USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 898 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 99 LYS NZ :NH3+ 179:sc= -0.0096 (180deg=-0.0125) USER MOD Set 1.2: A 115 TYR OH : rot 180:sc= -0.762 USER MOD Set 2.1: A 54 ASN : amide:sc= -0.0485 X(o=-0.049,f=0) USER MOD Set 2.2: A 84 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 79 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 HIS : no HD1:sc= -1.12 K(o=-1.1,f=-2.8) USER MOD Single : A 16 THR OG1 : rot -99:sc= 0.958 USER MOD Single : A 17 THR OG1 : rot -39:sc= 0.165 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0198) USER MOD Single : A 28 GLN : amide:sc= -1.67! K(o=-1.7!,f=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0616) USER MOD Single : A 57 TYR OH : rot 30:sc= -0.35 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 HIS : no HE2:sc= -0.742 K(o=-0.74,f=-3.1!) USER MOD Single : A 62 TYR OH : rot 0:sc= -1.36 USER MOD Single : A 64 THR OG1 : rot 132:sc= 0.962 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.067) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 SER OG : rot 39:sc= 0.482 USER MOD Single : A 95 SER OG : rot 180:sc= 0.247 USER MOD Single : A 98 TYR OH : rot -7:sc= 0.198 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0.016) USER MOD Single : A 116 CYS SG : rot 145:sc= -15! USER MOD Single : A 119 LYS NZ :NH3+ -137:sc= -0.0353 (180deg=-1.19) USER MOD Single : A 120 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 4 -9.459 -17.560 -13.855 1.00 0.00 N ATOM 2 CA TYR A 4 -8.061 -17.439 -13.399 1.00 0.00 C ATOM 3 C TYR A 4 -7.987 -17.100 -11.900 1.00 0.00 C ATOM 4 O TYR A 4 -8.507 -17.838 -11.060 1.00 0.00 O ATOM 5 CB TYR A 4 -7.282 -16.535 -14.348 1.00 0.00 C ATOM 6 CG TYR A 4 -5.772 -16.725 -14.341 1.00 0.00 C ATOM 7 CD1 TYR A 4 -5.207 -17.822 -14.919 1.00 0.00 C ATOM 8 CD2 TYR A 4 -4.979 -15.702 -13.929 1.00 0.00 C ATOM 9 CE1 TYR A 4 -3.861 -17.890 -15.080 1.00 0.00 C ATOM 10 CE2 TYR A 4 -3.633 -15.768 -14.089 1.00 0.00 C ATOM 11 CZ TYR A 4 -3.071 -16.866 -14.658 1.00 0.00 C ATOM 12 OH TYR A 4 -1.716 -16.922 -14.850 1.00 0.00 O ATOM 0 HA TYR A 4 -7.550 -18.400 -13.455 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -7.647 -16.701 -15.362 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -7.501 -15.498 -14.096 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -5.831 -18.639 -15.250 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -5.423 -14.830 -13.471 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -3.417 -18.758 -15.544 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -3.009 -14.948 -13.764 1.00 0.00 H new ATOM 0 HH TYR A 4 -1.301 -16.110 -14.491 1.00 0.00 H new ATOM 22 N LYS A 5 -7.393 -15.962 -11.570 1.00 0.00 N ATOM 23 CA LYS A 5 -7.435 -15.434 -10.207 1.00 0.00 C ATOM 24 C LYS A 5 -8.392 -14.244 -10.043 1.00 0.00 C ATOM 25 O LYS A 5 -8.757 -13.535 -10.980 1.00 0.00 O ATOM 26 CB LYS A 5 -6.004 -14.982 -9.880 1.00 0.00 C ATOM 27 CG LYS A 5 -4.982 -16.124 -9.773 1.00 0.00 C ATOM 28 CD LYS A 5 -5.265 -17.065 -8.597 1.00 0.00 C ATOM 29 CE LYS A 5 -4.191 -18.151 -8.494 1.00 0.00 C ATOM 30 NZ LYS A 5 -4.485 -19.053 -7.368 1.00 0.00 N ATOM 0 H LYS A 5 -6.873 -15.382 -12.228 1.00 0.00 H new ATOM 0 HA LYS A 5 -7.805 -16.210 -9.536 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -5.672 -14.286 -10.650 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -6.016 -14.434 -8.938 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -4.986 -16.697 -10.700 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -3.983 -15.702 -9.663 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -5.300 -16.494 -7.669 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -6.244 -17.527 -8.724 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -4.148 -18.719 -9.423 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -3.212 -17.692 -8.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -3.749 -19.785 -7.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -4.503 -18.508 -6.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -5.411 -19.503 -7.517 1.00 0.00 H new ATOM 44 N THR A 6 -8.743 -14.031 -8.781 1.00 0.00 N ATOM 45 CA THR A 6 -9.478 -12.832 -8.349 1.00 0.00 C ATOM 46 C THR A 6 -8.436 -11.815 -7.864 1.00 0.00 C ATOM 47 O THR A 6 -7.668 -12.137 -6.956 1.00 0.00 O ATOM 48 CB THR A 6 -10.414 -13.301 -7.215 1.00 0.00 C ATOM 49 OG1 THR A 6 -11.529 -13.971 -7.790 1.00 0.00 O ATOM 50 CG2 THR A 6 -10.933 -12.184 -6.306 1.00 0.00 C ATOM 0 H THR A 6 -8.530 -14.679 -8.023 1.00 0.00 H new ATOM 0 HA THR A 6 -10.070 -12.360 -9.133 1.00 0.00 H new ATOM 0 HB THR A 6 -9.814 -13.954 -6.582 1.00 0.00 H new ATOM 0 HG1 THR A 6 -12.130 -14.275 -7.079 1.00 0.00 H new ATOM 0 HG21 THR A 6 -11.582 -12.610 -5.541 1.00 0.00 H new ATOM 0 HG22 THR A 6 -10.091 -11.682 -5.830 1.00 0.00 H new ATOM 0 HG23 THR A 6 -11.496 -11.464 -6.900 1.00 0.00 H new ATOM 58 N GLY A 7 -8.353 -10.622 -8.464 1.00 0.00 N ATOM 59 CA GLY A 7 -7.315 -9.668 -8.043 1.00 0.00 C ATOM 60 C GLY A 7 -7.840 -8.301 -7.599 1.00 0.00 C ATOM 61 O GLY A 7 -8.957 -8.161 -7.098 1.00 0.00 O ATOM 0 H GLY A 7 -8.965 -10.300 -9.214 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.749 -10.108 -7.222 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.618 -9.523 -8.869 1.00 0.00 H new ATOM 65 N LEU A 8 -6.957 -7.307 -7.692 1.00 0.00 N ATOM 66 CA LEU A 8 -7.175 -6.011 -7.051 1.00 0.00 C ATOM 67 C LEU A 8 -6.838 -4.943 -8.074 1.00 0.00 C ATOM 68 O LEU A 8 -5.859 -5.047 -8.817 1.00 0.00 O ATOM 69 CB LEU A 8 -6.175 -5.859 -5.888 1.00 0.00 C ATOM 70 CG LEU A 8 -6.455 -4.658 -4.979 1.00 0.00 C ATOM 71 CD1 LEU A 8 -7.823 -4.751 -4.297 1.00 0.00 C ATOM 72 CD2 LEU A 8 -5.353 -4.545 -3.924 1.00 0.00 C ATOM 0 H LEU A 8 -6.080 -7.376 -8.208 1.00 0.00 H new ATOM 0 HA LEU A 8 -8.200 -5.927 -6.691 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -6.191 -6.768 -5.287 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -5.169 -5.765 -6.297 1.00 0.00 H new ATOM 0 HG LEU A 8 -6.466 -3.766 -5.606 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -7.974 -3.877 -3.664 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -8.605 -4.790 -5.055 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -7.864 -5.653 -3.686 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.554 -3.690 -3.278 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.329 -5.455 -3.324 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -4.390 -4.409 -4.417 1.00 0.00 H new ATOM 84 N LEU A 9 -7.609 -3.871 -8.054 1.00 0.00 N ATOM 85 CA LEU A 9 -7.237 -2.696 -8.802 1.00 0.00 C ATOM 86 C LEU A 9 -7.190 -1.530 -7.809 1.00 0.00 C ATOM 87 O LEU A 9 -8.113 -1.268 -7.038 1.00 0.00 O ATOM 88 CB LEU A 9 -8.264 -2.589 -9.926 1.00 0.00 C ATOM 89 CG LEU A 9 -8.277 -1.209 -10.557 1.00 0.00 C ATOM 90 CD1 LEU A 9 -6.931 -0.947 -11.219 1.00 0.00 C ATOM 91 CD2 LEU A 9 -9.396 -1.223 -11.572 1.00 0.00 C ATOM 0 H LEU A 9 -8.483 -3.794 -7.534 1.00 0.00 H new ATOM 0 HA LEU A 9 -6.254 -2.714 -9.272 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -8.044 -3.335 -10.690 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -9.255 -2.817 -9.534 1.00 0.00 H new ATOM 0 HG LEU A 9 -8.438 -0.418 -9.825 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -6.936 0.044 -11.674 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -6.141 -0.998 -10.470 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -6.751 -1.698 -11.988 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -9.455 -0.251 -12.062 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -9.201 -1.994 -12.318 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.340 -1.434 -11.070 1.00 0.00 H new ATOM 103 N LEU A 10 -6.068 -0.831 -7.883 1.00 0.00 N ATOM 104 CA LEU A 10 -5.895 0.433 -7.155 1.00 0.00 C ATOM 105 C LEU A 10 -5.901 1.529 -8.217 1.00 0.00 C ATOM 106 O LEU A 10 -5.120 1.501 -9.165 1.00 0.00 O ATOM 107 CB LEU A 10 -4.598 0.460 -6.308 1.00 0.00 C ATOM 108 CG LEU A 10 -4.852 0.477 -4.799 1.00 0.00 C ATOM 109 CD1 LEU A 10 -3.547 0.224 -4.050 1.00 0.00 C ATOM 110 CD2 LEU A 10 -5.411 1.830 -4.357 1.00 0.00 C ATOM 0 H LEU A 10 -5.259 -1.111 -8.438 1.00 0.00 H new ATOM 0 HA LEU A 10 -6.698 0.573 -6.431 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -3.994 -0.412 -6.556 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.015 1.340 -6.580 1.00 0.00 H new ATOM 0 HG LEU A 10 -5.576 -0.305 -4.571 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.735 0.237 -2.976 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.146 -0.748 -4.336 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.826 1.002 -4.302 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -5.584 1.818 -3.281 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -4.697 2.616 -4.601 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -6.352 2.021 -4.873 1.00 0.00 H new ATOM 122 N ILE A 11 -6.845 2.452 -8.117 1.00 0.00 N ATOM 123 CA ILE A 11 -7.008 3.468 -9.171 1.00 0.00 C ATOM 124 C ILE A 11 -7.118 4.851 -8.528 1.00 0.00 C ATOM 125 O ILE A 11 -7.778 5.035 -7.503 1.00 0.00 O ATOM 126 CB ILE A 11 -8.208 3.071 -10.047 1.00 0.00 C ATOM 127 CG1 ILE A 11 -8.337 3.960 -11.288 1.00 0.00 C ATOM 128 CG2 ILE A 11 -9.536 3.027 -9.278 1.00 0.00 C ATOM 129 CD1 ILE A 11 -9.345 3.375 -12.278 1.00 0.00 C ATOM 0 H ILE A 11 -7.501 2.528 -7.340 1.00 0.00 H new ATOM 0 HA ILE A 11 -6.143 3.519 -9.832 1.00 0.00 H new ATOM 0 HB ILE A 11 -7.996 2.053 -10.374 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -8.651 4.961 -10.992 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.365 4.061 -11.770 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.340 2.740 -9.956 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -9.465 2.298 -8.471 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -9.747 4.011 -8.860 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -9.418 4.025 -13.150 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -9.015 2.384 -12.591 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -10.322 3.298 -11.800 1.00 0.00 H new ATOM 141 N HIS A 12 -6.482 5.832 -9.151 1.00 0.00 N ATOM 142 CA HIS A 12 -6.600 7.216 -8.673 1.00 0.00 C ATOM 143 C HIS A 12 -7.608 7.959 -9.573 1.00 0.00 C ATOM 144 O HIS A 12 -7.473 7.911 -10.797 1.00 0.00 O ATOM 145 CB HIS A 12 -5.225 7.888 -8.782 1.00 0.00 C ATOM 146 CG HIS A 12 -5.197 9.396 -8.555 1.00 0.00 C ATOM 147 ND1 HIS A 12 -5.939 10.099 -7.615 1.00 0.00 N ATOM 148 CD2 HIS A 12 -4.411 10.266 -9.318 1.00 0.00 C ATOM 149 CE1 HIS A 12 -5.503 11.366 -7.909 1.00 0.00 C ATOM 150 NE2 HIS A 12 -4.587 11.568 -8.903 1.00 0.00 N ATOM 0 H HIS A 12 -5.889 5.708 -9.972 1.00 0.00 H new ATOM 0 HA HIS A 12 -6.941 7.240 -7.638 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -4.556 7.420 -8.060 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -4.820 7.682 -9.773 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -3.757 9.960 -10.121 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -5.886 12.208 -7.352 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -4.159 12.431 -9.239 1.00 0.00 H new ATOM 158 N PRO A 13 -8.611 8.655 -9.023 1.00 0.00 N ATOM 159 CA PRO A 13 -9.710 9.203 -9.838 1.00 0.00 C ATOM 160 C PRO A 13 -9.413 10.252 -10.922 1.00 0.00 C ATOM 161 O PRO A 13 -10.331 10.641 -11.646 1.00 0.00 O ATOM 162 CB PRO A 13 -10.534 9.898 -8.762 1.00 0.00 C ATOM 163 CG PRO A 13 -10.434 8.977 -7.555 1.00 0.00 C ATOM 164 CD PRO A 13 -8.985 8.498 -7.606 1.00 0.00 C ATOM 0 HA PRO A 13 -10.132 8.389 -10.427 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.141 10.890 -8.539 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.569 10.029 -9.077 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -10.652 9.504 -6.626 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -11.136 8.146 -7.622 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -8.344 9.093 -6.955 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -8.895 7.461 -7.281 1.00 0.00 H new ATOM 172 N ALA A 14 -8.217 10.834 -10.959 1.00 0.00 N ATOM 173 CA ALA A 14 -8.055 12.098 -11.707 1.00 0.00 C ATOM 174 C ALA A 14 -8.175 12.001 -13.230 1.00 0.00 C ATOM 175 O ALA A 14 -8.956 12.745 -13.823 1.00 0.00 O ATOM 176 CB ALA A 14 -6.704 12.725 -11.366 1.00 0.00 C ATOM 0 H ALA A 14 -7.375 10.479 -10.506 1.00 0.00 H new ATOM 0 HA ALA A 14 -8.896 12.712 -11.386 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -6.586 13.657 -11.918 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -6.657 12.929 -10.296 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.904 12.037 -11.640 1.00 0.00 H new ATOM 182 N VAL A 15 -7.463 11.079 -13.868 1.00 0.00 N ATOM 183 CA VAL A 15 -7.721 10.819 -15.296 1.00 0.00 C ATOM 184 C VAL A 15 -8.879 9.806 -15.453 1.00 0.00 C ATOM 185 O VAL A 15 -9.603 9.833 -16.449 1.00 0.00 O ATOM 186 CB VAL A 15 -6.434 10.366 -16.014 1.00 0.00 C ATOM 187 CG1 VAL A 15 -6.682 10.059 -17.496 1.00 0.00 C ATOM 188 CG2 VAL A 15 -5.354 11.453 -15.936 1.00 0.00 C ATOM 0 H VAL A 15 -6.727 10.513 -13.446 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.034 11.745 -15.777 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.104 9.460 -15.506 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.749 9.744 -17.963 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -7.420 9.261 -17.584 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.054 10.954 -17.996 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.455 11.111 -16.449 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -5.719 12.363 -16.412 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.119 11.658 -14.892 1.00 0.00 H new ATOM 198 N THR A 16 -9.047 8.904 -14.485 1.00 0.00 N ATOM 199 CA THR A 16 -9.969 7.771 -14.633 1.00 0.00 C ATOM 200 C THR A 16 -11.456 8.088 -14.367 1.00 0.00 C ATOM 201 O THR A 16 -12.297 7.207 -14.552 1.00 0.00 O ATOM 202 CB THR A 16 -9.467 6.627 -13.746 1.00 0.00 C ATOM 203 OG1 THR A 16 -9.495 7.018 -12.379 1.00 0.00 O ATOM 204 CG2 THR A 16 -8.045 6.192 -14.125 1.00 0.00 C ATOM 0 H THR A 16 -8.558 8.934 -13.590 1.00 0.00 H new ATOM 0 HA THR A 16 -9.959 7.486 -15.685 1.00 0.00 H new ATOM 0 HB THR A 16 -10.133 5.778 -13.902 1.00 0.00 H new ATOM 0 HG1 THR A 16 -8.597 7.291 -12.098 1.00 0.00 H new ATOM 0 HG21 THR A 16 -7.727 5.379 -13.472 1.00 0.00 H new ATOM 0 HG22 THR A 16 -8.032 5.852 -15.161 1.00 0.00 H new ATOM 0 HG23 THR A 16 -7.364 7.036 -14.012 1.00 0.00 H new ATOM 212 N THR A 17 -11.822 9.328 -14.033 1.00 0.00 N ATOM 213 CA THR A 17 -13.248 9.714 -14.086 1.00 0.00 C ATOM 214 C THR A 17 -13.737 9.959 -15.539 1.00 0.00 C ATOM 215 O THR A 17 -14.927 10.164 -15.782 1.00 0.00 O ATOM 216 CB THR A 17 -13.454 10.954 -13.194 1.00 0.00 C ATOM 217 OG1 THR A 17 -14.846 11.211 -13.066 1.00 0.00 O ATOM 218 CG2 THR A 17 -12.768 12.218 -13.728 1.00 0.00 C ATOM 0 H THR A 17 -11.183 10.064 -13.732 1.00 0.00 H new ATOM 0 HA THR A 17 -13.854 8.890 -13.709 1.00 0.00 H new ATOM 0 HB THR A 17 -12.996 10.724 -12.232 1.00 0.00 H new ATOM 0 HG1 THR A 17 -15.289 11.048 -13.925 1.00 0.00 H new ATOM 0 HG21 THR A 17 -12.957 13.049 -13.049 1.00 0.00 H new ATOM 0 HG22 THR A 17 -11.694 12.046 -13.801 1.00 0.00 H new ATOM 0 HG23 THR A 17 -13.165 12.458 -14.714 1.00 0.00 H new ATOM 226 N THR A 18 -12.828 9.810 -16.503 1.00 0.00 N ATOM 227 CA THR A 18 -13.163 9.659 -17.925 1.00 0.00 C ATOM 228 C THR A 18 -12.758 8.212 -18.289 1.00 0.00 C ATOM 229 O THR A 18 -11.625 8.004 -18.727 1.00 0.00 O ATOM 230 CB THR A 18 -12.475 10.718 -18.794 1.00 0.00 C ATOM 231 OG1 THR A 18 -12.777 12.015 -18.298 1.00 0.00 O ATOM 232 CG2 THR A 18 -12.999 10.611 -20.226 1.00 0.00 C ATOM 0 H THR A 18 -11.825 9.790 -16.319 1.00 0.00 H new ATOM 0 HA THR A 18 -14.225 9.820 -18.113 1.00 0.00 H new ATOM 0 HB THR A 18 -11.397 10.555 -18.772 1.00 0.00 H new ATOM 0 HG1 THR A 18 -12.334 12.689 -18.855 1.00 0.00 H new ATOM 0 HG21 THR A 18 -12.513 11.362 -20.848 1.00 0.00 H new ATOM 0 HG22 THR A 18 -12.782 9.618 -20.620 1.00 0.00 H new ATOM 0 HG23 THR A 18 -14.076 10.776 -20.233 1.00 0.00 H new ATOM 240 N PRO A 19 -13.502 7.204 -17.806 1.00 0.00 N ATOM 241 CA PRO A 19 -12.986 5.845 -17.555 1.00 0.00 C ATOM 242 C PRO A 19 -12.711 4.980 -18.801 1.00 0.00 C ATOM 243 O PRO A 19 -13.007 3.783 -18.826 1.00 0.00 O ATOM 244 CB PRO A 19 -14.129 5.274 -16.704 1.00 0.00 C ATOM 245 CG PRO A 19 -15.396 5.936 -17.241 1.00 0.00 C ATOM 246 CD PRO A 19 -14.948 7.340 -17.638 1.00 0.00 C ATOM 0 HA PRO A 19 -11.997 5.858 -17.097 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -14.183 4.189 -16.794 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -13.984 5.500 -15.647 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -15.799 5.391 -18.095 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -16.180 5.968 -16.484 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -15.430 7.669 -18.559 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -15.195 8.072 -16.869 1.00 0.00 H new ATOM 254 N GLU A 20 -12.054 5.554 -19.799 1.00 0.00 N ATOM 255 CA GLU A 20 -11.482 4.755 -20.896 1.00 0.00 C ATOM 256 C GLU A 20 -10.354 3.821 -20.422 1.00 0.00 C ATOM 257 O GLU A 20 -10.296 2.656 -20.818 1.00 0.00 O ATOM 258 CB GLU A 20 -10.932 5.748 -21.922 1.00 0.00 C ATOM 259 CG GLU A 20 -10.551 5.084 -23.249 1.00 0.00 C ATOM 260 CD GLU A 20 -10.018 6.108 -24.241 1.00 0.00 C ATOM 261 OE1 GLU A 20 -8.796 6.368 -24.245 1.00 0.00 O ATOM 262 OE2 GLU A 20 -10.822 6.662 -25.023 1.00 0.00 O ATOM 0 H GLU A 20 -11.900 6.559 -19.880 1.00 0.00 H new ATOM 0 HA GLU A 20 -12.256 4.112 -21.316 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -11.678 6.520 -22.109 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -10.056 6.245 -21.506 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -9.797 4.317 -23.072 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -11.422 4.583 -23.672 1.00 0.00 H new ATOM 269 N LEU A 21 -9.459 4.327 -19.573 1.00 0.00 N ATOM 270 CA LEU A 21 -8.403 3.486 -18.981 1.00 0.00 C ATOM 271 C LEU A 21 -8.977 2.354 -18.106 1.00 0.00 C ATOM 272 O LEU A 21 -8.377 1.283 -18.004 1.00 0.00 O ATOM 273 CB LEU A 21 -7.437 4.341 -18.143 1.00 0.00 C ATOM 274 CG LEU A 21 -6.507 5.271 -18.943 1.00 0.00 C ATOM 275 CD1 LEU A 21 -7.235 6.466 -19.565 1.00 0.00 C ATOM 276 CD2 LEU A 21 -5.411 5.800 -18.014 1.00 0.00 C ATOM 0 H LEU A 21 -9.438 5.303 -19.278 1.00 0.00 H new ATOM 0 HA LEU A 21 -7.865 3.028 -19.811 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -8.023 4.948 -17.453 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -6.822 3.675 -17.538 1.00 0.00 H new ATOM 0 HG LEU A 21 -6.094 4.679 -19.760 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -6.522 7.081 -20.114 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -8.006 6.108 -20.247 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -7.696 7.062 -18.777 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -4.747 6.460 -18.573 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -5.866 6.354 -17.193 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -4.838 4.963 -17.614 1.00 0.00 H new ATOM 288 N VAL A 22 -10.141 2.574 -17.487 1.00 0.00 N ATOM 289 CA VAL A 22 -10.832 1.482 -16.768 1.00 0.00 C ATOM 290 C VAL A 22 -11.243 0.359 -17.739 1.00 0.00 C ATOM 291 O VAL A 22 -10.996 -0.815 -17.471 1.00 0.00 O ATOM 292 CB VAL A 22 -12.052 2.028 -15.998 1.00 0.00 C ATOM 293 CG1 VAL A 22 -12.772 0.921 -15.217 1.00 0.00 C ATOM 294 CG2 VAL A 22 -11.658 3.128 -15.009 1.00 0.00 C ATOM 0 H VAL A 22 -10.621 3.474 -17.464 1.00 0.00 H new ATOM 0 HA VAL A 22 -10.139 1.055 -16.043 1.00 0.00 H new ATOM 0 HB VAL A 22 -12.720 2.440 -16.755 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.625 1.345 -14.688 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -13.119 0.154 -15.909 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -12.084 0.476 -14.498 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -12.547 3.484 -14.488 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -10.948 2.729 -14.284 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -11.198 3.955 -15.549 1.00 0.00 H new ATOM 304 N GLU A 23 -11.843 0.711 -18.876 1.00 0.00 N ATOM 305 CA GLU A 23 -12.173 -0.297 -19.900 1.00 0.00 C ATOM 306 C GLU A 23 -10.947 -1.047 -20.448 1.00 0.00 C ATOM 307 O GLU A 23 -11.046 -2.226 -20.778 1.00 0.00 O ATOM 308 CB GLU A 23 -12.889 0.386 -21.072 1.00 0.00 C ATOM 309 CG GLU A 23 -14.257 0.957 -20.682 1.00 0.00 C ATOM 310 CD GLU A 23 -14.913 1.665 -21.861 1.00 0.00 C ATOM 311 OE1 GLU A 23 -15.648 1.007 -22.627 1.00 0.00 O ATOM 312 OE2 GLU A 23 -14.697 2.886 -22.025 1.00 0.00 O ATOM 0 H GLU A 23 -12.109 1.666 -19.115 1.00 0.00 H new ATOM 0 HA GLU A 23 -12.810 -1.034 -19.411 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -12.261 1.190 -21.456 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -13.018 -0.333 -21.881 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -14.904 0.153 -20.332 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -14.140 1.656 -19.854 1.00 0.00 H new ATOM 319 N ASN A 24 -9.801 -0.379 -20.552 1.00 0.00 N ATOM 320 CA ASN A 24 -8.575 -1.022 -21.056 1.00 0.00 C ATOM 321 C ASN A 24 -7.993 -2.056 -20.092 1.00 0.00 C ATOM 322 O ASN A 24 -7.667 -3.171 -20.496 1.00 0.00 O ATOM 323 CB ASN A 24 -7.539 0.079 -21.265 1.00 0.00 C ATOM 324 CG ASN A 24 -6.657 -0.156 -22.488 1.00 0.00 C ATOM 325 OD1 ASN A 24 -5.706 -0.934 -22.458 1.00 0.00 O ATOM 326 ND2 ASN A 24 -6.961 0.518 -23.585 1.00 0.00 N ATOM 0 H ASN A 24 -9.688 0.602 -20.297 1.00 0.00 H new ATOM 0 HA ASN A 24 -8.825 -1.552 -21.975 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -8.050 1.036 -21.371 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -6.909 0.151 -20.378 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -6.401 0.397 -24.429 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -7.755 1.158 -23.587 1.00 0.00 H new ATOM 333 N THR A 25 -7.851 -1.683 -18.821 1.00 0.00 N ATOM 334 CA THR A 25 -7.373 -2.665 -17.824 1.00 0.00 C ATOM 335 C THR A 25 -8.345 -3.859 -17.695 1.00 0.00 C ATOM 336 O THR A 25 -7.921 -5.015 -17.625 1.00 0.00 O ATOM 337 CB THR A 25 -7.020 -2.001 -16.480 1.00 0.00 C ATOM 338 OG1 THR A 25 -6.301 -2.933 -15.686 1.00 0.00 O ATOM 339 CG2 THR A 25 -8.218 -1.508 -15.668 1.00 0.00 C ATOM 0 H THR A 25 -8.048 -0.750 -18.458 1.00 0.00 H new ATOM 0 HA THR A 25 -6.435 -3.083 -18.190 1.00 0.00 H new ATOM 0 HB THR A 25 -6.435 -1.117 -16.732 1.00 0.00 H new ATOM 0 HG1 THR A 25 -6.069 -2.521 -14.828 1.00 0.00 H new ATOM 0 HG21 THR A 25 -7.867 -1.056 -14.740 1.00 0.00 H new ATOM 0 HG22 THR A 25 -8.769 -0.767 -16.247 1.00 0.00 H new ATOM 0 HG23 THR A 25 -8.872 -2.349 -15.438 1.00 0.00 H new ATOM 347 N LYS A 26 -9.647 -3.580 -17.743 1.00 0.00 N ATOM 348 CA LYS A 26 -10.650 -4.647 -17.853 1.00 0.00 C ATOM 349 C LYS A 26 -10.585 -5.404 -19.195 1.00 0.00 C ATOM 350 O LYS A 26 -10.932 -6.583 -19.228 1.00 0.00 O ATOM 351 CB LYS A 26 -12.052 -4.059 -17.629 1.00 0.00 C ATOM 352 CG LYS A 26 -12.241 -3.431 -16.237 1.00 0.00 C ATOM 353 CD LYS A 26 -12.091 -4.421 -15.071 1.00 0.00 C ATOM 354 CE LYS A 26 -13.119 -5.560 -15.076 1.00 0.00 C ATOM 355 NZ LYS A 26 -14.488 -5.048 -14.904 1.00 0.00 N ATOM 0 H LYS A 26 -10.032 -2.636 -17.708 1.00 0.00 H new ATOM 0 HA LYS A 26 -10.427 -5.383 -17.080 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -12.245 -3.302 -18.389 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -12.793 -4.846 -17.767 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -11.515 -2.628 -16.112 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -13.231 -2.977 -16.188 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -11.090 -4.850 -15.100 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -12.176 -3.874 -14.132 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -13.050 -6.110 -16.014 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -12.889 -6.264 -14.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -15.150 -5.846 -14.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -14.537 -4.472 -14.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -14.745 -4.463 -15.724 1.00 0.00 H new ATOM 369 N ALA A 27 -10.167 -4.778 -20.303 1.00 0.00 N ATOM 370 CA ALA A 27 -10.053 -5.518 -21.575 1.00 0.00 C ATOM 371 C ALA A 27 -8.921 -6.557 -21.578 1.00 0.00 C ATOM 372 O ALA A 27 -9.113 -7.681 -22.046 1.00 0.00 O ATOM 373 CB ALA A 27 -9.878 -4.532 -22.731 1.00 0.00 C ATOM 0 H ALA A 27 -9.909 -3.792 -20.351 1.00 0.00 H new ATOM 0 HA ALA A 27 -10.979 -6.080 -21.699 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -9.794 -5.082 -23.669 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -10.741 -3.867 -22.776 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -8.974 -3.943 -22.573 1.00 0.00 H new ATOM 379 N GLN A 28 -7.754 -6.208 -21.036 1.00 0.00 N ATOM 380 CA GLN A 28 -6.693 -7.208 -20.813 1.00 0.00 C ATOM 381 C GLN A 28 -7.163 -8.332 -19.882 1.00 0.00 C ATOM 382 O GLN A 28 -7.049 -9.512 -20.214 1.00 0.00 O ATOM 383 CB GLN A 28 -5.505 -6.549 -20.116 1.00 0.00 C ATOM 384 CG GLN A 28 -4.735 -5.534 -20.969 1.00 0.00 C ATOM 385 CD GLN A 28 -3.729 -4.808 -20.084 1.00 0.00 C ATOM 386 OE1 GLN A 28 -2.514 -4.938 -20.231 1.00 0.00 O ATOM 387 NE2 GLN A 28 -4.242 -4.064 -19.119 1.00 0.00 N ATOM 0 H GLN A 28 -7.515 -5.260 -20.746 1.00 0.00 H new ATOM 0 HA GLN A 28 -6.428 -7.611 -21.790 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -5.863 -6.048 -19.217 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.814 -7.328 -19.793 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -4.222 -6.041 -21.786 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -5.425 -4.820 -21.420 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -5.254 -3.977 -19.025 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -3.626 -3.577 -18.469 1.00 0.00 H new ATOM 396 N ALA A 29 -7.721 -7.953 -18.730 1.00 0.00 N ATOM 397 CA ALA A 29 -8.327 -8.937 -17.814 1.00 0.00 C ATOM 398 C ALA A 29 -9.331 -9.874 -18.528 1.00 0.00 C ATOM 399 O ALA A 29 -9.353 -11.082 -18.298 1.00 0.00 O ATOM 400 CB ALA A 29 -9.043 -8.117 -16.734 1.00 0.00 C ATOM 0 H ALA A 29 -7.769 -6.987 -18.407 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.557 -9.589 -17.401 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.516 -8.791 -16.019 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -8.320 -7.488 -16.216 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -9.803 -7.489 -17.198 1.00 0.00 H new ATOM 406 N ALA A 30 -10.165 -9.315 -19.400 1.00 0.00 N ATOM 407 CA ALA A 30 -11.291 -10.083 -19.964 1.00 0.00 C ATOM 408 C ALA A 30 -10.914 -11.054 -21.095 1.00 0.00 C ATOM 409 O ALA A 30 -11.255 -12.236 -21.024 1.00 0.00 O ATOM 410 CB ALA A 30 -12.356 -9.099 -20.456 1.00 0.00 C ATOM 0 H ALA A 30 -10.093 -8.353 -19.732 1.00 0.00 H new ATOM 0 HA ALA A 30 -11.664 -10.717 -19.160 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -13.196 -9.652 -20.876 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -12.703 -8.491 -19.621 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -11.928 -8.452 -21.222 1.00 0.00 H new ATOM 416 N SER A 31 -10.176 -10.604 -22.111 1.00 0.00 N ATOM 417 CA SER A 31 -9.612 -11.528 -23.111 1.00 0.00 C ATOM 418 C SER A 31 -8.666 -12.608 -22.556 1.00 0.00 C ATOM 419 O SER A 31 -8.660 -13.734 -23.053 1.00 0.00 O ATOM 420 CB SER A 31 -8.877 -10.707 -24.177 1.00 0.00 C ATOM 421 OG SER A 31 -9.772 -9.802 -24.809 1.00 0.00 O ATOM 0 H SER A 31 -9.954 -9.621 -22.267 1.00 0.00 H new ATOM 0 HA SER A 31 -10.460 -12.077 -23.521 1.00 0.00 H new ATOM 0 HB2 SER A 31 -8.056 -10.156 -23.719 1.00 0.00 H new ATOM 0 HB3 SER A 31 -8.438 -11.373 -24.920 1.00 0.00 H new ATOM 0 HG SER A 31 -9.289 -9.283 -25.486 1.00 0.00 H new ATOM 427 N LYS A 32 -7.846 -12.278 -21.560 1.00 0.00 N ATOM 428 CA LYS A 32 -6.778 -13.190 -21.136 1.00 0.00 C ATOM 429 C LYS A 32 -7.313 -14.201 -20.114 1.00 0.00 C ATOM 430 O LYS A 32 -8.036 -15.137 -20.458 1.00 0.00 O ATOM 431 CB LYS A 32 -5.604 -12.329 -20.635 1.00 0.00 C ATOM 432 CG LYS A 32 -4.971 -11.473 -21.740 1.00 0.00 C ATOM 433 CD LYS A 32 -3.833 -10.610 -21.193 1.00 0.00 C ATOM 434 CE LYS A 32 -3.241 -9.719 -22.288 1.00 0.00 C ATOM 435 NZ LYS A 32 -2.156 -8.889 -21.738 1.00 0.00 N ATOM 0 H LYS A 32 -7.895 -11.403 -21.038 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.410 -13.802 -21.960 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -5.955 -11.677 -19.835 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -4.842 -12.979 -20.206 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -4.592 -12.120 -22.531 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -5.732 -10.834 -22.188 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -4.203 -9.990 -20.376 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -3.053 -11.250 -20.780 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -2.860 -10.336 -23.102 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -4.019 -9.082 -22.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -1.762 -8.289 -22.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -2.531 -8.288 -20.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -1.408 -9.503 -21.358 1.00 0.00 H new ATOM 449 N LYS A 33 -6.934 -14.009 -18.863 1.00 0.00 N ATOM 450 CA LYS A 33 -7.183 -15.014 -17.818 1.00 0.00 C ATOM 451 C LYS A 33 -7.841 -14.371 -16.593 1.00 0.00 C ATOM 452 O LYS A 33 -8.754 -14.962 -16.014 1.00 0.00 O ATOM 453 CB LYS A 33 -5.900 -15.782 -17.453 1.00 0.00 C ATOM 454 CG LYS A 33 -5.090 -16.352 -18.623 1.00 0.00 C ATOM 455 CD LYS A 33 -5.811 -17.518 -19.306 1.00 0.00 C ATOM 456 CE LYS A 33 -4.901 -18.251 -20.293 1.00 0.00 C ATOM 457 NZ LYS A 33 -4.607 -17.419 -21.473 1.00 0.00 N ATOM 0 H LYS A 33 -6.453 -13.171 -18.536 1.00 0.00 H new ATOM 0 HA LYS A 33 -7.882 -15.750 -18.216 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.253 -15.115 -16.883 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.171 -16.605 -16.792 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.903 -15.564 -19.353 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -4.118 -16.688 -18.261 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -6.166 -18.219 -18.550 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -6.690 -17.144 -19.831 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -3.969 -18.524 -19.797 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.378 -19.179 -20.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -3.988 -17.945 -22.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -5.495 -17.179 -21.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -4.130 -16.545 -21.172 1.00 0.00 H new ATOM 471 N VAL A 34 -7.365 -13.219 -16.132 1.00 0.00 N ATOM 472 CA VAL A 34 -7.754 -12.739 -14.800 1.00 0.00 C ATOM 473 C VAL A 34 -8.883 -11.720 -14.886 1.00 0.00 C ATOM 474 O VAL A 34 -8.988 -10.925 -15.811 1.00 0.00 O ATOM 475 CB VAL A 34 -6.491 -12.089 -14.164 1.00 0.00 C ATOM 476 CG1 VAL A 34 -5.720 -11.111 -15.059 1.00 0.00 C ATOM 477 CG2 VAL A 34 -6.802 -11.297 -12.898 1.00 0.00 C ATOM 0 H VAL A 34 -6.725 -12.610 -16.642 1.00 0.00 H new ATOM 0 HA VAL A 34 -8.120 -13.568 -14.194 1.00 0.00 H new ATOM 0 HB VAL A 34 -5.880 -12.970 -13.971 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -4.861 -10.719 -14.514 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -5.377 -11.630 -15.954 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -6.374 -10.287 -15.346 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -5.882 -10.868 -12.502 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -7.503 -10.496 -13.133 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -7.244 -11.960 -12.154 1.00 0.00 H new ATOM 487 N LYS A 35 -9.684 -11.724 -13.831 1.00 0.00 N ATOM 488 CA LYS A 35 -10.677 -10.666 -13.626 1.00 0.00 C ATOM 489 C LYS A 35 -10.284 -9.902 -12.369 1.00 0.00 C ATOM 490 O LYS A 35 -9.940 -10.487 -11.339 1.00 0.00 O ATOM 491 CB LYS A 35 -12.092 -11.250 -13.504 1.00 0.00 C ATOM 492 CG LYS A 35 -12.240 -12.372 -12.466 1.00 0.00 C ATOM 493 CD LYS A 35 -13.687 -12.864 -12.383 1.00 0.00 C ATOM 494 CE LYS A 35 -13.829 -13.969 -11.333 1.00 0.00 C ATOM 495 NZ LYS A 35 -15.227 -14.422 -11.258 1.00 0.00 N ATOM 0 H LYS A 35 -9.671 -12.440 -13.105 1.00 0.00 H new ATOM 0 HA LYS A 35 -10.693 -9.993 -14.483 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -12.781 -10.445 -13.248 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -12.397 -11.633 -14.478 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -11.585 -13.203 -12.729 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -11.919 -12.011 -11.489 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -14.344 -12.032 -12.132 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -14.004 -13.239 -13.356 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -13.180 -14.807 -11.587 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -13.506 -13.600 -10.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -15.311 -15.172 -10.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -15.837 -13.622 -10.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -15.522 -14.793 -12.184 1.00 0.00 H new ATOM 509 N PHE A 36 -10.358 -8.578 -12.448 1.00 0.00 N ATOM 510 CA PHE A 36 -10.173 -7.776 -11.227 1.00 0.00 C ATOM 511 C PHE A 36 -11.559 -7.586 -10.599 1.00 0.00 C ATOM 512 O PHE A 36 -12.572 -7.423 -11.281 1.00 0.00 O ATOM 513 CB PHE A 36 -9.360 -6.488 -11.451 1.00 0.00 C ATOM 514 CG PHE A 36 -7.983 -6.749 -12.068 1.00 0.00 C ATOM 515 CD1 PHE A 36 -6.929 -7.136 -11.295 1.00 0.00 C ATOM 516 CD2 PHE A 36 -7.805 -6.605 -13.410 1.00 0.00 C ATOM 517 CE1 PHE A 36 -5.719 -7.382 -11.862 1.00 0.00 C ATOM 518 CE2 PHE A 36 -6.596 -6.857 -13.976 1.00 0.00 C ATOM 519 CZ PHE A 36 -5.554 -7.252 -13.201 1.00 0.00 C ATOM 0 H PHE A 36 -10.536 -8.048 -13.301 1.00 0.00 H new ATOM 0 HA PHE A 36 -9.539 -8.302 -10.513 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -9.923 -5.818 -12.102 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -9.234 -5.974 -10.498 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -7.056 -7.247 -10.228 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -8.631 -6.288 -14.029 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -4.886 -7.682 -11.244 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -6.464 -6.743 -15.042 1.00 0.00 H new ATOM 0 HZ PHE A 36 -4.595 -7.462 -13.651 1.00 0.00 H new ATOM 529 N VAL A 37 -11.590 -7.686 -9.276 1.00 0.00 N ATOM 530 CA VAL A 37 -12.861 -7.906 -8.556 1.00 0.00 C ATOM 531 C VAL A 37 -13.172 -6.756 -7.597 1.00 0.00 C ATOM 532 O VAL A 37 -14.342 -6.443 -7.366 1.00 0.00 O ATOM 533 CB VAL A 37 -12.854 -9.277 -7.836 1.00 0.00 C ATOM 534 CG1 VAL A 37 -14.077 -9.482 -6.949 1.00 0.00 C ATOM 535 CG2 VAL A 37 -12.798 -10.402 -8.876 1.00 0.00 C ATOM 0 H VAL A 37 -10.767 -7.621 -8.677 1.00 0.00 H new ATOM 0 HA VAL A 37 -13.665 -7.925 -9.291 1.00 0.00 H new ATOM 0 HB VAL A 37 -11.973 -9.297 -7.194 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -14.019 -10.459 -6.470 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -14.107 -8.705 -6.186 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -14.980 -9.429 -7.557 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -12.793 -11.367 -8.369 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -13.670 -10.339 -9.527 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -11.891 -10.301 -9.473 1.00 0.00 H new ATOM 545 N ASP A 38 -12.144 -6.144 -7.024 1.00 0.00 N ATOM 546 CA ASP A 38 -12.373 -5.080 -6.040 1.00 0.00 C ATOM 547 C ASP A 38 -11.709 -3.779 -6.482 1.00 0.00 C ATOM 548 O ASP A 38 -10.966 -3.698 -7.462 1.00 0.00 O ATOM 549 CB ASP A 38 -11.934 -5.510 -4.633 1.00 0.00 C ATOM 550 CG ASP A 38 -12.885 -6.569 -4.081 1.00 0.00 C ATOM 551 OD1 ASP A 38 -13.908 -6.198 -3.467 1.00 0.00 O ATOM 552 OD2 ASP A 38 -12.619 -7.775 -4.271 1.00 0.00 O ATOM 0 H ASP A 38 -11.164 -6.355 -7.213 1.00 0.00 H new ATOM 0 HA ASP A 38 -13.446 -4.893 -5.986 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -10.919 -5.905 -4.667 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -11.918 -4.645 -3.970 1.00 0.00 H new ATOM 557 N GLN A 39 -12.060 -2.739 -5.740 1.00 0.00 N ATOM 558 CA GLN A 39 -11.632 -1.382 -6.080 1.00 0.00 C ATOM 559 C GLN A 39 -11.147 -0.722 -4.814 1.00 0.00 C ATOM 560 O GLN A 39 -11.870 -0.615 -3.822 1.00 0.00 O ATOM 561 CB GLN A 39 -12.765 -0.547 -6.690 1.00 0.00 C ATOM 562 CG GLN A 39 -12.412 0.931 -6.895 1.00 0.00 C ATOM 563 CD GLN A 39 -13.451 1.649 -7.751 1.00 0.00 C ATOM 564 OE1 GLN A 39 -13.358 1.691 -8.975 1.00 0.00 O ATOM 565 NE2 GLN A 39 -14.455 2.230 -7.115 1.00 0.00 N ATOM 0 H GLN A 39 -12.637 -2.804 -4.902 1.00 0.00 H new ATOM 0 HA GLN A 39 -10.843 -1.443 -6.830 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -13.044 -0.980 -7.651 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -13.640 -0.614 -6.044 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -12.336 1.424 -5.926 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -11.434 1.008 -7.370 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -14.511 2.181 -6.098 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -15.173 2.727 -7.642 1.00 0.00 H new ATOM 574 N PHE A 40 -9.923 -0.234 -4.894 1.00 0.00 N ATOM 575 CA PHE A 40 -9.437 0.641 -3.830 1.00 0.00 C ATOM 576 C PHE A 40 -9.130 1.981 -4.494 1.00 0.00 C ATOM 577 O PHE A 40 -8.350 2.060 -5.440 1.00 0.00 O ATOM 578 CB PHE A 40 -8.224 0.048 -3.099 1.00 0.00 C ATOM 579 CG PHE A 40 -8.477 -1.178 -2.221 1.00 0.00 C ATOM 580 CD1 PHE A 40 -9.697 -1.476 -1.689 1.00 0.00 C ATOM 581 CD2 PHE A 40 -7.420 -1.993 -1.954 1.00 0.00 C ATOM 582 CE1 PHE A 40 -9.855 -2.575 -0.907 1.00 0.00 C ATOM 583 CE2 PHE A 40 -7.578 -3.091 -1.169 1.00 0.00 C ATOM 584 CZ PHE A 40 -8.793 -3.378 -0.641 1.00 0.00 C ATOM 0 H PHE A 40 -9.265 -0.416 -5.652 1.00 0.00 H new ATOM 0 HA PHE A 40 -10.186 0.763 -3.048 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -7.475 -0.218 -3.845 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -7.789 0.829 -2.475 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -10.542 -0.834 -1.891 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -6.449 -1.765 -2.369 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -10.826 -2.810 -0.497 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -6.735 -3.735 -0.966 1.00 0.00 H new ATOM 0 HZ PHE A 40 -8.916 -4.245 -0.009 1.00 0.00 H new ATOM 594 N LEU A 41 -9.797 3.039 -4.045 1.00 0.00 N ATOM 595 CA LEU A 41 -9.468 4.374 -4.539 1.00 0.00 C ATOM 596 C LEU A 41 -8.403 4.958 -3.611 1.00 0.00 C ATOM 597 O LEU A 41 -8.365 4.665 -2.414 1.00 0.00 O ATOM 598 CB LEU A 41 -10.749 5.219 -4.483 1.00 0.00 C ATOM 599 CG LEU A 41 -11.838 4.772 -5.473 1.00 0.00 C ATOM 600 CD1 LEU A 41 -13.138 5.534 -5.217 1.00 0.00 C ATOM 601 CD2 LEU A 41 -11.398 4.999 -6.918 1.00 0.00 C ATOM 0 H LEU A 41 -10.550 3.004 -3.358 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.090 4.355 -5.561 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.154 5.180 -3.472 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -10.495 6.260 -4.684 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.003 3.706 -5.320 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -13.898 5.206 -5.926 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -13.481 5.338 -4.201 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -12.964 6.603 -5.341 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -12.188 4.674 -7.594 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -11.199 6.059 -7.076 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -10.492 4.427 -7.117 1.00 0.00 H new ATOM 613 N ILE A 42 -7.538 5.805 -4.152 1.00 0.00 N ATOM 614 CA ILE A 42 -6.465 6.385 -3.335 1.00 0.00 C ATOM 615 C ILE A 42 -6.969 7.278 -2.181 1.00 0.00 C ATOM 616 O ILE A 42 -6.441 7.203 -1.071 1.00 0.00 O ATOM 617 CB ILE A 42 -5.428 7.005 -4.296 1.00 0.00 C ATOM 618 CG1 ILE A 42 -4.130 7.414 -3.603 1.00 0.00 C ATOM 619 CG2 ILE A 42 -5.930 8.228 -5.067 1.00 0.00 C ATOM 620 CD1 ILE A 42 -3.589 6.329 -2.673 1.00 0.00 C ATOM 0 H ILE A 42 -7.550 6.104 -5.127 1.00 0.00 H new ATOM 0 HA ILE A 42 -5.954 5.610 -2.763 1.00 0.00 H new ATOM 0 HB ILE A 42 -5.245 6.191 -4.997 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -3.379 7.648 -4.357 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -4.301 8.325 -3.030 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -5.138 8.598 -5.717 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -6.794 7.948 -5.670 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -6.217 9.009 -4.363 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.666 6.675 -2.208 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -4.326 6.112 -1.899 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -3.389 5.424 -3.247 1.00 0.00 H new ATOM 632 N ASN A 43 -8.000 8.089 -2.408 1.00 0.00 N ATOM 633 CA ASN A 43 -8.498 8.963 -1.329 1.00 0.00 C ATOM 634 C ASN A 43 -9.449 8.251 -0.349 1.00 0.00 C ATOM 635 O ASN A 43 -9.462 8.586 0.838 1.00 0.00 O ATOM 636 CB ASN A 43 -9.223 10.172 -1.943 1.00 0.00 C ATOM 637 CG ASN A 43 -8.298 11.064 -2.776 1.00 0.00 C ATOM 638 OD1 ASN A 43 -7.401 11.725 -2.253 1.00 0.00 O ATOM 639 ND2 ASN A 43 -8.507 11.095 -4.080 1.00 0.00 N ATOM 0 H ASN A 43 -8.498 8.165 -3.295 1.00 0.00 H new ATOM 0 HA ASN A 43 -7.625 9.275 -0.755 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -10.040 9.818 -2.571 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -9.669 10.765 -1.145 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -7.918 11.676 -4.677 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -9.257 10.538 -4.490 1.00 0.00 H new ATOM 646 N LYS A 44 -10.212 7.251 -0.794 1.00 0.00 N ATOM 647 CA LYS A 44 -11.140 6.563 0.114 1.00 0.00 C ATOM 648 C LYS A 44 -10.474 5.427 0.902 1.00 0.00 C ATOM 649 O LYS A 44 -10.855 5.180 2.046 1.00 0.00 O ATOM 650 CB LYS A 44 -12.344 6.044 -0.675 1.00 0.00 C ATOM 651 CG LYS A 44 -13.221 7.180 -1.215 1.00 0.00 C ATOM 652 CD LYS A 44 -14.578 6.659 -1.697 1.00 0.00 C ATOM 653 CE LYS A 44 -15.409 7.783 -2.318 1.00 0.00 C ATOM 654 NZ LYS A 44 -16.702 7.263 -2.786 1.00 0.00 N ATOM 0 H LYS A 44 -10.210 6.904 -1.753 1.00 0.00 H new ATOM 0 HA LYS A 44 -11.472 7.292 0.853 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -11.994 5.432 -1.506 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.944 5.398 -0.034 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -13.372 7.927 -0.435 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -12.708 7.678 -2.038 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -14.427 5.866 -2.430 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -15.121 6.221 -0.860 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -15.571 8.573 -1.584 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.865 8.229 -3.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -17.256 8.037 -3.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -16.541 6.525 -3.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -17.225 6.859 -1.983 1.00 0.00 H new ATOM 668 N LEU A 45 -9.472 4.747 0.344 1.00 0.00 N ATOM 669 CA LEU A 45 -8.692 3.787 1.148 1.00 0.00 C ATOM 670 C LEU A 45 -7.882 4.483 2.251 1.00 0.00 C ATOM 671 O LEU A 45 -7.817 4.024 3.391 1.00 0.00 O ATOM 672 CB LEU A 45 -7.676 3.116 0.219 1.00 0.00 C ATOM 673 CG LEU A 45 -7.064 1.828 0.799 1.00 0.00 C ATOM 674 CD1 LEU A 45 -8.106 0.710 0.913 1.00 0.00 C ATOM 675 CD2 LEU A 45 -5.896 1.361 -0.073 1.00 0.00 C ATOM 0 H LEU A 45 -9.182 4.833 -0.630 1.00 0.00 H new ATOM 0 HA LEU A 45 -9.390 3.085 1.604 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -8.162 2.882 -0.728 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.875 3.822 0.001 1.00 0.00 H new ATOM 0 HG LEU A 45 -6.703 2.056 1.802 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -7.638 -0.183 1.326 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -8.915 1.032 1.569 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -8.508 0.485 -0.075 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -5.471 0.449 0.346 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -6.253 1.163 -1.084 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -5.132 2.137 -0.104 1.00 0.00 H new ATOM 687 N ASN A 46 -7.307 5.627 1.892 1.00 0.00 N ATOM 688 CA ASN A 46 -6.566 6.443 2.866 1.00 0.00 C ATOM 689 C ASN A 46 -7.480 7.103 3.918 1.00 0.00 C ATOM 690 O ASN A 46 -7.022 7.409 5.020 1.00 0.00 O ATOM 691 CB ASN A 46 -5.759 7.491 2.084 1.00 0.00 C ATOM 692 CG ASN A 46 -4.781 8.272 2.961 1.00 0.00 C ATOM 693 OD1 ASN A 46 -3.800 7.731 3.471 1.00 0.00 O ATOM 694 ND2 ASN A 46 -5.030 9.557 3.144 1.00 0.00 N ATOM 0 H ASN A 46 -7.335 6.012 0.948 1.00 0.00 H new ATOM 0 HA ASN A 46 -5.900 5.795 3.436 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.206 6.994 1.287 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -6.447 8.189 1.607 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -4.403 10.121 3.718 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -5.849 9.984 2.712 1.00 0.00 H new ATOM 701 N ASP A 47 -8.759 7.325 3.604 1.00 0.00 N ATOM 702 CA ASP A 47 -9.675 7.910 4.600 1.00 0.00 C ATOM 703 C ASP A 47 -10.296 6.834 5.505 1.00 0.00 C ATOM 704 O ASP A 47 -10.420 7.056 6.710 1.00 0.00 O ATOM 705 CB ASP A 47 -10.733 8.805 3.928 1.00 0.00 C ATOM 706 CG ASP A 47 -11.334 9.804 4.911 1.00 0.00 C ATOM 707 OD1 ASP A 47 -10.760 10.902 5.084 1.00 0.00 O ATOM 708 OD2 ASP A 47 -12.386 9.498 5.515 1.00 0.00 O ATOM 0 H ASP A 47 -9.179 7.118 2.698 1.00 0.00 H new ATOM 0 HA ASP A 47 -9.088 8.555 5.254 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -10.279 9.342 3.095 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -11.525 8.182 3.512 1.00 0.00 H new ATOM 713 N GLY A 48 -10.670 5.674 4.959 1.00 0.00 N ATOM 714 CA GLY A 48 -11.135 4.570 5.814 1.00 0.00 C ATOM 715 C GLY A 48 -12.410 3.844 5.356 1.00 0.00 C ATOM 716 O GLY A 48 -13.034 3.150 6.159 1.00 0.00 O ATOM 0 H GLY A 48 -10.663 5.474 3.959 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -10.333 3.836 5.892 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -11.306 4.962 6.816 1.00 0.00 H new ATOM 720 N SER A 49 -12.842 4.016 4.108 1.00 0.00 N ATOM 721 CA SER A 49 -14.150 3.489 3.685 1.00 0.00 C ATOM 722 C SER A 49 -14.172 1.987 3.358 1.00 0.00 C ATOM 723 O SER A 49 -15.216 1.349 3.512 1.00 0.00 O ATOM 724 CB SER A 49 -14.617 4.275 2.453 1.00 0.00 C ATOM 725 OG SER A 49 -14.727 5.660 2.760 1.00 0.00 O ATOM 0 H SER A 49 -12.322 4.506 3.380 1.00 0.00 H new ATOM 0 HA SER A 49 -14.817 3.614 4.538 1.00 0.00 H new ATOM 0 HB2 SER A 49 -13.912 4.133 1.634 1.00 0.00 H new ATOM 0 HB3 SER A 49 -15.580 3.894 2.114 1.00 0.00 H new ATOM 0 HG SER A 49 -15.024 6.149 1.964 1.00 0.00 H new ATOM 731 N ILE A 50 -13.065 1.413 2.883 1.00 0.00 N ATOM 732 CA ILE A 50 -13.137 0.090 2.235 1.00 0.00 C ATOM 733 C ILE A 50 -12.370 -0.940 3.069 1.00 0.00 C ATOM 734 O ILE A 50 -11.168 -0.815 3.313 1.00 0.00 O ATOM 735 CB ILE A 50 -12.570 0.121 0.801 1.00 0.00 C ATOM 736 CG1 ILE A 50 -12.993 1.396 0.049 1.00 0.00 C ATOM 737 CG2 ILE A 50 -13.014 -1.136 0.044 1.00 0.00 C ATOM 738 CD1 ILE A 50 -12.601 1.365 -1.425 1.00 0.00 C ATOM 0 H ILE A 50 -12.132 1.823 2.929 1.00 0.00 H new ATOM 0 HA ILE A 50 -14.189 -0.190 2.173 1.00 0.00 H new ATOM 0 HB ILE A 50 -11.482 0.135 0.862 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -14.073 1.521 0.131 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -12.535 2.263 0.525 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -12.612 -1.112 -0.969 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -12.643 -2.022 0.560 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -14.103 -1.170 0.002 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -12.923 2.288 -1.907 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -11.519 1.269 -1.512 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -13.081 0.515 -1.911 1.00 0.00 H new ATOM 750 N THR A 51 -13.100 -1.960 3.502 1.00 0.00 N ATOM 751 CA THR A 51 -12.479 -3.085 4.218 1.00 0.00 C ATOM 752 C THR A 51 -12.901 -4.396 3.558 1.00 0.00 C ATOM 753 O THR A 51 -14.084 -4.733 3.490 1.00 0.00 O ATOM 754 CB THR A 51 -12.834 -3.120 5.715 1.00 0.00 C ATOM 755 OG1 THR A 51 -12.297 -1.970 6.354 1.00 0.00 O ATOM 756 CG2 THR A 51 -12.253 -4.379 6.379 1.00 0.00 C ATOM 0 H THR A 51 -14.109 -2.039 3.376 1.00 0.00 H new ATOM 0 HA THR A 51 -11.399 -2.950 4.155 1.00 0.00 H new ATOM 0 HB THR A 51 -13.919 -3.134 5.815 1.00 0.00 H new ATOM 0 HG1 THR A 51 -12.524 -1.990 7.307 1.00 0.00 H new ATOM 0 HG21 THR A 51 -12.514 -4.386 7.437 1.00 0.00 H new ATOM 0 HG22 THR A 51 -12.664 -5.267 5.898 1.00 0.00 H new ATOM 0 HG23 THR A 51 -11.168 -4.378 6.273 1.00 0.00 H new ATOM 764 N LEU A 52 -11.906 -5.138 3.091 1.00 0.00 N ATOM 765 CA LEU A 52 -12.170 -6.461 2.513 1.00 0.00 C ATOM 766 C LEU A 52 -11.452 -7.557 3.322 1.00 0.00 C ATOM 767 O LEU A 52 -10.951 -7.352 4.429 1.00 0.00 O ATOM 768 CB LEU A 52 -11.715 -6.431 1.044 1.00 0.00 C ATOM 769 CG LEU A 52 -12.459 -5.409 0.171 1.00 0.00 C ATOM 770 CD1 LEU A 52 -11.817 -5.399 -1.213 1.00 0.00 C ATOM 771 CD2 LEU A 52 -13.948 -5.741 0.038 1.00 0.00 C ATOM 0 H LEU A 52 -10.925 -4.859 3.097 1.00 0.00 H new ATOM 0 HA LEU A 52 -13.233 -6.697 2.553 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.648 -6.211 1.011 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -11.849 -7.424 0.614 1.00 0.00 H new ATOM 0 HG LEU A 52 -12.384 -4.431 0.647 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -12.332 -4.678 -1.848 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -10.767 -5.119 -1.125 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -11.892 -6.392 -1.656 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -14.433 -4.992 -0.587 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -14.062 -6.724 -0.419 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -14.410 -5.744 1.025 1.00 0.00 H new ATOM 783 N GLU A 53 -11.419 -8.742 2.725 1.00 0.00 N ATOM 784 CA GLU A 53 -10.847 -9.939 3.363 1.00 0.00 C ATOM 785 C GLU A 53 -9.415 -10.150 2.849 1.00 0.00 C ATOM 786 O GLU A 53 -9.149 -10.176 1.645 1.00 0.00 O ATOM 787 CB GLU A 53 -11.755 -11.155 3.121 1.00 0.00 C ATOM 788 CG GLU A 53 -11.947 -11.532 1.646 1.00 0.00 C ATOM 789 CD GLU A 53 -12.976 -12.645 1.485 1.00 0.00 C ATOM 790 OE1 GLU A 53 -12.861 -13.680 2.176 1.00 0.00 O ATOM 791 OE2 GLU A 53 -13.904 -12.490 0.662 1.00 0.00 O ATOM 0 H GLU A 53 -11.785 -8.909 1.788 1.00 0.00 H new ATOM 0 HA GLU A 53 -10.792 -9.804 4.443 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -11.338 -12.013 3.649 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -12.732 -10.954 3.560 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -12.267 -10.655 1.084 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -10.994 -11.852 1.224 1.00 0.00 H new ATOM 798 N ASN A 54 -8.481 -10.136 3.793 1.00 0.00 N ATOM 799 CA ASN A 54 -7.057 -9.929 3.476 1.00 0.00 C ATOM 800 C ASN A 54 -6.272 -11.162 2.979 1.00 0.00 C ATOM 801 O ASN A 54 -5.125 -11.365 3.383 1.00 0.00 O ATOM 802 CB ASN A 54 -6.441 -9.370 4.775 1.00 0.00 C ATOM 803 CG ASN A 54 -6.741 -7.885 4.983 1.00 0.00 C ATOM 804 OD1 ASN A 54 -7.808 -7.505 5.466 1.00 0.00 O ATOM 805 ND2 ASN A 54 -5.805 -7.025 4.626 1.00 0.00 N ATOM 0 H ASN A 54 -8.675 -10.265 4.786 1.00 0.00 H new ATOM 0 HA ASN A 54 -6.989 -9.258 2.620 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -6.823 -9.935 5.625 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -5.361 -9.518 4.753 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -5.959 -6.024 4.748 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -4.928 -7.362 4.228 1.00 0.00 H new ATOM 812 N ALA A 55 -6.805 -11.941 2.031 1.00 0.00 N ATOM 813 CA ALA A 55 -5.963 -12.987 1.405 1.00 0.00 C ATOM 814 C ALA A 55 -6.217 -13.394 -0.075 1.00 0.00 C ATOM 815 O ALA A 55 -5.602 -14.361 -0.526 1.00 0.00 O ATOM 816 CB ALA A 55 -6.072 -14.236 2.288 1.00 0.00 C ATOM 0 H ALA A 55 -7.764 -11.881 1.688 1.00 0.00 H new ATOM 0 HA ALA A 55 -4.975 -12.531 1.347 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -5.465 -15.036 1.863 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -5.716 -14.004 3.292 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -7.112 -14.557 2.337 1.00 0.00 H new ATOM 822 N LYS A 56 -7.120 -12.769 -0.839 1.00 0.00 N ATOM 823 CA LYS A 56 -7.499 -13.311 -2.164 1.00 0.00 C ATOM 824 C LYS A 56 -6.832 -12.637 -3.381 1.00 0.00 C ATOM 825 O LYS A 56 -6.734 -13.234 -4.452 1.00 0.00 O ATOM 826 CB LYS A 56 -9.021 -13.283 -2.335 1.00 0.00 C ATOM 827 CG LYS A 56 -9.719 -14.231 -1.360 1.00 0.00 C ATOM 828 CD LYS A 56 -11.228 -14.278 -1.620 1.00 0.00 C ATOM 829 CE LYS A 56 -11.948 -15.261 -0.692 1.00 0.00 C ATOM 830 NZ LYS A 56 -11.583 -16.655 -0.996 1.00 0.00 N ATOM 0 H LYS A 56 -7.597 -11.906 -0.577 1.00 0.00 H new ATOM 0 HA LYS A 56 -7.119 -14.333 -2.157 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -9.386 -12.268 -2.179 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -9.277 -13.560 -3.358 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -9.299 -15.232 -1.458 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -9.533 -13.906 -0.336 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -11.649 -13.281 -1.486 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -11.407 -14.563 -2.657 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -11.697 -15.036 0.344 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -13.026 -15.136 -0.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -12.186 -17.300 -0.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -11.719 -16.836 -2.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -10.586 -16.815 -0.746 1.00 0.00 H new ATOM 844 N TYR A 57 -6.604 -11.331 -3.280 1.00 0.00 N ATOM 845 CA TYR A 57 -6.434 -10.453 -4.452 1.00 0.00 C ATOM 846 C TYR A 57 -5.027 -10.450 -5.081 1.00 0.00 C ATOM 847 O TYR A 57 -4.636 -9.402 -5.592 1.00 0.00 O ATOM 848 CB TYR A 57 -6.921 -9.012 -4.235 1.00 0.00 C ATOM 849 CG TYR A 57 -8.203 -8.913 -3.406 1.00 0.00 C ATOM 850 CD1 TYR A 57 -9.364 -9.423 -3.908 1.00 0.00 C ATOM 851 CD2 TYR A 57 -8.192 -8.389 -2.150 1.00 0.00 C ATOM 852 CE1 TYR A 57 -10.480 -9.469 -3.136 1.00 0.00 C ATOM 853 CE2 TYR A 57 -9.314 -8.424 -1.383 1.00 0.00 C ATOM 854 CZ TYR A 57 -10.454 -8.979 -1.872 1.00 0.00 C ATOM 855 OH TYR A 57 -11.578 -9.051 -1.094 1.00 0.00 O ATOM 0 H TYR A 57 -6.530 -10.844 -2.387 1.00 0.00 H new ATOM 0 HA TYR A 57 -7.095 -10.926 -5.178 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -6.134 -8.443 -3.740 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -7.090 -8.545 -5.205 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -9.396 -9.791 -4.923 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -7.288 -7.944 -1.761 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -11.390 -9.897 -3.530 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -9.299 -8.011 -0.385 1.00 0.00 H new ATOM 0 HH TYR A 57 -12.104 -9.837 -1.351 1.00 0.00 H new ATOM 865 N GLU A 58 -4.200 -11.485 -4.879 1.00 0.00 N ATOM 866 CA GLU A 58 -2.747 -11.435 -5.210 1.00 0.00 C ATOM 867 C GLU A 58 -2.375 -11.195 -6.706 1.00 0.00 C ATOM 868 O GLU A 58 -1.324 -11.624 -7.188 1.00 0.00 O ATOM 869 CB GLU A 58 -2.095 -12.756 -4.751 1.00 0.00 C ATOM 870 CG GLU A 58 -2.801 -14.019 -5.266 1.00 0.00 C ATOM 871 CD GLU A 58 -2.047 -15.282 -4.873 1.00 0.00 C ATOM 872 OE1 GLU A 58 -1.157 -15.714 -5.636 1.00 0.00 O ATOM 873 OE2 GLU A 58 -2.345 -15.853 -3.801 1.00 0.00 O ATOM 0 H GLU A 58 -4.503 -12.376 -4.487 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.373 -10.556 -4.685 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -1.058 -12.771 -5.085 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -2.079 -12.781 -3.661 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -3.814 -14.060 -4.865 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -2.890 -13.970 -6.351 1.00 0.00 H new ATOM 880 N THR A 59 -3.151 -10.349 -7.375 1.00 0.00 N ATOM 881 CA THR A 59 -2.718 -9.693 -8.628 1.00 0.00 C ATOM 882 C THR A 59 -3.188 -8.242 -8.558 1.00 0.00 C ATOM 883 O THR A 59 -4.367 -7.951 -8.365 1.00 0.00 O ATOM 884 CB THR A 59 -3.152 -10.388 -9.930 1.00 0.00 C ATOM 885 OG1 THR A 59 -2.668 -9.646 -11.041 1.00 0.00 O ATOM 886 CG2 THR A 59 -4.648 -10.621 -10.115 1.00 0.00 C ATOM 0 H THR A 59 -4.092 -10.093 -7.077 1.00 0.00 H new ATOM 0 HA THR A 59 -1.632 -9.761 -8.685 1.00 0.00 H new ATOM 0 HB THR A 59 -2.717 -11.385 -9.861 1.00 0.00 H new ATOM 0 HG1 THR A 59 -2.941 -10.087 -11.873 1.00 0.00 H new ATOM 0 HG21 THR A 59 -4.824 -11.117 -11.070 1.00 0.00 H new ATOM 0 HG22 THR A 59 -5.021 -11.249 -9.306 1.00 0.00 H new ATOM 0 HG23 THR A 59 -5.170 -9.664 -10.102 1.00 0.00 H new ATOM 894 N VAL A 60 -2.210 -7.347 -8.524 1.00 0.00 N ATOM 895 CA VAL A 60 -2.441 -5.985 -8.036 1.00 0.00 C ATOM 896 C VAL A 60 -1.999 -4.993 -9.128 1.00 0.00 C ATOM 897 O VAL A 60 -0.807 -4.860 -9.403 1.00 0.00 O ATOM 898 CB VAL A 60 -1.568 -5.842 -6.780 1.00 0.00 C ATOM 899 CG1 VAL A 60 -1.441 -4.404 -6.286 1.00 0.00 C ATOM 900 CG2 VAL A 60 -2.120 -6.684 -5.646 1.00 0.00 C ATOM 0 H VAL A 60 -1.253 -7.533 -8.825 1.00 0.00 H new ATOM 0 HA VAL A 60 -3.487 -5.786 -7.804 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.577 -6.185 -7.077 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.811 -4.379 -5.397 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -0.992 -3.790 -7.066 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -2.429 -4.015 -6.041 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -1.487 -6.569 -4.766 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -3.133 -6.358 -5.410 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -2.137 -7.732 -5.946 1.00 0.00 H new ATOM 910 N HIS A 61 -2.937 -4.299 -9.757 1.00 0.00 N ATOM 911 CA HIS A 61 -2.585 -3.252 -10.738 1.00 0.00 C ATOM 912 C HIS A 61 -2.835 -1.864 -10.104 1.00 0.00 C ATOM 913 O HIS A 61 -3.894 -1.647 -9.519 1.00 0.00 O ATOM 914 CB HIS A 61 -3.428 -3.510 -12.017 1.00 0.00 C ATOM 915 CG HIS A 61 -2.620 -4.299 -13.025 1.00 0.00 C ATOM 916 ND1 HIS A 61 -2.632 -5.682 -13.144 1.00 0.00 N ATOM 917 CD2 HIS A 61 -1.599 -3.741 -13.790 1.00 0.00 C ATOM 918 CE1 HIS A 61 -1.588 -5.821 -14.025 1.00 0.00 C ATOM 919 NE2 HIS A 61 -0.945 -4.716 -14.509 1.00 0.00 N ATOM 0 H HIS A 61 -3.939 -4.431 -9.616 1.00 0.00 H new ATOM 0 HA HIS A 61 -1.532 -3.278 -11.018 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -4.335 -4.057 -11.759 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -3.740 -2.561 -12.453 1.00 0.00 H new ATOM 0 HD1 HIS A 61 -3.233 -6.382 -12.709 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -1.354 -2.689 -13.816 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -1.274 -6.806 -14.336 1.00 0.00 H new ATOM 927 N TYR A 62 -1.903 -0.903 -10.240 1.00 0.00 N ATOM 928 CA TYR A 62 -2.139 0.463 -9.717 1.00 0.00 C ATOM 929 C TYR A 62 -2.118 1.459 -10.889 1.00 0.00 C ATOM 930 O TYR A 62 -1.087 1.682 -11.522 1.00 0.00 O ATOM 931 CB TYR A 62 -1.137 0.931 -8.637 1.00 0.00 C ATOM 932 CG TYR A 62 -1.606 1.995 -7.659 1.00 0.00 C ATOM 933 CD1 TYR A 62 -2.596 2.883 -7.953 1.00 0.00 C ATOM 934 CD2 TYR A 62 -0.892 2.146 -6.511 1.00 0.00 C ATOM 935 CE1 TYR A 62 -2.887 3.895 -7.094 1.00 0.00 C ATOM 936 CE2 TYR A 62 -1.162 3.176 -5.668 1.00 0.00 C ATOM 937 CZ TYR A 62 -2.156 4.053 -5.963 1.00 0.00 C ATOM 938 OH TYR A 62 -2.389 5.124 -5.147 1.00 0.00 O ATOM 0 H TYR A 62 -1.000 -1.037 -10.695 1.00 0.00 H new ATOM 0 HA TYR A 62 -3.111 0.430 -9.224 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.830 0.057 -8.062 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -0.248 1.308 -9.143 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -3.152 2.782 -8.873 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -0.108 1.444 -6.269 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.699 4.572 -7.312 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -0.586 3.298 -4.763 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.109 5.672 -5.524 1.00 0.00 H new ATOM 948 N LEU A 63 -3.282 2.012 -11.206 1.00 0.00 N ATOM 949 CA LEU A 63 -3.454 2.804 -12.418 1.00 0.00 C ATOM 950 C LEU A 63 -3.511 4.308 -12.104 1.00 0.00 C ATOM 951 O LEU A 63 -4.586 4.848 -11.839 1.00 0.00 O ATOM 952 CB LEU A 63 -4.799 2.318 -12.981 1.00 0.00 C ATOM 953 CG LEU A 63 -5.151 2.941 -14.322 1.00 0.00 C ATOM 954 CD1 LEU A 63 -4.163 2.439 -15.373 1.00 0.00 C ATOM 955 CD2 LEU A 63 -6.568 2.482 -14.633 1.00 0.00 C ATOM 0 H LEU A 63 -4.125 1.926 -10.638 1.00 0.00 H new ATOM 0 HA LEU A 63 -2.626 2.680 -13.116 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -4.769 1.234 -13.089 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.588 2.545 -12.264 1.00 0.00 H new ATOM 0 HG LEU A 63 -5.096 4.030 -14.311 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -4.406 2.879 -16.340 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -3.151 2.726 -15.087 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.226 1.353 -15.443 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -6.883 2.898 -15.590 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -6.595 1.394 -14.684 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -7.242 2.826 -13.848 1.00 0.00 H new ATOM 967 N THR A 64 -2.364 4.991 -12.086 1.00 0.00 N ATOM 968 CA THR A 64 -2.353 6.380 -11.588 1.00 0.00 C ATOM 969 C THR A 64 -1.487 7.231 -12.536 1.00 0.00 C ATOM 970 O THR A 64 -0.300 7.428 -12.268 1.00 0.00 O ATOM 971 CB THR A 64 -1.831 6.401 -10.147 1.00 0.00 C ATOM 972 OG1 THR A 64 -2.668 5.583 -9.349 1.00 0.00 O ATOM 973 CG2 THR A 64 -1.865 7.812 -9.558 1.00 0.00 C ATOM 0 H THR A 64 -1.462 4.629 -12.395 1.00 0.00 H new ATOM 0 HA THR A 64 -3.358 6.801 -11.574 1.00 0.00 H new ATOM 0 HB THR A 64 -0.801 6.043 -10.156 1.00 0.00 H new ATOM 0 HG1 THR A 64 -2.116 4.986 -8.802 1.00 0.00 H new ATOM 0 HG21 THR A 64 -1.488 7.789 -8.536 1.00 0.00 H new ATOM 0 HG22 THR A 64 -1.241 8.473 -10.160 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.890 8.182 -9.558 1.00 0.00 H new ATOM 981 N PRO A 65 -2.031 7.786 -13.628 1.00 0.00 N ATOM 982 CA PRO A 65 -1.309 8.769 -14.447 1.00 0.00 C ATOM 983 C PRO A 65 -1.344 10.187 -13.848 1.00 0.00 C ATOM 984 O PRO A 65 -2.140 11.031 -14.264 1.00 0.00 O ATOM 985 CB PRO A 65 -2.110 8.678 -15.749 1.00 0.00 C ATOM 986 CG PRO A 65 -3.546 8.445 -15.281 1.00 0.00 C ATOM 987 CD PRO A 65 -3.412 7.540 -14.058 1.00 0.00 C ATOM 0 HA PRO A 65 -0.242 8.571 -14.546 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -2.024 9.593 -16.336 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -1.757 7.861 -16.379 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -4.037 9.384 -15.027 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -4.145 7.973 -16.060 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -4.131 7.800 -13.281 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -3.578 6.492 -14.309 1.00 0.00 H new ATOM 1104 N PHE A 73 3.802 8.166 -2.082 1.00 0.00 N ATOM 1105 CA PHE A 73 2.819 7.240 -1.492 1.00 0.00 C ATOM 1106 C PHE A 73 3.298 6.981 -0.063 1.00 0.00 C ATOM 1107 O PHE A 73 4.509 6.897 0.159 1.00 0.00 O ATOM 1108 CB PHE A 73 2.805 5.984 -2.392 1.00 0.00 C ATOM 1109 CG PHE A 73 1.875 4.826 -2.040 1.00 0.00 C ATOM 1110 CD1 PHE A 73 0.606 5.033 -1.597 1.00 0.00 C ATOM 1111 CD2 PHE A 73 2.302 3.551 -2.269 1.00 0.00 C ATOM 1112 CE1 PHE A 73 -0.214 3.980 -1.345 1.00 0.00 C ATOM 1113 CE2 PHE A 73 1.464 2.503 -2.057 1.00 0.00 C ATOM 1114 CZ PHE A 73 0.224 2.714 -1.556 1.00 0.00 C ATOM 0 HA PHE A 73 1.796 7.613 -1.441 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.558 6.308 -3.403 1.00 0.00 H new ATOM 0 HB3 PHE A 73 3.821 5.591 -2.423 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.248 6.041 -1.445 1.00 0.00 H new ATOM 0 HD2 PHE A 73 3.308 3.374 -2.620 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -1.215 4.151 -0.977 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.788 1.499 -2.289 1.00 0.00 H new ATOM 0 HZ PHE A 73 -0.416 1.875 -1.325 1.00 0.00 H new ATOM 1124 N PRO A 74 2.427 6.727 0.919 1.00 0.00 N ATOM 1125 CA PRO A 74 2.926 6.479 2.271 1.00 0.00 C ATOM 1126 C PRO A 74 3.373 5.024 2.414 1.00 0.00 C ATOM 1127 O PRO A 74 2.822 4.118 1.785 1.00 0.00 O ATOM 1128 CB PRO A 74 1.715 6.824 3.136 1.00 0.00 C ATOM 1129 CG PRO A 74 0.792 7.671 2.270 1.00 0.00 C ATOM 1130 CD PRO A 74 1.016 7.127 0.870 1.00 0.00 C ATOM 0 HA PRO A 74 3.806 7.060 2.548 1.00 0.00 H new ATOM 0 HB2 PRO A 74 1.209 5.919 3.473 1.00 0.00 H new ATOM 0 HB3 PRO A 74 2.019 7.371 4.029 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -0.249 7.571 2.577 1.00 0.00 H new ATOM 0 HG3 PRO A 74 1.043 8.730 2.333 1.00 0.00 H new ATOM 0 HD2 PRO A 74 0.361 6.284 0.650 1.00 0.00 H new ATOM 0 HD3 PRO A 74 0.832 7.881 0.105 1.00 0.00 H new ATOM 1138 N LYS A 75 4.364 4.795 3.266 1.00 0.00 N ATOM 1139 CA LYS A 75 4.791 3.412 3.551 1.00 0.00 C ATOM 1140 C LYS A 75 3.692 2.552 4.205 1.00 0.00 C ATOM 1141 O LYS A 75 3.564 1.359 3.921 1.00 0.00 O ATOM 1142 CB LYS A 75 6.061 3.406 4.415 1.00 0.00 C ATOM 1143 CG LYS A 75 7.270 3.999 3.680 1.00 0.00 C ATOM 1144 CD LYS A 75 8.536 3.914 4.534 1.00 0.00 C ATOM 1145 CE LYS A 75 9.742 4.481 3.783 1.00 0.00 C ATOM 1146 NZ LYS A 75 10.952 4.389 4.615 1.00 0.00 N ATOM 0 H LYS A 75 4.881 5.519 3.764 1.00 0.00 H new ATOM 0 HA LYS A 75 5.005 2.955 2.585 1.00 0.00 H new ATOM 0 HB2 LYS A 75 5.879 3.974 5.327 1.00 0.00 H new ATOM 0 HB3 LYS A 75 6.288 2.383 4.716 1.00 0.00 H new ATOM 0 HG2 LYS A 75 7.425 3.466 2.742 1.00 0.00 H new ATOM 0 HG3 LYS A 75 7.069 5.040 3.426 1.00 0.00 H new ATOM 0 HD2 LYS A 75 8.390 4.465 5.463 1.00 0.00 H new ATOM 0 HD3 LYS A 75 8.727 2.876 4.805 1.00 0.00 H new ATOM 0 HE2 LYS A 75 9.890 3.933 2.852 1.00 0.00 H new ATOM 0 HE3 LYS A 75 9.556 5.521 3.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 11.763 4.778 4.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 10.813 4.931 5.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 11.137 3.393 4.850 1.00 0.00 H new ATOM 1160 N LYS A 76 2.910 3.150 5.106 1.00 0.00 N ATOM 1161 CA LYS A 76 1.845 2.409 5.807 1.00 0.00 C ATOM 1162 C LYS A 76 0.782 1.815 4.869 1.00 0.00 C ATOM 1163 O LYS A 76 0.249 0.740 5.146 1.00 0.00 O ATOM 1164 CB LYS A 76 1.161 3.326 6.834 1.00 0.00 C ATOM 1165 CG LYS A 76 2.110 3.766 7.956 1.00 0.00 C ATOM 1166 CD LYS A 76 1.386 4.643 8.981 1.00 0.00 C ATOM 1167 CE LYS A 76 2.334 5.077 10.101 1.00 0.00 C ATOM 1168 NZ LYS A 76 1.620 5.913 11.077 1.00 0.00 N ATOM 0 H LYS A 76 2.987 4.132 5.369 1.00 0.00 H new ATOM 0 HA LYS A 76 2.334 1.568 6.300 1.00 0.00 H new ATOM 0 HB2 LYS A 76 0.772 4.208 6.326 1.00 0.00 H new ATOM 0 HB3 LYS A 76 0.307 2.806 7.268 1.00 0.00 H new ATOM 0 HG2 LYS A 76 2.523 2.888 8.452 1.00 0.00 H new ATOM 0 HG3 LYS A 76 2.950 4.316 7.531 1.00 0.00 H new ATOM 0 HD2 LYS A 76 0.976 5.523 8.486 1.00 0.00 H new ATOM 0 HD3 LYS A 76 0.545 4.094 9.404 1.00 0.00 H new ATOM 0 HE2 LYS A 76 2.748 4.199 10.597 1.00 0.00 H new ATOM 0 HE3 LYS A 76 3.174 5.632 9.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 2.275 6.201 11.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 1.246 6.759 10.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 0.834 5.371 11.489 1.00 0.00 H new ATOM 1182 N LEU A 77 0.496 2.468 3.741 1.00 0.00 N ATOM 1183 CA LEU A 77 -0.471 1.879 2.789 1.00 0.00 C ATOM 1184 C LEU A 77 0.173 0.735 1.986 1.00 0.00 C ATOM 1185 O LEU A 77 -0.515 -0.233 1.679 1.00 0.00 O ATOM 1186 CB LEU A 77 -1.109 2.878 1.799 1.00 0.00 C ATOM 1187 CG LEU A 77 -2.203 3.768 2.409 1.00 0.00 C ATOM 1188 CD1 LEU A 77 -1.658 4.763 3.434 1.00 0.00 C ATOM 1189 CD2 LEU A 77 -2.926 4.544 1.304 1.00 0.00 C ATOM 0 H LEU A 77 0.895 3.365 3.464 1.00 0.00 H new ATOM 0 HA LEU A 77 -1.277 1.510 3.424 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.325 3.516 1.390 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -1.535 2.321 0.964 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.892 3.100 2.926 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -2.477 5.363 3.830 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.179 4.220 4.249 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.928 5.416 2.955 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.699 5.172 1.747 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.211 5.171 0.772 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.383 3.842 0.606 1.00 0.00 H new ATOM 1201 N ILE A 78 1.480 0.757 1.716 1.00 0.00 N ATOM 1202 CA ILE A 78 2.154 -0.407 1.137 1.00 0.00 C ATOM 1203 C ILE A 78 2.126 -1.612 2.109 1.00 0.00 C ATOM 1204 O ILE A 78 2.001 -2.750 1.656 1.00 0.00 O ATOM 1205 CB ILE A 78 3.585 0.064 0.799 1.00 0.00 C ATOM 1206 CG1 ILE A 78 3.665 1.153 -0.275 1.00 0.00 C ATOM 1207 CG2 ILE A 78 4.479 -1.110 0.425 1.00 0.00 C ATOM 1208 CD1 ILE A 78 5.048 1.802 -0.389 1.00 0.00 C ATOM 0 H ILE A 78 2.087 1.559 1.887 1.00 0.00 H new ATOM 0 HA ILE A 78 1.653 -0.767 0.238 1.00 0.00 H new ATOM 0 HB ILE A 78 3.948 0.525 1.718 1.00 0.00 H new ATOM 0 HG12 ILE A 78 3.395 0.721 -1.239 1.00 0.00 H new ATOM 0 HG13 ILE A 78 2.928 1.925 -0.053 1.00 0.00 H new ATOM 0 HG21 ILE A 78 5.480 -0.746 0.192 1.00 0.00 H new ATOM 0 HG22 ILE A 78 4.532 -1.808 1.261 1.00 0.00 H new ATOM 0 HG23 ILE A 78 4.066 -1.618 -0.446 1.00 0.00 H new ATOM 0 HD11 ILE A 78 5.030 2.563 -1.169 1.00 0.00 H new ATOM 0 HD12 ILE A 78 5.313 2.264 0.562 1.00 0.00 H new ATOM 0 HD13 ILE A 78 5.787 1.042 -0.641 1.00 0.00 H new ATOM 1220 N SER A 79 2.220 -1.400 3.429 1.00 0.00 N ATOM 1221 CA SER A 79 2.085 -2.521 4.377 1.00 0.00 C ATOM 1222 C SER A 79 0.652 -3.083 4.425 1.00 0.00 C ATOM 1223 O SER A 79 0.464 -4.299 4.486 1.00 0.00 O ATOM 1224 CB SER A 79 2.520 -2.059 5.771 1.00 0.00 C ATOM 1225 OG SER A 79 3.878 -1.639 5.751 1.00 0.00 O ATOM 0 H SER A 79 2.384 -0.490 3.859 1.00 0.00 H new ATOM 0 HA SER A 79 2.729 -3.330 4.031 1.00 0.00 H new ATOM 0 HB2 SER A 79 1.884 -1.239 6.105 1.00 0.00 H new ATOM 0 HB3 SER A 79 2.394 -2.872 6.486 1.00 0.00 H new ATOM 0 HG SER A 79 4.143 -1.345 6.648 1.00 0.00 H new ATOM 1231 N VAL A 80 -0.359 -2.214 4.379 1.00 0.00 N ATOM 1232 CA VAL A 80 -1.761 -2.679 4.315 1.00 0.00 C ATOM 1233 C VAL A 80 -2.071 -3.387 2.978 1.00 0.00 C ATOM 1234 O VAL A 80 -2.802 -4.378 2.963 1.00 0.00 O ATOM 1235 CB VAL A 80 -2.714 -1.491 4.572 1.00 0.00 C ATOM 1236 CG1 VAL A 80 -4.189 -1.889 4.426 1.00 0.00 C ATOM 1237 CG2 VAL A 80 -2.526 -0.924 5.985 1.00 0.00 C ATOM 0 H VAL A 80 -0.246 -1.200 4.384 1.00 0.00 H new ATOM 0 HA VAL A 80 -1.916 -3.423 5.096 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.462 -0.742 3.822 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -4.821 -1.021 4.616 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -4.369 -2.254 3.415 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -4.427 -2.675 5.143 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -3.210 -0.089 6.136 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -2.734 -1.702 6.720 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.499 -0.578 6.104 1.00 0.00 H new ATOM 1247 N LEU A 81 -1.526 -2.901 1.862 1.00 0.00 N ATOM 1248 CA LEU A 81 -1.706 -3.565 0.572 1.00 0.00 C ATOM 1249 C LEU A 81 -1.034 -4.949 0.521 1.00 0.00 C ATOM 1250 O LEU A 81 -1.608 -5.893 -0.022 1.00 0.00 O ATOM 1251 CB LEU A 81 -1.109 -2.632 -0.501 1.00 0.00 C ATOM 1252 CG LEU A 81 -2.097 -1.740 -1.273 1.00 0.00 C ATOM 1253 CD1 LEU A 81 -3.393 -2.458 -1.668 1.00 0.00 C ATOM 1254 CD2 LEU A 81 -2.385 -0.470 -0.474 1.00 0.00 C ATOM 0 H LEU A 81 -0.959 -2.054 1.826 1.00 0.00 H new ATOM 0 HA LEU A 81 -2.767 -3.744 0.400 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -0.374 -1.987 -0.019 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -0.570 -3.246 -1.223 1.00 0.00 H new ATOM 0 HG LEU A 81 -1.616 -1.474 -2.214 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.041 -1.768 -2.209 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -3.157 -3.310 -2.306 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -3.903 -2.807 -0.771 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -3.085 0.157 -1.027 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -2.819 -0.737 0.489 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -1.456 0.078 -0.314 1.00 0.00 H new ATOM 1266 N ALA A 82 0.163 -5.083 1.087 1.00 0.00 N ATOM 1267 CA ALA A 82 0.818 -6.392 1.196 1.00 0.00 C ATOM 1268 C ALA A 82 0.076 -7.377 2.116 1.00 0.00 C ATOM 1269 O ALA A 82 0.153 -8.589 1.913 1.00 0.00 O ATOM 1270 CB ALA A 82 2.229 -6.126 1.723 1.00 0.00 C ATOM 0 H ALA A 82 0.700 -4.308 1.477 1.00 0.00 H new ATOM 0 HA ALA A 82 0.825 -6.872 0.217 1.00 0.00 H new ATOM 0 HB1 ALA A 82 2.764 -7.070 1.824 1.00 0.00 H new ATOM 0 HB2 ALA A 82 2.762 -5.480 1.026 1.00 0.00 H new ATOM 0 HB3 ALA A 82 2.168 -5.638 2.696 1.00 0.00 H new ATOM 1276 N ASP A 83 -0.626 -6.875 3.135 1.00 0.00 N ATOM 1277 CA ASP A 83 -1.372 -7.766 4.044 1.00 0.00 C ATOM 1278 C ASP A 83 -2.643 -8.384 3.435 1.00 0.00 C ATOM 1279 O ASP A 83 -3.140 -9.406 3.907 1.00 0.00 O ATOM 1280 CB ASP A 83 -1.673 -7.000 5.341 1.00 0.00 C ATOM 1281 CG ASP A 83 -2.216 -7.896 6.450 1.00 0.00 C ATOM 1282 OD1 ASP A 83 -1.419 -8.627 7.079 1.00 0.00 O ATOM 1283 OD2 ASP A 83 -3.440 -7.873 6.699 1.00 0.00 O ATOM 0 H ASP A 83 -0.697 -5.881 3.353 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.737 -8.628 4.250 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -0.762 -6.513 5.688 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -2.396 -6.212 5.131 1.00 0.00 H new ATOM 1288 N SER A 84 -3.141 -7.781 2.366 1.00 0.00 N ATOM 1289 CA SER A 84 -4.251 -8.357 1.597 1.00 0.00 C ATOM 1290 C SER A 84 -3.867 -9.591 0.764 1.00 0.00 C ATOM 1291 O SER A 84 -4.745 -10.324 0.307 1.00 0.00 O ATOM 1292 CB SER A 84 -4.761 -7.259 0.662 1.00 0.00 C ATOM 1293 OG SER A 84 -5.245 -6.150 1.407 1.00 0.00 O ATOM 0 H SER A 84 -2.798 -6.891 2.005 1.00 0.00 H new ATOM 0 HA SER A 84 -5.006 -8.702 2.303 1.00 0.00 H new ATOM 0 HB2 SER A 84 -3.958 -6.936 -0.000 1.00 0.00 H new ATOM 0 HB3 SER A 84 -5.556 -7.653 0.029 1.00 0.00 H new ATOM 0 HG SER A 84 -5.565 -5.458 0.792 1.00 0.00 H new ATOM 1299 N LEU A 85 -2.576 -9.813 0.530 1.00 0.00 N ATOM 1300 CA LEU A 85 -2.147 -10.819 -0.438 1.00 0.00 C ATOM 1301 C LEU A 85 -1.478 -11.998 0.278 1.00 0.00 C ATOM 1302 O LEU A 85 -0.979 -11.886 1.399 1.00 0.00 O ATOM 1303 CB LEU A 85 -1.137 -10.159 -1.395 1.00 0.00 C ATOM 1304 CG LEU A 85 -1.406 -8.700 -1.814 1.00 0.00 C ATOM 1305 CD1 LEU A 85 -0.271 -8.207 -2.714 1.00 0.00 C ATOM 1306 CD2 LEU A 85 -2.751 -8.512 -2.522 1.00 0.00 C ATOM 0 H LEU A 85 -1.815 -9.315 0.992 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.010 -11.195 -0.987 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -0.154 -10.199 -0.927 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -1.084 -10.765 -2.299 1.00 0.00 H new ATOM 0 HG LEU A 85 -1.451 -8.110 -0.898 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.463 -7.175 -3.009 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.673 -8.260 -2.171 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -0.213 -8.834 -3.604 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.878 -7.463 -2.790 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -2.776 -9.123 -3.425 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.558 -8.816 -1.856 1.00 0.00 H new ATOM 1318 N LYS A 86 -1.424 -13.131 -0.416 1.00 0.00 N ATOM 1319 CA LYS A 86 -0.620 -14.269 0.051 1.00 0.00 C ATOM 1320 C LYS A 86 0.798 -14.176 -0.554 1.00 0.00 C ATOM 1321 O LYS A 86 1.059 -13.282 -1.362 1.00 0.00 O ATOM 1322 CB LYS A 86 -1.330 -15.551 -0.420 1.00 0.00 C ATOM 1323 CG LYS A 86 -2.583 -15.875 0.402 1.00 0.00 C ATOM 1324 CD LYS A 86 -3.201 -17.201 -0.055 1.00 0.00 C ATOM 1325 CE LYS A 86 -4.450 -17.588 0.744 1.00 0.00 C ATOM 1326 NZ LYS A 86 -4.128 -17.848 2.156 1.00 0.00 N ATOM 0 H LYS A 86 -1.919 -13.291 -1.294 1.00 0.00 H new ATOM 0 HA LYS A 86 -0.524 -14.271 1.137 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -1.607 -15.442 -1.468 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -0.635 -16.389 -0.359 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.326 -15.933 1.460 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.312 -15.072 0.295 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.460 -17.129 -1.111 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -2.458 -17.993 0.038 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -5.187 -16.788 0.679 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -4.904 -18.476 0.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -4.964 -18.237 2.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -3.346 -18.532 2.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -3.846 -16.960 2.617 1.00 0.00 H new ATOM 1340 N PRO A 87 1.750 -15.053 -0.192 1.00 0.00 N ATOM 1341 CA PRO A 87 3.162 -14.877 -0.581 1.00 0.00 C ATOM 1342 C PRO A 87 3.487 -14.846 -2.088 1.00 0.00 C ATOM 1343 O PRO A 87 4.603 -14.486 -2.464 1.00 0.00 O ATOM 1344 CB PRO A 87 3.843 -16.068 0.102 1.00 0.00 C ATOM 1345 CG PRO A 87 3.008 -16.313 1.355 1.00 0.00 C ATOM 1346 CD PRO A 87 1.577 -15.962 0.947 1.00 0.00 C ATOM 0 HA PRO A 87 3.503 -13.887 -0.278 1.00 0.00 H new ATOM 0 HB2 PRO A 87 3.855 -16.945 -0.546 1.00 0.00 H new ATOM 0 HB3 PRO A 87 4.880 -15.843 0.353 1.00 0.00 H new ATOM 0 HG2 PRO A 87 3.082 -17.350 1.683 1.00 0.00 H new ATOM 0 HG3 PRO A 87 3.347 -15.691 2.184 1.00 0.00 H new ATOM 0 HD2 PRO A 87 1.012 -16.851 0.667 1.00 0.00 H new ATOM 0 HD3 PRO A 87 1.035 -15.483 1.762 1.00 0.00 H new ATOM 1354 N ASN A 88 2.535 -15.189 -2.953 1.00 0.00 N ATOM 1355 CA ASN A 88 2.710 -14.937 -4.401 1.00 0.00 C ATOM 1356 C ASN A 88 1.903 -13.693 -4.815 1.00 0.00 C ATOM 1357 O ASN A 88 1.171 -13.696 -5.805 1.00 0.00 O ATOM 1358 CB ASN A 88 2.325 -16.181 -5.232 1.00 0.00 C ATOM 1359 CG ASN A 88 3.111 -17.430 -4.831 1.00 0.00 C ATOM 1360 OD1 ASN A 88 2.586 -18.342 -4.194 1.00 0.00 O ATOM 1361 ND2 ASN A 88 4.380 -17.485 -5.193 1.00 0.00 N ATOM 0 H ASN A 88 1.652 -15.631 -2.697 1.00 0.00 H new ATOM 0 HA ASN A 88 3.763 -14.739 -4.603 1.00 0.00 H new ATOM 0 HB2 ASN A 88 1.259 -16.375 -5.114 1.00 0.00 H new ATOM 0 HB3 ASN A 88 2.496 -15.974 -6.288 1.00 0.00 H new ATOM 0 HD21 ASN A 88 4.946 -18.296 -4.945 1.00 0.00 H new ATOM 0 HD22 ASN A 88 4.794 -16.716 -5.721 1.00 0.00 H new ATOM 1368 N GLY A 89 2.083 -12.606 -4.066 1.00 0.00 N ATOM 1369 CA GLY A 89 1.496 -11.316 -4.437 1.00 0.00 C ATOM 1370 C GLY A 89 2.328 -10.684 -5.535 1.00 0.00 C ATOM 1371 O GLY A 89 3.550 -10.796 -5.525 1.00 0.00 O ATOM 0 H GLY A 89 2.627 -12.591 -3.203 1.00 0.00 H new ATOM 0 HA2 GLY A 89 0.470 -11.455 -4.777 1.00 0.00 H new ATOM 0 HA3 GLY A 89 1.458 -10.658 -3.569 1.00 0.00 H new ATOM 1375 N SER A 90 1.686 -10.039 -6.498 1.00 0.00 N ATOM 1376 CA SER A 90 2.442 -9.508 -7.634 1.00 0.00 C ATOM 1377 C SER A 90 1.856 -8.133 -7.964 1.00 0.00 C ATOM 1378 O SER A 90 0.778 -8.004 -8.547 1.00 0.00 O ATOM 1379 CB SER A 90 2.355 -10.469 -8.827 1.00 0.00 C ATOM 1380 OG SER A 90 1.004 -10.695 -9.209 1.00 0.00 O ATOM 0 H SER A 90 0.680 -9.872 -6.523 1.00 0.00 H new ATOM 0 HA SER A 90 3.500 -9.408 -7.393 1.00 0.00 H new ATOM 0 HB2 SER A 90 2.910 -10.057 -9.670 1.00 0.00 H new ATOM 0 HB3 SER A 90 2.826 -11.417 -8.568 1.00 0.00 H new ATOM 0 HG SER A 90 0.500 -9.858 -9.139 1.00 0.00 H new ATOM 1386 N LEU A 91 2.581 -7.102 -7.565 1.00 0.00 N ATOM 1387 CA LEU A 91 2.158 -5.726 -7.765 1.00 0.00 C ATOM 1388 C LEU A 91 2.719 -5.299 -9.128 1.00 0.00 C ATOM 1389 O LEU A 91 3.913 -5.449 -9.380 1.00 0.00 O ATOM 1390 CB LEU A 91 2.829 -5.013 -6.586 1.00 0.00 C ATOM 1391 CG LEU A 91 2.591 -3.511 -6.564 1.00 0.00 C ATOM 1392 CD1 LEU A 91 2.150 -3.053 -5.172 1.00 0.00 C ATOM 1393 CD2 LEU A 91 3.866 -2.761 -6.945 1.00 0.00 C ATOM 0 H LEU A 91 3.480 -7.195 -7.093 1.00 0.00 H new ATOM 0 HA LEU A 91 1.086 -5.527 -7.783 1.00 0.00 H new ATOM 0 HB2 LEU A 91 2.461 -5.444 -5.655 1.00 0.00 H new ATOM 0 HB3 LEU A 91 3.902 -5.201 -6.622 1.00 0.00 H new ATOM 0 HG LEU A 91 1.805 -3.290 -7.286 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.985 -1.976 -5.179 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.225 -3.560 -4.898 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.926 -3.297 -4.446 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.677 -1.688 -6.924 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.657 -3.004 -6.235 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.175 -3.055 -7.948 1.00 0.00 H new ATOM 1405 N ILE A 92 1.880 -4.737 -9.991 1.00 0.00 N ATOM 1406 CA ILE A 92 2.372 -4.116 -11.230 1.00 0.00 C ATOM 1407 C ILE A 92 2.189 -2.621 -11.098 1.00 0.00 C ATOM 1408 O ILE A 92 1.107 -2.075 -11.334 1.00 0.00 O ATOM 1409 CB ILE A 92 1.582 -4.617 -12.437 1.00 0.00 C ATOM 1410 CG1 ILE A 92 1.637 -6.138 -12.593 1.00 0.00 C ATOM 1411 CG2 ILE A 92 2.055 -3.939 -13.736 1.00 0.00 C ATOM 1412 CD1 ILE A 92 3.081 -6.599 -12.537 1.00 0.00 C ATOM 0 H ILE A 92 0.869 -4.695 -9.865 1.00 0.00 H new ATOM 0 HA ILE A 92 3.421 -4.373 -11.380 1.00 0.00 H new ATOM 0 HB ILE A 92 0.543 -4.345 -12.250 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.060 -6.617 -11.802 1.00 0.00 H new ATOM 0 HG13 ILE A 92 1.186 -6.434 -13.540 1.00 0.00 H new ATOM 0 HG21 ILE A 92 1.473 -4.317 -14.577 1.00 0.00 H new ATOM 0 HG22 ILE A 92 1.917 -2.861 -13.655 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.110 -4.158 -13.897 1.00 0.00 H new ATOM 0 HD11 ILE A 92 3.122 -7.683 -12.648 1.00 0.00 H new ATOM 0 HD12 ILE A 92 3.644 -6.130 -13.344 1.00 0.00 H new ATOM 0 HD13 ILE A 92 3.516 -6.316 -11.579 1.00 0.00 H new ATOM 1424 N GLY A 93 3.228 -1.993 -10.592 1.00 0.00 N ATOM 1425 CA GLY A 93 3.022 -0.640 -10.081 1.00 0.00 C ATOM 1426 C GLY A 93 4.089 0.429 -10.232 1.00 0.00 C ATOM 1427 O GLY A 93 3.964 1.353 -11.037 1.00 0.00 O ATOM 0 H GLY A 93 4.176 -2.363 -10.521 1.00 0.00 H new ATOM 0 HA2 GLY A 93 2.118 -0.256 -10.553 1.00 0.00 H new ATOM 0 HA3 GLY A 93 2.811 -0.731 -9.015 1.00 0.00 H new ATOM 1431 N LEU A 94 5.072 0.388 -9.347 1.00 0.00 N ATOM 1432 CA LEU A 94 5.625 1.647 -8.821 1.00 0.00 C ATOM 1433 C LEU A 94 7.098 1.772 -9.250 1.00 0.00 C ATOM 1434 O LEU A 94 7.669 0.860 -9.846 1.00 0.00 O ATOM 1435 CB LEU A 94 5.566 1.542 -7.283 1.00 0.00 C ATOM 1436 CG LEU A 94 4.196 1.520 -6.564 1.00 0.00 C ATOM 1437 CD1 LEU A 94 4.225 0.479 -5.443 1.00 0.00 C ATOM 1438 CD2 LEU A 94 3.907 2.847 -5.881 1.00 0.00 C ATOM 0 H LEU A 94 5.498 -0.464 -8.982 1.00 0.00 H new ATOM 0 HA LEU A 94 5.069 2.509 -9.190 1.00 0.00 H new ATOM 0 HB2 LEU A 94 6.097 0.633 -6.999 1.00 0.00 H new ATOM 0 HB3 LEU A 94 6.132 2.381 -6.878 1.00 0.00 H new ATOM 0 HG LEU A 94 3.442 1.302 -7.321 1.00 0.00 H new ATOM 0 HD11 LEU A 94 3.260 0.463 -4.936 1.00 0.00 H new ATOM 0 HD12 LEU A 94 4.429 -0.505 -5.865 1.00 0.00 H new ATOM 0 HD13 LEU A 94 5.006 0.736 -4.728 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.937 2.798 -5.386 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.682 3.052 -5.142 1.00 0.00 H new ATOM 0 HD23 LEU A 94 3.894 3.644 -6.625 1.00 0.00 H new ATOM 1450 N SER A 95 7.693 2.946 -9.039 1.00 0.00 N ATOM 1451 CA SER A 95 8.893 3.310 -9.825 1.00 0.00 C ATOM 1452 C SER A 95 10.112 3.646 -8.943 1.00 0.00 C ATOM 1453 O SER A 95 10.643 2.756 -8.280 1.00 0.00 O ATOM 1454 CB SER A 95 8.509 4.356 -10.893 1.00 0.00 C ATOM 1455 OG SER A 95 8.555 5.693 -10.412 1.00 0.00 O ATOM 0 H SER A 95 7.387 3.643 -8.361 1.00 0.00 H new ATOM 0 HA SER A 95 9.253 2.441 -10.375 1.00 0.00 H new ATOM 0 HB2 SER A 95 9.183 4.260 -11.744 1.00 0.00 H new ATOM 0 HB3 SER A 95 7.504 4.142 -11.256 1.00 0.00 H new ATOM 0 HG SER A 95 8.304 6.309 -11.132 1.00 0.00 H new ATOM 1461 N ASP A 96 10.626 4.878 -8.993 1.00 0.00 N ATOM 1462 CA ASP A 96 12.038 5.105 -8.625 1.00 0.00 C ATOM 1463 C ASP A 96 12.356 5.022 -7.126 1.00 0.00 C ATOM 1464 O ASP A 96 13.168 4.186 -6.723 1.00 0.00 O ATOM 1465 CB ASP A 96 12.491 6.435 -9.247 1.00 0.00 C ATOM 1466 CG ASP A 96 13.999 6.651 -9.144 1.00 0.00 C ATOM 1467 OD1 ASP A 96 14.749 6.058 -9.948 1.00 0.00 O ATOM 1468 OD2 ASP A 96 14.438 7.413 -8.255 1.00 0.00 O ATOM 0 H ASP A 96 10.111 5.712 -9.274 1.00 0.00 H new ATOM 0 HA ASP A 96 12.612 4.273 -9.033 1.00 0.00 H new ATOM 0 HB2 ASP A 96 12.195 6.460 -10.296 1.00 0.00 H new ATOM 0 HB3 ASP A 96 11.976 7.257 -8.751 1.00 0.00 H new ATOM 1473 N ILE A 97 11.736 5.853 -6.292 1.00 0.00 N ATOM 1474 CA ILE A 97 11.898 5.692 -4.820 1.00 0.00 C ATOM 1475 C ILE A 97 11.413 4.301 -4.342 1.00 0.00 C ATOM 1476 O ILE A 97 11.831 3.728 -3.326 1.00 0.00 O ATOM 1477 CB ILE A 97 11.109 6.779 -4.048 1.00 0.00 C ATOM 1478 CG1 ILE A 97 11.143 8.139 -4.766 1.00 0.00 C ATOM 1479 CG2 ILE A 97 11.647 6.892 -2.616 1.00 0.00 C ATOM 1480 CD1 ILE A 97 10.407 9.257 -4.025 1.00 0.00 C ATOM 0 H ILE A 97 11.134 6.624 -6.580 1.00 0.00 H new ATOM 0 HA ILE A 97 12.963 5.793 -4.613 1.00 0.00 H new ATOM 0 HB ILE A 97 10.063 6.475 -4.011 1.00 0.00 H new ATOM 0 HG12 ILE A 97 12.182 8.436 -4.909 1.00 0.00 H new ATOM 0 HG13 ILE A 97 10.704 8.025 -5.757 1.00 0.00 H new ATOM 0 HG21 ILE A 97 11.089 7.658 -2.077 1.00 0.00 H new ATOM 0 HG22 ILE A 97 11.533 5.935 -2.108 1.00 0.00 H new ATOM 0 HG23 ILE A 97 12.702 7.164 -2.644 1.00 0.00 H new ATOM 0 HD11 ILE A 97 10.479 10.182 -4.598 1.00 0.00 H new ATOM 0 HD12 ILE A 97 9.358 8.985 -3.905 1.00 0.00 H new ATOM 0 HD13 ILE A 97 10.859 9.402 -3.044 1.00 0.00 H new ATOM 1492 N TYR A 98 10.485 3.766 -5.118 1.00 0.00 N ATOM 1493 CA TYR A 98 9.753 2.589 -4.706 1.00 0.00 C ATOM 1494 C TYR A 98 10.610 1.309 -4.867 1.00 0.00 C ATOM 1495 O TYR A 98 10.331 0.305 -4.220 1.00 0.00 O ATOM 1496 CB TYR A 98 8.410 2.565 -5.420 1.00 0.00 C ATOM 1497 CG TYR A 98 7.641 3.865 -5.219 1.00 0.00 C ATOM 1498 CD1 TYR A 98 7.029 4.107 -4.029 1.00 0.00 C ATOM 1499 CD2 TYR A 98 7.625 4.820 -6.190 1.00 0.00 C ATOM 1500 CE1 TYR A 98 6.361 5.270 -3.832 1.00 0.00 C ATOM 1501 CE2 TYR A 98 6.950 5.980 -5.996 1.00 0.00 C ATOM 1502 CZ TYR A 98 6.314 6.204 -4.816 1.00 0.00 C ATOM 1503 OH TYR A 98 5.646 7.376 -4.597 1.00 0.00 O ATOM 0 H TYR A 98 10.224 4.130 -6.034 1.00 0.00 H new ATOM 0 HA TYR A 98 9.533 2.624 -3.639 1.00 0.00 H new ATOM 0 HB2 TYR A 98 8.567 2.396 -6.485 1.00 0.00 H new ATOM 0 HB3 TYR A 98 7.816 1.730 -5.049 1.00 0.00 H new ATOM 0 HD1 TYR A 98 7.075 3.371 -3.240 1.00 0.00 H new ATOM 0 HD2 TYR A 98 8.152 4.653 -7.118 1.00 0.00 H new ATOM 0 HE1 TYR A 98 5.865 5.454 -2.890 1.00 0.00 H new ATOM 0 HE2 TYR A 98 6.918 6.724 -6.778 1.00 0.00 H new ATOM 0 HH TYR A 98 5.179 7.331 -3.737 1.00 0.00 H new ATOM 1513 N LYS A 99 11.684 1.337 -5.669 1.00 0.00 N ATOM 1514 CA LYS A 99 12.652 0.218 -5.707 1.00 0.00 C ATOM 1515 C LYS A 99 13.207 -0.128 -4.310 1.00 0.00 C ATOM 1516 O LYS A 99 13.124 -1.273 -3.863 1.00 0.00 O ATOM 1517 CB LYS A 99 13.830 0.581 -6.629 1.00 0.00 C ATOM 1518 CG LYS A 99 13.419 0.720 -8.098 1.00 0.00 C ATOM 1519 CD LYS A 99 14.613 1.093 -8.983 1.00 0.00 C ATOM 1520 CE LYS A 99 14.251 1.130 -10.472 1.00 0.00 C ATOM 1521 NZ LYS A 99 13.294 2.206 -10.773 1.00 0.00 N ATOM 0 H LYS A 99 11.908 2.110 -6.295 1.00 0.00 H new ATOM 0 HA LYS A 99 12.117 -0.654 -6.084 1.00 0.00 H new ATOM 0 HB2 LYS A 99 14.273 1.518 -6.291 1.00 0.00 H new ATOM 0 HB3 LYS A 99 14.600 -0.185 -6.544 1.00 0.00 H new ATOM 0 HG2 LYS A 99 12.986 -0.218 -8.446 1.00 0.00 H new ATOM 0 HG3 LYS A 99 12.645 1.482 -8.190 1.00 0.00 H new ATOM 0 HD2 LYS A 99 14.994 2.068 -8.681 1.00 0.00 H new ATOM 0 HD3 LYS A 99 15.417 0.374 -8.826 1.00 0.00 H new ATOM 0 HE2 LYS A 99 15.156 1.272 -11.063 1.00 0.00 H new ATOM 0 HE3 LYS A 99 13.825 0.171 -10.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 13.086 2.211 -11.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 12.415 2.047 -10.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 13.704 3.122 -10.499 1.00 0.00 H new ATOM 1535 N VAL A 100 13.753 0.866 -3.607 1.00 0.00 N ATOM 1536 CA VAL A 100 14.196 0.654 -2.212 1.00 0.00 C ATOM 1537 C VAL A 100 13.010 0.341 -1.274 1.00 0.00 C ATOM 1538 O VAL A 100 13.151 -0.435 -0.326 1.00 0.00 O ATOM 1539 CB VAL A 100 14.991 1.887 -1.727 1.00 0.00 C ATOM 1540 CG1 VAL A 100 15.505 1.702 -0.294 1.00 0.00 C ATOM 1541 CG2 VAL A 100 16.199 2.172 -2.629 1.00 0.00 C ATOM 0 H VAL A 100 13.901 1.810 -3.964 1.00 0.00 H new ATOM 0 HA VAL A 100 14.849 -0.218 -2.186 1.00 0.00 H new ATOM 0 HB VAL A 100 14.295 2.725 -1.764 1.00 0.00 H new ATOM 0 HG11 VAL A 100 16.059 2.590 0.011 1.00 0.00 H new ATOM 0 HG12 VAL A 100 14.661 1.552 0.379 1.00 0.00 H new ATOM 0 HG13 VAL A 100 16.161 0.833 -0.252 1.00 0.00 H new ATOM 0 HG21 VAL A 100 16.733 3.046 -2.256 1.00 0.00 H new ATOM 0 HG22 VAL A 100 16.866 1.310 -2.626 1.00 0.00 H new ATOM 0 HG23 VAL A 100 15.857 2.363 -3.646 1.00 0.00 H new ATOM 1551 N ASP A 101 11.838 0.916 -1.544 1.00 0.00 N ATOM 1552 CA ASP A 101 10.617 0.538 -0.805 1.00 0.00 C ATOM 1553 C ASP A 101 10.259 -0.947 -0.950 1.00 0.00 C ATOM 1554 O ASP A 101 9.904 -1.610 0.024 1.00 0.00 O ATOM 1555 CB ASP A 101 9.464 1.385 -1.357 1.00 0.00 C ATOM 1556 CG ASP A 101 8.804 2.279 -0.314 1.00 0.00 C ATOM 1557 OD1 ASP A 101 8.195 1.745 0.638 1.00 0.00 O ATOM 1558 OD2 ASP A 101 8.893 3.518 -0.441 1.00 0.00 O ATOM 0 H ASP A 101 11.701 1.634 -2.255 1.00 0.00 H new ATOM 0 HA ASP A 101 10.793 0.715 0.256 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.839 2.007 -2.170 1.00 0.00 H new ATOM 0 HB3 ASP A 101 8.711 0.723 -1.784 1.00 0.00 H new ATOM 1563 N ALA A 102 10.361 -1.467 -2.173 1.00 0.00 N ATOM 1564 CA ALA A 102 10.160 -2.895 -2.418 1.00 0.00 C ATOM 1565 C ALA A 102 11.178 -3.753 -1.659 1.00 0.00 C ATOM 1566 O ALA A 102 10.839 -4.794 -1.100 1.00 0.00 O ATOM 1567 CB ALA A 102 10.361 -3.099 -3.913 1.00 0.00 C ATOM 0 H ALA A 102 10.581 -0.923 -3.007 1.00 0.00 H new ATOM 0 HA ALA A 102 9.168 -3.195 -2.079 1.00 0.00 H new ATOM 0 HB1 ALA A 102 10.223 -4.152 -4.158 1.00 0.00 H new ATOM 0 HB2 ALA A 102 9.635 -2.500 -4.463 1.00 0.00 H new ATOM 0 HB3 ALA A 102 11.369 -2.791 -4.190 1.00 0.00 H new ATOM 1573 N LEU A 103 12.437 -3.313 -1.644 1.00 0.00 N ATOM 1574 CA LEU A 103 13.497 -4.081 -0.973 1.00 0.00 C ATOM 1575 C LEU A 103 13.268 -4.219 0.540 1.00 0.00 C ATOM 1576 O LEU A 103 13.454 -5.302 1.099 1.00 0.00 O ATOM 1577 CB LEU A 103 14.838 -3.382 -1.263 1.00 0.00 C ATOM 1578 CG LEU A 103 16.074 -4.159 -0.781 1.00 0.00 C ATOM 1579 CD1 LEU A 103 16.244 -5.481 -1.540 1.00 0.00 C ATOM 1580 CD2 LEU A 103 17.326 -3.299 -0.974 1.00 0.00 C ATOM 0 H LEU A 103 12.748 -2.445 -2.079 1.00 0.00 H new ATOM 0 HA LEU A 103 13.496 -5.099 -1.364 1.00 0.00 H new ATOM 0 HB2 LEU A 103 14.923 -3.217 -2.337 1.00 0.00 H new ATOM 0 HB3 LEU A 103 14.833 -2.401 -0.789 1.00 0.00 H new ATOM 0 HG LEU A 103 15.933 -4.391 0.275 1.00 0.00 H new ATOM 0 HD11 LEU A 103 17.128 -6.001 -1.171 1.00 0.00 H new ATOM 0 HD12 LEU A 103 15.364 -6.105 -1.385 1.00 0.00 H new ATOM 0 HD13 LEU A 103 16.361 -5.277 -2.604 1.00 0.00 H new ATOM 0 HD21 LEU A 103 18.202 -3.850 -0.632 1.00 0.00 H new ATOM 0 HD22 LEU A 103 17.440 -3.055 -2.030 1.00 0.00 H new ATOM 0 HD23 LEU A 103 17.228 -2.379 -0.397 1.00 0.00 H new ATOM 1592 N ILE A 104 12.890 -3.133 1.211 1.00 0.00 N ATOM 1593 CA ILE A 104 12.744 -3.176 2.678 1.00 0.00 C ATOM 1594 C ILE A 104 11.406 -3.811 3.108 1.00 0.00 C ATOM 1595 O ILE A 104 11.365 -4.533 4.105 1.00 0.00 O ATOM 1596 CB ILE A 104 12.984 -1.763 3.252 1.00 0.00 C ATOM 1597 CG1 ILE A 104 14.429 -1.317 2.964 1.00 0.00 C ATOM 1598 CG2 ILE A 104 12.716 -1.713 4.764 1.00 0.00 C ATOM 1599 CD1 ILE A 104 14.697 0.146 3.324 1.00 0.00 C ATOM 0 H ILE A 104 12.682 -2.231 0.783 1.00 0.00 H new ATOM 0 HA ILE A 104 13.502 -3.834 3.103 1.00 0.00 H new ATOM 0 HB ILE A 104 12.286 -1.083 2.764 1.00 0.00 H new ATOM 0 HG12 ILE A 104 15.116 -1.953 3.523 1.00 0.00 H new ATOM 0 HG13 ILE A 104 14.644 -1.468 1.906 1.00 0.00 H new ATOM 0 HG21 ILE A 104 12.895 -0.703 5.132 1.00 0.00 H new ATOM 0 HG22 ILE A 104 11.681 -1.992 4.959 1.00 0.00 H new ATOM 0 HG23 ILE A 104 13.382 -2.409 5.275 1.00 0.00 H new ATOM 0 HD11 ILE A 104 15.734 0.393 3.095 1.00 0.00 H new ATOM 0 HD12 ILE A 104 14.035 0.790 2.746 1.00 0.00 H new ATOM 0 HD13 ILE A 104 14.514 0.298 4.388 1.00 0.00 H new ATOM 1611 N ASN A 105 10.320 -3.591 2.364 1.00 0.00 N ATOM 1612 CA ASN A 105 9.026 -4.186 2.734 1.00 0.00 C ATOM 1613 C ASN A 105 8.941 -5.704 2.509 1.00 0.00 C ATOM 1614 O ASN A 105 8.066 -6.357 3.081 1.00 0.00 O ATOM 1615 CB ASN A 105 7.918 -3.467 1.940 1.00 0.00 C ATOM 1616 CG ASN A 105 6.575 -3.481 2.672 1.00 0.00 C ATOM 1617 OD1 ASN A 105 6.299 -2.636 3.522 1.00 0.00 O ATOM 1618 ND2 ASN A 105 5.720 -4.435 2.350 1.00 0.00 N ATOM 0 H ASN A 105 10.304 -3.019 1.520 1.00 0.00 H new ATOM 0 HA ASN A 105 8.902 -4.049 3.808 1.00 0.00 H new ATOM 0 HB2 ASN A 105 8.218 -2.435 1.756 1.00 0.00 H new ATOM 0 HB3 ASN A 105 7.804 -3.945 0.967 1.00 0.00 H new ATOM 0 HD21 ASN A 105 4.810 -4.481 2.809 1.00 0.00 H new ATOM 0 HD22 ASN A 105 5.969 -5.126 1.642 1.00 0.00 H new ATOM 1625 N GLY A 106 9.818 -6.281 1.689 1.00 0.00 N ATOM 1626 CA GLY A 106 9.732 -7.724 1.411 1.00 0.00 C ATOM 1627 C GLY A 106 9.141 -8.028 0.032 1.00 0.00 C ATOM 1628 O GLY A 106 8.514 -9.067 -0.168 1.00 0.00 O ATOM 0 H GLY A 106 10.578 -5.793 1.215 1.00 0.00 H new ATOM 0 HA2 GLY A 106 10.728 -8.163 1.479 1.00 0.00 H new ATOM 0 HA3 GLY A 106 9.120 -8.201 2.177 1.00 0.00 H new ATOM 1632 N PHE A 107 9.393 -7.144 -0.928 1.00 0.00 N ATOM 1633 CA PHE A 107 9.033 -7.412 -2.327 1.00 0.00 C ATOM 1634 C PHE A 107 10.333 -7.709 -3.098 1.00 0.00 C ATOM 1635 O PHE A 107 11.444 -7.375 -2.680 1.00 0.00 O ATOM 1636 CB PHE A 107 8.284 -6.245 -2.996 1.00 0.00 C ATOM 1637 CG PHE A 107 6.882 -5.953 -2.491 1.00 0.00 C ATOM 1638 CD1 PHE A 107 5.798 -6.515 -3.100 1.00 0.00 C ATOM 1639 CD2 PHE A 107 6.700 -5.025 -1.516 1.00 0.00 C ATOM 1640 CE1 PHE A 107 4.543 -6.163 -2.712 1.00 0.00 C ATOM 1641 CE2 PHE A 107 5.446 -4.675 -1.129 1.00 0.00 C ATOM 1642 CZ PHE A 107 4.368 -5.248 -1.723 1.00 0.00 C ATOM 0 H PHE A 107 9.841 -6.241 -0.771 1.00 0.00 H new ATOM 0 HA PHE A 107 8.349 -8.261 -2.346 1.00 0.00 H new ATOM 0 HB2 PHE A 107 8.883 -5.343 -2.875 1.00 0.00 H new ATOM 0 HB3 PHE A 107 8.225 -6.448 -4.065 1.00 0.00 H new ATOM 0 HD1 PHE A 107 5.937 -7.239 -3.890 1.00 0.00 H new ATOM 0 HD2 PHE A 107 7.556 -4.563 -1.046 1.00 0.00 H new ATOM 0 HE1 PHE A 107 3.685 -6.611 -3.190 1.00 0.00 H new ATOM 0 HE2 PHE A 107 5.306 -3.941 -0.349 1.00 0.00 H new ATOM 0 HZ PHE A 107 3.371 -4.976 -1.409 1.00 0.00 H new ATOM 1652 N GLU A 108 10.170 -8.364 -4.239 1.00 0.00 N ATOM 1653 CA GLU A 108 11.302 -8.823 -5.050 1.00 0.00 C ATOM 1654 C GLU A 108 11.073 -8.326 -6.482 1.00 0.00 C ATOM 1655 O GLU A 108 10.171 -8.774 -7.191 1.00 0.00 O ATOM 1656 CB GLU A 108 11.372 -10.359 -4.977 1.00 0.00 C ATOM 1657 CG GLU A 108 12.570 -10.959 -5.720 1.00 0.00 C ATOM 1658 CD GLU A 108 13.902 -10.578 -5.083 1.00 0.00 C ATOM 1659 OE1 GLU A 108 14.299 -11.223 -4.089 1.00 0.00 O ATOM 1660 OE2 GLU A 108 14.557 -9.635 -5.575 1.00 0.00 O ATOM 0 H GLU A 108 9.257 -8.594 -4.632 1.00 0.00 H new ATOM 0 HA GLU A 108 12.253 -8.432 -4.688 1.00 0.00 H new ATOM 0 HB2 GLU A 108 11.416 -10.662 -3.931 1.00 0.00 H new ATOM 0 HB3 GLU A 108 10.454 -10.775 -5.391 1.00 0.00 H new ATOM 0 HG2 GLU A 108 12.476 -12.045 -5.737 1.00 0.00 H new ATOM 0 HG3 GLU A 108 12.557 -10.622 -6.756 1.00 0.00 H new ATOM 1667 N ILE A 109 11.884 -7.356 -6.883 1.00 0.00 N ATOM 1668 CA ILE A 109 11.574 -6.528 -8.050 1.00 0.00 C ATOM 1669 C ILE A 109 12.065 -7.103 -9.382 1.00 0.00 C ATOM 1670 O ILE A 109 13.258 -7.270 -9.636 1.00 0.00 O ATOM 1671 CB ILE A 109 12.068 -5.120 -7.725 1.00 0.00 C ATOM 1672 CG1 ILE A 109 11.676 -4.055 -8.745 1.00 0.00 C ATOM 1673 CG2 ILE A 109 13.575 -5.077 -7.577 1.00 0.00 C ATOM 1674 CD1 ILE A 109 12.041 -2.673 -8.221 1.00 0.00 C ATOM 0 H ILE A 109 12.762 -7.120 -6.420 1.00 0.00 H new ATOM 0 HA ILE A 109 10.499 -6.504 -8.226 1.00 0.00 H new ATOM 0 HB ILE A 109 11.570 -4.885 -6.784 1.00 0.00 H new ATOM 0 HG12 ILE A 109 12.185 -4.241 -9.691 1.00 0.00 H new ATOM 0 HG13 ILE A 109 10.606 -4.107 -8.944 1.00 0.00 H new ATOM 0 HG21 ILE A 109 13.889 -4.059 -7.346 1.00 0.00 H new ATOM 0 HG22 ILE A 109 13.880 -5.743 -6.770 1.00 0.00 H new ATOM 0 HG23 ILE A 109 14.041 -5.398 -8.508 1.00 0.00 H new ATOM 0 HD11 ILE A 109 11.758 -1.919 -8.955 1.00 0.00 H new ATOM 0 HD12 ILE A 109 11.511 -2.487 -7.287 1.00 0.00 H new ATOM 0 HD13 ILE A 109 13.116 -2.623 -8.045 1.00 0.00 H new ATOM 1686 N ILE A 110 11.083 -7.499 -10.177 1.00 0.00 N ATOM 1687 CA ILE A 110 11.357 -8.151 -11.461 1.00 0.00 C ATOM 1688 C ILE A 110 11.080 -7.137 -12.566 1.00 0.00 C ATOM 1689 O ILE A 110 10.010 -6.526 -12.655 1.00 0.00 O ATOM 1690 CB ILE A 110 10.542 -9.453 -11.586 1.00 0.00 C ATOM 1691 CG1 ILE A 110 10.807 -10.182 -12.913 1.00 0.00 C ATOM 1692 CG2 ILE A 110 9.034 -9.238 -11.375 1.00 0.00 C ATOM 1693 CD1 ILE A 110 10.281 -11.619 -12.897 1.00 0.00 C ATOM 0 H ILE A 110 10.092 -7.384 -9.963 1.00 0.00 H new ATOM 0 HA ILE A 110 12.399 -8.459 -11.543 1.00 0.00 H new ATOM 0 HB ILE A 110 10.893 -10.093 -10.777 1.00 0.00 H new ATOM 0 HG12 ILE A 110 10.335 -9.633 -13.728 1.00 0.00 H new ATOM 0 HG13 ILE A 110 11.878 -10.191 -13.113 1.00 0.00 H new ATOM 0 HG21 ILE A 110 8.513 -10.190 -11.475 1.00 0.00 H new ATOM 0 HG22 ILE A 110 8.860 -8.832 -10.378 1.00 0.00 H new ATOM 0 HG23 ILE A 110 8.658 -8.539 -12.122 1.00 0.00 H new ATOM 0 HD11 ILE A 110 10.491 -12.094 -13.855 1.00 0.00 H new ATOM 0 HD12 ILE A 110 10.772 -12.177 -12.100 1.00 0.00 H new ATOM 0 HD13 ILE A 110 9.205 -11.611 -12.724 1.00 0.00 H new ATOM 1705 N ASN A 111 12.105 -6.954 -13.388 1.00 0.00 N ATOM 1706 CA ASN A 111 12.061 -5.914 -14.425 1.00 0.00 C ATOM 1707 C ASN A 111 12.094 -6.525 -15.826 1.00 0.00 C ATOM 1708 O ASN A 111 13.118 -6.674 -16.494 1.00 0.00 O ATOM 1709 CB ASN A 111 13.134 -4.843 -14.201 1.00 0.00 C ATOM 1710 CG ASN A 111 14.567 -5.361 -14.041 1.00 0.00 C ATOM 1711 OD1 ASN A 111 15.268 -5.635 -15.011 1.00 0.00 O ATOM 1712 ND2 ASN A 111 15.019 -5.490 -12.806 1.00 0.00 N ATOM 0 H ASN A 111 12.967 -7.499 -13.364 1.00 0.00 H new ATOM 0 HA ASN A 111 11.106 -5.395 -14.343 1.00 0.00 H new ATOM 0 HB2 ASN A 111 13.110 -4.149 -15.041 1.00 0.00 H new ATOM 0 HB3 ASN A 111 12.872 -4.273 -13.310 1.00 0.00 H new ATOM 0 HD21 ASN A 111 15.969 -5.823 -12.643 1.00 0.00 H new ATOM 0 HD22 ASN A 111 14.418 -5.256 -12.016 1.00 0.00 H new ATOM 1719 N GLU A 112 10.898 -6.937 -16.195 1.00 0.00 N ATOM 1720 CA GLU A 112 10.659 -7.743 -17.399 1.00 0.00 C ATOM 1721 C GLU A 112 9.449 -7.051 -18.039 1.00 0.00 C ATOM 1722 O GLU A 112 8.380 -7.218 -17.463 1.00 0.00 O ATOM 1723 CB GLU A 112 10.362 -9.209 -17.053 1.00 0.00 C ATOM 1724 CG GLU A 112 11.631 -9.952 -16.611 1.00 0.00 C ATOM 1725 CD GLU A 112 11.392 -11.429 -16.317 1.00 0.00 C ATOM 1726 OE1 GLU A 112 10.270 -11.931 -16.538 1.00 0.00 O ATOM 1727 OE2 GLU A 112 12.340 -12.099 -15.852 1.00 0.00 O ATOM 0 H GLU A 112 10.050 -6.725 -15.670 1.00 0.00 H new ATOM 0 HA GLU A 112 11.523 -7.791 -18.061 1.00 0.00 H new ATOM 0 HB2 GLU A 112 9.618 -9.252 -16.257 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.930 -9.708 -17.921 1.00 0.00 H new ATOM 0 HG2 GLU A 112 12.387 -9.861 -17.391 1.00 0.00 H new ATOM 0 HG3 GLU A 112 12.033 -9.471 -15.719 1.00 0.00 H new ATOM 1734 N PRO A 113 9.581 -6.199 -19.077 1.00 0.00 N ATOM 1735 CA PRO A 113 8.794 -4.947 -19.207 1.00 0.00 C ATOM 1736 C PRO A 113 7.254 -4.867 -19.167 1.00 0.00 C ATOM 1737 O PRO A 113 6.672 -3.878 -19.612 1.00 0.00 O ATOM 1738 CB PRO A 113 9.280 -4.422 -20.548 1.00 0.00 C ATOM 1739 CG PRO A 113 10.764 -4.755 -20.557 1.00 0.00 C ATOM 1740 CD PRO A 113 10.850 -6.088 -19.818 1.00 0.00 C ATOM 0 HA PRO A 113 8.974 -4.407 -18.277 1.00 0.00 H new ATOM 0 HB2 PRO A 113 8.758 -4.901 -21.377 1.00 0.00 H new ATOM 0 HB3 PRO A 113 9.111 -3.349 -20.642 1.00 0.00 H new ATOM 0 HG2 PRO A 113 11.148 -4.837 -21.574 1.00 0.00 H new ATOM 0 HG3 PRO A 113 11.349 -3.983 -20.057 1.00 0.00 H new ATOM 0 HD2 PRO A 113 10.974 -6.917 -20.514 1.00 0.00 H new ATOM 0 HD3 PRO A 113 11.705 -6.109 -19.142 1.00 0.00 H new ATOM 1748 N ASP A 114 6.613 -5.765 -18.447 1.00 0.00 N ATOM 1749 CA ASP A 114 5.555 -5.332 -17.522 1.00 0.00 C ATOM 1750 C ASP A 114 6.230 -5.308 -16.142 1.00 0.00 C ATOM 1751 O ASP A 114 6.496 -6.347 -15.536 1.00 0.00 O ATOM 1752 CB ASP A 114 4.369 -6.296 -17.556 1.00 0.00 C ATOM 1753 CG ASP A 114 3.546 -6.155 -18.834 1.00 0.00 C ATOM 1754 OD1 ASP A 114 3.876 -6.814 -19.844 1.00 0.00 O ATOM 1755 OD2 ASP A 114 2.564 -5.382 -18.833 1.00 0.00 O ATOM 0 H ASP A 114 6.788 -6.769 -18.472 1.00 0.00 H new ATOM 0 HA ASP A 114 5.145 -4.357 -17.787 1.00 0.00 H new ATOM 0 HB2 ASP A 114 4.733 -7.320 -17.472 1.00 0.00 H new ATOM 0 HB3 ASP A 114 3.730 -6.113 -16.692 1.00 0.00 H new ATOM 1760 N TYR A 115 6.621 -4.109 -15.707 1.00 0.00 N ATOM 1761 CA TYR A 115 7.579 -3.978 -14.598 1.00 0.00 C ATOM 1762 C TYR A 115 6.845 -3.908 -13.260 1.00 0.00 C ATOM 1763 O TYR A 115 6.002 -3.025 -13.076 1.00 0.00 O ATOM 1764 CB TYR A 115 8.397 -2.706 -14.856 1.00 0.00 C ATOM 1765 CG TYR A 115 9.091 -2.132 -13.631 1.00 0.00 C ATOM 1766 CD1 TYR A 115 10.019 -2.839 -12.931 1.00 0.00 C ATOM 1767 CD2 TYR A 115 8.730 -0.891 -13.208 1.00 0.00 C ATOM 1768 CE1 TYR A 115 10.662 -2.263 -11.881 1.00 0.00 C ATOM 1769 CE2 TYR A 115 9.376 -0.312 -12.164 1.00 0.00 C ATOM 1770 CZ TYR A 115 10.360 -0.987 -11.518 1.00 0.00 C ATOM 1771 OH TYR A 115 11.008 -0.389 -10.467 1.00 0.00 O ATOM 0 H TYR A 115 6.297 -3.224 -16.096 1.00 0.00 H new ATOM 0 HA TYR A 115 8.239 -4.844 -14.547 1.00 0.00 H new ATOM 0 HB2 TYR A 115 9.150 -2.923 -15.614 1.00 0.00 H new ATOM 0 HB3 TYR A 115 7.737 -1.945 -15.272 1.00 0.00 H new ATOM 0 HD1 TYR A 115 10.245 -3.858 -13.210 1.00 0.00 H new ATOM 0 HD2 TYR A 115 7.928 -0.365 -13.704 1.00 0.00 H new ATOM 0 HE1 TYR A 115 11.411 -2.817 -11.336 1.00 0.00 H new ATOM 0 HE2 TYR A 115 9.107 0.685 -11.848 1.00 0.00 H new ATOM 0 HH TYR A 115 10.668 0.522 -10.349 1.00 0.00 H new ATOM 1781 N CYS A 116 7.044 -4.914 -12.400 1.00 0.00 N ATOM 1782 CA CYS A 116 6.538 -4.832 -11.015 1.00 0.00 C ATOM 1783 C CYS A 116 7.453 -5.563 -10.033 1.00 0.00 C ATOM 1784 O CYS A 116 8.641 -5.793 -10.264 1.00 0.00 O ATOM 1785 CB CYS A 116 5.124 -5.449 -10.943 1.00 0.00 C ATOM 1786 SG CYS A 116 5.166 -7.151 -11.555 1.00 0.00 S ATOM 0 H CYS A 116 7.539 -5.777 -12.626 1.00 0.00 H new ATOM 0 HA CYS A 116 6.509 -3.779 -10.734 1.00 0.00 H new ATOM 0 HB2 CYS A 116 4.761 -5.431 -9.915 1.00 0.00 H new ATOM 0 HB3 CYS A 116 4.428 -4.856 -11.537 1.00 0.00 H new ATOM 0 HG CYS A 116 4.324 -7.876 -10.880 1.00 0.00 H new ATOM 1792 N TRP A 117 6.821 -5.941 -8.919 1.00 0.00 N ATOM 1793 CA TRP A 117 7.490 -6.555 -7.768 1.00 0.00 C ATOM 1794 C TRP A 117 6.594 -7.736 -7.397 1.00 0.00 C ATOM 1795 O TRP A 117 5.369 -7.635 -7.477 1.00 0.00 O ATOM 1796 CB TRP A 117 7.499 -5.611 -6.555 1.00 0.00 C ATOM 1797 CG TRP A 117 7.865 -4.178 -6.827 1.00 0.00 C ATOM 1798 CD1 TRP A 117 8.561 -3.688 -7.917 1.00 0.00 C ATOM 1799 CD2 TRP A 117 7.616 -3.102 -6.037 1.00 0.00 C ATOM 1800 NE1 TRP A 117 8.753 -2.321 -7.841 1.00 0.00 N ATOM 1801 CE2 TRP A 117 8.168 -1.991 -6.627 1.00 0.00 C ATOM 1802 CE3 TRP A 117 7.022 -3.042 -4.821 1.00 0.00 C ATOM 1803 CZ2 TRP A 117 8.253 -0.828 -5.929 1.00 0.00 C ATOM 1804 CZ3 TRP A 117 7.015 -1.855 -4.173 1.00 0.00 C ATOM 1805 CH2 TRP A 117 7.688 -0.786 -4.682 1.00 0.00 C ATOM 0 H TRP A 117 5.816 -5.828 -8.789 1.00 0.00 H new ATOM 0 HA TRP A 117 8.520 -6.813 -8.013 1.00 0.00 H new ATOM 0 HB2 TRP A 117 6.509 -5.630 -6.099 1.00 0.00 H new ATOM 0 HB3 TRP A 117 8.197 -6.008 -5.818 1.00 0.00 H new ATOM 0 HD1 TRP A 117 8.914 -4.302 -8.733 1.00 0.00 H new ATOM 0 HE1 TRP A 117 9.212 -1.706 -8.513 1.00 0.00 H new ATOM 0 HE3 TRP A 117 6.567 -3.917 -4.381 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 8.750 0.036 -6.345 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 6.472 -1.754 -3.245 1.00 0.00 H new ATOM 0 HH2 TRP A 117 7.778 0.113 -4.090 1.00 0.00 H new ATOM 1816 N ILE A 118 7.157 -8.804 -6.857 1.00 0.00 N ATOM 1817 CA ILE A 118 6.311 -9.796 -6.178 1.00 0.00 C ATOM 1818 C ILE A 118 6.832 -9.972 -4.746 1.00 0.00 C ATOM 1819 O ILE A 118 8.032 -10.021 -4.484 1.00 0.00 O ATOM 1820 CB ILE A 118 6.167 -11.085 -7.022 1.00 0.00 C ATOM 1821 CG1 ILE A 118 5.873 -12.360 -6.216 1.00 0.00 C ATOM 1822 CG2 ILE A 118 7.359 -11.401 -7.918 1.00 0.00 C ATOM 1823 CD1 ILE A 118 4.891 -13.218 -7.002 1.00 0.00 C ATOM 0 H ILE A 118 8.156 -9.011 -6.868 1.00 0.00 H new ATOM 0 HA ILE A 118 5.280 -9.454 -6.085 1.00 0.00 H new ATOM 0 HB ILE A 118 5.302 -10.827 -7.632 1.00 0.00 H new ATOM 0 HG12 ILE A 118 6.795 -12.912 -6.033 1.00 0.00 H new ATOM 0 HG13 ILE A 118 5.456 -12.104 -5.242 1.00 0.00 H new ATOM 0 HG21 ILE A 118 7.166 -12.321 -8.470 1.00 0.00 H new ATOM 0 HG22 ILE A 118 7.513 -10.582 -8.621 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.252 -11.526 -7.305 1.00 0.00 H new ATOM 0 HD11 ILE A 118 4.673 -14.127 -6.442 1.00 0.00 H new ATOM 0 HD12 ILE A 118 3.968 -12.660 -7.163 1.00 0.00 H new ATOM 0 HD13 ILE A 118 5.328 -13.481 -7.965 1.00 0.00 H new ATOM 1835 N LYS A 119 5.884 -10.172 -3.836 1.00 0.00 N ATOM 1836 CA LYS A 119 6.224 -10.318 -2.409 1.00 0.00 C ATOM 1837 C LYS A 119 6.479 -11.791 -2.039 1.00 0.00 C ATOM 1838 O LYS A 119 5.780 -12.395 -1.223 1.00 0.00 O ATOM 1839 CB LYS A 119 5.083 -9.731 -1.572 1.00 0.00 C ATOM 1840 CG LYS A 119 5.458 -9.541 -0.098 1.00 0.00 C ATOM 1841 CD LYS A 119 4.216 -9.429 0.787 1.00 0.00 C ATOM 1842 CE LYS A 119 4.608 -9.299 2.260 1.00 0.00 C ATOM 1843 NZ LYS A 119 3.411 -9.301 3.115 1.00 0.00 N ATOM 0 H LYS A 119 4.888 -10.237 -4.047 1.00 0.00 H new ATOM 0 HA LYS A 119 7.147 -9.777 -2.202 1.00 0.00 H new ATOM 0 HB2 LYS A 119 4.788 -8.770 -1.993 1.00 0.00 H new ATOM 0 HB3 LYS A 119 4.216 -10.388 -1.639 1.00 0.00 H new ATOM 0 HG2 LYS A 119 6.068 -10.381 0.234 1.00 0.00 H new ATOM 0 HG3 LYS A 119 6.066 -8.643 0.011 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.626 -8.564 0.485 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.586 -10.308 0.650 1.00 0.00 H new ATOM 0 HE2 LYS A 119 5.264 -10.122 2.542 1.00 0.00 H new ATOM 0 HE3 LYS A 119 5.169 -8.377 2.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 3.507 -8.570 3.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 2.570 -9.102 2.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 3.308 -10.233 3.566 1.00 0.00 H new ATOM 1857 N MET A 120 7.532 -12.340 -2.627 1.00 0.00 N ATOM 1858 CA MET A 120 8.043 -13.658 -2.230 1.00 0.00 C ATOM 1859 C MET A 120 9.453 -13.475 -1.644 1.00 0.00 C ATOM 1860 O MET A 120 10.084 -12.426 -1.791 1.00 0.00 O ATOM 1861 CB MET A 120 8.010 -14.552 -3.482 1.00 0.00 C ATOM 1862 CG MET A 120 8.250 -16.036 -3.194 1.00 0.00 C ATOM 1863 SD MET A 120 7.032 -16.636 -2.010 1.00 0.00 S ATOM 1864 CE MET A 120 7.603 -18.334 -1.830 1.00 0.00 C ATOM 0 H MET A 120 8.055 -11.898 -3.383 1.00 0.00 H new ATOM 0 HA MET A 120 7.441 -14.137 -1.457 1.00 0.00 H new ATOM 0 HB2 MET A 120 7.042 -14.439 -3.971 1.00 0.00 H new ATOM 0 HB3 MET A 120 8.765 -14.202 -4.186 1.00 0.00 H new ATOM 0 HG2 MET A 120 8.185 -16.610 -4.118 1.00 0.00 H new ATOM 0 HG3 MET A 120 9.256 -16.181 -2.799 1.00 0.00 H new ATOM 0 HE1 MET A 120 6.959 -18.862 -1.126 1.00 0.00 H new ATOM 0 HE2 MET A 120 7.569 -18.834 -2.798 1.00 0.00 H new ATOM 0 HE3 MET A 120 8.627 -18.336 -1.457 1.00 0.00 H new