USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 924 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 44 TYR OH : rot -40:sc= 1.05 USER MOD Set 1.2: A 89 THR OG1 : rot -143:sc= 1.08 USER MOD Set 2.1: A 70 LYS NZ :NH3+ 158:sc= 0 (180deg=0) USER MOD Set 2.2: A 71 LYS NZ :NH3+ 145:sc= 0.673 (180deg=0.174) USER MOD Set 3.1: A 47 TYR OH : rot -33:sc= 1.2 USER MOD Set 3.2: A 108 LYS NZ :NH3+ 137:sc= 1.12 (180deg=0) USER MOD Set 4.1: A 9 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 0 GLY N :NH3+ -119:sc= 0.0795 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 MET CE :methyl 173:sc= -1.72 (180deg=-1.99) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 84:sc= 0.162 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.283 X(o=-0.28,f=-0.048) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ 151:sc= -0.359 (180deg=-1.63!) USER MOD Single : A 18 GLN : amide:sc= -2.82! C(o=-2.8!,f=-3.1!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 MET CE :methyl -156:sc= -0.87 (180deg=-1.92) USER MOD Single : A 30 SER OG : rot 180:sc= -0.103 USER MOD Single : A 34 ASN : amide:sc= -5.62! C(o=-5.6!,f=-13!) USER MOD Single : A 38 MET CE :methyl 140:sc= -0.81 (180deg=-3.82!) USER MOD Single : A 42 SER OG : rot -85:sc= 1.35 USER MOD Single : A 45 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0151) USER MOD Single : A 49 SER OG : rot -149:sc= -1.11 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.307 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 60:sc= -1.12 USER MOD Single : A 68 HIS : no HE2:sc= -3.53! C(o=-3.5!,f=-6.8!) USER MOD Single : A 72 THR OG1 : rot 91:sc= 0.0217 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -0.65 K(o=-0.65,f=-4.8!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ -179:sc= 0.224 (180deg=0.223) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 81 TYR OH : rot 165:sc= -0.435 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0.101 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.0415 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 30:sc= 0.711 USER MOD Single : A 92 LYS NZ :NH3+ -125:sc= 0.695 (180deg=-1.51) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.306 X(o=-0.31,f=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 TYR OH : rot 120:sc= -0.0817 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 0 34.253 10.292 12.053 1.00 0.00 N ATOM 2 CA GLY A 0 32.916 10.680 12.582 1.00 0.00 C ATOM 3 C GLY A 0 31.779 10.078 11.779 1.00 0.00 C ATOM 4 O GLY A 0 32.008 9.350 10.814 1.00 0.00 O ATOM 0 H1 GLY A 0 34.777 9.769 12.783 1.00 0.00 H new ATOM 0 H2 GLY A 0 34.133 9.689 11.214 1.00 0.00 H new ATOM 0 H3 GLY A 0 34.784 11.147 11.792 1.00 0.00 H new ATOM 0 HA2 GLY A 0 32.833 10.360 13.621 1.00 0.00 H new ATOM 0 HA3 GLY A 0 32.827 11.766 12.575 1.00 0.00 H new ATOM 10 N SER A 1 30.549 10.384 12.180 1.00 0.00 N ATOM 11 CA SER A 1 29.371 9.869 11.492 1.00 0.00 C ATOM 12 C SER A 1 28.213 10.858 11.580 1.00 0.00 C ATOM 13 O SER A 1 28.174 11.704 12.474 1.00 0.00 O ATOM 14 CB SER A 1 28.954 8.523 12.089 1.00 0.00 C ATOM 15 OG SER A 1 28.663 8.647 13.470 1.00 0.00 O ATOM 0 H SER A 1 30.343 10.986 12.977 1.00 0.00 H new ATOM 0 HA SER A 1 29.627 9.730 10.442 1.00 0.00 H new ATOM 0 HB2 SER A 1 28.079 8.143 11.562 1.00 0.00 H new ATOM 0 HB3 SER A 1 29.753 7.795 11.946 1.00 0.00 H new ATOM 0 HG SER A 1 28.397 7.774 13.828 1.00 0.00 H new ATOM 21 N MET A 2 27.273 10.745 10.648 1.00 0.00 N ATOM 22 CA MET A 2 26.114 11.630 10.621 1.00 0.00 C ATOM 23 C MET A 2 24.826 10.835 10.431 1.00 0.00 C ATOM 24 O MET A 2 23.865 11.325 9.839 1.00 0.00 O ATOM 25 CB MET A 2 26.260 12.662 9.501 1.00 0.00 C ATOM 26 CG MET A 2 27.271 13.755 9.809 1.00 0.00 C ATOM 27 SD MET A 2 26.501 15.250 10.461 1.00 0.00 S ATOM 28 CE MET A 2 25.524 14.570 11.800 1.00 0.00 C ATOM 0 H MET A 2 27.291 10.050 9.902 1.00 0.00 H new ATOM 0 HA MET A 2 26.062 12.148 11.579 1.00 0.00 H new ATOM 0 HB2 MET A 2 26.557 12.152 8.585 1.00 0.00 H new ATOM 0 HB3 MET A 2 25.289 13.120 9.311 1.00 0.00 H new ATOM 0 HG2 MET A 2 27.997 13.380 10.531 1.00 0.00 H new ATOM 0 HG3 MET A 2 27.822 14.001 8.901 1.00 0.00 H new ATOM 0 HE1 MET A 2 25.085 15.382 12.379 1.00 0.00 H new ATOM 0 HE2 MET A 2 24.729 13.946 11.390 1.00 0.00 H new ATOM 0 HE3 MET A 2 26.162 13.967 12.446 1.00 0.00 H new ATOM 38 N MET A 3 24.815 9.607 10.939 1.00 0.00 N ATOM 39 CA MET A 3 23.645 8.744 10.826 1.00 0.00 C ATOM 40 C MET A 3 22.987 8.539 12.186 1.00 0.00 C ATOM 41 O MET A 3 23.504 8.986 13.211 1.00 0.00 O ATOM 42 CB MET A 3 24.038 7.393 10.225 1.00 0.00 C ATOM 43 CG MET A 3 23.064 6.888 9.172 1.00 0.00 C ATOM 44 SD MET A 3 23.646 7.179 7.490 1.00 0.00 S ATOM 45 CE MET A 3 22.720 8.651 7.061 1.00 0.00 C ATOM 0 H MET A 3 25.603 9.187 11.433 1.00 0.00 H new ATOM 0 HA MET A 3 22.927 9.231 10.166 1.00 0.00 H new ATOM 0 HB2 MET A 3 25.029 7.477 9.780 1.00 0.00 H new ATOM 0 HB3 MET A 3 24.109 6.656 11.025 1.00 0.00 H new ATOM 0 HG2 MET A 3 22.901 5.820 9.316 1.00 0.00 H new ATOM 0 HG3 MET A 3 22.100 7.379 9.309 1.00 0.00 H new ATOM 0 HE1 MET A 3 22.972 8.956 6.045 1.00 0.00 H new ATOM 0 HE2 MET A 3 21.652 8.440 7.122 1.00 0.00 H new ATOM 0 HE3 MET A 3 22.971 9.454 7.754 1.00 0.00 H new ATOM 55 N MET A 4 21.844 7.861 12.190 1.00 0.00 N ATOM 56 CA MET A 4 21.116 7.596 13.425 1.00 0.00 C ATOM 57 C MET A 4 20.064 6.514 13.215 1.00 0.00 C ATOM 58 O MET A 4 19.912 5.610 14.038 1.00 0.00 O ATOM 59 CB MET A 4 20.456 8.878 13.937 1.00 0.00 C ATOM 60 CG MET A 4 20.610 9.085 15.435 1.00 0.00 C ATOM 61 SD MET A 4 19.378 8.181 16.391 1.00 0.00 S ATOM 62 CE MET A 4 19.767 8.731 18.050 1.00 0.00 C ATOM 0 H MET A 4 21.402 7.485 11.351 1.00 0.00 H new ATOM 0 HA MET A 4 21.829 7.242 14.170 1.00 0.00 H new ATOM 0 HB2 MET A 4 20.887 9.732 13.414 1.00 0.00 H new ATOM 0 HB3 MET A 4 19.395 8.855 13.689 1.00 0.00 H new ATOM 0 HG2 MET A 4 21.607 8.767 15.741 1.00 0.00 H new ATOM 0 HG3 MET A 4 20.531 10.148 15.661 1.00 0.00 H new ATOM 0 HE1 MET A 4 19.088 8.257 18.759 1.00 0.00 H new ATOM 0 HE2 MET A 4 20.794 8.457 18.293 1.00 0.00 H new ATOM 0 HE3 MET A 4 19.656 9.814 18.110 1.00 0.00 H new ATOM 72 N ALA A 5 19.339 6.615 12.109 1.00 0.00 N ATOM 73 CA ALA A 5 18.300 5.647 11.784 1.00 0.00 C ATOM 74 C ALA A 5 18.903 4.340 11.283 1.00 0.00 C ATOM 75 O ALA A 5 19.923 4.339 10.593 1.00 0.00 O ATOM 76 CB ALA A 5 17.348 6.224 10.746 1.00 0.00 C ATOM 0 H ALA A 5 19.452 7.359 11.420 1.00 0.00 H new ATOM 0 HA ALA A 5 17.741 5.432 12.695 1.00 0.00 H new ATOM 0 HB1 ALA A 5 16.577 5.490 10.512 1.00 0.00 H new ATOM 0 HB2 ALA A 5 16.882 7.127 11.141 1.00 0.00 H new ATOM 0 HB3 ALA A 5 17.902 6.469 9.840 1.00 0.00 H new ATOM 82 N LEU A 6 18.266 3.228 11.633 1.00 0.00 N ATOM 83 CA LEU A 6 18.740 1.912 11.217 1.00 0.00 C ATOM 84 C LEU A 6 17.588 1.057 10.702 1.00 0.00 C ATOM 85 O LEU A 6 17.703 0.399 9.667 1.00 0.00 O ATOM 86 CB LEU A 6 19.444 1.203 12.376 1.00 0.00 C ATOM 87 CG LEU A 6 18.774 1.376 13.739 1.00 0.00 C ATOM 88 CD1 LEU A 6 17.975 0.135 14.106 1.00 0.00 C ATOM 89 CD2 LEU A 6 19.811 1.680 14.811 1.00 0.00 C ATOM 0 H LEU A 6 17.421 3.211 12.203 1.00 0.00 H new ATOM 0 HA LEU A 6 19.454 2.053 10.406 1.00 0.00 H new ATOM 0 HB2 LEU A 6 19.503 0.139 12.149 1.00 0.00 H new ATOM 0 HB3 LEU A 6 20.467 1.573 12.441 1.00 0.00 H new ATOM 0 HG LEU A 6 18.087 2.220 13.677 1.00 0.00 H new ATOM 0 HD11 LEU A 6 17.506 0.279 15.079 1.00 0.00 H new ATOM 0 HD12 LEU A 6 17.205 -0.037 13.354 1.00 0.00 H new ATOM 0 HD13 LEU A 6 18.641 -0.727 14.148 1.00 0.00 H new ATOM 0 HD21 LEU A 6 19.315 1.800 15.774 1.00 0.00 H new ATOM 0 HD22 LEU A 6 20.525 0.858 14.870 1.00 0.00 H new ATOM 0 HD23 LEU A 6 20.338 2.600 14.557 1.00 0.00 H new ATOM 101 N SER A 7 16.481 1.070 11.431 1.00 0.00 N ATOM 102 CA SER A 7 15.304 0.298 11.052 1.00 0.00 C ATOM 103 C SER A 7 14.651 0.883 9.804 1.00 0.00 C ATOM 104 O SER A 7 14.971 1.998 9.388 1.00 0.00 O ATOM 105 CB SER A 7 14.296 0.267 12.202 1.00 0.00 C ATOM 106 OG SER A 7 13.961 1.578 12.623 1.00 0.00 O ATOM 0 H SER A 7 16.372 1.608 12.291 1.00 0.00 H new ATOM 0 HA SER A 7 15.623 -0.721 10.831 1.00 0.00 H new ATOM 0 HB2 SER A 7 13.395 -0.258 11.885 1.00 0.00 H new ATOM 0 HB3 SER A 7 14.713 -0.292 13.040 1.00 0.00 H new ATOM 0 HG SER A 7 13.256 1.937 12.045 1.00 0.00 H new ATOM 112 N LYS A 8 13.736 0.125 9.210 1.00 0.00 N ATOM 113 CA LYS A 8 13.038 0.570 8.008 1.00 0.00 C ATOM 114 C LYS A 8 11.567 0.854 8.300 1.00 0.00 C ATOM 115 O LYS A 8 10.933 1.654 7.613 1.00 0.00 O ATOM 116 CB LYS A 8 13.156 -0.486 6.906 1.00 0.00 C ATOM 117 CG LYS A 8 14.586 -0.913 6.623 1.00 0.00 C ATOM 118 CD LYS A 8 14.824 -1.115 5.134 1.00 0.00 C ATOM 119 CE LYS A 8 16.254 -1.547 4.852 1.00 0.00 C ATOM 120 NZ LYS A 8 17.138 -0.385 4.559 1.00 0.00 N ATOM 0 H LYS A 8 13.460 -0.800 9.540 1.00 0.00 H new ATOM 0 HA LYS A 8 13.505 1.495 7.670 1.00 0.00 H new ATOM 0 HB2 LYS A 8 12.574 -1.362 7.190 1.00 0.00 H new ATOM 0 HB3 LYS A 8 12.715 -0.094 5.990 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.274 -0.158 7.003 1.00 0.00 H new ATOM 0 HG3 LYS A 8 14.802 -1.839 7.156 1.00 0.00 H new ATOM 0 HD2 LYS A 8 14.134 -1.867 4.753 1.00 0.00 H new ATOM 0 HD3 LYS A 8 14.611 -0.188 4.601 1.00 0.00 H new ATOM 0 HE2 LYS A 8 16.644 -2.093 5.711 1.00 0.00 H new ATOM 0 HE3 LYS A 8 16.265 -2.234 4.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 18.104 -0.722 4.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 16.780 0.121 3.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 17.148 0.258 5.376 1.00 0.00 H new ATOM 134 N THR A 9 11.029 0.190 9.320 1.00 0.00 N ATOM 135 CA THR A 9 9.631 0.372 9.696 1.00 0.00 C ATOM 136 C THR A 9 9.518 1.108 11.028 1.00 0.00 C ATOM 137 O THR A 9 10.240 0.804 11.978 1.00 0.00 O ATOM 138 CB THR A 9 8.927 -0.985 9.783 1.00 0.00 C ATOM 139 OG1 THR A 9 9.118 -1.572 11.058 1.00 0.00 O ATOM 140 CG2 THR A 9 9.406 -1.980 8.746 1.00 0.00 C ATOM 0 H THR A 9 11.539 -0.477 9.899 1.00 0.00 H new ATOM 0 HA THR A 9 9.146 0.976 8.929 1.00 0.00 H new ATOM 0 HB THR A 9 7.874 -0.771 9.600 1.00 0.00 H new ATOM 0 HG1 THR A 9 8.659 -2.437 11.092 1.00 0.00 H new ATOM 0 HG21 THR A 9 8.865 -2.919 8.866 1.00 0.00 H new ATOM 0 HG22 THR A 9 9.224 -1.581 7.748 1.00 0.00 H new ATOM 0 HG23 THR A 9 10.474 -2.157 8.877 1.00 0.00 H new ATOM 148 N PHE A 10 8.609 2.077 11.092 1.00 0.00 N ATOM 149 CA PHE A 10 8.409 2.854 12.314 1.00 0.00 C ATOM 150 C PHE A 10 6.927 3.088 12.583 1.00 0.00 C ATOM 151 O PHE A 10 6.216 3.607 11.725 1.00 0.00 O ATOM 152 CB PHE A 10 9.110 4.211 12.193 1.00 0.00 C ATOM 153 CG PHE A 10 10.169 4.258 11.127 1.00 0.00 C ATOM 154 CD1 PHE A 10 10.001 5.051 10.004 1.00 0.00 C ATOM 155 CD2 PHE A 10 11.327 3.507 11.246 1.00 0.00 C ATOM 156 CE1 PHE A 10 10.968 5.095 9.018 1.00 0.00 C ATOM 157 CE2 PHE A 10 12.299 3.546 10.264 1.00 0.00 C ATOM 158 CZ PHE A 10 12.119 4.342 9.148 1.00 0.00 C ATOM 0 H PHE A 10 8.002 2.343 10.317 1.00 0.00 H new ATOM 0 HA PHE A 10 8.833 2.285 13.142 1.00 0.00 H new ATOM 0 HB2 PHE A 10 8.363 4.977 11.983 1.00 0.00 H new ATOM 0 HB3 PHE A 10 9.563 4.462 13.152 1.00 0.00 H new ATOM 0 HD1 PHE A 10 9.103 5.642 9.898 1.00 0.00 H new ATOM 0 HD2 PHE A 10 11.472 2.884 12.116 1.00 0.00 H new ATOM 0 HE1 PHE A 10 10.824 5.717 8.147 1.00 0.00 H new ATOM 0 HE2 PHE A 10 13.197 2.956 10.368 1.00 0.00 H new ATOM 0 HZ PHE A 10 12.877 4.375 8.379 1.00 0.00 H new ATOM 168 N GLY A 11 6.466 2.736 13.781 1.00 0.00 N ATOM 169 CA GLY A 11 5.071 2.961 14.107 1.00 0.00 C ATOM 170 C GLY A 11 4.206 1.739 13.872 1.00 0.00 C ATOM 171 O GLY A 11 4.711 0.648 13.605 1.00 0.00 O ATOM 0 H GLY A 11 7.024 2.306 14.519 1.00 0.00 H new ATOM 0 HA2 GLY A 11 4.991 3.261 15.152 1.00 0.00 H new ATOM 0 HA3 GLY A 11 4.692 3.789 13.508 1.00 0.00 H new ATOM 175 N GLN A 12 2.897 1.934 13.957 1.00 0.00 N ATOM 176 CA GLN A 12 1.943 0.859 13.731 1.00 0.00 C ATOM 177 C GLN A 12 1.985 0.433 12.266 1.00 0.00 C ATOM 178 O GLN A 12 2.413 1.200 11.403 1.00 0.00 O ATOM 179 CB GLN A 12 0.529 1.309 14.110 1.00 0.00 C ATOM 180 CG GLN A 12 0.076 0.808 15.471 1.00 0.00 C ATOM 181 CD GLN A 12 -1.427 0.631 15.555 1.00 0.00 C ATOM 182 OE1 GLN A 12 -2.078 1.170 16.451 1.00 0.00 O ATOM 183 NE2 GLN A 12 -1.988 -0.127 14.619 1.00 0.00 N ATOM 0 H GLN A 12 2.471 2.833 14.182 1.00 0.00 H new ATOM 0 HA GLN A 12 2.213 0.010 14.359 1.00 0.00 H new ATOM 0 HB2 GLN A 12 0.489 2.398 14.101 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -0.171 0.958 13.351 1.00 0.00 H new ATOM 0 HG2 GLN A 12 0.563 -0.144 15.685 1.00 0.00 H new ATOM 0 HG3 GLN A 12 0.399 1.511 16.239 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -1.410 -0.554 13.895 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -2.996 -0.281 14.624 1.00 0.00 H new ATOM 192 N LYS A 13 1.558 -0.793 11.986 1.00 0.00 N ATOM 193 CA LYS A 13 1.574 -1.306 10.620 1.00 0.00 C ATOM 194 C LYS A 13 0.546 -0.567 9.765 1.00 0.00 C ATOM 195 O LYS A 13 -0.514 -0.178 10.252 1.00 0.00 O ATOM 196 CB LYS A 13 1.275 -2.812 10.625 1.00 0.00 C ATOM 197 CG LYS A 13 1.054 -3.416 9.243 1.00 0.00 C ATOM 198 CD LYS A 13 2.338 -4.000 8.677 1.00 0.00 C ATOM 199 CE LYS A 13 2.792 -5.219 9.464 1.00 0.00 C ATOM 200 NZ LYS A 13 2.440 -6.490 8.774 1.00 0.00 N ATOM 0 H LYS A 13 1.199 -1.447 12.681 1.00 0.00 H new ATOM 0 HA LYS A 13 2.563 -1.142 10.193 1.00 0.00 H new ATOM 0 HB2 LYS A 13 2.102 -3.332 11.107 1.00 0.00 H new ATOM 0 HB3 LYS A 13 0.388 -2.992 11.232 1.00 0.00 H new ATOM 0 HG2 LYS A 13 0.294 -4.195 9.303 1.00 0.00 H new ATOM 0 HG3 LYS A 13 0.673 -2.650 8.567 1.00 0.00 H new ATOM 0 HD2 LYS A 13 2.184 -4.276 7.634 1.00 0.00 H new ATOM 0 HD3 LYS A 13 3.122 -3.242 8.694 1.00 0.00 H new ATOM 0 HE2 LYS A 13 3.871 -5.174 9.612 1.00 0.00 H new ATOM 0 HE3 LYS A 13 2.333 -5.204 10.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 2.767 -7.296 9.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 1.408 -6.546 8.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 2.898 -6.517 7.841 1.00 0.00 H new ATOM 214 N PRO A 14 0.859 -0.347 8.472 1.00 0.00 N ATOM 215 CA PRO A 14 -0.038 0.367 7.557 1.00 0.00 C ATOM 216 C PRO A 14 -1.384 -0.326 7.419 1.00 0.00 C ATOM 217 O PRO A 14 -1.513 -1.519 7.692 1.00 0.00 O ATOM 218 CB PRO A 14 0.711 0.345 6.219 1.00 0.00 C ATOM 219 CG PRO A 14 2.137 0.105 6.578 1.00 0.00 C ATOM 220 CD PRO A 14 2.111 -0.754 7.809 1.00 0.00 C ATOM 0 HA PRO A 14 -0.263 1.372 7.914 1.00 0.00 H new ATOM 0 HB2 PRO A 14 0.331 -0.441 5.567 1.00 0.00 H new ATOM 0 HB3 PRO A 14 0.592 1.288 5.685 1.00 0.00 H new ATOM 0 HG2 PRO A 14 2.666 -0.393 5.765 1.00 0.00 H new ATOM 0 HG3 PRO A 14 2.656 1.045 6.768 1.00 0.00 H new ATOM 0 HD2 PRO A 14 2.109 -1.815 7.560 1.00 0.00 H new ATOM 0 HD3 PRO A 14 2.980 -0.577 8.443 1.00 0.00 H new ATOM 228 N VAL A 15 -2.391 0.433 7.004 1.00 0.00 N ATOM 229 CA VAL A 15 -3.731 -0.105 6.846 1.00 0.00 C ATOM 230 C VAL A 15 -3.832 -1.014 5.624 1.00 0.00 C ATOM 231 O VAL A 15 -3.651 -0.575 4.478 1.00 0.00 O ATOM 232 CB VAL A 15 -4.782 1.017 6.749 1.00 0.00 C ATOM 233 CG1 VAL A 15 -4.667 1.958 7.941 1.00 0.00 C ATOM 234 CG2 VAL A 15 -4.643 1.781 5.440 1.00 0.00 C ATOM 0 H VAL A 15 -2.302 1.422 6.772 1.00 0.00 H new ATOM 0 HA VAL A 15 -3.936 -0.699 7.737 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.772 0.561 6.766 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.417 2.745 7.857 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.829 1.399 8.863 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -3.673 2.404 7.958 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.396 2.568 5.396 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -3.650 2.226 5.382 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -4.783 1.097 4.603 1.00 0.00 H new ATOM 244 N LYS A 16 -4.130 -2.284 5.889 1.00 0.00 N ATOM 245 CA LYS A 16 -4.276 -3.286 4.841 1.00 0.00 C ATOM 246 C LYS A 16 -5.735 -3.718 4.737 1.00 0.00 C ATOM 247 O LYS A 16 -6.465 -3.702 5.728 1.00 0.00 O ATOM 248 CB LYS A 16 -3.388 -4.500 5.134 1.00 0.00 C ATOM 249 CG LYS A 16 -3.596 -5.092 6.518 1.00 0.00 C ATOM 250 CD LYS A 16 -3.355 -6.594 6.522 1.00 0.00 C ATOM 251 CE LYS A 16 -2.156 -6.968 7.378 1.00 0.00 C ATOM 252 NZ LYS A 16 -2.185 -6.285 8.702 1.00 0.00 N ATOM 0 H LYS A 16 -4.276 -2.644 6.832 1.00 0.00 H new ATOM 0 HA LYS A 16 -3.964 -2.849 3.892 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.582 -5.269 4.387 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.343 -4.209 5.027 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -2.920 -4.612 7.226 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.611 -4.884 6.855 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -4.243 -7.104 6.896 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -3.195 -6.940 5.501 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -2.138 -8.048 7.527 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -1.238 -6.704 6.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -1.700 -6.875 9.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -1.703 -5.366 8.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.172 -6.136 8.994 1.00 0.00 H new ATOM 266 N PHE A 17 -6.164 -4.098 3.538 1.00 0.00 N ATOM 267 CA PHE A 17 -7.544 -4.521 3.330 1.00 0.00 C ATOM 268 C PHE A 17 -7.643 -5.582 2.241 1.00 0.00 C ATOM 269 O PHE A 17 -6.691 -5.817 1.500 1.00 0.00 O ATOM 270 CB PHE A 17 -8.413 -3.319 2.958 1.00 0.00 C ATOM 271 CG PHE A 17 -7.832 -2.477 1.855 1.00 0.00 C ATOM 272 CD1 PHE A 17 -7.986 -2.845 0.527 1.00 0.00 C ATOM 273 CD2 PHE A 17 -7.134 -1.316 2.148 1.00 0.00 C ATOM 274 CE1 PHE A 17 -7.454 -2.071 -0.488 1.00 0.00 C ATOM 275 CE2 PHE A 17 -6.601 -0.541 1.138 1.00 0.00 C ATOM 276 CZ PHE A 17 -6.759 -0.915 -0.180 1.00 0.00 C ATOM 0 H PHE A 17 -5.581 -4.122 2.701 1.00 0.00 H new ATOM 0 HA PHE A 17 -7.902 -4.956 4.263 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -9.398 -3.673 2.654 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.557 -2.697 3.842 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -8.528 -3.747 0.282 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -7.006 -1.015 3.177 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -7.581 -2.368 -1.519 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.059 0.361 1.380 1.00 0.00 H new ATOM 0 HZ PHE A 17 -6.342 -0.307 -0.969 1.00 0.00 H new ATOM 286 N GLN A 18 -8.807 -6.216 2.149 1.00 0.00 N ATOM 287 CA GLN A 18 -9.038 -7.248 1.146 1.00 0.00 C ATOM 288 C GLN A 18 -9.876 -6.700 -0.004 1.00 0.00 C ATOM 289 O GLN A 18 -10.939 -6.120 0.212 1.00 0.00 O ATOM 290 CB GLN A 18 -9.738 -8.456 1.772 1.00 0.00 C ATOM 291 CG GLN A 18 -9.266 -9.786 1.213 1.00 0.00 C ATOM 292 CD GLN A 18 -10.413 -10.685 0.806 1.00 0.00 C ATOM 293 OE1 GLN A 18 -11.389 -10.234 0.206 1.00 0.00 O ATOM 294 NE2 GLN A 18 -10.304 -11.965 1.131 1.00 0.00 N ATOM 0 H GLN A 18 -9.605 -6.033 2.757 1.00 0.00 H new ATOM 0 HA GLN A 18 -8.071 -7.565 0.755 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -9.572 -8.444 2.849 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -10.813 -8.365 1.614 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -8.626 -9.606 0.349 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -8.658 -10.295 1.961 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -9.477 -12.296 1.628 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -11.047 -12.619 0.884 1.00 0.00 H new ATOM 303 N LEU A 19 -9.387 -6.882 -1.227 1.00 0.00 N ATOM 304 CA LEU A 19 -10.092 -6.399 -2.408 1.00 0.00 C ATOM 305 C LEU A 19 -10.684 -7.555 -3.211 1.00 0.00 C ATOM 306 O LEU A 19 -11.683 -7.387 -3.911 1.00 0.00 O ATOM 307 CB LEU A 19 -9.149 -5.572 -3.287 1.00 0.00 C ATOM 308 CG LEU A 19 -9.368 -4.058 -3.234 1.00 0.00 C ATOM 309 CD1 LEU A 19 -8.507 -3.362 -4.276 1.00 0.00 C ATOM 310 CD2 LEU A 19 -10.836 -3.720 -3.447 1.00 0.00 C ATOM 0 H LEU A 19 -8.508 -7.359 -1.425 1.00 0.00 H new ATOM 0 HA LEU A 19 -10.914 -5.766 -2.074 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -8.122 -5.785 -2.991 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -9.258 -5.903 -4.320 1.00 0.00 H new ATOM 0 HG LEU A 19 -9.074 -3.703 -2.246 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -8.674 -2.286 -4.226 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -7.456 -3.576 -4.081 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -8.773 -3.725 -5.269 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -10.970 -2.639 -3.406 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -11.157 -4.088 -4.421 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -11.435 -4.190 -2.667 1.00 0.00 H new ATOM 322 N GLU A 20 -10.066 -8.728 -3.107 1.00 0.00 N ATOM 323 CA GLU A 20 -10.541 -9.905 -3.829 1.00 0.00 C ATOM 324 C GLU A 20 -10.940 -11.016 -2.864 1.00 0.00 C ATOM 325 O GLU A 20 -10.314 -11.205 -1.823 1.00 0.00 O ATOM 326 CB GLU A 20 -9.464 -10.412 -4.790 1.00 0.00 C ATOM 327 CG GLU A 20 -8.855 -9.318 -5.652 1.00 0.00 C ATOM 328 CD GLU A 20 -8.843 -9.675 -7.127 1.00 0.00 C ATOM 329 OE1 GLU A 20 -7.739 -9.838 -7.689 1.00 0.00 O ATOM 330 OE2 GLU A 20 -9.936 -9.792 -7.718 1.00 0.00 O ATOM 0 H GLU A 20 -9.239 -8.889 -2.532 1.00 0.00 H new ATOM 0 HA GLU A 20 -11.422 -9.614 -4.402 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -8.673 -10.893 -4.215 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -9.896 -11.175 -5.437 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -9.416 -8.394 -5.510 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -7.835 -9.125 -5.320 1.00 0.00 H new ATOM 337 N ASP A 21 -11.989 -11.749 -3.222 1.00 0.00 N ATOM 338 CA ASP A 21 -12.486 -12.846 -2.399 1.00 0.00 C ATOM 339 C ASP A 21 -11.483 -13.999 -2.328 1.00 0.00 C ATOM 340 O ASP A 21 -11.636 -14.913 -1.517 1.00 0.00 O ATOM 341 CB ASP A 21 -13.821 -13.354 -2.948 1.00 0.00 C ATOM 342 CG ASP A 21 -14.807 -13.692 -1.846 1.00 0.00 C ATOM 343 OD1 ASP A 21 -14.360 -13.993 -0.720 1.00 0.00 O ATOM 344 OD2 ASP A 21 -16.028 -13.657 -2.112 1.00 0.00 O ATOM 0 H ASP A 21 -12.515 -11.601 -4.083 1.00 0.00 H new ATOM 0 HA ASP A 21 -12.629 -12.462 -1.389 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.255 -12.596 -3.600 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -13.646 -14.239 -3.560 1.00 0.00 H new ATOM 349 N ASP A 22 -10.468 -13.963 -3.187 1.00 0.00 N ATOM 350 CA ASP A 22 -9.460 -15.017 -3.221 1.00 0.00 C ATOM 351 C ASP A 22 -8.400 -14.824 -2.136 1.00 0.00 C ATOM 352 O ASP A 22 -7.498 -15.648 -1.989 1.00 0.00 O ATOM 353 CB ASP A 22 -8.790 -15.062 -4.596 1.00 0.00 C ATOM 354 CG ASP A 22 -9.759 -15.441 -5.698 1.00 0.00 C ATOM 355 OD1 ASP A 22 -10.712 -14.671 -5.941 1.00 0.00 O ATOM 356 OD2 ASP A 22 -9.565 -16.507 -6.318 1.00 0.00 O ATOM 0 H ASP A 22 -10.322 -13.217 -3.867 1.00 0.00 H new ATOM 0 HA ASP A 22 -9.968 -15.962 -3.030 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -8.355 -14.087 -4.817 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -7.970 -15.780 -4.574 1.00 0.00 H new ATOM 361 N GLY A 23 -8.516 -13.742 -1.368 1.00 0.00 N ATOM 362 CA GLY A 23 -7.560 -13.488 -0.306 1.00 0.00 C ATOM 363 C GLY A 23 -6.527 -12.440 -0.674 1.00 0.00 C ATOM 364 O GLY A 23 -5.426 -12.430 -0.123 1.00 0.00 O ATOM 0 H GLY A 23 -9.251 -13.041 -1.463 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.095 -13.164 0.587 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.051 -14.418 -0.053 1.00 0.00 H new ATOM 368 N GLU A 24 -6.878 -11.554 -1.599 1.00 0.00 N ATOM 369 CA GLU A 24 -5.963 -10.499 -2.022 1.00 0.00 C ATOM 370 C GLU A 24 -5.974 -9.348 -1.025 1.00 0.00 C ATOM 371 O GLU A 24 -6.998 -8.692 -0.832 1.00 0.00 O ATOM 372 CB GLU A 24 -6.342 -9.984 -3.411 1.00 0.00 C ATOM 373 CG GLU A 24 -6.189 -11.021 -4.512 1.00 0.00 C ATOM 374 CD GLU A 24 -4.812 -11.654 -4.529 1.00 0.00 C ATOM 375 OE1 GLU A 24 -3.816 -10.916 -4.371 1.00 0.00 O ATOM 376 OE2 GLU A 24 -4.727 -12.889 -4.700 1.00 0.00 O ATOM 0 H GLU A 24 -7.784 -11.544 -2.068 1.00 0.00 H new ATOM 0 HA GLU A 24 -4.958 -10.920 -2.063 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -7.376 -9.639 -3.391 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -5.722 -9.120 -3.650 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -6.941 -11.799 -4.380 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -6.381 -10.552 -5.477 1.00 0.00 H new ATOM 383 N PHE A 25 -4.831 -9.105 -0.394 1.00 0.00 N ATOM 384 CA PHE A 25 -4.717 -8.033 0.582 1.00 0.00 C ATOM 385 C PHE A 25 -3.820 -6.915 0.065 1.00 0.00 C ATOM 386 O PHE A 25 -2.738 -7.163 -0.466 1.00 0.00 O ATOM 387 CB PHE A 25 -4.172 -8.571 1.906 1.00 0.00 C ATOM 388 CG PHE A 25 -5.247 -8.959 2.880 1.00 0.00 C ATOM 389 CD1 PHE A 25 -5.630 -8.096 3.897 1.00 0.00 C ATOM 390 CD2 PHE A 25 -5.877 -10.189 2.777 1.00 0.00 C ATOM 391 CE1 PHE A 25 -6.621 -8.456 4.791 1.00 0.00 C ATOM 392 CE2 PHE A 25 -6.867 -10.553 3.667 1.00 0.00 C ATOM 393 CZ PHE A 25 -7.241 -9.686 4.676 1.00 0.00 C ATOM 0 H PHE A 25 -3.973 -9.636 -0.542 1.00 0.00 H new ATOM 0 HA PHE A 25 -5.714 -7.624 0.749 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -3.543 -9.439 1.706 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -3.535 -7.814 2.362 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -5.149 -7.134 3.991 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -5.590 -10.871 1.991 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -6.911 -7.777 5.579 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -7.349 -11.515 3.575 1.00 0.00 H new ATOM 0 HZ PHE A 25 -8.016 -9.969 5.373 1.00 0.00 H new ATOM 403 N TYR A 26 -4.283 -5.683 0.226 1.00 0.00 N ATOM 404 CA TYR A 26 -3.535 -4.517 -0.216 1.00 0.00 C ATOM 405 C TYR A 26 -3.361 -3.529 0.927 1.00 0.00 C ATOM 406 O TYR A 26 -4.019 -3.635 1.959 1.00 0.00 O ATOM 407 CB TYR A 26 -4.240 -3.832 -1.384 1.00 0.00 C ATOM 408 CG TYR A 26 -4.306 -4.680 -2.633 1.00 0.00 C ATOM 409 CD1 TYR A 26 -5.282 -5.657 -2.788 1.00 0.00 C ATOM 410 CD2 TYR A 26 -3.388 -4.502 -3.657 1.00 0.00 C ATOM 411 CE1 TYR A 26 -5.339 -6.433 -3.932 1.00 0.00 C ATOM 412 CE2 TYR A 26 -3.438 -5.270 -4.802 1.00 0.00 C ATOM 413 CZ TYR A 26 -4.415 -6.234 -4.936 1.00 0.00 C ATOM 414 OH TYR A 26 -4.468 -7.002 -6.077 1.00 0.00 O ATOM 0 H TYR A 26 -5.179 -5.466 0.662 1.00 0.00 H new ATOM 0 HA TYR A 26 -2.553 -4.855 -0.547 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -5.253 -3.567 -1.081 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -3.722 -2.901 -1.614 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -6.007 -5.813 -2.003 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -2.620 -3.749 -3.556 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -6.102 -7.190 -4.038 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -2.715 -5.117 -5.590 1.00 0.00 H new ATOM 0 HH TYR A 26 -3.747 -6.735 -6.685 1.00 0.00 H new ATOM 424 N MET A 27 -2.471 -2.568 0.730 1.00 0.00 N ATOM 425 CA MET A 27 -2.203 -1.551 1.738 1.00 0.00 C ATOM 426 C MET A 27 -2.210 -0.164 1.111 1.00 0.00 C ATOM 427 O MET A 27 -1.808 0.002 -0.042 1.00 0.00 O ATOM 428 CB MET A 27 -0.851 -1.809 2.406 1.00 0.00 C ATOM 429 CG MET A 27 -0.945 -2.672 3.652 1.00 0.00 C ATOM 430 SD MET A 27 -0.275 -4.328 3.405 1.00 0.00 S ATOM 431 CE MET A 27 1.072 -4.326 4.585 1.00 0.00 C ATOM 0 H MET A 27 -1.919 -2.470 -0.122 1.00 0.00 H new ATOM 0 HA MET A 27 -2.989 -1.601 2.492 1.00 0.00 H new ATOM 0 HB2 MET A 27 -0.187 -2.291 1.689 1.00 0.00 H new ATOM 0 HB3 MET A 27 -0.397 -0.854 2.669 1.00 0.00 H new ATOM 0 HG2 MET A 27 -0.409 -2.186 4.467 1.00 0.00 H new ATOM 0 HG3 MET A 27 -1.988 -2.749 3.958 1.00 0.00 H new ATOM 0 HE1 MET A 27 1.823 -5.055 4.281 1.00 0.00 H new ATOM 0 HE2 MET A 27 1.523 -3.334 4.621 1.00 0.00 H new ATOM 0 HE3 MET A 27 0.691 -4.587 5.572 1.00 0.00 H new ATOM 441 N ILE A 28 -2.663 0.832 1.866 1.00 0.00 N ATOM 442 CA ILE A 28 -2.702 2.198 1.350 1.00 0.00 C ATOM 443 C ILE A 28 -1.305 2.817 1.341 1.00 0.00 C ATOM 444 O ILE A 28 -0.635 2.888 2.375 1.00 0.00 O ATOM 445 CB ILE A 28 -3.663 3.099 2.149 1.00 0.00 C ATOM 446 CG1 ILE A 28 -4.992 2.383 2.383 1.00 0.00 C ATOM 447 CG2 ILE A 28 -3.896 4.402 1.401 1.00 0.00 C ATOM 448 CD1 ILE A 28 -6.009 3.220 3.130 1.00 0.00 C ATOM 0 H ILE A 28 -3.003 0.724 2.821 1.00 0.00 H new ATOM 0 HA ILE A 28 -3.076 2.133 0.328 1.00 0.00 H new ATOM 0 HB ILE A 28 -3.212 3.321 3.116 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -5.412 2.090 1.421 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -4.807 1.466 2.943 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -4.576 5.033 1.973 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -2.946 4.920 1.268 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -4.333 4.188 0.425 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -6.927 2.647 3.260 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -5.610 3.491 4.107 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -6.223 4.125 2.562 1.00 0.00 H new ATOM 460 N GLY A 29 -0.870 3.252 0.159 1.00 0.00 N ATOM 461 CA GLY A 29 0.451 3.840 0.018 1.00 0.00 C ATOM 462 C GLY A 29 0.690 4.996 0.965 1.00 0.00 C ATOM 463 O GLY A 29 1.824 5.239 1.377 1.00 0.00 O ATOM 0 H GLY A 29 -1.411 3.207 -0.704 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.205 3.072 0.194 1.00 0.00 H new ATOM 0 HA3 GLY A 29 0.581 4.185 -1.008 1.00 0.00 H new ATOM 467 N SER A 30 -0.372 5.703 1.324 1.00 0.00 N ATOM 468 CA SER A 30 -0.251 6.826 2.244 1.00 0.00 C ATOM 469 C SER A 30 0.275 6.342 3.590 1.00 0.00 C ATOM 470 O SER A 30 1.135 6.982 4.206 1.00 0.00 O ATOM 471 CB SER A 30 -1.604 7.516 2.425 1.00 0.00 C ATOM 472 OG SER A 30 -2.440 6.778 3.299 1.00 0.00 O ATOM 0 H SER A 30 -1.320 5.521 0.996 1.00 0.00 H new ATOM 0 HA SER A 30 0.452 7.546 1.826 1.00 0.00 H new ATOM 0 HB2 SER A 30 -1.454 8.520 2.822 1.00 0.00 H new ATOM 0 HB3 SER A 30 -2.092 7.626 1.457 1.00 0.00 H new ATOM 0 HG SER A 30 -3.298 7.241 3.399 1.00 0.00 H new ATOM 478 N GLU A 31 -0.235 5.196 4.033 1.00 0.00 N ATOM 479 CA GLU A 31 0.191 4.616 5.298 1.00 0.00 C ATOM 480 C GLU A 31 1.607 4.081 5.180 1.00 0.00 C ATOM 481 O GLU A 31 2.433 4.272 6.072 1.00 0.00 O ATOM 482 CB GLU A 31 -0.764 3.501 5.728 1.00 0.00 C ATOM 483 CG GLU A 31 -2.072 4.013 6.307 1.00 0.00 C ATOM 484 CD GLU A 31 -2.139 3.869 7.815 1.00 0.00 C ATOM 485 OE1 GLU A 31 -1.918 2.745 8.314 1.00 0.00 O ATOM 486 OE2 GLU A 31 -2.412 4.879 8.497 1.00 0.00 O ATOM 0 H GLU A 31 -0.941 4.654 3.535 1.00 0.00 H new ATOM 0 HA GLU A 31 0.173 5.396 6.059 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -0.980 2.867 4.868 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.268 2.875 6.470 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.197 5.062 6.040 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -2.902 3.469 5.857 1.00 0.00 H new ATOM 493 N VAL A 32 1.885 3.423 4.063 1.00 0.00 N ATOM 494 CA VAL A 32 3.209 2.873 3.816 1.00 0.00 C ATOM 495 C VAL A 32 4.247 3.985 3.765 1.00 0.00 C ATOM 496 O VAL A 32 5.351 3.845 4.291 1.00 0.00 O ATOM 497 CB VAL A 32 3.256 2.077 2.498 1.00 0.00 C ATOM 498 CG1 VAL A 32 4.593 1.369 2.348 1.00 0.00 C ATOM 499 CG2 VAL A 32 2.106 1.082 2.434 1.00 0.00 C ATOM 0 H VAL A 32 1.212 3.258 3.315 1.00 0.00 H new ATOM 0 HA VAL A 32 3.435 2.195 4.639 1.00 0.00 H new ATOM 0 HB VAL A 32 3.148 2.776 1.669 1.00 0.00 H new ATOM 0 HG11 VAL A 32 4.607 0.812 1.411 1.00 0.00 H new ATOM 0 HG12 VAL A 32 5.396 2.106 2.344 1.00 0.00 H new ATOM 0 HG13 VAL A 32 4.736 0.681 3.181 1.00 0.00 H new ATOM 0 HG21 VAL A 32 2.155 0.529 1.496 1.00 0.00 H new ATOM 0 HG22 VAL A 32 2.180 0.386 3.270 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.158 1.617 2.490 1.00 0.00 H new ATOM 509 N GLY A 33 3.882 5.093 3.129 1.00 0.00 N ATOM 510 CA GLY A 33 4.789 6.218 3.023 1.00 0.00 C ATOM 511 C GLY A 33 5.127 6.818 4.372 1.00 0.00 C ATOM 512 O GLY A 33 6.300 6.996 4.703 1.00 0.00 O ATOM 0 H GLY A 33 2.974 5.231 2.685 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.707 5.896 2.532 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.341 6.984 2.390 1.00 0.00 H new ATOM 516 N ASN A 34 4.104 7.118 5.168 1.00 0.00 N ATOM 517 CA ASN A 34 4.333 7.686 6.490 1.00 0.00 C ATOM 518 C ASN A 34 5.047 6.674 7.382 1.00 0.00 C ATOM 519 O ASN A 34 5.853 7.041 8.237 1.00 0.00 O ATOM 520 CB ASN A 34 3.021 8.161 7.129 1.00 0.00 C ATOM 521 CG ASN A 34 2.067 7.032 7.475 1.00 0.00 C ATOM 522 OD1 ASN A 34 2.478 5.954 7.900 1.00 0.00 O ATOM 523 ND2 ASN A 34 0.774 7.282 7.302 1.00 0.00 N ATOM 0 H ASN A 34 3.123 6.979 4.924 1.00 0.00 H new ATOM 0 HA ASN A 34 4.974 8.561 6.380 1.00 0.00 H new ATOM 0 HB2 ASN A 34 3.251 8.721 8.035 1.00 0.00 H new ATOM 0 HB3 ASN A 34 2.523 8.849 6.446 1.00 0.00 H new ATOM 0 HD21 ASN A 34 0.082 6.566 7.524 1.00 0.00 H new ATOM 0 HD22 ASN A 34 0.473 8.190 6.947 1.00 0.00 H new ATOM 530 N TYR A 35 4.748 5.397 7.165 1.00 0.00 N ATOM 531 CA TYR A 35 5.359 4.318 7.934 1.00 0.00 C ATOM 532 C TYR A 35 6.870 4.299 7.733 1.00 0.00 C ATOM 533 O TYR A 35 7.632 4.140 8.687 1.00 0.00 O ATOM 534 CB TYR A 35 4.758 2.981 7.498 1.00 0.00 C ATOM 535 CG TYR A 35 5.046 1.845 8.443 1.00 0.00 C ATOM 536 CD1 TYR A 35 5.286 0.563 7.968 1.00 0.00 C ATOM 537 CD2 TYR A 35 5.075 2.054 9.812 1.00 0.00 C ATOM 538 CE1 TYR A 35 5.547 -0.477 8.835 1.00 0.00 C ATOM 539 CE2 TYR A 35 5.336 1.022 10.683 1.00 0.00 C ATOM 540 CZ TYR A 35 5.572 -0.243 10.193 1.00 0.00 C ATOM 541 OH TYR A 35 5.832 -1.278 11.062 1.00 0.00 O ATOM 0 H TYR A 35 4.082 5.083 6.459 1.00 0.00 H new ATOM 0 HA TYR A 35 5.158 4.483 8.992 1.00 0.00 H new ATOM 0 HB2 TYR A 35 3.678 3.094 7.400 1.00 0.00 H new ATOM 0 HB3 TYR A 35 5.143 2.726 6.511 1.00 0.00 H new ATOM 0 HD1 TYR A 35 5.268 0.377 6.904 1.00 0.00 H new ATOM 0 HD2 TYR A 35 4.890 3.044 10.202 1.00 0.00 H new ATOM 0 HE1 TYR A 35 5.731 -1.470 8.452 1.00 0.00 H new ATOM 0 HE2 TYR A 35 5.356 1.203 11.748 1.00 0.00 H new ATOM 0 HH TYR A 35 5.814 -0.944 11.983 1.00 0.00 H new ATOM 551 N LEU A 36 7.294 4.477 6.490 1.00 0.00 N ATOM 552 CA LEU A 36 8.716 4.496 6.162 1.00 0.00 C ATOM 553 C LEU A 36 9.259 5.925 6.169 1.00 0.00 C ATOM 554 O LEU A 36 10.458 6.142 5.988 1.00 0.00 O ATOM 555 CB LEU A 36 8.962 3.846 4.800 1.00 0.00 C ATOM 556 CG LEU A 36 8.526 2.383 4.693 1.00 0.00 C ATOM 557 CD1 LEU A 36 7.442 2.214 3.635 1.00 0.00 C ATOM 558 CD2 LEU A 36 9.720 1.490 4.384 1.00 0.00 C ATOM 0 H LEU A 36 6.675 4.611 5.690 1.00 0.00 H new ATOM 0 HA LEU A 36 9.244 3.923 6.924 1.00 0.00 H new ATOM 0 HB2 LEU A 36 8.436 4.423 4.039 1.00 0.00 H new ATOM 0 HB3 LEU A 36 10.026 3.910 4.570 1.00 0.00 H new ATOM 0 HG LEU A 36 8.110 2.082 5.655 1.00 0.00 H new ATOM 0 HD11 LEU A 36 7.149 1.166 3.578 1.00 0.00 H new ATOM 0 HD12 LEU A 36 6.575 2.819 3.902 1.00 0.00 H new ATOM 0 HD13 LEU A 36 7.825 2.537 2.667 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.390 0.454 4.312 1.00 0.00 H new ATOM 0 HD22 LEU A 36 10.167 1.795 3.438 1.00 0.00 H new ATOM 0 HD23 LEU A 36 10.458 1.581 5.181 1.00 0.00 H new ATOM 570 N ARG A 37 8.372 6.897 6.383 1.00 0.00 N ATOM 571 CA ARG A 37 8.759 8.304 6.420 1.00 0.00 C ATOM 572 C ARG A 37 9.184 8.800 5.043 1.00 0.00 C ATOM 573 O ARG A 37 10.019 9.698 4.929 1.00 0.00 O ATOM 574 CB ARG A 37 9.893 8.523 7.423 1.00 0.00 C ATOM 575 CG ARG A 37 9.816 9.858 8.146 1.00 0.00 C ATOM 576 CD ARG A 37 10.712 9.880 9.376 1.00 0.00 C ATOM 577 NE ARG A 37 11.751 10.904 9.277 1.00 0.00 N ATOM 578 CZ ARG A 37 12.857 10.910 10.018 1.00 0.00 C ATOM 579 NH1 ARG A 37 13.074 9.952 10.909 1.00 0.00 N ATOM 580 NH2 ARG A 37 13.750 11.879 9.864 1.00 0.00 N ATOM 0 H ARG A 37 7.377 6.733 6.534 1.00 0.00 H new ATOM 0 HA ARG A 37 7.887 8.876 6.736 1.00 0.00 H new ATOM 0 HB2 ARG A 37 9.876 7.719 8.159 1.00 0.00 H new ATOM 0 HB3 ARG A 37 10.847 8.457 6.900 1.00 0.00 H new ATOM 0 HG2 ARG A 37 10.110 10.658 7.467 1.00 0.00 H new ATOM 0 HG3 ARG A 37 8.785 10.053 8.442 1.00 0.00 H new ATOM 0 HD2 ARG A 37 10.106 10.063 10.263 1.00 0.00 H new ATOM 0 HD3 ARG A 37 11.177 8.902 9.504 1.00 0.00 H new ATOM 0 HE ARG A 37 11.621 11.657 8.601 1.00 0.00 H new ATOM 0 HH11 ARG A 37 12.391 9.204 11.030 1.00 0.00 H new ATOM 0 HH12 ARG A 37 13.924 9.963 11.473 1.00 0.00 H new ATOM 0 HH21 ARG A 37 13.588 12.617 9.179 1.00 0.00 H new ATOM 0 HH22 ARG A 37 14.598 11.886 10.431 1.00 0.00 H new ATOM 594 N MET A 38 8.595 8.227 3.999 1.00 0.00 N ATOM 595 CA MET A 38 8.907 8.634 2.637 1.00 0.00 C ATOM 596 C MET A 38 7.808 9.541 2.098 1.00 0.00 C ATOM 597 O MET A 38 6.629 9.186 2.123 1.00 0.00 O ATOM 598 CB MET A 38 9.067 7.409 1.735 1.00 0.00 C ATOM 599 CG MET A 38 10.227 6.510 2.131 1.00 0.00 C ATOM 600 SD MET A 38 11.751 6.917 1.259 1.00 0.00 S ATOM 601 CE MET A 38 11.970 5.449 0.255 1.00 0.00 C ATOM 0 H MET A 38 7.902 7.482 4.071 1.00 0.00 H new ATOM 0 HA MET A 38 9.848 9.183 2.646 1.00 0.00 H new ATOM 0 HB2 MET A 38 8.144 6.829 1.757 1.00 0.00 H new ATOM 0 HB3 MET A 38 9.210 7.741 0.707 1.00 0.00 H new ATOM 0 HG2 MET A 38 10.395 6.592 3.205 1.00 0.00 H new ATOM 0 HG3 MET A 38 9.963 5.472 1.928 1.00 0.00 H new ATOM 0 HE1 MET A 38 12.322 5.735 -0.736 1.00 0.00 H new ATOM 0 HE2 MET A 38 12.703 4.793 0.725 1.00 0.00 H new ATOM 0 HE3 MET A 38 11.019 4.925 0.165 1.00 0.00 H new ATOM 611 N PHE A 39 8.197 10.717 1.620 1.00 0.00 N ATOM 612 CA PHE A 39 7.239 11.678 1.085 1.00 0.00 C ATOM 613 C PHE A 39 7.629 12.118 -0.322 1.00 0.00 C ATOM 614 O PHE A 39 8.686 11.743 -0.829 1.00 0.00 O ATOM 615 CB PHE A 39 7.136 12.890 2.014 1.00 0.00 C ATOM 616 CG PHE A 39 7.169 12.530 3.474 1.00 0.00 C ATOM 617 CD1 PHE A 39 8.372 12.484 4.162 1.00 0.00 C ATOM 618 CD2 PHE A 39 5.999 12.230 4.158 1.00 0.00 C ATOM 619 CE1 PHE A 39 8.407 12.148 5.503 1.00 0.00 C ATOM 620 CE2 PHE A 39 6.030 11.895 5.498 1.00 0.00 C ATOM 621 CZ PHE A 39 7.235 11.853 6.171 1.00 0.00 C ATOM 0 H PHE A 39 9.168 11.028 1.592 1.00 0.00 H new ATOM 0 HA PHE A 39 6.265 11.192 1.026 1.00 0.00 H new ATOM 0 HB2 PHE A 39 7.956 13.574 1.798 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.210 13.424 1.800 1.00 0.00 H new ATOM 0 HD1 PHE A 39 9.292 12.713 3.645 1.00 0.00 H new ATOM 0 HD2 PHE A 39 5.054 12.259 3.637 1.00 0.00 H new ATOM 0 HE1 PHE A 39 9.351 12.116 6.028 1.00 0.00 H new ATOM 0 HE2 PHE A 39 5.112 11.666 6.019 1.00 0.00 H new ATOM 0 HZ PHE A 39 7.261 11.590 7.218 1.00 0.00 H new ATOM 631 N ARG A 40 6.769 12.916 -0.949 1.00 0.00 N ATOM 632 CA ARG A 40 7.026 13.408 -2.299 1.00 0.00 C ATOM 633 C ARG A 40 7.242 12.249 -3.268 1.00 0.00 C ATOM 634 O ARG A 40 8.149 12.282 -4.099 1.00 0.00 O ATOM 635 CB ARG A 40 8.249 14.329 -2.304 1.00 0.00 C ATOM 636 CG ARG A 40 7.974 15.710 -1.731 1.00 0.00 C ATOM 637 CD ARG A 40 9.129 16.662 -1.995 1.00 0.00 C ATOM 638 NE ARG A 40 10.030 16.762 -0.849 1.00 0.00 N ATOM 639 CZ ARG A 40 11.034 17.632 -0.769 1.00 0.00 C ATOM 640 NH1 ARG A 40 11.271 18.478 -1.763 1.00 0.00 N ATOM 641 NH2 ARG A 40 11.805 17.656 0.310 1.00 0.00 N ATOM 0 H ARG A 40 5.889 13.235 -0.544 1.00 0.00 H new ATOM 0 HA ARG A 40 6.153 13.973 -2.626 1.00 0.00 H new ATOM 0 HB2 ARG A 40 9.049 13.860 -1.731 1.00 0.00 H new ATOM 0 HB3 ARG A 40 8.610 14.435 -3.327 1.00 0.00 H new ATOM 0 HG2 ARG A 40 7.061 16.113 -2.171 1.00 0.00 H new ATOM 0 HG3 ARG A 40 7.803 15.632 -0.657 1.00 0.00 H new ATOM 0 HD2 ARG A 40 9.688 16.321 -2.867 1.00 0.00 H new ATOM 0 HD3 ARG A 40 8.737 17.650 -2.235 1.00 0.00 H new ATOM 0 HE ARG A 40 9.881 16.128 -0.064 1.00 0.00 H new ATOM 0 HH11 ARG A 40 10.682 18.464 -2.596 1.00 0.00 H new ATOM 0 HH12 ARG A 40 12.042 19.142 -1.695 1.00 0.00 H new ATOM 0 HH21 ARG A 40 11.628 17.008 1.078 1.00 0.00 H new ATOM 0 HH22 ARG A 40 12.575 18.322 0.372 1.00 0.00 H new ATOM 655 N GLY A 41 6.406 11.224 -3.150 1.00 0.00 N ATOM 656 CA GLY A 41 6.525 10.068 -4.019 1.00 0.00 C ATOM 657 C GLY A 41 7.867 9.374 -3.880 1.00 0.00 C ATOM 658 O GLY A 41 8.275 8.615 -4.759 1.00 0.00 O ATOM 0 H GLY A 41 5.649 11.173 -2.469 1.00 0.00 H new ATOM 0 HA2 GLY A 41 5.728 9.361 -3.789 1.00 0.00 H new ATOM 0 HA3 GLY A 41 6.386 10.380 -5.054 1.00 0.00 H new ATOM 662 N SER A 42 8.554 9.634 -2.771 1.00 0.00 N ATOM 663 CA SER A 42 9.858 9.032 -2.518 1.00 0.00 C ATOM 664 C SER A 42 9.757 7.510 -2.480 1.00 0.00 C ATOM 665 O SER A 42 10.683 6.807 -2.885 1.00 0.00 O ATOM 666 CB SER A 42 10.434 9.549 -1.199 1.00 0.00 C ATOM 667 OG SER A 42 11.681 8.939 -0.912 1.00 0.00 O ATOM 0 H SER A 42 8.228 10.258 -2.033 1.00 0.00 H new ATOM 0 HA SER A 42 10.525 9.314 -3.333 1.00 0.00 H new ATOM 0 HB2 SER A 42 10.559 10.631 -1.252 1.00 0.00 H new ATOM 0 HB3 SER A 42 9.733 9.348 -0.389 1.00 0.00 H new ATOM 0 HG SER A 42 11.530 8.083 -0.459 1.00 0.00 H new ATOM 673 N LEU A 43 8.628 7.008 -1.989 1.00 0.00 N ATOM 674 CA LEU A 43 8.412 5.569 -1.898 1.00 0.00 C ATOM 675 C LEU A 43 8.363 4.938 -3.284 1.00 0.00 C ATOM 676 O LEU A 43 9.067 3.965 -3.558 1.00 0.00 O ATOM 677 CB LEU A 43 7.110 5.276 -1.148 1.00 0.00 C ATOM 678 CG LEU A 43 6.946 3.828 -0.681 1.00 0.00 C ATOM 679 CD1 LEU A 43 7.306 3.696 0.791 1.00 0.00 C ATOM 680 CD2 LEU A 43 5.524 3.345 -0.929 1.00 0.00 C ATOM 0 H LEU A 43 7.851 7.575 -1.649 1.00 0.00 H new ATOM 0 HA LEU A 43 9.248 5.135 -1.349 1.00 0.00 H new ATOM 0 HB2 LEU A 43 7.053 5.931 -0.279 1.00 0.00 H new ATOM 0 HB3 LEU A 43 6.270 5.531 -1.795 1.00 0.00 H new ATOM 0 HG LEU A 43 7.627 3.202 -1.258 1.00 0.00 H new ATOM 0 HD11 LEU A 43 7.183 2.659 1.104 1.00 0.00 H new ATOM 0 HD12 LEU A 43 8.342 4.000 0.941 1.00 0.00 H new ATOM 0 HD13 LEU A 43 6.651 4.334 1.384 1.00 0.00 H new ATOM 0 HD21 LEU A 43 5.426 2.313 -0.591 1.00 0.00 H new ATOM 0 HD22 LEU A 43 4.825 3.975 -0.379 1.00 0.00 H new ATOM 0 HD23 LEU A 43 5.302 3.400 -1.995 1.00 0.00 H new ATOM 692 N TYR A 44 7.530 5.494 -4.155 1.00 0.00 N ATOM 693 CA TYR A 44 7.392 4.981 -5.512 1.00 0.00 C ATOM 694 C TYR A 44 8.653 5.247 -6.327 1.00 0.00 C ATOM 695 O TYR A 44 9.059 4.421 -7.144 1.00 0.00 O ATOM 696 CB TYR A 44 6.178 5.612 -6.194 1.00 0.00 C ATOM 697 CG TYR A 44 4.878 5.324 -5.480 1.00 0.00 C ATOM 698 CD1 TYR A 44 3.986 6.344 -5.176 1.00 0.00 C ATOM 699 CD2 TYR A 44 4.547 4.028 -5.102 1.00 0.00 C ATOM 700 CE1 TYR A 44 2.800 6.081 -4.517 1.00 0.00 C ATOM 701 CE2 TYR A 44 3.363 3.756 -4.445 1.00 0.00 C ATOM 702 CZ TYR A 44 2.493 4.786 -4.154 1.00 0.00 C ATOM 703 OH TYR A 44 1.313 4.522 -3.498 1.00 0.00 O ATOM 0 H TYR A 44 6.940 6.300 -3.946 1.00 0.00 H new ATOM 0 HA TYR A 44 7.246 3.902 -5.455 1.00 0.00 H new ATOM 0 HB2 TYR A 44 6.322 6.691 -6.252 1.00 0.00 H new ATOM 0 HB3 TYR A 44 6.112 5.244 -7.218 1.00 0.00 H new ATOM 0 HD1 TYR A 44 4.223 7.359 -5.459 1.00 0.00 H new ATOM 0 HD2 TYR A 44 5.227 3.220 -5.326 1.00 0.00 H new ATOM 0 HE1 TYR A 44 2.117 6.885 -4.287 1.00 0.00 H new ATOM 0 HE2 TYR A 44 3.120 2.743 -4.161 1.00 0.00 H new ATOM 0 HH TYR A 44 1.139 5.228 -2.841 1.00 0.00 H new ATOM 713 N LYS A 45 9.274 6.398 -6.095 1.00 0.00 N ATOM 714 CA LYS A 45 10.495 6.759 -6.805 1.00 0.00 C ATOM 715 C LYS A 45 11.624 5.802 -6.437 1.00 0.00 C ATOM 716 O LYS A 45 12.476 5.480 -7.266 1.00 0.00 O ATOM 717 CB LYS A 45 10.898 8.200 -6.480 1.00 0.00 C ATOM 718 CG LYS A 45 10.677 9.167 -7.632 1.00 0.00 C ATOM 719 CD LYS A 45 11.775 9.050 -8.676 1.00 0.00 C ATOM 720 CE LYS A 45 12.999 9.865 -8.292 1.00 0.00 C ATOM 721 NZ LYS A 45 12.800 11.319 -8.543 1.00 0.00 N ATOM 0 H LYS A 45 8.953 7.095 -5.423 1.00 0.00 H new ATOM 0 HA LYS A 45 10.306 6.684 -7.876 1.00 0.00 H new ATOM 0 HB2 LYS A 45 10.329 8.542 -5.615 1.00 0.00 H new ATOM 0 HB3 LYS A 45 11.950 8.219 -6.197 1.00 0.00 H new ATOM 0 HG2 LYS A 45 9.711 8.968 -8.095 1.00 0.00 H new ATOM 0 HG3 LYS A 45 10.644 10.187 -7.250 1.00 0.00 H new ATOM 0 HD2 LYS A 45 12.056 8.003 -8.794 1.00 0.00 H new ATOM 0 HD3 LYS A 45 11.399 9.390 -9.641 1.00 0.00 H new ATOM 0 HE2 LYS A 45 13.224 9.706 -7.237 1.00 0.00 H new ATOM 0 HE3 LYS A 45 13.861 9.514 -8.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 13.694 11.825 -8.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 12.494 11.463 -9.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 12.073 11.686 -7.897 1.00 0.00 H new ATOM 735 N ARG A 46 11.618 5.348 -5.189 1.00 0.00 N ATOM 736 CA ARG A 46 12.634 4.422 -4.704 1.00 0.00 C ATOM 737 C ARG A 46 12.186 2.971 -4.879 1.00 0.00 C ATOM 738 O ARG A 46 12.993 2.048 -4.779 1.00 0.00 O ATOM 739 CB ARG A 46 12.941 4.696 -3.230 1.00 0.00 C ATOM 740 CG ARG A 46 14.172 3.965 -2.720 1.00 0.00 C ATOM 741 CD ARG A 46 14.940 4.804 -1.711 1.00 0.00 C ATOM 742 NE ARG A 46 16.236 4.215 -1.382 1.00 0.00 N ATOM 743 CZ ARG A 46 16.941 4.532 -0.298 1.00 0.00 C ATOM 744 NH1 ARG A 46 16.480 5.431 0.562 1.00 0.00 N ATOM 745 NH2 ARG A 46 18.110 3.948 -0.074 1.00 0.00 N ATOM 0 H ARG A 46 10.919 5.607 -4.493 1.00 0.00 H new ATOM 0 HA ARG A 46 13.537 4.576 -5.294 1.00 0.00 H new ATOM 0 HB2 ARG A 46 13.081 5.768 -3.090 1.00 0.00 H new ATOM 0 HB3 ARG A 46 12.080 4.405 -2.628 1.00 0.00 H new ATOM 0 HG2 ARG A 46 13.873 3.024 -2.259 1.00 0.00 H new ATOM 0 HG3 ARG A 46 14.823 3.717 -3.559 1.00 0.00 H new ATOM 0 HD2 ARG A 46 15.089 5.807 -2.112 1.00 0.00 H new ATOM 0 HD3 ARG A 46 14.348 4.909 -0.802 1.00 0.00 H new ATOM 0 HE ARG A 46 16.623 3.520 -2.020 1.00 0.00 H new ATOM 0 HH11 ARG A 46 15.581 5.883 0.394 1.00 0.00 H new ATOM 0 HH12 ARG A 46 17.024 5.670 1.391 1.00 0.00 H new ATOM 0 HH21 ARG A 46 18.469 3.256 -0.732 1.00 0.00 H new ATOM 0 HH22 ARG A 46 18.650 4.191 0.756 1.00 0.00 H new ATOM 759 N TYR A 47 10.895 2.777 -5.143 1.00 0.00 N ATOM 760 CA TYR A 47 10.347 1.439 -5.332 1.00 0.00 C ATOM 761 C TYR A 47 9.417 1.390 -6.548 1.00 0.00 C ATOM 762 O TYR A 47 8.235 1.068 -6.421 1.00 0.00 O ATOM 763 CB TYR A 47 9.580 1.004 -4.081 1.00 0.00 C ATOM 764 CG TYR A 47 10.458 0.761 -2.874 1.00 0.00 C ATOM 765 CD1 TYR A 47 11.003 -0.491 -2.635 1.00 0.00 C ATOM 766 CD2 TYR A 47 10.732 1.780 -1.972 1.00 0.00 C ATOM 767 CE1 TYR A 47 11.797 -0.727 -1.532 1.00 0.00 C ATOM 768 CE2 TYR A 47 11.529 1.556 -0.865 1.00 0.00 C ATOM 769 CZ TYR A 47 12.059 0.301 -0.648 1.00 0.00 C ATOM 770 OH TYR A 47 12.849 0.076 0.457 1.00 0.00 O ATOM 0 H TYR A 47 10.212 3.529 -5.230 1.00 0.00 H new ATOM 0 HA TYR A 47 11.179 0.756 -5.506 1.00 0.00 H new ATOM 0 HB2 TYR A 47 8.844 1.769 -3.834 1.00 0.00 H new ATOM 0 HB3 TYR A 47 9.028 0.091 -4.305 1.00 0.00 H new ATOM 0 HD1 TYR A 47 10.802 -1.297 -3.325 1.00 0.00 H new ATOM 0 HD2 TYR A 47 10.316 2.763 -2.138 1.00 0.00 H new ATOM 0 HE1 TYR A 47 12.211 -1.710 -1.361 1.00 0.00 H new ATOM 0 HE2 TYR A 47 11.736 2.359 -0.174 1.00 0.00 H new ATOM 0 HH TYR A 47 12.715 -0.842 0.773 1.00 0.00 H new ATOM 780 N PRO A 48 9.935 1.707 -7.750 1.00 0.00 N ATOM 781 CA PRO A 48 9.133 1.695 -8.980 1.00 0.00 C ATOM 782 C PRO A 48 8.595 0.307 -9.310 1.00 0.00 C ATOM 783 O PRO A 48 7.528 0.171 -9.910 1.00 0.00 O ATOM 784 CB PRO A 48 10.113 2.157 -10.066 1.00 0.00 C ATOM 785 CG PRO A 48 11.224 2.820 -9.327 1.00 0.00 C ATOM 786 CD PRO A 48 11.328 2.102 -8.013 1.00 0.00 C ATOM 0 HA PRO A 48 8.252 2.331 -8.888 1.00 0.00 H new ATOM 0 HB2 PRO A 48 10.477 1.314 -10.653 1.00 0.00 H new ATOM 0 HB3 PRO A 48 9.635 2.847 -10.761 1.00 0.00 H new ATOM 0 HG2 PRO A 48 12.159 2.753 -9.884 1.00 0.00 H new ATOM 0 HG3 PRO A 48 11.017 3.880 -9.178 1.00 0.00 H new ATOM 0 HD2 PRO A 48 11.989 1.238 -8.075 1.00 0.00 H new ATOM 0 HD3 PRO A 48 11.721 2.748 -7.228 1.00 0.00 H new ATOM 794 N SER A 49 9.338 -0.722 -8.916 1.00 0.00 N ATOM 795 CA SER A 49 8.933 -2.099 -9.173 1.00 0.00 C ATOM 796 C SER A 49 7.756 -2.504 -8.288 1.00 0.00 C ATOM 797 O SER A 49 7.095 -3.510 -8.544 1.00 0.00 O ATOM 798 CB SER A 49 10.110 -3.046 -8.939 1.00 0.00 C ATOM 799 OG SER A 49 9.669 -4.386 -8.796 1.00 0.00 O ATOM 0 H SER A 49 10.223 -0.628 -8.418 1.00 0.00 H new ATOM 0 HA SER A 49 8.616 -2.167 -10.214 1.00 0.00 H new ATOM 0 HB2 SER A 49 10.807 -2.977 -9.774 1.00 0.00 H new ATOM 0 HB3 SER A 49 10.653 -2.742 -8.044 1.00 0.00 H new ATOM 0 HG SER A 49 10.276 -4.868 -8.196 1.00 0.00 H new ATOM 805 N LEU A 50 7.502 -1.720 -7.244 1.00 0.00 N ATOM 806 CA LEU A 50 6.408 -2.005 -6.324 1.00 0.00 C ATOM 807 C LEU A 50 5.056 -1.835 -7.008 1.00 0.00 C ATOM 808 O LEU A 50 4.831 -0.864 -7.730 1.00 0.00 O ATOM 809 CB LEU A 50 6.499 -1.086 -5.106 1.00 0.00 C ATOM 810 CG LEU A 50 6.169 -1.743 -3.767 1.00 0.00 C ATOM 811 CD1 LEU A 50 7.252 -2.737 -3.382 1.00 0.00 C ATOM 812 CD2 LEU A 50 6.005 -0.687 -2.687 1.00 0.00 C ATOM 0 H LEU A 50 8.039 -0.884 -7.015 1.00 0.00 H new ATOM 0 HA LEU A 50 6.496 -3.042 -6.001 1.00 0.00 H new ATOM 0 HB2 LEU A 50 7.509 -0.679 -5.053 1.00 0.00 H new ATOM 0 HB3 LEU A 50 5.823 -0.244 -5.255 1.00 0.00 H new ATOM 0 HG LEU A 50 5.228 -2.283 -3.868 1.00 0.00 H new ATOM 0 HD11 LEU A 50 7.001 -3.196 -2.426 1.00 0.00 H new ATOM 0 HD12 LEU A 50 7.325 -3.510 -4.147 1.00 0.00 H new ATOM 0 HD13 LEU A 50 8.207 -2.219 -3.297 1.00 0.00 H new ATOM 0 HD21 LEU A 50 5.770 -1.170 -1.739 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.932 -0.122 -2.587 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.195 -0.010 -2.960 1.00 0.00 H new ATOM 824 N TRP A 51 4.159 -2.785 -6.771 1.00 0.00 N ATOM 825 CA TRP A 51 2.825 -2.744 -7.359 1.00 0.00 C ATOM 826 C TRP A 51 1.983 -1.644 -6.719 1.00 0.00 C ATOM 827 O TRP A 51 1.735 -1.664 -5.514 1.00 0.00 O ATOM 828 CB TRP A 51 2.124 -4.093 -7.179 1.00 0.00 C ATOM 829 CG TRP A 51 0.752 -4.134 -7.788 1.00 0.00 C ATOM 830 CD1 TRP A 51 0.407 -4.631 -9.011 1.00 0.00 C ATOM 831 CD2 TRP A 51 -0.459 -3.657 -7.196 1.00 0.00 C ATOM 832 NE1 TRP A 51 -0.944 -4.481 -9.218 1.00 0.00 N ATOM 833 CE2 TRP A 51 -1.496 -3.887 -8.116 1.00 0.00 C ATOM 834 CE3 TRP A 51 -0.764 -3.054 -5.976 1.00 0.00 C ATOM 835 CZ2 TRP A 51 -2.817 -3.533 -7.852 1.00 0.00 C ATOM 836 CZ3 TRP A 51 -2.070 -2.705 -5.713 1.00 0.00 C ATOM 837 CH2 TRP A 51 -3.084 -2.944 -6.646 1.00 0.00 C ATOM 0 H TRP A 51 4.331 -3.594 -6.175 1.00 0.00 H new ATOM 0 HA TRP A 51 2.932 -2.531 -8.423 1.00 0.00 H new ATOM 0 HB2 TRP A 51 2.736 -4.876 -7.627 1.00 0.00 H new ATOM 0 HB3 TRP A 51 2.049 -4.317 -6.115 1.00 0.00 H new ATOM 0 HD1 TRP A 51 1.095 -5.077 -9.714 1.00 0.00 H new ATOM 0 HE1 TRP A 51 -1.451 -4.766 -10.056 1.00 0.00 H new ATOM 0 HE3 TRP A 51 0.012 -2.864 -5.249 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 -3.601 -3.716 -8.572 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 -2.315 -2.239 -4.770 1.00 0.00 H new ATOM 0 HH2 TRP A 51 -4.098 -2.658 -6.410 1.00 0.00 H new ATOM 848 N ARG A 52 1.541 -0.690 -7.530 1.00 0.00 N ATOM 849 CA ARG A 52 0.718 0.408 -7.037 1.00 0.00 C ATOM 850 C ARG A 52 -0.396 0.734 -8.026 1.00 0.00 C ATOM 851 O ARG A 52 -0.170 0.760 -9.237 1.00 0.00 O ATOM 852 CB ARG A 52 1.577 1.649 -6.790 1.00 0.00 C ATOM 853 CG ARG A 52 2.399 2.071 -7.998 1.00 0.00 C ATOM 854 CD ARG A 52 2.804 3.534 -7.913 1.00 0.00 C ATOM 855 NE ARG A 52 1.915 4.395 -8.688 1.00 0.00 N ATOM 856 CZ ARG A 52 1.951 4.494 -10.016 1.00 0.00 C ATOM 857 NH1 ARG A 52 2.828 3.787 -10.718 1.00 0.00 N ATOM 858 NH2 ARG A 52 1.107 5.302 -10.643 1.00 0.00 N ATOM 0 H ARG A 52 1.738 -0.654 -8.530 1.00 0.00 H new ATOM 0 HA ARG A 52 0.266 0.097 -6.095 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.930 2.475 -6.494 1.00 0.00 H new ATOM 0 HB3 ARG A 52 2.249 1.455 -5.954 1.00 0.00 H new ATOM 0 HG2 ARG A 52 3.291 1.449 -8.067 1.00 0.00 H new ATOM 0 HG3 ARG A 52 1.822 1.904 -8.908 1.00 0.00 H new ATOM 0 HD2 ARG A 52 2.798 3.852 -6.870 1.00 0.00 H new ATOM 0 HD3 ARG A 52 3.826 3.649 -8.275 1.00 0.00 H new ATOM 0 HE ARG A 52 1.226 4.953 -8.183 1.00 0.00 H new ATOM 0 HH11 ARG A 52 3.479 3.164 -10.241 1.00 0.00 H new ATOM 0 HH12 ARG A 52 2.851 3.867 -11.735 1.00 0.00 H new ATOM 0 HH21 ARG A 52 0.431 5.847 -10.109 1.00 0.00 H new ATOM 0 HH22 ARG A 52 1.134 5.378 -11.660 1.00 0.00 H new ATOM 872 N ARG A 53 -1.595 0.994 -7.512 1.00 0.00 N ATOM 873 CA ARG A 53 -2.726 1.327 -8.373 1.00 0.00 C ATOM 874 C ARG A 53 -3.763 2.173 -7.631 1.00 0.00 C ATOM 875 O ARG A 53 -3.792 2.200 -6.401 1.00 0.00 O ATOM 876 CB ARG A 53 -3.358 0.050 -8.951 1.00 0.00 C ATOM 877 CG ARG A 53 -4.500 -0.531 -8.129 1.00 0.00 C ATOM 878 CD ARG A 53 -5.847 -0.283 -8.786 1.00 0.00 C ATOM 879 NE ARG A 53 -6.693 -1.474 -8.760 1.00 0.00 N ATOM 880 CZ ARG A 53 -8.014 -1.450 -8.919 1.00 0.00 C ATOM 881 NH1 ARG A 53 -8.646 -0.299 -9.114 1.00 0.00 N ATOM 882 NH2 ARG A 53 -8.707 -2.581 -8.884 1.00 0.00 N ATOM 0 H ARG A 53 -1.808 0.981 -6.514 1.00 0.00 H new ATOM 0 HA ARG A 53 -2.353 1.928 -9.203 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -3.726 0.266 -9.954 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -2.581 -0.708 -9.053 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -4.349 -1.603 -8.002 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -4.494 -0.088 -7.133 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -6.355 0.535 -8.275 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -5.695 0.032 -9.818 1.00 0.00 H new ATOM 0 HE ARG A 53 -6.244 -2.378 -8.611 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -8.119 0.574 -9.143 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -9.659 -0.287 -9.235 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -8.227 -3.469 -8.735 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -9.720 -2.563 -9.006 1.00 0.00 H new ATOM 896 N LEU A 54 -4.605 2.866 -8.394 1.00 0.00 N ATOM 897 CA LEU A 54 -5.640 3.719 -7.819 1.00 0.00 C ATOM 898 C LEU A 54 -6.970 2.978 -7.719 1.00 0.00 C ATOM 899 O LEU A 54 -7.423 2.362 -8.684 1.00 0.00 O ATOM 900 CB LEU A 54 -5.809 4.980 -8.667 1.00 0.00 C ATOM 901 CG LEU A 54 -4.840 6.114 -8.340 1.00 0.00 C ATOM 902 CD1 LEU A 54 -3.991 6.464 -9.554 1.00 0.00 C ATOM 903 CD2 LEU A 54 -5.592 7.339 -7.842 1.00 0.00 C ATOM 0 H LEU A 54 -4.590 2.853 -9.414 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.329 3.999 -6.812 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -5.690 4.712 -9.717 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.828 5.347 -8.546 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.176 5.774 -7.545 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.308 7.274 -9.299 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -3.418 5.589 -9.862 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.639 6.780 -10.372 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -4.882 8.134 -7.615 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -6.284 7.679 -8.612 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -6.149 7.082 -6.941 1.00 0.00 H new ATOM 915 N ALA A 55 -7.590 3.043 -6.545 1.00 0.00 N ATOM 916 CA ALA A 55 -8.867 2.376 -6.316 1.00 0.00 C ATOM 917 C ALA A 55 -10.039 3.225 -6.803 1.00 0.00 C ATOM 918 O ALA A 55 -10.014 4.452 -6.712 1.00 0.00 O ATOM 919 CB ALA A 55 -9.033 2.052 -4.838 1.00 0.00 C ATOM 0 H ALA A 55 -7.229 3.551 -5.737 1.00 0.00 H new ATOM 0 HA ALA A 55 -8.866 1.449 -6.889 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -9.990 1.554 -4.680 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -8.225 1.395 -4.517 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -9.003 2.974 -4.258 1.00 0.00 H new ATOM 925 N THR A 56 -11.071 2.553 -7.305 1.00 0.00 N ATOM 926 CA THR A 56 -12.266 3.230 -7.794 1.00 0.00 C ATOM 927 C THR A 56 -13.073 3.783 -6.627 1.00 0.00 C ATOM 928 O THR A 56 -12.774 3.497 -5.472 1.00 0.00 O ATOM 929 CB THR A 56 -13.129 2.262 -8.606 1.00 0.00 C ATOM 930 OG1 THR A 56 -13.826 1.376 -7.745 1.00 0.00 O ATOM 931 CG2 THR A 56 -12.333 1.424 -9.583 1.00 0.00 C ATOM 0 H THR A 56 -11.103 1.537 -7.384 1.00 0.00 H new ATOM 0 HA THR A 56 -11.958 4.055 -8.436 1.00 0.00 H new ATOM 0 HB THR A 56 -13.817 2.890 -9.172 1.00 0.00 H new ATOM 0 HG1 THR A 56 -14.374 0.764 -8.279 1.00 0.00 H new ATOM 0 HG21 THR A 56 -13.006 0.760 -10.125 1.00 0.00 H new ATOM 0 HG22 THR A 56 -11.820 2.077 -10.289 1.00 0.00 H new ATOM 0 HG23 THR A 56 -11.598 0.830 -9.039 1.00 0.00 H new ATOM 939 N VAL A 57 -14.098 4.572 -6.927 1.00 0.00 N ATOM 940 CA VAL A 57 -14.937 5.145 -5.881 1.00 0.00 C ATOM 941 C VAL A 57 -15.587 4.043 -5.048 1.00 0.00 C ATOM 942 O VAL A 57 -15.729 4.168 -3.830 1.00 0.00 O ATOM 943 CB VAL A 57 -16.035 6.051 -6.467 1.00 0.00 C ATOM 944 CG1 VAL A 57 -16.784 6.773 -5.358 1.00 0.00 C ATOM 945 CG2 VAL A 57 -15.437 7.046 -7.451 1.00 0.00 C ATOM 0 H VAL A 57 -14.367 4.828 -7.877 1.00 0.00 H new ATOM 0 HA VAL A 57 -14.289 5.750 -5.246 1.00 0.00 H new ATOM 0 HB VAL A 57 -16.747 5.424 -7.005 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -17.555 7.408 -5.794 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -17.247 6.042 -4.696 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -16.087 7.388 -4.789 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -16.228 7.678 -7.855 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -14.702 7.667 -6.939 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -14.952 6.506 -8.265 1.00 0.00 H new ATOM 955 N GLU A 58 -15.970 2.958 -5.711 1.00 0.00 N ATOM 956 CA GLU A 58 -16.590 1.829 -5.030 1.00 0.00 C ATOM 957 C GLU A 58 -15.565 1.104 -4.164 1.00 0.00 C ATOM 958 O GLU A 58 -15.798 0.857 -2.979 1.00 0.00 O ATOM 959 CB GLU A 58 -17.196 0.860 -6.047 1.00 0.00 C ATOM 960 CG GLU A 58 -18.414 1.415 -6.767 1.00 0.00 C ATOM 961 CD GLU A 58 -19.466 0.357 -7.034 1.00 0.00 C ATOM 962 OE1 GLU A 58 -19.186 -0.574 -7.818 1.00 0.00 O ATOM 963 OE2 GLU A 58 -20.569 0.458 -6.457 1.00 0.00 O ATOM 0 H GLU A 58 -15.862 2.837 -6.718 1.00 0.00 H new ATOM 0 HA GLU A 58 -17.386 2.208 -4.389 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -16.437 0.599 -6.784 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -17.475 -0.062 -5.536 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -18.852 2.215 -6.169 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -18.102 1.858 -7.713 1.00 0.00 H new ATOM 970 N GLU A 59 -14.428 0.768 -4.765 1.00 0.00 N ATOM 971 CA GLU A 59 -13.363 0.074 -4.053 1.00 0.00 C ATOM 972 C GLU A 59 -12.864 0.902 -2.873 1.00 0.00 C ATOM 973 O GLU A 59 -12.708 0.389 -1.766 1.00 0.00 O ATOM 974 CB GLU A 59 -12.202 -0.231 -5.003 1.00 0.00 C ATOM 975 CG GLU A 59 -12.500 -1.351 -5.986 1.00 0.00 C ATOM 976 CD GLU A 59 -11.996 -1.048 -7.384 1.00 0.00 C ATOM 977 OE1 GLU A 59 -11.037 -0.258 -7.511 1.00 0.00 O ATOM 978 OE2 GLU A 59 -12.560 -1.601 -8.351 1.00 0.00 O ATOM 0 H GLU A 59 -14.221 0.966 -5.744 1.00 0.00 H new ATOM 0 HA GLU A 59 -13.768 -0.862 -3.670 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -11.951 0.672 -5.559 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -11.323 -0.498 -4.416 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -12.041 -2.274 -5.630 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -13.576 -1.523 -6.021 1.00 0.00 H new ATOM 985 N ARG A 60 -12.619 2.186 -3.116 1.00 0.00 N ATOM 986 CA ARG A 60 -12.139 3.084 -2.073 1.00 0.00 C ATOM 987 C ARG A 60 -13.148 3.166 -0.935 1.00 0.00 C ATOM 988 O ARG A 60 -12.774 3.136 0.237 1.00 0.00 O ATOM 989 CB ARG A 60 -11.850 4.475 -2.649 1.00 0.00 C ATOM 990 CG ARG A 60 -13.092 5.297 -2.945 1.00 0.00 C ATOM 991 CD ARG A 60 -12.732 6.646 -3.546 1.00 0.00 C ATOM 992 NE ARG A 60 -12.145 6.511 -4.877 1.00 0.00 N ATOM 993 CZ ARG A 60 -12.096 7.496 -5.771 1.00 0.00 C ATOM 994 NH1 ARG A 60 -12.595 8.692 -5.481 1.00 0.00 N ATOM 995 NH2 ARG A 60 -11.547 7.286 -6.960 1.00 0.00 N ATOM 0 H ARG A 60 -12.745 2.627 -4.027 1.00 0.00 H new ATOM 0 HA ARG A 60 -11.207 2.684 -1.674 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -11.224 5.024 -1.946 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -11.275 4.363 -3.568 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -13.737 4.750 -3.633 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -13.660 5.446 -2.026 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -13.626 7.267 -3.605 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -12.029 7.160 -2.890 1.00 0.00 H new ATOM 0 HE ARG A 60 -11.749 5.608 -5.137 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -13.019 8.860 -4.569 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -12.554 9.442 -6.171 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -11.162 6.370 -7.189 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -11.510 8.041 -7.645 1.00 0.00 H new ATOM 1009 N LYS A 61 -14.431 3.244 -1.280 1.00 0.00 N ATOM 1010 CA LYS A 61 -15.475 3.296 -0.266 1.00 0.00 C ATOM 1011 C LYS A 61 -15.378 2.059 0.619 1.00 0.00 C ATOM 1012 O LYS A 61 -15.486 2.143 1.842 1.00 0.00 O ATOM 1013 CB LYS A 61 -16.858 3.375 -0.921 1.00 0.00 C ATOM 1014 CG LYS A 61 -17.499 4.749 -0.825 1.00 0.00 C ATOM 1015 CD LYS A 61 -18.356 5.052 -2.043 1.00 0.00 C ATOM 1016 CE LYS A 61 -19.817 4.716 -1.793 1.00 0.00 C ATOM 1017 NZ LYS A 61 -20.506 4.273 -3.037 1.00 0.00 N ATOM 0 H LYS A 61 -14.768 3.272 -2.242 1.00 0.00 H new ATOM 0 HA LYS A 61 -15.338 4.189 0.344 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -16.770 3.097 -1.971 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -17.515 2.643 -0.452 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -18.112 4.803 0.075 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -16.722 5.508 -0.728 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -18.263 6.107 -2.301 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -17.991 4.481 -2.897 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -19.885 3.930 -1.041 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -20.326 5.590 -1.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -21.500 4.053 -2.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -20.464 5.032 -3.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -20.036 3.424 -3.410 1.00 0.00 H new ATOM 1031 N LYS A 62 -15.144 0.915 -0.018 1.00 0.00 N ATOM 1032 CA LYS A 62 -14.996 -0.344 0.698 1.00 0.00 C ATOM 1033 C LYS A 62 -13.712 -0.332 1.521 1.00 0.00 C ATOM 1034 O LYS A 62 -13.655 -0.896 2.614 1.00 0.00 O ATOM 1035 CB LYS A 62 -14.981 -1.518 -0.282 1.00 0.00 C ATOM 1036 CG LYS A 62 -16.345 -1.825 -0.883 1.00 0.00 C ATOM 1037 CD LYS A 62 -16.262 -2.039 -2.388 1.00 0.00 C ATOM 1038 CE LYS A 62 -16.460 -3.501 -2.759 1.00 0.00 C ATOM 1039 NZ LYS A 62 -17.733 -3.719 -3.499 1.00 0.00 N ATOM 0 H LYS A 62 -15.053 0.836 -1.031 1.00 0.00 H new ATOM 0 HA LYS A 62 -15.846 -0.463 1.370 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -14.279 -1.300 -1.087 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -14.611 -2.405 0.232 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -16.758 -2.716 -0.411 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -17.030 -1.004 -0.669 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -17.019 -1.432 -2.884 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -15.292 -1.699 -2.751 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -15.623 -3.837 -3.371 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -16.458 -4.109 -1.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -17.830 -4.728 -3.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -18.534 -3.423 -2.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -17.725 -3.159 -4.376 1.00 0.00 H new ATOM 1053 N ILE A 63 -12.680 0.321 0.986 1.00 0.00 N ATOM 1054 CA ILE A 63 -11.395 0.415 1.669 1.00 0.00 C ATOM 1055 C ILE A 63 -11.556 1.097 3.024 1.00 0.00 C ATOM 1056 O ILE A 63 -10.976 0.670 4.019 1.00 0.00 O ATOM 1057 CB ILE A 63 -10.359 1.192 0.823 1.00 0.00 C ATOM 1058 CG1 ILE A 63 -9.937 0.363 -0.390 1.00 0.00 C ATOM 1059 CG2 ILE A 63 -9.138 1.560 1.660 1.00 0.00 C ATOM 1060 CD1 ILE A 63 -9.244 1.173 -1.463 1.00 0.00 C ATOM 0 H ILE A 63 -12.712 0.792 0.082 1.00 0.00 H new ATOM 0 HA ILE A 63 -11.031 -0.602 1.815 1.00 0.00 H new ATOM 0 HB ILE A 63 -10.826 2.114 0.476 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -9.271 -0.435 -0.061 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -10.818 -0.114 -0.818 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -8.425 2.106 1.042 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -9.446 2.186 2.497 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -8.670 0.652 2.039 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -8.973 0.521 -2.293 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -9.915 1.954 -1.820 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -8.344 1.629 -1.051 1.00 0.00 H new ATOM 1072 N VAL A 64 -12.349 2.161 3.051 1.00 0.00 N ATOM 1073 CA VAL A 64 -12.587 2.904 4.280 1.00 0.00 C ATOM 1074 C VAL A 64 -13.209 2.015 5.354 1.00 0.00 C ATOM 1075 O VAL A 64 -12.745 1.986 6.494 1.00 0.00 O ATOM 1076 CB VAL A 64 -13.511 4.112 4.026 1.00 0.00 C ATOM 1077 CG1 VAL A 64 -13.676 4.939 5.294 1.00 0.00 C ATOM 1078 CG2 VAL A 64 -12.972 4.967 2.887 1.00 0.00 C ATOM 0 H VAL A 64 -12.838 2.528 2.235 1.00 0.00 H new ATOM 0 HA VAL A 64 -11.618 3.259 4.631 1.00 0.00 H new ATOM 0 HB VAL A 64 -14.493 3.739 3.736 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -14.332 5.786 5.093 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -14.113 4.320 6.078 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -12.702 5.303 5.620 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -13.637 5.815 2.722 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -11.977 5.331 3.144 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -12.915 4.368 1.978 1.00 0.00 H new ATOM 1088 N ALA A 65 -14.264 1.299 4.984 1.00 0.00 N ATOM 1089 CA ALA A 65 -14.959 0.417 5.915 1.00 0.00 C ATOM 1090 C ALA A 65 -14.147 -0.838 6.233 1.00 0.00 C ATOM 1091 O ALA A 65 -14.056 -1.250 7.390 1.00 0.00 O ATOM 1092 CB ALA A 65 -16.318 0.032 5.353 1.00 0.00 C ATOM 0 H ALA A 65 -14.658 1.312 4.043 1.00 0.00 H new ATOM 0 HA ALA A 65 -15.092 0.965 6.848 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -16.829 -0.627 6.055 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -16.915 0.930 5.198 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -16.186 -0.484 4.402 1.00 0.00 H new ATOM 1098 N SER A 66 -13.578 -1.455 5.202 1.00 0.00 N ATOM 1099 CA SER A 66 -12.798 -2.679 5.375 1.00 0.00 C ATOM 1100 C SER A 66 -11.436 -2.408 6.010 1.00 0.00 C ATOM 1101 O SER A 66 -11.060 -3.056 6.986 1.00 0.00 O ATOM 1102 CB SER A 66 -12.610 -3.377 4.028 1.00 0.00 C ATOM 1103 OG SER A 66 -13.774 -4.093 3.657 1.00 0.00 O ATOM 0 H SER A 66 -13.642 -1.129 4.238 1.00 0.00 H new ATOM 0 HA SER A 66 -13.356 -3.326 6.052 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.374 -2.638 3.262 1.00 0.00 H new ATOM 0 HB3 SER A 66 -11.762 -4.060 4.084 1.00 0.00 H new ATOM 0 HG SER A 66 -13.628 -4.529 2.791 1.00 0.00 H new ATOM 1109 N SER A 67 -10.693 -1.462 5.446 1.00 0.00 N ATOM 1110 CA SER A 67 -9.367 -1.131 5.959 1.00 0.00 C ATOM 1111 C SER A 67 -9.449 -0.425 7.308 1.00 0.00 C ATOM 1112 O SER A 67 -8.712 -0.757 8.237 1.00 0.00 O ATOM 1113 CB SER A 67 -8.614 -0.250 4.961 1.00 0.00 C ATOM 1114 OG SER A 67 -7.224 -0.239 5.238 1.00 0.00 O ATOM 0 H SER A 67 -10.984 -0.913 4.637 1.00 0.00 H new ATOM 0 HA SER A 67 -8.826 -2.067 6.096 1.00 0.00 H new ATOM 0 HB2 SER A 67 -8.783 -0.616 3.948 1.00 0.00 H new ATOM 0 HB3 SER A 67 -9.004 0.767 5.002 1.00 0.00 H new ATOM 0 HG SER A 67 -6.872 -1.152 5.180 1.00 0.00 H new ATOM 1120 N HIS A 68 -10.338 0.555 7.410 1.00 0.00 N ATOM 1121 CA HIS A 68 -10.498 1.310 8.647 1.00 0.00 C ATOM 1122 C HIS A 68 -11.805 0.964 9.344 1.00 0.00 C ATOM 1123 O HIS A 68 -12.858 0.874 8.711 1.00 0.00 O ATOM 1124 CB HIS A 68 -10.436 2.809 8.356 1.00 0.00 C ATOM 1125 CG HIS A 68 -9.201 3.203 7.613 1.00 0.00 C ATOM 1126 ND1 HIS A 68 -9.217 3.967 6.466 1.00 0.00 N ATOM 1127 CD2 HIS A 68 -7.902 2.917 7.856 1.00 0.00 C ATOM 1128 CE1 HIS A 68 -7.980 4.133 6.033 1.00 0.00 C ATOM 1129 NE2 HIS A 68 -7.163 3.507 6.860 1.00 0.00 N ATOM 0 H HIS A 68 -10.958 0.845 6.654 1.00 0.00 H new ATOM 0 HA HIS A 68 -9.681 1.039 9.316 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -11.312 3.098 7.775 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -10.480 3.359 9.296 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -10.053 4.345 6.021 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -7.517 2.334 8.679 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -7.687 4.686 5.153 1.00 0.00 H new ATOM 1138 N GLY A 69 -11.731 0.771 10.656 1.00 0.00 N ATOM 1139 CA GLY A 69 -12.913 0.438 11.422 1.00 0.00 C ATOM 1140 C GLY A 69 -12.585 -0.048 12.821 1.00 0.00 C ATOM 1141 O GLY A 69 -13.228 0.354 13.791 1.00 0.00 O ATOM 0 H GLY A 69 -10.872 0.840 11.201 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -13.557 1.315 11.488 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -13.476 -0.333 10.897 1.00 0.00 H new ATOM 1145 N LYS A 70 -11.581 -0.912 12.925 1.00 0.00 N ATOM 1146 CA LYS A 70 -11.169 -1.453 14.217 1.00 0.00 C ATOM 1147 C LYS A 70 -9.793 -2.107 14.123 1.00 0.00 C ATOM 1148 O LYS A 70 -9.595 -3.056 13.364 1.00 0.00 O ATOM 1149 CB LYS A 70 -12.197 -2.466 14.744 1.00 0.00 C ATOM 1150 CG LYS A 70 -13.108 -3.045 13.672 1.00 0.00 C ATOM 1151 CD LYS A 70 -12.314 -3.740 12.579 1.00 0.00 C ATOM 1152 CE LYS A 70 -11.776 -5.083 13.047 1.00 0.00 C ATOM 1153 NZ LYS A 70 -11.276 -5.907 11.913 1.00 0.00 N ATOM 0 H LYS A 70 -11.038 -1.253 12.132 1.00 0.00 H new ATOM 0 HA LYS A 70 -11.111 -0.620 14.918 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -11.667 -3.283 15.235 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -12.811 -1.982 15.504 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -13.800 -3.754 14.126 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -13.709 -2.248 13.235 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -12.948 -3.886 11.704 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -11.485 -3.103 12.269 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -10.969 -4.922 13.762 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -12.562 -5.626 13.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -10.602 -6.614 12.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -12.076 -6.390 11.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -10.801 -5.293 11.221 1.00 0.00 H new ATOM 1167 N LYS A 71 -8.845 -1.593 14.900 1.00 0.00 N ATOM 1168 CA LYS A 71 -7.487 -2.128 14.903 1.00 0.00 C ATOM 1169 C LYS A 71 -6.838 -1.966 16.273 1.00 0.00 C ATOM 1170 O LYS A 71 -6.228 -2.898 16.797 1.00 0.00 O ATOM 1171 CB LYS A 71 -6.640 -1.433 13.837 1.00 0.00 C ATOM 1172 CG LYS A 71 -7.011 -1.826 12.417 1.00 0.00 C ATOM 1173 CD LYS A 71 -6.547 -3.236 12.090 1.00 0.00 C ATOM 1174 CE LYS A 71 -7.114 -3.715 10.763 1.00 0.00 C ATOM 1175 NZ LYS A 71 -8.459 -4.334 10.923 1.00 0.00 N ATOM 0 H LYS A 71 -8.991 -0.808 15.535 1.00 0.00 H new ATOM 0 HA LYS A 71 -7.544 -3.192 14.674 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -6.746 -0.354 13.946 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -5.590 -1.669 14.008 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -8.092 -1.759 12.290 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -6.563 -1.123 11.715 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -5.458 -3.262 12.052 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -6.855 -3.915 12.885 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -7.181 -2.874 10.073 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -6.432 -4.439 10.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -9.043 -4.114 10.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -8.358 -5.365 11.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -8.916 -3.955 11.777 1.00 0.00 H new ATOM 1189 N THR A 72 -6.971 -0.777 16.845 1.00 0.00 N ATOM 1190 CA THR A 72 -6.398 -0.488 18.155 1.00 0.00 C ATOM 1191 C THR A 72 -7.154 -1.224 19.256 1.00 0.00 C ATOM 1192 O THR A 72 -8.152 -1.896 18.995 1.00 0.00 O ATOM 1193 CB THR A 72 -6.420 1.017 18.424 1.00 0.00 C ATOM 1194 OG1 THR A 72 -6.350 1.746 17.211 1.00 0.00 O ATOM 1195 CG2 THR A 72 -5.281 1.484 19.305 1.00 0.00 C ATOM 0 H THR A 72 -7.471 0.005 16.423 1.00 0.00 H new ATOM 0 HA THR A 72 -5.365 -0.835 18.155 1.00 0.00 H new ATOM 0 HB THR A 72 -7.361 1.203 18.943 1.00 0.00 H new ATOM 0 HG1 THR A 72 -7.256 1.923 16.883 1.00 0.00 H new ATOM 0 HG21 THR A 72 -5.356 2.561 19.456 1.00 0.00 H new ATOM 0 HG22 THR A 72 -5.335 0.978 20.269 1.00 0.00 H new ATOM 0 HG23 THR A 72 -4.331 1.250 18.825 1.00 0.00 H new ATOM 1203 N LYS A 73 -6.672 -1.092 20.488 1.00 0.00 N ATOM 1204 CA LYS A 73 -7.302 -1.744 21.629 1.00 0.00 C ATOM 1205 C LYS A 73 -8.697 -1.173 21.882 1.00 0.00 C ATOM 1206 O LYS A 73 -8.948 0.006 21.632 1.00 0.00 O ATOM 1207 CB LYS A 73 -6.437 -1.578 22.881 1.00 0.00 C ATOM 1208 CG LYS A 73 -6.152 -0.127 23.236 1.00 0.00 C ATOM 1209 CD LYS A 73 -5.442 -0.011 24.574 1.00 0.00 C ATOM 1210 CE LYS A 73 -5.013 1.420 24.855 1.00 0.00 C ATOM 1211 NZ LYS A 73 -3.579 1.645 24.521 1.00 0.00 N ATOM 0 H LYS A 73 -5.847 -0.539 20.721 1.00 0.00 H new ATOM 0 HA LYS A 73 -7.399 -2.805 21.400 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -6.935 -2.058 23.723 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -5.491 -2.099 22.731 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -5.539 0.326 22.457 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -7.088 0.431 23.270 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -6.103 -0.357 25.369 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -4.568 -0.662 24.581 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -5.632 2.105 24.276 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -5.181 1.650 25.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -3.325 2.632 24.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -2.986 1.009 25.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -3.423 1.451 23.511 1.00 0.00 H new ATOM 1225 N PRO A 74 -9.625 -2.007 22.381 1.00 0.00 N ATOM 1226 CA PRO A 74 -10.997 -1.579 22.665 1.00 0.00 C ATOM 1227 C PRO A 74 -11.093 -0.751 23.943 1.00 0.00 C ATOM 1228 O PRO A 74 -11.801 -1.118 24.882 1.00 0.00 O ATOM 1229 CB PRO A 74 -11.745 -2.901 22.825 1.00 0.00 C ATOM 1230 CG PRO A 74 -10.717 -3.855 23.327 1.00 0.00 C ATOM 1231 CD PRO A 74 -9.411 -3.430 22.707 1.00 0.00 C ATOM 0 HA PRO A 74 -11.399 -0.936 21.882 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -12.574 -2.805 23.527 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -12.167 -3.235 21.877 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -10.659 -3.827 24.415 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -10.966 -4.879 23.047 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -8.578 -3.562 23.398 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -9.182 -4.015 21.816 1.00 0.00 H new ATOM 1239 N ASN A 75 -10.375 0.368 23.974 1.00 0.00 N ATOM 1240 CA ASN A 75 -10.379 1.247 25.136 1.00 0.00 C ATOM 1241 C ASN A 75 -11.140 2.536 24.840 1.00 0.00 C ATOM 1242 O ASN A 75 -11.893 3.030 25.679 1.00 0.00 O ATOM 1243 CB ASN A 75 -8.944 1.569 25.561 1.00 0.00 C ATOM 1244 CG ASN A 75 -8.592 0.973 26.910 1.00 0.00 C ATOM 1245 OD1 ASN A 75 -7.612 0.240 27.040 1.00 0.00 O ATOM 1246 ND2 ASN A 75 -9.393 1.285 27.922 1.00 0.00 N ATOM 0 H ASN A 75 -9.783 0.686 23.207 1.00 0.00 H new ATOM 0 HA ASN A 75 -10.884 0.730 25.952 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -8.252 1.191 24.808 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -8.814 2.650 25.600 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -9.207 0.913 28.853 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -10.195 1.897 27.768 1.00 0.00 H new ATOM 1253 N THR A 76 -10.938 3.074 23.643 1.00 0.00 N ATOM 1254 CA THR A 76 -11.604 4.306 23.236 1.00 0.00 C ATOM 1255 C THR A 76 -12.819 4.003 22.364 1.00 0.00 C ATOM 1256 O THR A 76 -12.940 2.913 21.806 1.00 0.00 O ATOM 1257 CB THR A 76 -10.632 5.214 22.481 1.00 0.00 C ATOM 1258 OG1 THR A 76 -10.021 4.514 21.411 1.00 0.00 O ATOM 1259 CG2 THR A 76 -9.530 5.768 23.357 1.00 0.00 C ATOM 0 H THR A 76 -10.318 2.677 22.937 1.00 0.00 H new ATOM 0 HA THR A 76 -11.943 4.820 24.135 1.00 0.00 H new ATOM 0 HB THR A 76 -11.235 6.045 22.115 1.00 0.00 H new ATOM 0 HG1 THR A 76 -9.404 5.112 20.939 1.00 0.00 H new ATOM 0 HG21 THR A 76 -8.876 6.404 22.760 1.00 0.00 H new ATOM 0 HG22 THR A 76 -9.968 6.355 24.165 1.00 0.00 H new ATOM 0 HG23 THR A 76 -8.952 4.946 23.778 1.00 0.00 H new ATOM 1267 N LYS A 77 -13.717 4.977 22.252 1.00 0.00 N ATOM 1268 CA LYS A 77 -14.923 4.816 21.448 1.00 0.00 C ATOM 1269 C LYS A 77 -14.991 5.871 20.347 1.00 0.00 C ATOM 1270 O LYS A 77 -15.002 7.070 20.624 1.00 0.00 O ATOM 1271 CB LYS A 77 -16.166 4.906 22.334 1.00 0.00 C ATOM 1272 CG LYS A 77 -16.300 3.752 23.313 1.00 0.00 C ATOM 1273 CD LYS A 77 -17.125 2.616 22.728 1.00 0.00 C ATOM 1274 CE LYS A 77 -16.476 1.265 22.986 1.00 0.00 C ATOM 1275 NZ LYS A 77 -15.428 0.951 21.976 1.00 0.00 N ATOM 0 H LYS A 77 -13.632 5.886 22.708 1.00 0.00 H new ATOM 0 HA LYS A 77 -14.888 3.832 20.980 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -16.138 5.843 22.891 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -17.052 4.939 21.700 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -15.310 3.383 23.580 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -16.767 4.106 24.232 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -18.124 2.630 23.163 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -17.242 2.765 21.655 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -16.034 1.259 23.982 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -17.239 0.487 22.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -15.022 0.015 22.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -15.851 0.948 21.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -14.678 1.670 22.019 1.00 0.00 H new ATOM 1289 N ASP A 78 -15.038 5.414 19.101 1.00 0.00 N ATOM 1290 CA ASP A 78 -15.107 6.318 17.959 1.00 0.00 C ATOM 1291 C ASP A 78 -16.557 6.644 17.612 1.00 0.00 C ATOM 1292 O ASP A 78 -17.474 5.908 17.980 1.00 0.00 O ATOM 1293 CB ASP A 78 -14.406 5.698 16.747 1.00 0.00 C ATOM 1294 CG ASP A 78 -12.998 6.228 16.562 1.00 0.00 C ATOM 1295 OD1 ASP A 78 -12.182 6.088 17.498 1.00 0.00 O ATOM 1296 OD2 ASP A 78 -12.710 6.783 15.480 1.00 0.00 O ATOM 0 H ASP A 78 -15.030 4.424 18.856 1.00 0.00 H new ATOM 0 HA ASP A 78 -14.599 7.244 18.228 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -14.371 4.615 16.865 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -14.989 5.902 15.849 1.00 0.00 H new ATOM 1301 N HIS A 79 -16.757 7.749 16.903 1.00 0.00 N ATOM 1302 CA HIS A 79 -18.096 8.171 16.506 1.00 0.00 C ATOM 1303 C HIS A 79 -18.213 8.246 14.988 1.00 0.00 C ATOM 1304 O HIS A 79 -19.183 7.760 14.405 1.00 0.00 O ATOM 1305 CB HIS A 79 -18.429 9.532 17.124 1.00 0.00 C ATOM 1306 CG HIS A 79 -19.845 9.643 17.594 1.00 0.00 C ATOM 1307 ND1 HIS A 79 -20.872 10.093 16.792 1.00 0.00 N ATOM 1308 CD2 HIS A 79 -20.405 9.360 18.794 1.00 0.00 C ATOM 1309 CE1 HIS A 79 -22.001 10.083 17.477 1.00 0.00 C ATOM 1310 NE2 HIS A 79 -21.745 9.641 18.694 1.00 0.00 N ATOM 0 H HIS A 79 -16.010 8.369 16.591 1.00 0.00 H new ATOM 0 HA HIS A 79 -18.808 7.431 16.871 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -17.760 9.714 17.965 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -18.236 10.313 16.389 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -19.893 8.983 19.667 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -22.969 10.385 17.105 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -22.432 9.527 19.440 1.00 0.00 H new ATOM 1319 N GLY A 80 -17.218 8.856 14.352 1.00 0.00 N ATOM 1320 CA GLY A 80 -17.227 8.983 12.907 1.00 0.00 C ATOM 1321 C GLY A 80 -16.032 8.310 12.261 1.00 0.00 C ATOM 1322 O GLY A 80 -15.157 7.788 12.951 1.00 0.00 O ATOM 0 H GLY A 80 -16.405 9.265 14.813 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -18.144 8.546 12.512 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -17.235 10.039 12.638 1.00 0.00 H new ATOM 1326 N TYR A 81 -15.995 8.323 10.933 1.00 0.00 N ATOM 1327 CA TYR A 81 -14.898 7.709 10.194 1.00 0.00 C ATOM 1328 C TYR A 81 -14.092 8.763 9.440 1.00 0.00 C ATOM 1329 O TYR A 81 -14.515 9.913 9.320 1.00 0.00 O ATOM 1330 CB TYR A 81 -15.436 6.665 9.214 1.00 0.00 C ATOM 1331 CG TYR A 81 -15.556 5.281 9.810 1.00 0.00 C ATOM 1332 CD1 TYR A 81 -16.210 5.078 11.019 1.00 0.00 C ATOM 1333 CD2 TYR A 81 -15.015 4.177 9.163 1.00 0.00 C ATOM 1334 CE1 TYR A 81 -16.321 3.815 11.567 1.00 0.00 C ATOM 1335 CE2 TYR A 81 -15.123 2.909 9.704 1.00 0.00 C ATOM 1336 CZ TYR A 81 -15.777 2.734 10.906 1.00 0.00 C ATOM 1337 OH TYR A 81 -15.886 1.474 11.448 1.00 0.00 O ATOM 0 H TYR A 81 -16.711 8.752 10.347 1.00 0.00 H new ATOM 0 HA TYR A 81 -14.240 7.219 10.911 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -16.415 6.984 8.857 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -14.779 6.622 8.345 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -16.639 5.922 11.539 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -14.502 4.311 8.222 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -16.831 3.675 12.508 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -14.698 2.061 9.188 1.00 0.00 H new ATOM 0 HH TYR A 81 -15.672 0.804 10.765 1.00 0.00 H new ATOM 1347 N THR A 82 -12.933 8.362 8.931 1.00 0.00 N ATOM 1348 CA THR A 82 -12.070 9.272 8.187 1.00 0.00 C ATOM 1349 C THR A 82 -12.535 9.395 6.740 1.00 0.00 C ATOM 1350 O THR A 82 -13.008 8.426 6.145 1.00 0.00 O ATOM 1351 CB THR A 82 -10.618 8.789 8.233 1.00 0.00 C ATOM 1352 OG1 THR A 82 -10.556 7.410 8.555 1.00 0.00 O ATOM 1353 CG2 THR A 82 -9.772 9.536 9.244 1.00 0.00 C ATOM 0 H THR A 82 -12.569 7.413 9.020 1.00 0.00 H new ATOM 0 HA THR A 82 -12.129 10.255 8.655 1.00 0.00 H new ATOM 0 HB THR A 82 -10.219 8.978 7.237 1.00 0.00 H new ATOM 0 HG1 THR A 82 -9.620 7.121 8.578 1.00 0.00 H new ATOM 0 HG21 THR A 82 -8.755 9.145 9.226 1.00 0.00 H new ATOM 0 HG22 THR A 82 -9.758 10.597 8.994 1.00 0.00 H new ATOM 0 HG23 THR A 82 -10.194 9.404 10.240 1.00 0.00 H new ATOM 1361 N THR A 83 -12.401 10.592 6.179 1.00 0.00 N ATOM 1362 CA THR A 83 -12.811 10.840 4.802 1.00 0.00 C ATOM 1363 C THR A 83 -11.614 10.792 3.858 1.00 0.00 C ATOM 1364 O THR A 83 -10.655 11.547 4.014 1.00 0.00 O ATOM 1365 CB THR A 83 -13.506 12.197 4.692 1.00 0.00 C ATOM 1366 OG1 THR A 83 -13.000 13.099 5.661 1.00 0.00 O ATOM 1367 CG2 THR A 83 -15.005 12.118 4.877 1.00 0.00 C ATOM 0 H THR A 83 -12.012 11.405 6.656 1.00 0.00 H new ATOM 0 HA THR A 83 -13.510 10.055 4.512 1.00 0.00 H new ATOM 0 HB THR A 83 -13.299 12.547 3.681 1.00 0.00 H new ATOM 0 HG1 THR A 83 -13.456 13.962 5.574 1.00 0.00 H new ATOM 0 HG21 THR A 83 -15.436 13.115 4.787 1.00 0.00 H new ATOM 0 HG22 THR A 83 -15.432 11.468 4.113 1.00 0.00 H new ATOM 0 HG23 THR A 83 -15.229 11.714 5.864 1.00 0.00 H new ATOM 1375 N LEU A 84 -11.681 9.900 2.875 1.00 0.00 N ATOM 1376 CA LEU A 84 -10.610 9.753 1.900 1.00 0.00 C ATOM 1377 C LEU A 84 -11.090 8.975 0.678 1.00 0.00 C ATOM 1378 O LEU A 84 -10.362 8.148 0.131 1.00 0.00 O ATOM 1379 CB LEU A 84 -9.394 9.058 2.526 1.00 0.00 C ATOM 1380 CG LEU A 84 -9.698 7.829 3.391 1.00 0.00 C ATOM 1381 CD1 LEU A 84 -10.342 8.240 4.706 1.00 0.00 C ATOM 1382 CD2 LEU A 84 -10.590 6.848 2.644 1.00 0.00 C ATOM 0 H LEU A 84 -12.468 9.267 2.734 1.00 0.00 H new ATOM 0 HA LEU A 84 -10.312 10.751 1.579 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -8.719 8.757 1.725 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -8.859 9.785 3.137 1.00 0.00 H new ATOM 0 HG LEU A 84 -8.754 7.332 3.613 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -10.549 7.352 5.303 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -9.665 8.896 5.253 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -11.275 8.767 4.505 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -10.792 5.984 3.278 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -11.530 7.335 2.385 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -10.088 6.520 1.734 1.00 0.00 H new ATOM 1394 N ALA A 85 -12.322 9.246 0.258 1.00 0.00 N ATOM 1395 CA ALA A 85 -12.901 8.570 -0.896 1.00 0.00 C ATOM 1396 C ALA A 85 -12.700 9.384 -2.171 1.00 0.00 C ATOM 1397 O ALA A 85 -13.569 9.413 -3.043 1.00 0.00 O ATOM 1398 CB ALA A 85 -14.380 8.304 -0.665 1.00 0.00 C ATOM 0 H ALA A 85 -12.938 9.929 0.700 1.00 0.00 H new ATOM 0 HA ALA A 85 -12.387 7.617 -1.021 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -14.799 7.799 -1.535 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -14.503 7.673 0.215 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -14.900 9.249 -0.509 1.00 0.00 H new ATOM 1404 N THR A 86 -11.548 10.038 -2.277 1.00 0.00 N ATOM 1405 CA THR A 86 -11.233 10.845 -3.449 1.00 0.00 C ATOM 1406 C THR A 86 -10.097 10.213 -4.245 1.00 0.00 C ATOM 1407 O THR A 86 -10.110 10.215 -5.476 1.00 0.00 O ATOM 1408 CB THR A 86 -10.852 12.265 -3.030 1.00 0.00 C ATOM 1409 OG1 THR A 86 -11.805 12.793 -2.125 1.00 0.00 O ATOM 1410 CG2 THR A 86 -10.744 13.225 -4.195 1.00 0.00 C ATOM 0 H THR A 86 -10.817 10.025 -1.565 1.00 0.00 H new ATOM 0 HA THR A 86 -12.119 10.890 -4.082 1.00 0.00 H new ATOM 0 HB THR A 86 -9.871 12.175 -2.563 1.00 0.00 H new ATOM 0 HG1 THR A 86 -11.543 13.701 -1.867 1.00 0.00 H new ATOM 0 HG21 THR A 86 -10.471 14.214 -3.827 1.00 0.00 H new ATOM 0 HG22 THR A 86 -9.980 12.872 -4.888 1.00 0.00 H new ATOM 0 HG23 THR A 86 -11.703 13.282 -4.710 1.00 0.00 H new ATOM 1418 N SER A 87 -9.118 9.671 -3.530 1.00 0.00 N ATOM 1419 CA SER A 87 -7.971 9.031 -4.162 1.00 0.00 C ATOM 1420 C SER A 87 -7.282 8.073 -3.196 1.00 0.00 C ATOM 1421 O SER A 87 -6.640 8.500 -2.235 1.00 0.00 O ATOM 1422 CB SER A 87 -6.976 10.084 -4.651 1.00 0.00 C ATOM 1423 OG SER A 87 -6.505 10.880 -3.577 1.00 0.00 O ATOM 0 H SER A 87 -9.096 9.662 -2.510 1.00 0.00 H new ATOM 0 HA SER A 87 -8.332 8.459 -5.017 1.00 0.00 H new ATOM 0 HB2 SER A 87 -6.134 9.594 -5.140 1.00 0.00 H new ATOM 0 HB3 SER A 87 -7.452 10.720 -5.397 1.00 0.00 H new ATOM 0 HG SER A 87 -6.509 10.351 -2.752 1.00 0.00 H new ATOM 1429 N VAL A 88 -7.413 6.776 -3.458 1.00 0.00 N ATOM 1430 CA VAL A 88 -6.798 5.761 -2.612 1.00 0.00 C ATOM 1431 C VAL A 88 -5.786 4.936 -3.400 1.00 0.00 C ATOM 1432 O VAL A 88 -6.133 4.283 -4.385 1.00 0.00 O ATOM 1433 CB VAL A 88 -7.856 4.815 -2.005 1.00 0.00 C ATOM 1434 CG1 VAL A 88 -7.208 3.808 -1.064 1.00 0.00 C ATOM 1435 CG2 VAL A 88 -8.930 5.612 -1.279 1.00 0.00 C ATOM 0 H VAL A 88 -7.939 6.404 -4.249 1.00 0.00 H new ATOM 0 HA VAL A 88 -6.289 6.286 -1.804 1.00 0.00 H new ATOM 0 HB VAL A 88 -8.326 4.263 -2.819 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -7.974 3.153 -0.649 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -6.480 3.212 -1.614 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -6.706 4.337 -0.254 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -9.667 4.929 -0.857 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -8.473 6.192 -0.477 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.420 6.286 -1.981 1.00 0.00 H new ATOM 1445 N THR A 89 -4.533 4.967 -2.958 1.00 0.00 N ATOM 1446 CA THR A 89 -3.470 4.219 -3.618 1.00 0.00 C ATOM 1447 C THR A 89 -3.265 2.870 -2.940 1.00 0.00 C ATOM 1448 O THR A 89 -2.873 2.804 -1.775 1.00 0.00 O ATOM 1449 CB THR A 89 -2.167 5.018 -3.600 1.00 0.00 C ATOM 1450 OG1 THR A 89 -1.090 4.235 -4.083 1.00 0.00 O ATOM 1451 CG2 THR A 89 -1.789 5.514 -2.221 1.00 0.00 C ATOM 0 H THR A 89 -4.229 5.503 -2.145 1.00 0.00 H new ATOM 0 HA THR A 89 -3.764 4.048 -4.654 1.00 0.00 H new ATOM 0 HB THR A 89 -2.349 5.879 -4.243 1.00 0.00 H new ATOM 0 HG1 THR A 89 -0.281 4.440 -3.570 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.855 6.073 -2.279 1.00 0.00 H new ATOM 0 HG22 THR A 89 -2.577 6.163 -1.839 1.00 0.00 H new ATOM 0 HG23 THR A 89 -1.662 4.664 -1.551 1.00 0.00 H new ATOM 1459 N LEU A 90 -3.538 1.795 -3.671 1.00 0.00 N ATOM 1460 CA LEU A 90 -3.390 0.450 -3.131 1.00 0.00 C ATOM 1461 C LEU A 90 -2.051 -0.163 -3.523 1.00 0.00 C ATOM 1462 O LEU A 90 -1.521 0.107 -4.602 1.00 0.00 O ATOM 1463 CB LEU A 90 -4.526 -0.450 -3.617 1.00 0.00 C ATOM 1464 CG LEU A 90 -5.913 0.193 -3.609 1.00 0.00 C ATOM 1465 CD1 LEU A 90 -6.144 0.977 -4.893 1.00 0.00 C ATOM 1466 CD2 LEU A 90 -6.987 -0.869 -3.427 1.00 0.00 C ATOM 0 H LEU A 90 -3.862 1.829 -4.637 1.00 0.00 H new ATOM 0 HA LEU A 90 -3.429 0.528 -2.044 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.300 -0.777 -4.632 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -4.553 -1.343 -2.993 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.970 0.887 -2.770 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -7.136 1.428 -4.870 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -5.391 1.760 -4.981 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -6.070 0.305 -5.748 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.969 -0.396 -3.423 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -6.932 -1.586 -4.246 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -6.830 -1.387 -2.481 1.00 0.00 H new ATOM 1478 N LEU A 91 -1.520 -1.000 -2.638 1.00 0.00 N ATOM 1479 CA LEU A 91 -0.250 -1.673 -2.877 1.00 0.00 C ATOM 1480 C LEU A 91 -0.369 -3.160 -2.550 1.00 0.00 C ATOM 1481 O LEU A 91 -1.246 -3.564 -1.786 1.00 0.00 O ATOM 1482 CB LEU A 91 0.850 -1.035 -2.029 1.00 0.00 C ATOM 1483 CG LEU A 91 1.725 -0.018 -2.764 1.00 0.00 C ATOM 1484 CD1 LEU A 91 0.876 1.117 -3.316 1.00 0.00 C ATOM 1485 CD2 LEU A 91 2.802 0.523 -1.836 1.00 0.00 C ATOM 0 H LEU A 91 -1.953 -1.229 -1.743 1.00 0.00 H new ATOM 0 HA LEU A 91 0.010 -1.566 -3.930 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.389 -0.543 -1.173 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.490 -1.825 -1.636 1.00 0.00 H new ATOM 0 HG LEU A 91 2.210 -0.520 -3.601 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.516 1.831 -3.835 1.00 0.00 H new ATOM 0 HD12 LEU A 91 0.140 0.715 -4.013 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.363 1.620 -2.496 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.416 1.245 -2.374 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.334 1.010 -0.980 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.429 -0.298 -1.488 1.00 0.00 H new ATOM 1497 N LYS A 92 0.509 -3.973 -3.128 1.00 0.00 N ATOM 1498 CA LYS A 92 0.482 -5.413 -2.886 1.00 0.00 C ATOM 1499 C LYS A 92 0.951 -5.735 -1.470 1.00 0.00 C ATOM 1500 O LYS A 92 2.069 -5.391 -1.081 1.00 0.00 O ATOM 1501 CB LYS A 92 1.363 -6.138 -3.908 1.00 0.00 C ATOM 1502 CG LYS A 92 0.776 -6.159 -5.307 1.00 0.00 C ATOM 1503 CD LYS A 92 -0.486 -6.998 -5.378 1.00 0.00 C ATOM 1504 CE LYS A 92 -0.470 -7.941 -6.568 1.00 0.00 C ATOM 1505 NZ LYS A 92 -0.168 -7.230 -7.840 1.00 0.00 N ATOM 0 H LYS A 92 1.244 -3.663 -3.764 1.00 0.00 H new ATOM 0 HA LYS A 92 -0.546 -5.757 -2.994 1.00 0.00 H new ATOM 0 HB2 LYS A 92 2.340 -5.656 -3.940 1.00 0.00 H new ATOM 0 HB3 LYS A 92 1.524 -7.163 -3.575 1.00 0.00 H new ATOM 0 HG2 LYS A 92 0.553 -5.140 -5.622 1.00 0.00 H new ATOM 0 HG3 LYS A 92 1.514 -6.554 -6.005 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -0.591 -7.574 -4.459 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.355 -6.343 -5.445 1.00 0.00 H new ATOM 0 HE2 LYS A 92 0.274 -8.720 -6.403 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -1.437 -8.437 -6.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.922 -7.420 -8.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -0.112 -6.207 -7.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 0.741 -7.566 -8.218 1.00 0.00 H new ATOM 1519 N ALA A 93 0.090 -6.404 -0.706 1.00 0.00 N ATOM 1520 CA ALA A 93 0.416 -6.778 0.667 1.00 0.00 C ATOM 1521 C ALA A 93 1.741 -7.528 0.728 1.00 0.00 C ATOM 1522 O ALA A 93 2.532 -7.342 1.653 1.00 0.00 O ATOM 1523 CB ALA A 93 -0.698 -7.626 1.263 1.00 0.00 C ATOM 0 H ALA A 93 -0.837 -6.697 -1.014 1.00 0.00 H new ATOM 0 HA ALA A 93 0.515 -5.864 1.253 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -0.441 -7.897 2.287 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -1.628 -7.058 1.261 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -0.824 -8.531 0.669 1.00 0.00 H new ATOM 1529 N SER A 94 1.975 -8.375 -0.267 1.00 0.00 N ATOM 1530 CA SER A 94 3.202 -9.154 -0.335 1.00 0.00 C ATOM 1531 C SER A 94 4.413 -8.246 -0.522 1.00 0.00 C ATOM 1532 O SER A 94 5.490 -8.516 0.008 1.00 0.00 O ATOM 1533 CB SER A 94 3.128 -10.165 -1.482 1.00 0.00 C ATOM 1534 OG SER A 94 4.226 -11.059 -1.447 1.00 0.00 O ATOM 0 H SER A 94 1.329 -8.539 -1.039 1.00 0.00 H new ATOM 0 HA SER A 94 3.313 -9.691 0.607 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.196 -10.726 -1.416 1.00 0.00 H new ATOM 0 HB3 SER A 94 3.115 -9.637 -2.436 1.00 0.00 H new ATOM 0 HG SER A 94 4.154 -11.695 -2.189 1.00 0.00 H new ATOM 1540 N GLU A 95 4.229 -7.166 -1.275 1.00 0.00 N ATOM 1541 CA GLU A 95 5.315 -6.225 -1.525 1.00 0.00 C ATOM 1542 C GLU A 95 5.699 -5.500 -0.241 1.00 0.00 C ATOM 1543 O GLU A 95 6.875 -5.440 0.127 1.00 0.00 O ATOM 1544 CB GLU A 95 4.899 -5.214 -2.595 1.00 0.00 C ATOM 1545 CG GLU A 95 5.547 -5.459 -3.948 1.00 0.00 C ATOM 1546 CD GLU A 95 4.631 -6.191 -4.909 1.00 0.00 C ATOM 1547 OE1 GLU A 95 3.931 -5.516 -5.693 1.00 0.00 O ATOM 1548 OE2 GLU A 95 4.615 -7.440 -4.879 1.00 0.00 O ATOM 0 H GLU A 95 3.344 -6.922 -1.720 1.00 0.00 H new ATOM 0 HA GLU A 95 6.181 -6.782 -1.882 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.815 -5.244 -2.710 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.156 -4.211 -2.255 1.00 0.00 H new ATOM 0 HG2 GLU A 95 5.838 -4.504 -4.386 1.00 0.00 H new ATOM 0 HG3 GLU A 95 6.460 -6.038 -3.810 1.00 0.00 H new ATOM 1555 N VAL A 96 4.697 -4.965 0.444 1.00 0.00 N ATOM 1556 CA VAL A 96 4.926 -4.255 1.692 1.00 0.00 C ATOM 1557 C VAL A 96 5.475 -5.200 2.752 1.00 0.00 C ATOM 1558 O VAL A 96 6.345 -4.833 3.537 1.00 0.00 O ATOM 1559 CB VAL A 96 3.634 -3.603 2.222 1.00 0.00 C ATOM 1560 CG1 VAL A 96 3.950 -2.631 3.348 1.00 0.00 C ATOM 1561 CG2 VAL A 96 2.887 -2.901 1.097 1.00 0.00 C ATOM 0 H VAL A 96 3.720 -5.010 0.156 1.00 0.00 H new ATOM 0 HA VAL A 96 5.653 -3.470 1.484 1.00 0.00 H new ATOM 0 HB VAL A 96 2.990 -4.388 2.619 1.00 0.00 H new ATOM 0 HG11 VAL A 96 3.026 -2.180 3.710 1.00 0.00 H new ATOM 0 HG12 VAL A 96 4.437 -3.165 4.164 1.00 0.00 H new ATOM 0 HG13 VAL A 96 4.614 -1.850 2.979 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.978 -2.447 1.492 1.00 0.00 H new ATOM 0 HG22 VAL A 96 3.522 -2.127 0.666 1.00 0.00 H new ATOM 0 HG23 VAL A 96 2.626 -3.626 0.326 1.00 0.00 H new ATOM 1571 N GLU A 97 4.960 -6.423 2.761 1.00 0.00 N ATOM 1572 CA GLU A 97 5.395 -7.428 3.721 1.00 0.00 C ATOM 1573 C GLU A 97 6.885 -7.697 3.581 1.00 0.00 C ATOM 1574 O GLU A 97 7.612 -7.751 4.574 1.00 0.00 O ATOM 1575 CB GLU A 97 4.604 -8.725 3.530 1.00 0.00 C ATOM 1576 CG GLU A 97 3.505 -8.924 4.561 1.00 0.00 C ATOM 1577 CD GLU A 97 3.797 -10.068 5.513 1.00 0.00 C ATOM 1578 OE1 GLU A 97 3.966 -9.805 6.722 1.00 0.00 O ATOM 1579 OE2 GLU A 97 3.858 -11.226 5.049 1.00 0.00 O ATOM 0 H GLU A 97 4.240 -6.743 2.113 1.00 0.00 H new ATOM 0 HA GLU A 97 5.207 -7.046 4.724 1.00 0.00 H new ATOM 0 HB2 GLU A 97 4.161 -8.728 2.534 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.291 -9.570 3.576 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.377 -8.005 5.132 1.00 0.00 H new ATOM 0 HG3 GLU A 97 2.562 -9.114 4.049 1.00 0.00 H new ATOM 1586 N GLU A 98 7.338 -7.862 2.344 1.00 0.00 N ATOM 1587 CA GLU A 98 8.745 -8.121 2.086 1.00 0.00 C ATOM 1588 C GLU A 98 9.601 -6.948 2.550 1.00 0.00 C ATOM 1589 O GLU A 98 10.594 -7.125 3.261 1.00 0.00 O ATOM 1590 CB GLU A 98 8.967 -8.349 0.594 1.00 0.00 C ATOM 1591 CG GLU A 98 8.092 -9.432 -0.005 1.00 0.00 C ATOM 1592 CD GLU A 98 8.829 -10.742 -0.197 1.00 0.00 C ATOM 1593 OE1 GLU A 98 9.347 -10.975 -1.309 1.00 0.00 O ATOM 1594 OE2 GLU A 98 8.891 -11.535 0.767 1.00 0.00 O ATOM 0 H GLU A 98 6.753 -7.821 1.509 1.00 0.00 H new ATOM 0 HA GLU A 98 9.036 -9.013 2.640 1.00 0.00 H new ATOM 0 HB2 GLU A 98 8.784 -7.415 0.064 1.00 0.00 H new ATOM 0 HB3 GLU A 98 10.013 -8.609 0.429 1.00 0.00 H new ATOM 0 HG2 GLU A 98 7.231 -9.596 0.642 1.00 0.00 H new ATOM 0 HG3 GLU A 98 7.708 -9.092 -0.967 1.00 0.00 H new ATOM 1601 N ILE A 99 9.201 -5.739 2.165 1.00 0.00 N ATOM 1602 CA ILE A 99 9.938 -4.547 2.561 1.00 0.00 C ATOM 1603 C ILE A 99 9.932 -4.423 4.076 1.00 0.00 C ATOM 1604 O ILE A 99 10.939 -4.065 4.688 1.00 0.00 O ATOM 1605 CB ILE A 99 9.367 -3.258 1.932 1.00 0.00 C ATOM 1606 CG1 ILE A 99 9.048 -3.469 0.449 1.00 0.00 C ATOM 1607 CG2 ILE A 99 10.360 -2.116 2.094 1.00 0.00 C ATOM 1608 CD1 ILE A 99 7.805 -2.739 -0.010 1.00 0.00 C ATOM 0 H ILE A 99 8.380 -5.562 1.586 1.00 0.00 H new ATOM 0 HA ILE A 99 10.958 -4.661 2.193 1.00 0.00 H new ATOM 0 HB ILE A 99 8.441 -3.005 2.449 1.00 0.00 H new ATOM 0 HG12 ILE A 99 9.897 -3.136 -0.148 1.00 0.00 H new ATOM 0 HG13 ILE A 99 8.924 -4.535 0.260 1.00 0.00 H new ATOM 0 HG21 ILE A 99 9.949 -1.211 1.647 1.00 0.00 H new ATOM 0 HG22 ILE A 99 10.548 -1.945 3.154 1.00 0.00 H new ATOM 0 HG23 ILE A 99 11.295 -2.374 1.597 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.639 -2.933 -1.070 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.945 -3.089 0.562 1.00 0.00 H new ATOM 0 HD13 ILE A 99 7.933 -1.668 0.147 1.00 0.00 H new ATOM 1620 N LEU A 100 8.792 -4.746 4.678 1.00 0.00 N ATOM 1621 CA LEU A 100 8.657 -4.698 6.128 1.00 0.00 C ATOM 1622 C LEU A 100 9.548 -5.757 6.769 1.00 0.00 C ATOM 1623 O LEU A 100 10.123 -5.539 7.835 1.00 0.00 O ATOM 1624 CB LEU A 100 7.201 -4.921 6.541 1.00 0.00 C ATOM 1625 CG LEU A 100 6.249 -3.749 6.277 1.00 0.00 C ATOM 1626 CD1 LEU A 100 4.978 -3.915 7.092 1.00 0.00 C ATOM 1627 CD2 LEU A 100 6.919 -2.420 6.596 1.00 0.00 C ATOM 0 H LEU A 100 7.950 -5.043 4.185 1.00 0.00 H new ATOM 0 HA LEU A 100 8.968 -3.712 6.472 1.00 0.00 H new ATOM 0 HB2 LEU A 100 6.823 -5.798 6.015 1.00 0.00 H new ATOM 0 HB3 LEU A 100 7.176 -5.153 7.606 1.00 0.00 H new ATOM 0 HG LEU A 100 5.990 -3.748 5.218 1.00 0.00 H new ATOM 0 HD11 LEU A 100 4.309 -3.077 6.897 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.485 -4.846 6.812 1.00 0.00 H new ATOM 0 HD13 LEU A 100 5.227 -3.941 8.153 1.00 0.00 H new ATOM 0 HD21 LEU A 100 6.222 -1.605 6.400 1.00 0.00 H new ATOM 0 HD22 LEU A 100 7.212 -2.403 7.646 1.00 0.00 H new ATOM 0 HD23 LEU A 100 7.804 -2.299 5.971 1.00 0.00 H new ATOM 1639 N ASP A 101 9.668 -6.899 6.098 1.00 0.00 N ATOM 1640 CA ASP A 101 10.503 -7.992 6.584 1.00 0.00 C ATOM 1641 C ASP A 101 11.975 -7.698 6.304 1.00 0.00 C ATOM 1642 O ASP A 101 12.867 -8.359 6.836 1.00 0.00 O ATOM 1643 CB ASP A 101 10.096 -9.310 5.924 1.00 0.00 C ATOM 1644 CG ASP A 101 10.658 -10.518 6.647 1.00 0.00 C ATOM 1645 OD1 ASP A 101 10.992 -11.513 5.970 1.00 0.00 O ATOM 1646 OD2 ASP A 101 10.765 -10.470 7.890 1.00 0.00 O ATOM 0 H ASP A 101 9.196 -7.091 5.214 1.00 0.00 H new ATOM 0 HA ASP A 101 10.361 -8.083 7.661 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.009 -9.379 5.898 1.00 0.00 H new ATOM 0 HB3 ASP A 101 10.440 -9.317 4.890 1.00 0.00 H new ATOM 1651 N GLY A 102 12.213 -6.697 5.460 1.00 0.00 N ATOM 1652 CA GLY A 102 13.566 -6.311 5.106 1.00 0.00 C ATOM 1653 C GLY A 102 13.988 -6.842 3.751 1.00 0.00 C ATOM 1654 O GLY A 102 15.120 -6.626 3.318 1.00 0.00 O ATOM 0 H GLY A 102 11.484 -6.142 5.012 1.00 0.00 H new ATOM 0 HA2 GLY A 102 13.641 -5.224 5.105 1.00 0.00 H new ATOM 0 HA3 GLY A 102 14.255 -6.678 5.867 1.00 0.00 H new ATOM 1658 N ASN A 103 13.063 -7.501 3.061 1.00 0.00 N ATOM 1659 CA ASN A 103 13.333 -8.018 1.729 1.00 0.00 C ATOM 1660 C ASN A 103 12.656 -7.130 0.695 1.00 0.00 C ATOM 1661 O ASN A 103 11.431 -7.092 0.611 1.00 0.00 O ATOM 1662 CB ASN A 103 12.831 -9.458 1.599 1.00 0.00 C ATOM 1663 CG ASN A 103 13.234 -10.094 0.282 1.00 0.00 C ATOM 1664 OD1 ASN A 103 14.417 -10.304 0.018 1.00 0.00 O ATOM 1665 ND2 ASN A 103 12.247 -10.401 -0.552 1.00 0.00 N ATOM 0 H ASN A 103 12.121 -7.688 3.404 1.00 0.00 H new ATOM 0 HA ASN A 103 14.410 -8.016 1.559 1.00 0.00 H new ATOM 0 HB2 ASN A 103 13.225 -10.053 2.423 1.00 0.00 H new ATOM 0 HB3 ASN A 103 11.745 -9.471 1.688 1.00 0.00 H new ATOM 0 HD21 ASN A 103 12.456 -10.829 -1.454 1.00 0.00 H new ATOM 0 HD22 ASN A 103 11.280 -10.209 -0.291 1.00 0.00 H new ATOM 1672 N ASP A 104 13.442 -6.403 -0.082 1.00 0.00 N ATOM 1673 CA ASP A 104 12.871 -5.513 -1.087 1.00 0.00 C ATOM 1674 C ASP A 104 13.902 -5.050 -2.112 1.00 0.00 C ATOM 1675 O ASP A 104 13.659 -4.100 -2.853 1.00 0.00 O ATOM 1676 CB ASP A 104 12.244 -4.299 -0.399 1.00 0.00 C ATOM 1677 CG ASP A 104 13.211 -3.603 0.540 1.00 0.00 C ATOM 1678 OD1 ASP A 104 13.890 -4.302 1.320 1.00 0.00 O ATOM 1679 OD2 ASP A 104 13.286 -2.358 0.497 1.00 0.00 O ATOM 0 H ASP A 104 14.461 -6.408 -0.041 1.00 0.00 H new ATOM 0 HA ASP A 104 12.110 -6.077 -1.627 1.00 0.00 H new ATOM 0 HB2 ASP A 104 11.904 -3.592 -1.155 1.00 0.00 H new ATOM 0 HB3 ASP A 104 11.364 -4.616 0.160 1.00 0.00 H new ATOM 1684 N GLU A 105 15.044 -5.725 -2.158 1.00 0.00 N ATOM 1685 CA GLU A 105 16.104 -5.374 -3.099 1.00 0.00 C ATOM 1686 C GLU A 105 15.577 -5.335 -4.528 1.00 0.00 C ATOM 1687 O GLU A 105 15.933 -4.454 -5.310 1.00 0.00 O ATOM 1688 CB GLU A 105 17.259 -6.372 -2.995 1.00 0.00 C ATOM 1689 CG GLU A 105 17.990 -6.321 -1.663 1.00 0.00 C ATOM 1690 CD GLU A 105 17.407 -7.278 -0.642 1.00 0.00 C ATOM 1691 OE1 GLU A 105 16.883 -8.336 -1.051 1.00 0.00 O ATOM 1692 OE2 GLU A 105 17.473 -6.970 0.567 1.00 0.00 O ATOM 0 H GLU A 105 15.261 -6.519 -1.555 1.00 0.00 H new ATOM 0 HA GLU A 105 16.467 -4.379 -2.840 1.00 0.00 H new ATOM 0 HB2 GLU A 105 16.873 -7.379 -3.149 1.00 0.00 H new ATOM 0 HB3 GLU A 105 17.970 -6.177 -3.798 1.00 0.00 H new ATOM 0 HG2 GLU A 105 19.042 -6.560 -1.820 1.00 0.00 H new ATOM 0 HG3 GLU A 105 17.949 -5.306 -1.269 1.00 0.00 H new ATOM 1699 N LYS A 106 14.722 -6.294 -4.859 1.00 0.00 N ATOM 1700 CA LYS A 106 14.138 -6.367 -6.192 1.00 0.00 C ATOM 1701 C LYS A 106 13.229 -5.171 -6.447 1.00 0.00 C ATOM 1702 O LYS A 106 13.079 -4.724 -7.584 1.00 0.00 O ATOM 1703 CB LYS A 106 13.348 -7.668 -6.355 1.00 0.00 C ATOM 1704 CG LYS A 106 12.212 -7.819 -5.356 1.00 0.00 C ATOM 1705 CD LYS A 106 11.265 -8.940 -5.753 1.00 0.00 C ATOM 1706 CE LYS A 106 10.396 -8.539 -6.935 1.00 0.00 C ATOM 1707 NZ LYS A 106 9.113 -9.297 -6.962 1.00 0.00 N ATOM 0 H LYS A 106 14.418 -7.031 -4.223 1.00 0.00 H new ATOM 0 HA LYS A 106 14.948 -6.350 -6.921 1.00 0.00 H new ATOM 0 HB2 LYS A 106 12.941 -7.712 -7.365 1.00 0.00 H new ATOM 0 HB3 LYS A 106 14.029 -8.513 -6.249 1.00 0.00 H new ATOM 0 HG2 LYS A 106 12.621 -8.021 -4.366 1.00 0.00 H new ATOM 0 HG3 LYS A 106 11.660 -6.882 -5.288 1.00 0.00 H new ATOM 0 HD2 LYS A 106 11.839 -9.831 -6.007 1.00 0.00 H new ATOM 0 HD3 LYS A 106 10.631 -9.201 -4.905 1.00 0.00 H new ATOM 0 HE2 LYS A 106 10.186 -7.471 -6.886 1.00 0.00 H new ATOM 0 HE3 LYS A 106 10.941 -8.714 -7.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 8.549 -8.995 -7.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 9.313 -10.315 -7.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 8.581 -9.110 -6.088 1.00 0.00 H new ATOM 1721 N TYR A 107 12.622 -4.658 -5.381 1.00 0.00 N ATOM 1722 CA TYR A 107 11.728 -3.519 -5.485 1.00 0.00 C ATOM 1723 C TYR A 107 12.508 -2.211 -5.587 1.00 0.00 C ATOM 1724 O TYR A 107 12.127 -1.308 -6.333 1.00 0.00 O ATOM 1725 CB TYR A 107 10.805 -3.474 -4.271 1.00 0.00 C ATOM 1726 CG TYR A 107 10.056 -4.760 -4.014 1.00 0.00 C ATOM 1727 CD1 TYR A 107 9.347 -5.390 -5.027 1.00 0.00 C ATOM 1728 CD2 TYR A 107 10.051 -5.338 -2.752 1.00 0.00 C ATOM 1729 CE1 TYR A 107 8.654 -6.561 -4.789 1.00 0.00 C ATOM 1730 CE2 TYR A 107 9.364 -6.508 -2.505 1.00 0.00 C ATOM 1731 CZ TYR A 107 8.665 -7.116 -3.526 1.00 0.00 C ATOM 1732 OH TYR A 107 7.976 -8.283 -3.286 1.00 0.00 O ATOM 0 H TYR A 107 12.736 -5.018 -4.433 1.00 0.00 H new ATOM 0 HA TYR A 107 11.136 -3.635 -6.393 1.00 0.00 H new ATOM 0 HB2 TYR A 107 11.396 -3.228 -3.389 1.00 0.00 H new ATOM 0 HB3 TYR A 107 10.084 -2.668 -4.407 1.00 0.00 H new ATOM 0 HD1 TYR A 107 9.337 -4.958 -6.017 1.00 0.00 H new ATOM 0 HD2 TYR A 107 10.595 -4.863 -1.949 1.00 0.00 H new ATOM 0 HE1 TYR A 107 8.106 -7.040 -5.587 1.00 0.00 H new ATOM 0 HE2 TYR A 107 9.374 -6.945 -1.518 1.00 0.00 H new ATOM 0 HH TYR A 107 8.600 -8.974 -2.981 1.00 0.00 H new ATOM 1742 N LYS A 108 13.599 -2.111 -4.832 1.00 0.00 N ATOM 1743 CA LYS A 108 14.426 -0.902 -4.843 1.00 0.00 C ATOM 1744 C LYS A 108 15.283 -0.832 -6.109 1.00 0.00 C ATOM 1745 O LYS A 108 15.971 0.160 -6.345 1.00 0.00 O ATOM 1746 CB LYS A 108 15.338 -0.826 -3.606 1.00 0.00 C ATOM 1747 CG LYS A 108 14.975 -1.777 -2.478 1.00 0.00 C ATOM 1748 CD LYS A 108 15.674 -1.397 -1.182 1.00 0.00 C ATOM 1749 CE LYS A 108 15.419 0.056 -0.811 1.00 0.00 C ATOM 1750 NZ LYS A 108 15.421 0.265 0.664 1.00 0.00 N ATOM 0 H LYS A 108 13.932 -2.846 -4.208 1.00 0.00 H new ATOM 0 HA LYS A 108 13.742 -0.053 -4.825 1.00 0.00 H new ATOM 0 HB2 LYS A 108 16.363 -1.030 -3.916 1.00 0.00 H new ATOM 0 HB3 LYS A 108 15.318 0.194 -3.221 1.00 0.00 H new ATOM 0 HG2 LYS A 108 13.896 -1.768 -2.327 1.00 0.00 H new ATOM 0 HG3 LYS A 108 15.250 -2.795 -2.756 1.00 0.00 H new ATOM 0 HD2 LYS A 108 15.326 -2.045 -0.377 1.00 0.00 H new ATOM 0 HD3 LYS A 108 16.746 -1.564 -1.284 1.00 0.00 H new ATOM 0 HE2 LYS A 108 16.183 0.686 -1.267 1.00 0.00 H new ATOM 0 HE3 LYS A 108 14.459 0.371 -1.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 15.949 1.132 0.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 14.442 0.357 1.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 15.873 -0.548 1.129 1.00 0.00 H new ATOM 1764 N ALA A 109 15.248 -1.893 -6.914 1.00 0.00 N ATOM 1765 CA ALA A 109 16.033 -1.945 -8.145 1.00 0.00 C ATOM 1766 C ALA A 109 15.193 -1.595 -9.371 1.00 0.00 C ATOM 1767 O ALA A 109 15.676 -1.673 -10.502 1.00 0.00 O ATOM 1768 CB ALA A 109 16.646 -3.326 -8.310 1.00 0.00 C ATOM 0 H ALA A 109 14.686 -2.725 -6.736 1.00 0.00 H new ATOM 0 HA ALA A 109 16.825 -1.200 -8.065 1.00 0.00 H new ATOM 0 HB1 ALA A 109 17.230 -3.357 -9.230 1.00 0.00 H new ATOM 0 HB2 ALA A 109 17.295 -3.540 -7.461 1.00 0.00 H new ATOM 0 HB3 ALA A 109 15.853 -4.073 -8.358 1.00 0.00 H new ATOM 1774 N VAL A 110 13.938 -1.207 -9.147 1.00 0.00 N ATOM 1775 CA VAL A 110 13.037 -0.841 -10.231 1.00 0.00 C ATOM 1776 C VAL A 110 12.647 -2.050 -11.088 1.00 0.00 C ATOM 1777 O VAL A 110 11.920 -1.907 -12.071 1.00 0.00 O ATOM 1778 CB VAL A 110 13.677 0.231 -11.127 1.00 0.00 C ATOM 1779 CG1 VAL A 110 12.711 0.687 -12.211 1.00 0.00 C ATOM 1780 CG2 VAL A 110 14.153 1.409 -10.291 1.00 0.00 C ATOM 0 H VAL A 110 13.523 -1.139 -8.218 1.00 0.00 H new ATOM 0 HA VAL A 110 12.133 -0.444 -9.770 1.00 0.00 H new ATOM 0 HB VAL A 110 14.543 -0.211 -11.620 1.00 0.00 H new ATOM 0 HG11 VAL A 110 13.190 1.446 -12.830 1.00 0.00 H new ATOM 0 HG12 VAL A 110 12.432 -0.165 -12.832 1.00 0.00 H new ATOM 0 HG13 VAL A 110 11.818 1.107 -11.749 1.00 0.00 H new ATOM 0 HG21 VAL A 110 14.604 2.158 -10.942 1.00 0.00 H new ATOM 0 HG22 VAL A 110 13.305 1.848 -9.765 1.00 0.00 H new ATOM 0 HG23 VAL A 110 14.892 1.066 -9.567 1.00 0.00 H new ATOM 1790 N SER A 111 13.123 -3.240 -10.710 1.00 0.00 N ATOM 1791 CA SER A 111 12.816 -4.469 -11.445 1.00 0.00 C ATOM 1792 C SER A 111 12.847 -4.245 -12.956 1.00 0.00 C ATOM 1793 O SER A 111 11.803 -4.133 -13.598 1.00 0.00 O ATOM 1794 CB SER A 111 11.446 -5.008 -11.029 1.00 0.00 C ATOM 1795 OG SER A 111 11.176 -6.253 -11.649 1.00 0.00 O ATOM 0 H SER A 111 13.724 -3.378 -9.897 1.00 0.00 H new ATOM 0 HA SER A 111 13.585 -5.201 -11.196 1.00 0.00 H new ATOM 0 HB2 SER A 111 11.411 -5.123 -9.946 1.00 0.00 H new ATOM 0 HB3 SER A 111 10.672 -4.289 -11.298 1.00 0.00 H new ATOM 0 HG SER A 111 10.295 -6.576 -11.365 1.00 0.00 H new ATOM 1801 N ILE A 112 14.051 -4.179 -13.517 1.00 0.00 N ATOM 1802 CA ILE A 112 14.212 -3.966 -14.951 1.00 0.00 C ATOM 1803 C ILE A 112 14.720 -5.227 -15.640 1.00 0.00 C ATOM 1804 O ILE A 112 14.416 -5.474 -16.807 1.00 0.00 O ATOM 1805 CB ILE A 112 15.183 -2.807 -15.242 1.00 0.00 C ATOM 1806 CG1 ILE A 112 14.820 -1.584 -14.398 1.00 0.00 C ATOM 1807 CG2 ILE A 112 15.165 -2.461 -16.723 1.00 0.00 C ATOM 1808 CD1 ILE A 112 15.866 -0.491 -14.436 1.00 0.00 C ATOM 0 H ILE A 112 14.927 -4.270 -13.002 1.00 0.00 H new ATOM 0 HA ILE A 112 13.228 -3.712 -15.345 1.00 0.00 H new ATOM 0 HB ILE A 112 16.192 -3.122 -14.975 1.00 0.00 H new ATOM 0 HG12 ILE A 112 13.871 -1.179 -14.749 1.00 0.00 H new ATOM 0 HG13 ILE A 112 14.671 -1.897 -13.365 1.00 0.00 H new ATOM 0 HG21 ILE A 112 15.856 -1.640 -16.913 1.00 0.00 H new ATOM 0 HG22 ILE A 112 15.468 -3.332 -17.304 1.00 0.00 H new ATOM 0 HG23 ILE A 112 14.158 -2.162 -17.015 1.00 0.00 H new ATOM 0 HD11 ILE A 112 15.542 0.344 -13.815 1.00 0.00 H new ATOM 0 HD12 ILE A 112 16.812 -0.879 -14.057 1.00 0.00 H new ATOM 0 HD13 ILE A 112 15.999 -0.150 -15.463 1.00 0.00 H new ATOM 1820 N SER A 113 15.498 -6.023 -14.912 1.00 0.00 N ATOM 1821 CA SER A 113 16.048 -7.259 -15.457 1.00 0.00 C ATOM 1822 C SER A 113 15.886 -8.408 -14.468 1.00 0.00 C ATOM 1823 O SER A 113 15.376 -9.472 -14.877 1.00 0.00 O ATOM 1824 CB SER A 113 17.526 -7.074 -15.804 1.00 0.00 C ATOM 1825 OG SER A 113 18.062 -8.245 -16.395 1.00 0.00 O ATOM 1826 OXT SER A 113 16.272 -8.235 -13.292 1.00 0.00 O ATOM 0 H SER A 113 15.761 -5.834 -13.945 1.00 0.00 H new ATOM 0 HA SER A 113 15.497 -7.504 -16.365 1.00 0.00 H new ATOM 0 HB2 SER A 113 17.640 -6.233 -16.488 1.00 0.00 H new ATOM 0 HB3 SER A 113 18.087 -6.829 -14.902 1.00 0.00 H new ATOM 0 HG SER A 113 19.007 -8.100 -16.609 1.00 0.00 H new TER 1832 SER A 113