USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=36 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: A 2 SER OG : rot 140:sc= 0.947 USER MOD Set 1.2: B 113 SER OG : rot 177:sc= 1.02 USER MOD Set 2.1: B 111 SER OG : rot 180:sc= 0.0975 USER MOD Set 2.2: B 115 HIS : no HD1:sc= 0 X(o=0.097,f=-0.038) USER MOD Set 3.1: B 90 GLN : amide:sc= -1.55! K(o=-1.9!,f=-0.39) USER MOD Set 3.2: B 91 TYR OH : rot 6:sc= -0.358 USER MOD Set 4.1: B 89 GLN : amide:sc= -4.91! C(o=-4.1!,f=-4.4!) USER MOD Set 4.2: B 93 HIS : no HE2:sc= 0.8 K(o=-4.1,f=-12!) USER MOD Set 5.1: B 45 TYR OH : rot 45:sc= 0.84 USER MOD Set 5.2: B 68 ASN : amide:sc= 0.731 K(o=1.6,f=-0.51) USER MOD Single : A 1 GLY N :NH3+ -123:sc= 0.124 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= -0.106 X(o=-0.11,f=-0.21) 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 -55:sc= 1.21 USER MOD Single : A 17 GLN : amide:sc= -1.41 K(o=-1.4,f=-6.3!) USER MOD Single : A 21 THR OG1 : rot -95:sc= 1.23 USER MOD Single : A 22 SER OG : rot 170:sc= -0.175 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : B 31 MET CE :methyl 166:sc= -0.0778 (180deg=-0.469) USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 35 ASN : amide:sc= 0.273 X(o=0.27,f=0) USER MOD Single : B 38 GLN : amide:sc= -0.143 K(o=-0.14,f=-0.78) USER MOD Single : B 40 SER OG : rot -51:sc= 0.208 USER MOD Single : B 41 HIS : no HE2:sc= -1.15 X(o=-1.1,f=-0.72) USER MOD Single : B 43 SER OG : rot 180:sc= 0 USER MOD Single : B 44 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0766) USER MOD Single : B 52 LYS NZ :NH3+ 154:sc= 1.17 (180deg=-0.288) USER MOD Single : B 53 ASN : amide:sc= -4.02! K(o=-4!,f=-1.3) USER MOD Single : B 54 SER OG : rot -26:sc= 1.09 USER MOD Single : B 59 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0273) USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 66 HIS : no HD1:sc= 0 X(o=0,f=0) 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+ 180:sc= 0 (180deg=0) USER MOD Single : B 81 TYR OH : rot 110:sc= 1.04 USER MOD Single : B 84 GLN : amide:sc= 0.258 K(o=0.26,f=-1.2) USER MOD Single : B 87 SER OG : rot 138:sc= -1.02! USER MOD Single : B 94 GLN : amide:sc= -0.0979 K(o=-0.098,f=-0.6) USER MOD Single : B 97 THR OG1 : rot 169:sc= 0.579 USER MOD Single : B 102 THR OG1 : rot -169:sc= 0 USER MOD Single : B 103 THR OG1 : rot 180:sc= -0.157 USER MOD Single : B 104 THR OG1 : rot 180:sc= 0 USER MOD Single : B 105 SER OG : rot 180:sc= 0 USER MOD Single : B 106 THR OG1 : rot 180:sc= 0 USER MOD Single : B 107 SER OG : rot 96:sc= 0.781 USER MOD Single : B 108 THR OG1 : rot -81:sc= 0.888 USER MOD Single : B 114 HIS : no HD1:sc= 0 X(o=0,f=-0.0022) USER MOD Single : B 116 HIS : no HD1:sc= -0.142 X(o=-0.14,f=-0.041) USER MOD Single : B 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 118 HIS : no HD1:sc= -0.0278 X(o=-0.028,f=0) USER MOD Single : B 119 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.683 4.666 12.911 1.00 0.00 N ATOM 2 CA GLY A 1 6.132 5.171 14.189 1.00 0.00 C ATOM 3 C GLY A 1 4.643 5.413 14.101 1.00 0.00 C ATOM 4 O GLY A 1 4.028 5.138 13.071 1.00 0.00 O ATOM 0 H1 GLY A 1 7.159 3.756 13.074 1.00 0.00 H new ATOM 0 H2 GLY A 1 5.910 4.535 12.227 1.00 0.00 H new ATOM 0 H3 GLY A 1 7.367 5.352 12.533 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.337 4.453 14.983 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.636 6.099 14.461 1.00 0.00 H new ATOM 10 N SER A 2 4.061 5.924 15.174 1.00 0.00 N ATOM 11 CA SER A 2 2.636 6.213 15.202 1.00 0.00 C ATOM 12 C SER A 2 2.306 7.416 14.324 1.00 0.00 C ATOM 13 O SER A 2 1.351 7.388 13.549 1.00 0.00 O ATOM 14 CB SER A 2 2.187 6.480 16.634 1.00 0.00 C ATOM 15 OG SER A 2 2.483 5.378 17.475 1.00 0.00 O ATOM 0 H SER A 2 4.554 6.148 16.038 1.00 0.00 H new ATOM 0 HA SER A 2 2.104 5.345 14.811 1.00 0.00 H new ATOM 0 HB2 SER A 2 2.682 7.374 17.013 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.115 6.677 16.652 1.00 0.00 H new ATOM 0 HG SER A 2 2.803 5.705 18.342 1.00 0.00 H new ATOM 21 N GLN A 3 3.103 8.465 14.445 1.00 0.00 N ATOM 22 CA GLN A 3 2.873 9.681 13.683 1.00 0.00 C ATOM 23 C GLN A 3 3.487 9.566 12.295 1.00 0.00 C ATOM 24 O GLN A 3 4.709 9.615 12.135 1.00 0.00 O ATOM 25 CB GLN A 3 3.442 10.889 14.423 1.00 0.00 C ATOM 26 CG GLN A 3 2.793 11.132 15.777 1.00 0.00 C ATOM 27 CD GLN A 3 1.312 11.436 15.669 1.00 0.00 C ATOM 28 OE1 GLN A 3 0.474 10.532 15.699 1.00 0.00 O ATOM 29 NE2 GLN A 3 0.977 12.709 15.552 1.00 0.00 N ATOM 0 H GLN A 3 3.914 8.499 15.063 1.00 0.00 H new ATOM 0 HA GLN A 3 1.798 9.820 13.571 1.00 0.00 H new ATOM 0 HB2 GLN A 3 4.514 10.748 14.563 1.00 0.00 H new ATOM 0 HB3 GLN A 3 3.316 11.777 13.804 1.00 0.00 H new ATOM 0 HG2 GLN A 3 2.935 10.253 16.406 1.00 0.00 H new ATOM 0 HG3 GLN A 3 3.295 11.963 16.272 1.00 0.00 H new ATOM 0 HE21 GLN A 3 1.701 13.427 15.531 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -0.006 12.973 15.483 1.00 0.00 H new ATOM 38 N THR A 4 2.631 9.404 11.302 1.00 0.00 N ATOM 39 CA THR A 4 3.063 9.258 9.926 1.00 0.00 C ATOM 40 C THR A 4 3.642 10.575 9.406 1.00 0.00 C ATOM 41 O THR A 4 2.984 11.617 9.456 1.00 0.00 O ATOM 42 CB THR A 4 1.880 8.822 9.041 1.00 0.00 C ATOM 43 OG1 THR A 4 1.159 7.765 9.693 1.00 0.00 O ATOM 44 CG2 THR A 4 2.362 8.337 7.682 1.00 0.00 C ATOM 0 H THR A 4 1.619 9.370 11.428 1.00 0.00 H new ATOM 0 HA THR A 4 3.838 8.493 9.887 1.00 0.00 H new ATOM 0 HB THR A 4 1.230 9.684 8.890 1.00 0.00 H new ATOM 0 HG1 THR A 4 0.405 7.488 9.131 1.00 0.00 H new ATOM 0 HG21 THR A 4 1.506 8.036 7.079 1.00 0.00 H new ATOM 0 HG22 THR A 4 2.897 9.142 7.177 1.00 0.00 H new ATOM 0 HG23 THR A 4 3.029 7.486 7.815 1.00 0.00 H new ATOM 52 N THR A 5 4.884 10.520 8.930 1.00 0.00 N ATOM 53 CA THR A 5 5.576 11.708 8.446 1.00 0.00 C ATOM 54 C THR A 5 4.934 12.236 7.167 1.00 0.00 C ATOM 55 O THR A 5 4.977 13.436 6.889 1.00 0.00 O ATOM 56 CB THR A 5 7.068 11.421 8.192 1.00 0.00 C ATOM 57 OG1 THR A 5 7.209 10.293 7.318 1.00 0.00 O ATOM 58 CG2 THR A 5 7.799 11.148 9.498 1.00 0.00 C ATOM 0 H THR A 5 5.432 9.662 8.870 1.00 0.00 H new ATOM 0 HA THR A 5 5.492 12.467 9.224 1.00 0.00 H new ATOM 0 HB THR A 5 7.508 12.302 7.725 1.00 0.00 H new ATOM 0 HG1 THR A 5 8.160 10.118 7.160 1.00 0.00 H new ATOM 0 HG21 THR A 5 8.850 10.948 9.292 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.716 12.018 10.150 1.00 0.00 H new ATOM 0 HG23 THR A 5 7.355 10.282 9.989 1.00 0.00 H new ATOM 66 N ALA A 6 4.349 11.331 6.393 1.00 0.00 N ATOM 67 CA ALA A 6 3.612 11.708 5.201 1.00 0.00 C ATOM 68 C ALA A 6 2.121 11.758 5.514 1.00 0.00 C ATOM 69 O ALA A 6 1.480 10.721 5.672 1.00 0.00 O ATOM 70 CB ALA A 6 3.892 10.730 4.071 1.00 0.00 C ATOM 0 H ALA A 6 4.373 10.327 6.573 1.00 0.00 H new ATOM 0 HA ALA A 6 3.937 12.697 4.879 1.00 0.00 H new ATOM 0 HB1 ALA A 6 3.331 11.028 3.185 1.00 0.00 H new ATOM 0 HB2 ALA A 6 4.958 10.732 3.844 1.00 0.00 H new ATOM 0 HB3 ALA A 6 3.588 9.728 4.373 1.00 0.00 H new ATOM 76 N PRO A 7 1.551 12.966 5.620 1.00 0.00 N ATOM 77 CA PRO A 7 0.154 13.146 6.026 1.00 0.00 C ATOM 78 C PRO A 7 -0.837 12.591 5.008 1.00 0.00 C ATOM 79 O PRO A 7 -1.974 12.269 5.348 1.00 0.00 O ATOM 80 CB PRO A 7 0.005 14.665 6.141 1.00 0.00 C ATOM 81 CG PRO A 7 1.072 15.222 5.266 1.00 0.00 C ATOM 82 CD PRO A 7 2.218 14.252 5.351 1.00 0.00 C ATOM 0 HA PRO A 7 -0.065 12.609 6.949 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -0.983 14.991 5.815 1.00 0.00 H new ATOM 0 HB3 PRO A 7 0.126 14.997 7.172 1.00 0.00 H new ATOM 0 HG2 PRO A 7 0.722 15.325 4.239 1.00 0.00 H new ATOM 0 HG3 PRO A 7 1.374 16.214 5.601 1.00 0.00 H new ATOM 0 HD2 PRO A 7 2.790 14.223 4.424 1.00 0.00 H new ATOM 0 HD3 PRO A 7 2.914 14.519 6.147 1.00 0.00 H new ATOM 90 N ASP A 8 -0.402 12.466 3.762 1.00 0.00 N ATOM 91 CA ASP A 8 -1.285 12.018 2.690 1.00 0.00 C ATOM 92 C ASP A 8 -1.282 10.496 2.589 1.00 0.00 C ATOM 93 O ASP A 8 -1.998 9.917 1.774 1.00 0.00 O ATOM 94 CB ASP A 8 -0.870 12.642 1.351 1.00 0.00 C ATOM 95 CG ASP A 8 -0.868 14.161 1.387 1.00 0.00 C ATOM 96 OD1 ASP A 8 -1.960 14.765 1.498 1.00 0.00 O ATOM 97 OD2 ASP A 8 0.230 14.761 1.310 1.00 0.00 O ATOM 0 H ASP A 8 0.554 12.667 3.467 1.00 0.00 H new ATOM 0 HA ASP A 8 -2.297 12.346 2.926 1.00 0.00 H new ATOM 0 HB2 ASP A 8 0.125 12.288 1.083 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -1.550 12.302 0.570 1.00 0.00 H new ATOM 102 N ALA A 9 -0.490 9.856 3.441 1.00 0.00 N ATOM 103 CA ALA A 9 -0.369 8.404 3.442 1.00 0.00 C ATOM 104 C ALA A 9 -1.500 7.754 4.235 1.00 0.00 C ATOM 105 O ALA A 9 -1.929 8.286 5.262 1.00 0.00 O ATOM 106 CB ALA A 9 0.972 7.994 4.025 1.00 0.00 C ATOM 0 H ALA A 9 0.081 10.324 4.144 1.00 0.00 H new ATOM 0 HA ALA A 9 -0.437 8.060 2.410 1.00 0.00 H new ATOM 0 HB1 ALA A 9 1.053 6.907 4.022 1.00 0.00 H new ATOM 0 HB2 ALA A 9 1.776 8.420 3.424 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.051 8.361 5.048 1.00 0.00 H new ATOM 112 N PRO A 10 -2.011 6.604 3.765 1.00 0.00 N ATOM 113 CA PRO A 10 -3.003 5.821 4.504 1.00 0.00 C ATOM 114 C PRO A 10 -2.389 5.198 5.755 1.00 0.00 C ATOM 115 O PRO A 10 -1.433 4.426 5.671 1.00 0.00 O ATOM 116 CB PRO A 10 -3.424 4.717 3.520 1.00 0.00 C ATOM 117 CG PRO A 10 -2.864 5.112 2.195 1.00 0.00 C ATOM 118 CD PRO A 10 -1.671 5.978 2.481 1.00 0.00 C ATOM 0 HA PRO A 10 -3.839 6.434 4.841 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -3.038 3.747 3.833 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -4.509 4.628 3.474 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -2.577 4.234 1.617 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -3.605 5.653 1.606 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -0.755 5.392 2.549 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -1.516 6.721 1.699 1.00 0.00 H new ATOM 126 N PRO A 11 -2.943 5.532 6.937 1.00 0.00 N ATOM 127 CA PRO A 11 -2.426 5.056 8.228 1.00 0.00 C ATOM 128 C PRO A 11 -2.378 3.536 8.322 1.00 0.00 C ATOM 129 O PRO A 11 -1.426 2.971 8.862 1.00 0.00 O ATOM 130 CB PRO A 11 -3.423 5.615 9.248 1.00 0.00 C ATOM 131 CG PRO A 11 -4.065 6.771 8.566 1.00 0.00 C ATOM 132 CD PRO A 11 -4.109 6.418 7.106 1.00 0.00 C ATOM 0 HA PRO A 11 -1.398 5.383 8.388 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -4.161 4.864 9.531 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -2.919 5.927 10.163 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -5.068 6.946 8.956 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -3.495 7.686 8.729 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -5.039 5.914 6.842 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -4.036 7.304 6.475 1.00 0.00 H new ATOM 140 N ASP A 12 -3.404 2.878 7.798 1.00 0.00 N ATOM 141 CA ASP A 12 -3.475 1.423 7.842 1.00 0.00 C ATOM 142 C ASP A 12 -4.402 0.880 6.760 1.00 0.00 C ATOM 143 O ASP A 12 -5.600 1.167 6.761 1.00 0.00 O ATOM 144 CB ASP A 12 -3.967 0.963 9.220 1.00 0.00 C ATOM 145 CG ASP A 12 -4.302 -0.516 9.263 1.00 0.00 C ATOM 146 OD1 ASP A 12 -5.496 -0.863 9.154 1.00 0.00 O ATOM 147 OD2 ASP A 12 -3.377 -1.336 9.425 1.00 0.00 O ATOM 0 H ASP A 12 -4.196 3.327 7.339 1.00 0.00 H new ATOM 0 HA ASP A 12 -2.473 1.033 7.661 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -3.201 1.179 9.965 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -4.850 1.539 9.496 1.00 0.00 H new ATOM 152 N PRO A 13 -3.862 0.121 5.799 1.00 0.00 N ATOM 153 CA PRO A 13 -4.674 -0.611 4.836 1.00 0.00 C ATOM 154 C PRO A 13 -5.246 -1.879 5.460 1.00 0.00 C ATOM 155 O PRO A 13 -4.504 -2.799 5.801 1.00 0.00 O ATOM 156 CB PRO A 13 -3.689 -0.969 3.709 1.00 0.00 C ATOM 157 CG PRO A 13 -2.395 -0.307 4.066 1.00 0.00 C ATOM 158 CD PRO A 13 -2.431 -0.065 5.547 1.00 0.00 C ATOM 0 HA PRO A 13 -5.526 -0.029 4.486 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -3.565 -2.049 3.627 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -4.055 -0.616 2.745 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -1.549 -0.940 3.797 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -2.277 0.631 3.523 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -2.026 -0.908 6.107 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -1.851 0.813 5.830 1.00 0.00 H new ATOM 166 N THR A 14 -6.559 -1.928 5.599 1.00 0.00 N ATOM 167 CA THR A 14 -7.214 -3.070 6.212 1.00 0.00 C ATOM 168 C THR A 14 -7.923 -3.882 5.141 1.00 0.00 C ATOM 169 O THR A 14 -8.490 -3.316 4.208 1.00 0.00 O ATOM 170 CB THR A 14 -8.240 -2.623 7.267 1.00 0.00 C ATOM 171 OG1 THR A 14 -7.783 -1.430 7.924 1.00 0.00 O ATOM 172 CG2 THR A 14 -8.463 -3.716 8.301 1.00 0.00 C ATOM 0 H THR A 14 -7.193 -1.189 5.295 1.00 0.00 H new ATOM 0 HA THR A 14 -6.453 -3.675 6.704 1.00 0.00 H new ATOM 0 HB THR A 14 -9.183 -2.422 6.759 1.00 0.00 H new ATOM 0 HG1 THR A 14 -6.891 -1.585 8.299 1.00 0.00 H new ATOM 0 HG21 THR A 14 -9.192 -3.377 9.037 1.00 0.00 H new ATOM 0 HG22 THR A 14 -8.836 -4.613 7.807 1.00 0.00 H new ATOM 0 HG23 THR A 14 -7.521 -3.942 8.801 1.00 0.00 H new ATOM 180 N VAL A 15 -7.882 -5.197 5.251 1.00 0.00 N ATOM 181 CA VAL A 15 -8.486 -6.029 4.241 1.00 0.00 C ATOM 182 C VAL A 15 -9.804 -6.624 4.734 1.00 0.00 C ATOM 183 O VAL A 15 -9.920 -7.067 5.877 1.00 0.00 O ATOM 184 CB VAL A 15 -7.509 -7.120 3.758 1.00 0.00 C ATOM 185 CG1 VAL A 15 -6.079 -6.594 3.745 1.00 0.00 C ATOM 186 CG2 VAL A 15 -7.606 -8.381 4.584 1.00 0.00 C ATOM 0 H VAL A 15 -7.442 -5.702 6.020 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.716 -5.400 3.381 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.797 -7.381 2.740 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.406 -7.379 3.401 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -6.012 -5.739 3.073 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -5.795 -6.287 4.752 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -6.899 -9.119 4.205 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -7.371 -8.154 5.624 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -8.618 -8.781 4.520 1.00 0.00 H new ATOM 196 N ASP A 16 -10.804 -6.578 3.871 1.00 0.00 N ATOM 197 CA ASP A 16 -12.131 -7.091 4.183 1.00 0.00 C ATOM 198 C ASP A 16 -12.522 -8.152 3.167 1.00 0.00 C ATOM 199 O ASP A 16 -11.778 -8.405 2.218 1.00 0.00 O ATOM 200 CB ASP A 16 -13.180 -5.969 4.155 1.00 0.00 C ATOM 201 CG ASP A 16 -12.983 -4.916 5.231 1.00 0.00 C ATOM 202 OD1 ASP A 16 -13.230 -5.217 6.418 1.00 0.00 O ATOM 203 OD2 ASP A 16 -12.621 -3.768 4.889 1.00 0.00 O ATOM 0 H ASP A 16 -10.721 -6.184 2.934 1.00 0.00 H new ATOM 0 HA ASP A 16 -12.099 -7.519 5.185 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -13.155 -5.486 3.178 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -14.171 -6.409 4.268 1.00 0.00 H new ATOM 208 N GLN A 17 -13.690 -8.756 3.377 1.00 0.00 N ATOM 209 CA GLN A 17 -14.277 -9.705 2.430 1.00 0.00 C ATOM 210 C GLN A 17 -13.302 -10.814 2.045 1.00 0.00 C ATOM 211 O GLN A 17 -12.813 -10.866 0.913 1.00 0.00 O ATOM 212 CB GLN A 17 -14.765 -8.974 1.175 1.00 0.00 C ATOM 213 CG GLN A 17 -15.883 -7.975 1.438 1.00 0.00 C ATOM 214 CD GLN A 17 -17.184 -8.631 1.873 1.00 0.00 C ATOM 215 OE1 GLN A 17 -17.193 -9.691 2.504 1.00 0.00 O ATOM 216 NE2 GLN A 17 -18.296 -8.002 1.539 1.00 0.00 N ATOM 0 H GLN A 17 -14.258 -8.602 4.210 1.00 0.00 H new ATOM 0 HA GLN A 17 -15.125 -10.174 2.929 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -13.923 -8.451 0.721 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -15.112 -9.710 0.450 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -15.561 -7.275 2.209 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -16.062 -7.393 0.534 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -18.250 -7.127 1.017 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -19.201 -8.391 1.803 1.00 0.00 H new ATOM 225 N VAL A 18 -13.034 -11.706 2.985 1.00 0.00 N ATOM 226 CA VAL A 18 -12.125 -12.812 2.742 1.00 0.00 C ATOM 227 C VAL A 18 -12.838 -13.958 2.025 1.00 0.00 C ATOM 228 O VAL A 18 -13.788 -14.549 2.543 1.00 0.00 O ATOM 229 CB VAL A 18 -11.474 -13.324 4.048 1.00 0.00 C ATOM 230 CG1 VAL A 18 -10.496 -12.294 4.592 1.00 0.00 C ATOM 231 CG2 VAL A 18 -12.527 -13.654 5.097 1.00 0.00 C ATOM 0 H VAL A 18 -13.434 -11.685 3.923 1.00 0.00 H new ATOM 0 HA VAL A 18 -11.330 -12.434 2.099 1.00 0.00 H new ATOM 0 HB VAL A 18 -10.931 -14.240 3.814 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -10.046 -12.669 5.511 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -9.715 -12.109 3.855 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -11.025 -11.364 4.800 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -12.038 -14.011 6.003 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -13.106 -12.759 5.326 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -13.192 -14.428 4.714 1.00 0.00 H new ATOM 241 N ASP A 19 -12.389 -14.244 0.817 1.00 0.00 N ATOM 242 CA ASP A 19 -12.956 -15.319 0.018 1.00 0.00 C ATOM 243 C ASP A 19 -12.075 -16.563 0.160 1.00 0.00 C ATOM 244 O ASP A 19 -11.308 -16.658 1.120 1.00 0.00 O ATOM 245 CB ASP A 19 -13.064 -14.866 -1.443 1.00 0.00 C ATOM 246 CG ASP A 19 -14.019 -15.712 -2.257 1.00 0.00 C ATOM 247 OD1 ASP A 19 -13.543 -16.567 -3.025 1.00 0.00 O ATOM 248 OD2 ASP A 19 -15.248 -15.523 -2.136 1.00 0.00 O ATOM 0 H ASP A 19 -11.626 -13.742 0.363 1.00 0.00 H new ATOM 0 HA ASP A 19 -13.959 -15.568 0.366 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -13.393 -13.827 -1.472 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -12.076 -14.900 -1.902 1.00 0.00 H new ATOM 253 N ASP A 20 -12.160 -17.511 -0.771 1.00 0.00 N ATOM 254 CA ASP A 20 -11.388 -18.748 -0.648 1.00 0.00 C ATOM 255 C ASP A 20 -9.896 -18.465 -0.810 1.00 0.00 C ATOM 256 O ASP A 20 -9.066 -19.068 -0.124 1.00 0.00 O ATOM 257 CB ASP A 20 -11.849 -19.816 -1.658 1.00 0.00 C ATOM 258 CG ASP A 20 -11.190 -19.696 -3.023 1.00 0.00 C ATOM 259 OD1 ASP A 20 -10.132 -20.323 -3.237 1.00 0.00 O ATOM 260 OD2 ASP A 20 -11.726 -18.980 -3.890 1.00 0.00 O ATOM 0 H ASP A 20 -12.744 -17.451 -1.605 1.00 0.00 H new ATOM 0 HA ASP A 20 -11.565 -19.146 0.351 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -11.638 -20.804 -1.249 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -12.930 -19.745 -1.779 1.00 0.00 H new ATOM 265 N THR A 21 -9.566 -17.536 -1.705 1.00 0.00 N ATOM 266 CA THR A 21 -8.183 -17.134 -1.931 1.00 0.00 C ATOM 267 C THR A 21 -8.090 -15.673 -2.374 1.00 0.00 C ATOM 268 O THR A 21 -7.128 -15.276 -3.023 1.00 0.00 O ATOM 269 CB THR A 21 -7.494 -18.024 -2.993 1.00 0.00 C ATOM 270 OG1 THR A 21 -8.429 -18.399 -4.016 1.00 0.00 O ATOM 271 CG2 THR A 21 -6.889 -19.271 -2.365 1.00 0.00 C ATOM 0 H THR A 21 -10.244 -17.046 -2.288 1.00 0.00 H new ATOM 0 HA THR A 21 -7.669 -17.255 -0.978 1.00 0.00 H new ATOM 0 HB THR A 21 -6.688 -17.441 -3.439 1.00 0.00 H new ATOM 0 HG1 THR A 21 -8.809 -19.278 -3.806 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.413 -19.874 -3.139 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.146 -18.980 -1.623 1.00 0.00 H new ATOM 0 HG23 THR A 21 -7.674 -19.853 -1.883 1.00 0.00 H new ATOM 279 N SER A 22 -9.081 -14.870 -2.015 1.00 0.00 N ATOM 280 CA SER A 22 -9.099 -13.468 -2.414 1.00 0.00 C ATOM 281 C SER A 22 -9.518 -12.579 -1.250 1.00 0.00 C ATOM 282 O SER A 22 -10.360 -12.964 -0.438 1.00 0.00 O ATOM 283 CB SER A 22 -10.049 -13.257 -3.597 1.00 0.00 C ATOM 284 OG SER A 22 -9.707 -14.089 -4.691 1.00 0.00 O ATOM 0 H SER A 22 -9.879 -15.162 -1.451 1.00 0.00 H new ATOM 0 HA SER A 22 -8.089 -13.193 -2.718 1.00 0.00 H new ATOM 0 HB2 SER A 22 -11.072 -13.466 -3.285 1.00 0.00 H new ATOM 0 HB3 SER A 22 -10.018 -12.213 -3.909 1.00 0.00 H new ATOM 0 HG SER A 22 -10.418 -14.052 -5.365 1.00 0.00 H new ATOM 290 N ILE A 23 -8.916 -11.402 -1.166 1.00 0.00 N ATOM 291 CA ILE A 23 -9.265 -10.427 -0.140 1.00 0.00 C ATOM 292 C ILE A 23 -9.505 -9.071 -0.781 1.00 0.00 C ATOM 293 O ILE A 23 -9.098 -8.839 -1.919 1.00 0.00 O ATOM 294 CB ILE A 23 -8.143 -10.256 0.910 1.00 0.00 C ATOM 295 CG1 ILE A 23 -6.946 -9.536 0.277 1.00 0.00 C ATOM 296 CG2 ILE A 23 -7.722 -11.606 1.468 1.00 0.00 C ATOM 297 CD1 ILE A 23 -5.937 -9.015 1.274 1.00 0.00 C ATOM 0 H ILE A 23 -8.178 -11.096 -1.800 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.162 -10.799 0.356 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.521 -9.653 1.736 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.444 -10.221 -0.406 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.313 -8.702 -0.321 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.932 -11.465 2.205 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -8.578 -12.087 1.941 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -7.354 -12.236 0.658 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.124 -8.520 0.744 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.421 -8.303 1.943 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.538 -9.846 1.856 1.00 0.00 H new ATOM 309 N VAL A 24 -10.157 -8.178 -0.062 1.00 0.00 N ATOM 310 CA VAL A 24 -10.284 -6.806 -0.512 1.00 0.00 C ATOM 311 C VAL A 24 -9.531 -5.885 0.435 1.00 0.00 C ATOM 312 O VAL A 24 -9.995 -5.598 1.533 1.00 0.00 O ATOM 313 CB VAL A 24 -11.758 -6.363 -0.595 1.00 0.00 C ATOM 314 CG1 VAL A 24 -11.864 -4.944 -1.133 1.00 0.00 C ATOM 315 CG2 VAL A 24 -12.558 -7.320 -1.461 1.00 0.00 C ATOM 0 H VAL A 24 -10.605 -8.377 0.832 1.00 0.00 H new ATOM 0 HA VAL A 24 -9.859 -6.745 -1.514 1.00 0.00 H new ATOM 0 HB VAL A 24 -12.174 -6.381 0.412 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -12.913 -4.651 -1.183 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -11.329 -4.263 -0.471 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -11.427 -4.899 -2.130 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -13.596 -6.989 -1.506 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -12.139 -7.338 -2.467 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.515 -8.321 -1.032 1.00 0.00 H new ATOM 325 N VAL A 25 -8.377 -5.415 0.000 1.00 0.00 N ATOM 326 CA VAL A 25 -7.552 -4.547 0.821 1.00 0.00 C ATOM 327 C VAL A 25 -7.933 -3.090 0.579 1.00 0.00 C ATOM 328 O VAL A 25 -7.898 -2.601 -0.551 1.00 0.00 O ATOM 329 CB VAL A 25 -6.039 -4.790 0.566 1.00 0.00 C ATOM 330 CG1 VAL A 25 -5.750 -4.951 -0.911 1.00 0.00 C ATOM 331 CG2 VAL A 25 -5.183 -3.684 1.162 1.00 0.00 C ATOM 0 H VAL A 25 -7.988 -5.620 -0.920 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.736 -4.784 1.869 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.776 -5.721 1.068 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.683 -5.120 -1.057 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.308 -5.802 -1.300 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.050 -4.047 -1.441 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.131 -3.890 0.963 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.457 -2.730 0.713 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.346 -3.638 2.239 1.00 0.00 H new ATOM 341 N ARG A 26 -8.345 -2.425 1.648 1.00 0.00 N ATOM 342 CA ARG A 26 -8.859 -1.069 1.568 1.00 0.00 C ATOM 343 C ARG A 26 -7.983 -0.106 2.357 1.00 0.00 C ATOM 344 O ARG A 26 -7.649 -0.357 3.515 1.00 0.00 O ATOM 345 CB ARG A 26 -10.288 -1.030 2.107 1.00 0.00 C ATOM 346 CG ARG A 26 -11.254 -1.896 1.320 1.00 0.00 C ATOM 347 CD ARG A 26 -12.609 -1.989 1.998 1.00 0.00 C ATOM 348 NE ARG A 26 -13.597 -2.630 1.135 1.00 0.00 N ATOM 349 CZ ARG A 26 -14.694 -3.240 1.573 1.00 0.00 C ATOM 350 NH1 ARG A 26 -14.928 -3.349 2.873 1.00 0.00 N ATOM 351 NH2 ARG A 26 -15.550 -3.759 0.702 1.00 0.00 N ATOM 0 H ARG A 26 -8.332 -2.810 2.592 1.00 0.00 H new ATOM 0 HA ARG A 26 -8.852 -0.758 0.523 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.285 -1.356 3.147 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.644 0.000 2.097 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.377 -1.485 0.318 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -10.835 -2.896 1.206 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -12.515 -2.553 2.926 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -12.952 -0.990 2.266 1.00 0.00 H new ATOM 0 HE ARG A 26 -13.435 -2.608 0.128 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -14.264 -2.963 3.545 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -15.772 -3.818 3.202 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -15.365 -3.689 -0.299 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -16.393 -4.228 1.033 1.00 0.00 H new ATOM 365 N TRP A 27 -7.614 0.992 1.725 1.00 0.00 N ATOM 366 CA TRP A 27 -6.802 2.008 2.369 1.00 0.00 C ATOM 367 C TRP A 27 -7.484 3.368 2.266 1.00 0.00 C ATOM 368 O TRP A 27 -7.889 3.791 1.183 1.00 0.00 O ATOM 369 CB TRP A 27 -5.402 2.050 1.741 1.00 0.00 C ATOM 370 CG TRP A 27 -5.413 2.178 0.245 1.00 0.00 C ATOM 371 CD1 TRP A 27 -5.419 3.335 -0.478 1.00 0.00 C ATOM 372 CD2 TRP A 27 -5.415 1.110 -0.711 1.00 0.00 C ATOM 373 NE1 TRP A 27 -5.438 3.052 -1.819 1.00 0.00 N ATOM 374 CE2 TRP A 27 -5.429 1.695 -1.990 1.00 0.00 C ATOM 375 CE3 TRP A 27 -5.405 -0.282 -0.610 1.00 0.00 C ATOM 376 CZ2 TRP A 27 -5.437 0.936 -3.158 1.00 0.00 C ATOM 377 CZ3 TRP A 27 -5.411 -1.034 -1.770 1.00 0.00 C ATOM 378 CH2 TRP A 27 -5.426 -0.424 -3.028 1.00 0.00 C ATOM 0 H TRP A 27 -7.866 1.204 0.760 1.00 0.00 H new ATOM 0 HA TRP A 27 -6.693 1.757 3.424 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -4.849 2.889 2.164 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -4.864 1.143 2.015 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -5.410 4.329 -0.055 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -5.456 3.743 -2.569 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -5.393 -0.763 0.357 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -5.451 1.405 -4.131 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.404 -2.112 -1.703 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -5.429 -1.040 -3.915 1.00 0.00 H new ATOM 389 N SER A 28 -7.662 4.028 3.397 1.00 0.00 N ATOM 390 CA SER A 28 -8.246 5.353 3.402 1.00 0.00 C ATOM 391 C SER A 28 -7.208 6.385 3.836 1.00 0.00 C ATOM 392 O SER A 28 -6.796 6.416 4.998 1.00 0.00 O ATOM 393 CB SER A 28 -9.459 5.381 4.338 1.00 0.00 C ATOM 394 OG SER A 28 -10.154 6.614 4.255 1.00 0.00 O ATOM 0 H SER A 28 -7.411 3.668 4.318 1.00 0.00 H new ATOM 0 HA SER A 28 -8.576 5.603 2.394 1.00 0.00 H new ATOM 0 HB2 SER A 28 -10.134 4.564 4.084 1.00 0.00 H new ATOM 0 HB3 SER A 28 -9.131 5.216 5.364 1.00 0.00 H new ATOM 0 HG SER A 28 -10.923 6.598 4.863 1.00 0.00 H new ATOM 400 N ARG A 29 -6.763 7.202 2.894 1.00 0.00 N ATOM 401 CA ARG A 29 -5.851 8.292 3.194 1.00 0.00 C ATOM 402 C ARG A 29 -6.636 9.582 3.443 1.00 0.00 C ATOM 403 O ARG A 29 -7.751 9.739 2.939 1.00 0.00 O ATOM 404 CB ARG A 29 -4.807 8.436 2.072 1.00 0.00 C ATOM 405 CG ARG A 29 -5.329 9.002 0.766 1.00 0.00 C ATOM 406 CD ARG A 29 -5.317 10.513 0.801 1.00 0.00 C ATOM 407 NE ARG A 29 -5.686 11.099 -0.484 1.00 0.00 N ATOM 408 CZ ARG A 29 -5.468 12.369 -0.809 1.00 0.00 C ATOM 409 NH1 ARG A 29 -4.912 13.196 0.068 1.00 0.00 N ATOM 410 NH2 ARG A 29 -5.812 12.816 -2.010 1.00 0.00 N ATOM 0 H ARG A 29 -7.021 7.129 1.910 1.00 0.00 H new ATOM 0 HA ARG A 29 -5.303 8.072 4.110 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -4.001 9.077 2.429 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -4.372 7.456 1.876 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -4.716 8.647 -0.062 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -6.343 8.645 0.588 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -6.007 10.862 1.569 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -4.323 10.860 1.084 1.00 0.00 H new ATOM 0 HE ARG A 29 -6.138 10.498 -1.173 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -4.651 12.857 0.994 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -4.746 14.170 -0.184 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -6.244 12.185 -2.685 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -5.644 13.791 -2.259 1.00 0.00 H new ATOM 424 N PRO A 30 -6.088 10.511 4.241 1.00 0.00 N ATOM 425 CA PRO A 30 -6.731 11.792 4.516 1.00 0.00 C ATOM 426 C PRO A 30 -6.559 12.778 3.362 1.00 0.00 C ATOM 427 O PRO A 30 -5.430 13.274 3.160 1.00 0.00 O ATOM 428 CB PRO A 30 -6.025 12.308 5.780 1.00 0.00 C ATOM 429 CG PRO A 30 -5.000 11.279 6.146 1.00 0.00 C ATOM 430 CD PRO A 30 -4.809 10.394 4.946 1.00 0.00 C ATOM 431 OXT PRO A 30 -7.556 13.056 2.659 1.00 0.00 O ATOM 0 HA PRO A 30 -7.808 11.682 4.645 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -5.556 13.274 5.595 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -6.738 12.451 6.592 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -4.060 11.755 6.426 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -5.331 10.696 7.005 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -3.976 10.727 4.328 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -4.600 9.364 5.234 1.00 0.00 H new TER 439 PRO A 30 ATOM 440 N MET B 31 4.086 31.772 -3.777 1.00 0.00 N ATOM 441 CA MET B 31 4.748 31.072 -2.647 1.00 0.00 C ATOM 442 C MET B 31 4.028 31.384 -1.345 1.00 0.00 C ATOM 443 O MET B 31 3.595 30.477 -0.636 1.00 0.00 O ATOM 444 CB MET B 31 6.221 31.477 -2.537 1.00 0.00 C ATOM 445 CG MET B 31 7.062 31.081 -3.740 1.00 0.00 C ATOM 446 SD MET B 31 8.739 31.742 -3.663 1.00 0.00 S ATOM 447 CE MET B 31 9.343 30.982 -2.156 1.00 0.00 C ATOM 0 HA MET B 31 4.700 30.000 -2.838 1.00 0.00 H new ATOM 0 HB2 MET B 31 6.281 32.557 -2.404 1.00 0.00 H new ATOM 0 HB3 MET B 31 6.647 31.021 -1.643 1.00 0.00 H new ATOM 0 HG2 MET B 31 7.107 29.994 -3.805 1.00 0.00 H new ATOM 0 HG3 MET B 31 6.577 31.435 -4.650 1.00 0.00 H new ATOM 0 HE1 MET B 31 10.426 31.089 -2.103 1.00 0.00 H new ATOM 0 HE2 MET B 31 8.888 31.470 -1.294 1.00 0.00 H new ATOM 0 HE3 MET B 31 9.083 29.924 -2.153 1.00 0.00 H new ATOM 459 N ARG B 32 3.909 32.670 -1.025 1.00 0.00 N ATOM 460 CA ARG B 32 3.126 33.093 0.128 1.00 0.00 C ATOM 461 C ARG B 32 1.651 32.993 -0.222 1.00 0.00 C ATOM 462 O ARG B 32 0.821 32.595 0.597 1.00 0.00 O ATOM 463 CB ARG B 32 3.488 34.522 0.534 1.00 0.00 C ATOM 464 CG ARG B 32 4.968 34.703 0.824 1.00 0.00 C ATOM 465 CD ARG B 32 5.275 36.100 1.332 1.00 0.00 C ATOM 466 NE ARG B 32 6.713 36.312 1.479 1.00 0.00 N ATOM 467 CZ ARG B 32 7.332 36.495 2.643 1.00 0.00 C ATOM 468 NH1 ARG B 32 6.653 36.464 3.784 1.00 0.00 N ATOM 469 NH2 ARG B 32 8.641 36.699 2.661 1.00 0.00 N ATOM 0 H ARG B 32 4.343 33.432 -1.546 1.00 0.00 H new ATOM 0 HA ARG B 32 3.346 32.445 0.976 1.00 0.00 H new ATOM 0 HB2 ARG B 32 3.194 35.205 -0.263 1.00 0.00 H new ATOM 0 HB3 ARG B 32 2.914 34.798 1.419 1.00 0.00 H new ATOM 0 HG2 ARG B 32 5.286 33.969 1.564 1.00 0.00 H new ATOM 0 HG3 ARG B 32 5.542 34.511 -0.082 1.00 0.00 H new ATOM 0 HD2 ARG B 32 4.866 36.837 0.641 1.00 0.00 H new ATOM 0 HD3 ARG B 32 4.783 36.255 2.292 1.00 0.00 H new ATOM 0 HE ARG B 32 7.281 36.320 0.632 1.00 0.00 H new ATOM 0 HH11 ARG B 32 5.647 36.299 3.774 1.00 0.00 H new ATOM 0 HH12 ARG B 32 7.138 36.606 4.670 1.00 0.00 H new ATOM 0 HH21 ARG B 32 9.167 36.715 1.787 1.00 0.00 H new ATOM 0 HH22 ARG B 32 9.123 36.840 3.549 1.00 0.00 H new ATOM 483 N GLY B 33 1.344 33.361 -1.457 1.00 0.00 N ATOM 484 CA GLY B 33 0.034 33.112 -2.005 1.00 0.00 C ATOM 485 C GLY B 33 0.075 31.905 -2.913 1.00 0.00 C ATOM 486 O GLY B 33 1.160 31.509 -3.355 1.00 0.00 O ATOM 0 H GLY B 33 1.988 33.832 -2.092 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -0.681 32.947 -1.199 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -0.308 33.985 -2.561 1.00 0.00 H new ATOM 490 N SER B 34 -1.086 31.321 -3.188 1.00 0.00 N ATOM 491 CA SER B 34 -1.170 30.106 -3.992 1.00 0.00 C ATOM 492 C SER B 34 -0.310 29.002 -3.377 1.00 0.00 C ATOM 493 O SER B 34 0.652 28.530 -3.982 1.00 0.00 O ATOM 494 CB SER B 34 -0.738 30.387 -5.435 1.00 0.00 C ATOM 495 OG SER B 34 -1.485 31.459 -5.985 1.00 0.00 O ATOM 0 H SER B 34 -1.987 31.672 -2.864 1.00 0.00 H new ATOM 0 HA SER B 34 -2.206 29.769 -4.005 1.00 0.00 H new ATOM 0 HB2 SER B 34 0.325 30.628 -5.461 1.00 0.00 H new ATOM 0 HB3 SER B 34 -0.877 29.492 -6.042 1.00 0.00 H new ATOM 0 HG SER B 34 -1.192 31.623 -6.906 1.00 0.00 H new ATOM 501 N ASN B 35 -0.665 28.603 -2.161 1.00 0.00 N ATOM 502 CA ASN B 35 0.102 27.601 -1.426 1.00 0.00 C ATOM 503 C ASN B 35 -0.182 26.205 -1.960 1.00 0.00 C ATOM 504 O ASN B 35 0.479 25.235 -1.589 1.00 0.00 O ATOM 505 CB ASN B 35 -0.215 27.670 0.069 1.00 0.00 C ATOM 506 CG ASN B 35 0.289 28.949 0.710 1.00 0.00 C ATOM 507 OD1 ASN B 35 1.420 29.011 1.192 1.00 0.00 O ATOM 508 ND2 ASN B 35 -0.545 29.978 0.725 1.00 0.00 N ATOM 0 H ASN B 35 -1.480 28.958 -1.662 1.00 0.00 H new ATOM 0 HA ASN B 35 1.161 27.816 -1.568 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -1.293 27.595 0.213 1.00 0.00 H new ATOM 0 HB3 ASN B 35 0.234 26.814 0.572 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -0.258 30.861 1.146 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -1.475 29.887 0.315 1.00 0.00 H new ATOM 515 N ALA B 36 -1.168 26.111 -2.838 1.00 0.00 N ATOM 516 CA ALA B 36 -1.488 24.860 -3.497 1.00 0.00 C ATOM 517 C ALA B 36 -1.587 25.057 -5.008 1.00 0.00 C ATOM 518 O ALA B 36 -2.684 25.048 -5.568 1.00 0.00 O ATOM 519 CB ALA B 36 -2.784 24.285 -2.945 1.00 0.00 C ATOM 0 H ALA B 36 -1.763 26.894 -3.110 1.00 0.00 H new ATOM 0 HA ALA B 36 -0.684 24.151 -3.298 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -3.010 23.346 -3.450 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -2.676 24.105 -1.876 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -3.596 24.992 -3.113 1.00 0.00 H new ATOM 525 N PRO B 37 -0.442 25.257 -5.691 1.00 0.00 N ATOM 526 CA PRO B 37 -0.414 25.385 -7.146 1.00 0.00 C ATOM 527 C PRO B 37 -0.720 24.049 -7.810 1.00 0.00 C ATOM 528 O PRO B 37 0.187 23.256 -8.070 1.00 0.00 O ATOM 529 CB PRO B 37 1.020 25.835 -7.447 1.00 0.00 C ATOM 530 CG PRO B 37 1.826 25.352 -6.290 1.00 0.00 C ATOM 531 CD PRO B 37 0.905 25.369 -5.099 1.00 0.00 C ATOM 0 HA PRO B 37 -1.159 26.084 -7.525 1.00 0.00 H new ATOM 0 HB2 PRO B 37 1.379 25.409 -8.384 1.00 0.00 H new ATOM 0 HB3 PRO B 37 1.081 26.919 -7.546 1.00 0.00 H new ATOM 0 HG2 PRO B 37 2.206 24.347 -6.473 1.00 0.00 H new ATOM 0 HG3 PRO B 37 2.690 25.995 -6.123 1.00 0.00 H new ATOM 0 HD2 PRO B 37 1.113 24.542 -4.421 1.00 0.00 H new ATOM 0 HD3 PRO B 37 1.013 26.288 -4.523 1.00 0.00 H new ATOM 539 N GLN B 38 -2.007 23.817 -8.065 1.00 0.00 N ATOM 540 CA GLN B 38 -2.505 22.520 -8.512 1.00 0.00 C ATOM 541 C GLN B 38 -2.284 21.493 -7.401 1.00 0.00 C ATOM 542 O GLN B 38 -1.189 20.947 -7.252 1.00 0.00 O ATOM 543 CB GLN B 38 -1.833 22.075 -9.816 1.00 0.00 C ATOM 544 CG GLN B 38 -2.486 20.856 -10.450 1.00 0.00 C ATOM 545 CD GLN B 38 -3.908 21.124 -10.906 1.00 0.00 C ATOM 546 OE1 GLN B 38 -4.250 22.242 -11.293 1.00 0.00 O ATOM 547 NE2 GLN B 38 -4.749 20.106 -10.850 1.00 0.00 N ATOM 0 H GLN B 38 -2.734 24.526 -7.967 1.00 0.00 H new ATOM 0 HA GLN B 38 -3.571 22.605 -8.722 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -1.856 22.901 -10.527 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -0.784 21.854 -9.618 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -1.890 20.532 -11.303 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -2.487 20.035 -9.733 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -4.426 19.195 -10.523 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -5.721 20.231 -11.133 1.00 0.00 H new ATOM 556 N PRO B 39 -3.330 21.243 -6.595 1.00 0.00 N ATOM 557 CA PRO B 39 -3.245 20.392 -5.398 1.00 0.00 C ATOM 558 C PRO B 39 -2.646 19.012 -5.674 1.00 0.00 C ATOM 559 O PRO B 39 -2.918 18.394 -6.708 1.00 0.00 O ATOM 560 CB PRO B 39 -4.703 20.261 -4.953 1.00 0.00 C ATOM 561 CG PRO B 39 -5.374 21.472 -5.493 1.00 0.00 C ATOM 562 CD PRO B 39 -4.690 21.773 -6.795 1.00 0.00 C ATOM 0 HA PRO B 39 -2.585 20.828 -4.648 1.00 0.00 H new ATOM 0 HB2 PRO B 39 -5.156 19.350 -5.344 1.00 0.00 H new ATOM 0 HB3 PRO B 39 -4.783 20.216 -3.867 1.00 0.00 H new ATOM 0 HG2 PRO B 39 -6.439 21.295 -5.643 1.00 0.00 H new ATOM 0 HG3 PRO B 39 -5.284 22.310 -4.801 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -5.191 21.289 -7.634 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -4.678 22.843 -7.005 1.00 0.00 H new ATOM 570 N SER B 40 -1.839 18.537 -4.736 1.00 0.00 N ATOM 571 CA SER B 40 -1.176 17.249 -4.865 1.00 0.00 C ATOM 572 C SER B 40 -2.149 16.106 -4.585 1.00 0.00 C ATOM 573 O SER B 40 -2.559 15.883 -3.447 1.00 0.00 O ATOM 574 CB SER B 40 0.015 17.175 -3.906 1.00 0.00 C ATOM 575 OG SER B 40 0.931 18.233 -4.147 1.00 0.00 O ATOM 0 H SER B 40 -1.627 19.031 -3.869 1.00 0.00 H new ATOM 0 HA SER B 40 -0.817 17.148 -5.889 1.00 0.00 H new ATOM 0 HB2 SER B 40 -0.339 17.224 -2.876 1.00 0.00 H new ATOM 0 HB3 SER B 40 0.522 16.217 -4.023 1.00 0.00 H new ATOM 0 HG SER B 40 1.159 18.258 -5.100 1.00 0.00 H new ATOM 581 N HIS B 41 -2.534 15.398 -5.636 1.00 0.00 N ATOM 582 CA HIS B 41 -3.432 14.261 -5.504 1.00 0.00 C ATOM 583 C HIS B 41 -2.736 12.984 -5.945 1.00 0.00 C ATOM 584 O HIS B 41 -1.782 13.025 -6.725 1.00 0.00 O ATOM 585 CB HIS B 41 -4.701 14.482 -6.330 1.00 0.00 C ATOM 586 CG HIS B 41 -5.641 15.483 -5.731 1.00 0.00 C ATOM 587 ND1 HIS B 41 -6.774 15.129 -5.032 1.00 0.00 N ATOM 588 CD2 HIS B 41 -5.608 16.835 -5.727 1.00 0.00 C ATOM 589 CE1 HIS B 41 -7.396 16.220 -4.626 1.00 0.00 C ATOM 590 NE2 HIS B 41 -6.709 17.268 -5.034 1.00 0.00 N ATOM 0 H HIS B 41 -2.237 15.592 -6.593 1.00 0.00 H new ATOM 0 HA HIS B 41 -3.712 14.163 -4.455 1.00 0.00 H new ATOM 0 HB2 HIS B 41 -4.420 14.813 -7.330 1.00 0.00 H new ATOM 0 HB3 HIS B 41 -5.221 13.531 -6.443 1.00 0.00 H new ATOM 0 HD1 HIS B 41 -7.084 14.173 -4.856 1.00 0.00 H new ATOM 0 HD2 HIS B 41 -4.854 17.458 -6.185 1.00 0.00 H new ATOM 0 HE1 HIS B 41 -8.313 16.249 -4.056 1.00 0.00 H new ATOM 599 N ILE B 42 -3.210 11.858 -5.433 1.00 0.00 N ATOM 600 CA ILE B 42 -2.642 10.562 -5.765 1.00 0.00 C ATOM 601 C ILE B 42 -3.175 10.087 -7.109 1.00 0.00 C ATOM 602 O ILE B 42 -4.387 9.967 -7.304 1.00 0.00 O ATOM 603 CB ILE B 42 -2.938 9.492 -4.682 1.00 0.00 C ATOM 604 CG1 ILE B 42 -2.170 9.778 -3.381 1.00 0.00 C ATOM 605 CG2 ILE B 42 -2.578 8.104 -5.196 1.00 0.00 C ATOM 606 CD1 ILE B 42 -2.665 10.982 -2.606 1.00 0.00 C ATOM 0 H ILE B 42 -3.993 11.817 -4.781 1.00 0.00 H new ATOM 0 HA ILE B 42 -1.561 10.690 -5.816 1.00 0.00 H new ATOM 0 HB ILE B 42 -4.005 9.533 -4.464 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -2.230 8.899 -2.739 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -1.117 9.925 -3.621 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -2.791 7.364 -4.425 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -3.167 7.881 -6.086 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -1.518 8.072 -5.446 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -2.065 11.106 -1.705 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -2.578 11.874 -3.226 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -3.709 10.833 -2.329 1.00 0.00 H new ATOM 618 N SER B 43 -2.260 9.828 -8.029 1.00 0.00 N ATOM 619 CA SER B 43 -2.617 9.413 -9.372 1.00 0.00 C ATOM 620 C SER B 43 -2.850 7.905 -9.436 1.00 0.00 C ATOM 621 O SER B 43 -3.744 7.436 -10.141 1.00 0.00 O ATOM 622 CB SER B 43 -1.509 9.822 -10.341 1.00 0.00 C ATOM 623 OG SER B 43 -1.226 11.208 -10.227 1.00 0.00 O ATOM 0 H SER B 43 -1.256 9.899 -7.866 1.00 0.00 H new ATOM 0 HA SER B 43 -3.547 9.905 -9.656 1.00 0.00 H new ATOM 0 HB2 SER B 43 -0.608 9.244 -10.135 1.00 0.00 H new ATOM 0 HB3 SER B 43 -1.810 9.590 -11.363 1.00 0.00 H new ATOM 0 HG SER B 43 -0.513 11.449 -10.854 1.00 0.00 H new ATOM 629 N LYS B 44 -2.051 7.149 -8.690 1.00 0.00 N ATOM 630 CA LYS B 44 -2.179 5.698 -8.674 1.00 0.00 C ATOM 631 C LYS B 44 -1.581 5.111 -7.403 1.00 0.00 C ATOM 632 O LYS B 44 -0.606 5.634 -6.862 1.00 0.00 O ATOM 633 CB LYS B 44 -1.508 5.077 -9.908 1.00 0.00 C ATOM 634 CG LYS B 44 -0.014 5.358 -10.022 1.00 0.00 C ATOM 635 CD LYS B 44 0.577 4.714 -11.267 1.00 0.00 C ATOM 636 CE LYS B 44 2.053 5.042 -11.428 1.00 0.00 C ATOM 637 NZ LYS B 44 2.278 6.479 -11.740 1.00 0.00 N ATOM 0 H LYS B 44 -1.311 7.516 -8.091 1.00 0.00 H new ATOM 0 HA LYS B 44 -3.242 5.459 -8.698 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -1.662 3.998 -9.885 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -2.005 5.451 -10.803 1.00 0.00 H new ATOM 0 HG2 LYS B 44 0.154 6.435 -10.052 1.00 0.00 H new ATOM 0 HG3 LYS B 44 0.498 4.980 -9.137 1.00 0.00 H new ATOM 0 HD2 LYS B 44 0.449 3.633 -11.212 1.00 0.00 H new ATOM 0 HD3 LYS B 44 0.031 5.055 -12.146 1.00 0.00 H new ATOM 0 HE2 LYS B 44 2.583 4.784 -10.511 1.00 0.00 H new ATOM 0 HE3 LYS B 44 2.475 4.429 -12.224 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 3.280 6.631 -11.974 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 1.687 6.755 -12.550 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 2.024 7.057 -10.914 1.00 0.00 H new ATOM 651 N TYR B 45 -2.190 4.040 -6.927 1.00 0.00 N ATOM 652 CA TYR B 45 -1.679 3.294 -5.791 1.00 0.00 C ATOM 653 C TYR B 45 -1.074 1.990 -6.285 1.00 0.00 C ATOM 654 O TYR B 45 -1.683 1.293 -7.094 1.00 0.00 O ATOM 655 CB TYR B 45 -2.792 2.958 -4.795 1.00 0.00 C ATOM 656 CG TYR B 45 -3.610 4.132 -4.307 1.00 0.00 C ATOM 657 CD1 TYR B 45 -4.870 4.385 -4.834 1.00 0.00 C ATOM 658 CD2 TYR B 45 -3.142 4.961 -3.297 1.00 0.00 C ATOM 659 CE1 TYR B 45 -5.640 5.434 -4.370 1.00 0.00 C ATOM 660 CE2 TYR B 45 -3.906 6.017 -2.830 1.00 0.00 C ATOM 661 CZ TYR B 45 -5.154 6.247 -3.369 1.00 0.00 C ATOM 662 OH TYR B 45 -5.925 7.288 -2.904 1.00 0.00 O ATOM 0 H TYR B 45 -3.053 3.663 -7.317 1.00 0.00 H new ATOM 0 HA TYR B 45 -0.933 3.911 -5.291 1.00 0.00 H new ATOM 0 HB2 TYR B 45 -3.465 2.238 -5.260 1.00 0.00 H new ATOM 0 HB3 TYR B 45 -2.345 2.466 -3.931 1.00 0.00 H new ATOM 0 HD1 TYR B 45 -5.254 3.751 -5.620 1.00 0.00 H new ATOM 0 HD2 TYR B 45 -2.167 4.780 -2.869 1.00 0.00 H new ATOM 0 HE1 TYR B 45 -6.618 5.616 -4.790 1.00 0.00 H new ATOM 0 HE2 TYR B 45 -3.526 6.657 -2.048 1.00 0.00 H new ATOM 0 HH TYR B 45 -6.846 6.980 -2.773 1.00 0.00 H new ATOM 672 N ILE B 46 0.112 1.663 -5.818 1.00 0.00 N ATOM 673 CA ILE B 46 0.736 0.402 -6.172 1.00 0.00 C ATOM 674 C ILE B 46 0.707 -0.538 -4.974 1.00 0.00 C ATOM 675 O ILE B 46 1.276 -0.243 -3.924 1.00 0.00 O ATOM 676 CB ILE B 46 2.193 0.579 -6.680 1.00 0.00 C ATOM 677 CG1 ILE B 46 2.221 1.229 -8.073 1.00 0.00 C ATOM 678 CG2 ILE B 46 2.919 -0.761 -6.720 1.00 0.00 C ATOM 679 CD1 ILE B 46 1.830 2.692 -8.092 1.00 0.00 C ATOM 0 H ILE B 46 0.664 2.250 -5.193 1.00 0.00 H new ATOM 0 HA ILE B 46 0.164 -0.026 -6.995 1.00 0.00 H new ATOM 0 HB ILE B 46 2.706 1.238 -5.980 1.00 0.00 H new ATOM 0 HG12 ILE B 46 3.225 1.129 -8.486 1.00 0.00 H new ATOM 0 HG13 ILE B 46 1.549 0.678 -8.731 1.00 0.00 H new ATOM 0 HG21 ILE B 46 3.937 -0.612 -7.079 1.00 0.00 H new ATOM 0 HG22 ILE B 46 2.946 -1.190 -5.718 1.00 0.00 H new ATOM 0 HG23 ILE B 46 2.393 -1.440 -7.391 1.00 0.00 H new ATOM 0 HD11 ILE B 46 1.878 3.068 -9.114 1.00 0.00 H new ATOM 0 HD12 ILE B 46 0.814 2.802 -7.712 1.00 0.00 H new ATOM 0 HD13 ILE B 46 2.516 3.260 -7.464 1.00 0.00 H new ATOM 691 N LEU B 47 0.012 -1.652 -5.134 1.00 0.00 N ATOM 692 CA LEU B 47 -0.106 -2.642 -4.077 1.00 0.00 C ATOM 693 C LEU B 47 0.934 -3.733 -4.307 1.00 0.00 C ATOM 694 O LEU B 47 0.971 -4.350 -5.374 1.00 0.00 O ATOM 695 CB LEU B 47 -1.532 -3.234 -4.076 1.00 0.00 C ATOM 696 CG LEU B 47 -2.042 -3.865 -2.760 1.00 0.00 C ATOM 697 CD1 LEU B 47 -1.167 -5.017 -2.302 1.00 0.00 C ATOM 698 CD2 LEU B 47 -2.158 -2.820 -1.662 1.00 0.00 C ATOM 0 H LEU B 47 -0.482 -1.894 -5.993 1.00 0.00 H new ATOM 0 HA LEU B 47 0.071 -2.180 -3.106 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -2.225 -2.442 -4.360 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.581 -3.995 -4.855 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.034 -4.267 -2.967 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -1.564 -5.429 -1.374 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.156 -5.793 -3.068 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.151 -4.658 -2.135 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -2.519 -3.291 -0.748 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.180 -2.374 -1.479 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -2.858 -2.044 -1.971 1.00 0.00 H new ATOM 710 N ARG B 48 1.789 -3.941 -3.319 1.00 0.00 N ATOM 711 CA ARG B 48 2.818 -4.967 -3.391 1.00 0.00 C ATOM 712 C ARG B 48 2.663 -5.954 -2.250 1.00 0.00 C ATOM 713 O ARG B 48 2.337 -5.562 -1.133 1.00 0.00 O ATOM 714 CB ARG B 48 4.211 -4.338 -3.335 1.00 0.00 C ATOM 715 CG ARG B 48 4.612 -3.629 -4.603 1.00 0.00 C ATOM 716 CD ARG B 48 5.986 -3.002 -4.467 1.00 0.00 C ATOM 717 NE ARG B 48 6.380 -2.313 -5.687 1.00 0.00 N ATOM 718 CZ ARG B 48 7.355 -1.411 -5.764 1.00 0.00 C ATOM 719 NH1 ARG B 48 8.028 -1.054 -4.676 1.00 0.00 N ATOM 720 NH2 ARG B 48 7.647 -0.866 -6.936 1.00 0.00 N ATOM 0 H ARG B 48 1.790 -3.408 -2.450 1.00 0.00 H new ATOM 0 HA ARG B 48 2.703 -5.493 -4.339 1.00 0.00 H new ATOM 0 HB2 ARG B 48 4.246 -3.629 -2.507 1.00 0.00 H new ATOM 0 HB3 ARG B 48 4.942 -5.117 -3.119 1.00 0.00 H new ATOM 0 HG2 ARG B 48 4.612 -4.335 -5.434 1.00 0.00 H new ATOM 0 HG3 ARG B 48 3.879 -2.858 -4.840 1.00 0.00 H new ATOM 0 HD2 ARG B 48 5.985 -2.299 -3.634 1.00 0.00 H new ATOM 0 HD3 ARG B 48 6.718 -3.774 -4.231 1.00 0.00 H new ATOM 0 HE ARG B 48 5.873 -2.537 -6.543 1.00 0.00 H new ATOM 0 HH11 ARG B 48 7.799 -1.472 -3.774 1.00 0.00 H new ATOM 0 HH12 ARG B 48 8.774 -0.362 -4.742 1.00 0.00 H new ATOM 0 HH21 ARG B 48 7.126 -1.139 -7.769 1.00 0.00 H new ATOM 0 HH22 ARG B 48 8.393 -0.174 -7.005 1.00 0.00 H new ATOM 734 N TRP B 49 2.887 -7.231 -2.528 1.00 0.00 N ATOM 735 CA TRP B 49 2.836 -8.246 -1.487 1.00 0.00 C ATOM 736 C TRP B 49 3.764 -9.414 -1.805 1.00 0.00 C ATOM 737 O TRP B 49 3.928 -9.801 -2.966 1.00 0.00 O ATOM 738 CB TRP B 49 1.395 -8.735 -1.260 1.00 0.00 C ATOM 739 CG TRP B 49 0.774 -9.460 -2.422 1.00 0.00 C ATOM 740 CD1 TRP B 49 0.596 -10.808 -2.540 1.00 0.00 C ATOM 741 CD2 TRP B 49 0.236 -8.880 -3.619 1.00 0.00 C ATOM 742 NE1 TRP B 49 -0.022 -11.101 -3.731 1.00 0.00 N ATOM 743 CE2 TRP B 49 -0.252 -9.935 -4.411 1.00 0.00 C ATOM 744 CE3 TRP B 49 0.119 -7.574 -4.096 1.00 0.00 C ATOM 745 CZ2 TRP B 49 -0.848 -9.720 -5.653 1.00 0.00 C ATOM 746 CZ3 TRP B 49 -0.471 -7.362 -5.327 1.00 0.00 C ATOM 747 CH2 TRP B 49 -0.948 -8.430 -6.092 1.00 0.00 C ATOM 0 H TRP B 49 3.104 -7.586 -3.459 1.00 0.00 H new ATOM 0 HA TRP B 49 3.185 -7.786 -0.562 1.00 0.00 H new ATOM 0 HB2 TRP B 49 1.385 -9.396 -0.393 1.00 0.00 H new ATOM 0 HB3 TRP B 49 0.771 -7.876 -1.013 1.00 0.00 H new ATOM 0 HD1 TRP B 49 0.897 -11.538 -1.804 1.00 0.00 H new ATOM 0 HE1 TRP B 49 -0.269 -12.036 -4.056 1.00 0.00 H new ATOM 0 HE3 TRP B 49 0.484 -6.742 -3.512 1.00 0.00 H new ATOM 0 HZ2 TRP B 49 -1.217 -10.543 -6.247 1.00 0.00 H new ATOM 0 HZ3 TRP B 49 -0.565 -6.354 -5.704 1.00 0.00 H new ATOM 0 HH2 TRP B 49 -1.405 -8.231 -7.050 1.00 0.00 H new ATOM 758 N ARG B 50 4.392 -9.940 -0.762 1.00 0.00 N ATOM 759 CA ARG B 50 5.279 -11.089 -0.879 1.00 0.00 C ATOM 760 C ARG B 50 4.904 -12.150 0.156 1.00 0.00 C ATOM 761 O ARG B 50 4.776 -11.850 1.345 1.00 0.00 O ATOM 762 CB ARG B 50 6.746 -10.670 -0.694 1.00 0.00 C ATOM 763 CG ARG B 50 7.018 -9.938 0.612 1.00 0.00 C ATOM 764 CD ARG B 50 8.497 -9.635 0.803 1.00 0.00 C ATOM 765 NE ARG B 50 9.256 -10.804 1.217 1.00 0.00 N ATOM 766 CZ ARG B 50 10.582 -10.821 1.380 1.00 0.00 C ATOM 767 NH1 ARG B 50 11.305 -9.733 1.142 1.00 0.00 N ATOM 768 NH2 ARG B 50 11.184 -11.932 1.781 1.00 0.00 N ATOM 0 H ARG B 50 4.301 -9.582 0.189 1.00 0.00 H new ATOM 0 HA ARG B 50 5.165 -11.508 -1.879 1.00 0.00 H new ATOM 0 HB2 ARG B 50 7.376 -11.558 -0.739 1.00 0.00 H new ATOM 0 HB3 ARG B 50 7.038 -10.029 -1.526 1.00 0.00 H new ATOM 0 HG2 ARG B 50 6.453 -9.006 0.629 1.00 0.00 H new ATOM 0 HG3 ARG B 50 6.662 -10.542 1.446 1.00 0.00 H new ATOM 0 HD2 ARG B 50 8.909 -9.250 -0.130 1.00 0.00 H new ATOM 0 HD3 ARG B 50 8.610 -8.849 1.550 1.00 0.00 H new ATOM 0 HE ARG B 50 8.743 -11.667 1.395 1.00 0.00 H new ATOM 0 HH11 ARG B 50 10.849 -8.875 0.832 1.00 0.00 H new ATOM 0 HH12 ARG B 50 12.317 -9.755 1.269 1.00 0.00 H new ATOM 0 HH21 ARG B 50 10.635 -12.772 1.964 1.00 0.00 H new ATOM 0 HH22 ARG B 50 12.196 -11.947 1.906 1.00 0.00 H new ATOM 782 N PRO B 51 4.698 -13.400 -0.283 1.00 0.00 N ATOM 783 CA PRO B 51 4.389 -14.511 0.616 1.00 0.00 C ATOM 784 C PRO B 51 5.591 -14.916 1.467 1.00 0.00 C ATOM 785 O PRO B 51 6.675 -15.188 0.945 1.00 0.00 O ATOM 786 CB PRO B 51 4.004 -15.661 -0.326 1.00 0.00 C ATOM 787 CG PRO B 51 3.868 -15.053 -1.684 1.00 0.00 C ATOM 788 CD PRO B 51 4.731 -13.828 -1.687 1.00 0.00 C ATOM 0 HA PRO B 51 3.603 -14.244 1.322 1.00 0.00 H new ATOM 0 HB2 PRO B 51 4.766 -16.440 -0.322 1.00 0.00 H new ATOM 0 HB3 PRO B 51 3.070 -16.127 -0.012 1.00 0.00 H new ATOM 0 HG2 PRO B 51 4.185 -15.753 -2.457 1.00 0.00 H new ATOM 0 HG3 PRO B 51 2.829 -14.797 -1.893 1.00 0.00 H new ATOM 0 HD2 PRO B 51 5.746 -14.049 -2.018 1.00 0.00 H new ATOM 0 HD3 PRO B 51 4.339 -13.059 -2.353 1.00 0.00 H new ATOM 796 N LYS B 52 5.391 -14.974 2.776 1.00 0.00 N ATOM 797 CA LYS B 52 6.447 -15.362 3.707 1.00 0.00 C ATOM 798 C LYS B 52 6.860 -16.818 3.503 1.00 0.00 C ATOM 799 O LYS B 52 7.919 -17.243 3.957 1.00 0.00 O ATOM 800 CB LYS B 52 5.983 -15.144 5.146 1.00 0.00 C ATOM 801 CG LYS B 52 6.279 -13.750 5.679 1.00 0.00 C ATOM 802 CD LYS B 52 7.755 -13.599 6.020 1.00 0.00 C ATOM 803 CE LYS B 52 8.077 -12.222 6.576 1.00 0.00 C ATOM 804 NZ LYS B 52 7.251 -11.887 7.767 1.00 0.00 N ATOM 0 H LYS B 52 4.500 -14.756 3.222 1.00 0.00 H new ATOM 0 HA LYS B 52 7.317 -14.735 3.511 1.00 0.00 H new ATOM 0 HB2 LYS B 52 4.910 -15.325 5.204 1.00 0.00 H new ATOM 0 HB3 LYS B 52 6.466 -15.880 5.790 1.00 0.00 H new ATOM 0 HG2 LYS B 52 5.996 -13.005 4.936 1.00 0.00 H new ATOM 0 HG3 LYS B 52 5.676 -13.560 6.567 1.00 0.00 H new ATOM 0 HD2 LYS B 52 8.037 -14.359 6.749 1.00 0.00 H new ATOM 0 HD3 LYS B 52 8.353 -13.777 5.126 1.00 0.00 H new ATOM 0 HE2 LYS B 52 9.132 -12.179 6.845 1.00 0.00 H new ATOM 0 HE3 LYS B 52 7.914 -11.473 5.801 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 7.759 -11.200 8.360 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 6.347 -11.475 7.458 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 7.068 -12.751 8.317 1.00 0.00 H new ATOM 818 N ASN B 53 6.019 -17.572 2.808 1.00 0.00 N ATOM 819 CA ASN B 53 6.287 -18.983 2.537 1.00 0.00 C ATOM 820 C ASN B 53 7.040 -19.149 1.224 1.00 0.00 C ATOM 821 O ASN B 53 7.274 -20.266 0.764 1.00 0.00 O ATOM 822 CB ASN B 53 4.981 -19.784 2.486 1.00 0.00 C ATOM 823 CG ASN B 53 4.332 -19.954 3.847 1.00 0.00 C ATOM 824 OD1 ASN B 53 3.609 -20.920 4.087 1.00 0.00 O ATOM 825 ND2 ASN B 53 4.598 -19.026 4.746 1.00 0.00 N ATOM 0 H ASN B 53 5.140 -17.230 2.419 1.00 0.00 H new ATOM 0 HA ASN B 53 6.906 -19.365 3.349 1.00 0.00 H new ATOM 0 HB2 ASN B 53 4.281 -19.284 1.817 1.00 0.00 H new ATOM 0 HB3 ASN B 53 5.182 -20.767 2.061 1.00 0.00 H new ATOM 0 HD21 ASN B 53 4.199 -19.093 5.682 1.00 0.00 H new ATOM 0 HD22 ASN B 53 5.203 -18.241 4.505 1.00 0.00 H new ATOM 832 N SER B 54 7.415 -18.034 0.621 1.00 0.00 N ATOM 833 CA SER B 54 8.114 -18.064 -0.658 1.00 0.00 C ATOM 834 C SER B 54 9.474 -17.376 -0.550 1.00 0.00 C ATOM 835 O SER B 54 9.931 -17.077 0.558 1.00 0.00 O ATOM 836 CB SER B 54 7.263 -17.400 -1.741 1.00 0.00 C ATOM 837 OG SER B 54 7.122 -16.009 -1.509 1.00 0.00 O ATOM 0 H SER B 54 7.249 -17.099 0.992 1.00 0.00 H new ATOM 0 HA SER B 54 8.282 -19.105 -0.934 1.00 0.00 H new ATOM 0 HB2 SER B 54 7.721 -17.563 -2.716 1.00 0.00 H new ATOM 0 HB3 SER B 54 6.279 -17.867 -1.769 1.00 0.00 H new ATOM 0 HG SER B 54 7.215 -15.826 -0.551 1.00 0.00 H new ATOM 843 N VAL B 55 10.121 -17.132 -1.687 1.00 0.00 N ATOM 844 CA VAL B 55 11.410 -16.465 -1.704 1.00 0.00 C ATOM 845 C VAL B 55 11.272 -14.999 -1.275 1.00 0.00 C ATOM 846 O VAL B 55 12.140 -14.461 -0.582 1.00 0.00 O ATOM 847 CB VAL B 55 12.075 -16.565 -3.096 1.00 0.00 C ATOM 848 CG1 VAL B 55 11.244 -15.877 -4.168 1.00 0.00 C ATOM 849 CG2 VAL B 55 13.479 -15.996 -3.062 1.00 0.00 C ATOM 0 H VAL B 55 9.768 -17.389 -2.609 1.00 0.00 H new ATOM 0 HA VAL B 55 12.055 -16.973 -0.987 1.00 0.00 H new ATOM 0 HB VAL B 55 12.134 -17.622 -3.354 1.00 0.00 H new ATOM 0 HG11 VAL B 55 11.745 -15.969 -5.132 1.00 0.00 H new ATOM 0 HG12 VAL B 55 10.261 -16.346 -4.223 1.00 0.00 H new ATOM 0 HG13 VAL B 55 11.129 -14.822 -3.918 1.00 0.00 H new ATOM 0 HG21 VAL B 55 13.928 -16.077 -4.052 1.00 0.00 H new ATOM 0 HG22 VAL B 55 13.440 -14.948 -2.766 1.00 0.00 H new ATOM 0 HG23 VAL B 55 14.080 -16.554 -2.344 1.00 0.00 H new ATOM 859 N GLY B 56 10.172 -14.363 -1.671 1.00 0.00 N ATOM 860 CA GLY B 56 9.905 -13.009 -1.224 1.00 0.00 C ATOM 861 C GLY B 56 9.809 -12.003 -2.349 1.00 0.00 C ATOM 862 O GLY B 56 10.173 -10.839 -2.184 1.00 0.00 O ATOM 0 H GLY B 56 9.465 -14.760 -2.290 1.00 0.00 H new ATOM 0 HA2 GLY B 56 8.972 -13.000 -0.660 1.00 0.00 H new ATOM 0 HA3 GLY B 56 10.695 -12.700 -0.539 1.00 0.00 H new ATOM 866 N ARG B 57 9.318 -12.442 -3.489 1.00 0.00 N ATOM 867 CA ARG B 57 9.122 -11.556 -4.627 1.00 0.00 C ATOM 868 C ARG B 57 7.830 -10.767 -4.477 1.00 0.00 C ATOM 869 O ARG B 57 6.821 -11.291 -4.007 1.00 0.00 O ATOM 870 CB ARG B 57 9.105 -12.344 -5.937 1.00 0.00 C ATOM 871 CG ARG B 57 10.452 -12.938 -6.309 1.00 0.00 C ATOM 872 CD ARG B 57 11.531 -11.868 -6.392 1.00 0.00 C ATOM 873 NE ARG B 57 11.183 -10.807 -7.337 1.00 0.00 N ATOM 874 CZ ARG B 57 11.493 -9.521 -7.168 1.00 0.00 C ATOM 875 NH1 ARG B 57 12.147 -9.119 -6.084 1.00 0.00 N ATOM 876 NH2 ARG B 57 11.145 -8.631 -8.083 1.00 0.00 N ATOM 0 H ARG B 57 9.045 -13.410 -3.657 1.00 0.00 H new ATOM 0 HA ARG B 57 9.959 -10.858 -4.654 1.00 0.00 H new ATOM 0 HB2 ARG B 57 8.373 -13.148 -5.858 1.00 0.00 H new ATOM 0 HB3 ARG B 57 8.773 -11.688 -6.741 1.00 0.00 H new ATOM 0 HG2 ARG B 57 10.737 -13.687 -5.570 1.00 0.00 H new ATOM 0 HG3 ARG B 57 10.372 -13.451 -7.268 1.00 0.00 H new ATOM 0 HD2 ARG B 57 11.689 -11.435 -5.404 1.00 0.00 H new ATOM 0 HD3 ARG B 57 12.473 -12.326 -6.693 1.00 0.00 H new ATOM 0 HE ARG B 57 10.670 -11.068 -8.179 1.00 0.00 H new ATOM 0 HH11 ARG B 57 12.417 -9.796 -5.371 1.00 0.00 H new ATOM 0 HH12 ARG B 57 12.379 -8.133 -5.965 1.00 0.00 H new ATOM 0 HH21 ARG B 57 10.640 -8.928 -8.918 1.00 0.00 H new ATOM 0 HH22 ARG B 57 11.382 -7.647 -7.954 1.00 0.00 H new ATOM 890 N TRP B 58 7.872 -9.505 -4.868 1.00 0.00 N ATOM 891 CA TRP B 58 6.722 -8.625 -4.735 1.00 0.00 C ATOM 892 C TRP B 58 5.868 -8.639 -5.992 1.00 0.00 C ATOM 893 O TRP B 58 6.361 -8.369 -7.091 1.00 0.00 O ATOM 894 CB TRP B 58 7.175 -7.193 -4.450 1.00 0.00 C ATOM 895 CG TRP B 58 7.943 -7.056 -3.176 1.00 0.00 C ATOM 896 CD1 TRP B 58 9.294 -7.144 -3.021 1.00 0.00 C ATOM 897 CD2 TRP B 58 7.403 -6.813 -1.874 1.00 0.00 C ATOM 898 NE1 TRP B 58 9.628 -6.969 -1.703 1.00 0.00 N ATOM 899 CE2 TRP B 58 8.485 -6.764 -0.978 1.00 0.00 C ATOM 900 CE3 TRP B 58 6.111 -6.630 -1.378 1.00 0.00 C ATOM 901 CZ2 TRP B 58 8.313 -6.544 0.384 1.00 0.00 C ATOM 902 CZ3 TRP B 58 5.941 -6.410 -0.027 1.00 0.00 C ATOM 903 CH2 TRP B 58 7.036 -6.371 0.841 1.00 0.00 C ATOM 0 H TRP B 58 8.694 -9.065 -5.282 1.00 0.00 H new ATOM 0 HA TRP B 58 6.124 -8.992 -3.901 1.00 0.00 H new ATOM 0 HB2 TRP B 58 7.793 -6.844 -5.277 1.00 0.00 H new ATOM 0 HB3 TRP B 58 6.300 -6.544 -4.410 1.00 0.00 H new ATOM 0 HD1 TRP B 58 9.998 -7.325 -3.819 1.00 0.00 H new ATOM 0 HE1 TRP B 58 10.575 -6.988 -1.324 1.00 0.00 H new ATOM 0 HE3 TRP B 58 5.259 -6.660 -2.041 1.00 0.00 H new ATOM 0 HZ2 TRP B 58 9.157 -6.511 1.057 1.00 0.00 H new ATOM 0 HZ3 TRP B 58 4.946 -6.266 0.367 1.00 0.00 H new ATOM 0 HH2 TRP B 58 6.870 -6.201 1.894 1.00 0.00 H new ATOM 914 N LYS B 59 4.599 -8.972 -5.839 1.00 0.00 N ATOM 915 CA LYS B 59 3.649 -8.798 -6.921 1.00 0.00 C ATOM 916 C LYS B 59 3.173 -7.354 -6.913 1.00 0.00 C ATOM 917 O LYS B 59 2.869 -6.812 -5.853 1.00 0.00 O ATOM 918 CB LYS B 59 2.451 -9.741 -6.779 1.00 0.00 C ATOM 919 CG LYS B 59 2.814 -11.216 -6.735 1.00 0.00 C ATOM 920 CD LYS B 59 1.576 -12.091 -6.867 1.00 0.00 C ATOM 921 CE LYS B 59 1.912 -13.571 -6.761 1.00 0.00 C ATOM 922 NZ LYS B 59 2.292 -13.963 -5.378 1.00 0.00 N ATOM 0 H LYS B 59 4.205 -9.362 -4.983 1.00 0.00 H new ATOM 0 HA LYS B 59 4.141 -9.037 -7.864 1.00 0.00 H new ATOM 0 HB2 LYS B 59 1.909 -9.486 -5.868 1.00 0.00 H new ATOM 0 HB3 LYS B 59 1.770 -9.572 -7.613 1.00 0.00 H new ATOM 0 HG2 LYS B 59 3.512 -11.446 -7.540 1.00 0.00 H new ATOM 0 HG3 LYS B 59 3.323 -11.440 -5.798 1.00 0.00 H new ATOM 0 HD2 LYS B 59 0.859 -11.825 -6.090 1.00 0.00 H new ATOM 0 HD3 LYS B 59 1.094 -11.896 -7.825 1.00 0.00 H new ATOM 0 HE2 LYS B 59 1.053 -14.161 -7.081 1.00 0.00 H new ATOM 0 HE3 LYS B 59 2.731 -13.806 -7.441 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 2.430 -14.993 -5.335 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 3.176 -13.484 -5.112 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 1.536 -13.687 -4.719 1.00 0.00 H new ATOM 936 N GLU B 60 3.127 -6.727 -8.074 1.00 0.00 N ATOM 937 CA GLU B 60 2.756 -5.323 -8.152 1.00 0.00 C ATOM 938 C GLU B 60 1.433 -5.140 -8.874 1.00 0.00 C ATOM 939 O GLU B 60 1.262 -5.594 -10.007 1.00 0.00 O ATOM 940 CB GLU B 60 3.840 -4.516 -8.866 1.00 0.00 C ATOM 941 CG GLU B 60 5.165 -4.481 -8.128 1.00 0.00 C ATOM 942 CD GLU B 60 6.204 -3.642 -8.835 1.00 0.00 C ATOM 943 OE1 GLU B 60 6.188 -2.405 -8.669 1.00 0.00 O ATOM 944 OE2 GLU B 60 7.047 -4.215 -9.552 1.00 0.00 O ATOM 0 H GLU B 60 3.340 -7.163 -8.971 1.00 0.00 H new ATOM 0 HA GLU B 60 2.649 -4.959 -7.130 1.00 0.00 H new ATOM 0 HB2 GLU B 60 3.999 -4.938 -9.859 1.00 0.00 H new ATOM 0 HB3 GLU B 60 3.486 -3.495 -9.006 1.00 0.00 H new ATOM 0 HG2 GLU B 60 5.007 -4.086 -7.124 1.00 0.00 H new ATOM 0 HG3 GLU B 60 5.540 -5.498 -8.015 1.00 0.00 H new ATOM 951 N ALA B 61 0.502 -4.478 -8.209 1.00 0.00 N ATOM 952 CA ALA B 61 -0.780 -4.142 -8.805 1.00 0.00 C ATOM 953 C ALA B 61 -0.971 -2.631 -8.814 1.00 0.00 C ATOM 954 O ALA B 61 -0.709 -1.966 -7.814 1.00 0.00 O ATOM 955 CB ALA B 61 -1.910 -4.815 -8.041 1.00 0.00 C ATOM 0 H ALA B 61 0.612 -4.160 -7.246 1.00 0.00 H new ATOM 0 HA ALA B 61 -0.796 -4.503 -9.833 1.00 0.00 H new ATOM 0 HB1 ALA B 61 -2.864 -4.554 -8.499 1.00 0.00 H new ATOM 0 HB2 ALA B 61 -1.776 -5.896 -8.071 1.00 0.00 H new ATOM 0 HB3 ALA B 61 -1.900 -4.477 -7.005 1.00 0.00 H new ATOM 961 N THR B 62 -1.411 -2.092 -9.940 1.00 0.00 N ATOM 962 CA THR B 62 -1.620 -0.658 -10.062 1.00 0.00 C ATOM 963 C THR B 62 -3.103 -0.315 -9.947 1.00 0.00 C ATOM 964 O THR B 62 -3.922 -0.755 -10.754 1.00 0.00 O ATOM 965 CB THR B 62 -1.071 -0.133 -11.400 1.00 0.00 C ATOM 966 OG1 THR B 62 0.280 -0.581 -11.579 1.00 0.00 O ATOM 967 CG2 THR B 62 -1.109 1.387 -11.443 1.00 0.00 C ATOM 0 H THR B 62 -1.630 -2.625 -10.782 1.00 0.00 H new ATOM 0 HA THR B 62 -1.080 -0.176 -9.247 1.00 0.00 H new ATOM 0 HB THR B 62 -1.698 -0.520 -12.203 1.00 0.00 H new ATOM 0 HG1 THR B 62 0.625 -0.246 -12.433 1.00 0.00 H new ATOM 0 HG21 THR B 62 -0.716 1.734 -12.399 1.00 0.00 H new ATOM 0 HG22 THR B 62 -2.138 1.729 -11.328 1.00 0.00 H new ATOM 0 HG23 THR B 62 -0.501 1.789 -10.633 1.00 0.00 H new ATOM 975 N ILE B 63 -3.441 0.456 -8.927 1.00 0.00 N ATOM 976 CA ILE B 63 -4.816 0.860 -8.681 1.00 0.00 C ATOM 977 C ILE B 63 -4.968 2.362 -8.896 1.00 0.00 C ATOM 978 O ILE B 63 -4.241 3.149 -8.297 1.00 0.00 O ATOM 979 CB ILE B 63 -5.263 0.518 -7.235 1.00 0.00 C ATOM 980 CG1 ILE B 63 -5.193 -0.989 -6.970 1.00 0.00 C ATOM 981 CG2 ILE B 63 -6.672 1.029 -6.966 1.00 0.00 C ATOM 982 CD1 ILE B 63 -3.822 -1.485 -6.558 1.00 0.00 C ATOM 0 H ILE B 63 -2.772 0.819 -8.248 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.445 0.311 -9.382 1.00 0.00 H new ATOM 0 HB ILE B 63 -4.573 1.017 -6.555 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -5.909 -1.242 -6.188 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -5.503 -1.519 -7.870 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -6.962 0.777 -5.946 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -6.697 2.111 -7.093 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -7.367 0.565 -7.666 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -3.860 -2.561 -6.390 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -3.103 -1.266 -7.348 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -3.515 -0.985 -5.639 1.00 0.00 H new ATOM 994 N PRO B 64 -5.895 2.777 -9.773 1.00 0.00 N ATOM 995 CA PRO B 64 -6.206 4.195 -9.986 1.00 0.00 C ATOM 996 C PRO B 64 -6.435 4.938 -8.669 1.00 0.00 C ATOM 997 O PRO B 64 -7.074 4.411 -7.750 1.00 0.00 O ATOM 998 CB PRO B 64 -7.492 4.151 -10.806 1.00 0.00 C ATOM 999 CG PRO B 64 -7.417 2.864 -11.550 1.00 0.00 C ATOM 1000 CD PRO B 64 -6.695 1.900 -10.648 1.00 0.00 C ATOM 0 HA PRO B 64 -5.391 4.727 -10.476 1.00 0.00 H new ATOM 0 HB2 PRO B 64 -8.373 4.188 -10.165 1.00 0.00 H new ATOM 0 HB3 PRO B 64 -7.558 5.000 -11.487 1.00 0.00 H new ATOM 0 HG2 PRO B 64 -8.414 2.497 -11.794 1.00 0.00 H new ATOM 0 HG3 PRO B 64 -6.884 2.989 -12.492 1.00 0.00 H new ATOM 0 HD2 PRO B 64 -7.392 1.289 -10.074 1.00 0.00 H new ATOM 0 HD3 PRO B 64 -6.064 1.216 -11.215 1.00 0.00 H new ATOM 1008 N GLY B 65 -5.925 6.166 -8.595 1.00 0.00 N ATOM 1009 CA GLY B 65 -5.968 6.942 -7.362 1.00 0.00 C ATOM 1010 C GLY B 65 -7.344 7.493 -7.034 1.00 0.00 C ATOM 1011 O GLY B 65 -7.497 8.684 -6.759 1.00 0.00 O ATOM 0 H GLY B 65 -5.477 6.644 -9.377 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -5.632 6.315 -6.537 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -5.264 7.770 -7.440 1.00 0.00 H new ATOM 1015 N HIS B 66 -8.345 6.625 -7.069 1.00 0.00 N ATOM 1016 CA HIS B 66 -9.709 6.990 -6.709 1.00 0.00 C ATOM 1017 C HIS B 66 -10.557 5.747 -6.452 1.00 0.00 C ATOM 1018 O HIS B 66 -11.784 5.819 -6.419 1.00 0.00 O ATOM 1019 CB HIS B 66 -10.358 7.874 -7.789 1.00 0.00 C ATOM 1020 CG HIS B 66 -10.141 7.408 -9.200 1.00 0.00 C ATOM 1021 ND1 HIS B 66 -9.334 8.081 -10.093 1.00 0.00 N ATOM 1022 CD2 HIS B 66 -10.635 6.343 -9.873 1.00 0.00 C ATOM 1023 CE1 HIS B 66 -9.343 7.450 -11.253 1.00 0.00 C ATOM 1024 NE2 HIS B 66 -10.123 6.394 -11.145 1.00 0.00 N ATOM 0 H HIS B 66 -8.236 5.650 -7.347 1.00 0.00 H new ATOM 0 HA HIS B 66 -9.660 7.569 -5.787 1.00 0.00 H new ATOM 0 HB2 HIS B 66 -11.430 7.926 -7.600 1.00 0.00 H new ATOM 0 HB3 HIS B 66 -9.968 8.887 -7.692 1.00 0.00 H new ATOM 0 HD2 HIS B 66 -11.307 5.593 -9.482 1.00 0.00 H new ATOM 0 HE1 HIS B 66 -8.803 7.749 -12.139 1.00 0.00 H new ATOM 0 HE2 HIS B 66 -10.315 5.722 -11.888 1.00 0.00 H new ATOM 1033 N LEU B 67 -9.898 4.605 -6.279 1.00 0.00 N ATOM 1034 CA LEU B 67 -10.600 3.373 -5.937 1.00 0.00 C ATOM 1035 C LEU B 67 -10.420 3.062 -4.461 1.00 0.00 C ATOM 1036 O LEU B 67 -11.371 2.717 -3.761 1.00 0.00 O ATOM 1037 CB LEU B 67 -10.105 2.193 -6.779 1.00 0.00 C ATOM 1038 CG LEU B 67 -10.342 2.308 -8.287 1.00 0.00 C ATOM 1039 CD1 LEU B 67 -9.946 1.020 -8.990 1.00 0.00 C ATOM 1040 CD2 LEU B 67 -11.793 2.647 -8.581 1.00 0.00 C ATOM 0 H LEU B 67 -8.887 4.507 -6.369 1.00 0.00 H new ATOM 0 HA LEU B 67 -11.658 3.523 -6.152 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -9.036 2.070 -6.606 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -10.592 1.286 -6.421 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.718 3.117 -8.667 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -10.122 1.121 -10.061 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -8.889 0.819 -8.813 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -10.543 0.195 -8.601 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -11.938 2.724 -9.659 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -12.438 1.863 -8.183 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -12.047 3.598 -8.112 1.00 0.00 H new ATOM 1052 N ASN B 68 -9.171 3.194 -4.010 1.00 0.00 N ATOM 1053 CA ASN B 68 -8.810 3.079 -2.592 1.00 0.00 C ATOM 1054 C ASN B 68 -8.994 1.659 -2.068 1.00 0.00 C ATOM 1055 O ASN B 68 -9.026 1.436 -0.856 1.00 0.00 O ATOM 1056 CB ASN B 68 -9.620 4.065 -1.738 1.00 0.00 C ATOM 1057 CG ASN B 68 -9.442 5.509 -2.173 1.00 0.00 C ATOM 1058 OD1 ASN B 68 -8.398 5.890 -2.706 1.00 0.00 O ATOM 1059 ND2 ASN B 68 -10.461 6.321 -1.949 1.00 0.00 N ATOM 0 H ASN B 68 -8.376 3.385 -4.620 1.00 0.00 H new ATOM 0 HA ASN B 68 -7.752 3.328 -2.514 1.00 0.00 H new ATOM 0 HB2 ASN B 68 -10.676 3.802 -1.792 1.00 0.00 H new ATOM 0 HB3 ASN B 68 -9.320 3.966 -0.695 1.00 0.00 H new ATOM 0 HD21 ASN B 68 -10.400 7.302 -2.220 1.00 0.00 H new ATOM 0 HD22 ASN B 68 -11.308 5.966 -1.505 1.00 0.00 H new ATOM 1066 N SER B 69 -9.091 0.702 -2.980 1.00 0.00 N ATOM 1067 CA SER B 69 -9.274 -0.692 -2.613 1.00 0.00 C ATOM 1068 C SER B 69 -8.863 -1.601 -3.764 1.00 0.00 C ATOM 1069 O SER B 69 -8.954 -1.213 -4.931 1.00 0.00 O ATOM 1070 CB SER B 69 -10.734 -0.941 -2.236 1.00 0.00 C ATOM 1071 OG SER B 69 -11.605 -0.497 -3.262 1.00 0.00 O ATOM 0 H SER B 69 -9.045 0.869 -3.985 1.00 0.00 H new ATOM 0 HA SER B 69 -8.643 -0.917 -1.754 1.00 0.00 H new ATOM 0 HB2 SER B 69 -10.891 -2.004 -2.056 1.00 0.00 H new ATOM 0 HB3 SER B 69 -10.967 -0.422 -1.306 1.00 0.00 H new ATOM 0 HG SER B 69 -12.534 -0.668 -2.999 1.00 0.00 H new ATOM 1077 N TYR B 70 -8.400 -2.799 -3.434 1.00 0.00 N ATOM 1078 CA TYR B 70 -8.033 -3.778 -4.445 1.00 0.00 C ATOM 1079 C TYR B 70 -8.383 -5.185 -3.979 1.00 0.00 C ATOM 1080 O TYR B 70 -8.220 -5.518 -2.805 1.00 0.00 O ATOM 1081 CB TYR B 70 -6.537 -3.691 -4.761 1.00 0.00 C ATOM 1082 CG TYR B 70 -6.093 -4.621 -5.873 1.00 0.00 C ATOM 1083 CD1 TYR B 70 -5.270 -5.707 -5.608 1.00 0.00 C ATOM 1084 CD2 TYR B 70 -6.509 -4.418 -7.183 1.00 0.00 C ATOM 1085 CE1 TYR B 70 -4.871 -6.564 -6.617 1.00 0.00 C ATOM 1086 CE2 TYR B 70 -6.114 -5.270 -8.198 1.00 0.00 C ATOM 1087 CZ TYR B 70 -5.297 -6.341 -7.909 1.00 0.00 C ATOM 1088 OH TYR B 70 -4.900 -7.195 -8.916 1.00 0.00 O ATOM 0 H TYR B 70 -8.270 -3.115 -2.473 1.00 0.00 H new ATOM 0 HA TYR B 70 -8.597 -3.557 -5.351 1.00 0.00 H new ATOM 0 HB2 TYR B 70 -6.292 -2.666 -5.038 1.00 0.00 H new ATOM 0 HB3 TYR B 70 -5.970 -3.921 -3.859 1.00 0.00 H new ATOM 0 HD1 TYR B 70 -4.936 -5.886 -4.597 1.00 0.00 H new ATOM 0 HD2 TYR B 70 -7.152 -3.581 -7.412 1.00 0.00 H new ATOM 0 HE1 TYR B 70 -4.229 -7.403 -6.394 1.00 0.00 H new ATOM 0 HE2 TYR B 70 -6.444 -5.097 -9.212 1.00 0.00 H new ATOM 0 HH TYR B 70 -5.287 -6.900 -9.767 1.00 0.00 H new ATOM 1098 N THR B 71 -8.876 -5.998 -4.895 1.00 0.00 N ATOM 1099 CA THR B 71 -9.162 -7.389 -4.597 1.00 0.00 C ATOM 1100 C THR B 71 -7.962 -8.258 -4.961 1.00 0.00 C ATOM 1101 O THR B 71 -7.746 -8.574 -6.130 1.00 0.00 O ATOM 1102 CB THR B 71 -10.402 -7.878 -5.366 1.00 0.00 C ATOM 1103 OG1 THR B 71 -11.478 -6.946 -5.189 1.00 0.00 O ATOM 1104 CG2 THR B 71 -10.839 -9.254 -4.883 1.00 0.00 C ATOM 0 H THR B 71 -9.087 -5.718 -5.853 1.00 0.00 H new ATOM 0 HA THR B 71 -9.363 -7.470 -3.529 1.00 0.00 H new ATOM 0 HB THR B 71 -10.142 -7.949 -6.422 1.00 0.00 H new ATOM 0 HG1 THR B 71 -12.266 -7.259 -5.681 1.00 0.00 H new ATOM 0 HG21 THR B 71 -11.717 -9.574 -5.444 1.00 0.00 H new ATOM 0 HG22 THR B 71 -10.030 -9.968 -5.037 1.00 0.00 H new ATOM 0 HG23 THR B 71 -11.084 -9.206 -3.822 1.00 0.00 H new ATOM 1112 N ILE B 72 -7.171 -8.621 -3.961 1.00 0.00 N ATOM 1113 CA ILE B 72 -6.000 -9.453 -4.187 1.00 0.00 C ATOM 1114 C ILE B 72 -6.416 -10.911 -4.305 1.00 0.00 C ATOM 1115 O ILE B 72 -6.831 -11.530 -3.322 1.00 0.00 O ATOM 1116 CB ILE B 72 -4.960 -9.320 -3.054 1.00 0.00 C ATOM 1117 CG1 ILE B 72 -4.600 -7.853 -2.812 1.00 0.00 C ATOM 1118 CG2 ILE B 72 -3.710 -10.118 -3.397 1.00 0.00 C ATOM 1119 CD1 ILE B 72 -3.676 -7.643 -1.629 1.00 0.00 C ATOM 0 H ILE B 72 -7.319 -8.353 -2.988 1.00 0.00 H new ATOM 0 HA ILE B 72 -5.538 -9.110 -5.113 1.00 0.00 H new ATOM 0 HB ILE B 72 -5.397 -9.718 -2.139 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -4.127 -7.451 -3.708 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -5.516 -7.284 -2.653 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -2.982 -10.018 -2.592 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -3.972 -11.169 -3.521 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -3.280 -9.739 -4.324 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -3.464 -6.580 -1.517 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -4.155 -8.014 -0.723 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -2.744 -8.184 -1.795 1.00 0.00 H new ATOM 1131 N LYS B 73 -6.326 -11.444 -5.510 1.00 0.00 N ATOM 1132 CA LYS B 73 -6.706 -12.823 -5.766 1.00 0.00 C ATOM 1133 C LYS B 73 -5.467 -13.709 -5.836 1.00 0.00 C ATOM 1134 O LYS B 73 -4.551 -13.452 -6.621 1.00 0.00 O ATOM 1135 CB LYS B 73 -7.501 -12.909 -7.068 1.00 0.00 C ATOM 1136 CG LYS B 73 -8.713 -11.991 -7.085 1.00 0.00 C ATOM 1137 CD LYS B 73 -9.448 -12.046 -8.411 1.00 0.00 C ATOM 1138 CE LYS B 73 -10.615 -11.072 -8.428 1.00 0.00 C ATOM 1139 NZ LYS B 73 -11.353 -11.106 -9.716 1.00 0.00 N ATOM 0 H LYS B 73 -5.991 -10.940 -6.331 1.00 0.00 H new ATOM 0 HA LYS B 73 -7.334 -13.176 -4.948 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -6.848 -12.656 -7.903 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -7.829 -13.937 -7.220 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -9.393 -12.273 -6.281 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -8.395 -10.967 -6.889 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -8.760 -11.809 -9.222 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -9.812 -13.058 -8.587 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -11.298 -11.311 -7.613 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -10.246 -10.062 -8.249 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -12.140 -10.427 -9.683 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -10.709 -10.852 -10.492 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -11.728 -12.063 -9.876 1.00 0.00 H new ATOM 1153 N GLY B 74 -5.442 -14.742 -5.012 1.00 0.00 N ATOM 1154 CA GLY B 74 -4.309 -15.644 -4.981 1.00 0.00 C ATOM 1155 C GLY B 74 -3.639 -15.687 -3.623 1.00 0.00 C ATOM 1156 O GLY B 74 -2.452 -16.002 -3.521 1.00 0.00 O ATOM 0 H GLY B 74 -6.190 -14.975 -4.359 1.00 0.00 H new ATOM 0 HA2 GLY B 74 -4.640 -16.647 -5.251 1.00 0.00 H new ATOM 0 HA3 GLY B 74 -3.582 -15.335 -5.732 1.00 0.00 H new ATOM 1160 N LEU B 75 -4.390 -15.357 -2.580 1.00 0.00 N ATOM 1161 CA LEU B 75 -3.870 -15.403 -1.218 1.00 0.00 C ATOM 1162 C LEU B 75 -4.397 -16.629 -0.488 1.00 0.00 C ATOM 1163 O LEU B 75 -5.592 -16.912 -0.514 1.00 0.00 O ATOM 1164 CB LEU B 75 -4.251 -14.143 -0.438 1.00 0.00 C ATOM 1165 CG LEU B 75 -3.755 -12.824 -1.030 1.00 0.00 C ATOM 1166 CD1 LEU B 75 -4.011 -11.687 -0.060 1.00 0.00 C ATOM 1167 CD2 LEU B 75 -2.276 -12.905 -1.377 1.00 0.00 C ATOM 0 H LEU B 75 -5.362 -15.054 -2.650 1.00 0.00 H new ATOM 0 HA LEU B 75 -2.783 -15.459 -1.282 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -5.337 -14.100 -0.361 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -3.863 -14.234 0.576 1.00 0.00 H new ATOM 0 HG LEU B 75 -4.307 -12.632 -1.950 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -3.654 -10.752 -0.492 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -5.080 -11.610 0.137 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -3.483 -11.880 0.874 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -1.948 -11.954 -1.796 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -1.702 -13.121 -0.476 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -2.117 -13.698 -2.108 1.00 0.00 H new ATOM 1179 N LYS B 76 -3.503 -17.352 0.160 1.00 0.00 N ATOM 1180 CA LYS B 76 -3.874 -18.561 0.872 1.00 0.00 C ATOM 1181 C LYS B 76 -4.059 -18.287 2.363 1.00 0.00 C ATOM 1182 O LYS B 76 -3.140 -17.814 3.033 1.00 0.00 O ATOM 1183 CB LYS B 76 -2.801 -19.629 0.661 1.00 0.00 C ATOM 1184 CG LYS B 76 -2.676 -20.088 -0.783 1.00 0.00 C ATOM 1185 CD LYS B 76 -1.565 -21.109 -0.952 1.00 0.00 C ATOM 1186 CE LYS B 76 -0.201 -20.457 -1.087 1.00 0.00 C ATOM 1187 NZ LYS B 76 0.867 -21.467 -1.306 1.00 0.00 N ATOM 0 H LYS B 76 -2.510 -17.122 0.208 1.00 0.00 H new ATOM 0 HA LYS B 76 -4.825 -18.918 0.477 1.00 0.00 H new ATOM 0 HB2 LYS B 76 -1.840 -19.237 0.994 1.00 0.00 H new ATOM 0 HB3 LYS B 76 -3.029 -20.490 1.289 1.00 0.00 H new ATOM 0 HG2 LYS B 76 -3.621 -20.521 -1.111 1.00 0.00 H new ATOM 0 HG3 LYS B 76 -2.480 -19.228 -1.423 1.00 0.00 H new ATOM 0 HD2 LYS B 76 -1.560 -21.783 -0.095 1.00 0.00 H new ATOM 0 HD3 LYS B 76 -1.764 -21.717 -1.835 1.00 0.00 H new ATOM 0 HE2 LYS B 76 -0.214 -19.753 -1.919 1.00 0.00 H new ATOM 0 HE3 LYS B 76 0.019 -19.882 -0.187 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 1.786 -20.987 -1.394 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 0.895 -22.123 -0.500 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 0.669 -21.998 -2.178 1.00 0.00 H new ATOM 1201 N PRO B 77 -5.256 -18.577 2.902 1.00 0.00 N ATOM 1202 CA PRO B 77 -5.537 -18.434 4.334 1.00 0.00 C ATOM 1203 C PRO B 77 -4.650 -19.344 5.176 1.00 0.00 C ATOM 1204 O PRO B 77 -4.677 -20.568 5.032 1.00 0.00 O ATOM 1205 CB PRO B 77 -7.007 -18.849 4.467 1.00 0.00 C ATOM 1206 CG PRO B 77 -7.569 -18.729 3.093 1.00 0.00 C ATOM 1207 CD PRO B 77 -6.436 -19.042 2.159 1.00 0.00 C ATOM 0 HA PRO B 77 -5.343 -17.422 4.688 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -7.097 -19.869 4.842 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -7.537 -18.204 5.168 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -8.398 -19.421 2.948 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -7.957 -17.726 2.915 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -6.379 -20.108 1.937 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -6.543 -18.523 1.206 1.00 0.00 H new ATOM 1215 N GLY B 78 -3.856 -18.737 6.042 1.00 0.00 N ATOM 1216 CA GLY B 78 -2.929 -19.491 6.859 1.00 0.00 C ATOM 1217 C GLY B 78 -1.500 -19.183 6.484 1.00 0.00 C ATOM 1218 O GLY B 78 -0.570 -19.441 7.248 1.00 0.00 O ATOM 0 H GLY B 78 -3.837 -17.729 6.195 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -3.091 -19.255 7.911 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -3.118 -20.558 6.739 1.00 0.00 H new ATOM 1222 N VAL B 79 -1.334 -18.612 5.304 1.00 0.00 N ATOM 1223 CA VAL B 79 -0.027 -18.229 4.802 1.00 0.00 C ATOM 1224 C VAL B 79 0.197 -16.739 5.055 1.00 0.00 C ATOM 1225 O VAL B 79 -0.690 -15.927 4.801 1.00 0.00 O ATOM 1226 CB VAL B 79 0.075 -18.546 3.292 1.00 0.00 C ATOM 1227 CG1 VAL B 79 1.429 -18.177 2.723 1.00 0.00 C ATOM 1228 CG2 VAL B 79 -0.199 -20.016 3.039 1.00 0.00 C ATOM 0 H VAL B 79 -2.102 -18.401 4.667 1.00 0.00 H new ATOM 0 HA VAL B 79 0.744 -18.797 5.323 1.00 0.00 H new ATOM 0 HB VAL B 79 -0.678 -17.941 2.787 1.00 0.00 H new ATOM 0 HG11 VAL B 79 1.455 -18.417 1.660 1.00 0.00 H new ATOM 0 HG12 VAL B 79 1.602 -17.109 2.858 1.00 0.00 H new ATOM 0 HG13 VAL B 79 2.207 -18.739 3.241 1.00 0.00 H new ATOM 0 HG21 VAL B 79 -0.123 -20.222 1.971 1.00 0.00 H new ATOM 0 HG22 VAL B 79 0.531 -20.620 3.578 1.00 0.00 H new ATOM 0 HG23 VAL B 79 -1.202 -20.264 3.386 1.00 0.00 H new ATOM 1238 N VAL B 80 1.350 -16.386 5.607 1.00 0.00 N ATOM 1239 CA VAL B 80 1.644 -14.990 5.923 1.00 0.00 C ATOM 1240 C VAL B 80 2.112 -14.233 4.686 1.00 0.00 C ATOM 1241 O VAL B 80 2.945 -14.725 3.921 1.00 0.00 O ATOM 1242 CB VAL B 80 2.710 -14.864 7.037 1.00 0.00 C ATOM 1243 CG1 VAL B 80 3.005 -13.403 7.350 1.00 0.00 C ATOM 1244 CG2 VAL B 80 2.264 -15.590 8.293 1.00 0.00 C ATOM 0 H VAL B 80 2.095 -17.041 5.845 1.00 0.00 H new ATOM 0 HA VAL B 80 0.714 -14.549 6.283 1.00 0.00 H new ATOM 0 HB VAL B 80 3.627 -15.328 6.673 1.00 0.00 H new ATOM 0 HG11 VAL B 80 3.758 -13.344 8.136 1.00 0.00 H new ATOM 0 HG12 VAL B 80 3.377 -12.907 6.454 1.00 0.00 H new ATOM 0 HG13 VAL B 80 2.092 -12.911 7.684 1.00 0.00 H new ATOM 0 HG21 VAL B 80 3.029 -15.488 9.063 1.00 0.00 H new ATOM 0 HG22 VAL B 80 1.329 -15.158 8.650 1.00 0.00 H new ATOM 0 HG23 VAL B 80 2.113 -16.646 8.069 1.00 0.00 H new ATOM 1254 N TYR B 81 1.561 -13.045 4.491 1.00 0.00 N ATOM 1255 CA TYR B 81 1.939 -12.192 3.379 1.00 0.00 C ATOM 1256 C TYR B 81 2.400 -10.831 3.886 1.00 0.00 C ATOM 1257 O TYR B 81 1.811 -10.269 4.810 1.00 0.00 O ATOM 1258 CB TYR B 81 0.764 -12.014 2.411 1.00 0.00 C ATOM 1259 CG TYR B 81 0.341 -13.291 1.719 1.00 0.00 C ATOM 1260 CD1 TYR B 81 0.942 -13.689 0.533 1.00 0.00 C ATOM 1261 CD2 TYR B 81 -0.658 -14.098 2.251 1.00 0.00 C ATOM 1262 CE1 TYR B 81 0.563 -14.856 -0.101 1.00 0.00 C ATOM 1263 CE2 TYR B 81 -1.041 -15.266 1.621 1.00 0.00 C ATOM 1264 CZ TYR B 81 -0.428 -15.641 0.446 1.00 0.00 C ATOM 1265 OH TYR B 81 -0.799 -16.806 -0.185 1.00 0.00 O ATOM 0 H TYR B 81 0.843 -12.648 5.097 1.00 0.00 H new ATOM 0 HA TYR B 81 2.762 -12.671 2.848 1.00 0.00 H new ATOM 0 HB2 TYR B 81 -0.087 -11.610 2.959 1.00 0.00 H new ATOM 0 HB3 TYR B 81 1.036 -11.276 1.656 1.00 0.00 H new ATOM 0 HD1 TYR B 81 1.718 -13.076 0.099 1.00 0.00 H new ATOM 0 HD2 TYR B 81 -1.142 -13.807 3.171 1.00 0.00 H new ATOM 0 HE1 TYR B 81 1.042 -15.152 -1.023 1.00 0.00 H new ATOM 0 HE2 TYR B 81 -1.818 -15.883 2.048 1.00 0.00 H new ATOM 0 HH TYR B 81 -0.503 -17.574 0.346 1.00 0.00 H new ATOM 1275 N GLU B 82 3.449 -10.308 3.271 1.00 0.00 N ATOM 1276 CA GLU B 82 3.944 -8.977 3.588 1.00 0.00 C ATOM 1277 C GLU B 82 3.490 -8.022 2.499 1.00 0.00 C ATOM 1278 O GLU B 82 3.868 -8.186 1.342 1.00 0.00 O ATOM 1279 CB GLU B 82 5.474 -8.971 3.656 1.00 0.00 C ATOM 1280 CG GLU B 82 6.059 -9.868 4.731 1.00 0.00 C ATOM 1281 CD GLU B 82 5.740 -9.395 6.132 1.00 0.00 C ATOM 1282 OE1 GLU B 82 5.931 -8.193 6.421 1.00 0.00 O ATOM 1283 OE2 GLU B 82 5.332 -10.233 6.963 1.00 0.00 O ATOM 0 H GLU B 82 3.978 -10.789 2.544 1.00 0.00 H new ATOM 0 HA GLU B 82 3.552 -8.670 4.558 1.00 0.00 H new ATOM 0 HB2 GLU B 82 5.869 -9.279 2.688 1.00 0.00 H new ATOM 0 HB3 GLU B 82 5.814 -7.950 3.828 1.00 0.00 H new ATOM 0 HG2 GLU B 82 5.677 -10.880 4.599 1.00 0.00 H new ATOM 0 HG3 GLU B 82 7.141 -9.917 4.607 1.00 0.00 H new ATOM 1290 N GLY B 83 2.675 -7.040 2.853 1.00 0.00 N ATOM 1291 CA GLY B 83 2.127 -6.161 1.842 1.00 0.00 C ATOM 1292 C GLY B 83 2.428 -4.702 2.087 1.00 0.00 C ATOM 1293 O GLY B 83 2.637 -4.282 3.226 1.00 0.00 O ATOM 0 H GLY B 83 2.386 -6.837 3.810 1.00 0.00 H new ATOM 0 HA2 GLY B 83 2.524 -6.448 0.868 1.00 0.00 H new ATOM 0 HA3 GLY B 83 1.047 -6.299 1.798 1.00 0.00 H new ATOM 1297 N GLN B 84 2.450 -3.934 1.006 1.00 0.00 N ATOM 1298 CA GLN B 84 2.710 -2.504 1.066 1.00 0.00 C ATOM 1299 C GLN B 84 1.825 -1.759 0.077 1.00 0.00 C ATOM 1300 O GLN B 84 1.580 -2.235 -1.034 1.00 0.00 O ATOM 1301 CB GLN B 84 4.176 -2.205 0.748 1.00 0.00 C ATOM 1302 CG GLN B 84 5.158 -2.913 1.661 1.00 0.00 C ATOM 1303 CD GLN B 84 6.595 -2.547 1.368 1.00 0.00 C ATOM 1304 OE1 GLN B 84 6.895 -1.441 0.921 1.00 0.00 O ATOM 1305 NE2 GLN B 84 7.494 -3.479 1.613 1.00 0.00 N ATOM 0 H GLN B 84 2.288 -4.286 0.063 1.00 0.00 H new ATOM 0 HA GLN B 84 2.487 -2.168 2.079 1.00 0.00 H new ATOM 0 HB2 GLN B 84 4.380 -2.493 -0.283 1.00 0.00 H new ATOM 0 HB3 GLN B 84 4.341 -1.130 0.817 1.00 0.00 H new ATOM 0 HG2 GLN B 84 4.928 -2.665 2.697 1.00 0.00 H new ATOM 0 HG3 GLN B 84 5.033 -3.991 1.556 1.00 0.00 H new ATOM 0 HE21 GLN B 84 7.203 -4.384 1.984 1.00 0.00 H new ATOM 0 HE22 GLN B 84 8.481 -3.296 1.432 1.00 0.00 H new ATOM 1314 N LEU B 85 1.343 -0.602 0.493 1.00 0.00 N ATOM 1315 CA LEU B 85 0.578 0.272 -0.376 1.00 0.00 C ATOM 1316 C LEU B 85 1.400 1.522 -0.663 1.00 0.00 C ATOM 1317 O LEU B 85 1.827 2.224 0.259 1.00 0.00 O ATOM 1318 CB LEU B 85 -0.768 0.627 0.282 1.00 0.00 C ATOM 1319 CG LEU B 85 -1.795 1.355 -0.603 1.00 0.00 C ATOM 1320 CD1 LEU B 85 -1.467 2.834 -0.738 1.00 0.00 C ATOM 1321 CD2 LEU B 85 -1.868 0.710 -1.977 1.00 0.00 C ATOM 0 H LEU B 85 1.470 -0.243 1.439 1.00 0.00 H new ATOM 0 HA LEU B 85 0.361 -0.232 -1.318 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -1.223 -0.294 0.645 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -0.568 1.249 1.154 1.00 0.00 H new ATOM 0 HG LEU B 85 -2.767 1.268 -0.117 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -2.213 3.316 -1.370 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -1.471 3.299 0.248 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -0.481 2.948 -1.189 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -2.599 1.238 -2.589 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -0.890 0.761 -2.455 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -2.167 -0.333 -1.874 1.00 0.00 H new ATOM 1333 N ILE B 86 1.643 1.775 -1.937 1.00 0.00 N ATOM 1334 CA ILE B 86 2.464 2.899 -2.352 1.00 0.00 C ATOM 1335 C ILE B 86 1.648 3.874 -3.190 1.00 0.00 C ATOM 1336 O ILE B 86 1.231 3.550 -4.300 1.00 0.00 O ATOM 1337 CB ILE B 86 3.669 2.415 -3.179 1.00 0.00 C ATOM 1338 CG1 ILE B 86 4.315 1.208 -2.500 1.00 0.00 C ATOM 1339 CG2 ILE B 86 4.684 3.538 -3.345 1.00 0.00 C ATOM 1340 CD1 ILE B 86 5.133 0.357 -3.439 1.00 0.00 C ATOM 0 H ILE B 86 1.281 1.213 -2.707 1.00 0.00 H new ATOM 0 HA ILE B 86 2.821 3.401 -1.453 1.00 0.00 H new ATOM 0 HB ILE B 86 3.321 2.118 -4.168 1.00 0.00 H new ATOM 0 HG12 ILE B 86 4.954 1.556 -1.688 1.00 0.00 H new ATOM 0 HG13 ILE B 86 3.535 0.593 -2.051 1.00 0.00 H new ATOM 0 HG21 ILE B 86 5.530 3.180 -3.932 1.00 0.00 H new ATOM 0 HG22 ILE B 86 4.216 4.378 -3.858 1.00 0.00 H new ATOM 0 HG23 ILE B 86 5.033 3.861 -2.364 1.00 0.00 H new ATOM 0 HD11 ILE B 86 5.562 -0.481 -2.890 1.00 0.00 H new ATOM 0 HD12 ILE B 86 4.494 -0.021 -4.237 1.00 0.00 H new ATOM 0 HD13 ILE B 86 5.935 0.957 -3.869 1.00 0.00 H new ATOM 1352 N SER B 87 1.408 5.055 -2.655 1.00 0.00 N ATOM 1353 CA SER B 87 0.652 6.065 -3.369 1.00 0.00 C ATOM 1354 C SER B 87 1.582 6.971 -4.169 1.00 0.00 C ATOM 1355 O SER B 87 2.531 7.537 -3.628 1.00 0.00 O ATOM 1356 CB SER B 87 -0.191 6.878 -2.385 1.00 0.00 C ATOM 1357 OG SER B 87 0.528 7.151 -1.197 1.00 0.00 O ATOM 0 H SER B 87 1.726 5.339 -1.728 1.00 0.00 H new ATOM 0 HA SER B 87 -0.017 5.571 -4.074 1.00 0.00 H new ATOM 0 HB2 SER B 87 -0.496 7.815 -2.851 1.00 0.00 H new ATOM 0 HB3 SER B 87 -1.102 6.330 -2.144 1.00 0.00 H new ATOM 0 HG SER B 87 0.370 8.079 -0.925 1.00 0.00 H new ATOM 1363 N ILE B 88 1.327 7.066 -5.466 1.00 0.00 N ATOM 1364 CA ILE B 88 2.111 7.926 -6.341 1.00 0.00 C ATOM 1365 C ILE B 88 1.326 9.191 -6.656 1.00 0.00 C ATOM 1366 O ILE B 88 0.303 9.138 -7.343 1.00 0.00 O ATOM 1367 CB ILE B 88 2.463 7.218 -7.668 1.00 0.00 C ATOM 1368 CG1 ILE B 88 3.082 5.842 -7.404 1.00 0.00 C ATOM 1369 CG2 ILE B 88 3.407 8.078 -8.500 1.00 0.00 C ATOM 1370 CD1 ILE B 88 4.370 5.880 -6.611 1.00 0.00 C ATOM 0 H ILE B 88 0.580 6.556 -5.937 1.00 0.00 H new ATOM 0 HA ILE B 88 3.037 8.170 -5.820 1.00 0.00 H new ATOM 0 HB ILE B 88 1.541 7.074 -8.231 1.00 0.00 H new ATOM 0 HG12 ILE B 88 2.358 5.227 -6.869 1.00 0.00 H new ATOM 0 HG13 ILE B 88 3.272 5.353 -8.359 1.00 0.00 H new ATOM 0 HG21 ILE B 88 3.644 7.563 -9.431 1.00 0.00 H new ATOM 0 HG22 ILE B 88 2.928 9.031 -8.724 1.00 0.00 H new ATOM 0 HG23 ILE B 88 4.325 8.256 -7.940 1.00 0.00 H new ATOM 0 HD11 ILE B 88 4.740 4.865 -6.469 1.00 0.00 H new ATOM 0 HD12 ILE B 88 5.113 6.465 -7.152 1.00 0.00 H new ATOM 0 HD13 ILE B 88 4.186 6.338 -5.639 1.00 0.00 H new ATOM 1382 N GLN B 89 1.792 10.319 -6.145 1.00 0.00 N ATOM 1383 CA GLN B 89 1.102 11.583 -6.352 1.00 0.00 C ATOM 1384 C GLN B 89 1.466 12.222 -7.683 1.00 0.00 C ATOM 1385 O GLN B 89 2.301 11.705 -8.427 1.00 0.00 O ATOM 1386 CB GLN B 89 1.410 12.566 -5.233 1.00 0.00 C ATOM 1387 CG GLN B 89 0.931 12.130 -3.865 1.00 0.00 C ATOM 1388 CD GLN B 89 1.295 13.145 -2.807 1.00 0.00 C ATOM 1389 OE1 GLN B 89 1.369 14.345 -3.078 1.00 0.00 O ATOM 1390 NE2 GLN B 89 1.554 12.677 -1.606 1.00 0.00 N ATOM 0 H GLN B 89 2.642 10.386 -5.586 1.00 0.00 H new ATOM 0 HA GLN B 89 0.037 11.353 -6.355 1.00 0.00 H new ATOM 0 HB2 GLN B 89 2.488 12.725 -5.193 1.00 0.00 H new ATOM 0 HB3 GLN B 89 0.954 13.526 -5.475 1.00 0.00 H new ATOM 0 HG2 GLN B 89 -0.150 11.992 -3.883 1.00 0.00 H new ATOM 0 HG3 GLN B 89 1.372 11.165 -3.613 1.00 0.00 H new ATOM 0 HE21 GLN B 89 1.481 11.676 -1.422 1.00 0.00 H new ATOM 0 HE22 GLN B 89 1.828 13.315 -0.858 1.00 0.00 H new ATOM 1399 N GLN B 90 0.852 13.362 -7.958 1.00 0.00 N ATOM 1400 CA GLN B 90 1.050 14.074 -9.213 1.00 0.00 C ATOM 1401 C GLN B 90 2.511 14.477 -9.413 1.00 0.00 C ATOM 1402 O GLN B 90 3.062 14.318 -10.503 1.00 0.00 O ATOM 1403 CB GLN B 90 0.151 15.310 -9.252 1.00 0.00 C ATOM 1404 CG GLN B 90 0.182 16.044 -10.581 1.00 0.00 C ATOM 1405 CD GLN B 90 -0.799 17.195 -10.630 1.00 0.00 C ATOM 1406 OE1 GLN B 90 -1.956 17.021 -11.008 1.00 0.00 O ATOM 1407 NE2 GLN B 90 -0.343 18.378 -10.261 1.00 0.00 N ATOM 0 H GLN B 90 0.203 13.820 -7.319 1.00 0.00 H new ATOM 0 HA GLN B 90 0.782 13.401 -10.027 1.00 0.00 H new ATOM 0 HB2 GLN B 90 -0.874 15.010 -9.036 1.00 0.00 H new ATOM 0 HB3 GLN B 90 0.456 15.995 -8.461 1.00 0.00 H new ATOM 0 HG2 GLN B 90 1.189 16.421 -10.761 1.00 0.00 H new ATOM 0 HG3 GLN B 90 -0.044 15.343 -11.385 1.00 0.00 H new ATOM 0 HE21 GLN B 90 0.624 18.479 -9.954 1.00 0.00 H new ATOM 0 HE22 GLN B 90 -0.958 19.191 -10.283 1.00 0.00 H new ATOM 1416 N TYR B 91 3.144 14.980 -8.359 1.00 0.00 N ATOM 1417 CA TYR B 91 4.507 15.489 -8.469 1.00 0.00 C ATOM 1418 C TYR B 91 5.528 14.422 -8.105 1.00 0.00 C ATOM 1419 O TYR B 91 6.694 14.723 -7.841 1.00 0.00 O ATOM 1420 CB TYR B 91 4.689 16.727 -7.591 1.00 0.00 C ATOM 1421 CG TYR B 91 3.731 17.839 -7.942 1.00 0.00 C ATOM 1422 CD1 TYR B 91 2.623 18.108 -7.150 1.00 0.00 C ATOM 1423 CD2 TYR B 91 3.924 18.603 -9.082 1.00 0.00 C ATOM 1424 CE1 TYR B 91 1.734 19.108 -7.486 1.00 0.00 C ATOM 1425 CE2 TYR B 91 3.044 19.608 -9.420 1.00 0.00 C ATOM 1426 CZ TYR B 91 1.951 19.857 -8.623 1.00 0.00 C ATOM 1427 OH TYR B 91 1.068 20.848 -8.974 1.00 0.00 O ATOM 0 H TYR B 91 2.739 15.046 -7.425 1.00 0.00 H new ATOM 0 HA TYR B 91 4.675 15.770 -9.509 1.00 0.00 H new ATOM 0 HB2 TYR B 91 4.549 16.450 -6.546 1.00 0.00 H new ATOM 0 HB3 TYR B 91 5.712 17.090 -7.690 1.00 0.00 H new ATOM 0 HD1 TYR B 91 2.454 17.525 -6.257 1.00 0.00 H new ATOM 0 HD2 TYR B 91 4.777 18.408 -9.715 1.00 0.00 H new ATOM 0 HE1 TYR B 91 0.874 19.303 -6.863 1.00 0.00 H new ATOM 0 HE2 TYR B 91 3.212 20.199 -10.308 1.00 0.00 H new ATOM 0 HH TYR B 91 0.398 20.955 -8.267 1.00 0.00 H new ATOM 1437 N GLY B 92 5.084 13.176 -8.082 1.00 0.00 N ATOM 1438 CA GLY B 92 5.992 12.073 -7.865 1.00 0.00 C ATOM 1439 C GLY B 92 6.169 11.711 -6.406 1.00 0.00 C ATOM 1440 O GLY B 92 6.982 10.845 -6.082 1.00 0.00 O ATOM 0 H GLY B 92 4.108 12.909 -8.210 1.00 0.00 H new ATOM 0 HA2 GLY B 92 5.626 11.200 -8.405 1.00 0.00 H new ATOM 0 HA3 GLY B 92 6.964 12.325 -8.289 1.00 0.00 H new ATOM 1444 N HIS B 93 5.421 12.365 -5.523 1.00 0.00 N ATOM 1445 CA HIS B 93 5.486 12.046 -4.100 1.00 0.00 C ATOM 1446 C HIS B 93 5.005 10.616 -3.888 1.00 0.00 C ATOM 1447 O HIS B 93 3.963 10.227 -4.414 1.00 0.00 O ATOM 1448 CB HIS B 93 4.627 13.006 -3.268 1.00 0.00 C ATOM 1449 CG HIS B 93 4.994 13.036 -1.815 1.00 0.00 C ATOM 1450 ND1 HIS B 93 4.507 12.137 -0.897 1.00 0.00 N ATOM 1451 CD2 HIS B 93 5.807 13.867 -1.125 1.00 0.00 C ATOM 1452 CE1 HIS B 93 4.998 12.412 0.293 1.00 0.00 C ATOM 1453 NE2 HIS B 93 5.793 13.458 0.184 1.00 0.00 N ATOM 0 H HIS B 93 4.769 13.112 -5.763 1.00 0.00 H new ATOM 0 HA HIS B 93 6.520 12.152 -3.771 1.00 0.00 H new ATOM 0 HB2 HIS B 93 4.720 14.012 -3.678 1.00 0.00 H new ATOM 0 HB3 HIS B 93 3.580 12.719 -3.364 1.00 0.00 H new ATOM 0 HD1 HIS B 93 3.864 11.374 -1.106 1.00 0.00 H new ATOM 0 HD2 HIS B 93 6.364 14.699 -1.530 1.00 0.00 H new ATOM 0 HE1 HIS B 93 4.786 11.872 1.204 1.00 0.00 H new ATOM 1462 N GLN B 94 5.776 9.835 -3.151 1.00 0.00 N ATOM 1463 CA GLN B 94 5.419 8.449 -2.891 1.00 0.00 C ATOM 1464 C GLN B 94 5.273 8.202 -1.399 1.00 0.00 C ATOM 1465 O GLN B 94 6.191 8.482 -0.622 1.00 0.00 O ATOM 1466 CB GLN B 94 6.483 7.502 -3.445 1.00 0.00 C ATOM 1467 CG GLN B 94 6.839 7.750 -4.898 1.00 0.00 C ATOM 1468 CD GLN B 94 7.855 6.755 -5.418 1.00 0.00 C ATOM 1469 OE1 GLN B 94 8.682 6.239 -4.662 1.00 0.00 O ATOM 1470 NE2 GLN B 94 7.810 6.485 -6.710 1.00 0.00 N ATOM 0 H GLN B 94 6.652 10.135 -2.722 1.00 0.00 H new ATOM 0 HA GLN B 94 4.468 8.257 -3.387 1.00 0.00 H new ATOM 0 HB2 GLN B 94 7.385 7.594 -2.841 1.00 0.00 H new ATOM 0 HB3 GLN B 94 6.131 6.476 -3.339 1.00 0.00 H new ATOM 0 HG2 GLN B 94 5.936 7.695 -5.506 1.00 0.00 H new ATOM 0 HG3 GLN B 94 7.235 8.760 -5.006 1.00 0.00 H new ATOM 0 HE21 GLN B 94 7.110 6.934 -7.301 1.00 0.00 H new ATOM 0 HE22 GLN B 94 8.475 5.828 -7.117 1.00 0.00 H new ATOM 1479 N GLU B 95 4.122 7.693 -0.999 1.00 0.00 N ATOM 1480 CA GLU B 95 3.912 7.281 0.377 1.00 0.00 C ATOM 1481 C GLU B 95 3.865 5.765 0.439 1.00 0.00 C ATOM 1482 O GLU B 95 3.190 5.130 -0.370 1.00 0.00 O ATOM 1483 CB GLU B 95 2.612 7.848 0.954 1.00 0.00 C ATOM 1484 CG GLU B 95 2.476 9.361 0.863 1.00 0.00 C ATOM 1485 CD GLU B 95 2.021 9.823 -0.502 1.00 0.00 C ATOM 1486 OE1 GLU B 95 0.808 9.775 -0.776 1.00 0.00 O ATOM 1487 OE2 GLU B 95 2.873 10.248 -1.303 1.00 0.00 O ATOM 0 H GLU B 95 3.316 7.555 -1.609 1.00 0.00 H new ATOM 0 HA GLU B 95 4.738 7.668 0.973 1.00 0.00 H new ATOM 0 HB2 GLU B 95 1.771 7.390 0.433 1.00 0.00 H new ATOM 0 HB3 GLU B 95 2.538 7.554 2.001 1.00 0.00 H new ATOM 0 HG2 GLU B 95 1.765 9.704 1.614 1.00 0.00 H new ATOM 0 HG3 GLU B 95 3.435 9.823 1.098 1.00 0.00 H new ATOM 1494 N VAL B 96 4.583 5.183 1.382 1.00 0.00 N ATOM 1495 CA VAL B 96 4.600 3.738 1.525 1.00 0.00 C ATOM 1496 C VAL B 96 4.085 3.329 2.895 1.00 0.00 C ATOM 1497 O VAL B 96 4.693 3.645 3.919 1.00 0.00 O ATOM 1498 CB VAL B 96 6.015 3.155 1.324 1.00 0.00 C ATOM 1499 CG1 VAL B 96 5.992 1.638 1.465 1.00 0.00 C ATOM 1500 CG2 VAL B 96 6.577 3.563 -0.032 1.00 0.00 C ATOM 0 H VAL B 96 5.159 5.685 2.057 1.00 0.00 H new ATOM 0 HA VAL B 96 3.948 3.337 0.750 1.00 0.00 H new ATOM 0 HB VAL B 96 6.667 3.561 2.097 1.00 0.00 H new ATOM 0 HG11 VAL B 96 6.998 1.244 1.320 1.00 0.00 H new ATOM 0 HG12 VAL B 96 5.637 1.370 2.460 1.00 0.00 H new ATOM 0 HG13 VAL B 96 5.324 1.213 0.715 1.00 0.00 H new ATOM 0 HG21 VAL B 96 7.575 3.142 -0.154 1.00 0.00 H new ATOM 0 HG22 VAL B 96 5.926 3.189 -0.823 1.00 0.00 H new ATOM 0 HG23 VAL B 96 6.632 4.650 -0.091 1.00 0.00 H new ATOM 1510 N THR B 97 2.958 2.643 2.910 1.00 0.00 N ATOM 1511 CA THR B 97 2.405 2.115 4.143 1.00 0.00 C ATOM 1512 C THR B 97 2.286 0.594 4.033 1.00 0.00 C ATOM 1513 O THR B 97 1.788 0.066 3.040 1.00 0.00 O ATOM 1514 CB THR B 97 1.043 2.767 4.468 1.00 0.00 C ATOM 1515 OG1 THR B 97 0.575 2.364 5.764 1.00 0.00 O ATOM 1516 CG2 THR B 97 0.018 2.400 3.423 1.00 0.00 C ATOM 0 H THR B 97 2.405 2.437 2.078 1.00 0.00 H new ATOM 0 HA THR B 97 3.076 2.357 4.968 1.00 0.00 H new ATOM 0 HB THR B 97 1.184 3.848 4.468 1.00 0.00 H new ATOM 0 HG1 THR B 97 -0.186 2.924 6.026 1.00 0.00 H new ATOM 0 HG21 THR B 97 -0.935 2.868 3.668 1.00 0.00 H new ATOM 0 HG22 THR B 97 0.353 2.749 2.446 1.00 0.00 H new ATOM 0 HG23 THR B 97 -0.105 1.317 3.399 1.00 0.00 H new ATOM 1524 N ARG B 98 2.789 -0.110 5.030 1.00 0.00 N ATOM 1525 CA ARG B 98 2.837 -1.565 4.980 1.00 0.00 C ATOM 1526 C ARG B 98 1.704 -2.172 5.794 1.00 0.00 C ATOM 1527 O ARG B 98 1.184 -1.537 6.714 1.00 0.00 O ATOM 1528 CB ARG B 98 4.181 -2.078 5.502 1.00 0.00 C ATOM 1529 CG ARG B 98 5.385 -1.319 4.961 1.00 0.00 C ATOM 1530 CD ARG B 98 6.683 -2.055 5.248 1.00 0.00 C ATOM 1531 NE ARG B 98 6.811 -2.415 6.658 1.00 0.00 N ATOM 1532 CZ ARG B 98 7.730 -3.255 7.134 1.00 0.00 C ATOM 1533 NH1 ARG B 98 8.644 -3.776 6.327 1.00 0.00 N ATOM 1534 NH2 ARG B 98 7.737 -3.567 8.425 1.00 0.00 N ATOM 0 H ARG B 98 3.170 0.298 5.884 1.00 0.00 H new ATOM 0 HA ARG B 98 2.722 -1.868 3.939 1.00 0.00 H new ATOM 0 HB2 ARG B 98 4.184 -2.016 6.590 1.00 0.00 H new ATOM 0 HB3 ARG B 98 4.282 -3.132 5.242 1.00 0.00 H new ATOM 0 HG2 ARG B 98 5.275 -1.179 3.886 1.00 0.00 H new ATOM 0 HG3 ARG B 98 5.422 -0.326 5.409 1.00 0.00 H new ATOM 0 HD2 ARG B 98 6.730 -2.957 4.638 1.00 0.00 H new ATOM 0 HD3 ARG B 98 7.526 -1.429 4.956 1.00 0.00 H new ATOM 0 HE ARG B 98 6.156 -1.998 7.319 1.00 0.00 H new ATOM 0 HH11 ARG B 98 8.646 -3.535 5.336 1.00 0.00 H new ATOM 0 HH12 ARG B 98 9.345 -4.418 6.697 1.00 0.00 H new ATOM 0 HH21 ARG B 98 7.040 -3.164 9.051 1.00 0.00 H new ATOM 0 HH22 ARG B 98 8.440 -4.210 8.791 1.00 0.00 H new ATOM 1548 N PHE B 99 1.326 -3.400 5.459 1.00 0.00 N ATOM 1549 CA PHE B 99 0.282 -4.101 6.190 1.00 0.00 C ATOM 1550 C PHE B 99 0.614 -5.583 6.325 1.00 0.00 C ATOM 1551 O PHE B 99 1.483 -6.107 5.621 1.00 0.00 O ATOM 1552 CB PHE B 99 -1.090 -3.912 5.519 1.00 0.00 C ATOM 1553 CG PHE B 99 -1.208 -4.494 4.135 1.00 0.00 C ATOM 1554 CD1 PHE B 99 -1.633 -5.802 3.954 1.00 0.00 C ATOM 1555 CD2 PHE B 99 -0.911 -3.730 3.018 1.00 0.00 C ATOM 1556 CE1 PHE B 99 -1.757 -6.337 2.687 1.00 0.00 C ATOM 1557 CE2 PHE B 99 -1.031 -4.261 1.747 1.00 0.00 C ATOM 1558 CZ PHE B 99 -1.455 -5.566 1.582 1.00 0.00 C ATOM 0 H PHE B 99 1.728 -3.929 4.685 1.00 0.00 H new ATOM 0 HA PHE B 99 0.230 -3.669 7.189 1.00 0.00 H new ATOM 0 HB2 PHE B 99 -1.853 -4.364 6.153 1.00 0.00 H new ATOM 0 HB3 PHE B 99 -1.309 -2.845 5.468 1.00 0.00 H new ATOM 0 HD1 PHE B 99 -1.870 -6.410 4.815 1.00 0.00 H new ATOM 0 HD2 PHE B 99 -0.582 -2.709 3.141 1.00 0.00 H new ATOM 0 HE1 PHE B 99 -2.090 -7.357 2.561 1.00 0.00 H new ATOM 0 HE2 PHE B 99 -0.794 -3.657 0.884 1.00 0.00 H new ATOM 0 HZ PHE B 99 -1.550 -5.982 0.590 1.00 0.00 H new ATOM 1568 N ASP B 100 -0.081 -6.246 7.239 1.00 0.00 N ATOM 1569 CA ASP B 100 0.145 -7.659 7.517 1.00 0.00 C ATOM 1570 C ASP B 100 -1.143 -8.447 7.338 1.00 0.00 C ATOM 1571 O ASP B 100 -2.217 -7.996 7.748 1.00 0.00 O ATOM 1572 CB ASP B 100 0.674 -7.840 8.945 1.00 0.00 C ATOM 1573 CG ASP B 100 0.674 -9.291 9.398 1.00 0.00 C ATOM 1574 OD1 ASP B 100 -0.305 -9.716 10.050 1.00 0.00 O ATOM 1575 OD2 ASP B 100 1.656 -10.008 9.121 1.00 0.00 O ATOM 0 H ASP B 100 -0.815 -5.822 7.807 1.00 0.00 H new ATOM 0 HA ASP B 100 0.888 -8.035 6.813 1.00 0.00 H new ATOM 0 HB2 ASP B 100 1.689 -7.447 9.003 1.00 0.00 H new ATOM 0 HB3 ASP B 100 0.064 -7.251 9.630 1.00 0.00 H new ATOM 1580 N PHE B 101 -1.036 -9.614 6.723 1.00 0.00 N ATOM 1581 CA PHE B 101 -2.187 -10.477 6.526 1.00 0.00 C ATOM 1582 C PHE B 101 -1.759 -11.938 6.497 1.00 0.00 C ATOM 1583 O PHE B 101 -0.688 -12.273 5.990 1.00 0.00 O ATOM 1584 CB PHE B 101 -2.928 -10.119 5.230 1.00 0.00 C ATOM 1585 CG PHE B 101 -4.070 -11.048 4.921 1.00 0.00 C ATOM 1586 CD1 PHE B 101 -5.249 -10.984 5.645 1.00 0.00 C ATOM 1587 CD2 PHE B 101 -3.956 -11.994 3.913 1.00 0.00 C ATOM 1588 CE1 PHE B 101 -6.294 -11.845 5.372 1.00 0.00 C ATOM 1589 CE2 PHE B 101 -4.999 -12.856 3.633 1.00 0.00 C ATOM 1590 CZ PHE B 101 -6.168 -12.782 4.365 1.00 0.00 C ATOM 0 H PHE B 101 -0.161 -9.985 6.351 1.00 0.00 H new ATOM 0 HA PHE B 101 -2.868 -10.325 7.364 1.00 0.00 H new ATOM 0 HB2 PHE B 101 -3.308 -9.100 5.307 1.00 0.00 H new ATOM 0 HB3 PHE B 101 -2.222 -10.134 4.400 1.00 0.00 H new ATOM 0 HD1 PHE B 101 -5.353 -10.252 6.432 1.00 0.00 H new ATOM 0 HD2 PHE B 101 -3.042 -12.058 3.341 1.00 0.00 H new ATOM 0 HE1 PHE B 101 -7.208 -11.786 5.945 1.00 0.00 H new ATOM 0 HE2 PHE B 101 -4.900 -13.586 2.843 1.00 0.00 H new ATOM 0 HZ PHE B 101 -6.983 -13.457 4.150 1.00 0.00 H new ATOM 1600 N THR B 102 -2.598 -12.797 7.053 1.00 0.00 N ATOM 1601 CA THR B 102 -2.369 -14.230 7.007 1.00 0.00 C ATOM 1602 C THR B 102 -3.676 -14.980 7.254 1.00 0.00 C ATOM 1603 O THR B 102 -3.941 -16.012 6.634 1.00 0.00 O ATOM 1604 CB THR B 102 -1.286 -14.674 8.021 1.00 0.00 C ATOM 1605 OG1 THR B 102 -1.019 -16.071 7.871 1.00 0.00 O ATOM 1606 CG2 THR B 102 -1.703 -14.391 9.455 1.00 0.00 C ATOM 0 H THR B 102 -3.449 -12.523 7.544 1.00 0.00 H new ATOM 0 HA THR B 102 -2.000 -14.476 6.011 1.00 0.00 H new ATOM 0 HB THR B 102 -0.385 -14.097 7.811 1.00 0.00 H new ATOM 0 HG1 THR B 102 -0.469 -16.381 8.620 1.00 0.00 H new ATOM 0 HG21 THR B 102 -0.915 -14.717 10.134 1.00 0.00 H new ATOM 0 HG22 THR B 102 -1.870 -13.321 9.581 1.00 0.00 H new ATOM 0 HG23 THR B 102 -2.623 -14.931 9.680 1.00 0.00 H new ATOM 1614 N THR B 103 -4.490 -14.458 8.162 1.00 0.00 N ATOM 1615 CA THR B 103 -5.812 -15.003 8.427 1.00 0.00 C ATOM 1616 C THR B 103 -6.706 -13.911 9.004 1.00 0.00 C ATOM 1617 O THR B 103 -7.841 -13.728 8.566 1.00 0.00 O ATOM 1618 CB THR B 103 -5.760 -16.196 9.407 1.00 0.00 C ATOM 1619 OG1 THR B 103 -4.815 -17.171 8.942 1.00 0.00 O ATOM 1620 CG2 THR B 103 -7.128 -16.848 9.545 1.00 0.00 C ATOM 0 H THR B 103 -4.252 -13.647 8.733 1.00 0.00 H new ATOM 0 HA THR B 103 -6.217 -15.365 7.482 1.00 0.00 H new ATOM 0 HB THR B 103 -5.452 -15.819 10.382 1.00 0.00 H new ATOM 0 HG1 THR B 103 -4.786 -17.924 9.569 1.00 0.00 H new ATOM 0 HG21 THR B 103 -7.064 -17.685 10.240 1.00 0.00 H new ATOM 0 HG22 THR B 103 -7.843 -16.117 9.922 1.00 0.00 H new ATOM 0 HG23 THR B 103 -7.458 -17.210 8.571 1.00 0.00 H new ATOM 1628 N THR B 104 -6.178 -13.188 9.985 1.00 0.00 N ATOM 1629 CA THR B 104 -6.876 -12.054 10.568 1.00 0.00 C ATOM 1630 C THR B 104 -6.997 -10.924 9.545 1.00 0.00 C ATOM 1631 O THR B 104 -6.018 -10.564 8.890 1.00 0.00 O ATOM 1632 CB THR B 104 -6.128 -11.548 11.817 1.00 0.00 C ATOM 1633 OG1 THR B 104 -5.880 -12.644 12.709 1.00 0.00 O ATOM 1634 CG2 THR B 104 -6.927 -10.472 12.540 1.00 0.00 C ATOM 0 H THR B 104 -5.262 -13.371 10.394 1.00 0.00 H new ATOM 0 HA THR B 104 -7.875 -12.378 10.861 1.00 0.00 H new ATOM 0 HB THR B 104 -5.183 -11.112 11.494 1.00 0.00 H new ATOM 0 HG1 THR B 104 -5.403 -12.320 13.501 1.00 0.00 H new ATOM 0 HG21 THR B 104 -6.374 -10.135 13.417 1.00 0.00 H new ATOM 0 HG22 THR B 104 -7.092 -9.629 11.869 1.00 0.00 H new ATOM 0 HG23 THR B 104 -7.888 -10.881 12.853 1.00 0.00 H new ATOM 1642 N SER B 105 -8.206 -10.393 9.396 1.00 0.00 N ATOM 1643 CA SER B 105 -8.459 -9.314 8.452 1.00 0.00 C ATOM 1644 C SER B 105 -7.965 -7.983 9.014 1.00 0.00 C ATOM 1645 O SER B 105 -7.664 -7.051 8.268 1.00 0.00 O ATOM 1646 CB SER B 105 -9.953 -9.240 8.133 1.00 0.00 C ATOM 1647 OG SER B 105 -10.440 -10.494 7.677 1.00 0.00 O ATOM 0 H SER B 105 -9.028 -10.695 9.920 1.00 0.00 H new ATOM 0 HA SER B 105 -7.913 -9.518 7.531 1.00 0.00 H new ATOM 0 HB2 SER B 105 -10.503 -8.934 9.023 1.00 0.00 H new ATOM 0 HB3 SER B 105 -10.129 -8.479 7.372 1.00 0.00 H new ATOM 0 HG SER B 105 -11.398 -10.422 7.481 1.00 0.00 H new ATOM 1653 N THR B 106 -7.895 -7.903 10.340 1.00 0.00 N ATOM 1654 CA THR B 106 -7.326 -6.743 11.006 1.00 0.00 C ATOM 1655 C THR B 106 -5.808 -6.725 10.804 1.00 0.00 C ATOM 1656 O THR B 106 -5.099 -7.613 11.279 1.00 0.00 O ATOM 1657 CB THR B 106 -7.654 -6.758 12.511 1.00 0.00 C ATOM 1658 OG1 THR B 106 -9.035 -7.104 12.704 1.00 0.00 O ATOM 1659 CG2 THR B 106 -7.386 -5.399 13.138 1.00 0.00 C ATOM 0 H THR B 106 -8.227 -8.631 10.973 1.00 0.00 H new ATOM 0 HA THR B 106 -7.763 -5.845 10.569 1.00 0.00 H new ATOM 0 HB THR B 106 -7.015 -7.499 12.992 1.00 0.00 H new ATOM 0 HG1 THR B 106 -9.239 -7.114 13.663 1.00 0.00 H new ATOM 0 HG21 THR B 106 -7.625 -5.435 14.201 1.00 0.00 H new ATOM 0 HG22 THR B 106 -6.335 -5.141 13.011 1.00 0.00 H new ATOM 0 HG23 THR B 106 -8.006 -4.645 12.652 1.00 0.00 H new ATOM 1667 N SER B 107 -5.324 -5.715 10.100 1.00 0.00 N ATOM 1668 CA SER B 107 -3.931 -5.655 9.677 1.00 0.00 C ATOM 1669 C SER B 107 -2.993 -5.158 10.781 1.00 0.00 C ATOM 1670 O SER B 107 -1.783 -5.393 10.726 1.00 0.00 O ATOM 1671 CB SER B 107 -3.840 -4.747 8.457 1.00 0.00 C ATOM 1672 OG SER B 107 -4.704 -3.634 8.611 1.00 0.00 O ATOM 0 H SER B 107 -5.883 -4.914 9.805 1.00 0.00 H new ATOM 0 HA SER B 107 -3.604 -6.666 9.435 1.00 0.00 H new ATOM 0 HB2 SER B 107 -2.814 -4.405 8.325 1.00 0.00 H new ATOM 0 HB3 SER B 107 -4.108 -5.304 7.559 1.00 0.00 H new ATOM 0 HG SER B 107 -4.197 -2.873 8.963 1.00 0.00 H new ATOM 1678 N THR B 108 -3.540 -4.473 11.774 1.00 0.00 N ATOM 1679 CA THR B 108 -2.727 -3.913 12.846 1.00 0.00 C ATOM 1680 C THR B 108 -3.355 -4.153 14.213 1.00 0.00 C ATOM 1681 O THR B 108 -4.569 -4.312 14.332 1.00 0.00 O ATOM 1682 CB THR B 108 -2.530 -2.399 12.646 1.00 0.00 C ATOM 1683 OG1 THR B 108 -3.692 -1.835 12.029 1.00 0.00 O ATOM 1684 CG2 THR B 108 -1.298 -2.111 11.804 1.00 0.00 C ATOM 0 H THR B 108 -4.540 -4.291 11.861 1.00 0.00 H new ATOM 0 HA THR B 108 -1.762 -4.419 12.809 1.00 0.00 H new ATOM 0 HB THR B 108 -2.382 -1.942 13.624 1.00 0.00 H new ATOM 0 HG1 THR B 108 -3.660 -1.995 11.063 1.00 0.00 H new ATOM 0 HG21 THR B 108 -1.186 -1.034 11.680 1.00 0.00 H new ATOM 0 HG22 THR B 108 -0.415 -2.513 12.301 1.00 0.00 H new ATOM 0 HG23 THR B 108 -1.408 -2.579 10.826 1.00 0.00 H new ATOM 1692 N PRO B 109 -2.522 -4.208 15.266 1.00 0.00 N ATOM 1693 CA PRO B 109 -2.990 -4.295 16.646 1.00 0.00 C ATOM 1694 C PRO B 109 -3.254 -2.912 17.232 1.00 0.00 C ATOM 1695 O PRO B 109 -3.524 -2.762 18.424 1.00 0.00 O ATOM 1696 CB PRO B 109 -1.818 -4.965 17.353 1.00 0.00 C ATOM 1697 CG PRO B 109 -0.613 -4.485 16.617 1.00 0.00 C ATOM 1698 CD PRO B 109 -1.046 -4.219 15.194 1.00 0.00 C ATOM 0 HA PRO B 109 -3.931 -4.836 16.746 1.00 0.00 H new ATOM 0 HB2 PRO B 109 -1.777 -4.685 18.406 1.00 0.00 H new ATOM 0 HB3 PRO B 109 -1.900 -6.051 17.315 1.00 0.00 H new ATOM 0 HG2 PRO B 109 -0.216 -3.580 17.076 1.00 0.00 H new ATOM 0 HG3 PRO B 109 0.180 -5.232 16.646 1.00 0.00 H new ATOM 0 HD2 PRO B 109 -0.657 -3.268 14.829 1.00 0.00 H new ATOM 0 HD3 PRO B 109 -0.685 -4.992 14.516 1.00 0.00 H new ATOM 1706 N GLY B 110 -3.148 -1.907 16.379 1.00 0.00 N ATOM 1707 CA GLY B 110 -3.387 -0.541 16.780 1.00 0.00 C ATOM 1708 C GLY B 110 -3.481 0.366 15.576 1.00 0.00 C ATOM 1709 O GLY B 110 -2.467 0.677 14.951 1.00 0.00 O ATOM 0 H GLY B 110 -2.895 -2.019 15.397 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -4.310 -0.483 17.357 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -2.582 -0.203 17.433 1.00 0.00 H new ATOM 1713 N SER B 111 -4.695 0.775 15.243 1.00 0.00 N ATOM 1714 CA SER B 111 -4.943 1.590 14.061 1.00 0.00 C ATOM 1715 C SER B 111 -4.212 2.928 14.149 1.00 0.00 C ATOM 1716 O SER B 111 -3.289 3.201 13.375 1.00 0.00 O ATOM 1717 CB SER B 111 -6.448 1.810 13.901 1.00 0.00 C ATOM 1718 OG SER B 111 -7.043 2.194 15.135 1.00 0.00 O ATOM 0 H SER B 111 -5.533 0.554 15.780 1.00 0.00 H new ATOM 0 HA SER B 111 -4.560 1.063 13.187 1.00 0.00 H new ATOM 0 HB2 SER B 111 -6.628 2.580 13.151 1.00 0.00 H new ATOM 0 HB3 SER B 111 -6.916 0.895 13.537 1.00 0.00 H new ATOM 0 HG SER B 111 -8.005 2.330 15.006 1.00 0.00 H new ATOM 1724 N ARG B 112 -4.626 3.752 15.095 1.00 0.00 N ATOM 1725 CA ARG B 112 -4.009 5.047 15.318 1.00 0.00 C ATOM 1726 C ARG B 112 -3.759 5.242 16.802 1.00 0.00 C ATOM 1727 O ARG B 112 -4.613 4.919 17.627 1.00 0.00 O ATOM 1728 CB ARG B 112 -4.909 6.169 14.794 1.00 0.00 C ATOM 1729 CG ARG B 112 -5.202 6.083 13.305 1.00 0.00 C ATOM 1730 CD ARG B 112 -6.065 7.242 12.844 1.00 0.00 C ATOM 1731 NE ARG B 112 -5.386 8.526 13.008 1.00 0.00 N ATOM 1732 CZ ARG B 112 -6.014 9.687 13.188 1.00 0.00 C ATOM 1733 NH1 ARG B 112 -7.339 9.730 13.283 1.00 0.00 N ATOM 1734 NH2 ARG B 112 -5.311 10.807 13.288 1.00 0.00 N ATOM 0 H ARG B 112 -5.397 3.543 15.729 1.00 0.00 H new ATOM 0 HA ARG B 112 -3.062 5.081 14.780 1.00 0.00 H new ATOM 0 HB2 ARG B 112 -5.852 6.150 15.341 1.00 0.00 H new ATOM 0 HB3 ARG B 112 -4.437 7.128 15.006 1.00 0.00 H new ATOM 0 HG2 ARG B 112 -4.265 6.080 12.748 1.00 0.00 H new ATOM 0 HG3 ARG B 112 -5.706 5.142 13.085 1.00 0.00 H new ATOM 0 HD2 ARG B 112 -6.330 7.103 11.796 1.00 0.00 H new ATOM 0 HD3 ARG B 112 -6.996 7.249 13.410 1.00 0.00 H new ATOM 0 HE ARG B 112 -4.366 8.534 12.983 1.00 0.00 H new ATOM 0 HH11 ARG B 112 -7.883 8.870 13.218 1.00 0.00 H new ATOM 0 HH12 ARG B 112 -7.812 10.623 13.421 1.00 0.00 H new ATOM 0 HH21 ARG B 112 -4.293 10.777 13.227 1.00 0.00 H new ATOM 0 HH22 ARG B 112 -5.788 11.698 13.426 1.00 0.00 H new ATOM 1748 N SER B 113 -2.592 5.756 17.142 1.00 0.00 N ATOM 1749 CA SER B 113 -2.262 6.017 18.529 1.00 0.00 C ATOM 1750 C SER B 113 -3.018 7.238 19.032 1.00 0.00 C ATOM 1751 O SER B 113 -3.255 8.181 18.274 1.00 0.00 O ATOM 1752 CB SER B 113 -0.760 6.209 18.684 1.00 0.00 C ATOM 1753 OG SER B 113 -0.065 5.044 18.272 1.00 0.00 O ATOM 0 H SER B 113 -1.858 6.001 16.477 1.00 0.00 H new ATOM 0 HA SER B 113 -2.563 5.159 19.130 1.00 0.00 H new ATOM 0 HB2 SER B 113 -0.434 7.063 18.091 1.00 0.00 H new ATOM 0 HB3 SER B 113 -0.522 6.433 19.724 1.00 0.00 H new ATOM 0 HG SER B 113 0.901 5.203 18.326 1.00 0.00 H new ATOM 1759 N HIS B 114 -3.394 7.206 20.307 1.00 0.00 N ATOM 1760 CA HIS B 114 -4.205 8.258 20.910 1.00 0.00 C ATOM 1761 C HIS B 114 -5.545 8.359 20.186 1.00 0.00 C ATOM 1762 O HIS B 114 -5.780 9.276 19.399 1.00 0.00 O ATOM 1763 CB HIS B 114 -3.466 9.606 20.888 1.00 0.00 C ATOM 1764 CG HIS B 114 -4.169 10.701 21.635 1.00 0.00 C ATOM 1765 ND1 HIS B 114 -4.833 11.737 21.014 1.00 0.00 N ATOM 1766 CD2 HIS B 114 -4.292 10.923 22.963 1.00 0.00 C ATOM 1767 CE1 HIS B 114 -5.330 12.549 21.929 1.00 0.00 C ATOM 1768 NE2 HIS B 114 -5.016 12.077 23.119 1.00 0.00 N ATOM 0 H HIS B 114 -3.146 6.453 20.949 1.00 0.00 H new ATOM 0 HA HIS B 114 -4.389 8.001 21.953 1.00 0.00 H new ATOM 0 HB2 HIS B 114 -2.472 9.470 21.314 1.00 0.00 H new ATOM 0 HB3 HIS B 114 -3.330 9.917 19.852 1.00 0.00 H new ATOM 0 HD2 HIS B 114 -3.894 10.306 23.755 1.00 0.00 H new ATOM 0 HE1 HIS B 114 -5.897 13.447 21.735 1.00 0.00 H new ATOM 0 HE2 HIS B 114 -5.270 12.501 24.011 1.00 0.00 H new ATOM 1777 N HIS B 115 -6.409 7.389 20.447 1.00 0.00 N ATOM 1778 CA HIS B 115 -7.728 7.344 19.827 1.00 0.00 C ATOM 1779 C HIS B 115 -8.591 8.493 20.331 1.00 0.00 C ATOM 1780 O HIS B 115 -8.648 8.752 21.535 1.00 0.00 O ATOM 1781 CB HIS B 115 -8.422 6.011 20.132 1.00 0.00 C ATOM 1782 CG HIS B 115 -7.733 4.811 19.557 1.00 0.00 C ATOM 1783 ND1 HIS B 115 -6.970 3.951 20.315 1.00 0.00 N ATOM 1784 CD2 HIS B 115 -7.716 4.316 18.298 1.00 0.00 C ATOM 1785 CE1 HIS B 115 -6.514 2.979 19.547 1.00 0.00 C ATOM 1786 NE2 HIS B 115 -6.952 3.176 18.318 1.00 0.00 N ATOM 0 H HIS B 115 -6.220 6.618 21.087 1.00 0.00 H new ATOM 0 HA HIS B 115 -7.599 7.439 18.749 1.00 0.00 H new ATOM 0 HB2 HIS B 115 -8.493 5.891 21.213 1.00 0.00 H new ATOM 0 HB3 HIS B 115 -9.441 6.049 19.747 1.00 0.00 H new ATOM 0 HD2 HIS B 115 -8.212 4.739 17.437 1.00 0.00 H new ATOM 0 HE1 HIS B 115 -5.888 2.160 19.870 1.00 0.00 H new ATOM 0 HE2 HIS B 115 -6.755 2.579 17.515 1.00 0.00 H new ATOM 1795 N HIS B 116 -9.277 9.162 19.410 1.00 0.00 N ATOM 1796 CA HIS B 116 -10.127 10.301 19.760 1.00 0.00 C ATOM 1797 C HIS B 116 -11.401 9.843 20.464 1.00 0.00 C ATOM 1798 O HIS B 116 -12.266 10.651 20.791 1.00 0.00 O ATOM 1799 CB HIS B 116 -10.474 11.142 18.520 1.00 0.00 C ATOM 1800 CG HIS B 116 -11.218 10.409 17.439 1.00 0.00 C ATOM 1801 ND1 HIS B 116 -10.647 10.074 16.230 1.00 0.00 N ATOM 1802 CD2 HIS B 116 -12.502 9.976 17.374 1.00 0.00 C ATOM 1803 CE1 HIS B 116 -11.542 9.469 15.473 1.00 0.00 C ATOM 1804 NE2 HIS B 116 -12.675 9.397 16.142 1.00 0.00 N ATOM 0 H HIS B 116 -9.263 8.937 18.415 1.00 0.00 H new ATOM 0 HA HIS B 116 -9.561 10.928 20.449 1.00 0.00 H new ATOM 0 HB2 HIS B 116 -11.072 11.997 18.836 1.00 0.00 H new ATOM 0 HB3 HIS B 116 -9.550 11.538 18.099 1.00 0.00 H new ATOM 0 HD2 HIS B 116 -13.249 10.070 18.148 1.00 0.00 H new ATOM 0 HE1 HIS B 116 -11.374 9.096 14.474 1.00 0.00 H new ATOM 0 HE2 HIS B 116 -13.540 8.979 15.800 1.00 0.00 H new ATOM 1813 N HIS B 117 -11.510 8.538 20.678 1.00 0.00 N ATOM 1814 CA HIS B 117 -12.613 7.970 21.439 1.00 0.00 C ATOM 1815 C HIS B 117 -12.459 8.318 22.920 1.00 0.00 C ATOM 1816 O HIS B 117 -13.401 8.202 23.702 1.00 0.00 O ATOM 1817 CB HIS B 117 -12.646 6.450 21.246 1.00 0.00 C ATOM 1818 CG HIS B 117 -13.877 5.790 21.794 1.00 0.00 C ATOM 1819 ND1 HIS B 117 -15.060 5.709 21.095 1.00 0.00 N ATOM 1820 CD2 HIS B 117 -14.100 5.172 22.977 1.00 0.00 C ATOM 1821 CE1 HIS B 117 -15.957 5.073 21.824 1.00 0.00 C ATOM 1822 NE2 HIS B 117 -15.399 4.735 22.969 1.00 0.00 N ATOM 0 H HIS B 117 -10.842 7.849 20.332 1.00 0.00 H new ATOM 0 HA HIS B 117 -13.553 8.390 21.080 1.00 0.00 H new ATOM 0 HB2 HIS B 117 -12.571 6.228 20.182 1.00 0.00 H new ATOM 0 HB3 HIS B 117 -11.769 6.014 21.725 1.00 0.00 H new ATOM 0 HD2 HIS B 117 -13.387 5.046 23.778 1.00 0.00 H new ATOM 0 HE1 HIS B 117 -16.976 4.865 21.532 1.00 0.00 H new ATOM 0 HE2 HIS B 117 -15.859 4.230 23.726 1.00 0.00 H new ATOM 1831 N HIS B 118 -11.258 8.746 23.289 1.00 0.00 N ATOM 1832 CA HIS B 118 -10.977 9.160 24.656 1.00 0.00 C ATOM 1833 C HIS B 118 -11.334 10.631 24.835 1.00 0.00 C ATOM 1834 O HIS B 118 -11.110 11.441 23.937 1.00 0.00 O ATOM 1835 CB HIS B 118 -9.500 8.928 25.000 1.00 0.00 C ATOM 1836 CG HIS B 118 -9.128 7.481 25.136 1.00 0.00 C ATOM 1837 ND1 HIS B 118 -8.534 6.955 26.264 1.00 0.00 N ATOM 1838 CD2 HIS B 118 -9.265 6.445 24.274 1.00 0.00 C ATOM 1839 CE1 HIS B 118 -8.326 5.665 26.090 1.00 0.00 C ATOM 1840 NE2 HIS B 118 -8.761 5.328 24.891 1.00 0.00 N ATOM 0 H HIS B 118 -10.461 8.815 22.657 1.00 0.00 H new ATOM 0 HA HIS B 118 -11.584 8.560 25.333 1.00 0.00 H new ATOM 0 HB2 HIS B 118 -8.881 9.381 24.225 1.00 0.00 H new ATOM 0 HB3 HIS B 118 -9.269 9.442 25.933 1.00 0.00 H new ATOM 0 HD2 HIS B 118 -9.692 6.490 23.283 1.00 0.00 H new ATOM 0 HE1 HIS B 118 -7.875 4.996 26.808 1.00 0.00 H new ATOM 0 HE2 HIS B 118 -8.728 4.391 24.489 1.00 0.00 H new ATOM 1849 N HIS B 119 -11.891 10.970 25.986 1.00 0.00 N ATOM 1850 CA HIS B 119 -12.308 12.338 26.259 1.00 0.00 C ATOM 1851 C HIS B 119 -11.475 12.923 27.392 1.00 0.00 C ATOM 1852 O HIS B 119 -11.834 12.704 28.568 1.00 0.00 O ATOM 1853 CB HIS B 119 -13.799 12.374 26.617 1.00 0.00 C ATOM 1854 CG HIS B 119 -14.357 13.757 26.783 1.00 0.00 C ATOM 1855 ND1 HIS B 119 -14.476 14.386 28.005 1.00 0.00 N ATOM 1856 CD2 HIS B 119 -14.847 14.628 25.871 1.00 0.00 C ATOM 1857 CE1 HIS B 119 -15.015 15.578 27.836 1.00 0.00 C ATOM 1858 NE2 HIS B 119 -15.249 15.751 26.551 1.00 0.00 N ATOM 1859 OXT HIS B 119 -10.455 13.580 27.104 1.00 0.00 O ATOM 0 H HIS B 119 -12.066 10.316 26.749 1.00 0.00 H new ATOM 0 HA HIS B 119 -12.151 12.941 25.364 1.00 0.00 H new ATOM 0 HB2 HIS B 119 -14.361 11.858 25.838 1.00 0.00 H new ATOM 0 HB3 HIS B 119 -13.953 11.818 27.542 1.00 0.00 H new ATOM 0 HD2 HIS B 119 -14.910 14.469 24.805 1.00 0.00 H new ATOM 0 HE1 HIS B 119 -15.228 16.291 28.618 1.00 0.00 H new ATOM 0 HE2 HIS B 119 -15.662 16.583 26.130 1.00 0.00 H new TER 1868 HIS B 119