HIS B 119 -16.802 1.635 21.837 1.00 0.00 C ATOM 1854 CG HIS B 119 -16.216 1.436 23.205 1.00 0.00 C ATOM 1855 ND1 HIS B 119 -16.023 0.194 23.771 1.00 0.00 N ATOM 1856 CD2 HIS B 119 -15.776 2.334 24.116 1.00 0.00 C ATOM 1857 CE1 HIS B 119 -15.493 0.338 24.970 1.00 0.00 C ATOM 1858 NE2 HIS B 119 -15.331 1.626 25.204 1.00 0.00 N ATOM 1859 OXT HIS B 119 -15.556 -0.702 20.720 1.00 0.00 O ATOM 0 H HIS B 119 -16.821 1.030 19.039 1.00 0.00 H new ATOM 0 HA HIS B 119 -15.084 2.512 20.906 1.00 0.00 H new ATOM 0 HB2 HIS B 119 -17.366 2.568 21.824 1.00 0.00 H new ATOM 0 HB3 HIS B 119 -17.510 0.831 21.633 1.00 0.00 H new ATOM 0 HD2 HIS B 119 -15.775 3.409 24.007 1.00 0.00 H new ATOM 0 HE1 HIS B 119 -15.235 -0.464 25.646 1.00 0.00 H new ATOM 0 HE2 HIS B 119 -14.939 2.030 26.055 1.00 0.00 H new TER 1868 HIS B 119