USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 938 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 83 ASN : amide:sc= -0.934 K(o=-0.93,f=0.014) USER MOD Set 1.2: A 114 SER OG : rot -150:sc= 0 USER MOD Set 2.1: A 31 MET CE :methyl 126:sc= -2.93! (180deg=-0.826) USER MOD Set 2.2: A 105 THR OG1 : rot -81:sc= -0.196 USER MOD Set 3.1: A 8 SER OG : rot 94:sc= 0.315 USER MOD Set 3.2: A 17 SER OG : rot -150:sc= 0.293 USER MOD Single : A 1 MET CE :methyl 157:sc=-0.00566 (180deg=-0.711) USER MOD Single : A 1 MET N :NH3+ -147:sc= -0.285 (180deg=-1.28!) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot -60:sc= 1.1 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0.0849 USER MOD Single : A 14 SER OG : rot 56:sc= 0.126 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0401) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= -1.29 X(o=-1.3,f=-1.6) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= -0.656 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= -0.307 X(o=-0.31,f=-0.054) USER MOD Single : A 63 ASN : amide:sc= -1.02 K(o=-1,f=-0.076) USER MOD Single : A 64 ASN : amide:sc= -0.0241 K(o=-0.024,f=-1.8!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 71:sc= 0.819 USER MOD Single : A 73 SER OG : rot 111:sc= 0.235 USER MOD Single : A 77 ASN : amide:sc= -0.966 K(o=-0.97,f=-0.34) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.0671 USER MOD Single : A 95 THR OG1 : rot 5:sc= 0.271 USER MOD Single : A 96 SER OG : rot -17:sc= 0.566 USER MOD Single : A 100 ASN : amide:sc= -1.94! C(o=-1.9!,f=-4.4!) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.849 2.320 -4.315 1.00 0.00 N ATOM 2 CA MET A 1 7.787 1.766 -5.202 1.00 0.00 C ATOM 3 C MET A 1 6.577 1.359 -4.359 1.00 0.00 C ATOM 4 O MET A 1 6.684 0.566 -3.444 1.00 0.00 O ATOM 5 CB MET A 1 8.330 0.541 -5.941 1.00 0.00 C ATOM 6 CG MET A 1 9.507 0.957 -6.824 1.00 0.00 C ATOM 7 SD MET A 1 10.629 -0.448 -7.035 1.00 0.00 S ATOM 8 CE MET A 1 9.416 -1.606 -7.715 1.00 0.00 C ATOM 0 H1 MET A 1 9.373 3.062 -4.822 1.00 0.00 H new ATOM 0 H2 MET A 1 8.413 2.725 -3.462 1.00 0.00 H new ATOM 0 H3 MET A 1 9.504 1.560 -4.041 1.00 0.00 H new ATOM 0 HA MET A 1 7.486 2.524 -5.925 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.649 -0.217 -5.225 1.00 0.00 H new ATOM 0 HB3 MET A 1 7.545 0.093 -6.551 1.00 0.00 H new ATOM 0 HG2 MET A 1 9.145 1.296 -7.795 1.00 0.00 H new ATOM 0 HG3 MET A 1 10.037 1.795 -6.371 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.931 -2.377 -8.289 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.860 -2.071 -6.901 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.726 -1.069 -8.366 1.00 0.00 H new ATOM 20 N LYS A 2 5.424 1.893 -4.661 1.00 0.00 N ATOM 21 CA LYS A 2 4.208 1.535 -3.878 1.00 0.00 C ATOM 22 C LYS A 2 3.228 0.781 -4.781 1.00 0.00 C ATOM 23 O LYS A 2 3.188 0.986 -5.978 1.00 0.00 O ATOM 24 CB LYS A 2 3.544 2.809 -3.352 1.00 0.00 C ATOM 25 CG LYS A 2 3.776 2.920 -1.844 1.00 0.00 C ATOM 26 CD LYS A 2 2.520 3.478 -1.174 1.00 0.00 C ATOM 27 CE LYS A 2 2.919 4.338 0.027 1.00 0.00 C ATOM 28 NZ LYS A 2 1.888 4.211 1.095 1.00 0.00 N ATOM 0 H LYS A 2 5.272 2.562 -5.416 1.00 0.00 H new ATOM 0 HA LYS A 2 4.489 0.902 -3.037 1.00 0.00 H new ATOM 0 HB2 LYS A 2 3.955 3.682 -3.859 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.475 2.790 -3.566 1.00 0.00 H new ATOM 0 HG2 LYS A 2 4.018 1.941 -1.430 1.00 0.00 H new ATOM 0 HG3 LYS A 2 4.627 3.570 -1.643 1.00 0.00 H new ATOM 0 HD2 LYS A 2 1.949 4.073 -1.887 1.00 0.00 H new ATOM 0 HD3 LYS A 2 1.874 2.661 -0.851 1.00 0.00 H new ATOM 0 HE2 LYS A 2 3.891 4.023 0.406 1.00 0.00 H new ATOM 0 HE3 LYS A 2 3.018 5.380 -0.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 2.160 4.796 1.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 0.969 4.532 0.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 1.815 3.217 1.391 1.00 0.00 H new ATOM 42 N ILE A 3 2.439 -0.093 -4.216 1.00 0.00 N ATOM 43 CA ILE A 3 1.469 -0.864 -5.043 1.00 0.00 C ATOM 44 C ILE A 3 0.043 -0.604 -4.551 1.00 0.00 C ATOM 45 O ILE A 3 -0.392 -1.158 -3.561 1.00 0.00 O ATOM 46 CB ILE A 3 1.781 -2.357 -4.929 1.00 0.00 C ATOM 47 CG1 ILE A 3 3.204 -2.618 -5.425 1.00 0.00 C ATOM 48 CG2 ILE A 3 0.791 -3.156 -5.781 1.00 0.00 C ATOM 49 CD1 ILE A 3 3.867 -3.676 -4.540 1.00 0.00 C ATOM 0 H ILE A 3 2.425 -0.306 -3.219 1.00 0.00 H new ATOM 0 HA ILE A 3 1.553 -0.548 -6.083 1.00 0.00 H new ATOM 0 HB ILE A 3 1.694 -2.666 -3.887 1.00 0.00 H new ATOM 0 HG12 ILE A 3 3.183 -2.956 -6.461 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.783 -1.695 -5.403 1.00 0.00 H new ATOM 0 HG21 ILE A 3 1.015 -4.219 -5.698 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.224 -2.971 -5.429 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.876 -2.847 -6.823 1.00 0.00 H new ATOM 0 HD11 ILE A 3 4.881 -3.862 -4.893 1.00 0.00 H new ATOM 0 HD12 ILE A 3 3.901 -3.320 -3.510 1.00 0.00 H new ATOM 0 HD13 ILE A 3 3.292 -4.601 -4.585 1.00 0.00 H new ATOM 61 N ALA A 4 -0.688 0.228 -5.239 1.00 0.00 N ATOM 62 CA ALA A 4 -2.089 0.517 -4.819 1.00 0.00 C ATOM 63 C ALA A 4 -3.049 -0.322 -5.664 1.00 0.00 C ATOM 64 O ALA A 4 -3.300 -0.023 -6.814 1.00 0.00 O ATOM 65 CB ALA A 4 -2.388 2.003 -5.026 1.00 0.00 C ATOM 0 H ALA A 4 -0.376 0.721 -6.075 1.00 0.00 H new ATOM 0 HA ALA A 4 -2.216 0.268 -3.765 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -3.412 2.214 -4.719 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -1.699 2.599 -4.428 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -2.266 2.255 -6.079 1.00 0.00 H new ATOM 71 N ILE A 5 -3.583 -1.374 -5.106 1.00 0.00 N ATOM 72 CA ILE A 5 -4.520 -2.236 -5.883 1.00 0.00 C ATOM 73 C ILE A 5 -5.949 -1.707 -5.742 1.00 0.00 C ATOM 74 O ILE A 5 -6.475 -1.598 -4.652 1.00 0.00 O ATOM 75 CB ILE A 5 -4.452 -3.667 -5.350 1.00 0.00 C ATOM 76 CG1 ILE A 5 -2.988 -4.063 -5.141 1.00 0.00 C ATOM 77 CG2 ILE A 5 -5.098 -4.620 -6.357 1.00 0.00 C ATOM 78 CD1 ILE A 5 -2.906 -5.548 -4.785 1.00 0.00 C ATOM 0 H ILE A 5 -3.411 -1.674 -4.146 1.00 0.00 H new ATOM 0 HA ILE A 5 -4.234 -2.222 -6.935 1.00 0.00 H new ATOM 0 HB ILE A 5 -4.985 -3.726 -4.401 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -2.414 -3.863 -6.046 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -2.548 -3.463 -4.345 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -5.049 -5.640 -5.976 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -6.140 -4.339 -6.507 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -4.566 -4.561 -7.306 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -1.864 -5.829 -4.636 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -3.466 -5.734 -3.869 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -3.330 -6.140 -5.596 1.00 0.00 H new ATOM 90 N ALA A 6 -6.585 -1.387 -6.837 1.00 0.00 N ATOM 91 CA ALA A 6 -7.982 -0.875 -6.763 1.00 0.00 C ATOM 92 C ALA A 6 -8.912 -2.015 -6.342 1.00 0.00 C ATOM 93 O ALA A 6 -8.688 -3.162 -6.671 1.00 0.00 O ATOM 94 CB ALA A 6 -8.408 -0.349 -8.136 1.00 0.00 C ATOM 0 H ALA A 6 -6.197 -1.458 -7.778 1.00 0.00 H new ATOM 0 HA ALA A 6 -8.038 -0.066 -6.034 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -9.430 0.025 -8.081 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -7.742 0.459 -8.439 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -8.356 -1.156 -8.867 1.00 0.00 H new ATOM 100 N SER A 7 -9.952 -1.712 -5.614 1.00 0.00 N ATOM 101 CA SER A 7 -10.884 -2.788 -5.175 1.00 0.00 C ATOM 102 C SER A 7 -12.244 -2.183 -4.822 1.00 0.00 C ATOM 103 O SER A 7 -12.456 -0.992 -4.938 1.00 0.00 O ATOM 104 CB SER A 7 -10.307 -3.487 -3.944 1.00 0.00 C ATOM 105 OG SER A 7 -10.536 -2.682 -2.796 1.00 0.00 O ATOM 0 H SER A 7 -10.196 -0.771 -5.306 1.00 0.00 H new ATOM 0 HA SER A 7 -11.008 -3.508 -5.983 1.00 0.00 H new ATOM 0 HB2 SER A 7 -10.772 -4.464 -3.815 1.00 0.00 H new ATOM 0 HB3 SER A 7 -9.238 -3.657 -4.076 1.00 0.00 H new ATOM 0 HG SER A 7 -10.098 -1.813 -2.913 1.00 0.00 H new ATOM 111 N SER A 8 -13.168 -2.997 -4.392 1.00 0.00 N ATOM 112 CA SER A 8 -14.515 -2.474 -4.029 1.00 0.00 C ATOM 113 C SER A 8 -14.931 -3.043 -2.671 1.00 0.00 C ATOM 114 O SER A 8 -16.070 -2.934 -2.264 1.00 0.00 O ATOM 115 CB SER A 8 -15.529 -2.898 -5.092 1.00 0.00 C ATOM 116 OG SER A 8 -15.716 -1.831 -6.013 1.00 0.00 O ATOM 0 H SER A 8 -13.048 -4.003 -4.276 1.00 0.00 H new ATOM 0 HA SER A 8 -14.481 -1.386 -3.973 1.00 0.00 H new ATOM 0 HB2 SER A 8 -15.176 -3.787 -5.614 1.00 0.00 H new ATOM 0 HB3 SER A 8 -16.477 -3.160 -4.623 1.00 0.00 H new ATOM 0 HG SER A 8 -15.117 -1.951 -6.779 1.00 0.00 H new ATOM 122 N GLY A 9 -14.015 -3.651 -1.968 1.00 0.00 N ATOM 123 CA GLY A 9 -14.356 -4.228 -0.637 1.00 0.00 C ATOM 124 C GLY A 9 -13.121 -4.198 0.265 1.00 0.00 C ATOM 125 O GLY A 9 -12.043 -3.830 -0.156 1.00 0.00 O ATOM 0 H GLY A 9 -13.045 -3.773 -2.258 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -15.167 -3.661 -0.180 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -14.710 -5.252 -0.753 1.00 0.00 H new ATOM 129 N THR A 10 -13.269 -4.583 1.502 1.00 0.00 N ATOM 130 CA THR A 10 -12.104 -4.576 2.431 1.00 0.00 C ATOM 131 C THR A 10 -11.164 -5.732 2.079 1.00 0.00 C ATOM 132 O THR A 10 -9.961 -5.571 2.018 1.00 0.00 O ATOM 133 CB THR A 10 -12.597 -4.740 3.870 1.00 0.00 C ATOM 134 OG1 THR A 10 -13.742 -5.581 3.882 1.00 0.00 O ATOM 135 CG2 THR A 10 -12.960 -3.372 4.446 1.00 0.00 C ATOM 0 H THR A 10 -14.147 -4.903 1.910 1.00 0.00 H new ATOM 0 HA THR A 10 -11.570 -3.631 2.336 1.00 0.00 H new ATOM 0 HB THR A 10 -11.810 -5.188 4.476 1.00 0.00 H new ATOM 0 HG1 THR A 10 -14.059 -5.689 4.803 1.00 0.00 H new ATOM 0 HG21 THR A 10 -13.311 -3.490 5.471 1.00 0.00 H new ATOM 0 HG22 THR A 10 -12.081 -2.728 4.436 1.00 0.00 H new ATOM 0 HG23 THR A 10 -13.748 -2.921 3.843 1.00 0.00 H new ATOM 143 N ASP A 11 -11.702 -6.898 1.847 1.00 0.00 N ATOM 144 CA ASP A 11 -10.840 -8.063 1.500 1.00 0.00 C ATOM 145 C ASP A 11 -11.721 -9.278 1.205 1.00 0.00 C ATOM 146 O ASP A 11 -11.591 -9.918 0.181 1.00 0.00 O ATOM 147 CB ASP A 11 -9.910 -8.377 2.673 1.00 0.00 C ATOM 148 CG ASP A 11 -8.908 -9.456 2.257 1.00 0.00 C ATOM 149 OD1 ASP A 11 -9.347 -10.510 1.825 1.00 0.00 O ATOM 150 OD2 ASP A 11 -7.719 -9.210 2.376 1.00 0.00 O ATOM 0 H ASP A 11 -12.702 -7.094 1.883 1.00 0.00 H new ATOM 0 HA ASP A 11 -10.244 -7.825 0.619 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -9.382 -7.475 2.983 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -10.491 -8.717 3.530 1.00 0.00 H new ATOM 155 N LEU A 12 -12.620 -9.601 2.095 1.00 0.00 N ATOM 156 CA LEU A 12 -13.511 -10.772 1.862 1.00 0.00 C ATOM 157 C LEU A 12 -14.263 -10.579 0.544 1.00 0.00 C ATOM 158 O LEU A 12 -14.610 -11.528 -0.131 1.00 0.00 O ATOM 159 CB LEU A 12 -14.514 -10.888 3.012 1.00 0.00 C ATOM 160 CG LEU A 12 -15.413 -12.104 2.787 1.00 0.00 C ATOM 161 CD1 LEU A 12 -15.753 -12.745 4.133 1.00 0.00 C ATOM 162 CD2 LEU A 12 -16.704 -11.663 2.093 1.00 0.00 C ATOM 0 H LEU A 12 -12.775 -9.105 2.972 1.00 0.00 H new ATOM 0 HA LEU A 12 -12.914 -11.682 1.812 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -13.986 -10.984 3.961 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -15.118 -9.983 3.074 1.00 0.00 H new ATOM 0 HG LEU A 12 -14.892 -12.828 2.161 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -16.394 -13.612 3.972 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -14.835 -13.060 4.628 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -16.273 -12.021 4.760 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -17.345 -12.530 1.932 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -17.224 -10.938 2.719 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -16.463 -11.207 1.133 1.00 0.00 H new ATOM 174 N GLY A 13 -14.519 -9.354 0.173 1.00 0.00 N ATOM 175 CA GLY A 13 -15.245 -9.096 -1.102 1.00 0.00 C ATOM 176 C GLY A 13 -14.398 -8.187 -1.995 1.00 0.00 C ATOM 177 O GLY A 13 -14.892 -7.566 -2.915 1.00 0.00 O ATOM 0 H GLY A 13 -14.256 -8.520 0.699 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -15.451 -10.037 -1.613 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -16.208 -8.628 -0.897 1.00 0.00 H new ATOM 181 N SER A 14 -13.122 -8.105 -1.730 1.00 0.00 N ATOM 182 CA SER A 14 -12.241 -7.239 -2.560 1.00 0.00 C ATOM 183 C SER A 14 -11.947 -7.935 -3.891 1.00 0.00 C ATOM 184 O SER A 14 -10.901 -8.522 -4.077 1.00 0.00 O ATOM 185 CB SER A 14 -10.929 -6.986 -1.817 1.00 0.00 C ATOM 186 OG SER A 14 -10.244 -8.219 -1.639 1.00 0.00 O ATOM 0 H SER A 14 -12.652 -8.602 -0.973 1.00 0.00 H new ATOM 0 HA SER A 14 -12.741 -6.289 -2.750 1.00 0.00 H new ATOM 0 HB2 SER A 14 -10.308 -6.290 -2.380 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.129 -6.525 -0.850 1.00 0.00 H new ATOM 0 HG SER A 14 -10.111 -8.648 -2.510 1.00 0.00 H new ATOM 192 N GLU A 15 -12.865 -7.872 -4.817 1.00 0.00 N ATOM 193 CA GLU A 15 -12.644 -8.530 -6.138 1.00 0.00 C ATOM 194 C GLU A 15 -11.706 -7.673 -6.993 1.00 0.00 C ATOM 195 O GLU A 15 -11.454 -7.974 -8.142 1.00 0.00 O ATOM 196 CB GLU A 15 -13.984 -8.686 -6.856 1.00 0.00 C ATOM 197 CG GLU A 15 -13.992 -9.995 -7.646 1.00 0.00 C ATOM 198 CD GLU A 15 -15.428 -10.508 -7.770 1.00 0.00 C ATOM 199 OE1 GLU A 15 -16.195 -9.893 -8.492 1.00 0.00 O ATOM 200 OE2 GLU A 15 -15.735 -11.507 -7.141 1.00 0.00 O ATOM 0 H GLU A 15 -13.760 -7.393 -4.716 1.00 0.00 H new ATOM 0 HA GLU A 15 -12.194 -9.510 -5.982 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -14.799 -8.681 -6.132 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -14.149 -7.843 -7.527 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -13.564 -9.837 -8.636 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -13.371 -10.738 -7.145 1.00 0.00 H new ATOM 207 N VAL A 16 -11.194 -6.604 -6.448 1.00 0.00 N ATOM 208 CA VAL A 16 -10.281 -5.729 -7.236 1.00 0.00 C ATOM 209 C VAL A 16 -11.103 -4.914 -8.237 1.00 0.00 C ATOM 210 O VAL A 16 -10.568 -4.290 -9.133 1.00 0.00 O ATOM 211 CB VAL A 16 -9.267 -6.593 -7.989 1.00 0.00 C ATOM 212 CG1 VAL A 16 -8.056 -5.739 -8.370 1.00 0.00 C ATOM 213 CG2 VAL A 16 -8.814 -7.745 -7.090 1.00 0.00 C ATOM 0 H VAL A 16 -11.369 -6.299 -5.491 1.00 0.00 H new ATOM 0 HA VAL A 16 -9.750 -5.055 -6.564 1.00 0.00 H new ATOM 0 HB VAL A 16 -9.729 -6.995 -8.891 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -7.332 -6.353 -8.907 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -8.378 -4.916 -9.008 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -7.594 -5.339 -7.467 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -8.092 -8.362 -7.625 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -8.351 -7.343 -6.189 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -9.676 -8.353 -6.815 1.00 0.00 H new ATOM 223 N SER A 17 -12.400 -4.912 -8.089 1.00 0.00 N ATOM 224 CA SER A 17 -13.258 -4.137 -9.028 1.00 0.00 C ATOM 225 C SER A 17 -13.062 -4.657 -10.453 1.00 0.00 C ATOM 226 O SER A 17 -12.111 -5.353 -10.747 1.00 0.00 O ATOM 227 CB SER A 17 -12.869 -2.658 -8.970 1.00 0.00 C ATOM 228 OG SER A 17 -13.991 -1.896 -8.544 1.00 0.00 O ATOM 0 H SER A 17 -12.902 -5.414 -7.357 1.00 0.00 H new ATOM 0 HA SER A 17 -14.303 -4.253 -8.741 1.00 0.00 H new ATOM 0 HB2 SER A 17 -12.035 -2.516 -8.282 1.00 0.00 H new ATOM 0 HB3 SER A 17 -12.535 -2.319 -9.951 1.00 0.00 H new ATOM 0 HG SER A 17 -13.945 -0.999 -8.936 1.00 0.00 H new ATOM 234 N ARG A 18 -13.957 -4.322 -11.342 1.00 0.00 N ATOM 235 CA ARG A 18 -13.826 -4.790 -12.750 1.00 0.00 C ATOM 236 C ARG A 18 -13.611 -3.582 -13.662 1.00 0.00 C ATOM 237 O ARG A 18 -12.773 -3.595 -14.542 1.00 0.00 O ATOM 238 CB ARG A 18 -15.103 -5.523 -13.167 1.00 0.00 C ATOM 239 CG ARG A 18 -14.734 -6.822 -13.885 1.00 0.00 C ATOM 240 CD ARG A 18 -14.499 -7.926 -12.854 1.00 0.00 C ATOM 241 NE ARG A 18 -15.232 -9.156 -13.265 1.00 0.00 N ATOM 242 CZ ARG A 18 -15.679 -9.981 -12.360 1.00 0.00 C ATOM 243 NH1 ARG A 18 -14.843 -10.605 -11.575 1.00 0.00 N ATOM 244 NH2 ARG A 18 -16.963 -10.183 -12.238 1.00 0.00 N ATOM 0 H ARG A 18 -14.775 -3.743 -11.153 1.00 0.00 H new ATOM 0 HA ARG A 18 -12.977 -5.469 -12.833 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -15.713 -5.740 -12.290 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -15.701 -4.890 -13.823 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -15.532 -7.112 -14.568 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -13.837 -6.675 -14.487 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -13.433 -8.137 -12.768 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -14.839 -7.599 -11.871 1.00 0.00 H new ATOM 0 HE ARG A 18 -15.384 -9.353 -14.254 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -13.840 -10.447 -11.670 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -15.193 -11.250 -10.867 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -17.616 -9.695 -12.851 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -17.313 -10.829 -11.530 1.00 0.00 H new ATOM 258 N PHE A 19 -14.361 -2.536 -13.456 1.00 0.00 N ATOM 259 CA PHE A 19 -14.203 -1.323 -14.305 1.00 0.00 C ATOM 260 C PHE A 19 -13.549 -0.213 -13.481 1.00 0.00 C ATOM 261 O PHE A 19 -14.207 0.692 -13.007 1.00 0.00 O ATOM 262 CB PHE A 19 -15.578 -0.859 -14.792 1.00 0.00 C ATOM 263 CG PHE A 19 -16.332 -2.033 -15.369 1.00 0.00 C ATOM 264 CD1 PHE A 19 -15.843 -2.688 -16.508 1.00 0.00 C ATOM 265 CD2 PHE A 19 -17.520 -2.468 -14.766 1.00 0.00 C ATOM 266 CE1 PHE A 19 -16.543 -3.777 -17.043 1.00 0.00 C ATOM 267 CE2 PHE A 19 -18.219 -3.558 -15.302 1.00 0.00 C ATOM 268 CZ PHE A 19 -17.731 -4.212 -16.441 1.00 0.00 C ATOM 0 H PHE A 19 -15.079 -2.469 -12.734 1.00 0.00 H new ATOM 0 HA PHE A 19 -13.576 -1.556 -15.165 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -16.140 -0.423 -13.966 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -15.464 -0.080 -15.546 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -14.927 -2.353 -16.973 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -17.897 -1.963 -13.889 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -16.167 -4.282 -17.920 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -19.134 -3.894 -14.837 1.00 0.00 H new ATOM 0 HZ PHE A 19 -18.270 -5.051 -16.855 1.00 0.00 H new ATOM 278 N PHE A 20 -12.257 -0.277 -13.303 1.00 0.00 N ATOM 279 CA PHE A 20 -11.557 0.770 -12.506 1.00 0.00 C ATOM 280 C PHE A 20 -12.101 2.149 -12.882 1.00 0.00 C ATOM 281 O PHE A 20 -12.121 2.526 -14.037 1.00 0.00 O ATOM 282 CB PHE A 20 -10.057 0.718 -12.801 1.00 0.00 C ATOM 283 CG PHE A 20 -9.332 1.678 -11.890 1.00 0.00 C ATOM 284 CD1 PHE A 20 -9.355 3.052 -12.159 1.00 0.00 C ATOM 285 CD2 PHE A 20 -8.637 1.194 -10.773 1.00 0.00 C ATOM 286 CE1 PHE A 20 -8.683 3.943 -11.313 1.00 0.00 C ATOM 287 CE2 PHE A 20 -7.964 2.085 -9.927 1.00 0.00 C ATOM 288 CZ PHE A 20 -7.987 3.461 -10.196 1.00 0.00 C ATOM 0 H PHE A 20 -11.655 -1.011 -13.676 1.00 0.00 H new ATOM 0 HA PHE A 20 -11.726 0.590 -11.444 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -9.681 -0.294 -12.653 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -9.871 0.978 -13.843 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -9.891 3.425 -13.019 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -8.620 0.134 -10.565 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -8.701 5.003 -11.521 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -7.427 1.712 -9.067 1.00 0.00 H new ATOM 0 HZ PHE A 20 -7.469 4.148 -9.543 1.00 0.00 H new ATOM 298 N GLY A 21 -12.544 2.906 -11.915 1.00 0.00 N ATOM 299 CA GLY A 21 -13.086 4.261 -12.220 1.00 0.00 C ATOM 300 C GLY A 21 -13.529 4.943 -10.924 1.00 0.00 C ATOM 301 O GLY A 21 -12.960 5.933 -10.507 1.00 0.00 O ATOM 0 H GLY A 21 -12.554 2.645 -10.929 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -12.326 4.863 -12.718 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -13.929 4.180 -12.906 1.00 0.00 H new ATOM 305 N ARG A 22 -14.542 4.426 -10.285 1.00 0.00 N ATOM 306 CA ARG A 22 -15.020 5.051 -9.018 1.00 0.00 C ATOM 307 C ARG A 22 -14.841 4.068 -7.860 1.00 0.00 C ATOM 308 O ARG A 22 -15.408 4.234 -6.799 1.00 0.00 O ATOM 309 CB ARG A 22 -16.501 5.411 -9.160 1.00 0.00 C ATOM 310 CG ARG A 22 -16.776 5.878 -10.591 1.00 0.00 C ATOM 311 CD ARG A 22 -18.054 6.715 -10.620 1.00 0.00 C ATOM 312 NE ARG A 22 -18.022 7.631 -11.795 1.00 0.00 N ATOM 313 CZ ARG A 22 -18.589 8.805 -11.724 1.00 0.00 C ATOM 314 NH1 ARG A 22 -18.468 9.523 -10.640 1.00 0.00 N ATOM 315 NH2 ARG A 22 -19.275 9.260 -12.735 1.00 0.00 N ATOM 0 H ARG A 22 -15.059 3.599 -10.584 1.00 0.00 H new ATOM 0 HA ARG A 22 -14.442 5.953 -8.816 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -17.121 4.547 -8.922 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -16.765 6.197 -8.452 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -15.936 6.466 -10.960 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -16.878 5.017 -11.252 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -18.926 6.064 -10.677 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -18.145 7.291 -9.699 1.00 0.00 H new ATOM 0 HE ARG A 22 -17.557 7.341 -12.655 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -17.931 9.167 -9.850 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -18.911 10.440 -10.584 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -19.369 8.699 -13.582 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -19.718 10.177 -12.679 1.00 0.00 H new ATOM 329 N ALA A 23 -14.054 3.045 -8.054 1.00 0.00 N ATOM 330 CA ALA A 23 -13.836 2.054 -6.962 1.00 0.00 C ATOM 331 C ALA A 23 -13.603 2.794 -5.638 1.00 0.00 C ATOM 332 O ALA A 23 -12.540 3.342 -5.423 1.00 0.00 O ATOM 333 CB ALA A 23 -12.608 1.203 -7.289 1.00 0.00 C ATOM 0 H ALA A 23 -13.553 2.853 -8.921 1.00 0.00 H new ATOM 0 HA ALA A 23 -14.713 1.413 -6.871 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -12.446 0.477 -6.492 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -12.769 0.678 -8.231 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -11.733 1.846 -7.377 1.00 0.00 H new ATOM 339 N PRO A 24 -14.604 2.791 -4.791 1.00 0.00 N ATOM 340 CA PRO A 24 -14.537 3.456 -3.476 1.00 0.00 C ATOM 341 C PRO A 24 -13.798 2.578 -2.459 1.00 0.00 C ATOM 342 O PRO A 24 -14.211 2.445 -1.325 1.00 0.00 O ATOM 343 CB PRO A 24 -16.008 3.614 -3.081 1.00 0.00 C ATOM 344 CG PRO A 24 -16.793 2.546 -3.882 1.00 0.00 C ATOM 345 CD PRO A 24 -15.898 2.134 -5.067 1.00 0.00 C ATOM 0 HA PRO A 24 -13.998 4.403 -3.507 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -16.140 3.470 -2.009 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -16.367 4.616 -3.314 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -17.025 1.685 -3.255 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -17.742 2.948 -4.236 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -15.790 1.051 -5.126 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -16.318 2.465 -6.017 1.00 0.00 H new ATOM 353 N TYR A 25 -12.707 1.978 -2.855 1.00 0.00 N ATOM 354 CA TYR A 25 -11.943 1.114 -1.914 1.00 0.00 C ATOM 355 C TYR A 25 -10.512 0.954 -2.431 1.00 0.00 C ATOM 356 O TYR A 25 -10.119 -0.104 -2.884 1.00 0.00 O ATOM 357 CB TYR A 25 -12.609 -0.262 -1.826 1.00 0.00 C ATOM 358 CG TYR A 25 -13.679 -0.240 -0.761 1.00 0.00 C ATOM 359 CD1 TYR A 25 -13.319 -0.266 0.593 1.00 0.00 C ATOM 360 CD2 TYR A 25 -15.031 -0.197 -1.126 1.00 0.00 C ATOM 361 CE1 TYR A 25 -14.312 -0.248 1.582 1.00 0.00 C ATOM 362 CE2 TYR A 25 -16.024 -0.179 -0.137 1.00 0.00 C ATOM 363 CZ TYR A 25 -15.665 -0.204 1.217 1.00 0.00 C ATOM 364 OH TYR A 25 -16.642 -0.188 2.190 1.00 0.00 O ATOM 0 H TYR A 25 -12.312 2.051 -3.793 1.00 0.00 H new ATOM 0 HA TYR A 25 -11.929 1.572 -0.925 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -13.045 -0.528 -2.789 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -11.865 -1.023 -1.592 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -12.277 -0.300 0.874 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -15.308 -0.178 -2.170 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -14.035 -0.268 2.626 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -17.066 -0.146 -0.419 1.00 0.00 H new ATOM 0 HH TYR A 25 -17.525 -0.156 1.766 1.00 0.00 H new ATOM 374 N PHE A 26 -9.731 1.998 -2.374 1.00 0.00 N ATOM 375 CA PHE A 26 -8.329 1.907 -2.869 1.00 0.00 C ATOM 376 C PHE A 26 -7.450 1.237 -1.813 1.00 0.00 C ATOM 377 O PHE A 26 -7.444 1.620 -0.660 1.00 0.00 O ATOM 378 CB PHE A 26 -7.797 3.313 -3.152 1.00 0.00 C ATOM 379 CG PHE A 26 -8.274 3.771 -4.509 1.00 0.00 C ATOM 380 CD1 PHE A 26 -7.701 3.235 -5.670 1.00 0.00 C ATOM 381 CD2 PHE A 26 -9.288 4.733 -4.607 1.00 0.00 C ATOM 382 CE1 PHE A 26 -8.144 3.660 -6.930 1.00 0.00 C ATOM 383 CE2 PHE A 26 -9.729 5.158 -5.867 1.00 0.00 C ATOM 384 CZ PHE A 26 -9.158 4.622 -7.029 1.00 0.00 C ATOM 0 H PHE A 26 -10.003 2.910 -2.006 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.309 1.315 -3.784 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.140 4.004 -2.382 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -6.708 3.314 -3.119 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.918 2.495 -5.594 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -9.729 5.146 -3.712 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -7.704 3.246 -7.825 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -10.510 5.900 -5.943 1.00 0.00 H new ATOM 0 HZ PHE A 26 -9.499 4.950 -8.000 1.00 0.00 H new ATOM 394 N MET A 27 -6.701 0.241 -2.200 1.00 0.00 N ATOM 395 CA MET A 27 -5.816 -0.451 -1.221 1.00 0.00 C ATOM 396 C MET A 27 -4.373 0.004 -1.440 1.00 0.00 C ATOM 397 O MET A 27 -3.709 -0.429 -2.361 1.00 0.00 O ATOM 398 CB MET A 27 -5.915 -1.964 -1.428 1.00 0.00 C ATOM 399 CG MET A 27 -5.500 -2.684 -0.143 1.00 0.00 C ATOM 400 SD MET A 27 -5.534 -4.472 -0.418 1.00 0.00 S ATOM 401 CE MET A 27 -6.719 -4.882 0.888 1.00 0.00 C ATOM 0 H MET A 27 -6.664 -0.123 -3.152 1.00 0.00 H new ATOM 0 HA MET A 27 -6.126 -0.205 -0.205 1.00 0.00 H new ATOM 0 HB2 MET A 27 -6.935 -2.239 -1.698 1.00 0.00 H new ATOM 0 HB3 MET A 27 -5.273 -2.272 -2.253 1.00 0.00 H new ATOM 0 HG2 MET A 27 -4.500 -2.370 0.156 1.00 0.00 H new ATOM 0 HG3 MET A 27 -6.175 -2.417 0.671 1.00 0.00 H new ATOM 0 HE1 MET A 27 -6.891 -5.958 0.899 1.00 0.00 H new ATOM 0 HE2 MET A 27 -6.320 -4.569 1.853 1.00 0.00 H new ATOM 0 HE3 MET A 27 -7.661 -4.366 0.700 1.00 0.00 H new ATOM 411 N ILE A 28 -3.878 0.876 -0.603 1.00 0.00 N ATOM 412 CA ILE A 28 -2.477 1.355 -0.770 1.00 0.00 C ATOM 413 C ILE A 28 -1.530 0.453 0.022 1.00 0.00 C ATOM 414 O ILE A 28 -1.606 0.369 1.231 1.00 0.00 O ATOM 415 CB ILE A 28 -2.367 2.793 -0.257 1.00 0.00 C ATOM 416 CG1 ILE A 28 -3.652 3.553 -0.593 1.00 0.00 C ATOM 417 CG2 ILE A 28 -1.177 3.484 -0.925 1.00 0.00 C ATOM 418 CD1 ILE A 28 -3.901 3.493 -2.101 1.00 0.00 C ATOM 0 H ILE A 28 -4.383 1.276 0.188 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.205 1.324 -1.825 1.00 0.00 H new ATOM 0 HB ILE A 28 -2.221 2.783 0.823 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -4.495 3.118 -0.057 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -3.569 4.590 -0.268 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -1.099 4.508 -0.560 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -0.261 2.943 -0.687 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -1.322 3.494 -2.005 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -4.816 4.034 -2.340 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -3.062 3.949 -2.627 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -4.003 2.453 -2.412 1.00 0.00 H new ATOM 430 N VAL A 29 -0.641 -0.226 -0.650 1.00 0.00 N ATOM 431 CA VAL A 29 0.306 -1.125 0.069 1.00 0.00 C ATOM 432 C VAL A 29 1.743 -0.660 -0.173 1.00 0.00 C ATOM 433 O VAL A 29 2.026 0.058 -1.112 1.00 0.00 O ATOM 434 CB VAL A 29 0.141 -2.555 -0.447 1.00 0.00 C ATOM 435 CG1 VAL A 29 0.798 -3.530 0.532 1.00 0.00 C ATOM 436 CG2 VAL A 29 -1.349 -2.883 -0.568 1.00 0.00 C ATOM 0 H VAL A 29 -0.529 -0.197 -1.663 1.00 0.00 H new ATOM 0 HA VAL A 29 0.092 -1.094 1.137 1.00 0.00 H new ATOM 0 HB VAL A 29 0.616 -2.646 -1.424 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.680 -4.549 0.164 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.859 -3.296 0.621 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.323 -3.440 1.509 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.469 -3.902 -0.936 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.822 -2.792 0.410 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -1.819 -2.189 -1.264 1.00 0.00 H new ATOM 446 N GLU A 30 2.653 -1.064 0.670 1.00 0.00 N ATOM 447 CA GLU A 30 4.073 -0.648 0.494 1.00 0.00 C ATOM 448 C GLU A 30 4.990 -1.837 0.791 1.00 0.00 C ATOM 449 O GLU A 30 5.486 -1.990 1.890 1.00 0.00 O ATOM 450 CB GLU A 30 4.394 0.497 1.457 1.00 0.00 C ATOM 451 CG GLU A 30 5.652 1.227 0.984 1.00 0.00 C ATOM 452 CD GLU A 30 6.694 1.226 2.103 1.00 0.00 C ATOM 453 OE1 GLU A 30 7.190 0.157 2.424 1.00 0.00 O ATOM 454 OE2 GLU A 30 6.981 2.293 2.619 1.00 0.00 O ATOM 0 H GLU A 30 2.474 -1.665 1.474 1.00 0.00 H new ATOM 0 HA GLU A 30 4.230 -0.313 -0.531 1.00 0.00 H new ATOM 0 HB2 GLU A 30 3.555 1.191 1.505 1.00 0.00 H new ATOM 0 HB3 GLU A 30 4.544 0.108 2.464 1.00 0.00 H new ATOM 0 HG2 GLU A 30 6.056 0.740 0.096 1.00 0.00 H new ATOM 0 HG3 GLU A 30 5.407 2.251 0.702 1.00 0.00 H new ATOM 461 N MET A 31 5.219 -2.680 -0.178 1.00 0.00 N ATOM 462 CA MET A 31 6.103 -3.857 0.052 1.00 0.00 C ATOM 463 C MET A 31 7.535 -3.510 -0.361 1.00 0.00 C ATOM 464 O MET A 31 7.761 -2.847 -1.354 1.00 0.00 O ATOM 465 CB MET A 31 5.605 -5.039 -0.783 1.00 0.00 C ATOM 466 CG MET A 31 6.433 -6.282 -0.455 1.00 0.00 C ATOM 467 SD MET A 31 6.440 -7.397 -1.882 1.00 0.00 S ATOM 468 CE MET A 31 4.647 -7.587 -2.028 1.00 0.00 C ATOM 0 H MET A 31 4.832 -2.605 -1.119 1.00 0.00 H new ATOM 0 HA MET A 31 6.084 -4.123 1.109 1.00 0.00 H new ATOM 0 HB2 MET A 31 4.551 -5.226 -0.575 1.00 0.00 H new ATOM 0 HB3 MET A 31 5.684 -4.806 -1.845 1.00 0.00 H new ATOM 0 HG2 MET A 31 7.453 -5.995 -0.199 1.00 0.00 H new ATOM 0 HG3 MET A 31 6.017 -6.790 0.415 1.00 0.00 H new ATOM 0 HE1 MET A 31 4.336 -7.337 -3.042 1.00 0.00 H new ATOM 0 HE2 MET A 31 4.371 -8.618 -1.807 1.00 0.00 H new ATOM 0 HE3 MET A 31 4.152 -6.920 -1.322 1.00 0.00 H new ATOM 478 N LYS A 32 8.503 -3.953 0.393 1.00 0.00 N ATOM 479 CA LYS A 32 9.919 -3.646 0.044 1.00 0.00 C ATOM 480 C LYS A 32 10.420 -4.655 -0.991 1.00 0.00 C ATOM 481 O LYS A 32 10.387 -4.406 -2.181 1.00 0.00 O ATOM 482 CB LYS A 32 10.787 -3.737 1.302 1.00 0.00 C ATOM 483 CG LYS A 32 12.264 -3.664 0.910 1.00 0.00 C ATOM 484 CD LYS A 32 13.132 -3.757 2.166 1.00 0.00 C ATOM 485 CE LYS A 32 13.371 -5.226 2.514 1.00 0.00 C ATOM 486 NZ LYS A 32 14.642 -5.685 1.887 1.00 0.00 N ATOM 0 H LYS A 32 8.375 -4.514 1.235 1.00 0.00 H new ATOM 0 HA LYS A 32 9.980 -2.639 -0.369 1.00 0.00 H new ATOM 0 HB2 LYS A 32 10.541 -2.925 1.986 1.00 0.00 H new ATOM 0 HB3 LYS A 32 10.585 -4.670 1.829 1.00 0.00 H new ATOM 0 HG2 LYS A 32 12.510 -4.475 0.225 1.00 0.00 H new ATOM 0 HG3 LYS A 32 12.466 -2.731 0.384 1.00 0.00 H new ATOM 0 HD2 LYS A 32 14.084 -3.252 2.001 1.00 0.00 H new ATOM 0 HD3 LYS A 32 12.642 -3.250 2.998 1.00 0.00 H new ATOM 0 HE2 LYS A 32 13.421 -5.351 3.596 1.00 0.00 H new ATOM 0 HE3 LYS A 32 12.538 -5.834 2.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 14.737 -6.714 2.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 14.631 -5.455 0.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 15.446 -5.207 2.342 1.00 0.00 H new ATOM 500 N LYS A 33 10.887 -5.792 -0.549 1.00 0.00 N ATOM 501 CA LYS A 33 11.393 -6.813 -1.510 1.00 0.00 C ATOM 502 C LYS A 33 10.784 -8.178 -1.178 1.00 0.00 C ATOM 503 O LYS A 33 11.447 -9.194 -1.237 1.00 0.00 O ATOM 504 CB LYS A 33 12.917 -6.896 -1.405 1.00 0.00 C ATOM 505 CG LYS A 33 13.538 -6.642 -2.781 1.00 0.00 C ATOM 506 CD LYS A 33 14.370 -7.854 -3.201 1.00 0.00 C ATOM 507 CE LYS A 33 15.846 -7.460 -3.266 1.00 0.00 C ATOM 508 NZ LYS A 33 16.684 -8.687 -3.381 1.00 0.00 N ATOM 0 H LYS A 33 10.940 -6.057 0.435 1.00 0.00 H new ATOM 0 HA LYS A 33 11.111 -6.529 -2.524 1.00 0.00 H new ATOM 0 HB2 LYS A 33 13.283 -6.162 -0.688 1.00 0.00 H new ATOM 0 HB3 LYS A 33 13.214 -7.878 -1.036 1.00 0.00 H new ATOM 0 HG2 LYS A 33 12.755 -6.454 -3.515 1.00 0.00 H new ATOM 0 HG3 LYS A 33 14.165 -5.751 -2.749 1.00 0.00 H new ATOM 0 HD2 LYS A 33 14.231 -8.668 -2.490 1.00 0.00 H new ATOM 0 HD3 LYS A 33 14.037 -8.219 -4.173 1.00 0.00 H new ATOM 0 HE2 LYS A 33 16.021 -6.806 -4.120 1.00 0.00 H new ATOM 0 HE3 LYS A 33 16.123 -6.900 -2.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 17.688 -8.419 -3.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 16.524 -9.295 -2.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 16.425 -9.204 -4.245 1.00 0.00 H new ATOM 522 N GLY A 34 9.526 -8.210 -0.832 1.00 0.00 N ATOM 523 CA GLY A 34 8.879 -9.513 -0.499 1.00 0.00 C ATOM 524 C GLY A 34 8.361 -9.477 0.939 1.00 0.00 C ATOM 525 O GLY A 34 8.209 -10.498 1.579 1.00 0.00 O ATOM 0 H GLY A 34 8.919 -7.393 -0.765 1.00 0.00 H new ATOM 0 HA2 GLY A 34 8.057 -9.708 -1.187 1.00 0.00 H new ATOM 0 HA3 GLY A 34 9.595 -10.327 -0.618 1.00 0.00 H new ATOM 529 N ASN A 35 8.085 -8.309 1.451 1.00 0.00 N ATOM 530 CA ASN A 35 7.574 -8.209 2.847 1.00 0.00 C ATOM 531 C ASN A 35 6.666 -6.983 2.968 1.00 0.00 C ATOM 532 O ASN A 35 7.127 -5.859 2.987 1.00 0.00 O ATOM 533 CB ASN A 35 8.752 -8.071 3.813 1.00 0.00 C ATOM 534 CG ASN A 35 9.657 -9.298 3.697 1.00 0.00 C ATOM 535 OD1 ASN A 35 9.279 -10.385 4.086 1.00 0.00 O ATOM 536 ND2 ASN A 35 10.846 -9.170 3.174 1.00 0.00 N ATOM 0 H ASN A 35 8.191 -7.420 0.963 1.00 0.00 H new ATOM 0 HA ASN A 35 7.008 -9.107 3.094 1.00 0.00 H new ATOM 0 HB2 ASN A 35 9.317 -7.167 3.586 1.00 0.00 H new ATOM 0 HB3 ASN A 35 8.387 -7.971 4.835 1.00 0.00 H new ATOM 0 HD21 ASN A 35 11.457 -9.982 3.092 1.00 0.00 H new ATOM 0 HD22 ASN A 35 11.164 -8.258 2.847 1.00 0.00 H new ATOM 543 N ILE A 36 5.381 -7.189 3.046 1.00 0.00 N ATOM 544 CA ILE A 36 4.449 -6.033 3.163 1.00 0.00 C ATOM 545 C ILE A 36 4.665 -5.334 4.507 1.00 0.00 C ATOM 546 O ILE A 36 4.416 -5.895 5.556 1.00 0.00 O ATOM 547 CB ILE A 36 3.005 -6.527 3.073 1.00 0.00 C ATOM 548 CG1 ILE A 36 2.896 -7.582 1.969 1.00 0.00 C ATOM 549 CG2 ILE A 36 2.085 -5.350 2.743 1.00 0.00 C ATOM 550 CD1 ILE A 36 2.666 -8.958 2.599 1.00 0.00 C ATOM 0 H ILE A 36 4.936 -8.107 3.034 1.00 0.00 H new ATOM 0 HA ILE A 36 4.643 -5.330 2.353 1.00 0.00 H new ATOM 0 HB ILE A 36 2.710 -6.965 4.026 1.00 0.00 H new ATOM 0 HG12 ILE A 36 2.074 -7.336 1.296 1.00 0.00 H new ATOM 0 HG13 ILE A 36 3.806 -7.592 1.370 1.00 0.00 H new ATOM 0 HG21 ILE A 36 1.055 -5.700 2.678 1.00 0.00 H new ATOM 0 HG22 ILE A 36 2.163 -4.596 3.526 1.00 0.00 H new ATOM 0 HG23 ILE A 36 2.380 -4.914 1.789 1.00 0.00 H new ATOM 0 HD11 ILE A 36 2.588 -9.710 1.813 1.00 0.00 H new ATOM 0 HD12 ILE A 36 3.502 -9.203 3.254 1.00 0.00 H new ATOM 0 HD13 ILE A 36 1.743 -8.943 3.179 1.00 0.00 H new ATOM 562 N GLU A 37 5.124 -4.114 4.483 1.00 0.00 N ATOM 563 CA GLU A 37 5.353 -3.377 5.756 1.00 0.00 C ATOM 564 C GLU A 37 4.513 -2.098 5.758 1.00 0.00 C ATOM 565 O GLU A 37 4.904 -1.087 6.307 1.00 0.00 O ATOM 566 CB GLU A 37 6.836 -3.017 5.876 1.00 0.00 C ATOM 567 CG GLU A 37 7.449 -3.758 7.065 1.00 0.00 C ATOM 568 CD GLU A 37 8.527 -4.722 6.566 1.00 0.00 C ATOM 569 OE1 GLU A 37 8.478 -5.084 5.402 1.00 0.00 O ATOM 570 OE2 GLU A 37 9.382 -5.084 7.357 1.00 0.00 O ATOM 0 H GLU A 37 5.351 -3.595 3.635 1.00 0.00 H new ATOM 0 HA GLU A 37 5.064 -4.004 6.600 1.00 0.00 H new ATOM 0 HB2 GLU A 37 7.361 -3.284 4.959 1.00 0.00 H new ATOM 0 HB3 GLU A 37 6.950 -1.941 6.007 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.881 -3.045 7.768 1.00 0.00 H new ATOM 0 HG3 GLU A 37 6.676 -4.307 7.603 1.00 0.00 H new ATOM 577 N SER A 38 3.360 -2.137 5.147 1.00 0.00 N ATOM 578 CA SER A 38 2.492 -0.927 5.111 1.00 0.00 C ATOM 579 C SER A 38 1.207 -1.247 4.344 1.00 0.00 C ATOM 580 O SER A 38 1.223 -1.447 3.146 1.00 0.00 O ATOM 581 CB SER A 38 3.233 0.212 4.411 1.00 0.00 C ATOM 582 OG SER A 38 2.979 1.430 5.099 1.00 0.00 O ATOM 0 H SER A 38 2.982 -2.956 4.671 1.00 0.00 H new ATOM 0 HA SER A 38 2.244 -0.626 6.129 1.00 0.00 H new ATOM 0 HB2 SER A 38 4.304 0.008 4.393 1.00 0.00 H new ATOM 0 HB3 SER A 38 2.906 0.291 3.374 1.00 0.00 H new ATOM 0 HG SER A 38 3.454 2.162 4.654 1.00 0.00 H new ATOM 588 N SER A 39 0.096 -1.300 5.024 1.00 0.00 N ATOM 589 CA SER A 39 -1.187 -1.609 4.331 1.00 0.00 C ATOM 590 C SER A 39 -2.293 -0.700 4.872 1.00 0.00 C ATOM 591 O SER A 39 -2.740 -0.848 5.991 1.00 0.00 O ATOM 592 CB SER A 39 -1.561 -3.070 4.582 1.00 0.00 C ATOM 593 OG SER A 39 -0.657 -3.632 5.524 1.00 0.00 O ATOM 0 H SER A 39 0.020 -1.143 6.029 1.00 0.00 H new ATOM 0 HA SER A 39 -1.071 -1.441 3.260 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.582 -3.137 4.957 1.00 0.00 H new ATOM 0 HB3 SER A 39 -1.527 -3.632 3.648 1.00 0.00 H new ATOM 0 HG SER A 39 -0.896 -4.568 5.688 1.00 0.00 H new ATOM 599 N GLU A 40 -2.735 0.239 4.083 1.00 0.00 N ATOM 600 CA GLU A 40 -3.810 1.158 4.548 1.00 0.00 C ATOM 601 C GLU A 40 -4.961 1.149 3.539 1.00 0.00 C ATOM 602 O GLU A 40 -4.754 1.233 2.343 1.00 0.00 O ATOM 603 CB GLU A 40 -3.250 2.577 4.672 1.00 0.00 C ATOM 604 CG GLU A 40 -3.215 2.985 6.147 1.00 0.00 C ATOM 605 CD GLU A 40 -2.613 4.385 6.274 1.00 0.00 C ATOM 606 OE1 GLU A 40 -2.281 4.962 5.252 1.00 0.00 O ATOM 607 OE2 GLU A 40 -2.492 4.857 7.394 1.00 0.00 O ATOM 0 H GLU A 40 -2.398 0.410 3.136 1.00 0.00 H new ATOM 0 HA GLU A 40 -4.177 0.826 5.519 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -2.247 2.622 4.247 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -3.868 3.274 4.105 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.222 2.971 6.563 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -2.624 2.270 6.719 1.00 0.00 H new ATOM 614 N VAL A 41 -6.174 1.048 4.012 1.00 0.00 N ATOM 615 CA VAL A 41 -7.339 1.034 3.085 1.00 0.00 C ATOM 616 C VAL A 41 -8.008 2.410 3.093 1.00 0.00 C ATOM 617 O VAL A 41 -8.177 3.023 4.128 1.00 0.00 O ATOM 618 CB VAL A 41 -8.345 -0.023 3.543 1.00 0.00 C ATOM 619 CG1 VAL A 41 -9.283 -0.371 2.385 1.00 0.00 C ATOM 620 CG2 VAL A 41 -7.596 -1.283 3.985 1.00 0.00 C ATOM 0 H VAL A 41 -6.407 0.975 5.002 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.999 0.797 2.077 1.00 0.00 H new ATOM 0 HB VAL A 41 -8.926 0.368 4.378 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -10.000 -1.124 2.711 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -9.817 0.525 2.067 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -8.701 -0.762 1.550 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -8.313 -2.037 4.312 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.015 -1.673 3.149 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -6.926 -1.038 4.809 1.00 0.00 H new ATOM 630 N ILE A 42 -8.388 2.901 1.945 1.00 0.00 N ATOM 631 CA ILE A 42 -9.044 4.237 1.887 1.00 0.00 C ATOM 632 C ILE A 42 -10.238 4.178 0.931 1.00 0.00 C ATOM 633 O ILE A 42 -10.080 4.107 -0.270 1.00 0.00 O ATOM 634 CB ILE A 42 -8.038 5.275 1.385 1.00 0.00 C ATOM 635 CG1 ILE A 42 -8.740 6.625 1.220 1.00 0.00 C ATOM 636 CG2 ILE A 42 -7.473 4.826 0.037 1.00 0.00 C ATOM 637 CD1 ILE A 42 -7.942 7.707 1.949 1.00 0.00 C ATOM 0 H ILE A 42 -8.272 2.435 1.045 1.00 0.00 H new ATOM 0 HA ILE A 42 -9.390 4.517 2.882 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.225 5.373 2.105 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -8.829 6.874 0.163 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -9.752 6.572 1.621 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -6.756 5.565 -0.321 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -6.974 3.864 0.154 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -8.285 4.729 -0.684 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -8.442 8.669 1.832 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -7.876 7.459 3.008 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -6.939 7.766 1.527 1.00 0.00 H new ATOM 649 N GLU A 43 -11.431 4.205 1.459 1.00 0.00 N ATOM 650 CA GLU A 43 -12.636 4.148 0.582 1.00 0.00 C ATOM 651 C GLU A 43 -12.826 5.499 -0.109 1.00 0.00 C ATOM 652 O GLU A 43 -12.156 6.465 0.199 1.00 0.00 O ATOM 653 CB GLU A 43 -13.873 3.829 1.426 1.00 0.00 C ATOM 654 CG GLU A 43 -13.473 2.963 2.622 1.00 0.00 C ATOM 655 CD GLU A 43 -13.346 3.842 3.867 1.00 0.00 C ATOM 656 OE1 GLU A 43 -13.096 5.026 3.710 1.00 0.00 O ATOM 657 OE2 GLU A 43 -13.500 3.317 4.956 1.00 0.00 O ATOM 0 H GLU A 43 -11.624 4.264 2.459 1.00 0.00 H new ATOM 0 HA GLU A 43 -12.500 3.369 -0.169 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -14.336 4.753 1.773 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -14.614 3.308 0.820 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -14.219 2.185 2.787 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -12.527 2.460 2.421 1.00 0.00 H new ATOM 664 N ASN A 44 -13.737 5.575 -1.041 1.00 0.00 N ATOM 665 CA ASN A 44 -13.971 6.864 -1.750 1.00 0.00 C ATOM 666 C ASN A 44 -15.476 7.140 -1.829 1.00 0.00 C ATOM 667 O ASN A 44 -16.044 7.167 -2.902 1.00 0.00 O ATOM 668 CB ASN A 44 -13.392 6.780 -3.164 1.00 0.00 C ATOM 669 CG ASN A 44 -12.685 8.092 -3.506 1.00 0.00 C ATOM 670 OD1 ASN A 44 -13.289 9.146 -3.483 1.00 0.00 O ATOM 671 ND2 ASN A 44 -11.419 8.073 -3.824 1.00 0.00 N ATOM 0 H ASN A 44 -14.329 4.800 -1.341 1.00 0.00 H new ATOM 0 HA ASN A 44 -13.483 7.672 -1.205 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -12.691 5.948 -3.232 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -14.188 6.586 -3.883 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -10.938 8.943 -4.053 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -10.911 7.189 -3.843 1.00 0.00 H new ATOM 678 N PRO A 45 -16.075 7.339 -0.682 1.00 0.00 N ATOM 679 CA PRO A 45 -17.517 7.619 -0.576 1.00 0.00 C ATOM 680 C PRO A 45 -17.804 9.080 -0.935 1.00 0.00 C ATOM 681 O PRO A 45 -16.901 9.873 -1.112 1.00 0.00 O ATOM 682 CB PRO A 45 -17.827 7.350 0.899 1.00 0.00 C ATOM 683 CG PRO A 45 -16.486 7.488 1.659 1.00 0.00 C ATOM 684 CD PRO A 45 -15.368 7.303 0.616 1.00 0.00 C ATOM 0 HA PRO A 45 -18.123 7.015 -1.251 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -18.563 8.060 1.277 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -18.248 6.353 1.032 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -16.411 8.464 2.138 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -16.408 6.739 2.447 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -14.623 8.095 0.686 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -14.843 6.358 0.758 1.00 0.00 H new ATOM 692 N SER A 46 -19.053 9.441 -1.043 1.00 0.00 N ATOM 693 CA SER A 46 -19.393 10.849 -1.389 1.00 0.00 C ATOM 694 C SER A 46 -18.487 11.326 -2.526 1.00 0.00 C ATOM 695 O SER A 46 -18.092 12.475 -2.579 1.00 0.00 O ATOM 696 CB SER A 46 -19.185 11.739 -0.162 1.00 0.00 C ATOM 697 OG SER A 46 -20.428 11.923 0.502 1.00 0.00 O ATOM 0 H SER A 46 -19.852 8.822 -0.907 1.00 0.00 H new ATOM 0 HA SER A 46 -20.434 10.906 -1.706 1.00 0.00 H new ATOM 0 HB2 SER A 46 -18.463 11.282 0.514 1.00 0.00 H new ATOM 0 HB3 SER A 46 -18.774 12.703 -0.463 1.00 0.00 H new ATOM 0 HG SER A 46 -20.297 12.491 1.289 1.00 0.00 H new ATOM 703 N ALA A 47 -18.153 10.453 -3.436 1.00 0.00 N ATOM 704 CA ALA A 47 -17.272 10.855 -4.569 1.00 0.00 C ATOM 705 C ALA A 47 -18.086 11.655 -5.589 1.00 0.00 C ATOM 706 O ALA A 47 -17.542 12.363 -6.413 1.00 0.00 O ATOM 707 CB ALA A 47 -16.703 9.605 -5.240 1.00 0.00 C ATOM 0 H ALA A 47 -18.452 9.478 -3.444 1.00 0.00 H new ATOM 0 HA ALA A 47 -16.454 11.470 -4.193 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -16.059 9.898 -6.069 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -16.124 9.034 -4.514 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -17.520 8.990 -5.616 1.00 0.00 H new ATOM 713 N SER A 48 -19.385 11.549 -5.539 1.00 0.00 N ATOM 714 CA SER A 48 -20.232 12.305 -6.505 1.00 0.00 C ATOM 715 C SER A 48 -20.534 13.692 -5.939 1.00 0.00 C ATOM 716 O SER A 48 -19.888 14.665 -6.275 1.00 0.00 O ATOM 717 CB SER A 48 -21.542 11.550 -6.734 1.00 0.00 C ATOM 718 OG SER A 48 -22.596 12.485 -6.925 1.00 0.00 O ATOM 0 H SER A 48 -19.897 10.972 -4.872 1.00 0.00 H new ATOM 0 HA SER A 48 -19.702 12.407 -7.452 1.00 0.00 H new ATOM 0 HB2 SER A 48 -21.454 10.901 -7.605 1.00 0.00 H new ATOM 0 HB3 SER A 48 -21.760 10.909 -5.880 1.00 0.00 H new ATOM 0 HG SER A 48 -23.437 12.004 -7.074 1.00 0.00 H new ATOM 724 N ALA A 49 -21.511 13.792 -5.078 1.00 0.00 N ATOM 725 CA ALA A 49 -21.855 15.118 -4.488 1.00 0.00 C ATOM 726 C ALA A 49 -21.916 16.171 -5.597 1.00 0.00 C ATOM 727 O ALA A 49 -22.937 16.360 -6.229 1.00 0.00 O ATOM 728 CB ALA A 49 -20.789 15.511 -3.464 1.00 0.00 C ATOM 0 H ALA A 49 -22.086 13.013 -4.758 1.00 0.00 H new ATOM 0 HA ALA A 49 -22.825 15.057 -3.995 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -21.039 16.480 -3.032 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -20.749 14.761 -2.674 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -19.818 15.573 -3.955 1.00 0.00 H new ATOM 734 N SER A 50 -20.834 16.861 -5.839 1.00 0.00 N ATOM 735 CA SER A 50 -20.836 17.900 -6.906 1.00 0.00 C ATOM 736 C SER A 50 -19.624 17.696 -7.818 1.00 0.00 C ATOM 737 O SER A 50 -18.493 17.883 -7.415 1.00 0.00 O ATOM 738 CB SER A 50 -20.765 19.287 -6.266 1.00 0.00 C ATOM 739 OG SER A 50 -21.316 19.228 -4.957 1.00 0.00 O ATOM 0 H SER A 50 -19.949 16.749 -5.343 1.00 0.00 H new ATOM 0 HA SER A 50 -21.751 17.817 -7.493 1.00 0.00 H new ATOM 0 HB2 SER A 50 -19.731 19.628 -6.223 1.00 0.00 H new ATOM 0 HB3 SER A 50 -21.313 20.008 -6.872 1.00 0.00 H new ATOM 0 HG SER A 50 -21.271 20.115 -4.543 1.00 0.00 H new ATOM 745 N GLY A 51 -19.852 17.314 -9.044 1.00 0.00 N ATOM 746 CA GLY A 51 -18.713 17.099 -9.982 1.00 0.00 C ATOM 747 C GLY A 51 -18.507 15.599 -10.197 1.00 0.00 C ATOM 748 O GLY A 51 -18.675 14.803 -9.294 1.00 0.00 O ATOM 0 H GLY A 51 -20.777 17.141 -9.437 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -18.914 17.590 -10.934 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -17.805 17.548 -9.578 1.00 0.00 H new ATOM 752 N GLY A 52 -18.143 15.205 -11.387 1.00 0.00 N ATOM 753 CA GLY A 52 -17.926 13.756 -11.658 1.00 0.00 C ATOM 754 C GLY A 52 -16.463 13.400 -11.396 1.00 0.00 C ATOM 755 O GLY A 52 -15.604 13.601 -12.232 1.00 0.00 O ATOM 0 H GLY A 52 -17.987 15.824 -12.183 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -18.577 13.155 -11.022 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -18.188 13.525 -12.691 1.00 0.00 H new ATOM 759 N ALA A 53 -16.170 12.870 -10.239 1.00 0.00 N ATOM 760 CA ALA A 53 -14.761 12.502 -9.924 1.00 0.00 C ATOM 761 C ALA A 53 -14.641 10.979 -9.827 1.00 0.00 C ATOM 762 O ALA A 53 -15.072 10.373 -8.867 1.00 0.00 O ATOM 763 CB ALA A 53 -14.357 13.131 -8.590 1.00 0.00 C ATOM 0 H ALA A 53 -16.845 12.676 -9.499 1.00 0.00 H new ATOM 0 HA ALA A 53 -14.104 12.869 -10.713 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -13.326 12.862 -8.358 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -14.443 14.215 -8.658 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -15.014 12.764 -7.801 1.00 0.00 H new ATOM 769 N GLY A 54 -14.060 10.357 -10.816 1.00 0.00 N ATOM 770 CA GLY A 54 -13.914 8.874 -10.781 1.00 0.00 C ATOM 771 C GLY A 54 -12.513 8.487 -11.259 1.00 0.00 C ATOM 772 O GLY A 54 -11.657 8.127 -10.474 1.00 0.00 O ATOM 0 H GLY A 54 -13.680 10.811 -11.647 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -14.079 8.506 -9.768 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -14.668 8.409 -11.416 1.00 0.00 H new ATOM 776 N ILE A 55 -12.271 8.559 -12.539 1.00 0.00 N ATOM 777 CA ILE A 55 -10.925 8.198 -13.065 1.00 0.00 C ATOM 778 C ILE A 55 -9.937 9.321 -12.744 1.00 0.00 C ATOM 779 O ILE A 55 -8.738 9.149 -12.829 1.00 0.00 O ATOM 780 CB ILE A 55 -11.007 7.996 -14.581 1.00 0.00 C ATOM 781 CG1 ILE A 55 -9.750 7.270 -15.066 1.00 0.00 C ATOM 782 CG2 ILE A 55 -11.112 9.355 -15.280 1.00 0.00 C ATOM 783 CD1 ILE A 55 -10.075 5.792 -15.295 1.00 0.00 C ATOM 0 H ILE A 55 -12.948 8.852 -13.243 1.00 0.00 H new ATOM 0 HA ILE A 55 -10.584 7.274 -12.598 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.889 7.400 -14.818 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -9.389 7.722 -15.990 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -8.952 7.369 -14.330 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -11.170 9.206 -16.358 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -12.008 9.873 -14.936 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -10.233 9.955 -15.043 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -9.181 5.272 -15.641 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -10.416 5.346 -14.361 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -10.859 5.704 -16.047 1.00 0.00 H new ATOM 795 N ARG A 56 -10.433 10.469 -12.370 1.00 0.00 N ATOM 796 CA ARG A 56 -9.526 11.601 -12.039 1.00 0.00 C ATOM 797 C ARG A 56 -8.843 11.326 -10.699 1.00 0.00 C ATOM 798 O ARG A 56 -7.882 11.974 -10.334 1.00 0.00 O ATOM 799 CB ARG A 56 -10.338 12.895 -11.945 1.00 0.00 C ATOM 800 CG ARG A 56 -9.724 13.954 -12.863 1.00 0.00 C ATOM 801 CD ARG A 56 -10.471 13.966 -14.199 1.00 0.00 C ATOM 802 NE ARG A 56 -10.093 15.185 -14.969 1.00 0.00 N ATOM 803 CZ ARG A 56 -8.996 15.196 -15.675 1.00 0.00 C ATOM 804 NH1 ARG A 56 -8.923 14.504 -16.779 1.00 0.00 N ATOM 805 NH2 ARG A 56 -7.971 15.899 -15.277 1.00 0.00 N ATOM 0 H ARG A 56 -11.429 10.671 -12.280 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.771 11.705 -12.818 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -11.373 12.708 -12.230 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -10.351 13.254 -10.916 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -9.782 14.936 -12.393 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -8.668 13.741 -13.027 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -10.228 13.071 -14.772 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -11.547 13.951 -14.026 1.00 0.00 H new ATOM 0 HE ARG A 56 -10.692 16.010 -14.944 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -9.724 13.954 -17.090 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -8.065 14.513 -17.331 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -8.028 16.440 -14.414 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -7.113 15.908 -15.829 1.00 0.00 H new ATOM 819 N THR A 57 -9.332 10.365 -9.962 1.00 0.00 N ATOM 820 CA THR A 57 -8.711 10.043 -8.646 1.00 0.00 C ATOM 821 C THR A 57 -7.299 9.503 -8.875 1.00 0.00 C ATOM 822 O THR A 57 -6.443 9.589 -8.017 1.00 0.00 O ATOM 823 CB THR A 57 -9.552 8.984 -7.929 1.00 0.00 C ATOM 824 OG1 THR A 57 -9.004 8.741 -6.641 1.00 0.00 O ATOM 825 CG2 THR A 57 -9.545 7.689 -8.742 1.00 0.00 C ATOM 0 H THR A 57 -10.135 9.789 -10.215 1.00 0.00 H new ATOM 0 HA THR A 57 -8.665 10.943 -8.033 1.00 0.00 H new ATOM 0 HB THR A 57 -10.577 9.340 -7.827 1.00 0.00 H new ATOM 0 HG1 THR A 57 -9.542 8.064 -6.179 1.00 0.00 H new ATOM 0 HG21 THR A 57 -10.144 6.935 -8.231 1.00 0.00 H new ATOM 0 HG22 THR A 57 -9.965 7.877 -9.730 1.00 0.00 H new ATOM 0 HG23 THR A 57 -8.521 7.330 -8.845 1.00 0.00 H new ATOM 833 N ALA A 58 -7.051 8.947 -10.028 1.00 0.00 N ATOM 834 CA ALA A 58 -5.696 8.401 -10.318 1.00 0.00 C ATOM 835 C ALA A 58 -4.644 9.485 -10.071 1.00 0.00 C ATOM 836 O ALA A 58 -3.602 9.235 -9.498 1.00 0.00 O ATOM 837 CB ALA A 58 -5.635 7.950 -11.779 1.00 0.00 C ATOM 0 H ALA A 58 -7.729 8.847 -10.783 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.497 7.551 -9.666 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -4.644 7.550 -11.995 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -6.384 7.178 -11.953 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.833 8.801 -12.431 1.00 0.00 H new ATOM 843 N GLN A 59 -4.910 10.690 -10.497 1.00 0.00 N ATOM 844 CA GLN A 59 -3.926 11.788 -10.283 1.00 0.00 C ATOM 845 C GLN A 59 -3.665 11.952 -8.785 1.00 0.00 C ATOM 846 O GLN A 59 -2.566 12.256 -8.366 1.00 0.00 O ATOM 847 CB GLN A 59 -4.488 13.095 -10.849 1.00 0.00 C ATOM 848 CG GLN A 59 -4.315 13.112 -12.369 1.00 0.00 C ATOM 849 CD GLN A 59 -4.163 14.556 -12.851 1.00 0.00 C ATOM 850 OE1 GLN A 59 -4.884 14.998 -13.723 1.00 0.00 O ATOM 851 NE2 GLN A 59 -3.248 15.316 -12.315 1.00 0.00 N ATOM 0 H GLN A 59 -5.765 10.961 -10.983 1.00 0.00 H new ATOM 0 HA GLN A 59 -2.993 11.544 -10.791 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -5.543 13.191 -10.592 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -3.973 13.947 -10.405 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -3.439 12.529 -12.652 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -5.176 12.646 -12.849 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -2.642 14.946 -11.583 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -3.138 16.281 -12.628 1.00 0.00 H new ATOM 860 N ILE A 60 -4.667 11.751 -7.975 1.00 0.00 N ATOM 861 CA ILE A 60 -4.477 11.894 -6.503 1.00 0.00 C ATOM 862 C ILE A 60 -3.665 10.709 -5.978 1.00 0.00 C ATOM 863 O ILE A 60 -2.885 10.838 -5.056 1.00 0.00 O ATOM 864 CB ILE A 60 -5.842 11.924 -5.813 1.00 0.00 C ATOM 865 CG1 ILE A 60 -6.662 13.096 -6.358 1.00 0.00 C ATOM 866 CG2 ILE A 60 -5.649 12.096 -4.305 1.00 0.00 C ATOM 867 CD1 ILE A 60 -7.957 13.229 -5.555 1.00 0.00 C ATOM 0 H ILE A 60 -5.610 11.494 -8.268 1.00 0.00 H new ATOM 0 HA ILE A 60 -3.944 12.821 -6.293 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.368 10.989 -6.007 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -6.085 14.019 -6.293 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -6.890 12.936 -7.412 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -6.622 12.117 -3.814 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -5.064 11.263 -3.916 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -5.123 13.031 -4.110 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -8.541 14.063 -5.943 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -8.535 12.309 -5.642 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -7.718 13.409 -4.507 1.00 0.00 H new ATOM 879 N ILE A 61 -3.841 9.554 -6.559 1.00 0.00 N ATOM 880 CA ILE A 61 -3.078 8.362 -6.095 1.00 0.00 C ATOM 881 C ILE A 61 -1.583 8.599 -6.321 1.00 0.00 C ATOM 882 O ILE A 61 -0.759 8.260 -5.497 1.00 0.00 O ATOM 883 CB ILE A 61 -3.528 7.130 -6.884 1.00 0.00 C ATOM 884 CG1 ILE A 61 -4.923 6.708 -6.414 1.00 0.00 C ATOM 885 CG2 ILE A 61 -2.545 5.982 -6.648 1.00 0.00 C ATOM 886 CD1 ILE A 61 -5.605 5.890 -7.512 1.00 0.00 C ATOM 0 H ILE A 61 -4.481 9.385 -7.335 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.264 8.198 -5.033 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.556 7.371 -7.947 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -4.848 6.119 -5.500 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -5.520 7.588 -6.177 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.867 5.106 -7.211 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.550 6.281 -6.979 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -2.516 5.740 -5.585 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -6.598 5.589 -7.178 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -5.693 6.495 -8.415 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -5.010 5.002 -7.727 1.00 0.00 H new ATOM 898 N ALA A 62 -1.227 9.183 -7.433 1.00 0.00 N ATOM 899 CA ALA A 62 0.213 9.444 -7.711 1.00 0.00 C ATOM 900 C ALA A 62 0.760 10.428 -6.674 1.00 0.00 C ATOM 901 O ALA A 62 1.946 10.476 -6.414 1.00 0.00 O ATOM 902 CB ALA A 62 0.365 10.040 -9.110 1.00 0.00 C ATOM 0 H ALA A 62 -1.872 9.491 -8.161 1.00 0.00 H new ATOM 0 HA ALA A 62 0.769 8.508 -7.655 1.00 0.00 H new ATOM 0 HB1 ALA A 62 1.419 10.230 -9.312 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -0.025 9.339 -9.848 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -0.191 10.976 -9.169 1.00 0.00 H new ATOM 908 N ASN A 63 -0.096 11.216 -6.082 1.00 0.00 N ATOM 909 CA ASN A 63 0.375 12.197 -5.064 1.00 0.00 C ATOM 910 C ASN A 63 0.701 11.465 -3.760 1.00 0.00 C ATOM 911 O ASN A 63 1.451 11.950 -2.936 1.00 0.00 O ATOM 912 CB ASN A 63 -0.726 13.230 -4.805 1.00 0.00 C ATOM 913 CG ASN A 63 -0.486 14.462 -5.680 1.00 0.00 C ATOM 914 OD1 ASN A 63 -0.955 15.540 -5.373 1.00 0.00 O ATOM 915 ND2 ASN A 63 0.229 14.347 -6.766 1.00 0.00 N ATOM 0 H ASN A 63 -1.100 11.223 -6.259 1.00 0.00 H new ATOM 0 HA ASN A 63 1.269 12.700 -5.432 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -1.703 12.799 -5.025 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -0.733 13.514 -3.753 1.00 0.00 H new ATOM 0 HD21 ASN A 63 0.394 15.162 -7.357 1.00 0.00 H new ATOM 0 HD22 ASN A 63 0.623 13.442 -7.024 1.00 0.00 H new ATOM 922 N ASN A 64 0.143 10.301 -3.566 1.00 0.00 N ATOM 923 CA ASN A 64 0.421 9.541 -2.314 1.00 0.00 C ATOM 924 C ASN A 64 1.769 8.827 -2.438 1.00 0.00 C ATOM 925 O ASN A 64 2.352 8.410 -1.456 1.00 0.00 O ATOM 926 CB ASN A 64 -0.683 8.506 -2.090 1.00 0.00 C ATOM 927 CG ASN A 64 -1.903 9.185 -1.466 1.00 0.00 C ATOM 928 OD1 ASN A 64 -1.953 10.395 -1.364 1.00 0.00 O ATOM 929 ND2 ASN A 64 -2.896 8.453 -1.042 1.00 0.00 N ATOM 0 H ASN A 64 -0.493 9.844 -4.220 1.00 0.00 H new ATOM 0 HA ASN A 64 0.451 10.231 -1.471 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -0.957 8.041 -3.037 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -0.323 7.711 -1.437 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -3.715 8.896 -0.625 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -2.854 7.437 -1.128 1.00 0.00 H new ATOM 936 N GLY A 65 2.266 8.680 -3.634 1.00 0.00 N ATOM 937 CA GLY A 65 3.575 7.990 -3.817 1.00 0.00 C ATOM 938 C GLY A 65 3.362 6.702 -4.614 1.00 0.00 C ATOM 939 O GLY A 65 4.295 6.112 -5.120 1.00 0.00 O ATOM 0 H GLY A 65 1.824 9.007 -4.493 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.273 8.643 -4.340 1.00 0.00 H new ATOM 0 HA3 GLY A 65 4.017 7.762 -2.847 1.00 0.00 H new ATOM 943 N VAL A 66 2.139 6.262 -4.725 1.00 0.00 N ATOM 944 CA VAL A 66 1.857 5.014 -5.488 1.00 0.00 C ATOM 945 C VAL A 66 2.641 5.020 -6.797 1.00 0.00 C ATOM 946 O VAL A 66 2.191 5.540 -7.800 1.00 0.00 O ATOM 947 CB VAL A 66 0.361 4.928 -5.792 1.00 0.00 C ATOM 948 CG1 VAL A 66 0.065 3.625 -6.534 1.00 0.00 C ATOM 949 CG2 VAL A 66 -0.427 4.959 -4.481 1.00 0.00 C ATOM 0 H VAL A 66 1.320 6.715 -4.319 1.00 0.00 H new ATOM 0 HA VAL A 66 2.159 4.153 -4.891 1.00 0.00 H new ATOM 0 HB VAL A 66 0.067 5.774 -6.414 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.002 3.564 -6.751 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.627 3.602 -7.468 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.358 2.778 -5.913 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.494 4.898 -4.696 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.133 4.113 -3.860 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.216 5.888 -3.952 1.00 0.00 H new ATOM 959 N LYS A 67 3.804 4.433 -6.801 1.00 0.00 N ATOM 960 CA LYS A 67 4.607 4.390 -8.048 1.00 0.00 C ATOM 961 C LYS A 67 4.058 3.278 -8.942 1.00 0.00 C ATOM 962 O LYS A 67 4.428 3.149 -10.093 1.00 0.00 O ATOM 963 CB LYS A 67 6.071 4.103 -7.708 1.00 0.00 C ATOM 964 CG LYS A 67 6.976 5.050 -8.498 1.00 0.00 C ATOM 965 CD LYS A 67 7.591 4.301 -9.681 1.00 0.00 C ATOM 966 CE LYS A 67 7.321 5.076 -10.973 1.00 0.00 C ATOM 967 NZ LYS A 67 8.615 5.403 -11.636 1.00 0.00 N ATOM 0 H LYS A 67 4.232 3.981 -5.993 1.00 0.00 H new ATOM 0 HA LYS A 67 4.546 5.348 -8.565 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.238 4.231 -6.639 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.314 3.068 -7.947 1.00 0.00 H new ATOM 0 HG2 LYS A 67 6.402 5.905 -8.854 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.763 5.441 -7.853 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.664 4.184 -9.532 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.168 3.299 -9.750 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.697 4.483 -11.642 1.00 0.00 H new ATOM 0 HE3 LYS A 67 6.772 5.991 -10.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 8.432 5.930 -12.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.195 5.985 -10.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.123 4.523 -11.860 1.00 0.00 H new ATOM 981 N ALA A 68 3.168 2.474 -8.419 1.00 0.00 N ATOM 982 CA ALA A 68 2.588 1.372 -9.237 1.00 0.00 C ATOM 983 C ALA A 68 1.093 1.257 -8.936 1.00 0.00 C ATOM 984 O ALA A 68 0.689 1.143 -7.797 1.00 0.00 O ATOM 985 CB ALA A 68 3.282 0.054 -8.886 1.00 0.00 C ATOM 0 H ALA A 68 2.820 2.534 -7.462 1.00 0.00 H new ATOM 0 HA ALA A 68 2.734 1.586 -10.296 1.00 0.00 H new ATOM 0 HB1 ALA A 68 2.857 -0.752 -9.485 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.349 0.138 -9.095 1.00 0.00 H new ATOM 0 HB3 ALA A 68 3.135 -0.164 -7.828 1.00 0.00 H new ATOM 991 N VAL A 69 0.267 1.291 -9.945 1.00 0.00 N ATOM 992 CA VAL A 69 -1.200 1.186 -9.707 1.00 0.00 C ATOM 993 C VAL A 69 -1.751 -0.053 -10.419 1.00 0.00 C ATOM 994 O VAL A 69 -1.556 -0.236 -11.603 1.00 0.00 O ATOM 995 CB VAL A 69 -1.894 2.437 -10.251 1.00 0.00 C ATOM 996 CG1 VAL A 69 -3.408 2.293 -10.083 1.00 0.00 C ATOM 997 CG2 VAL A 69 -1.412 3.665 -9.476 1.00 0.00 C ATOM 0 H VAL A 69 0.544 1.387 -10.922 1.00 0.00 H new ATOM 0 HA VAL A 69 -1.387 1.100 -8.637 1.00 0.00 H new ATOM 0 HB VAL A 69 -1.654 2.555 -11.308 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -3.903 3.183 -10.470 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -3.753 1.418 -10.633 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -3.647 2.175 -9.026 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -1.906 4.556 -9.863 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -1.653 3.546 -8.420 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.333 3.768 -9.593 1.00 0.00 H new ATOM 1007 N ILE A 70 -2.437 -0.902 -9.705 1.00 0.00 N ATOM 1008 CA ILE A 70 -3.002 -2.126 -10.339 1.00 0.00 C ATOM 1009 C ILE A 70 -4.487 -1.906 -10.631 1.00 0.00 C ATOM 1010 O ILE A 70 -5.282 -1.703 -9.734 1.00 0.00 O ATOM 1011 CB ILE A 70 -2.839 -3.315 -9.391 1.00 0.00 C ATOM 1012 CG1 ILE A 70 -1.351 -3.634 -9.227 1.00 0.00 C ATOM 1013 CG2 ILE A 70 -3.559 -4.535 -9.969 1.00 0.00 C ATOM 1014 CD1 ILE A 70 -1.186 -4.838 -8.298 1.00 0.00 C ATOM 0 H ILE A 70 -2.631 -0.801 -8.709 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.473 -2.331 -11.270 1.00 0.00 H new ATOM 0 HB ILE A 70 -3.269 -3.066 -8.421 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -0.905 -3.847 -10.198 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -0.826 -2.771 -8.818 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -3.442 -5.381 -9.292 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -4.619 -4.310 -10.088 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -3.130 -4.785 -10.940 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -0.126 -5.065 -8.181 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.617 -4.608 -7.324 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.697 -5.701 -8.726 1.00 0.00 H new ATOM 1026 N ALA A 71 -4.869 -1.940 -11.880 1.00 0.00 N ATOM 1027 CA ALA A 71 -6.302 -1.725 -12.225 1.00 0.00 C ATOM 1028 C ALA A 71 -6.659 -2.534 -13.473 1.00 0.00 C ATOM 1029 O ALA A 71 -5.814 -3.146 -14.096 1.00 0.00 O ATOM 1030 CB ALA A 71 -6.543 -0.240 -12.498 1.00 0.00 C ATOM 0 H ALA A 71 -4.251 -2.107 -12.674 1.00 0.00 H new ATOM 0 HA ALA A 71 -6.925 -2.050 -11.392 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -7.591 -0.082 -12.751 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -6.293 0.339 -11.609 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -5.917 0.083 -13.330 1.00 0.00 H new ATOM 1036 N SER A 72 -7.910 -2.539 -13.841 1.00 0.00 N ATOM 1037 CA SER A 72 -8.334 -3.303 -15.047 1.00 0.00 C ATOM 1038 C SER A 72 -9.430 -2.526 -15.781 1.00 0.00 C ATOM 1039 O SER A 72 -10.394 -3.091 -16.256 1.00 0.00 O ATOM 1040 CB SER A 72 -8.878 -4.667 -14.621 1.00 0.00 C ATOM 1041 OG SER A 72 -10.166 -4.499 -14.042 1.00 0.00 O ATOM 0 H SER A 72 -8.659 -2.045 -13.357 1.00 0.00 H new ATOM 0 HA SER A 72 -7.479 -3.443 -15.709 1.00 0.00 H new ATOM 0 HB2 SER A 72 -8.938 -5.333 -15.482 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.202 -5.133 -13.904 1.00 0.00 H new ATOM 0 HG SER A 72 -10.812 -4.268 -14.742 1.00 0.00 H new ATOM 1047 N SER A 73 -9.288 -1.231 -15.876 1.00 0.00 N ATOM 1048 CA SER A 73 -10.321 -0.417 -16.577 1.00 0.00 C ATOM 1049 C SER A 73 -10.585 -1.007 -17.966 1.00 0.00 C ATOM 1050 O SER A 73 -9.766 -1.728 -18.498 1.00 0.00 O ATOM 1051 CB SER A 73 -9.824 1.022 -16.723 1.00 0.00 C ATOM 1052 OG SER A 73 -8.486 1.008 -17.205 1.00 0.00 O ATOM 0 H SER A 73 -8.502 -0.703 -15.498 1.00 0.00 H new ATOM 0 HA SER A 73 -11.244 -0.427 -15.997 1.00 0.00 H new ATOM 0 HB2 SER A 73 -10.465 1.573 -17.411 1.00 0.00 H new ATOM 0 HB3 SER A 73 -9.872 1.535 -15.763 1.00 0.00 H new ATOM 0 HG SER A 73 -8.465 1.356 -18.121 1.00 0.00 H new ATOM 1058 N PRO A 74 -11.729 -0.677 -18.511 1.00 0.00 N ATOM 1059 CA PRO A 74 -12.141 -1.154 -19.843 1.00 0.00 C ATOM 1060 C PRO A 74 -11.423 -0.364 -20.943 1.00 0.00 C ATOM 1061 O PRO A 74 -11.151 -0.877 -22.010 1.00 0.00 O ATOM 1062 CB PRO A 74 -13.649 -0.882 -19.870 1.00 0.00 C ATOM 1063 CG PRO A 74 -13.912 0.224 -18.820 1.00 0.00 C ATOM 1064 CD PRO A 74 -12.715 0.204 -17.850 1.00 0.00 C ATOM 0 HA PRO A 74 -11.898 -2.202 -20.017 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -13.968 -0.560 -20.861 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -14.211 -1.785 -19.632 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -14.006 1.199 -19.299 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -14.845 0.039 -18.288 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -12.313 1.205 -17.693 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -13.001 -0.182 -16.872 1.00 0.00 H new ATOM 1072 N GLY A 75 -11.115 0.879 -20.691 1.00 0.00 N ATOM 1073 CA GLY A 75 -10.417 1.695 -21.723 1.00 0.00 C ATOM 1074 C GLY A 75 -9.048 2.137 -21.194 1.00 0.00 C ATOM 1075 O GLY A 75 -8.796 2.078 -20.007 1.00 0.00 O ATOM 0 H GLY A 75 -11.316 1.364 -19.816 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -10.294 1.115 -22.637 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.018 2.568 -21.978 1.00 0.00 H new ATOM 1079 N PRO A 76 -8.205 2.568 -22.099 1.00 0.00 N ATOM 1080 CA PRO A 76 -6.844 3.032 -21.768 1.00 0.00 C ATOM 1081 C PRO A 76 -6.868 4.471 -21.233 1.00 0.00 C ATOM 1082 O PRO A 76 -5.857 5.144 -21.198 1.00 0.00 O ATOM 1083 CB PRO A 76 -6.111 2.971 -23.111 1.00 0.00 C ATOM 1084 CG PRO A 76 -7.201 3.037 -24.208 1.00 0.00 C ATOM 1085 CD PRO A 76 -8.527 2.625 -23.540 1.00 0.00 C ATOM 0 HA PRO A 76 -6.370 2.431 -20.992 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -5.411 3.801 -23.209 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -5.531 2.052 -23.195 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -7.273 4.043 -24.622 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -6.960 2.368 -25.034 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.317 3.348 -23.743 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -8.876 1.660 -23.909 1.00 0.00 H new ATOM 1093 N ASN A 77 -8.010 4.952 -20.819 1.00 0.00 N ATOM 1094 CA ASN A 77 -8.084 6.345 -20.294 1.00 0.00 C ATOM 1095 C ASN A 77 -7.224 6.469 -19.034 1.00 0.00 C ATOM 1096 O ASN A 77 -6.390 7.345 -18.924 1.00 0.00 O ATOM 1097 CB ASN A 77 -9.538 6.681 -19.953 1.00 0.00 C ATOM 1098 CG ASN A 77 -10.453 6.170 -21.066 1.00 0.00 C ATOM 1099 OD1 ASN A 77 -11.574 5.771 -20.813 1.00 0.00 O ATOM 1100 ND2 ASN A 77 -10.022 6.164 -22.298 1.00 0.00 N ATOM 0 H ASN A 77 -8.893 4.441 -20.822 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.715 7.037 -21.051 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -9.814 6.225 -19.002 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -9.656 7.758 -19.836 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -10.625 5.825 -23.048 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -9.082 6.498 -22.511 1.00 0.00 H new ATOM 1107 N ALA A 78 -7.424 5.599 -18.081 1.00 0.00 N ATOM 1108 CA ALA A 78 -6.621 5.669 -16.827 1.00 0.00 C ATOM 1109 C ALA A 78 -5.138 5.471 -17.150 1.00 0.00 C ATOM 1110 O ALA A 78 -4.277 6.092 -16.559 1.00 0.00 O ATOM 1111 CB ALA A 78 -7.083 4.571 -15.867 1.00 0.00 C ATOM 0 H ALA A 78 -8.108 4.843 -18.117 1.00 0.00 H new ATOM 0 HA ALA A 78 -6.761 6.645 -16.363 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -6.497 4.620 -14.949 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.138 4.713 -15.632 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -6.943 3.596 -16.335 1.00 0.00 H new ATOM 1117 N PHE A 79 -4.832 4.608 -18.079 1.00 0.00 N ATOM 1118 CA PHE A 79 -3.404 4.370 -18.434 1.00 0.00 C ATOM 1119 C PHE A 79 -2.815 5.632 -19.065 1.00 0.00 C ATOM 1120 O PHE A 79 -1.632 5.892 -18.966 1.00 0.00 O ATOM 1121 CB PHE A 79 -3.313 3.212 -19.429 1.00 0.00 C ATOM 1122 CG PHE A 79 -4.179 2.069 -18.955 1.00 0.00 C ATOM 1123 CD1 PHE A 79 -4.432 1.901 -17.586 1.00 0.00 C ATOM 1124 CD2 PHE A 79 -4.731 1.176 -19.883 1.00 0.00 C ATOM 1125 CE1 PHE A 79 -5.236 0.841 -17.147 1.00 0.00 C ATOM 1126 CE2 PHE A 79 -5.534 0.116 -19.444 1.00 0.00 C ATOM 1127 CZ PHE A 79 -5.787 -0.051 -18.076 1.00 0.00 C ATOM 0 H PHE A 79 -5.509 4.057 -18.608 1.00 0.00 H new ATOM 0 HA PHE A 79 -2.843 4.121 -17.533 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.636 3.541 -20.417 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.279 2.882 -19.526 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -4.007 2.589 -16.870 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -4.537 1.305 -20.938 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -5.431 0.712 -16.093 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -5.958 -0.573 -20.160 1.00 0.00 H new ATOM 0 HZ PHE A 79 -6.407 -0.868 -17.738 1.00 0.00 H new ATOM 1137 N GLU A 80 -3.627 6.419 -19.715 1.00 0.00 N ATOM 1138 CA GLU A 80 -3.108 7.661 -20.352 1.00 0.00 C ATOM 1139 C GLU A 80 -2.765 8.687 -19.270 1.00 0.00 C ATOM 1140 O GLU A 80 -1.760 9.365 -19.340 1.00 0.00 O ATOM 1141 CB GLU A 80 -4.174 8.240 -21.284 1.00 0.00 C ATOM 1142 CG GLU A 80 -4.119 7.519 -22.634 1.00 0.00 C ATOM 1143 CD GLU A 80 -3.277 8.337 -23.616 1.00 0.00 C ATOM 1144 OE1 GLU A 80 -2.943 9.462 -23.285 1.00 0.00 O ATOM 1145 OE2 GLU A 80 -2.979 7.822 -24.681 1.00 0.00 O ATOM 0 H GLU A 80 -4.627 6.256 -19.832 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.212 7.426 -20.926 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.162 8.126 -20.839 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.009 9.308 -21.423 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -3.689 6.525 -22.510 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.127 7.384 -23.027 1.00 0.00 H new ATOM 1152 N VAL A 81 -3.595 8.810 -18.269 1.00 0.00 N ATOM 1153 CA VAL A 81 -3.315 9.795 -17.187 1.00 0.00 C ATOM 1154 C VAL A 81 -2.069 9.364 -16.408 1.00 0.00 C ATOM 1155 O VAL A 81 -1.158 10.139 -16.199 1.00 0.00 O ATOM 1156 CB VAL A 81 -4.512 9.866 -16.238 1.00 0.00 C ATOM 1157 CG1 VAL A 81 -4.413 11.133 -15.387 1.00 0.00 C ATOM 1158 CG2 VAL A 81 -5.807 9.901 -17.053 1.00 0.00 C ATOM 0 H VAL A 81 -4.454 8.271 -18.155 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.143 10.777 -17.628 1.00 0.00 H new ATOM 0 HB VAL A 81 -4.513 8.990 -15.589 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -5.266 11.184 -14.710 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -3.490 11.111 -14.807 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -4.412 12.008 -16.036 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -6.661 9.952 -16.377 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -5.805 10.777 -17.702 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -5.879 8.999 -17.661 1.00 0.00 H new ATOM 1168 N LEU A 82 -2.023 8.133 -15.976 1.00 0.00 N ATOM 1169 CA LEU A 82 -0.836 7.659 -15.211 1.00 0.00 C ATOM 1170 C LEU A 82 0.387 7.636 -16.130 1.00 0.00 C ATOM 1171 O LEU A 82 1.510 7.774 -15.688 1.00 0.00 O ATOM 1172 CB LEU A 82 -1.099 6.250 -14.676 1.00 0.00 C ATOM 1173 CG LEU A 82 -1.280 6.307 -13.158 1.00 0.00 C ATOM 1174 CD1 LEU A 82 -2.468 7.207 -12.817 1.00 0.00 C ATOM 1175 CD2 LEU A 82 -1.538 4.896 -12.624 1.00 0.00 C ATOM 0 H LEU A 82 -2.755 7.437 -16.120 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.651 8.334 -14.376 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.990 5.832 -15.144 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.268 5.592 -14.930 1.00 0.00 H new ATOM 0 HG LEU A 82 -0.378 6.711 -12.699 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -2.596 7.247 -11.735 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -2.284 8.212 -13.198 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -3.372 6.805 -13.275 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -1.667 4.934 -11.542 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -2.440 4.493 -13.083 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -0.690 4.255 -12.866 1.00 0.00 H new ATOM 1187 N ASN A 83 0.179 7.465 -17.407 1.00 0.00 N ATOM 1188 CA ASN A 83 1.332 7.437 -18.351 1.00 0.00 C ATOM 1189 C ASN A 83 1.997 8.815 -18.376 1.00 0.00 C ATOM 1190 O ASN A 83 3.203 8.935 -18.283 1.00 0.00 O ATOM 1191 CB ASN A 83 0.837 7.084 -19.755 1.00 0.00 C ATOM 1192 CG ASN A 83 2.007 7.134 -20.738 1.00 0.00 C ATOM 1193 OD1 ASN A 83 1.827 7.441 -21.900 1.00 0.00 O ATOM 1194 ND2 ASN A 83 3.209 6.842 -20.320 1.00 0.00 N ATOM 0 H ASN A 83 -0.738 7.344 -17.837 1.00 0.00 H new ATOM 0 HA ASN A 83 2.053 6.688 -18.024 1.00 0.00 H new ATOM 0 HB2 ASN A 83 0.391 6.089 -19.755 1.00 0.00 H new ATOM 0 HB3 ASN A 83 0.059 7.782 -20.064 1.00 0.00 H new ATOM 0 HD21 ASN A 83 3.996 6.872 -20.969 1.00 0.00 H new ATOM 0 HD22 ASN A 83 3.361 6.584 -19.345 1.00 0.00 H new ATOM 1201 N GLU A 84 1.220 9.855 -18.499 1.00 0.00 N ATOM 1202 CA GLU A 84 1.806 11.225 -18.527 1.00 0.00 C ATOM 1203 C GLU A 84 2.383 11.555 -17.150 1.00 0.00 C ATOM 1204 O GLU A 84 3.354 12.275 -17.028 1.00 0.00 O ATOM 1205 CB GLU A 84 0.716 12.239 -18.879 1.00 0.00 C ATOM 1206 CG GLU A 84 1.342 13.435 -19.599 1.00 0.00 C ATOM 1207 CD GLU A 84 0.257 14.466 -19.915 1.00 0.00 C ATOM 1208 OE1 GLU A 84 -0.677 14.572 -19.137 1.00 0.00 O ATOM 1209 OE2 GLU A 84 0.379 15.133 -20.929 1.00 0.00 O ATOM 0 H GLU A 84 0.204 9.816 -18.581 1.00 0.00 H new ATOM 0 HA GLU A 84 2.597 11.269 -19.276 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -0.037 11.773 -19.514 1.00 0.00 H new ATOM 0 HB3 GLU A 84 0.208 12.572 -17.974 1.00 0.00 H new ATOM 0 HG2 GLU A 84 2.115 13.884 -18.976 1.00 0.00 H new ATOM 0 HG3 GLU A 84 1.826 13.107 -20.519 1.00 0.00 H new ATOM 1216 N LEU A 85 1.793 11.030 -16.110 1.00 0.00 N ATOM 1217 CA LEU A 85 2.307 11.310 -14.740 1.00 0.00 C ATOM 1218 C LEU A 85 3.687 10.671 -14.575 1.00 0.00 C ATOM 1219 O LEU A 85 4.496 11.114 -13.784 1.00 0.00 O ATOM 1220 CB LEU A 85 1.344 10.721 -13.707 1.00 0.00 C ATOM 1221 CG LEU A 85 0.557 11.849 -13.039 1.00 0.00 C ATOM 1222 CD1 LEU A 85 -0.818 11.331 -12.614 1.00 0.00 C ATOM 1223 CD2 LEU A 85 1.318 12.342 -11.807 1.00 0.00 C ATOM 0 H LEU A 85 0.977 10.419 -16.151 1.00 0.00 H new ATOM 0 HA LEU A 85 2.386 12.387 -14.591 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.660 10.023 -14.189 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.899 10.157 -12.957 1.00 0.00 H new ATOM 0 HG LEU A 85 0.434 12.671 -13.744 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -1.379 12.135 -12.138 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -1.361 10.980 -13.491 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -0.695 10.508 -11.910 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.757 13.146 -11.331 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.442 11.519 -11.103 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.298 12.712 -12.109 1.00 0.00 H new ATOM 1235 N GLY A 86 3.963 9.633 -15.317 1.00 0.00 N ATOM 1236 CA GLY A 86 5.290 8.966 -15.204 1.00 0.00 C ATOM 1237 C GLY A 86 5.200 7.806 -14.210 1.00 0.00 C ATOM 1238 O GLY A 86 6.189 7.380 -13.649 1.00 0.00 O ATOM 0 H GLY A 86 3.326 9.218 -15.997 1.00 0.00 H new ATOM 0 HA2 GLY A 86 5.607 8.598 -16.180 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.042 9.683 -14.874 1.00 0.00 H new ATOM 1242 N ILE A 87 4.021 7.292 -13.987 1.00 0.00 N ATOM 1243 CA ILE A 87 3.873 6.159 -13.029 1.00 0.00 C ATOM 1244 C ILE A 87 3.744 4.847 -13.807 1.00 0.00 C ATOM 1245 O ILE A 87 3.464 4.840 -14.989 1.00 0.00 O ATOM 1246 CB ILE A 87 2.619 6.369 -12.179 1.00 0.00 C ATOM 1247 CG1 ILE A 87 2.483 7.853 -11.833 1.00 0.00 C ATOM 1248 CG2 ILE A 87 2.735 5.555 -10.889 1.00 0.00 C ATOM 1249 CD1 ILE A 87 3.597 8.256 -10.865 1.00 0.00 C ATOM 0 H ILE A 87 3.156 7.607 -14.426 1.00 0.00 H new ATOM 0 HA ILE A 87 4.749 6.115 -12.382 1.00 0.00 H new ATOM 0 HB ILE A 87 1.742 6.042 -12.737 1.00 0.00 H new ATOM 0 HG12 ILE A 87 2.539 8.455 -12.740 1.00 0.00 H new ATOM 0 HG13 ILE A 87 1.509 8.045 -11.383 1.00 0.00 H new ATOM 0 HG21 ILE A 87 1.841 5.704 -10.283 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.835 4.498 -11.134 1.00 0.00 H new ATOM 0 HG23 ILE A 87 3.612 5.882 -10.330 1.00 0.00 H new ATOM 0 HD11 ILE A 87 3.500 9.313 -10.619 1.00 0.00 H new ATOM 0 HD12 ILE A 87 3.520 7.663 -9.954 1.00 0.00 H new ATOM 0 HD13 ILE A 87 4.566 8.080 -11.332 1.00 0.00 H new ATOM 1261 N LYS A 88 3.946 3.737 -13.152 1.00 0.00 N ATOM 1262 CA LYS A 88 3.832 2.428 -13.854 1.00 0.00 C ATOM 1263 C LYS A 88 2.415 1.880 -13.680 1.00 0.00 C ATOM 1264 O LYS A 88 1.872 1.869 -12.592 1.00 0.00 O ATOM 1265 CB LYS A 88 4.836 1.439 -13.259 1.00 0.00 C ATOM 1266 CG LYS A 88 6.226 1.715 -13.833 1.00 0.00 C ATOM 1267 CD LYS A 88 7.279 1.505 -12.743 1.00 0.00 C ATOM 1268 CE LYS A 88 8.582 2.195 -13.150 1.00 0.00 C ATOM 1269 NZ LYS A 88 9.290 1.361 -14.162 1.00 0.00 N ATOM 0 H LYS A 88 4.185 3.680 -12.162 1.00 0.00 H new ATOM 0 HA LYS A 88 4.043 2.565 -14.915 1.00 0.00 H new ATOM 0 HB2 LYS A 88 4.854 1.532 -12.173 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.534 0.417 -13.486 1.00 0.00 H new ATOM 0 HG2 LYS A 88 6.422 1.051 -14.675 1.00 0.00 H new ATOM 0 HG3 LYS A 88 6.278 2.735 -14.212 1.00 0.00 H new ATOM 0 HD2 LYS A 88 6.922 1.909 -11.796 1.00 0.00 H new ATOM 0 HD3 LYS A 88 7.452 0.440 -12.590 1.00 0.00 H new ATOM 0 HE2 LYS A 88 8.370 3.182 -13.560 1.00 0.00 H new ATOM 0 HE3 LYS A 88 9.217 2.342 -12.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 10.176 1.829 -14.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 9.504 0.428 -13.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 8.684 1.242 -14.999 1.00 0.00 H new ATOM 1283 N ILE A 89 1.808 1.427 -14.743 1.00 0.00 N ATOM 1284 CA ILE A 89 0.426 0.882 -14.634 1.00 0.00 C ATOM 1285 C ILE A 89 0.443 -0.619 -14.929 1.00 0.00 C ATOM 1286 O ILE A 89 1.074 -1.070 -15.864 1.00 0.00 O ATOM 1287 CB ILE A 89 -0.482 1.591 -15.639 1.00 0.00 C ATOM 1288 CG1 ILE A 89 -0.243 3.100 -15.568 1.00 0.00 C ATOM 1289 CG2 ILE A 89 -1.945 1.291 -15.303 1.00 0.00 C ATOM 1290 CD1 ILE A 89 0.090 3.631 -16.963 1.00 0.00 C ATOM 0 H ILE A 89 2.209 1.411 -15.681 1.00 0.00 H new ATOM 0 HA ILE A 89 0.049 1.048 -13.625 1.00 0.00 H new ATOM 0 HB ILE A 89 -0.258 1.235 -16.645 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -1.129 3.601 -15.179 1.00 0.00 H new ATOM 0 HG13 ILE A 89 0.574 3.317 -14.880 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.594 1.796 -16.019 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -2.117 0.216 -15.353 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -2.168 1.647 -14.297 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.260 4.706 -16.912 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.989 3.139 -17.335 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -0.741 3.427 -17.638 1.00 0.00 H new ATOM 1302 N TYR A 90 -0.252 -1.393 -14.137 1.00 0.00 N ATOM 1303 CA TYR A 90 -0.285 -2.865 -14.366 1.00 0.00 C ATOM 1304 C TYR A 90 -1.738 -3.325 -14.501 1.00 0.00 C ATOM 1305 O TYR A 90 -2.641 -2.730 -13.945 1.00 0.00 O ATOM 1306 CB TYR A 90 0.370 -3.581 -13.183 1.00 0.00 C ATOM 1307 CG TYR A 90 1.808 -3.135 -13.054 1.00 0.00 C ATOM 1308 CD1 TYR A 90 2.538 -2.773 -14.196 1.00 0.00 C ATOM 1309 CD2 TYR A 90 2.413 -3.082 -11.791 1.00 0.00 C ATOM 1310 CE1 TYR A 90 3.870 -2.360 -14.074 1.00 0.00 C ATOM 1311 CE2 TYR A 90 3.747 -2.668 -11.670 1.00 0.00 C ATOM 1312 CZ TYR A 90 4.475 -2.307 -12.811 1.00 0.00 C ATOM 1313 OH TYR A 90 5.788 -1.899 -12.691 1.00 0.00 O ATOM 0 H TYR A 90 -0.799 -1.067 -13.340 1.00 0.00 H new ATOM 0 HA TYR A 90 0.259 -3.104 -15.280 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -0.174 -3.360 -12.265 1.00 0.00 H new ATOM 0 HB3 TYR A 90 0.325 -4.660 -13.328 1.00 0.00 H new ATOM 0 HD1 TYR A 90 2.072 -2.813 -15.170 1.00 0.00 H new ATOM 0 HD2 TYR A 90 1.852 -3.360 -10.911 1.00 0.00 H new ATOM 0 HE1 TYR A 90 4.432 -2.082 -14.954 1.00 0.00 H new ATOM 0 HE2 TYR A 90 4.213 -2.627 -10.697 1.00 0.00 H new ATOM 0 HH TYR A 90 6.052 -1.919 -11.747 1.00 0.00 H new ATOM 1323 N ARG A 91 -1.973 -4.376 -15.237 1.00 0.00 N ATOM 1324 CA ARG A 91 -3.370 -4.869 -15.408 1.00 0.00 C ATOM 1325 C ARG A 91 -3.752 -5.757 -14.223 1.00 0.00 C ATOM 1326 O ARG A 91 -2.912 -6.371 -13.597 1.00 0.00 O ATOM 1327 CB ARG A 91 -3.471 -5.679 -16.703 1.00 0.00 C ATOM 1328 CG ARG A 91 -4.915 -5.663 -17.205 1.00 0.00 C ATOM 1329 CD ARG A 91 -4.990 -6.341 -18.574 1.00 0.00 C ATOM 1330 NE ARG A 91 -6.417 -6.514 -18.965 1.00 0.00 N ATOM 1331 CZ ARG A 91 -7.280 -6.974 -18.100 1.00 0.00 C ATOM 1332 NH1 ARG A 91 -6.958 -7.975 -17.328 1.00 0.00 N ATOM 1333 NH2 ARG A 91 -8.464 -6.433 -18.008 1.00 0.00 N ATOM 0 H ARG A 91 -1.259 -4.915 -15.727 1.00 0.00 H new ATOM 0 HA ARG A 91 -4.049 -4.017 -15.456 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -2.808 -5.259 -17.459 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -3.147 -6.705 -16.529 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -5.563 -6.179 -16.496 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -5.275 -4.636 -17.276 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -4.468 -5.740 -19.319 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -4.491 -7.310 -18.540 1.00 0.00 H new ATOM 0 HE ARG A 91 -6.720 -6.273 -19.909 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -6.033 -8.398 -17.400 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -7.632 -8.335 -16.652 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -8.715 -5.650 -18.612 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -9.138 -6.793 -17.332 1.00 0.00 H new ATOM 1347 N ALA A 92 -5.017 -5.830 -13.910 1.00 0.00 N ATOM 1348 CA ALA A 92 -5.457 -6.681 -12.767 1.00 0.00 C ATOM 1349 C ALA A 92 -6.136 -7.942 -13.307 1.00 0.00 C ATOM 1350 O ALA A 92 -6.593 -7.978 -14.431 1.00 0.00 O ATOM 1351 CB ALA A 92 -6.447 -5.899 -11.901 1.00 0.00 C ATOM 0 H ALA A 92 -5.766 -5.337 -14.397 1.00 0.00 H new ATOM 0 HA ALA A 92 -4.592 -6.961 -12.166 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -6.769 -6.520 -11.065 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -5.965 -4.999 -11.519 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -7.313 -5.620 -12.501 1.00 0.00 H new ATOM 1357 N THR A 93 -6.207 -8.978 -12.515 1.00 0.00 N ATOM 1358 CA THR A 93 -6.857 -10.232 -12.989 1.00 0.00 C ATOM 1359 C THR A 93 -8.310 -10.270 -12.509 1.00 0.00 C ATOM 1360 O THR A 93 -8.999 -11.258 -12.665 1.00 0.00 O ATOM 1361 CB THR A 93 -6.104 -11.442 -12.429 1.00 0.00 C ATOM 1362 OG1 THR A 93 -4.793 -11.048 -12.049 1.00 0.00 O ATOM 1363 CG2 THR A 93 -6.022 -12.532 -13.498 1.00 0.00 C ATOM 0 H THR A 93 -5.844 -9.010 -11.562 1.00 0.00 H new ATOM 0 HA THR A 93 -6.834 -10.261 -14.078 1.00 0.00 H new ATOM 0 HB THR A 93 -6.633 -11.829 -11.558 1.00 0.00 H new ATOM 0 HG1 THR A 93 -4.311 -11.821 -11.689 1.00 0.00 H new ATOM 0 HG21 THR A 93 -5.486 -13.393 -13.099 1.00 0.00 H new ATOM 0 HG22 THR A 93 -7.028 -12.834 -13.788 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.493 -12.147 -14.370 1.00 0.00 H new ATOM 1371 N GLY A 94 -8.782 -9.201 -11.928 1.00 0.00 N ATOM 1372 CA GLY A 94 -10.190 -9.178 -11.441 1.00 0.00 C ATOM 1373 C GLY A 94 -10.475 -10.448 -10.638 1.00 0.00 C ATOM 1374 O GLY A 94 -11.187 -11.327 -11.082 1.00 0.00 O ATOM 0 H GLY A 94 -8.254 -8.343 -11.770 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -10.356 -8.298 -10.820 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -10.876 -9.107 -12.285 1.00 0.00 H new ATOM 1378 N THR A 95 -9.926 -10.551 -9.459 1.00 0.00 N ATOM 1379 CA THR A 95 -10.165 -11.765 -8.628 1.00 0.00 C ATOM 1380 C THR A 95 -10.084 -11.390 -7.148 1.00 0.00 C ATOM 1381 O THR A 95 -11.039 -11.525 -6.409 1.00 0.00 O ATOM 1382 CB THR A 95 -9.104 -12.820 -8.946 1.00 0.00 C ATOM 1383 OG1 THR A 95 -9.342 -13.355 -10.240 1.00 0.00 O ATOM 1384 CG2 THR A 95 -9.167 -13.942 -7.908 1.00 0.00 C ATOM 0 H THR A 95 -9.322 -9.847 -9.035 1.00 0.00 H new ATOM 0 HA THR A 95 -11.153 -12.168 -8.849 1.00 0.00 H new ATOM 0 HB THR A 95 -8.116 -12.360 -8.919 1.00 0.00 H new ATOM 0 HG1 THR A 95 -10.081 -12.871 -10.663 1.00 0.00 H new ATOM 0 HG21 THR A 95 -8.410 -14.692 -8.137 1.00 0.00 H new ATOM 0 HG22 THR A 95 -8.982 -13.531 -6.916 1.00 0.00 H new ATOM 0 HG23 THR A 95 -10.154 -14.404 -7.931 1.00 0.00 H new ATOM 1392 N SER A 96 -8.949 -10.919 -6.708 1.00 0.00 N ATOM 1393 CA SER A 96 -8.807 -10.535 -5.276 1.00 0.00 C ATOM 1394 C SER A 96 -7.535 -9.704 -5.093 1.00 0.00 C ATOM 1395 O SER A 96 -6.448 -10.136 -5.421 1.00 0.00 O ATOM 1396 CB SER A 96 -8.718 -11.797 -4.416 1.00 0.00 C ATOM 1397 OG SER A 96 -9.916 -12.548 -4.559 1.00 0.00 O ATOM 0 H SER A 96 -8.114 -10.784 -7.279 1.00 0.00 H new ATOM 0 HA SER A 96 -9.672 -9.947 -4.971 1.00 0.00 H new ATOM 0 HB2 SER A 96 -7.860 -12.398 -4.719 1.00 0.00 H new ATOM 0 HB3 SER A 96 -8.566 -11.529 -3.371 1.00 0.00 H new ATOM 0 HG SER A 96 -10.618 -11.976 -4.933 1.00 0.00 H new ATOM 1403 N VAL A 97 -7.661 -8.515 -4.570 1.00 0.00 N ATOM 1404 CA VAL A 97 -6.459 -7.659 -4.367 1.00 0.00 C ATOM 1405 C VAL A 97 -5.543 -8.308 -3.325 1.00 0.00 C ATOM 1406 O VAL A 97 -4.341 -8.365 -3.491 1.00 0.00 O ATOM 1407 CB VAL A 97 -6.891 -6.277 -3.875 1.00 0.00 C ATOM 1408 CG1 VAL A 97 -7.727 -5.589 -4.955 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -7.729 -6.427 -2.603 1.00 0.00 C ATOM 0 H VAL A 97 -8.545 -8.100 -4.275 1.00 0.00 H new ATOM 0 HA VAL A 97 -5.923 -7.556 -5.311 1.00 0.00 H new ATOM 0 HB VAL A 97 -6.007 -5.676 -3.661 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -8.035 -4.604 -4.604 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -7.132 -5.482 -5.862 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -8.610 -6.190 -5.169 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.037 -5.442 -2.252 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -8.612 -7.028 -2.818 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.135 -6.918 -1.832 1.00 0.00 H new ATOM 1419 N GLU A 98 -6.102 -8.798 -2.252 1.00 0.00 N ATOM 1420 CA GLU A 98 -5.263 -9.443 -1.203 1.00 0.00 C ATOM 1421 C GLU A 98 -4.251 -10.379 -1.866 1.00 0.00 C ATOM 1422 O GLU A 98 -3.089 -10.404 -1.514 1.00 0.00 O ATOM 1423 CB GLU A 98 -6.158 -10.246 -0.257 1.00 0.00 C ATOM 1424 CG GLU A 98 -5.288 -11.072 0.692 1.00 0.00 C ATOM 1425 CD GLU A 98 -5.505 -10.594 2.129 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -6.389 -11.124 2.782 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -4.784 -9.706 2.552 1.00 0.00 O ATOM 0 H GLU A 98 -7.103 -8.779 -2.057 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.733 -8.676 -0.638 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -6.799 -9.573 0.313 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -6.814 -10.902 -0.829 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.541 -12.129 0.607 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.237 -10.972 0.419 1.00 0.00 H new ATOM 1434 N GLU A 99 -4.685 -11.150 -2.825 1.00 0.00 N ATOM 1435 CA GLU A 99 -3.751 -12.086 -3.513 1.00 0.00 C ATOM 1436 C GLU A 99 -2.830 -11.295 -4.444 1.00 0.00 C ATOM 1437 O GLU A 99 -1.631 -11.489 -4.458 1.00 0.00 O ATOM 1438 CB GLU A 99 -4.555 -13.100 -4.328 1.00 0.00 C ATOM 1439 CG GLU A 99 -3.601 -13.982 -5.137 1.00 0.00 C ATOM 1440 CD GLU A 99 -2.616 -14.671 -4.191 1.00 0.00 C ATOM 1441 OE1 GLU A 99 -2.971 -14.871 -3.040 1.00 0.00 O ATOM 1442 OE2 GLU A 99 -1.524 -14.988 -4.632 1.00 0.00 O ATOM 0 H GLU A 99 -5.647 -11.172 -3.162 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.150 -12.612 -2.771 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -5.161 -13.716 -3.664 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -5.242 -12.581 -4.997 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -4.165 -14.727 -5.697 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -3.060 -13.378 -5.865 1.00 0.00 H new ATOM 1449 N ASN A 100 -3.380 -10.403 -5.223 1.00 0.00 N ATOM 1450 CA ASN A 100 -2.534 -9.601 -6.151 1.00 0.00 C ATOM 1451 C ASN A 100 -1.325 -9.055 -5.390 1.00 0.00 C ATOM 1452 O ASN A 100 -0.285 -8.793 -5.960 1.00 0.00 O ATOM 1453 CB ASN A 100 -3.353 -8.438 -6.714 1.00 0.00 C ATOM 1454 CG ASN A 100 -4.071 -8.890 -7.987 1.00 0.00 C ATOM 1455 OD1 ASN A 100 -3.847 -8.346 -9.051 1.00 0.00 O ATOM 1456 ND2 ASN A 100 -4.933 -9.867 -7.924 1.00 0.00 N ATOM 0 H ASN A 100 -4.378 -10.196 -5.256 1.00 0.00 H new ATOM 0 HA ASN A 100 -2.193 -10.232 -6.971 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -4.079 -8.099 -5.975 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -2.701 -7.592 -6.932 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -5.418 -10.174 -8.767 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -5.122 -10.324 -7.032 1.00 0.00 H new ATOM 1463 N LEU A 101 -1.453 -8.883 -4.102 1.00 0.00 N ATOM 1464 CA LEU A 101 -0.311 -8.357 -3.303 1.00 0.00 C ATOM 1465 C LEU A 101 0.886 -9.297 -3.453 1.00 0.00 C ATOM 1466 O LEU A 101 1.956 -8.897 -3.868 1.00 0.00 O ATOM 1467 CB LEU A 101 -0.713 -8.275 -1.829 1.00 0.00 C ATOM 1468 CG LEU A 101 -0.389 -6.882 -1.285 1.00 0.00 C ATOM 1469 CD1 LEU A 101 -0.681 -6.839 0.215 1.00 0.00 C ATOM 1470 CD2 LEU A 101 1.092 -6.572 -1.525 1.00 0.00 C ATOM 0 H LEU A 101 -2.299 -9.084 -3.569 1.00 0.00 H new ATOM 0 HA LEU A 101 -0.043 -7.363 -3.661 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -1.778 -8.480 -1.720 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -0.182 -9.034 -1.254 1.00 0.00 H new ATOM 0 HG LEU A 101 -1.004 -6.141 -1.796 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -0.450 -5.847 0.602 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -1.734 -7.060 0.387 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -0.067 -7.580 0.727 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.323 -5.580 -1.138 1.00 0.00 H new ATOM 0 HD22 LEU A 101 1.706 -7.313 -1.014 1.00 0.00 H new ATOM 0 HD23 LEU A 101 1.301 -6.602 -2.594 1.00 0.00 H new ATOM 1482 N LYS A 102 0.713 -10.548 -3.122 1.00 0.00 N ATOM 1483 CA LYS A 102 1.839 -11.515 -3.248 1.00 0.00 C ATOM 1484 C LYS A 102 2.210 -11.671 -4.725 1.00 0.00 C ATOM 1485 O LYS A 102 3.337 -11.973 -5.063 1.00 0.00 O ATOM 1486 CB LYS A 102 1.415 -12.871 -2.681 1.00 0.00 C ATOM 1487 CG LYS A 102 2.498 -13.389 -1.732 1.00 0.00 C ATOM 1488 CD LYS A 102 3.575 -14.120 -2.535 1.00 0.00 C ATOM 1489 CE LYS A 102 3.603 -15.594 -2.127 1.00 0.00 C ATOM 1490 NZ LYS A 102 5.000 -16.106 -2.212 1.00 0.00 N ATOM 0 H LYS A 102 -0.160 -10.941 -2.770 1.00 0.00 H new ATOM 0 HA LYS A 102 2.701 -11.145 -2.693 1.00 0.00 H new ATOM 0 HB2 LYS A 102 0.468 -12.775 -2.151 1.00 0.00 H new ATOM 0 HB3 LYS A 102 1.256 -13.582 -3.491 1.00 0.00 H new ATOM 0 HG2 LYS A 102 2.941 -12.559 -1.181 1.00 0.00 H new ATOM 0 HG3 LYS A 102 2.059 -14.062 -0.996 1.00 0.00 H new ATOM 0 HD2 LYS A 102 3.371 -14.031 -3.602 1.00 0.00 H new ATOM 0 HD3 LYS A 102 4.549 -13.664 -2.357 1.00 0.00 H new ATOM 0 HE2 LYS A 102 3.223 -15.709 -1.112 1.00 0.00 H new ATOM 0 HE3 LYS A 102 2.951 -16.175 -2.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 5.020 -17.108 -1.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 5.346 -16.010 -3.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 5.610 -15.558 -1.573 1.00 0.00 H new ATOM 1504 N LEU A 103 1.269 -11.466 -5.605 1.00 0.00 N ATOM 1505 CA LEU A 103 1.567 -11.602 -7.060 1.00 0.00 C ATOM 1506 C LEU A 103 2.596 -10.548 -7.472 1.00 0.00 C ATOM 1507 O LEU A 103 3.437 -10.786 -8.316 1.00 0.00 O ATOM 1508 CB LEU A 103 0.280 -11.399 -7.863 1.00 0.00 C ATOM 1509 CG LEU A 103 -0.230 -12.751 -8.363 1.00 0.00 C ATOM 1510 CD1 LEU A 103 -1.102 -13.397 -7.284 1.00 0.00 C ATOM 1511 CD2 LEU A 103 -1.060 -12.546 -9.633 1.00 0.00 C ATOM 0 H LEU A 103 0.307 -11.210 -5.381 1.00 0.00 H new ATOM 0 HA LEU A 103 1.968 -12.596 -7.258 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.477 -10.920 -7.242 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.467 -10.734 -8.707 1.00 0.00 H new ATOM 0 HG LEU A 103 0.618 -13.400 -8.584 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.466 -14.361 -7.639 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -0.512 -13.543 -6.379 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.949 -12.748 -7.064 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.424 -13.510 -9.990 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.908 -11.897 -9.413 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.440 -12.085 -10.402 1.00 0.00 H new ATOM 1523 N PHE A 104 2.537 -9.383 -6.886 1.00 0.00 N ATOM 1524 CA PHE A 104 3.513 -8.316 -7.248 1.00 0.00 C ATOM 1525 C PHE A 104 4.927 -8.764 -6.871 1.00 0.00 C ATOM 1526 O PHE A 104 5.900 -8.340 -7.460 1.00 0.00 O ATOM 1527 CB PHE A 104 3.165 -7.033 -6.494 1.00 0.00 C ATOM 1528 CG PHE A 104 3.777 -5.849 -7.204 1.00 0.00 C ATOM 1529 CD1 PHE A 104 5.162 -5.640 -7.147 1.00 0.00 C ATOM 1530 CD2 PHE A 104 2.963 -4.961 -7.919 1.00 0.00 C ATOM 1531 CE1 PHE A 104 5.732 -4.543 -7.806 1.00 0.00 C ATOM 1532 CE2 PHE A 104 3.533 -3.863 -8.577 1.00 0.00 C ATOM 1533 CZ PHE A 104 4.918 -3.655 -8.520 1.00 0.00 C ATOM 0 H PHE A 104 1.855 -9.124 -6.173 1.00 0.00 H new ATOM 0 HA PHE A 104 3.468 -8.131 -8.321 1.00 0.00 H new ATOM 0 HB2 PHE A 104 2.083 -6.916 -6.435 1.00 0.00 H new ATOM 0 HB3 PHE A 104 3.536 -7.088 -5.471 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.789 -6.324 -6.595 1.00 0.00 H new ATOM 0 HD2 PHE A 104 1.896 -5.123 -7.963 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.799 -4.382 -7.763 1.00 0.00 H new ATOM 0 HE2 PHE A 104 2.906 -3.178 -9.128 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.358 -2.809 -9.027 1.00 0.00 H new ATOM 1543 N THR A 105 5.049 -9.616 -5.890 1.00 0.00 N ATOM 1544 CA THR A 105 6.402 -10.087 -5.477 1.00 0.00 C ATOM 1545 C THR A 105 6.934 -11.080 -6.511 1.00 0.00 C ATOM 1546 O THR A 105 8.122 -11.325 -6.596 1.00 0.00 O ATOM 1547 CB THR A 105 6.310 -10.771 -4.111 1.00 0.00 C ATOM 1548 OG1 THR A 105 5.762 -9.864 -3.165 1.00 0.00 O ATOM 1549 CG2 THR A 105 7.706 -11.202 -3.659 1.00 0.00 C ATOM 0 H THR A 105 4.272 -10.006 -5.357 1.00 0.00 H new ATOM 0 HA THR A 105 7.079 -9.235 -5.411 1.00 0.00 H new ATOM 0 HB THR A 105 5.668 -11.649 -4.186 1.00 0.00 H new ATOM 0 HG1 THR A 105 6.465 -9.260 -2.846 1.00 0.00 H new ATOM 0 HG21 THR A 105 7.639 -11.689 -2.686 1.00 0.00 H new ATOM 0 HG22 THR A 105 8.125 -11.898 -4.385 1.00 0.00 H new ATOM 0 HG23 THR A 105 8.350 -10.326 -3.583 1.00 0.00 H new ATOM 1557 N GLU A 106 6.067 -11.655 -7.299 1.00 0.00 N ATOM 1558 CA GLU A 106 6.528 -12.632 -8.326 1.00 0.00 C ATOM 1559 C GLU A 106 6.454 -11.989 -9.713 1.00 0.00 C ATOM 1560 O GLU A 106 6.639 -12.643 -10.720 1.00 0.00 O ATOM 1561 CB GLU A 106 5.631 -13.870 -8.289 1.00 0.00 C ATOM 1562 CG GLU A 106 5.715 -14.524 -6.908 1.00 0.00 C ATOM 1563 CD GLU A 106 6.878 -15.518 -6.883 1.00 0.00 C ATOM 1564 OE1 GLU A 106 7.936 -15.174 -7.382 1.00 0.00 O ATOM 1565 OE2 GLU A 106 6.689 -16.606 -6.365 1.00 0.00 O ATOM 0 H GLU A 106 5.061 -11.491 -7.276 1.00 0.00 H new ATOM 0 HA GLU A 106 7.557 -12.922 -8.116 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.600 -13.591 -8.508 1.00 0.00 H new ATOM 0 HB3 GLU A 106 5.940 -14.579 -9.057 1.00 0.00 H new ATOM 0 HG2 GLU A 106 5.857 -13.762 -6.141 1.00 0.00 H new ATOM 0 HG3 GLU A 106 4.780 -15.036 -6.679 1.00 0.00 H new ATOM 1572 N GLY A 107 6.184 -10.714 -9.774 1.00 0.00 N ATOM 1573 CA GLY A 107 6.099 -10.034 -11.099 1.00 0.00 C ATOM 1574 C GLY A 107 5.132 -10.801 -12.003 1.00 0.00 C ATOM 1575 O GLY A 107 5.375 -10.977 -13.180 1.00 0.00 O ATOM 0 H GLY A 107 6.019 -10.114 -8.966 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.758 -9.007 -10.972 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.086 -9.987 -11.560 1.00 0.00 H new ATOM 1579 N ASN A 108 4.036 -11.259 -11.460 1.00 0.00 N ATOM 1580 CA ASN A 108 3.056 -12.016 -12.287 1.00 0.00 C ATOM 1581 C ASN A 108 2.142 -11.033 -13.024 1.00 0.00 C ATOM 1582 O ASN A 108 1.853 -11.196 -14.192 1.00 0.00 O ATOM 1583 CB ASN A 108 2.213 -12.917 -11.382 1.00 0.00 C ATOM 1584 CG ASN A 108 2.433 -14.379 -11.771 1.00 0.00 C ATOM 1585 OD1 ASN A 108 1.550 -15.016 -12.311 1.00 0.00 O ATOM 1586 ND2 ASN A 108 3.583 -14.942 -11.520 1.00 0.00 N ATOM 0 H ASN A 108 3.778 -11.141 -10.480 1.00 0.00 H new ATOM 0 HA ASN A 108 3.590 -12.629 -13.013 1.00 0.00 H new ATOM 0 HB2 ASN A 108 2.488 -12.762 -10.339 1.00 0.00 H new ATOM 0 HB3 ASN A 108 1.158 -12.659 -11.475 1.00 0.00 H new ATOM 0 HD21 ASN A 108 3.741 -15.916 -11.777 1.00 0.00 H new ATOM 0 HD22 ASN A 108 4.324 -14.408 -11.067 1.00 0.00 H new ATOM 1593 N LEU A 109 1.688 -10.013 -12.349 1.00 0.00 N ATOM 1594 CA LEU A 109 0.795 -9.019 -13.012 1.00 0.00 C ATOM 1595 C LEU A 109 1.629 -7.830 -13.489 1.00 0.00 C ATOM 1596 O LEU A 109 2.614 -7.466 -12.879 1.00 0.00 O ATOM 1597 CB LEU A 109 -0.258 -8.536 -12.014 1.00 0.00 C ATOM 1598 CG LEU A 109 -1.654 -8.744 -12.603 1.00 0.00 C ATOM 1599 CD1 LEU A 109 -1.833 -10.213 -12.988 1.00 0.00 C ATOM 1600 CD2 LEU A 109 -2.708 -8.359 -11.561 1.00 0.00 C ATOM 0 H LEU A 109 1.896 -9.824 -11.368 1.00 0.00 H new ATOM 0 HA LEU A 109 0.300 -9.483 -13.865 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -0.163 -9.083 -11.076 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -0.101 -7.482 -11.786 1.00 0.00 H new ATOM 0 HG LEU A 109 -1.771 -8.120 -13.489 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -2.828 -10.360 -13.408 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -1.082 -10.489 -13.728 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -1.716 -10.838 -12.103 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -3.704 -8.507 -11.979 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.590 -8.984 -10.676 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -2.582 -7.312 -11.285 1.00 0.00 H new ATOM 1612 N GLU A 110 1.245 -7.218 -14.576 1.00 0.00 N ATOM 1613 CA GLU A 110 2.022 -6.053 -15.084 1.00 0.00 C ATOM 1614 C GLU A 110 1.327 -5.460 -16.312 1.00 0.00 C ATOM 1615 O GLU A 110 0.273 -5.906 -16.720 1.00 0.00 O ATOM 1616 CB GLU A 110 3.432 -6.510 -15.466 1.00 0.00 C ATOM 1617 CG GLU A 110 4.435 -5.977 -14.442 1.00 0.00 C ATOM 1618 CD GLU A 110 5.644 -6.912 -14.374 1.00 0.00 C ATOM 1619 OE1 GLU A 110 5.765 -7.757 -15.247 1.00 0.00 O ATOM 1620 OE2 GLU A 110 6.429 -6.768 -13.450 1.00 0.00 O ATOM 0 H GLU A 110 0.429 -7.474 -15.132 1.00 0.00 H new ATOM 0 HA GLU A 110 2.082 -5.293 -14.305 1.00 0.00 H new ATOM 0 HB2 GLU A 110 3.476 -7.599 -15.502 1.00 0.00 H new ATOM 0 HB3 GLU A 110 3.686 -6.148 -16.462 1.00 0.00 H new ATOM 0 HG2 GLU A 110 4.754 -4.972 -14.719 1.00 0.00 H new ATOM 0 HG3 GLU A 110 3.964 -5.902 -13.462 1.00 0.00 H new ATOM 1627 N GLU A 111 1.914 -4.456 -16.900 1.00 0.00 N ATOM 1628 CA GLU A 111 1.300 -3.823 -18.099 1.00 0.00 C ATOM 1629 C GLU A 111 2.230 -2.723 -18.615 1.00 0.00 C ATOM 1630 O GLU A 111 3.307 -2.992 -19.106 1.00 0.00 O ATOM 1631 CB GLU A 111 -0.073 -3.250 -17.730 1.00 0.00 C ATOM 1632 CG GLU A 111 -0.736 -2.663 -18.978 1.00 0.00 C ATOM 1633 CD GLU A 111 -1.880 -3.574 -19.426 1.00 0.00 C ATOM 1634 OE1 GLU A 111 -1.737 -4.778 -19.302 1.00 0.00 O ATOM 1635 OE2 GLU A 111 -2.882 -3.050 -19.886 1.00 0.00 O ATOM 0 H GLU A 111 2.798 -4.045 -16.600 1.00 0.00 H new ATOM 0 HA GLU A 111 1.162 -4.564 -18.886 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -0.702 -4.032 -17.305 1.00 0.00 H new ATOM 0 HB3 GLU A 111 0.036 -2.479 -16.967 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -1.115 -1.664 -18.765 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -0.003 -2.562 -19.778 1.00 0.00 H new ATOM 1642 N ILE A 112 1.830 -1.497 -18.508 1.00 0.00 N ATOM 1643 CA ILE A 112 2.696 -0.385 -18.992 1.00 0.00 C ATOM 1644 C ILE A 112 3.775 -0.091 -17.948 1.00 0.00 C ATOM 1645 O ILE A 112 3.483 0.224 -16.812 1.00 0.00 O ATOM 1646 CB ILE A 112 1.845 0.866 -19.213 1.00 0.00 C ATOM 1647 CG1 ILE A 112 0.692 0.535 -20.164 1.00 0.00 C ATOM 1648 CG2 ILE A 112 2.708 1.970 -19.828 1.00 0.00 C ATOM 1649 CD1 ILE A 112 -0.555 1.316 -19.746 1.00 0.00 C ATOM 0 H ILE A 112 0.938 -1.209 -18.106 1.00 0.00 H new ATOM 0 HA ILE A 112 3.167 -0.673 -19.932 1.00 0.00 H new ATOM 0 HB ILE A 112 1.446 1.206 -18.258 1.00 0.00 H new ATOM 0 HG12 ILE A 112 0.967 0.789 -21.188 1.00 0.00 H new ATOM 0 HG13 ILE A 112 0.487 -0.535 -20.145 1.00 0.00 H new ATOM 0 HG21 ILE A 112 2.101 2.861 -19.985 1.00 0.00 H new ATOM 0 HG22 ILE A 112 3.531 2.206 -19.154 1.00 0.00 H new ATOM 0 HG23 ILE A 112 3.107 1.630 -20.783 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -1.376 1.080 -20.423 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -0.833 1.040 -18.729 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -0.346 2.385 -19.788 1.00 0.00 H new ATOM 1661 N ARG A 113 5.021 -0.191 -18.322 1.00 0.00 N ATOM 1662 CA ARG A 113 6.116 0.085 -17.350 1.00 0.00 C ATOM 1663 C ARG A 113 6.493 1.566 -17.417 1.00 0.00 C ATOM 1664 O ARG A 113 6.368 2.293 -16.452 1.00 0.00 O ATOM 1665 CB ARG A 113 7.339 -0.768 -17.699 1.00 0.00 C ATOM 1666 CG ARG A 113 7.830 -1.494 -16.445 1.00 0.00 C ATOM 1667 CD ARG A 113 8.410 -2.855 -16.838 1.00 0.00 C ATOM 1668 NE ARG A 113 9.678 -3.089 -16.091 1.00 0.00 N ATOM 1669 CZ ARG A 113 10.360 -4.184 -16.289 1.00 0.00 C ATOM 1670 NH1 ARG A 113 10.924 -4.402 -17.445 1.00 0.00 N ATOM 1671 NH2 ARG A 113 10.479 -5.062 -15.330 1.00 0.00 N ATOM 0 H ARG A 113 5.328 -0.452 -19.259 1.00 0.00 H new ATOM 0 HA ARG A 113 5.778 -0.161 -16.343 1.00 0.00 H new ATOM 0 HB2 ARG A 113 7.082 -1.491 -18.473 1.00 0.00 H new ATOM 0 HB3 ARG A 113 8.132 -0.138 -18.101 1.00 0.00 H new ATOM 0 HG2 ARG A 113 8.588 -0.896 -15.939 1.00 0.00 H new ATOM 0 HG3 ARG A 113 7.007 -1.626 -15.743 1.00 0.00 H new ATOM 0 HD2 ARG A 113 7.693 -3.646 -16.616 1.00 0.00 H new ATOM 0 HD3 ARG A 113 8.597 -2.887 -17.911 1.00 0.00 H new ATOM 0 HE ARG A 113 10.013 -2.393 -15.425 1.00 0.00 H new ATOM 0 HH11 ARG A 113 10.832 -3.716 -18.195 1.00 0.00 H new ATOM 0 HH12 ARG A 113 11.457 -5.258 -17.599 1.00 0.00 H new ATOM 0 HH21 ARG A 113 10.039 -4.892 -14.426 1.00 0.00 H new ATOM 0 HH22 ARG A 113 11.012 -5.918 -15.485 1.00 0.00 H new ATOM 1685 N SER A 114 6.950 2.019 -18.553 1.00 0.00 N ATOM 1686 CA SER A 114 7.333 3.452 -18.683 1.00 0.00 C ATOM 1687 C SER A 114 8.432 3.782 -17.670 1.00 0.00 C ATOM 1688 O SER A 114 8.148 4.177 -16.556 1.00 0.00 O ATOM 1689 CB SER A 114 6.111 4.331 -18.414 1.00 0.00 C ATOM 1690 OG SER A 114 5.847 5.131 -19.559 1.00 0.00 O ATOM 0 H SER A 114 7.074 1.458 -19.396 1.00 0.00 H new ATOM 0 HA SER A 114 7.702 3.639 -19.691 1.00 0.00 H new ATOM 0 HB2 SER A 114 5.246 3.710 -18.183 1.00 0.00 H new ATOM 0 HB3 SER A 114 6.289 4.966 -17.546 1.00 0.00 H new ATOM 0 HG SER A 114 5.434 5.975 -19.280 1.00 0.00 H new ATOM 1696 N PRO A 115 9.661 3.612 -18.090 1.00 0.00 N ATOM 1697 CA PRO A 115 10.836 3.884 -17.244 1.00 0.00 C ATOM 1698 C PRO A 115 11.102 5.390 -17.168 1.00 0.00 C ATOM 1699 O PRO A 115 10.282 6.196 -17.559 1.00 0.00 O ATOM 1700 CB PRO A 115 11.975 3.161 -17.969 1.00 0.00 C ATOM 1701 CG PRO A 115 11.525 3.006 -19.442 1.00 0.00 C ATOM 1702 CD PRO A 115 9.990 3.132 -19.448 1.00 0.00 C ATOM 0 HA PRO A 115 10.712 3.547 -16.215 1.00 0.00 H new ATOM 0 HB2 PRO A 115 12.901 3.732 -17.904 1.00 0.00 H new ATOM 0 HB3 PRO A 115 12.168 2.188 -17.517 1.00 0.00 H new ATOM 0 HG2 PRO A 115 11.979 3.773 -20.069 1.00 0.00 H new ATOM 0 HG3 PRO A 115 11.836 2.041 -19.843 1.00 0.00 H new ATOM 0 HD2 PRO A 115 9.651 3.832 -20.211 1.00 0.00 H new ATOM 0 HD3 PRO A 115 9.513 2.175 -19.659 1.00 0.00 H new ATOM 1710 N GLY A 116 12.244 5.776 -16.667 1.00 0.00 N ATOM 1711 CA GLY A 116 12.559 7.230 -16.566 1.00 0.00 C ATOM 1712 C GLY A 116 14.057 7.415 -16.320 1.00 0.00 C ATOM 1713 O GLY A 116 14.479 7.778 -15.240 1.00 0.00 O ATOM 0 H GLY A 116 12.971 5.149 -16.324 1.00 0.00 H new ATOM 0 HA2 GLY A 116 12.265 7.741 -17.483 1.00 0.00 H new ATOM 0 HA3 GLY A 116 11.989 7.680 -15.754 1.00 0.00 H new ATOM 1717 N SER A 117 14.866 7.170 -17.314 1.00 0.00 N ATOM 1718 CA SER A 117 16.336 7.333 -17.137 1.00 0.00 C ATOM 1719 C SER A 117 16.947 7.875 -18.431 1.00 0.00 C ATOM 1720 O SER A 117 17.092 7.165 -19.405 1.00 0.00 O ATOM 1721 CB SER A 117 16.962 5.979 -16.805 1.00 0.00 C ATOM 1722 OG SER A 117 16.114 4.940 -17.277 1.00 0.00 O ATOM 0 H SER A 117 14.572 6.864 -18.241 1.00 0.00 H new ATOM 0 HA SER A 117 16.530 8.032 -16.323 1.00 0.00 H new ATOM 0 HB2 SER A 117 17.946 5.898 -17.266 1.00 0.00 H new ATOM 0 HB3 SER A 117 17.105 5.886 -15.728 1.00 0.00 H new ATOM 0 HG SER A 117 16.514 4.070 -17.067 1.00 0.00 H new ATOM 1728 N GLY A 118 17.303 9.131 -18.450 1.00 0.00 N ATOM 1729 CA GLY A 118 17.903 9.716 -19.683 1.00 0.00 C ATOM 1730 C GLY A 118 16.809 10.400 -20.507 1.00 0.00 C ATOM 1731 O GLY A 118 15.659 10.439 -20.118 1.00 0.00 O ATOM 0 H GLY A 118 17.204 9.776 -17.666 1.00 0.00 H new ATOM 0 HA2 GLY A 118 18.677 10.436 -19.417 1.00 0.00 H new ATOM 0 HA3 GLY A 118 18.383 8.935 -20.273 1.00 0.00 H new ATOM 1735 N ARG A 119 17.158 10.937 -21.644 1.00 0.00 N ATOM 1736 CA ARG A 119 16.137 11.615 -22.491 1.00 0.00 C ATOM 1737 C ARG A 119 16.720 11.882 -23.880 1.00 0.00 C ATOM 1738 O ARG A 119 17.787 12.448 -24.017 1.00 0.00 O ATOM 1739 CB ARG A 119 15.735 12.941 -21.845 1.00 0.00 C ATOM 1740 CG ARG A 119 14.209 13.034 -21.774 1.00 0.00 C ATOM 1741 CD ARG A 119 13.793 14.497 -21.614 1.00 0.00 C ATOM 1742 NE ARG A 119 13.450 15.063 -22.949 1.00 0.00 N ATOM 1743 CZ ARG A 119 14.314 15.808 -23.581 1.00 0.00 C ATOM 1744 NH1 ARG A 119 15.288 15.253 -24.248 1.00 0.00 N ATOM 1745 NH2 ARG A 119 14.204 17.108 -23.546 1.00 0.00 N ATOM 0 H ARG A 119 18.105 10.935 -22.023 1.00 0.00 H new ATOM 0 HA ARG A 119 15.260 10.974 -22.582 1.00 0.00 H new ATOM 0 HB2 ARG A 119 16.161 13.014 -20.844 1.00 0.00 H new ATOM 0 HB3 ARG A 119 16.134 13.775 -22.423 1.00 0.00 H new ATOM 0 HG2 ARG A 119 13.766 12.616 -22.678 1.00 0.00 H new ATOM 0 HG3 ARG A 119 13.837 12.445 -20.935 1.00 0.00 H new ATOM 0 HD2 ARG A 119 12.936 14.572 -20.944 1.00 0.00 H new ATOM 0 HD3 ARG A 119 14.603 15.069 -21.161 1.00 0.00 H new ATOM 0 HE ARG A 119 12.541 14.868 -23.368 1.00 0.00 H new ATOM 0 HH11 ARG A 119 15.374 14.237 -24.275 1.00 0.00 H new ATOM 0 HH12 ARG A 119 15.964 15.835 -24.743 1.00 0.00 H new ATOM 0 HH21 ARG A 119 13.442 17.541 -23.024 1.00 0.00 H new ATOM 0 HH22 ARG A 119 14.880 17.690 -24.040 1.00 0.00 H new ATOM 1759 N GLY A 120 16.030 11.479 -24.911 1.00 0.00 N ATOM 1760 CA GLY A 120 16.547 11.711 -26.290 1.00 0.00 C ATOM 1761 C GLY A 120 17.769 10.824 -26.536 1.00 0.00 C ATOM 1762 O GLY A 120 17.813 9.683 -26.121 1.00 0.00 O ATOM 0 H GLY A 120 15.131 10.999 -24.859 1.00 0.00 H new ATOM 0 HA2 GLY A 120 15.771 11.489 -27.022 1.00 0.00 H new ATOM 0 HA3 GLY A 120 16.815 12.760 -26.417 1.00 0.00 H new ATOM 1766 N ARG A 121 18.761 11.340 -27.209 1.00 0.00 N ATOM 1767 CA ARG A 121 19.979 10.526 -27.482 1.00 0.00 C ATOM 1768 C ARG A 121 19.590 9.271 -28.265 1.00 0.00 C ATOM 1769 O ARG A 121 20.258 8.258 -28.204 1.00 0.00 O ATOM 1770 CB ARG A 121 20.632 10.122 -26.159 1.00 0.00 C ATOM 1771 CG ARG A 121 22.030 10.738 -26.071 1.00 0.00 C ATOM 1772 CD ARG A 121 22.061 11.776 -24.948 1.00 0.00 C ATOM 1773 NE ARG A 121 21.686 13.111 -25.494 1.00 0.00 N ATOM 1774 CZ ARG A 121 22.614 13.983 -25.781 1.00 0.00 C ATOM 1775 NH1 ARG A 121 23.221 13.933 -26.935 1.00 0.00 N ATOM 1776 NH2 ARG A 121 22.934 14.905 -24.915 1.00 0.00 N ATOM 0 H ARG A 121 18.781 12.289 -27.581 1.00 0.00 H new ATOM 0 HA ARG A 121 20.684 11.115 -28.068 1.00 0.00 H new ATOM 0 HB2 ARG A 121 20.021 10.459 -25.322 1.00 0.00 H new ATOM 0 HB3 ARG A 121 20.696 9.036 -26.090 1.00 0.00 H new ATOM 0 HG2 ARG A 121 22.770 9.960 -25.882 1.00 0.00 H new ATOM 0 HG3 ARG A 121 22.293 11.205 -27.020 1.00 0.00 H new ATOM 0 HD2 ARG A 121 21.371 11.489 -24.154 1.00 0.00 H new ATOM 0 HD3 ARG A 121 23.056 11.819 -24.505 1.00 0.00 H new ATOM 0 HE ARG A 121 20.704 13.343 -25.643 1.00 0.00 H new ATOM 0 HH11 ARG A 121 22.970 13.213 -27.612 1.00 0.00 H new ATOM 0 HH12 ARG A 121 23.946 14.614 -27.160 1.00 0.00 H new ATOM 0 HH21 ARG A 121 22.459 14.945 -24.013 1.00 0.00 H new ATOM 0 HH22 ARG A 121 23.659 15.586 -25.140 1.00 0.00 H new ATOM 1790 N ARG A 122 18.512 9.328 -29.000 1.00 0.00 N ATOM 1791 CA ARG A 122 18.082 8.137 -29.786 1.00 0.00 C ATOM 1792 C ARG A 122 18.840 8.106 -31.116 1.00 0.00 C ATOM 1793 O ARG A 122 19.214 7.057 -31.603 1.00 0.00 O ATOM 1794 CB ARG A 122 16.579 8.219 -30.057 1.00 0.00 C ATOM 1795 CG ARG A 122 15.980 6.811 -30.053 1.00 0.00 C ATOM 1796 CD ARG A 122 15.302 6.542 -31.397 1.00 0.00 C ATOM 1797 NE ARG A 122 14.148 7.470 -31.566 1.00 0.00 N ATOM 1798 CZ ARG A 122 13.950 8.063 -32.712 1.00 0.00 C ATOM 1799 NH1 ARG A 122 14.960 8.563 -33.370 1.00 0.00 N ATOM 1800 NH2 ARG A 122 12.744 8.154 -33.200 1.00 0.00 N ATOM 0 H ARG A 122 17.911 10.147 -29.090 1.00 0.00 H new ATOM 0 HA ARG A 122 18.299 7.230 -29.221 1.00 0.00 H new ATOM 0 HB2 ARG A 122 16.095 8.833 -29.298 1.00 0.00 H new ATOM 0 HB3 ARG A 122 16.398 8.700 -31.018 1.00 0.00 H new ATOM 0 HG2 ARG A 122 16.761 6.072 -29.873 1.00 0.00 H new ATOM 0 HG3 ARG A 122 15.257 6.714 -29.243 1.00 0.00 H new ATOM 0 HD2 ARG A 122 16.015 6.679 -32.210 1.00 0.00 H new ATOM 0 HD3 ARG A 122 14.961 5.508 -31.444 1.00 0.00 H new ATOM 0 HE ARG A 122 13.513 7.642 -30.786 1.00 0.00 H new ATOM 0 HH11 ARG A 122 15.903 8.490 -32.989 1.00 0.00 H new ATOM 0 HH12 ARG A 122 14.806 9.026 -34.265 1.00 0.00 H new ATOM 0 HH21 ARG A 122 11.955 7.762 -32.686 1.00 0.00 H new ATOM 0 HH22 ARG A 122 12.590 8.617 -34.095 1.00 0.00 H new ATOM 1814 N ARG A 123 19.066 9.246 -31.708 1.00 0.00 N ATOM 1815 CA ARG A 123 19.797 9.281 -33.006 1.00 0.00 C ATOM 1816 C ARG A 123 21.235 8.800 -32.794 1.00 0.00 C ATOM 1817 O ARG A 123 21.664 7.822 -33.373 1.00 0.00 O ATOM 1818 CB ARG A 123 19.811 10.712 -33.546 1.00 0.00 C ATOM 1819 CG ARG A 123 18.384 11.143 -33.891 1.00 0.00 C ATOM 1820 CD ARG A 123 17.911 12.197 -32.888 1.00 0.00 C ATOM 1821 NE ARG A 123 17.057 13.198 -33.586 1.00 0.00 N ATOM 1822 CZ ARG A 123 16.377 14.072 -32.894 1.00 0.00 C ATOM 1823 NH1 ARG A 123 16.976 15.122 -32.400 1.00 0.00 N ATOM 1824 NH2 ARG A 123 15.099 13.896 -32.696 1.00 0.00 N ATOM 0 H ARG A 123 18.776 10.156 -31.349 1.00 0.00 H new ATOM 0 HA ARG A 123 19.298 8.629 -33.722 1.00 0.00 H new ATOM 0 HB2 ARG A 123 20.237 11.388 -32.804 1.00 0.00 H new ATOM 0 HB3 ARG A 123 20.444 10.771 -34.431 1.00 0.00 H new ATOM 0 HG2 ARG A 123 18.350 11.547 -34.903 1.00 0.00 H new ATOM 0 HG3 ARG A 123 17.717 10.281 -33.870 1.00 0.00 H new ATOM 0 HD2 ARG A 123 17.350 11.723 -32.083 1.00 0.00 H new ATOM 0 HD3 ARG A 123 18.769 12.690 -32.431 1.00 0.00 H new ATOM 0 HE ARG A 123 17.003 13.201 -34.605 1.00 0.00 H new ATOM 0 HH11 ARG A 123 17.975 15.259 -32.555 1.00 0.00 H new ATOM 0 HH12 ARG A 123 16.445 15.805 -31.859 1.00 0.00 H new ATOM 0 HH21 ARG A 123 14.631 13.076 -33.082 1.00 0.00 H new ATOM 0 HH22 ARG A 123 14.568 14.579 -32.155 1.00 0.00 H new ATOM 1838 N ARG A 124 21.982 9.480 -31.968 1.00 0.00 N ATOM 1839 CA ARG A 124 23.391 9.060 -31.720 1.00 0.00 C ATOM 1840 C ARG A 124 23.402 7.802 -30.850 1.00 0.00 C ATOM 1841 O ARG A 124 24.475 7.412 -30.420 1.00 0.00 O ATOM 1842 CB ARG A 124 24.142 10.185 -31.003 1.00 0.00 C ATOM 1843 CG ARG A 124 23.501 10.439 -29.637 1.00 0.00 C ATOM 1844 CD ARG A 124 24.480 11.210 -28.751 1.00 0.00 C ATOM 1845 NE ARG A 124 25.724 10.410 -28.571 1.00 0.00 N ATOM 1846 CZ ARG A 124 26.579 10.732 -27.640 1.00 0.00 C ATOM 1847 NH1 ARG A 124 26.882 11.985 -27.437 1.00 0.00 N ATOM 1848 NH2 ARG A 124 27.131 9.801 -26.911 1.00 0.00 N ATOM 1849 OXT ARG A 124 22.337 7.250 -30.627 1.00 0.00 O ATOM 0 H ARG A 124 21.678 10.307 -31.454 1.00 0.00 H new ATOM 0 HA ARG A 124 23.879 8.848 -32.671 1.00 0.00 H new ATOM 0 HB2 ARG A 124 25.191 9.915 -30.880 1.00 0.00 H new ATOM 0 HB3 ARG A 124 24.115 11.094 -31.603 1.00 0.00 H new ATOM 0 HG2 ARG A 124 22.578 11.006 -29.756 1.00 0.00 H new ATOM 0 HG3 ARG A 124 23.235 9.492 -29.166 1.00 0.00 H new ATOM 0 HD2 ARG A 124 24.717 12.173 -29.204 1.00 0.00 H new ATOM 0 HD3 ARG A 124 24.025 11.417 -27.782 1.00 0.00 H new ATOM 0 HE ARG A 124 25.907 9.610 -29.176 1.00 0.00 H new ATOM 0 HH11 ARG A 124 26.450 12.713 -28.006 1.00 0.00 H new ATOM 0 HH12 ARG A 124 27.551 12.237 -26.709 1.00 0.00 H new ATOM 0 HH21 ARG A 124 26.894 8.822 -27.069 1.00 0.00 H new ATOM 0 HH22 ARG A 124 27.800 10.053 -26.183 1.00 0.00 H new TER 1863 ARG A 124