USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1124 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 129 ASN : amide:sc= -2.89! C(o=-6.3!,f=-23!) USER MOD Set 1.2: A 132 GLN : amide:sc= -3.43! C(o=-6.3!,f=-14!) USER MOD Set 2.1: A 65 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 108 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 36 CYS SG : rot -140:sc= 1.17 USER MOD Set 3.2: A 39 CYS SG : rot 180:sc= -0.432 USER MOD Set 4.1: A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 27 THR OG1 : rot 180:sc= 0.207 USER MOD Set 4.3: A 59 ASN : amide:sc= -2.09! C(o=-1.9!,f=-3.2!) USER MOD Single : A 1 MET CE :methyl -159:sc= -1.37 (180deg=-3.19!) USER MOD Single : A 1 MET N :NH3+ -152:sc= -0.0926 (180deg=-1.72) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=-0.064) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 80:sc= 0.0668 USER MOD Single : A 8 THR OG1 : rot 89:sc= 1.03 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 116:sc= 0.728 USER MOD Single : A 14 ASN : amide:sc= -0.184 X(o=-0.18,f=-0.032) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 173:sc= 0.678 (180deg=0.619) USER MOD Single : A 34 SER OG : rot -119:sc= 1.85 USER MOD Single : A 41 SER OG : rot -43:sc= 0.115 USER MOD Single : A 45 GLN : amide:sc=-0.00113 K(o=-0.0011,f=-0.88) USER MOD Single : A 46 THR OG1 : rot 83:sc= 1.17 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -92:sc= 0.389 USER MOD Single : A 70 HIS : no HD1:sc= -0.0291 X(o=-0.029,f=0) USER MOD Single : A 72 LYS NZ :NH3+ -148:sc= -0.215 (180deg=-1.2!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -1.32 K(o=-1.3,f=-4.8!) USER MOD Single : A 79 LYS NZ :NH3+ 168:sc= 0.299 (180deg=0.0609) USER MOD Single : A 81 TYR OH : rot 157:sc= 0.101 USER MOD Single : A 85 ASN : amide:sc= -0.185 K(o=-0.19,f=-2.4!) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 49:sc= 0.0654 USER MOD Single : A 95 ASN : amide:sc= 0.286 K(o=0.29,f=-5.2!) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -0.174 K(o=-0.17,f=-2!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.246 X(o=-0.25,f=-0.22) USER MOD Single : A 106 SER OG : rot -51:sc= 0.954 USER MOD Single : A 110 SER OG : rot 104:sc= 0.902 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 GLN : amide:sc= -0.289 K(o=-0.29,f=-1.8) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= -1.22 USER MOD Single : A 141 ASN : amide:sc= 0.93 K(o=0.93,f=-0.62) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.331 -12.873 10.636 1.00 0.00 N ATOM 2 CA MET A 1 8.181 -12.500 12.031 1.00 0.00 C ATOM 3 C MET A 1 8.280 -10.983 12.207 1.00 0.00 C ATOM 4 O MET A 1 9.364 -10.449 12.431 1.00 0.00 O ATOM 5 CB MET A 1 9.271 -13.181 12.862 1.00 0.00 C ATOM 6 CG MET A 1 8.797 -14.542 13.376 1.00 0.00 C ATOM 7 SD MET A 1 9.851 -15.835 12.739 1.00 0.00 S ATOM 8 CE MET A 1 9.247 -15.929 11.062 1.00 0.00 C ATOM 0 H1 MET A 1 7.817 -13.759 10.456 1.00 0.00 H new ATOM 0 H2 MET A 1 7.944 -12.120 10.032 1.00 0.00 H new ATOM 0 H3 MET A 1 9.339 -13.007 10.419 1.00 0.00 H new ATOM 0 HA MET A 1 7.197 -12.824 12.370 1.00 0.00 H new ATOM 0 HB2 MET A 1 10.168 -13.309 12.257 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.543 -12.544 13.704 1.00 0.00 H new ATOM 0 HG2 MET A 1 8.811 -14.554 14.466 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.766 -14.717 13.069 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.509 -16.897 10.635 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.163 -15.812 11.058 1.00 0.00 H new ATOM 0 HE3 MET A 1 9.700 -15.136 10.467 1.00 0.00 H new ATOM 18 N VAL A 2 7.131 -10.332 12.096 1.00 0.00 N ATOM 19 CA VAL A 2 7.074 -8.887 12.240 1.00 0.00 C ATOM 20 C VAL A 2 5.633 -8.465 12.538 1.00 0.00 C ATOM 21 O VAL A 2 5.022 -7.736 11.758 1.00 0.00 O ATOM 22 CB VAL A 2 7.647 -8.213 10.989 1.00 0.00 C ATOM 23 CG1 VAL A 2 9.156 -8.000 11.126 1.00 0.00 C ATOM 24 CG2 VAL A 2 7.319 -9.022 9.733 1.00 0.00 C ATOM 0 H VAL A 2 6.233 -10.778 11.908 1.00 0.00 H new ATOM 0 HA VAL A 2 7.689 -8.562 13.079 1.00 0.00 H new ATOM 0 HB VAL A 2 7.178 -7.234 10.889 1.00 0.00 H new ATOM 0 HG11 VAL A 2 9.539 -7.520 10.225 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.357 -7.365 11.989 1.00 0.00 H new ATOM 0 HG13 VAL A 2 9.649 -8.963 11.262 1.00 0.00 H new ATOM 0 HG21 VAL A 2 7.737 -8.522 8.859 1.00 0.00 H new ATOM 0 HG22 VAL A 2 7.749 -10.020 9.820 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.237 -9.101 9.623 1.00 0.00 H new ATOM 34 N PRO A 3 5.121 -8.953 13.699 1.00 0.00 N ATOM 35 CA PRO A 3 3.764 -8.634 14.111 1.00 0.00 C ATOM 36 C PRO A 3 3.672 -7.200 14.633 1.00 0.00 C ATOM 37 O PRO A 3 3.080 -6.336 13.988 1.00 0.00 O ATOM 38 CB PRO A 3 3.418 -9.674 15.165 1.00 0.00 C ATOM 39 CG PRO A 3 4.745 -10.245 15.637 1.00 0.00 C ATOM 40 CD PRO A 3 5.816 -9.819 14.647 1.00 0.00 C ATOM 0 HA PRO A 3 3.054 -8.672 13.285 1.00 0.00 H new ATOM 0 HB2 PRO A 3 2.870 -9.224 15.993 1.00 0.00 H new ATOM 0 HB3 PRO A 3 2.782 -10.455 14.749 1.00 0.00 H new ATOM 0 HG2 PRO A 3 4.983 -9.881 16.636 1.00 0.00 H new ATOM 0 HG3 PRO A 3 4.692 -11.332 15.698 1.00 0.00 H new ATOM 0 HD2 PRO A 3 6.628 -9.289 15.145 1.00 0.00 H new ATOM 0 HD3 PRO A 3 6.258 -10.681 14.146 1.00 0.00 H new ATOM 48 N HIS A 4 4.269 -6.989 15.798 1.00 0.00 N ATOM 49 CA HIS A 4 4.261 -5.674 16.416 1.00 0.00 C ATOM 50 C HIS A 4 4.702 -4.624 15.393 1.00 0.00 C ATOM 51 O HIS A 4 4.302 -3.464 15.478 1.00 0.00 O ATOM 52 CB HIS A 4 5.120 -5.663 17.682 1.00 0.00 C ATOM 53 CG HIS A 4 4.542 -6.466 18.823 1.00 0.00 C ATOM 54 ND1 HIS A 4 3.292 -6.211 19.361 1.00 0.00 N ATOM 55 CD2 HIS A 4 5.053 -7.519 19.521 1.00 0.00 C ATOM 56 CE1 HIS A 4 3.074 -7.078 20.338 1.00 0.00 C ATOM 57 NE2 HIS A 4 4.167 -7.888 20.437 1.00 0.00 N ATOM 0 H HIS A 4 4.761 -7.707 16.330 1.00 0.00 H new ATOM 0 HA HIS A 4 3.248 -5.423 16.731 1.00 0.00 H new ATOM 0 HB2 HIS A 4 6.109 -6.053 17.441 1.00 0.00 H new ATOM 0 HB3 HIS A 4 5.255 -4.632 18.008 1.00 0.00 H new ATOM 0 HD2 HIS A 4 6.017 -7.976 19.356 1.00 0.00 H new ATOM 0 HE1 HIS A 4 2.186 -7.134 20.950 1.00 0.00 H new ATOM 0 HE2 HIS A 4 4.284 -8.651 21.104 1.00 0.00 H new ATOM 66 N THR A 5 5.518 -5.071 14.449 1.00 0.00 N ATOM 67 CA THR A 5 6.017 -4.184 13.411 1.00 0.00 C ATOM 68 C THR A 5 4.874 -3.735 12.498 1.00 0.00 C ATOM 69 O THR A 5 4.641 -2.540 12.332 1.00 0.00 O ATOM 70 CB THR A 5 7.137 -4.912 12.667 1.00 0.00 C ATOM 71 OG1 THR A 5 8.182 -5.018 13.630 1.00 0.00 O ATOM 72 CG2 THR A 5 7.747 -4.061 11.550 1.00 0.00 C ATOM 0 H THR A 5 5.846 -6.035 14.381 1.00 0.00 H new ATOM 0 HA THR A 5 6.430 -3.269 13.837 1.00 0.00 H new ATOM 0 HB THR A 5 6.750 -5.841 12.247 1.00 0.00 H new ATOM 0 HG1 THR A 5 8.949 -5.480 13.231 1.00 0.00 H new ATOM 0 HG21 THR A 5 8.537 -4.624 11.054 1.00 0.00 H new ATOM 0 HG22 THR A 5 6.974 -3.804 10.825 1.00 0.00 H new ATOM 0 HG23 THR A 5 8.164 -3.148 11.975 1.00 0.00 H new ATOM 80 N LEU A 6 4.190 -4.719 11.934 1.00 0.00 N ATOM 81 CA LEU A 6 3.076 -4.442 11.042 1.00 0.00 C ATOM 82 C LEU A 6 1.893 -3.918 11.859 1.00 0.00 C ATOM 83 O LEU A 6 1.117 -3.095 11.377 1.00 0.00 O ATOM 84 CB LEU A 6 2.743 -5.674 10.198 1.00 0.00 C ATOM 85 CG LEU A 6 2.148 -6.863 10.955 1.00 0.00 C ATOM 86 CD1 LEU A 6 0.638 -6.700 11.131 1.00 0.00 C ATOM 87 CD2 LEU A 6 2.507 -8.183 10.269 1.00 0.00 C ATOM 0 H LEU A 6 4.385 -5.710 12.077 1.00 0.00 H new ATOM 0 HA LEU A 6 3.344 -3.661 10.330 1.00 0.00 H new ATOM 0 HB2 LEU A 6 2.042 -5.377 9.418 1.00 0.00 H new ATOM 0 HB3 LEU A 6 3.654 -6.005 9.699 1.00 0.00 H new ATOM 0 HG LEU A 6 2.587 -6.889 11.952 1.00 0.00 H new ATOM 0 HD11 LEU A 6 0.240 -7.558 11.672 1.00 0.00 H new ATOM 0 HD12 LEU A 6 0.434 -5.790 11.694 1.00 0.00 H new ATOM 0 HD13 LEU A 6 0.162 -6.636 10.152 1.00 0.00 H new ATOM 0 HD21 LEU A 6 2.072 -9.013 10.826 1.00 0.00 H new ATOM 0 HD22 LEU A 6 2.114 -8.183 9.252 1.00 0.00 H new ATOM 0 HD23 LEU A 6 3.591 -8.294 10.239 1.00 0.00 H new ATOM 99 N SER A 7 1.794 -4.418 13.083 1.00 0.00 N ATOM 100 CA SER A 7 0.718 -4.010 13.971 1.00 0.00 C ATOM 101 C SER A 7 0.956 -2.581 14.462 1.00 0.00 C ATOM 102 O SER A 7 0.019 -1.895 14.865 1.00 0.00 O ATOM 103 CB SER A 7 0.596 -4.965 15.162 1.00 0.00 C ATOM 104 OG SER A 7 0.146 -6.258 14.764 1.00 0.00 O ATOM 0 H SER A 7 2.440 -5.100 13.480 1.00 0.00 H new ATOM 0 HA SER A 7 -0.217 -4.044 13.412 1.00 0.00 H new ATOM 0 HB2 SER A 7 1.563 -5.054 15.656 1.00 0.00 H new ATOM 0 HB3 SER A 7 -0.098 -4.548 15.892 1.00 0.00 H new ATOM 0 HG SER A 7 0.900 -6.770 14.403 1.00 0.00 H new ATOM 110 N THR A 8 2.217 -2.175 14.412 1.00 0.00 N ATOM 111 CA THR A 8 2.590 -0.839 14.845 1.00 0.00 C ATOM 112 C THR A 8 2.094 0.206 13.843 1.00 0.00 C ATOM 113 O THR A 8 2.002 1.388 14.168 1.00 0.00 O ATOM 114 CB THR A 8 4.106 -0.815 15.048 1.00 0.00 C ATOM 115 OG1 THR A 8 4.274 -1.059 16.442 1.00 0.00 O ATOM 116 CG2 THR A 8 4.703 0.579 14.839 1.00 0.00 C ATOM 0 H THR A 8 2.992 -2.748 14.078 1.00 0.00 H new ATOM 0 HA THR A 8 2.116 -0.584 15.793 1.00 0.00 H new ATOM 0 HB THR A 8 4.575 -1.518 14.360 1.00 0.00 H new ATOM 0 HG1 THR A 8 4.328 -2.025 16.601 1.00 0.00 H new ATOM 0 HG21 THR A 8 5.781 0.540 14.995 1.00 0.00 H new ATOM 0 HG22 THR A 8 4.495 0.915 13.823 1.00 0.00 H new ATOM 0 HG23 THR A 8 4.258 1.276 15.550 1.00 0.00 H new ATOM 124 N LEU A 9 1.787 -0.269 12.645 1.00 0.00 N ATOM 125 CA LEU A 9 1.304 0.609 11.593 1.00 0.00 C ATOM 126 C LEU A 9 -0.177 0.915 11.832 1.00 0.00 C ATOM 127 O LEU A 9 -0.885 0.125 12.453 1.00 0.00 O ATOM 128 CB LEU A 9 1.592 0.005 10.216 1.00 0.00 C ATOM 129 CG LEU A 9 3.069 -0.120 9.836 1.00 0.00 C ATOM 130 CD1 LEU A 9 3.223 -0.646 8.408 1.00 0.00 C ATOM 131 CD2 LEU A 9 3.802 1.207 10.040 1.00 0.00 C ATOM 0 H LEU A 9 1.863 -1.251 12.379 1.00 0.00 H new ATOM 0 HA LEU A 9 1.836 1.560 11.616 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.141 -0.986 10.174 1.00 0.00 H new ATOM 0 HB3 LEU A 9 1.093 0.614 9.462 1.00 0.00 H new ATOM 0 HG LEU A 9 3.533 -0.849 10.501 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.282 -0.726 8.162 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.757 -1.628 8.330 1.00 0.00 H new ATOM 0 HD13 LEU A 9 2.740 0.041 7.713 1.00 0.00 H new ATOM 0 HD21 LEU A 9 4.850 1.090 9.763 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.345 1.975 9.416 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.735 1.503 11.087 1.00 0.00 H new ATOM 143 N LYS A 10 -0.599 2.065 11.328 1.00 0.00 N ATOM 144 CA LYS A 10 -1.981 2.487 11.478 1.00 0.00 C ATOM 145 C LYS A 10 -2.441 3.180 10.195 1.00 0.00 C ATOM 146 O LYS A 10 -1.624 3.719 9.450 1.00 0.00 O ATOM 147 CB LYS A 10 -2.146 3.345 12.734 1.00 0.00 C ATOM 148 CG LYS A 10 -1.760 2.559 13.990 1.00 0.00 C ATOM 149 CD LYS A 10 -2.371 3.193 15.241 1.00 0.00 C ATOM 150 CE LYS A 10 -1.662 2.703 16.506 1.00 0.00 C ATOM 151 NZ LYS A 10 -2.037 3.539 17.668 1.00 0.00 N ATOM 0 H LYS A 10 -0.007 2.718 10.815 1.00 0.00 H new ATOM 0 HA LYS A 10 -2.629 1.623 11.623 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -1.525 4.237 12.654 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -3.179 3.682 12.815 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -2.100 1.528 13.897 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -0.675 2.529 14.086 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -2.297 4.279 15.176 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -3.432 2.948 15.296 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -1.926 1.663 16.698 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -0.582 2.736 16.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -1.547 3.193 18.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -1.763 4.526 17.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -3.065 3.487 17.816 1.00 0.00 H new ATOM 164 N THR A 11 -3.747 3.144 9.975 1.00 0.00 N ATOM 165 CA THR A 11 -4.326 3.762 8.796 1.00 0.00 C ATOM 166 C THR A 11 -4.738 5.205 9.096 1.00 0.00 C ATOM 167 O THR A 11 -4.644 5.655 10.237 1.00 0.00 O ATOM 168 CB THR A 11 -5.487 2.883 8.323 1.00 0.00 C ATOM 169 OG1 THR A 11 -6.315 2.756 9.474 1.00 0.00 O ATOM 170 CG2 THR A 11 -5.049 1.451 8.015 1.00 0.00 C ATOM 0 H THR A 11 -4.421 2.695 10.595 1.00 0.00 H new ATOM 0 HA THR A 11 -3.599 3.828 7.987 1.00 0.00 H new ATOM 0 HB THR A 11 -5.937 3.322 7.433 1.00 0.00 H new ATOM 0 HG1 THR A 11 -7.183 3.178 9.301 1.00 0.00 H new ATOM 0 HG21 THR A 11 -5.910 0.870 7.684 1.00 0.00 H new ATOM 0 HG22 THR A 11 -4.295 1.462 7.228 1.00 0.00 H new ATOM 0 HG23 THR A 11 -4.629 0.998 8.913 1.00 0.00 H new ATOM 178 N ALA A 12 -5.186 5.888 8.054 1.00 0.00 N ATOM 179 CA ALA A 12 -5.613 7.270 8.192 1.00 0.00 C ATOM 180 C ALA A 12 -6.929 7.317 8.970 1.00 0.00 C ATOM 181 O ALA A 12 -7.405 8.393 9.327 1.00 0.00 O ATOM 182 CB ALA A 12 -5.732 7.909 6.807 1.00 0.00 C ATOM 0 H ALA A 12 -5.263 5.510 7.110 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.877 7.845 8.754 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -6.052 8.946 6.911 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -4.764 7.877 6.307 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -6.465 7.360 6.215 1.00 0.00 H new ATOM 188 N ASP A 13 -7.479 6.136 9.212 1.00 0.00 N ATOM 189 CA ASP A 13 -8.731 6.029 9.942 1.00 0.00 C ATOM 190 C ASP A 13 -8.446 5.559 11.370 1.00 0.00 C ATOM 191 O ASP A 13 -9.309 4.971 12.019 1.00 0.00 O ATOM 192 CB ASP A 13 -9.665 5.010 9.287 1.00 0.00 C ATOM 193 CG ASP A 13 -9.040 4.194 8.154 1.00 0.00 C ATOM 194 OD1 ASP A 13 -8.477 3.113 8.381 1.00 0.00 O ATOM 195 OD2 ASP A 13 -9.149 4.719 6.979 1.00 0.00 O ATOM 0 H ASP A 13 -7.081 5.245 8.916 1.00 0.00 H new ATOM 0 HA ASP A 13 -9.207 7.009 9.939 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -10.024 4.323 10.054 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -10.536 5.536 8.897 1.00 0.00 H new ATOM 201 N ASN A 14 -7.229 5.835 11.817 1.00 0.00 N ATOM 202 CA ASN A 14 -6.818 5.447 13.157 1.00 0.00 C ATOM 203 C ASN A 14 -7.206 3.988 13.401 1.00 0.00 C ATOM 204 O ASN A 14 -7.930 3.684 14.348 1.00 0.00 O ATOM 205 CB ASN A 14 -7.513 6.305 14.215 1.00 0.00 C ATOM 206 CG ASN A 14 -6.550 7.339 14.803 1.00 0.00 C ATOM 207 OD1 ASN A 14 -6.786 8.535 14.769 1.00 0.00 O ATOM 208 ND2 ASN A 14 -5.453 6.811 15.342 1.00 0.00 N ATOM 0 H ASN A 14 -6.515 6.322 11.276 1.00 0.00 H new ATOM 0 HA ASN A 14 -5.739 5.584 13.233 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -8.370 6.812 13.771 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -7.897 5.667 15.011 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -4.748 7.418 15.760 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -5.318 5.800 15.337 1.00 0.00 H new ATOM 215 N ARG A 15 -6.705 3.122 12.532 1.00 0.00 N ATOM 216 CA ARG A 15 -6.990 1.701 12.642 1.00 0.00 C ATOM 217 C ARG A 15 -5.703 0.888 12.490 1.00 0.00 C ATOM 218 O ARG A 15 -4.753 1.337 11.853 1.00 0.00 O ATOM 219 CB ARG A 15 -7.994 1.256 11.574 1.00 0.00 C ATOM 220 CG ARG A 15 -9.343 0.903 12.204 1.00 0.00 C ATOM 221 CD ARG A 15 -10.283 0.279 11.171 1.00 0.00 C ATOM 222 NE ARG A 15 -11.494 1.116 11.018 1.00 0.00 N ATOM 223 CZ ARG A 15 -12.543 1.093 11.867 1.00 0.00 C ATOM 224 NH1 ARG A 15 -12.538 0.272 12.940 1.00 0.00 N ATOM 225 NH2 ARG A 15 -13.573 1.883 11.634 1.00 0.00 N ATOM 0 H ARG A 15 -6.103 3.377 11.749 1.00 0.00 H new ATOM 0 HA ARG A 15 -7.421 1.525 13.627 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -8.128 2.052 10.841 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -7.601 0.392 11.038 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -9.192 0.208 13.030 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -9.800 1.800 12.621 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -9.772 0.185 10.213 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -10.563 -0.727 11.483 1.00 0.00 H new ATOM 0 HE ARG A 15 -11.539 1.750 10.221 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -11.738 -0.336 13.113 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -13.335 0.260 13.577 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -13.569 2.500 10.822 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -14.373 1.877 12.266 1.00 0.00 H new ATOM 238 N PRO A 16 -5.713 -0.324 13.108 1.00 0.00 N ATOM 239 CA PRO A 16 -4.558 -1.203 13.050 1.00 0.00 C ATOM 240 C PRO A 16 -4.442 -1.865 11.675 1.00 0.00 C ATOM 241 O PRO A 16 -5.395 -2.473 11.192 1.00 0.00 O ATOM 242 CB PRO A 16 -4.767 -2.203 14.175 1.00 0.00 C ATOM 243 CG PRO A 16 -6.246 -2.137 14.522 1.00 0.00 C ATOM 244 CD PRO A 16 -6.820 -0.887 13.875 1.00 0.00 C ATOM 0 HA PRO A 16 -3.616 -0.670 13.180 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -4.484 -3.208 13.862 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -4.152 -1.953 15.039 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -6.763 -3.026 14.161 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -6.384 -2.105 15.603 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -7.666 -1.127 13.231 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -7.180 -0.183 14.625 1.00 0.00 H new ATOM 252 N ALA A 17 -3.265 -1.724 11.083 1.00 0.00 N ATOM 253 CA ALA A 17 -3.012 -2.300 9.773 1.00 0.00 C ATOM 254 C ALA A 17 -3.225 -3.813 9.837 1.00 0.00 C ATOM 255 O ALA A 17 -3.590 -4.435 8.840 1.00 0.00 O ATOM 256 CB ALA A 17 -1.599 -1.928 9.315 1.00 0.00 C ATOM 0 H ALA A 17 -2.476 -1.219 11.486 1.00 0.00 H new ATOM 0 HA ALA A 17 -3.709 -1.900 9.036 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -1.409 -2.360 8.332 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -1.509 -0.843 9.258 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.872 -2.315 10.028 1.00 0.00 H new ATOM 262 N SER A 18 -2.987 -4.362 11.019 1.00 0.00 N ATOM 263 CA SER A 18 -3.147 -5.792 11.227 1.00 0.00 C ATOM 264 C SER A 18 -4.518 -6.244 10.717 1.00 0.00 C ATOM 265 O SER A 18 -4.714 -7.419 10.414 1.00 0.00 O ATOM 266 CB SER A 18 -2.983 -6.156 12.704 1.00 0.00 C ATOM 267 OG SER A 18 -2.967 -7.567 12.906 1.00 0.00 O ATOM 0 H SER A 18 -2.684 -3.843 11.843 1.00 0.00 H new ATOM 0 HA SER A 18 -2.369 -6.309 10.666 1.00 0.00 H new ATOM 0 HB2 SER A 18 -2.057 -5.725 13.083 1.00 0.00 H new ATOM 0 HB3 SER A 18 -3.798 -5.716 13.279 1.00 0.00 H new ATOM 0 HG SER A 18 -2.859 -7.760 13.861 1.00 0.00 H new ATOM 273 N VAL A 19 -5.430 -5.285 10.639 1.00 0.00 N ATOM 274 CA VAL A 19 -6.776 -5.569 10.171 1.00 0.00 C ATOM 275 C VAL A 19 -6.714 -6.075 8.729 1.00 0.00 C ATOM 276 O VAL A 19 -7.596 -6.807 8.286 1.00 0.00 O ATOM 277 CB VAL A 19 -7.658 -4.331 10.335 1.00 0.00 C ATOM 278 CG1 VAL A 19 -8.879 -4.402 9.414 1.00 0.00 C ATOM 279 CG2 VAL A 19 -8.082 -4.147 11.793 1.00 0.00 C ATOM 0 H VAL A 19 -5.263 -4.311 10.892 1.00 0.00 H new ATOM 0 HA VAL A 19 -7.232 -6.357 10.771 1.00 0.00 H new ATOM 0 HB VAL A 19 -7.069 -3.461 10.046 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -9.490 -3.510 9.550 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -8.549 -4.461 8.377 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -9.468 -5.286 9.659 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -8.708 -3.259 11.881 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -8.644 -5.021 12.122 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -7.196 -4.029 12.417 1.00 0.00 H new ATOM 289 N TYR A 20 -5.663 -5.660 8.034 1.00 0.00 N ATOM 290 CA TYR A 20 -5.475 -6.061 6.650 1.00 0.00 C ATOM 291 C TYR A 20 -4.364 -7.106 6.529 1.00 0.00 C ATOM 292 O TYR A 20 -3.787 -7.281 5.457 1.00 0.00 O ATOM 293 CB TYR A 20 -5.054 -4.797 5.899 1.00 0.00 C ATOM 294 CG TYR A 20 -6.228 -3.943 5.413 1.00 0.00 C ATOM 295 CD1 TYR A 20 -7.139 -4.467 4.519 1.00 0.00 C ATOM 296 CD2 TYR A 20 -6.374 -2.648 5.869 1.00 0.00 C ATOM 297 CE1 TYR A 20 -8.242 -3.664 4.060 1.00 0.00 C ATOM 298 CE2 TYR A 20 -7.479 -1.844 5.411 1.00 0.00 C ATOM 299 CZ TYR A 20 -8.357 -2.392 4.530 1.00 0.00 C ATOM 300 OH TYR A 20 -9.400 -1.633 4.096 1.00 0.00 O ATOM 0 H TYR A 20 -4.934 -5.050 8.404 1.00 0.00 H new ATOM 0 HA TYR A 20 -6.389 -6.500 6.250 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -4.423 -4.192 6.551 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -4.445 -5.082 5.041 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -7.024 -5.480 4.163 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -5.661 -2.238 6.568 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -8.961 -4.062 3.359 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -7.606 -0.830 5.760 1.00 0.00 H new ATOM 0 HH TYR A 20 -9.357 -0.748 4.515 1.00 0.00 H new ATOM 310 N LEU A 21 -4.098 -7.773 7.642 1.00 0.00 N ATOM 311 CA LEU A 21 -3.067 -8.795 7.674 1.00 0.00 C ATOM 312 C LEU A 21 -3.574 -10.001 8.469 1.00 0.00 C ATOM 313 O LEU A 21 -3.580 -9.980 9.698 1.00 0.00 O ATOM 314 CB LEU A 21 -1.755 -8.217 8.204 1.00 0.00 C ATOM 315 CG LEU A 21 -0.875 -7.496 7.180 1.00 0.00 C ATOM 316 CD1 LEU A 21 -0.439 -6.125 7.700 1.00 0.00 C ATOM 317 CD2 LEU A 21 0.320 -8.362 6.777 1.00 0.00 C ATOM 0 H LEU A 21 -4.579 -7.625 8.529 1.00 0.00 H new ATOM 0 HA LEU A 21 -2.849 -9.146 6.666 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -1.988 -7.519 9.008 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -1.175 -9.029 8.644 1.00 0.00 H new ATOM 0 HG LEU A 21 -1.467 -7.326 6.281 1.00 0.00 H new ATOM 0 HD11 LEU A 21 0.185 -5.634 6.953 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -1.320 -5.513 7.896 1.00 0.00 H new ATOM 0 HD13 LEU A 21 0.129 -6.249 8.622 1.00 0.00 H new ATOM 0 HD21 LEU A 21 0.929 -7.826 6.049 1.00 0.00 H new ATOM 0 HD22 LEU A 21 0.921 -8.585 7.658 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -0.037 -9.293 6.336 1.00 0.00 H new ATOM 329 N LYS A 22 -3.987 -11.023 7.732 1.00 0.00 N ATOM 330 CA LYS A 22 -4.494 -12.234 8.353 1.00 0.00 C ATOM 331 C LYS A 22 -5.027 -13.173 7.269 1.00 0.00 C ATOM 332 O LYS A 22 -4.745 -12.985 6.086 1.00 0.00 O ATOM 333 CB LYS A 22 -5.526 -11.894 9.431 1.00 0.00 C ATOM 334 CG LYS A 22 -4.962 -12.156 10.830 1.00 0.00 C ATOM 335 CD LYS A 22 -5.527 -13.452 11.413 1.00 0.00 C ATOM 336 CE LYS A 22 -5.870 -13.283 12.896 1.00 0.00 C ATOM 337 NZ LYS A 22 -6.692 -14.418 13.370 1.00 0.00 N ATOM 0 H LYS A 22 -3.981 -11.036 6.712 1.00 0.00 H new ATOM 0 HA LYS A 22 -3.691 -12.761 8.868 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -5.819 -10.848 9.343 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -6.426 -12.490 9.280 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -3.875 -12.218 10.782 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -5.205 -11.321 11.487 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -6.420 -13.745 10.861 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -4.801 -14.256 11.293 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -4.953 -13.220 13.483 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -6.409 -12.348 13.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -6.916 -14.288 14.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -7.575 -14.460 12.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -6.164 -15.305 13.245 1.00 0.00 H new ATOM 350 N LYS A 23 -5.788 -14.165 7.710 1.00 0.00 N ATOM 351 CA LYS A 23 -6.363 -15.132 6.791 1.00 0.00 C ATOM 352 C LYS A 23 -5.237 -15.867 6.061 1.00 0.00 C ATOM 353 O LYS A 23 -5.443 -16.400 4.972 1.00 0.00 O ATOM 354 CB LYS A 23 -7.364 -14.453 5.854 1.00 0.00 C ATOM 355 CG LYS A 23 -8.802 -14.809 6.236 1.00 0.00 C ATOM 356 CD LYS A 23 -9.698 -14.877 4.998 1.00 0.00 C ATOM 357 CE LYS A 23 -10.989 -14.083 5.212 1.00 0.00 C ATOM 358 NZ LYS A 23 -12.162 -14.876 4.783 1.00 0.00 N ATOM 0 H LYS A 23 -6.019 -14.319 8.691 1.00 0.00 H new ATOM 0 HA LYS A 23 -6.933 -15.884 7.337 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -7.230 -13.372 5.895 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.171 -14.759 4.826 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -8.818 -15.768 6.754 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -9.192 -14.065 6.931 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -9.162 -14.482 4.135 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -9.939 -15.917 4.775 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -11.088 -13.816 6.264 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -10.947 -13.151 4.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -13.029 -14.323 4.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -12.073 -15.110 3.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -12.210 -15.754 5.339 1.00 0.00 H new ATOM 371 N ASP A 24 -4.071 -15.871 6.690 1.00 0.00 N ATOM 372 CA ASP A 24 -2.912 -16.532 6.113 1.00 0.00 C ATOM 373 C ASP A 24 -2.886 -16.281 4.605 1.00 0.00 C ATOM 374 O ASP A 24 -2.546 -17.174 3.829 1.00 0.00 O ATOM 375 CB ASP A 24 -2.970 -18.043 6.340 1.00 0.00 C ATOM 376 CG ASP A 24 -2.467 -18.511 7.709 1.00 0.00 C ATOM 377 OD1 ASP A 24 -1.258 -18.501 7.983 1.00 0.00 O ATOM 378 OD2 ASP A 24 -3.388 -18.905 8.523 1.00 0.00 O ATOM 0 H ASP A 24 -3.904 -15.427 7.593 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.020 -16.130 6.594 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -4.001 -18.375 6.215 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -2.381 -18.535 5.566 1.00 0.00 H new ATOM 384 N LYS A 25 -3.251 -15.063 4.232 1.00 0.00 N ATOM 385 CA LYS A 25 -3.274 -14.685 2.830 1.00 0.00 C ATOM 386 C LYS A 25 -2.136 -13.699 2.554 1.00 0.00 C ATOM 387 O LYS A 25 -1.602 -13.086 3.477 1.00 0.00 O ATOM 388 CB LYS A 25 -4.654 -14.153 2.440 1.00 0.00 C ATOM 389 CG LYS A 25 -4.823 -12.695 2.874 1.00 0.00 C ATOM 390 CD LYS A 25 -5.963 -12.022 2.105 1.00 0.00 C ATOM 391 CE LYS A 25 -7.309 -12.658 2.453 1.00 0.00 C ATOM 392 NZ LYS A 25 -8.107 -11.749 3.306 1.00 0.00 N ATOM 0 H LYS A 25 -3.533 -14.325 4.877 1.00 0.00 H new ATOM 0 HA LYS A 25 -3.104 -15.557 2.198 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -4.787 -14.233 1.361 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -5.428 -14.766 2.902 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -5.026 -12.652 3.944 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -3.894 -12.151 2.704 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -5.987 -10.958 2.341 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -5.783 -12.106 1.033 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -7.858 -12.884 1.539 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -7.148 -13.604 2.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.018 -12.196 3.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -7.588 -11.554 4.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -8.276 -10.857 2.799 1.00 0.00 H new ATOM 405 N PRO A 26 -1.788 -13.575 1.245 1.00 0.00 N ATOM 406 CA PRO A 26 -0.723 -12.675 0.835 1.00 0.00 C ATOM 407 C PRO A 26 -1.187 -11.219 0.886 1.00 0.00 C ATOM 408 O PRO A 26 -2.352 -10.924 0.627 1.00 0.00 O ATOM 409 CB PRO A 26 -0.342 -13.129 -0.564 1.00 0.00 C ATOM 410 CG PRO A 26 -1.513 -13.959 -1.067 1.00 0.00 C ATOM 411 CD PRO A 26 -2.397 -14.285 0.124 1.00 0.00 C ATOM 0 HA PRO A 26 0.140 -12.713 1.500 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.160 -12.275 -1.216 1.00 0.00 H new ATOM 0 HB3 PRO A 26 0.575 -13.718 -0.547 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -2.076 -13.408 -1.821 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -1.157 -14.874 -1.540 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -3.423 -13.956 -0.043 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -2.433 -15.359 0.308 1.00 0.00 H new ATOM 419 N THR A 27 -0.250 -10.344 1.222 1.00 0.00 N ATOM 420 CA THR A 27 -0.547 -8.925 1.310 1.00 0.00 C ATOM 421 C THR A 27 0.292 -8.140 0.299 1.00 0.00 C ATOM 422 O THR A 27 1.457 -8.461 0.072 1.00 0.00 O ATOM 423 CB THR A 27 -0.324 -8.483 2.759 1.00 0.00 C ATOM 424 OG1 THR A 27 -1.261 -9.255 3.505 1.00 0.00 O ATOM 425 CG2 THR A 27 -0.756 -7.037 3.003 1.00 0.00 C ATOM 0 H THR A 27 0.716 -10.591 1.437 1.00 0.00 H new ATOM 0 HA THR A 27 -1.586 -8.722 1.050 1.00 0.00 H new ATOM 0 HB THR A 27 0.730 -8.595 3.014 1.00 0.00 H new ATOM 0 HG1 THR A 27 -1.184 -9.033 4.456 1.00 0.00 H new ATOM 0 HG21 THR A 27 -0.577 -6.775 4.046 1.00 0.00 H new ATOM 0 HG22 THR A 27 -0.182 -6.372 2.358 1.00 0.00 H new ATOM 0 HG23 THR A 27 -1.818 -6.932 2.780 1.00 0.00 H new ATOM 433 N LEU A 28 -0.333 -7.125 -0.278 1.00 0.00 N ATOM 434 CA LEU A 28 0.342 -6.292 -1.259 1.00 0.00 C ATOM 435 C LEU A 28 0.288 -4.831 -0.806 1.00 0.00 C ATOM 436 O LEU A 28 -0.792 -4.293 -0.563 1.00 0.00 O ATOM 437 CB LEU A 28 -0.244 -6.524 -2.654 1.00 0.00 C ATOM 438 CG LEU A 28 0.630 -6.087 -3.830 1.00 0.00 C ATOM 439 CD1 LEU A 28 1.848 -7.001 -3.978 1.00 0.00 C ATOM 440 CD2 LEU A 28 -0.188 -6.006 -5.121 1.00 0.00 C ATOM 0 H LEU A 28 -1.299 -6.860 -0.085 1.00 0.00 H new ATOM 0 HA LEU A 28 1.395 -6.566 -1.330 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -0.460 -7.587 -2.763 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.196 -5.997 -2.719 1.00 0.00 H new ATOM 0 HG LEU A 28 1.004 -5.084 -3.623 1.00 0.00 H new ATOM 0 HD11 LEU A 28 2.452 -6.668 -4.822 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.445 -6.963 -3.067 1.00 0.00 H new ATOM 0 HD13 LEU A 28 1.516 -8.025 -4.151 1.00 0.00 H new ATOM 0 HD21 LEU A 28 0.457 -5.693 -5.942 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.611 -6.985 -5.345 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.993 -5.282 -4.997 1.00 0.00 H new ATOM 452 N ILE A 29 1.465 -4.233 -0.704 1.00 0.00 N ATOM 453 CA ILE A 29 1.565 -2.846 -0.283 1.00 0.00 C ATOM 454 C ILE A 29 1.993 -1.986 -1.475 1.00 0.00 C ATOM 455 O ILE A 29 2.730 -2.447 -2.344 1.00 0.00 O ATOM 456 CB ILE A 29 2.488 -2.719 0.931 1.00 0.00 C ATOM 457 CG1 ILE A 29 2.087 -3.705 2.029 1.00 0.00 C ATOM 458 CG2 ILE A 29 2.528 -1.277 1.441 1.00 0.00 C ATOM 459 CD1 ILE A 29 3.289 -4.537 2.485 1.00 0.00 C ATOM 0 H ILE A 29 2.358 -4.683 -0.906 1.00 0.00 H new ATOM 0 HA ILE A 29 0.594 -2.476 0.045 1.00 0.00 H new ATOM 0 HB ILE A 29 3.500 -2.978 0.620 1.00 0.00 H new ATOM 0 HG12 ILE A 29 1.674 -3.161 2.878 1.00 0.00 H new ATOM 0 HG13 ILE A 29 1.302 -4.365 1.661 1.00 0.00 H new ATOM 0 HG21 ILE A 29 3.191 -1.215 2.304 1.00 0.00 H new ATOM 0 HG22 ILE A 29 2.897 -0.622 0.652 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.525 -0.966 1.731 1.00 0.00 H new ATOM 0 HD11 ILE A 29 2.977 -5.230 3.266 1.00 0.00 H new ATOM 0 HD12 ILE A 29 3.685 -5.099 1.639 1.00 0.00 H new ATOM 0 HD13 ILE A 29 4.062 -3.875 2.875 1.00 0.00 H new ATOM 471 N LYS A 30 1.513 -0.751 -1.474 1.00 0.00 N ATOM 472 CA LYS A 30 1.837 0.178 -2.544 1.00 0.00 C ATOM 473 C LYS A 30 2.100 1.563 -1.949 1.00 0.00 C ATOM 474 O LYS A 30 1.192 2.192 -1.408 1.00 0.00 O ATOM 475 CB LYS A 30 0.742 0.166 -3.614 1.00 0.00 C ATOM 476 CG LYS A 30 0.855 1.388 -4.528 1.00 0.00 C ATOM 477 CD LYS A 30 -0.331 2.332 -4.328 1.00 0.00 C ATOM 478 CE LYS A 30 -0.336 3.438 -5.387 1.00 0.00 C ATOM 479 NZ LYS A 30 -0.779 2.902 -6.694 1.00 0.00 N ATOM 0 H LYS A 30 0.903 -0.372 -0.750 1.00 0.00 H new ATOM 0 HA LYS A 30 2.751 -0.130 -3.052 1.00 0.00 H new ATOM 0 HB2 LYS A 30 0.819 -0.745 -4.208 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -0.238 0.154 -3.137 1.00 0.00 H new ATOM 0 HG2 LYS A 30 1.785 1.917 -4.320 1.00 0.00 H new ATOM 0 HG3 LYS A 30 0.897 1.066 -5.569 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -1.262 1.768 -4.381 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -0.284 2.776 -3.334 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -0.998 4.245 -5.075 1.00 0.00 H new ATOM 0 HE3 LYS A 30 0.663 3.864 -5.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -0.891 3.684 -7.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -0.069 2.232 -7.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -1.689 2.412 -6.578 1.00 0.00 H new ATOM 492 N PHE A 31 3.345 1.997 -2.070 1.00 0.00 N ATOM 493 CA PHE A 31 3.741 3.295 -1.552 1.00 0.00 C ATOM 494 C PHE A 31 3.408 4.407 -2.547 1.00 0.00 C ATOM 495 O PHE A 31 3.546 4.225 -3.756 1.00 0.00 O ATOM 496 CB PHE A 31 5.254 3.252 -1.340 1.00 0.00 C ATOM 497 CG PHE A 31 5.731 2.072 -0.488 1.00 0.00 C ATOM 498 CD1 PHE A 31 5.974 0.868 -1.070 1.00 0.00 C ATOM 499 CD2 PHE A 31 5.910 2.231 0.851 1.00 0.00 C ATOM 500 CE1 PHE A 31 6.417 -0.226 -0.278 1.00 0.00 C ATOM 501 CE2 PHE A 31 6.352 1.137 1.642 1.00 0.00 C ATOM 502 CZ PHE A 31 6.596 -0.067 1.060 1.00 0.00 C ATOM 0 H PHE A 31 4.094 1.472 -2.520 1.00 0.00 H new ATOM 0 HA PHE A 31 3.208 3.503 -0.624 1.00 0.00 H new ATOM 0 HB2 PHE A 31 5.745 3.207 -2.312 1.00 0.00 H new ATOM 0 HB3 PHE A 31 5.570 4.181 -0.865 1.00 0.00 H new ATOM 0 HD1 PHE A 31 5.831 0.743 -2.133 1.00 0.00 H new ATOM 0 HD2 PHE A 31 5.716 3.188 1.312 1.00 0.00 H new ATOM 0 HE1 PHE A 31 6.611 -1.183 -0.739 1.00 0.00 H new ATOM 0 HE2 PHE A 31 6.494 1.262 2.705 1.00 0.00 H new ATOM 0 HZ PHE A 31 6.933 -0.898 1.662 1.00 0.00 H new ATOM 512 N TRP A 32 2.976 5.536 -2.003 1.00 0.00 N ATOM 513 CA TRP A 32 2.623 6.678 -2.829 1.00 0.00 C ATOM 514 C TRP A 32 2.599 7.918 -1.935 1.00 0.00 C ATOM 515 O TRP A 32 2.317 7.823 -0.742 1.00 0.00 O ATOM 516 CB TRP A 32 1.299 6.439 -3.557 1.00 0.00 C ATOM 517 CG TRP A 32 0.101 6.251 -2.624 1.00 0.00 C ATOM 518 CD1 TRP A 32 0.110 6.064 -1.297 1.00 0.00 C ATOM 519 CD2 TRP A 32 -1.292 6.238 -3.004 1.00 0.00 C ATOM 520 NE1 TRP A 32 -1.169 5.934 -0.796 1.00 0.00 N ATOM 521 CE2 TRP A 32 -2.049 6.043 -1.867 1.00 0.00 C ATOM 522 CE3 TRP A 32 -1.891 6.388 -4.266 1.00 0.00 C ATOM 523 CZ2 TRP A 32 -3.447 5.978 -1.878 1.00 0.00 C ATOM 524 CZ3 TRP A 32 -3.289 6.321 -4.261 1.00 0.00 C ATOM 525 CH2 TRP A 32 -4.066 6.124 -3.124 1.00 0.00 C ATOM 0 H TRP A 32 2.863 5.684 -1.000 1.00 0.00 H new ATOM 0 HA TRP A 32 3.363 6.830 -3.615 1.00 0.00 H new ATOM 0 HB2 TRP A 32 1.102 7.283 -4.218 1.00 0.00 H new ATOM 0 HB3 TRP A 32 1.397 5.556 -4.188 1.00 0.00 H new ATOM 0 HD1 TRP A 32 1.006 6.021 -0.695 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -1.422 5.785 0.181 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -1.318 6.543 -5.168 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -4.017 5.824 -0.974 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -3.800 6.430 -5.206 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -5.142 6.084 -3.203 1.00 0.00 H new ATOM 536 N ALA A 33 2.899 9.055 -2.546 1.00 0.00 N ATOM 537 CA ALA A 33 2.916 10.314 -1.820 1.00 0.00 C ATOM 538 C ALA A 33 1.682 11.135 -2.203 1.00 0.00 C ATOM 539 O ALA A 33 1.109 10.937 -3.273 1.00 0.00 O ATOM 540 CB ALA A 33 4.223 11.054 -2.111 1.00 0.00 C ATOM 0 H ALA A 33 3.132 9.131 -3.536 1.00 0.00 H new ATOM 0 HA ALA A 33 2.874 10.138 -0.745 1.00 0.00 H new ATOM 0 HB1 ALA A 33 4.236 11.998 -1.566 1.00 0.00 H new ATOM 0 HB2 ALA A 33 5.067 10.441 -1.794 1.00 0.00 H new ATOM 0 HB3 ALA A 33 4.299 11.251 -3.180 1.00 0.00 H new ATOM 546 N SER A 34 1.311 12.039 -1.308 1.00 0.00 N ATOM 547 CA SER A 34 0.157 12.890 -1.539 1.00 0.00 C ATOM 548 C SER A 34 0.509 13.989 -2.543 1.00 0.00 C ATOM 549 O SER A 34 -0.341 14.422 -3.318 1.00 0.00 O ATOM 550 CB SER A 34 -0.343 13.506 -0.231 1.00 0.00 C ATOM 551 OG SER A 34 -1.756 13.694 -0.235 1.00 0.00 O ATOM 0 H SER A 34 1.789 12.200 -0.422 1.00 0.00 H new ATOM 0 HA SER A 34 -0.644 12.276 -1.950 1.00 0.00 H new ATOM 0 HB2 SER A 34 -0.065 12.861 0.603 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.150 14.465 -0.070 1.00 0.00 H new ATOM 0 HG SER A 34 -1.960 14.647 -0.131 1.00 0.00 H new ATOM 557 N TRP A 35 1.766 14.409 -2.494 1.00 0.00 N ATOM 558 CA TRP A 35 2.241 15.450 -3.390 1.00 0.00 C ATOM 559 C TRP A 35 2.280 14.872 -4.807 1.00 0.00 C ATOM 560 O TRP A 35 2.406 15.615 -5.780 1.00 0.00 O ATOM 561 CB TRP A 35 3.595 15.993 -2.930 1.00 0.00 C ATOM 562 CG TRP A 35 4.663 14.916 -2.729 1.00 0.00 C ATOM 563 CD1 TRP A 35 5.134 14.426 -1.574 1.00 0.00 C ATOM 564 CD2 TRP A 35 5.378 14.211 -3.765 1.00 0.00 C ATOM 565 NE1 TRP A 35 6.097 13.460 -1.789 1.00 0.00 N ATOM 566 CE2 TRP A 35 6.248 13.326 -3.164 1.00 0.00 C ATOM 567 CE3 TRP A 35 5.292 14.318 -5.164 1.00 0.00 C ATOM 568 CZ2 TRP A 35 7.101 12.479 -3.885 1.00 0.00 C ATOM 569 CZ3 TRP A 35 6.149 13.465 -5.871 1.00 0.00 C ATOM 570 CH2 TRP A 35 7.031 12.569 -5.281 1.00 0.00 C ATOM 0 H TRP A 35 2.468 14.048 -1.849 1.00 0.00 H new ATOM 0 HA TRP A 35 1.565 16.305 -3.380 1.00 0.00 H new ATOM 0 HB2 TRP A 35 3.954 16.713 -3.665 1.00 0.00 H new ATOM 0 HB3 TRP A 35 3.459 16.534 -1.994 1.00 0.00 H new ATOM 0 HD1 TRP A 35 4.802 14.746 -0.598 1.00 0.00 H new ATOM 0 HE1 TRP A 35 6.604 12.941 -1.072 1.00 0.00 H new ATOM 0 HE3 TRP A 35 4.618 15.004 -5.655 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 7.775 11.795 -3.391 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 6.122 13.507 -6.950 1.00 0.00 H new ATOM 0 HH2 TRP A 35 7.661 11.944 -5.897 1.00 0.00 H new ATOM 581 N CYS A 36 2.169 13.554 -4.878 1.00 0.00 N ATOM 582 CA CYS A 36 2.190 12.869 -6.160 1.00 0.00 C ATOM 583 C CYS A 36 0.787 12.943 -6.766 1.00 0.00 C ATOM 584 O CYS A 36 -0.177 12.470 -6.167 1.00 0.00 O ATOM 585 CB CYS A 36 2.677 11.426 -6.022 1.00 0.00 C ATOM 586 SG CYS A 36 2.857 10.664 -7.676 1.00 0.00 S ATOM 0 H CYS A 36 2.064 12.942 -4.069 1.00 0.00 H new ATOM 0 HA CYS A 36 2.899 13.360 -6.827 1.00 0.00 H new ATOM 0 HB2 CYS A 36 3.632 11.405 -5.497 1.00 0.00 H new ATOM 0 HB3 CYS A 36 1.971 10.851 -5.423 1.00 0.00 H new ATOM 0 HG CYS A 36 2.446 9.432 -7.633 1.00 0.00 H new ATOM 592 N PRO A 37 0.717 13.556 -7.979 1.00 0.00 N ATOM 593 CA PRO A 37 -0.551 13.696 -8.673 1.00 0.00 C ATOM 594 C PRO A 37 -0.995 12.364 -9.281 1.00 0.00 C ATOM 595 O PRO A 37 -2.107 11.902 -9.029 1.00 0.00 O ATOM 596 CB PRO A 37 -0.310 14.774 -9.718 1.00 0.00 C ATOM 597 CG PRO A 37 1.199 14.866 -9.880 1.00 0.00 C ATOM 598 CD PRO A 37 1.839 14.125 -8.717 1.00 0.00 C ATOM 0 HA PRO A 37 -1.366 13.979 -8.006 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -0.789 14.517 -10.662 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -0.728 15.729 -9.398 1.00 0.00 H new ATOM 0 HG2 PRO A 37 1.508 14.427 -10.829 1.00 0.00 H new ATOM 0 HG3 PRO A 37 1.519 15.908 -9.891 1.00 0.00 H new ATOM 0 HD2 PRO A 37 2.517 13.347 -9.068 1.00 0.00 H new ATOM 0 HD3 PRO A 37 2.424 14.799 -8.091 1.00 0.00 H new ATOM 606 N LEU A 38 -0.103 11.784 -10.070 1.00 0.00 N ATOM 607 CA LEU A 38 -0.389 10.513 -10.715 1.00 0.00 C ATOM 608 C LEU A 38 -0.954 9.537 -9.683 1.00 0.00 C ATOM 609 O LEU A 38 -1.788 8.694 -10.012 1.00 0.00 O ATOM 610 CB LEU A 38 0.852 9.990 -11.441 1.00 0.00 C ATOM 611 CG LEU A 38 0.673 8.686 -12.222 1.00 0.00 C ATOM 612 CD1 LEU A 38 1.348 8.771 -13.593 1.00 0.00 C ATOM 613 CD2 LEU A 38 1.171 7.489 -11.409 1.00 0.00 C ATOM 0 H LEU A 38 0.818 12.170 -10.278 1.00 0.00 H new ATOM 0 HA LEU A 38 -1.151 10.640 -11.484 1.00 0.00 H new ATOM 0 HB2 LEU A 38 1.196 10.760 -12.132 1.00 0.00 H new ATOM 0 HB3 LEU A 38 1.644 9.844 -10.706 1.00 0.00 H new ATOM 0 HG LEU A 38 -0.392 8.535 -12.398 1.00 0.00 H new ATOM 0 HD11 LEU A 38 1.206 7.832 -14.127 1.00 0.00 H new ATOM 0 HD12 LEU A 38 0.905 9.585 -14.167 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.414 8.957 -13.463 1.00 0.00 H new ATOM 0 HD21 LEU A 38 1.033 6.575 -11.986 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.229 7.618 -11.182 1.00 0.00 H new ATOM 0 HD23 LEU A 38 0.606 7.420 -10.479 1.00 0.00 H new ATOM 625 N CYS A 39 -0.479 9.684 -8.455 1.00 0.00 N ATOM 626 CA CYS A 39 -0.926 8.825 -7.371 1.00 0.00 C ATOM 627 C CYS A 39 -2.293 9.323 -6.897 1.00 0.00 C ATOM 628 O CYS A 39 -3.199 8.526 -6.656 1.00 0.00 O ATOM 629 CB CYS A 39 0.091 8.777 -6.229 1.00 0.00 C ATOM 630 SG CYS A 39 1.589 7.870 -6.764 1.00 0.00 S ATOM 0 H CYS A 39 0.211 10.385 -8.186 1.00 0.00 H new ATOM 0 HA CYS A 39 -1.017 7.800 -7.730 1.00 0.00 H new ATOM 0 HB2 CYS A 39 0.358 9.789 -5.925 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -0.349 8.289 -5.359 1.00 0.00 H new ATOM 0 HG CYS A 39 2.448 7.837 -5.788 1.00 0.00 H new ATOM 636 N LEU A 40 -2.399 10.638 -6.776 1.00 0.00 N ATOM 637 CA LEU A 40 -3.640 11.251 -6.336 1.00 0.00 C ATOM 638 C LEU A 40 -4.793 10.736 -7.198 1.00 0.00 C ATOM 639 O LEU A 40 -5.771 10.201 -6.678 1.00 0.00 O ATOM 640 CB LEU A 40 -3.510 12.776 -6.327 1.00 0.00 C ATOM 641 CG LEU A 40 -2.913 13.393 -5.060 1.00 0.00 C ATOM 642 CD1 LEU A 40 -2.661 14.889 -5.245 1.00 0.00 C ATOM 643 CD2 LEU A 40 -3.797 13.106 -3.843 1.00 0.00 C ATOM 0 H LEU A 40 -1.645 11.296 -6.975 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.861 10.967 -5.307 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -2.894 13.073 -7.176 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -4.499 13.206 -6.485 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.946 12.925 -4.874 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -2.237 15.302 -4.330 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.964 15.041 -6.069 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.602 15.392 -5.468 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.351 13.555 -2.955 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.788 13.530 -4.005 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.882 12.029 -3.701 1.00 0.00 H new ATOM 655 N SER A 41 -4.641 10.920 -8.502 1.00 0.00 N ATOM 656 CA SER A 41 -5.658 10.481 -9.443 1.00 0.00 C ATOM 657 C SER A 41 -5.899 8.977 -9.289 1.00 0.00 C ATOM 658 O SER A 41 -6.967 8.476 -9.635 1.00 0.00 O ATOM 659 CB SER A 41 -5.258 10.811 -10.881 1.00 0.00 C ATOM 660 OG SER A 41 -4.316 9.877 -11.400 1.00 0.00 O ATOM 0 H SER A 41 -3.829 11.367 -8.929 1.00 0.00 H new ATOM 0 HA SER A 41 -6.582 11.015 -9.222 1.00 0.00 H new ATOM 0 HB2 SER A 41 -6.147 10.818 -11.512 1.00 0.00 H new ATOM 0 HB3 SER A 41 -4.832 11.814 -10.918 1.00 0.00 H new ATOM 0 HG SER A 41 -3.637 9.686 -10.720 1.00 0.00 H new ATOM 666 N GLU A 42 -4.885 8.298 -8.771 1.00 0.00 N ATOM 667 CA GLU A 42 -4.972 6.861 -8.568 1.00 0.00 C ATOM 668 C GLU A 42 -5.827 6.549 -7.337 1.00 0.00 C ATOM 669 O GLU A 42 -6.221 5.405 -7.125 1.00 0.00 O ATOM 670 CB GLU A 42 -3.579 6.240 -8.442 1.00 0.00 C ATOM 671 CG GLU A 42 -3.211 5.456 -9.703 1.00 0.00 C ATOM 672 CD GLU A 42 -2.501 4.149 -9.348 1.00 0.00 C ATOM 673 OE1 GLU A 42 -3.155 3.103 -9.230 1.00 0.00 O ATOM 674 OE2 GLU A 42 -1.225 4.245 -9.194 1.00 0.00 O ATOM 0 H GLU A 42 -3.999 8.716 -8.486 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.453 6.418 -9.440 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -2.842 7.024 -8.269 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -3.549 5.578 -7.577 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -4.112 5.240 -10.277 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -2.566 6.063 -10.338 1.00 0.00 H new ATOM 682 N LEU A 43 -6.084 7.589 -6.557 1.00 0.00 N ATOM 683 CA LEU A 43 -6.883 7.441 -5.352 1.00 0.00 C ATOM 684 C LEU A 43 -8.131 6.615 -5.673 1.00 0.00 C ATOM 685 O LEU A 43 -8.451 5.665 -4.960 1.00 0.00 O ATOM 686 CB LEU A 43 -7.192 8.809 -4.742 1.00 0.00 C ATOM 687 CG LEU A 43 -6.067 9.445 -3.921 1.00 0.00 C ATOM 688 CD1 LEU A 43 -6.298 10.949 -3.748 1.00 0.00 C ATOM 689 CD2 LEU A 43 -5.896 8.733 -2.579 1.00 0.00 C ATOM 0 H LEU A 43 -5.753 8.537 -6.736 1.00 0.00 H new ATOM 0 HA LEU A 43 -6.326 6.897 -4.589 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -7.458 9.493 -5.548 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -8.070 8.711 -4.104 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.133 9.323 -4.470 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -5.485 11.377 -3.161 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -6.330 11.427 -4.727 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -7.244 11.115 -3.232 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -5.091 9.205 -2.017 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -6.824 8.801 -2.011 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -5.652 7.685 -2.752 1.00 0.00 H new ATOM 701 N GLY A 44 -8.803 7.009 -6.745 1.00 0.00 N ATOM 702 CA GLY A 44 -10.010 6.318 -7.168 1.00 0.00 C ATOM 703 C GLY A 44 -9.669 5.009 -7.882 1.00 0.00 C ATOM 704 O GLY A 44 -10.309 3.985 -7.647 1.00 0.00 O ATOM 0 H GLY A 44 -8.535 7.798 -7.333 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -10.638 6.111 -6.301 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -10.587 6.960 -7.834 1.00 0.00 H new ATOM 708 N GLN A 45 -8.661 5.084 -8.738 1.00 0.00 N ATOM 709 CA GLN A 45 -8.229 3.918 -9.488 1.00 0.00 C ATOM 710 C GLN A 45 -7.860 2.780 -8.534 1.00 0.00 C ATOM 711 O GLN A 45 -8.100 1.611 -8.833 1.00 0.00 O ATOM 712 CB GLN A 45 -7.057 4.262 -10.410 1.00 0.00 C ATOM 713 CG GLN A 45 -6.678 3.066 -11.286 1.00 0.00 C ATOM 714 CD GLN A 45 -6.128 3.529 -12.636 1.00 0.00 C ATOM 715 OE1 GLN A 45 -5.144 4.246 -12.723 1.00 0.00 O ATOM 716 NE2 GLN A 45 -6.814 3.082 -13.684 1.00 0.00 N ATOM 0 H GLN A 45 -8.131 5.934 -8.929 1.00 0.00 H new ATOM 0 HA GLN A 45 -9.057 3.587 -10.115 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -7.323 5.110 -11.041 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -6.197 4.567 -9.813 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -5.932 2.458 -10.774 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -7.552 2.434 -11.443 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -7.629 2.485 -13.543 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -6.525 3.336 -14.629 1.00 0.00 H new ATOM 725 N THR A 46 -7.282 3.162 -7.404 1.00 0.00 N ATOM 726 CA THR A 46 -6.878 2.189 -6.405 1.00 0.00 C ATOM 727 C THR A 46 -8.102 1.640 -5.668 1.00 0.00 C ATOM 728 O THR A 46 -8.181 0.446 -5.390 1.00 0.00 O ATOM 729 CB THR A 46 -5.861 2.857 -5.478 1.00 0.00 C ATOM 730 OG1 THR A 46 -4.802 3.248 -6.349 1.00 0.00 O ATOM 731 CG2 THR A 46 -5.205 1.865 -4.515 1.00 0.00 C ATOM 0 H THR A 46 -7.084 4.132 -7.159 1.00 0.00 H new ATOM 0 HA THR A 46 -6.401 1.325 -6.867 1.00 0.00 H new ATOM 0 HB THR A 46 -6.353 3.645 -4.907 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.028 4.100 -6.777 1.00 0.00 H new ATOM 0 HG21 THR A 46 -4.492 2.391 -3.880 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.971 1.401 -3.893 1.00 0.00 H new ATOM 0 HG23 THR A 46 -4.684 1.095 -5.085 1.00 0.00 H new ATOM 739 N GLU A 47 -9.028 2.543 -5.372 1.00 0.00 N ATOM 740 CA GLU A 47 -10.245 2.166 -4.674 1.00 0.00 C ATOM 741 C GLU A 47 -10.965 1.046 -5.429 1.00 0.00 C ATOM 742 O GLU A 47 -11.525 0.139 -4.814 1.00 0.00 O ATOM 743 CB GLU A 47 -11.161 3.373 -4.477 1.00 0.00 C ATOM 744 CG GLU A 47 -11.623 3.482 -3.023 1.00 0.00 C ATOM 745 CD GLU A 47 -13.150 3.462 -2.929 1.00 0.00 C ATOM 746 OE1 GLU A 47 -13.823 3.009 -3.867 1.00 0.00 O ATOM 747 OE2 GLU A 47 -13.635 3.940 -1.833 1.00 0.00 O ATOM 0 H GLU A 47 -8.959 3.534 -5.603 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.973 1.794 -3.686 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -10.635 4.283 -4.764 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -12.028 3.286 -5.132 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -11.209 2.657 -2.443 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -11.240 4.404 -2.584 1.00 0.00 H new ATOM 755 N LYS A 48 -10.927 1.148 -6.748 1.00 0.00 N ATOM 756 CA LYS A 48 -11.569 0.156 -7.595 1.00 0.00 C ATOM 757 C LYS A 48 -10.685 -1.089 -7.675 1.00 0.00 C ATOM 758 O LYS A 48 -11.186 -2.212 -7.684 1.00 0.00 O ATOM 759 CB LYS A 48 -11.914 0.757 -8.959 1.00 0.00 C ATOM 760 CG LYS A 48 -10.645 1.130 -9.729 1.00 0.00 C ATOM 761 CD LYS A 48 -10.952 1.370 -11.207 1.00 0.00 C ATOM 762 CE LYS A 48 -11.117 0.045 -11.955 1.00 0.00 C ATOM 763 NZ LYS A 48 -11.905 0.244 -13.192 1.00 0.00 N ATOM 0 H LYS A 48 -10.462 1.902 -7.253 1.00 0.00 H new ATOM 0 HA LYS A 48 -12.520 -0.156 -7.163 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -12.499 0.042 -9.538 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -12.536 1.642 -8.824 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -10.203 2.027 -9.295 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -9.909 0.332 -9.632 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -11.863 1.961 -11.302 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -10.148 1.950 -11.660 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -10.138 -0.364 -12.202 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -11.614 -0.683 -11.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -12.008 -0.664 -13.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -12.846 0.614 -12.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -11.416 0.922 -13.810 1.00 0.00 H new ATOM 776 N TRP A 49 -9.382 -0.848 -7.733 1.00 0.00 N ATOM 777 CA TRP A 49 -8.423 -1.936 -7.813 1.00 0.00 C ATOM 778 C TRP A 49 -8.513 -2.743 -6.517 1.00 0.00 C ATOM 779 O TRP A 49 -8.335 -3.959 -6.526 1.00 0.00 O ATOM 780 CB TRP A 49 -7.014 -1.405 -8.091 1.00 0.00 C ATOM 781 CG TRP A 49 -6.771 -1.021 -9.553 1.00 0.00 C ATOM 782 CD1 TRP A 49 -7.670 -0.931 -10.543 1.00 0.00 C ATOM 783 CD2 TRP A 49 -5.504 -0.677 -10.152 1.00 0.00 C ATOM 784 NE1 TRP A 49 -7.077 -0.557 -11.731 1.00 0.00 N ATOM 785 CE2 TRP A 49 -5.718 -0.396 -11.485 1.00 0.00 C ATOM 786 CE3 TRP A 49 -4.220 -0.605 -9.584 1.00 0.00 C ATOM 787 CZ2 TRP A 49 -4.692 -0.025 -12.365 1.00 0.00 C ATOM 788 CZ3 TRP A 49 -3.207 -0.232 -10.476 1.00 0.00 C ATOM 789 CH2 TRP A 49 -3.405 0.053 -11.821 1.00 0.00 C ATOM 0 H TRP A 49 -8.969 0.085 -7.726 1.00 0.00 H new ATOM 0 HA TRP A 49 -8.656 -2.595 -8.649 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -6.835 -0.533 -7.462 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -6.287 -2.163 -7.799 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -8.726 -1.127 -10.425 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -7.549 -0.423 -12.625 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -4.030 -0.820 -8.543 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -4.884 0.189 -13.406 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -2.200 -0.161 -10.091 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -2.569 0.334 -12.444 1.00 0.00 H new ATOM 800 N ALA A 50 -8.788 -2.032 -5.433 1.00 0.00 N ATOM 801 CA ALA A 50 -8.904 -2.667 -4.131 1.00 0.00 C ATOM 802 C ALA A 50 -10.279 -3.324 -4.009 1.00 0.00 C ATOM 803 O ALA A 50 -10.540 -4.056 -3.057 1.00 0.00 O ATOM 804 CB ALA A 50 -8.654 -1.630 -3.034 1.00 0.00 C ATOM 0 H ALA A 50 -8.934 -1.022 -5.430 1.00 0.00 H new ATOM 0 HA ALA A 50 -8.154 -3.450 -4.018 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -8.741 -2.106 -2.057 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -7.653 -1.214 -3.148 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -9.390 -0.830 -3.115 1.00 0.00 H new ATOM 810 N GLN A 51 -11.125 -3.038 -4.989 1.00 0.00 N ATOM 811 CA GLN A 51 -12.469 -3.593 -5.004 1.00 0.00 C ATOM 812 C GLN A 51 -12.553 -4.751 -6.000 1.00 0.00 C ATOM 813 O GLN A 51 -13.547 -5.476 -6.031 1.00 0.00 O ATOM 814 CB GLN A 51 -13.503 -2.515 -5.327 1.00 0.00 C ATOM 815 CG GLN A 51 -13.799 -1.652 -4.100 1.00 0.00 C ATOM 816 CD GLN A 51 -15.224 -1.886 -3.595 1.00 0.00 C ATOM 817 OE1 GLN A 51 -16.104 -1.051 -3.734 1.00 0.00 O ATOM 818 NE2 GLN A 51 -15.404 -3.064 -3.005 1.00 0.00 N ATOM 0 H GLN A 51 -10.906 -2.430 -5.778 1.00 0.00 H new ATOM 0 HA GLN A 51 -12.694 -3.978 -4.009 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -13.136 -1.886 -6.138 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -14.423 -2.982 -5.677 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -13.086 -1.883 -3.308 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -13.667 -0.600 -4.351 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -14.625 -3.717 -2.922 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -16.321 -3.315 -2.636 1.00 0.00 H new ATOM 827 N ASP A 52 -11.498 -4.890 -6.789 1.00 0.00 N ATOM 828 CA ASP A 52 -11.442 -5.948 -7.784 1.00 0.00 C ATOM 829 C ASP A 52 -11.423 -7.305 -7.078 1.00 0.00 C ATOM 830 O ASP A 52 -10.656 -7.511 -6.139 1.00 0.00 O ATOM 831 CB ASP A 52 -10.173 -5.839 -8.632 1.00 0.00 C ATOM 832 CG ASP A 52 -9.733 -7.140 -9.308 1.00 0.00 C ATOM 833 OD1 ASP A 52 -8.537 -7.466 -9.349 1.00 0.00 O ATOM 834 OD2 ASP A 52 -10.689 -7.841 -9.814 1.00 0.00 O ATOM 0 H ASP A 52 -10.675 -4.288 -6.760 1.00 0.00 H new ATOM 0 HA ASP A 52 -12.316 -5.852 -8.428 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -10.332 -5.083 -9.401 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -9.360 -5.483 -7.999 1.00 0.00 H new ATOM 840 N ALA A 53 -12.278 -8.197 -7.557 1.00 0.00 N ATOM 841 CA ALA A 53 -12.369 -9.529 -6.983 1.00 0.00 C ATOM 842 C ALA A 53 -11.009 -10.220 -7.092 1.00 0.00 C ATOM 843 O ALA A 53 -10.495 -10.745 -6.105 1.00 0.00 O ATOM 844 CB ALA A 53 -13.480 -10.313 -7.688 1.00 0.00 C ATOM 0 H ALA A 53 -12.914 -8.024 -8.336 1.00 0.00 H new ATOM 0 HA ALA A 53 -12.628 -9.475 -5.925 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -13.549 -11.312 -7.258 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -14.430 -9.795 -7.557 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -13.252 -10.390 -8.751 1.00 0.00 H new ATOM 850 N LYS A 54 -10.465 -10.201 -8.299 1.00 0.00 N ATOM 851 CA LYS A 54 -9.174 -10.820 -8.550 1.00 0.00 C ATOM 852 C LYS A 54 -8.179 -10.363 -7.480 1.00 0.00 C ATOM 853 O LYS A 54 -7.333 -11.140 -7.042 1.00 0.00 O ATOM 854 CB LYS A 54 -8.712 -10.537 -9.979 1.00 0.00 C ATOM 855 CG LYS A 54 -7.871 -11.693 -10.524 1.00 0.00 C ATOM 856 CD LYS A 54 -8.740 -12.688 -11.295 1.00 0.00 C ATOM 857 CE LYS A 54 -8.268 -14.124 -11.065 1.00 0.00 C ATOM 858 NZ LYS A 54 -9.419 -15.055 -11.061 1.00 0.00 N ATOM 0 H LYS A 54 -10.895 -9.766 -9.115 1.00 0.00 H new ATOM 0 HA LYS A 54 -9.250 -11.905 -8.474 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -9.579 -10.380 -10.621 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -8.128 -9.617 -10.000 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -7.091 -11.303 -11.178 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -7.371 -12.203 -9.701 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -9.779 -12.588 -10.980 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -8.706 -12.457 -12.360 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -7.564 -14.411 -11.846 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -7.736 -14.190 -10.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -9.080 -16.025 -10.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -10.077 -14.790 -10.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -9.910 -15.004 -11.976 1.00 0.00 H new ATOM 871 N PHE A 55 -8.314 -9.104 -7.091 1.00 0.00 N ATOM 872 CA PHE A 55 -7.438 -8.534 -6.081 1.00 0.00 C ATOM 873 C PHE A 55 -7.839 -9.002 -4.680 1.00 0.00 C ATOM 874 O PHE A 55 -6.991 -9.125 -3.798 1.00 0.00 O ATOM 875 CB PHE A 55 -7.591 -7.014 -6.162 1.00 0.00 C ATOM 876 CG PHE A 55 -6.339 -6.288 -6.659 1.00 0.00 C ATOM 877 CD1 PHE A 55 -5.141 -6.505 -6.051 1.00 0.00 C ATOM 878 CD2 PHE A 55 -6.424 -5.426 -7.705 1.00 0.00 C ATOM 879 CE1 PHE A 55 -3.979 -5.830 -6.512 1.00 0.00 C ATOM 880 CE2 PHE A 55 -5.262 -4.751 -8.167 1.00 0.00 C ATOM 881 CZ PHE A 55 -4.064 -4.968 -7.560 1.00 0.00 C ATOM 0 H PHE A 55 -9.017 -8.462 -7.457 1.00 0.00 H new ATOM 0 HA PHE A 55 -6.410 -8.849 -6.259 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -8.423 -6.778 -6.825 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -7.852 -6.632 -5.175 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -5.074 -7.190 -5.219 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -7.375 -5.253 -8.186 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -3.028 -6.002 -6.030 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -5.330 -4.066 -8.999 1.00 0.00 H new ATOM 0 HZ PHE A 55 -3.180 -4.455 -7.911 1.00 0.00 H new ATOM 891 N SER A 56 -9.130 -9.250 -4.522 1.00 0.00 N ATOM 892 CA SER A 56 -9.653 -9.702 -3.244 1.00 0.00 C ATOM 893 C SER A 56 -8.769 -10.816 -2.680 1.00 0.00 C ATOM 894 O SER A 56 -8.468 -10.832 -1.486 1.00 0.00 O ATOM 895 CB SER A 56 -11.097 -10.189 -3.380 1.00 0.00 C ATOM 896 OG SER A 56 -11.831 -10.033 -2.168 1.00 0.00 O ATOM 0 H SER A 56 -9.830 -9.147 -5.257 1.00 0.00 H new ATOM 0 HA SER A 56 -9.646 -8.857 -2.555 1.00 0.00 H new ATOM 0 HB2 SER A 56 -11.592 -9.635 -4.177 1.00 0.00 H new ATOM 0 HB3 SER A 56 -11.099 -11.239 -3.672 1.00 0.00 H new ATOM 0 HG SER A 56 -12.748 -10.354 -2.297 1.00 0.00 H new ATOM 902 N SER A 57 -8.375 -11.721 -3.564 1.00 0.00 N ATOM 903 CA SER A 57 -7.531 -12.835 -3.169 1.00 0.00 C ATOM 904 C SER A 57 -6.497 -12.371 -2.143 1.00 0.00 C ATOM 905 O SER A 57 -6.441 -12.893 -1.031 1.00 0.00 O ATOM 906 CB SER A 57 -6.833 -13.454 -4.383 1.00 0.00 C ATOM 907 OG SER A 57 -6.558 -14.839 -4.191 1.00 0.00 O ATOM 0 H SER A 57 -8.625 -11.705 -4.553 1.00 0.00 H new ATOM 0 HA SER A 57 -8.163 -13.599 -2.717 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.460 -13.328 -5.265 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.901 -12.922 -4.576 1.00 0.00 H new ATOM 0 HG SER A 57 -6.114 -15.198 -4.988 1.00 0.00 H new ATOM 913 N ALA A 58 -5.701 -11.393 -2.552 1.00 0.00 N ATOM 914 CA ALA A 58 -4.670 -10.851 -1.682 1.00 0.00 C ATOM 915 C ALA A 58 -5.135 -9.503 -1.129 1.00 0.00 C ATOM 916 O ALA A 58 -6.104 -8.926 -1.619 1.00 0.00 O ATOM 917 CB ALA A 58 -3.354 -10.744 -2.454 1.00 0.00 C ATOM 0 H ALA A 58 -5.749 -10.962 -3.475 1.00 0.00 H new ATOM 0 HA ALA A 58 -4.495 -11.513 -0.834 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -2.581 -10.338 -1.801 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -3.054 -11.733 -2.800 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -3.488 -10.085 -3.312 1.00 0.00 H new ATOM 923 N ASN A 59 -4.420 -9.038 -0.115 1.00 0.00 N ATOM 924 CA ASN A 59 -4.745 -7.768 0.510 1.00 0.00 C ATOM 925 C ASN A 59 -4.008 -6.642 -0.219 1.00 0.00 C ATOM 926 O ASN A 59 -2.828 -6.773 -0.538 1.00 0.00 O ATOM 927 CB ASN A 59 -4.308 -7.747 1.976 1.00 0.00 C ATOM 928 CG ASN A 59 -5.129 -8.735 2.808 1.00 0.00 C ATOM 929 OD1 ASN A 59 -6.341 -8.821 2.696 1.00 0.00 O ATOM 930 ND2 ASN A 59 -4.405 -9.470 3.645 1.00 0.00 N ATOM 0 H ASN A 59 -3.616 -9.519 0.289 1.00 0.00 H new ATOM 0 HA ASN A 59 -5.825 -7.632 0.454 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.250 -7.998 2.047 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -4.425 -6.741 2.380 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -4.861 -10.158 4.245 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -3.393 -9.347 3.688 1.00 0.00 H new ATOM 937 N LEU A 60 -4.735 -5.560 -0.459 1.00 0.00 N ATOM 938 CA LEU A 60 -4.167 -4.413 -1.144 1.00 0.00 C ATOM 939 C LEU A 60 -4.350 -3.165 -0.278 1.00 0.00 C ATOM 940 O LEU A 60 -5.465 -2.854 0.139 1.00 0.00 O ATOM 941 CB LEU A 60 -4.757 -4.279 -2.548 1.00 0.00 C ATOM 942 CG LEU A 60 -4.111 -3.226 -3.451 1.00 0.00 C ATOM 943 CD1 LEU A 60 -4.727 -3.252 -4.851 1.00 0.00 C ATOM 944 CD2 LEU A 60 -4.192 -1.836 -2.815 1.00 0.00 C ATOM 0 H LEU A 60 -5.713 -5.454 -0.191 1.00 0.00 H new ATOM 0 HA LEU A 60 -3.095 -4.548 -1.287 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -4.686 -5.247 -3.044 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -5.818 -4.046 -2.454 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.054 -3.470 -3.560 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -4.250 -2.494 -5.472 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -4.575 -4.235 -5.297 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -5.795 -3.045 -4.782 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.726 -1.106 -3.476 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.237 -1.568 -2.657 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.671 -1.843 -1.858 1.00 0.00 H new ATOM 956 N ILE A 61 -3.240 -2.484 -0.034 1.00 0.00 N ATOM 957 CA ILE A 61 -3.265 -1.276 0.774 1.00 0.00 C ATOM 958 C ILE A 61 -2.114 -0.362 0.352 1.00 0.00 C ATOM 959 O ILE A 61 -1.149 -0.815 -0.262 1.00 0.00 O ATOM 960 CB ILE A 61 -3.257 -1.629 2.262 1.00 0.00 C ATOM 961 CG1 ILE A 61 -1.895 -2.180 2.689 1.00 0.00 C ATOM 962 CG2 ILE A 61 -4.396 -2.591 2.605 1.00 0.00 C ATOM 963 CD1 ILE A 61 -1.921 -2.639 4.148 1.00 0.00 C ATOM 0 H ILE A 61 -2.317 -2.746 -0.382 1.00 0.00 H new ATOM 0 HA ILE A 61 -4.189 -0.723 0.606 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.427 -0.714 2.829 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.619 -3.016 2.046 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -1.132 -1.413 2.559 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.366 -2.825 3.669 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -5.351 -2.125 2.362 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.283 -3.509 2.028 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -0.940 -3.026 4.425 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.173 -1.795 4.790 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -2.668 -3.423 4.269 1.00 0.00 H new ATOM 975 N THR A 62 -2.252 0.909 0.700 1.00 0.00 N ATOM 976 CA THR A 62 -1.236 1.892 0.365 1.00 0.00 C ATOM 977 C THR A 62 -0.498 2.346 1.625 1.00 0.00 C ATOM 978 O THR A 62 -1.018 2.220 2.733 1.00 0.00 O ATOM 979 CB THR A 62 -1.915 3.037 -0.387 1.00 0.00 C ATOM 980 OG1 THR A 62 -2.686 3.701 0.612 1.00 0.00 O ATOM 981 CG2 THR A 62 -2.957 2.542 -1.392 1.00 0.00 C ATOM 0 H THR A 62 -3.053 1.281 1.211 1.00 0.00 H new ATOM 0 HA THR A 62 -0.472 1.465 -0.285 1.00 0.00 H new ATOM 0 HB THR A 62 -1.160 3.626 -0.907 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.591 3.326 0.629 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.408 3.395 -1.898 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.476 1.897 -2.127 1.00 0.00 H new ATOM 0 HG23 THR A 62 -3.730 1.980 -0.868 1.00 0.00 H new ATOM 989 N VAL A 63 0.704 2.865 1.414 1.00 0.00 N ATOM 990 CA VAL A 63 1.519 3.339 2.520 1.00 0.00 C ATOM 991 C VAL A 63 1.872 4.810 2.293 1.00 0.00 C ATOM 992 O VAL A 63 2.123 5.225 1.163 1.00 0.00 O ATOM 993 CB VAL A 63 2.751 2.445 2.681 1.00 0.00 C ATOM 994 CG1 VAL A 63 3.880 3.192 3.395 1.00 0.00 C ATOM 995 CG2 VAL A 63 2.397 1.151 3.417 1.00 0.00 C ATOM 0 H VAL A 63 1.132 2.967 0.494 1.00 0.00 H new ATOM 0 HA VAL A 63 0.966 3.279 3.457 1.00 0.00 H new ATOM 0 HB VAL A 63 3.104 2.177 1.685 1.00 0.00 H new ATOM 0 HG11 VAL A 63 4.744 2.535 3.497 1.00 0.00 H new ATOM 0 HG12 VAL A 63 4.159 4.071 2.814 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.542 3.503 4.384 1.00 0.00 H new ATOM 0 HG21 VAL A 63 3.290 0.534 3.518 1.00 0.00 H new ATOM 0 HG22 VAL A 63 2.007 1.390 4.406 1.00 0.00 H new ATOM 0 HG23 VAL A 63 1.641 0.606 2.851 1.00 0.00 H new ATOM 1005 N ALA A 64 1.881 5.557 3.388 1.00 0.00 N ATOM 1006 CA ALA A 64 2.199 6.974 3.323 1.00 0.00 C ATOM 1007 C ALA A 64 3.179 7.323 4.445 1.00 0.00 C ATOM 1008 O ALA A 64 2.912 7.051 5.614 1.00 0.00 O ATOM 1009 CB ALA A 64 0.909 7.791 3.400 1.00 0.00 C ATOM 0 H ALA A 64 1.674 5.208 4.324 1.00 0.00 H new ATOM 0 HA ALA A 64 2.681 7.217 2.376 1.00 0.00 H new ATOM 0 HB1 ALA A 64 1.148 8.853 3.351 1.00 0.00 H new ATOM 0 HB2 ALA A 64 0.260 7.526 2.565 1.00 0.00 H new ATOM 0 HB3 ALA A 64 0.398 7.577 4.339 1.00 0.00 H new ATOM 1015 N SER A 65 4.294 7.920 4.048 1.00 0.00 N ATOM 1016 CA SER A 65 5.315 8.309 5.005 1.00 0.00 C ATOM 1017 C SER A 65 5.228 9.812 5.282 1.00 0.00 C ATOM 1018 O SER A 65 5.589 10.625 4.431 1.00 0.00 O ATOM 1019 CB SER A 65 6.712 7.943 4.501 1.00 0.00 C ATOM 1020 OG SER A 65 6.771 6.603 4.019 1.00 0.00 O ATOM 0 H SER A 65 4.512 8.143 3.077 1.00 0.00 H new ATOM 0 HA SER A 65 5.139 7.764 5.932 1.00 0.00 H new ATOM 0 HB2 SER A 65 7.001 8.628 3.704 1.00 0.00 H new ATOM 0 HB3 SER A 65 7.434 8.070 5.308 1.00 0.00 H new ATOM 0 HG SER A 65 7.679 6.408 3.705 1.00 0.00 H new ATOM 1026 N PRO A 66 4.735 10.144 6.505 1.00 0.00 N ATOM 1027 CA PRO A 66 4.595 11.535 6.904 1.00 0.00 C ATOM 1028 C PRO A 66 5.955 12.145 7.248 1.00 0.00 C ATOM 1029 O PRO A 66 6.762 11.523 7.939 1.00 0.00 O ATOM 1030 CB PRO A 66 3.639 11.510 8.084 1.00 0.00 C ATOM 1031 CG PRO A 66 3.643 10.080 8.595 1.00 0.00 C ATOM 1032 CD PRO A 66 4.298 9.209 7.537 1.00 0.00 C ATOM 0 HA PRO A 66 4.204 12.166 6.105 1.00 0.00 H new ATOM 0 HB2 PRO A 66 3.960 12.203 8.861 1.00 0.00 H new ATOM 0 HB3 PRO A 66 2.637 11.813 7.781 1.00 0.00 H new ATOM 0 HG2 PRO A 66 4.189 10.013 9.536 1.00 0.00 H new ATOM 0 HG3 PRO A 66 2.626 9.742 8.791 1.00 0.00 H new ATOM 0 HD2 PRO A 66 5.140 8.652 7.948 1.00 0.00 H new ATOM 0 HD3 PRO A 66 3.596 8.477 7.137 1.00 0.00 H new ATOM 1040 N GLY A 67 6.168 13.355 6.751 1.00 0.00 N ATOM 1041 CA GLY A 67 7.416 14.056 6.997 1.00 0.00 C ATOM 1042 C GLY A 67 8.586 13.359 6.297 1.00 0.00 C ATOM 1043 O GLY A 67 9.745 13.661 6.568 1.00 0.00 O ATOM 0 H GLY A 67 5.497 13.867 6.179 1.00 0.00 H new ATOM 0 HA2 GLY A 67 7.336 15.084 6.642 1.00 0.00 H new ATOM 0 HA3 GLY A 67 7.605 14.103 8.069 1.00 0.00 H new ATOM 1047 N PHE A 68 8.236 12.437 5.411 1.00 0.00 N ATOM 1048 CA PHE A 68 9.242 11.695 4.669 1.00 0.00 C ATOM 1049 C PHE A 68 9.008 11.811 3.162 1.00 0.00 C ATOM 1050 O PHE A 68 7.871 11.729 2.698 1.00 0.00 O ATOM 1051 CB PHE A 68 9.110 10.228 5.083 1.00 0.00 C ATOM 1052 CG PHE A 68 10.185 9.315 4.490 1.00 0.00 C ATOM 1053 CD1 PHE A 68 11.413 9.244 5.072 1.00 0.00 C ATOM 1054 CD2 PHE A 68 9.913 8.576 3.381 1.00 0.00 C ATOM 1055 CE1 PHE A 68 12.411 8.396 4.521 1.00 0.00 C ATOM 1056 CE2 PHE A 68 10.911 7.729 2.832 1.00 0.00 C ATOM 1057 CZ PHE A 68 12.139 7.656 3.413 1.00 0.00 C ATOM 0 H PHE A 68 7.272 12.187 5.191 1.00 0.00 H new ATOM 0 HA PHE A 68 10.234 12.092 4.887 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.152 10.163 6.170 1.00 0.00 H new ATOM 0 HB3 PHE A 68 8.129 9.862 4.779 1.00 0.00 H new ATOM 0 HD1 PHE A 68 11.629 9.832 5.952 1.00 0.00 H new ATOM 0 HD2 PHE A 68 8.939 8.634 2.919 1.00 0.00 H new ATOM 0 HE1 PHE A 68 13.386 8.339 4.982 1.00 0.00 H new ATOM 0 HE2 PHE A 68 10.695 7.142 1.952 1.00 0.00 H new ATOM 0 HZ PHE A 68 12.897 7.011 2.995 1.00 0.00 H new ATOM 1067 N LEU A 69 10.101 11.998 2.438 1.00 0.00 N ATOM 1068 CA LEU A 69 10.029 12.125 0.992 1.00 0.00 C ATOM 1069 C LEU A 69 9.223 13.376 0.633 1.00 0.00 C ATOM 1070 O LEU A 69 8.318 13.317 -0.197 1.00 0.00 O ATOM 1071 CB LEU A 69 9.481 10.841 0.368 1.00 0.00 C ATOM 1072 CG LEU A 69 10.418 10.111 -0.597 1.00 0.00 C ATOM 1073 CD1 LEU A 69 10.775 10.997 -1.791 1.00 0.00 C ATOM 1074 CD2 LEU A 69 11.663 9.599 0.130 1.00 0.00 C ATOM 0 H LEU A 69 11.042 12.065 2.826 1.00 0.00 H new ATOM 0 HA LEU A 69 11.026 12.256 0.571 1.00 0.00 H new ATOM 0 HB2 LEU A 69 9.214 10.155 1.172 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.561 11.083 -0.164 1.00 0.00 H new ATOM 0 HG LEU A 69 9.893 9.240 -0.989 1.00 0.00 H new ATOM 0 HD11 LEU A 69 11.442 10.454 -2.461 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.866 11.269 -2.327 1.00 0.00 H new ATOM 0 HD13 LEU A 69 11.273 11.900 -1.438 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.312 9.084 -0.578 1.00 0.00 H new ATOM 0 HD22 LEU A 69 12.200 10.440 0.569 1.00 0.00 H new ATOM 0 HD23 LEU A 69 11.365 8.907 0.918 1.00 0.00 H new ATOM 1086 N HIS A 70 9.580 14.476 1.279 1.00 0.00 N ATOM 1087 CA HIS A 70 8.902 15.738 1.039 1.00 0.00 C ATOM 1088 C HIS A 70 7.389 15.539 1.163 1.00 0.00 C ATOM 1089 O HIS A 70 6.615 16.185 0.458 1.00 0.00 O ATOM 1090 CB HIS A 70 9.313 16.328 -0.312 1.00 0.00 C ATOM 1091 CG HIS A 70 10.752 16.782 -0.371 1.00 0.00 C ATOM 1092 ND1 HIS A 70 11.424 16.993 -1.562 1.00 0.00 N ATOM 1093 CD2 HIS A 70 11.639 17.065 0.626 1.00 0.00 C ATOM 1094 CE1 HIS A 70 12.659 17.383 -1.283 1.00 0.00 C ATOM 1095 NE2 HIS A 70 12.790 17.427 0.074 1.00 0.00 N ATOM 0 H HIS A 70 10.330 14.519 1.969 1.00 0.00 H new ATOM 0 HA HIS A 70 9.202 16.465 1.794 1.00 0.00 H new ATOM 0 HB2 HIS A 70 9.146 15.582 -1.089 1.00 0.00 H new ATOM 0 HB3 HIS A 70 8.666 17.175 -0.539 1.00 0.00 H new ATOM 0 HD2 HIS A 70 11.438 17.005 1.685 1.00 0.00 H new ATOM 0 HE1 HIS A 70 13.427 17.624 -2.003 1.00 0.00 H new ATOM 0 HE2 HIS A 70 13.634 17.694 0.581 1.00 0.00 H new ATOM 1104 N GLU A 71 7.015 14.643 2.063 1.00 0.00 N ATOM 1105 CA GLU A 71 5.610 14.351 2.288 1.00 0.00 C ATOM 1106 C GLU A 71 5.092 15.133 3.497 1.00 0.00 C ATOM 1107 O GLU A 71 5.869 15.523 4.368 1.00 0.00 O ATOM 1108 CB GLU A 71 5.384 12.849 2.471 1.00 0.00 C ATOM 1109 CG GLU A 71 3.893 12.530 2.610 1.00 0.00 C ATOM 1110 CD GLU A 71 3.128 12.934 1.349 1.00 0.00 C ATOM 1111 OE1 GLU A 71 2.117 13.649 1.439 1.00 0.00 O ATOM 1112 OE2 GLU A 71 3.616 12.479 0.246 1.00 0.00 O ATOM 0 H GLU A 71 7.660 14.109 2.645 1.00 0.00 H new ATOM 0 HA GLU A 71 5.049 14.665 1.408 1.00 0.00 H new ATOM 0 HB2 GLU A 71 5.797 12.309 1.619 1.00 0.00 H new ATOM 0 HB3 GLU A 71 5.917 12.503 3.356 1.00 0.00 H new ATOM 0 HG2 GLU A 71 3.761 11.464 2.794 1.00 0.00 H new ATOM 0 HG3 GLU A 71 3.484 13.056 3.473 1.00 0.00 H new ATOM 1120 N LYS A 72 3.783 15.341 3.511 1.00 0.00 N ATOM 1121 CA LYS A 72 3.153 16.070 4.598 1.00 0.00 C ATOM 1122 C LYS A 72 3.399 15.329 5.914 1.00 0.00 C ATOM 1123 O LYS A 72 3.329 14.102 5.964 1.00 0.00 O ATOM 1124 CB LYS A 72 1.672 16.309 4.295 1.00 0.00 C ATOM 1125 CG LYS A 72 1.466 17.653 3.594 1.00 0.00 C ATOM 1126 CD LYS A 72 0.862 18.683 4.551 1.00 0.00 C ATOM 1127 CE LYS A 72 1.215 20.107 4.116 1.00 0.00 C ATOM 1128 NZ LYS A 72 2.682 20.294 4.092 1.00 0.00 N ATOM 0 H LYS A 72 3.142 15.017 2.787 1.00 0.00 H new ATOM 0 HA LYS A 72 3.598 17.060 4.701 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.291 15.504 3.666 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.099 16.287 5.222 1.00 0.00 H new ATOM 0 HG2 LYS A 72 2.420 18.019 3.214 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.810 17.522 2.734 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -0.221 18.566 4.581 1.00 0.00 H new ATOM 0 HD3 LYS A 72 1.230 18.506 5.562 1.00 0.00 H new ATOM 0 HE2 LYS A 72 0.801 20.304 3.127 1.00 0.00 H new ATOM 0 HE3 LYS A 72 0.762 20.825 4.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 2.910 21.279 4.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 3.125 19.655 4.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 3.044 20.079 3.141 1.00 0.00 H new ATOM 1141 N LYS A 73 3.685 16.106 6.949 1.00 0.00 N ATOM 1142 CA LYS A 73 3.942 15.539 8.261 1.00 0.00 C ATOM 1143 C LYS A 73 2.691 14.811 8.753 1.00 0.00 C ATOM 1144 O LYS A 73 1.606 14.989 8.198 1.00 0.00 O ATOM 1145 CB LYS A 73 4.442 16.620 9.223 1.00 0.00 C ATOM 1146 CG LYS A 73 5.684 17.318 8.665 1.00 0.00 C ATOM 1147 CD LYS A 73 6.571 17.846 9.795 1.00 0.00 C ATOM 1148 CE LYS A 73 6.846 19.341 9.623 1.00 0.00 C ATOM 1149 NZ LYS A 73 7.978 19.762 10.479 1.00 0.00 N ATOM 0 H LYS A 73 3.744 17.123 6.905 1.00 0.00 H new ATOM 0 HA LYS A 73 4.740 14.799 8.205 1.00 0.00 H new ATOM 0 HB2 LYS A 73 3.654 17.353 9.393 1.00 0.00 H new ATOM 0 HB3 LYS A 73 4.675 16.173 10.189 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.251 16.621 8.048 1.00 0.00 H new ATOM 0 HG3 LYS A 73 5.383 18.143 8.019 1.00 0.00 H new ATOM 0 HD2 LYS A 73 6.086 17.670 10.755 1.00 0.00 H new ATOM 0 HD3 LYS A 73 7.513 17.298 9.809 1.00 0.00 H new ATOM 0 HE2 LYS A 73 7.072 19.557 8.579 1.00 0.00 H new ATOM 0 HE3 LYS A 73 5.955 19.913 9.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 8.151 20.779 10.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 7.748 19.574 11.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 8.831 19.229 10.214 1.00 0.00 H new ATOM 1162 N ASP A 74 2.880 14.006 9.788 1.00 0.00 N ATOM 1163 CA ASP A 74 1.780 13.251 10.360 1.00 0.00 C ATOM 1164 C ASP A 74 0.740 14.220 10.927 1.00 0.00 C ATOM 1165 O ASP A 74 1.080 15.330 11.334 1.00 0.00 O ATOM 1166 CB ASP A 74 2.262 12.354 11.502 1.00 0.00 C ATOM 1167 CG ASP A 74 1.551 11.003 11.609 1.00 0.00 C ATOM 1168 OD1 ASP A 74 1.949 10.019 10.967 1.00 0.00 O ATOM 1169 OD2 ASP A 74 0.533 10.984 12.401 1.00 0.00 O ATOM 0 H ASP A 74 3.780 13.861 10.245 1.00 0.00 H new ATOM 0 HA ASP A 74 1.351 12.633 9.572 1.00 0.00 H new ATOM 0 HB2 ASP A 74 3.330 12.176 11.378 1.00 0.00 H new ATOM 0 HB3 ASP A 74 2.135 12.890 12.443 1.00 0.00 H new ATOM 1175 N GLY A 75 -0.504 13.764 10.938 1.00 0.00 N ATOM 1176 CA GLY A 75 -1.594 14.578 11.448 1.00 0.00 C ATOM 1177 C GLY A 75 -2.116 15.533 10.373 1.00 0.00 C ATOM 1178 O GLY A 75 -3.314 15.571 10.098 1.00 0.00 O ATOM 0 H GLY A 75 -0.781 12.842 10.602 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -2.404 13.934 11.791 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.253 15.149 12.312 1.00 0.00 H new ATOM 1182 N ASP A 76 -1.191 16.282 9.791 1.00 0.00 N ATOM 1183 CA ASP A 76 -1.543 17.236 8.752 1.00 0.00 C ATOM 1184 C ASP A 76 -1.864 16.479 7.462 1.00 0.00 C ATOM 1185 O ASP A 76 -2.672 16.937 6.654 1.00 0.00 O ATOM 1186 CB ASP A 76 -0.383 18.189 8.464 1.00 0.00 C ATOM 1187 CG ASP A 76 -0.286 19.392 9.405 1.00 0.00 C ATOM 1188 OD1 ASP A 76 0.396 19.341 10.440 1.00 0.00 O ATOM 1189 OD2 ASP A 76 -0.957 20.429 9.034 1.00 0.00 O ATOM 0 H ASP A 76 -0.197 16.248 10.019 1.00 0.00 H new ATOM 0 HA ASP A 76 -2.403 17.810 9.097 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.550 17.628 8.518 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.477 18.553 7.441 1.00 0.00 H new ATOM 1195 N PHE A 77 -1.216 15.334 7.307 1.00 0.00 N ATOM 1196 CA PHE A 77 -1.423 14.510 6.128 1.00 0.00 C ATOM 1197 C PHE A 77 -2.736 13.730 6.228 1.00 0.00 C ATOM 1198 O PHE A 77 -3.598 13.846 5.359 1.00 0.00 O ATOM 1199 CB PHE A 77 -0.259 13.519 6.065 1.00 0.00 C ATOM 1200 CG PHE A 77 -0.507 12.325 5.141 1.00 0.00 C ATOM 1201 CD1 PHE A 77 -1.159 11.228 5.609 1.00 0.00 C ATOM 1202 CD2 PHE A 77 -0.076 12.362 3.851 1.00 0.00 C ATOM 1203 CE1 PHE A 77 -1.389 10.119 4.752 1.00 0.00 C ATOM 1204 CE2 PHE A 77 -0.307 11.254 2.994 1.00 0.00 C ATOM 1205 CZ PHE A 77 -0.958 10.156 3.462 1.00 0.00 C ATOM 0 H PHE A 77 -0.547 14.957 7.978 1.00 0.00 H new ATOM 0 HA PHE A 77 -1.471 15.138 5.239 1.00 0.00 H new ATOM 0 HB2 PHE A 77 0.635 14.045 5.730 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -0.054 13.151 7.070 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.502 11.200 6.633 1.00 0.00 H new ATOM 0 HD2 PHE A 77 0.442 13.234 3.479 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -1.906 9.247 5.124 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.035 11.283 1.970 1.00 0.00 H new ATOM 0 HZ PHE A 77 -1.133 9.313 2.810 1.00 0.00 H new ATOM 1215 N GLN A 78 -2.844 12.951 7.295 1.00 0.00 N ATOM 1216 CA GLN A 78 -4.037 12.152 7.519 1.00 0.00 C ATOM 1217 C GLN A 78 -5.288 13.029 7.429 1.00 0.00 C ATOM 1218 O GLN A 78 -6.363 12.548 7.077 1.00 0.00 O ATOM 1219 CB GLN A 78 -3.968 11.431 8.867 1.00 0.00 C ATOM 1220 CG GLN A 78 -3.748 12.424 10.009 1.00 0.00 C ATOM 1221 CD GLN A 78 -3.327 11.701 11.291 1.00 0.00 C ATOM 1222 OE1 GLN A 78 -2.159 11.456 11.541 1.00 0.00 O ATOM 1223 NE2 GLN A 78 -4.342 11.373 12.085 1.00 0.00 N ATOM 0 H GLN A 78 -2.126 12.856 8.013 1.00 0.00 H new ATOM 0 HA GLN A 78 -4.094 11.392 6.740 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -4.892 10.877 9.035 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -3.157 10.702 8.853 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -2.982 13.146 9.726 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -4.664 12.986 10.188 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -5.297 11.608 11.815 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -4.165 10.886 12.964 1.00 0.00 H new ATOM 1232 N LYS A 79 -5.105 14.300 7.755 1.00 0.00 N ATOM 1233 CA LYS A 79 -6.205 15.248 7.716 1.00 0.00 C ATOM 1234 C LYS A 79 -6.571 15.539 6.260 1.00 0.00 C ATOM 1235 O LYS A 79 -7.743 15.497 5.890 1.00 0.00 O ATOM 1236 CB LYS A 79 -5.864 16.501 8.525 1.00 0.00 C ATOM 1237 CG LYS A 79 -6.553 16.477 9.891 1.00 0.00 C ATOM 1238 CD LYS A 79 -6.512 17.857 10.551 1.00 0.00 C ATOM 1239 CE LYS A 79 -5.496 17.886 11.695 1.00 0.00 C ATOM 1240 NZ LYS A 79 -4.161 18.277 11.195 1.00 0.00 N ATOM 0 H LYS A 79 -4.211 14.695 8.047 1.00 0.00 H new ATOM 0 HA LYS A 79 -7.090 14.822 8.189 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -4.784 16.569 8.660 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -6.173 17.389 7.974 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -7.588 16.157 9.774 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -6.064 15.747 10.536 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -6.252 18.612 9.809 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -7.501 18.112 10.931 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -5.823 18.588 12.462 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -5.441 16.904 12.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -3.537 18.489 12.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -3.756 17.497 10.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -4.249 19.121 10.594 1.00 0.00 H new ATOM 1253 N TRP A 80 -5.546 15.826 5.472 1.00 0.00 N ATOM 1254 CA TRP A 80 -5.745 16.122 4.063 1.00 0.00 C ATOM 1255 C TRP A 80 -6.396 14.902 3.410 1.00 0.00 C ATOM 1256 O TRP A 80 -7.439 15.019 2.769 1.00 0.00 O ATOM 1257 CB TRP A 80 -4.428 16.526 3.397 1.00 0.00 C ATOM 1258 CG TRP A 80 -4.470 16.496 1.867 1.00 0.00 C ATOM 1259 CD1 TRP A 80 -5.547 16.492 1.071 1.00 0.00 C ATOM 1260 CD2 TRP A 80 -3.334 16.465 0.977 1.00 0.00 C ATOM 1261 NE1 TRP A 80 -5.191 16.462 -0.262 1.00 0.00 N ATOM 1262 CE2 TRP A 80 -3.802 16.445 -0.320 1.00 0.00 C ATOM 1263 CE3 TRP A 80 -1.957 16.456 1.259 1.00 0.00 C ATOM 1264 CZ2 TRP A 80 -2.961 16.413 -1.439 1.00 0.00 C ATOM 1265 CZ3 TRP A 80 -1.129 16.424 0.130 1.00 0.00 C ATOM 1266 CH2 TRP A 80 -1.586 16.403 -1.183 1.00 0.00 C ATOM 0 H TRP A 80 -4.575 15.860 5.782 1.00 0.00 H new ATOM 0 HA TRP A 80 -6.409 16.978 3.939 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -4.161 17.531 3.723 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -3.638 15.858 3.742 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -6.566 16.510 1.428 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -5.829 16.454 -1.058 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -1.568 16.472 2.267 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -3.353 16.397 -2.445 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -0.061 16.415 0.290 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -0.882 16.379 -2.002 1.00 0.00 H new ATOM 1277 N TYR A 81 -5.754 13.758 3.595 1.00 0.00 N ATOM 1278 CA TYR A 81 -6.257 12.517 3.032 1.00 0.00 C ATOM 1279 C TYR A 81 -7.649 12.192 3.578 1.00 0.00 C ATOM 1280 O TYR A 81 -8.449 11.544 2.904 1.00 0.00 O ATOM 1281 CB TYR A 81 -5.280 11.426 3.475 1.00 0.00 C ATOM 1282 CG TYR A 81 -4.415 10.869 2.342 1.00 0.00 C ATOM 1283 CD1 TYR A 81 -3.230 11.492 2.009 1.00 0.00 C ATOM 1284 CD2 TYR A 81 -4.820 9.742 1.655 1.00 0.00 C ATOM 1285 CE1 TYR A 81 -2.416 10.968 0.943 1.00 0.00 C ATOM 1286 CE2 TYR A 81 -4.005 9.218 0.590 1.00 0.00 C ATOM 1287 CZ TYR A 81 -2.844 9.855 0.286 1.00 0.00 C ATOM 1288 OH TYR A 81 -2.075 9.360 -0.720 1.00 0.00 O ATOM 0 H TYR A 81 -4.889 13.665 4.127 1.00 0.00 H new ATOM 0 HA TYR A 81 -6.336 12.592 1.947 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -4.629 11.829 4.251 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -5.844 10.608 3.924 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -2.913 12.373 2.548 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -5.747 9.254 1.916 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -1.487 11.447 0.671 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -4.310 8.337 0.044 1.00 0.00 H new ATOM 0 HH TYR A 81 -2.274 8.409 -0.846 1.00 0.00 H new ATOM 1298 N ALA A 82 -7.895 12.655 4.794 1.00 0.00 N ATOM 1299 CA ALA A 82 -9.176 12.422 5.439 1.00 0.00 C ATOM 1300 C ALA A 82 -10.243 13.294 4.774 1.00 0.00 C ATOM 1301 O ALA A 82 -11.436 13.030 4.908 1.00 0.00 O ATOM 1302 CB ALA A 82 -9.050 12.696 6.939 1.00 0.00 C ATOM 0 H ALA A 82 -7.229 13.191 5.350 1.00 0.00 H new ATOM 0 HA ALA A 82 -9.481 11.382 5.323 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -10.011 12.521 7.423 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -8.301 12.031 7.369 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.748 13.732 7.096 1.00 0.00 H new ATOM 1308 N GLY A 83 -9.774 14.314 4.073 1.00 0.00 N ATOM 1309 CA GLY A 83 -10.673 15.227 3.386 1.00 0.00 C ATOM 1310 C GLY A 83 -10.944 14.757 1.955 1.00 0.00 C ATOM 1311 O GLY A 83 -11.910 15.189 1.328 1.00 0.00 O ATOM 0 H GLY A 83 -8.783 14.530 3.965 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -11.613 15.298 3.933 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -10.238 16.226 3.368 1.00 0.00 H new ATOM 1315 N LEU A 84 -10.073 13.878 1.481 1.00 0.00 N ATOM 1316 CA LEU A 84 -10.205 13.346 0.134 1.00 0.00 C ATOM 1317 C LEU A 84 -11.424 12.423 0.073 1.00 0.00 C ATOM 1318 O LEU A 84 -11.942 12.004 1.108 1.00 0.00 O ATOM 1319 CB LEU A 84 -8.903 12.676 -0.307 1.00 0.00 C ATOM 1320 CG LEU A 84 -7.667 13.577 -0.354 1.00 0.00 C ATOM 1321 CD1 LEU A 84 -6.398 12.755 -0.591 1.00 0.00 C ATOM 1322 CD2 LEU A 84 -7.835 14.684 -1.396 1.00 0.00 C ATOM 0 H LEU A 84 -9.274 13.521 2.005 1.00 0.00 H new ATOM 0 HA LEU A 84 -10.379 14.152 -0.579 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -8.698 11.846 0.369 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -9.055 12.249 -1.298 1.00 0.00 H new ATOM 0 HG LEU A 84 -7.561 14.062 0.617 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.534 13.419 -0.620 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -6.275 12.035 0.218 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.480 12.225 -1.540 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -6.943 15.310 -1.409 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -7.980 14.238 -2.380 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -8.702 15.294 -1.142 1.00 0.00 H new ATOM 1334 N ASN A 85 -11.844 12.133 -1.148 1.00 0.00 N ATOM 1335 CA ASN A 85 -12.993 11.266 -1.358 1.00 0.00 C ATOM 1336 C ASN A 85 -12.532 9.807 -1.359 1.00 0.00 C ATOM 1337 O ASN A 85 -11.357 9.524 -1.131 1.00 0.00 O ATOM 1338 CB ASN A 85 -13.661 11.553 -2.704 1.00 0.00 C ATOM 1339 CG ASN A 85 -14.145 13.002 -2.778 1.00 0.00 C ATOM 1340 OD1 ASN A 85 -13.919 13.806 -1.889 1.00 0.00 O ATOM 1341 ND2 ASN A 85 -14.823 13.290 -3.886 1.00 0.00 N ATOM 0 H ASN A 85 -11.411 12.482 -2.003 1.00 0.00 H new ATOM 0 HA ASN A 85 -13.707 11.451 -0.555 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -12.956 11.360 -3.512 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -14.504 10.877 -2.847 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -15.189 14.231 -4.030 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -14.977 12.570 -4.591 1.00 0.00 H new ATOM 1348 N TYR A 86 -13.480 8.921 -1.619 1.00 0.00 N ATOM 1349 CA TYR A 86 -13.186 7.498 -1.654 1.00 0.00 C ATOM 1350 C TYR A 86 -12.480 7.054 -0.372 1.00 0.00 C ATOM 1351 O TYR A 86 -11.340 6.593 -0.416 1.00 0.00 O ATOM 1352 CB TYR A 86 -12.244 7.292 -2.841 1.00 0.00 C ATOM 1353 CG TYR A 86 -12.873 7.604 -4.199 1.00 0.00 C ATOM 1354 CD1 TYR A 86 -14.050 6.986 -4.573 1.00 0.00 C ATOM 1355 CD2 TYR A 86 -12.267 8.505 -5.051 1.00 0.00 C ATOM 1356 CE1 TYR A 86 -14.643 7.281 -5.852 1.00 0.00 C ATOM 1357 CE2 TYR A 86 -12.860 8.799 -6.330 1.00 0.00 C ATOM 1358 CZ TYR A 86 -14.019 8.173 -6.667 1.00 0.00 C ATOM 1359 OH TYR A 86 -14.579 8.451 -7.874 1.00 0.00 O ATOM 0 H TYR A 86 -14.453 9.160 -1.808 1.00 0.00 H new ATOM 0 HA TYR A 86 -14.104 6.917 -1.744 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -11.365 7.922 -2.707 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -11.898 6.258 -2.842 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -14.526 6.282 -3.907 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -11.347 8.990 -4.758 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -15.563 6.804 -6.157 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -12.395 9.501 -7.006 1.00 0.00 H new ATOM 0 HH TYR A 86 -14.025 9.106 -8.349 1.00 0.00 H new ATOM 1369 N PRO A 87 -13.204 7.211 0.768 1.00 0.00 N ATOM 1370 CA PRO A 87 -12.659 6.831 2.060 1.00 0.00 C ATOM 1371 C PRO A 87 -12.658 5.309 2.229 1.00 0.00 C ATOM 1372 O PRO A 87 -12.256 4.797 3.270 1.00 0.00 O ATOM 1373 CB PRO A 87 -13.533 7.540 3.080 1.00 0.00 C ATOM 1374 CG PRO A 87 -14.811 7.914 2.347 1.00 0.00 C ATOM 1375 CD PRO A 87 -14.557 7.752 0.857 1.00 0.00 C ATOM 0 HA PRO A 87 -11.615 7.123 2.178 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -13.746 6.891 3.930 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -13.034 8.426 3.473 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -15.635 7.275 2.666 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -15.096 8.941 2.576 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -15.283 7.078 0.402 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -14.637 8.706 0.336 1.00 0.00 H new ATOM 1383 N LYS A 88 -13.114 4.630 1.186 1.00 0.00 N ATOM 1384 CA LYS A 88 -13.172 3.178 1.206 1.00 0.00 C ATOM 1385 C LYS A 88 -11.847 2.613 0.688 1.00 0.00 C ATOM 1386 O LYS A 88 -11.727 1.409 0.464 1.00 0.00 O ATOM 1387 CB LYS A 88 -14.396 2.680 0.434 1.00 0.00 C ATOM 1388 CG LYS A 88 -15.168 1.638 1.246 1.00 0.00 C ATOM 1389 CD LYS A 88 -16.416 1.172 0.494 1.00 0.00 C ATOM 1390 CE LYS A 88 -16.217 -0.230 -0.085 1.00 0.00 C ATOM 1391 NZ LYS A 88 -17.417 -1.063 0.149 1.00 0.00 N ATOM 0 H LYS A 88 -13.447 5.058 0.322 1.00 0.00 H new ATOM 0 HA LYS A 88 -13.298 2.815 2.226 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -15.049 3.520 0.199 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -14.081 2.246 -0.515 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -14.524 0.784 1.454 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -15.456 2.062 2.208 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -17.272 1.172 1.168 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -16.643 1.872 -0.310 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -16.017 -0.163 -1.154 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -15.347 -0.699 0.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -17.265 -2.011 -0.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -17.591 -1.142 1.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -18.240 -0.623 -0.309 1.00 0.00 H new ATOM 1404 N LEU A 89 -10.886 3.509 0.512 1.00 0.00 N ATOM 1405 CA LEU A 89 -9.576 3.114 0.026 1.00 0.00 C ATOM 1406 C LEU A 89 -8.636 2.905 1.216 1.00 0.00 C ATOM 1407 O LEU A 89 -8.676 3.663 2.183 1.00 0.00 O ATOM 1408 CB LEU A 89 -9.056 4.127 -0.997 1.00 0.00 C ATOM 1409 CG LEU A 89 -7.536 4.252 -1.105 1.00 0.00 C ATOM 1410 CD1 LEU A 89 -7.010 3.510 -2.335 1.00 0.00 C ATOM 1411 CD2 LEU A 89 -7.103 5.719 -1.092 1.00 0.00 C ATOM 0 H LEU A 89 -10.989 4.507 0.697 1.00 0.00 H new ATOM 0 HA LEU A 89 -9.637 2.163 -0.503 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -9.449 3.857 -1.977 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -9.464 5.107 -0.748 1.00 0.00 H new ATOM 0 HG LEU A 89 -7.092 3.778 -0.229 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -5.926 3.615 -2.388 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -7.269 2.454 -2.261 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.459 3.932 -3.234 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -6.017 5.779 -1.170 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -7.557 6.240 -1.935 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -7.426 6.185 -0.161 1.00 0.00 H new ATOM 1423 N PRO A 90 -7.792 1.845 1.102 1.00 0.00 N ATOM 1424 CA PRO A 90 -6.844 1.526 2.156 1.00 0.00 C ATOM 1425 C PRO A 90 -5.670 2.507 2.152 1.00 0.00 C ATOM 1426 O PRO A 90 -5.031 2.711 1.121 1.00 0.00 O ATOM 1427 CB PRO A 90 -6.422 0.092 1.885 1.00 0.00 C ATOM 1428 CG PRO A 90 -6.787 -0.184 0.435 1.00 0.00 C ATOM 1429 CD PRO A 90 -7.717 0.924 -0.030 1.00 0.00 C ATOM 0 HA PRO A 90 -7.276 1.617 3.153 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -5.352 -0.038 2.050 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -6.934 -0.599 2.555 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -5.891 -0.216 -0.185 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -7.273 -1.155 0.342 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -7.328 1.420 -0.919 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -8.701 0.533 -0.288 1.00 0.00 H new ATOM 1437 N VAL A 91 -5.421 3.087 3.318 1.00 0.00 N ATOM 1438 CA VAL A 91 -4.334 4.042 3.460 1.00 0.00 C ATOM 1439 C VAL A 91 -3.609 3.786 4.783 1.00 0.00 C ATOM 1440 O VAL A 91 -4.211 3.862 5.852 1.00 0.00 O ATOM 1441 CB VAL A 91 -4.873 5.469 3.342 1.00 0.00 C ATOM 1442 CG1 VAL A 91 -3.809 6.492 3.747 1.00 0.00 C ATOM 1443 CG2 VAL A 91 -5.387 5.744 1.927 1.00 0.00 C ATOM 0 H VAL A 91 -5.952 2.914 4.171 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.606 3.916 2.658 1.00 0.00 H new ATOM 0 HB VAL A 91 -5.713 5.569 4.030 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -4.218 7.498 3.654 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.510 6.316 4.780 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.941 6.391 3.096 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.765 6.765 1.869 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -4.573 5.617 1.213 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -6.190 5.046 1.689 1.00 0.00 H new ATOM 1453 N VAL A 92 -2.323 3.485 4.667 1.00 0.00 N ATOM 1454 CA VAL A 92 -1.508 3.215 5.840 1.00 0.00 C ATOM 1455 C VAL A 92 -0.444 4.306 5.976 1.00 0.00 C ATOM 1456 O VAL A 92 0.250 4.625 5.010 1.00 0.00 O ATOM 1457 CB VAL A 92 -0.915 1.808 5.754 1.00 0.00 C ATOM 1458 CG1 VAL A 92 -0.154 1.455 7.034 1.00 0.00 C ATOM 1459 CG2 VAL A 92 -2.002 0.772 5.457 1.00 0.00 C ATOM 0 H VAL A 92 -1.826 3.422 3.779 1.00 0.00 H new ATOM 0 HA VAL A 92 -2.118 3.240 6.743 1.00 0.00 H new ATOM 0 HB VAL A 92 -0.204 1.793 4.928 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.258 0.450 6.947 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.657 2.168 7.183 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.834 1.496 7.885 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.554 -0.220 5.401 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.748 0.789 6.252 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.480 1.008 4.506 1.00 0.00 H new ATOM 1469 N THR A 93 -0.348 4.848 7.180 1.00 0.00 N ATOM 1470 CA THR A 93 0.620 5.897 7.455 1.00 0.00 C ATOM 1471 C THR A 93 1.692 5.393 8.425 1.00 0.00 C ATOM 1472 O THR A 93 1.388 5.053 9.567 1.00 0.00 O ATOM 1473 CB THR A 93 -0.140 7.120 7.971 1.00 0.00 C ATOM 1474 OG1 THR A 93 -1.156 6.570 8.805 1.00 0.00 O ATOM 1475 CG2 THR A 93 -0.913 7.838 6.865 1.00 0.00 C ATOM 0 H THR A 93 -0.925 4.581 7.978 1.00 0.00 H new ATOM 0 HA THR A 93 1.155 6.188 6.551 1.00 0.00 H new ATOM 0 HB THR A 93 0.561 7.815 8.433 1.00 0.00 H new ATOM 0 HG1 THR A 93 -0.758 5.920 9.421 1.00 0.00 H new ATOM 0 HG21 THR A 93 -1.434 8.698 7.285 1.00 0.00 H new ATOM 0 HG22 THR A 93 -0.218 8.175 6.095 1.00 0.00 H new ATOM 0 HG23 THR A 93 -1.638 7.154 6.425 1.00 0.00 H new ATOM 1483 N ASP A 94 2.921 5.360 7.933 1.00 0.00 N ATOM 1484 CA ASP A 94 4.038 4.903 8.742 1.00 0.00 C ATOM 1485 C ASP A 94 5.004 6.067 8.975 1.00 0.00 C ATOM 1486 O ASP A 94 5.663 6.526 8.044 1.00 0.00 O ATOM 1487 CB ASP A 94 4.807 3.784 8.039 1.00 0.00 C ATOM 1488 CG ASP A 94 6.007 3.236 8.813 1.00 0.00 C ATOM 1489 OD1 ASP A 94 6.383 3.768 9.869 1.00 0.00 O ATOM 1490 OD2 ASP A 94 6.572 2.203 8.285 1.00 0.00 O ATOM 0 H ASP A 94 3.168 5.642 6.984 1.00 0.00 H new ATOM 0 HA ASP A 94 3.639 4.529 9.685 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.119 2.963 7.837 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.155 4.154 7.074 1.00 0.00 H new ATOM 1496 N ASN A 95 5.057 6.510 10.222 1.00 0.00 N ATOM 1497 CA ASN A 95 5.931 7.611 10.588 1.00 0.00 C ATOM 1498 C ASN A 95 7.378 7.241 10.255 1.00 0.00 C ATOM 1499 O ASN A 95 7.937 6.316 10.839 1.00 0.00 O ATOM 1500 CB ASN A 95 5.852 7.902 12.088 1.00 0.00 C ATOM 1501 CG ASN A 95 4.404 7.859 12.579 1.00 0.00 C ATOM 1502 OD1 ASN A 95 3.657 6.932 12.311 1.00 0.00 O ATOM 1503 ND2 ASN A 95 4.050 8.911 13.312 1.00 0.00 N ATOM 0 H ASN A 95 4.509 6.126 10.992 1.00 0.00 H new ATOM 0 HA ASN A 95 5.613 8.493 10.032 1.00 0.00 H new ATOM 0 HB2 ASN A 95 6.447 7.171 12.636 1.00 0.00 H new ATOM 0 HB3 ASN A 95 6.281 8.882 12.295 1.00 0.00 H new ATOM 0 HD21 ASN A 95 3.104 8.976 13.687 1.00 0.00 H new ATOM 0 HD22 ASN A 95 4.725 9.653 13.499 1.00 0.00 H new ATOM 1510 N GLY A 96 7.942 7.985 9.314 1.00 0.00 N ATOM 1511 CA GLY A 96 9.313 7.747 8.895 1.00 0.00 C ATOM 1512 C GLY A 96 9.377 6.659 7.822 1.00 0.00 C ATOM 1513 O GLY A 96 10.397 6.501 7.153 1.00 0.00 O ATOM 0 H GLY A 96 7.475 8.752 8.831 1.00 0.00 H new ATOM 0 HA2 GLY A 96 9.744 8.670 8.508 1.00 0.00 H new ATOM 0 HA3 GLY A 96 9.914 7.451 9.755 1.00 0.00 H new ATOM 1517 N GLY A 97 8.275 5.935 7.693 1.00 0.00 N ATOM 1518 CA GLY A 97 8.193 4.864 6.713 1.00 0.00 C ATOM 1519 C GLY A 97 9.261 3.799 6.975 1.00 0.00 C ATOM 1520 O GLY A 97 10.185 3.633 6.180 1.00 0.00 O ATOM 0 H GLY A 97 7.431 6.069 8.250 1.00 0.00 H new ATOM 0 HA2 GLY A 97 7.203 4.408 6.749 1.00 0.00 H new ATOM 0 HA3 GLY A 97 8.320 5.273 5.711 1.00 0.00 H new ATOM 1524 N THR A 98 9.097 3.104 8.090 1.00 0.00 N ATOM 1525 CA THR A 98 10.034 2.060 8.466 1.00 0.00 C ATOM 1526 C THR A 98 10.199 1.055 7.324 1.00 0.00 C ATOM 1527 O THR A 98 11.314 0.635 7.018 1.00 0.00 O ATOM 1528 CB THR A 98 9.539 1.426 9.767 1.00 0.00 C ATOM 1529 OG1 THR A 98 10.049 2.280 10.788 1.00 0.00 O ATOM 1530 CG2 THR A 98 10.199 0.074 10.048 1.00 0.00 C ATOM 0 H THR A 98 8.328 3.244 8.746 1.00 0.00 H new ATOM 0 HA THR A 98 11.029 2.467 8.645 1.00 0.00 H new ATOM 0 HB THR A 98 8.457 1.299 9.719 1.00 0.00 H new ATOM 0 HG1 THR A 98 9.773 1.942 11.665 1.00 0.00 H new ATOM 0 HG21 THR A 98 9.812 -0.332 10.983 1.00 0.00 H new ATOM 0 HG22 THR A 98 9.977 -0.615 9.233 1.00 0.00 H new ATOM 0 HG23 THR A 98 11.278 0.206 10.128 1.00 0.00 H new ATOM 1538 N ILE A 99 9.072 0.699 6.725 1.00 0.00 N ATOM 1539 CA ILE A 99 9.078 -0.248 5.624 1.00 0.00 C ATOM 1540 C ILE A 99 9.713 0.409 4.394 1.00 0.00 C ATOM 1541 O ILE A 99 10.536 -0.202 3.717 1.00 0.00 O ATOM 1542 CB ILE A 99 7.668 -0.787 5.372 1.00 0.00 C ATOM 1543 CG1 ILE A 99 7.144 -1.539 6.598 1.00 0.00 C ATOM 1544 CG2 ILE A 99 7.627 -1.650 4.111 1.00 0.00 C ATOM 1545 CD1 ILE A 99 5.786 -0.987 7.040 1.00 0.00 C ATOM 0 H ILE A 99 8.149 1.049 6.982 1.00 0.00 H new ATOM 0 HA ILE A 99 9.687 -1.117 5.873 1.00 0.00 H new ATOM 0 HB ILE A 99 7.003 0.060 5.203 1.00 0.00 H new ATOM 0 HG12 ILE A 99 7.052 -2.600 6.366 1.00 0.00 H new ATOM 0 HG13 ILE A 99 7.860 -1.452 7.416 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.613 -2.020 3.956 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.931 -1.053 3.251 1.00 0.00 H new ATOM 0 HG23 ILE A 99 8.308 -2.494 4.225 1.00 0.00 H new ATOM 0 HD11 ILE A 99 5.436 -1.538 7.913 1.00 0.00 H new ATOM 0 HD12 ILE A 99 5.887 0.068 7.294 1.00 0.00 H new ATOM 0 HD13 ILE A 99 5.067 -1.097 6.228 1.00 0.00 H new ATOM 1557 N ALA A 100 9.304 1.645 4.148 1.00 0.00 N ATOM 1558 CA ALA A 100 9.822 2.390 3.012 1.00 0.00 C ATOM 1559 C ALA A 100 11.346 2.484 3.122 1.00 0.00 C ATOM 1560 O ALA A 100 12.053 2.348 2.125 1.00 0.00 O ATOM 1561 CB ALA A 100 9.155 3.766 2.958 1.00 0.00 C ATOM 0 H ALA A 100 8.621 2.149 4.714 1.00 0.00 H new ATOM 0 HA ALA A 100 9.590 1.878 2.078 1.00 0.00 H new ATOM 0 HB1 ALA A 100 9.543 4.325 2.107 1.00 0.00 H new ATOM 0 HB2 ALA A 100 8.077 3.644 2.851 1.00 0.00 H new ATOM 0 HB3 ALA A 100 9.369 4.311 3.878 1.00 0.00 H new ATOM 1567 N GLN A 101 11.806 2.717 4.343 1.00 0.00 N ATOM 1568 CA GLN A 101 13.232 2.832 4.596 1.00 0.00 C ATOM 1569 C GLN A 101 13.866 1.443 4.694 1.00 0.00 C ATOM 1570 O GLN A 101 14.986 1.233 4.228 1.00 0.00 O ATOM 1571 CB GLN A 101 13.500 3.648 5.862 1.00 0.00 C ATOM 1572 CG GLN A 101 13.885 5.087 5.514 1.00 0.00 C ATOM 1573 CD GLN A 101 14.887 5.646 6.527 1.00 0.00 C ATOM 1574 OE1 GLN A 101 15.218 5.021 7.522 1.00 0.00 O ATOM 1575 NE2 GLN A 101 15.349 6.854 6.220 1.00 0.00 N ATOM 0 H GLN A 101 11.216 2.829 5.168 1.00 0.00 H new ATOM 0 HA GLN A 101 13.689 3.361 3.760 1.00 0.00 H new ATOM 0 HB2 GLN A 101 12.612 3.648 6.494 1.00 0.00 H new ATOM 0 HB3 GLN A 101 14.300 3.182 6.437 1.00 0.00 H new ATOM 0 HG2 GLN A 101 14.317 5.120 4.514 1.00 0.00 H new ATOM 0 HG3 GLN A 101 12.992 5.712 5.497 1.00 0.00 H new ATOM 0 HE21 GLN A 101 15.030 7.321 5.371 1.00 0.00 H new ATOM 0 HE22 GLN A 101 16.022 7.313 6.833 1.00 0.00 H new ATOM 1584 N SER A 102 13.123 0.530 5.302 1.00 0.00 N ATOM 1585 CA SER A 102 13.599 -0.834 5.469 1.00 0.00 C ATOM 1586 C SER A 102 13.844 -1.473 4.100 1.00 0.00 C ATOM 1587 O SER A 102 14.824 -2.190 3.911 1.00 0.00 O ATOM 1588 CB SER A 102 12.604 -1.670 6.273 1.00 0.00 C ATOM 1589 OG SER A 102 13.044 -3.017 6.432 1.00 0.00 O ATOM 0 H SER A 102 12.195 0.707 5.685 1.00 0.00 H new ATOM 0 HA SER A 102 14.537 -0.803 6.023 1.00 0.00 H new ATOM 0 HB2 SER A 102 12.460 -1.218 7.254 1.00 0.00 H new ATOM 0 HB3 SER A 102 11.636 -1.662 5.773 1.00 0.00 H new ATOM 0 HG SER A 102 12.382 -3.518 6.952 1.00 0.00 H new ATOM 1595 N LEU A 103 12.936 -1.188 3.178 1.00 0.00 N ATOM 1596 CA LEU A 103 13.039 -1.725 1.833 1.00 0.00 C ATOM 1597 C LEU A 103 13.947 -0.821 0.995 1.00 0.00 C ATOM 1598 O LEU A 103 14.414 -1.219 -0.071 1.00 0.00 O ATOM 1599 CB LEU A 103 11.649 -1.928 1.227 1.00 0.00 C ATOM 1600 CG LEU A 103 10.850 -3.116 1.768 1.00 0.00 C ATOM 1601 CD1 LEU A 103 9.397 -3.062 1.292 1.00 0.00 C ATOM 1602 CD2 LEU A 103 11.523 -4.441 1.405 1.00 0.00 C ATOM 0 H LEU A 103 12.124 -0.591 3.337 1.00 0.00 H new ATOM 0 HA LEU A 103 13.500 -2.712 1.853 1.00 0.00 H new ATOM 0 HB2 LEU A 103 11.068 -1.020 1.389 1.00 0.00 H new ATOM 0 HB3 LEU A 103 11.758 -2.049 0.149 1.00 0.00 H new ATOM 0 HG LEU A 103 10.835 -3.050 2.856 1.00 0.00 H new ATOM 0 HD11 LEU A 103 8.852 -3.917 1.691 1.00 0.00 H new ATOM 0 HD12 LEU A 103 8.933 -2.140 1.643 1.00 0.00 H new ATOM 0 HD13 LEU A 103 9.370 -3.090 0.203 1.00 0.00 H new ATOM 0 HD21 LEU A 103 10.935 -5.269 1.801 1.00 0.00 H new ATOM 0 HD22 LEU A 103 11.590 -4.530 0.321 1.00 0.00 H new ATOM 0 HD23 LEU A 103 12.525 -4.470 1.834 1.00 0.00 H new ATOM 1614 N ASN A 104 14.169 0.380 1.510 1.00 0.00 N ATOM 1615 CA ASN A 104 15.013 1.344 0.824 1.00 0.00 C ATOM 1616 C ASN A 104 14.322 1.792 -0.465 1.00 0.00 C ATOM 1617 O ASN A 104 14.912 1.735 -1.542 1.00 0.00 O ATOM 1618 CB ASN A 104 16.361 0.727 0.447 1.00 0.00 C ATOM 1619 CG ASN A 104 17.343 1.800 -0.026 1.00 0.00 C ATOM 1620 OD1 ASN A 104 17.672 2.735 0.685 1.00 0.00 O ATOM 1621 ND2 ASN A 104 17.792 1.614 -1.265 1.00 0.00 N ATOM 0 H ASN A 104 13.779 0.707 2.394 1.00 0.00 H new ATOM 0 HA ASN A 104 15.178 2.186 1.496 1.00 0.00 H new ATOM 0 HB2 ASN A 104 16.777 0.202 1.306 1.00 0.00 H new ATOM 0 HB3 ASN A 104 16.219 -0.013 -0.341 1.00 0.00 H new ATOM 0 HD21 ASN A 104 18.452 2.276 -1.673 1.00 0.00 H new ATOM 0 HD22 ASN A 104 17.476 0.809 -1.807 1.00 0.00 H new ATOM 1628 N ILE A 105 13.080 2.229 -0.313 1.00 0.00 N ATOM 1629 CA ILE A 105 12.303 2.688 -1.451 1.00 0.00 C ATOM 1630 C ILE A 105 12.746 4.103 -1.828 1.00 0.00 C ATOM 1631 O ILE A 105 13.771 4.282 -2.485 1.00 0.00 O ATOM 1632 CB ILE A 105 10.806 2.570 -1.159 1.00 0.00 C ATOM 1633 CG1 ILE A 105 10.421 1.122 -0.849 1.00 0.00 C ATOM 1634 CG2 ILE A 105 9.977 3.151 -2.306 1.00 0.00 C ATOM 1635 CD1 ILE A 105 8.967 1.031 -0.376 1.00 0.00 C ATOM 0 H ILE A 105 12.593 2.275 0.582 1.00 0.00 H new ATOM 0 HA ILE A 105 12.487 2.054 -2.319 1.00 0.00 H new ATOM 0 HB ILE A 105 10.583 3.160 -0.270 1.00 0.00 H new ATOM 0 HG12 ILE A 105 10.557 0.507 -1.739 1.00 0.00 H new ATOM 0 HG13 ILE A 105 11.083 0.722 -0.081 1.00 0.00 H new ATOM 0 HG21 ILE A 105 8.916 3.055 -2.074 1.00 0.00 H new ATOM 0 HG22 ILE A 105 10.226 4.204 -2.437 1.00 0.00 H new ATOM 0 HG23 ILE A 105 10.198 2.609 -3.225 1.00 0.00 H new ATOM 0 HD11 ILE A 105 8.718 -0.009 -0.162 1.00 0.00 H new ATOM 0 HD12 ILE A 105 8.840 1.628 0.527 1.00 0.00 H new ATOM 0 HD13 ILE A 105 8.306 1.409 -1.156 1.00 0.00 H new ATOM 1647 N SER A 106 11.952 5.073 -1.398 1.00 0.00 N ATOM 1648 CA SER A 106 12.249 6.465 -1.684 1.00 0.00 C ATOM 1649 C SER A 106 11.753 6.831 -3.084 1.00 0.00 C ATOM 1650 O SER A 106 11.797 7.995 -3.478 1.00 0.00 O ATOM 1651 CB SER A 106 13.748 6.745 -1.563 1.00 0.00 C ATOM 1652 OG SER A 106 14.429 6.558 -2.801 1.00 0.00 O ATOM 0 H SER A 106 11.103 4.921 -0.853 1.00 0.00 H new ATOM 0 HA SER A 106 11.731 7.082 -0.950 1.00 0.00 H new ATOM 0 HB2 SER A 106 13.899 7.768 -1.217 1.00 0.00 H new ATOM 0 HB3 SER A 106 14.180 6.087 -0.809 1.00 0.00 H new ATOM 0 HG SER A 106 14.200 5.680 -3.171 1.00 0.00 H new ATOM 1658 N VAL A 107 11.293 5.813 -3.798 1.00 0.00 N ATOM 1659 CA VAL A 107 10.790 6.013 -5.146 1.00 0.00 C ATOM 1660 C VAL A 107 9.325 5.574 -5.208 1.00 0.00 C ATOM 1661 O VAL A 107 8.977 4.490 -4.744 1.00 0.00 O ATOM 1662 CB VAL A 107 11.678 5.275 -6.151 1.00 0.00 C ATOM 1663 CG1 VAL A 107 11.968 3.847 -5.681 1.00 0.00 C ATOM 1664 CG2 VAL A 107 11.046 5.276 -7.544 1.00 0.00 C ATOM 0 H VAL A 107 11.258 4.848 -3.468 1.00 0.00 H new ATOM 0 HA VAL A 107 10.826 7.069 -5.415 1.00 0.00 H new ATOM 0 HB VAL A 107 12.628 5.806 -6.213 1.00 0.00 H new ATOM 0 HG11 VAL A 107 12.601 3.345 -6.413 1.00 0.00 H new ATOM 0 HG12 VAL A 107 12.480 3.877 -4.719 1.00 0.00 H new ATOM 0 HG13 VAL A 107 11.030 3.301 -5.576 1.00 0.00 H new ATOM 0 HG21 VAL A 107 11.697 4.746 -8.239 1.00 0.00 H new ATOM 0 HG22 VAL A 107 10.076 4.780 -7.504 1.00 0.00 H new ATOM 0 HG23 VAL A 107 10.914 6.304 -7.883 1.00 0.00 H new ATOM 1674 N TYR A 108 8.507 6.441 -5.788 1.00 0.00 N ATOM 1675 CA TYR A 108 7.086 6.157 -5.917 1.00 0.00 C ATOM 1676 C TYR A 108 6.603 6.419 -7.346 1.00 0.00 C ATOM 1677 O TYR A 108 7.185 7.231 -8.062 1.00 0.00 O ATOM 1678 CB TYR A 108 6.376 7.121 -4.966 1.00 0.00 C ATOM 1679 CG TYR A 108 6.720 6.906 -3.490 1.00 0.00 C ATOM 1680 CD1 TYR A 108 7.046 5.644 -3.034 1.00 0.00 C ATOM 1681 CD2 TYR A 108 6.708 7.974 -2.616 1.00 0.00 C ATOM 1682 CE1 TYR A 108 7.371 5.441 -1.646 1.00 0.00 C ATOM 1683 CE2 TYR A 108 7.032 7.772 -1.228 1.00 0.00 C ATOM 1684 CZ TYR A 108 7.349 6.516 -0.812 1.00 0.00 C ATOM 1685 OH TYR A 108 7.656 6.325 0.500 1.00 0.00 O ATOM 0 H TYR A 108 8.800 7.339 -6.173 1.00 0.00 H new ATOM 0 HA TYR A 108 6.880 5.112 -5.684 1.00 0.00 H new ATOM 0 HB2 TYR A 108 6.633 8.143 -5.243 1.00 0.00 H new ATOM 0 HB3 TYR A 108 5.299 7.016 -5.096 1.00 0.00 H new ATOM 0 HD1 TYR A 108 7.057 4.809 -3.719 1.00 0.00 H new ATOM 0 HD2 TYR A 108 6.456 8.961 -2.973 1.00 0.00 H new ATOM 0 HE1 TYR A 108 7.626 4.459 -1.276 1.00 0.00 H new ATOM 0 HE2 TYR A 108 7.024 8.598 -0.533 1.00 0.00 H new ATOM 0 HH TYR A 108 7.601 7.180 0.977 1.00 0.00 H new ATOM 1695 N PRO A 109 5.515 5.698 -7.725 1.00 0.00 N ATOM 1696 CA PRO A 109 4.885 4.757 -6.813 1.00 0.00 C ATOM 1697 C PRO A 109 5.723 3.485 -6.676 1.00 0.00 C ATOM 1698 O PRO A 109 6.649 3.259 -7.453 1.00 0.00 O ATOM 1699 CB PRO A 109 3.508 4.501 -7.403 1.00 0.00 C ATOM 1700 CG PRO A 109 3.589 4.939 -8.857 1.00 0.00 C ATOM 1701 CD PRO A 109 4.857 5.759 -9.027 1.00 0.00 C ATOM 0 HA PRO A 109 4.803 5.144 -5.797 1.00 0.00 H new ATOM 0 HB2 PRO A 109 3.240 3.447 -7.327 1.00 0.00 H new ATOM 0 HB3 PRO A 109 2.743 5.064 -6.868 1.00 0.00 H new ATOM 0 HG2 PRO A 109 3.604 4.071 -9.517 1.00 0.00 H new ATOM 0 HG3 PRO A 109 2.714 5.529 -9.127 1.00 0.00 H new ATOM 0 HD2 PRO A 109 5.492 5.348 -9.811 1.00 0.00 H new ATOM 0 HD3 PRO A 109 4.629 6.787 -9.308 1.00 0.00 H new ATOM 1709 N SER A 110 5.369 2.686 -5.679 1.00 0.00 N ATOM 1710 CA SER A 110 6.075 1.443 -5.429 1.00 0.00 C ATOM 1711 C SER A 110 5.089 0.359 -4.987 1.00 0.00 C ATOM 1712 O SER A 110 3.947 0.658 -4.643 1.00 0.00 O ATOM 1713 CB SER A 110 7.164 1.632 -4.370 1.00 0.00 C ATOM 1714 OG SER A 110 8.464 1.703 -4.949 1.00 0.00 O ATOM 0 H SER A 110 4.601 2.877 -5.035 1.00 0.00 H new ATOM 0 HA SER A 110 6.556 1.131 -6.356 1.00 0.00 H new ATOM 0 HB2 SER A 110 6.968 2.544 -3.807 1.00 0.00 H new ATOM 0 HB3 SER A 110 7.128 0.805 -3.661 1.00 0.00 H new ATOM 0 HG SER A 110 8.767 2.635 -4.960 1.00 0.00 H new ATOM 1720 N TRP A 111 5.568 -0.876 -5.012 1.00 0.00 N ATOM 1721 CA TRP A 111 4.742 -2.006 -4.619 1.00 0.00 C ATOM 1722 C TRP A 111 5.625 -2.994 -3.854 1.00 0.00 C ATOM 1723 O TRP A 111 6.783 -3.202 -4.212 1.00 0.00 O ATOM 1724 CB TRP A 111 4.056 -2.633 -5.834 1.00 0.00 C ATOM 1725 CG TRP A 111 2.971 -1.754 -6.459 1.00 0.00 C ATOM 1726 CD1 TRP A 111 3.127 -0.737 -7.318 1.00 0.00 C ATOM 1727 CD2 TRP A 111 1.549 -1.857 -6.239 1.00 0.00 C ATOM 1728 NE1 TRP A 111 1.914 -0.179 -7.664 1.00 0.00 N ATOM 1729 CE2 TRP A 111 0.924 -0.880 -6.989 1.00 0.00 C ATOM 1730 CE3 TRP A 111 0.815 -2.743 -5.431 1.00 0.00 C ATOM 1731 CZ2 TRP A 111 -0.464 -0.699 -7.006 1.00 0.00 C ATOM 1732 CZ3 TRP A 111 -0.573 -2.549 -5.461 1.00 0.00 C ATOM 1733 CH2 TRP A 111 -1.215 -1.571 -6.210 1.00 0.00 C ATOM 0 H TRP A 111 6.516 -1.119 -5.298 1.00 0.00 H new ATOM 0 HA TRP A 111 3.933 -1.683 -3.964 1.00 0.00 H new ATOM 0 HB2 TRP A 111 4.810 -2.854 -6.590 1.00 0.00 H new ATOM 0 HB3 TRP A 111 3.613 -3.584 -5.538 1.00 0.00 H new ATOM 0 HD1 TRP A 111 4.082 -0.397 -7.692 1.00 0.00 H new ATOM 0 HE1 TRP A 111 1.771 0.606 -8.300 1.00 0.00 H new ATOM 0 HE3 TRP A 111 1.283 -3.512 -4.835 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 -0.930 0.072 -7.601 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 -1.185 -3.205 -4.860 1.00 0.00 H new ATOM 0 HH2 TRP A 111 -2.291 -1.484 -6.178 1.00 0.00 H new ATOM 1744 N ALA A 112 5.045 -3.577 -2.815 1.00 0.00 N ATOM 1745 CA ALA A 112 5.765 -4.538 -1.998 1.00 0.00 C ATOM 1746 C ALA A 112 4.880 -5.763 -1.761 1.00 0.00 C ATOM 1747 O ALA A 112 3.693 -5.628 -1.466 1.00 0.00 O ATOM 1748 CB ALA A 112 6.201 -3.872 -0.691 1.00 0.00 C ATOM 0 H ALA A 112 4.084 -3.402 -2.520 1.00 0.00 H new ATOM 0 HA ALA A 112 6.667 -4.876 -2.508 1.00 0.00 H new ATOM 0 HB1 ALA A 112 6.741 -4.593 -0.078 1.00 0.00 H new ATOM 0 HB2 ALA A 112 6.851 -3.026 -0.913 1.00 0.00 H new ATOM 0 HB3 ALA A 112 5.322 -3.522 -0.150 1.00 0.00 H new ATOM 1754 N LEU A 113 5.492 -6.931 -1.898 1.00 0.00 N ATOM 1755 CA LEU A 113 4.773 -8.178 -1.702 1.00 0.00 C ATOM 1756 C LEU A 113 5.241 -8.832 -0.400 1.00 0.00 C ATOM 1757 O LEU A 113 6.440 -8.913 -0.138 1.00 0.00 O ATOM 1758 CB LEU A 113 4.921 -9.080 -2.929 1.00 0.00 C ATOM 1759 CG LEU A 113 4.127 -10.388 -2.901 1.00 0.00 C ATOM 1760 CD1 LEU A 113 2.624 -10.115 -2.815 1.00 0.00 C ATOM 1761 CD2 LEU A 113 4.480 -11.271 -4.099 1.00 0.00 C ATOM 0 H LEU A 113 6.476 -7.039 -2.142 1.00 0.00 H new ATOM 0 HA LEU A 113 3.704 -7.989 -1.600 1.00 0.00 H new ATOM 0 HB2 LEU A 113 4.619 -8.514 -3.810 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.977 -9.322 -3.052 1.00 0.00 H new ATOM 0 HG LEU A 113 4.408 -10.938 -2.002 1.00 0.00 H new ATOM 0 HD11 LEU A 113 2.083 -11.061 -2.797 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.407 -9.555 -1.905 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.310 -9.534 -3.682 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.901 -12.194 -4.054 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.247 -10.741 -5.023 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.544 -11.508 -4.075 1.00 0.00 H new ATOM 1773 N ILE A 114 4.270 -9.281 0.382 1.00 0.00 N ATOM 1774 CA ILE A 114 4.568 -9.925 1.650 1.00 0.00 C ATOM 1775 C ILE A 114 3.964 -11.330 1.657 1.00 0.00 C ATOM 1776 O ILE A 114 2.778 -11.502 1.380 1.00 0.00 O ATOM 1777 CB ILE A 114 4.105 -9.050 2.816 1.00 0.00 C ATOM 1778 CG1 ILE A 114 4.677 -7.635 2.703 1.00 0.00 C ATOM 1779 CG2 ILE A 114 4.446 -9.700 4.159 1.00 0.00 C ATOM 1780 CD1 ILE A 114 6.183 -7.630 2.971 1.00 0.00 C ATOM 0 H ILE A 114 3.276 -9.212 0.162 1.00 0.00 H new ATOM 0 HA ILE A 114 5.645 -10.040 1.776 1.00 0.00 H new ATOM 0 HB ILE A 114 3.020 -8.963 2.766 1.00 0.00 H new ATOM 0 HG12 ILE A 114 4.480 -7.238 1.707 1.00 0.00 H new ATOM 0 HG13 ILE A 114 4.175 -6.978 3.414 1.00 0.00 H new ATOM 0 HG21 ILE A 114 4.106 -9.057 4.971 1.00 0.00 H new ATOM 0 HG22 ILE A 114 3.951 -10.668 4.231 1.00 0.00 H new ATOM 0 HG23 ILE A 114 5.525 -9.838 4.233 1.00 0.00 H new ATOM 0 HD11 ILE A 114 6.565 -6.613 2.884 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.375 -8.005 3.976 1.00 0.00 H new ATOM 0 HD13 ILE A 114 6.684 -8.269 2.244 1.00 0.00 H new ATOM 1792 N GLY A 115 4.806 -12.300 1.980 1.00 0.00 N ATOM 1793 CA GLY A 115 4.371 -13.686 2.027 1.00 0.00 C ATOM 1794 C GLY A 115 3.130 -13.839 2.908 1.00 0.00 C ATOM 1795 O GLY A 115 2.760 -12.918 3.633 1.00 0.00 O ATOM 0 H GLY A 115 5.788 -12.154 2.212 1.00 0.00 H new ATOM 0 HA2 GLY A 115 4.152 -14.037 1.019 1.00 0.00 H new ATOM 0 HA3 GLY A 115 5.176 -14.311 2.414 1.00 0.00 H new ATOM 1799 N LYS A 116 2.519 -15.013 2.816 1.00 0.00 N ATOM 1800 CA LYS A 116 1.326 -15.298 3.594 1.00 0.00 C ATOM 1801 C LYS A 116 1.713 -15.480 5.064 1.00 0.00 C ATOM 1802 O LYS A 116 0.846 -15.597 5.929 1.00 0.00 O ATOM 1803 CB LYS A 116 0.575 -16.493 3.004 1.00 0.00 C ATOM 1804 CG LYS A 116 1.373 -17.785 3.182 1.00 0.00 C ATOM 1805 CD LYS A 116 1.383 -18.606 1.891 1.00 0.00 C ATOM 1806 CE LYS A 116 2.651 -18.336 1.077 1.00 0.00 C ATOM 1807 NZ LYS A 116 3.449 -19.575 0.933 1.00 0.00 N ATOM 0 H LYS A 116 2.829 -15.776 2.215 1.00 0.00 H new ATOM 0 HA LYS A 116 0.631 -14.459 3.548 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.396 -16.592 3.489 1.00 0.00 H new ATOM 0 HB3 LYS A 116 0.386 -16.321 1.944 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.396 -17.547 3.474 1.00 0.00 H new ATOM 0 HG3 LYS A 116 0.940 -18.376 3.989 1.00 0.00 H new ATOM 0 HD2 LYS A 116 1.320 -19.667 2.131 1.00 0.00 H new ATOM 0 HD3 LYS A 116 0.505 -18.361 1.294 1.00 0.00 H new ATOM 0 HE2 LYS A 116 2.383 -17.952 0.092 1.00 0.00 H new ATOM 0 HE3 LYS A 116 3.248 -17.567 1.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 4.305 -19.374 0.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 3.720 -19.925 1.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 2.883 -20.298 0.445 1.00 0.00 H new ATOM 1820 N ASP A 117 3.017 -15.500 5.301 1.00 0.00 N ATOM 1821 CA ASP A 117 3.530 -15.665 6.650 1.00 0.00 C ATOM 1822 C ASP A 117 4.019 -14.314 7.175 1.00 0.00 C ATOM 1823 O ASP A 117 4.522 -14.224 8.294 1.00 0.00 O ATOM 1824 CB ASP A 117 4.711 -16.638 6.675 1.00 0.00 C ATOM 1825 CG ASP A 117 4.330 -18.117 6.779 1.00 0.00 C ATOM 1826 OD1 ASP A 117 3.198 -18.508 6.458 1.00 0.00 O ATOM 1827 OD2 ASP A 117 5.263 -18.890 7.218 1.00 0.00 O ATOM 0 H ASP A 117 3.733 -15.405 4.581 1.00 0.00 H new ATOM 0 HA ASP A 117 2.725 -16.059 7.271 1.00 0.00 H new ATOM 0 HB2 ASP A 117 5.301 -16.493 5.770 1.00 0.00 H new ATOM 0 HB3 ASP A 117 5.354 -16.384 7.518 1.00 0.00 H new ATOM 1833 N GLY A 118 3.856 -13.297 6.341 1.00 0.00 N ATOM 1834 CA GLY A 118 4.275 -11.956 6.707 1.00 0.00 C ATOM 1835 C GLY A 118 5.779 -11.775 6.498 1.00 0.00 C ATOM 1836 O GLY A 118 6.430 -11.050 7.249 1.00 0.00 O ATOM 0 H GLY A 118 3.439 -13.376 5.413 1.00 0.00 H new ATOM 0 HA2 GLY A 118 3.731 -11.225 6.109 1.00 0.00 H new ATOM 0 HA3 GLY A 118 4.024 -11.765 7.750 1.00 0.00 H new ATOM 1840 N ASP A 119 6.287 -12.445 5.475 1.00 0.00 N ATOM 1841 CA ASP A 119 7.703 -12.368 5.158 1.00 0.00 C ATOM 1842 C ASP A 119 7.877 -11.758 3.766 1.00 0.00 C ATOM 1843 O ASP A 119 7.168 -12.127 2.830 1.00 0.00 O ATOM 1844 CB ASP A 119 8.342 -13.756 5.150 1.00 0.00 C ATOM 1845 CG ASP A 119 7.984 -14.627 3.943 1.00 0.00 C ATOM 1846 OD1 ASP A 119 8.567 -14.485 2.858 1.00 0.00 O ATOM 1847 OD2 ASP A 119 7.050 -15.492 4.154 1.00 0.00 O ATOM 0 H ASP A 119 5.743 -13.044 4.854 1.00 0.00 H new ATOM 0 HA ASP A 119 8.186 -11.754 5.918 1.00 0.00 H new ATOM 0 HB2 ASP A 119 9.425 -13.641 5.187 1.00 0.00 H new ATOM 0 HB3 ASP A 119 8.046 -14.281 6.058 1.00 0.00 H new ATOM 1853 N VAL A 120 8.825 -10.838 3.671 1.00 0.00 N ATOM 1854 CA VAL A 120 9.100 -10.174 2.407 1.00 0.00 C ATOM 1855 C VAL A 120 9.131 -11.215 1.287 1.00 0.00 C ATOM 1856 O VAL A 120 9.986 -12.100 1.278 1.00 0.00 O ATOM 1857 CB VAL A 120 10.398 -9.371 2.511 1.00 0.00 C ATOM 1858 CG1 VAL A 120 10.854 -8.886 1.133 1.00 0.00 C ATOM 1859 CG2 VAL A 120 10.239 -8.197 3.480 1.00 0.00 C ATOM 0 H VAL A 120 9.413 -10.536 4.448 1.00 0.00 H new ATOM 0 HA VAL A 120 8.310 -9.462 2.169 1.00 0.00 H new ATOM 0 HB VAL A 120 11.170 -10.031 2.907 1.00 0.00 H new ATOM 0 HG11 VAL A 120 11.779 -8.318 1.235 1.00 0.00 H new ATOM 0 HG12 VAL A 120 11.025 -9.744 0.483 1.00 0.00 H new ATOM 0 HG13 VAL A 120 10.083 -8.250 0.698 1.00 0.00 H new ATOM 0 HG21 VAL A 120 11.176 -7.642 3.536 1.00 0.00 H new ATOM 0 HG22 VAL A 120 9.447 -7.537 3.125 1.00 0.00 H new ATOM 0 HG23 VAL A 120 9.981 -8.574 4.470 1.00 0.00 H new ATOM 1869 N GLN A 121 8.187 -11.075 0.367 1.00 0.00 N ATOM 1870 CA GLN A 121 8.095 -11.993 -0.757 1.00 0.00 C ATOM 1871 C GLN A 121 8.870 -11.443 -1.955 1.00 0.00 C ATOM 1872 O GLN A 121 9.833 -12.059 -2.412 1.00 0.00 O ATOM 1873 CB GLN A 121 6.634 -12.262 -1.126 1.00 0.00 C ATOM 1874 CG GLN A 121 6.163 -13.601 -0.556 1.00 0.00 C ATOM 1875 CD GLN A 121 6.912 -14.768 -1.204 1.00 0.00 C ATOM 1876 OE1 GLN A 121 7.630 -14.613 -2.178 1.00 0.00 O ATOM 1877 NE2 GLN A 121 6.706 -15.940 -0.611 1.00 0.00 N ATOM 0 H GLN A 121 7.480 -10.340 0.377 1.00 0.00 H new ATOM 0 HA GLN A 121 8.543 -12.943 -0.464 1.00 0.00 H new ATOM 0 HB2 GLN A 121 6.005 -11.458 -0.744 1.00 0.00 H new ATOM 0 HB3 GLN A 121 6.524 -12.265 -2.210 1.00 0.00 H new ATOM 0 HG2 GLN A 121 6.321 -13.617 0.522 1.00 0.00 H new ATOM 0 HG3 GLN A 121 5.092 -13.714 -0.723 1.00 0.00 H new ATOM 0 HE21 GLN A 121 6.092 -16.000 0.201 1.00 0.00 H new ATOM 0 HE22 GLN A 121 7.162 -16.780 -0.968 1.00 0.00 H new ATOM 1886 N ARG A 122 8.424 -10.290 -2.431 1.00 0.00 N ATOM 1887 CA ARG A 122 9.065 -9.651 -3.567 1.00 0.00 C ATOM 1888 C ARG A 122 8.746 -8.155 -3.585 1.00 0.00 C ATOM 1889 O ARG A 122 7.606 -7.757 -3.343 1.00 0.00 O ATOM 1890 CB ARG A 122 8.604 -10.279 -4.884 1.00 0.00 C ATOM 1891 CG ARG A 122 9.599 -9.987 -6.009 1.00 0.00 C ATOM 1892 CD ARG A 122 10.516 -11.188 -6.255 1.00 0.00 C ATOM 1893 NE ARG A 122 11.611 -10.808 -7.176 1.00 0.00 N ATOM 1894 CZ ARG A 122 12.611 -9.961 -6.856 1.00 0.00 C ATOM 1895 NH1 ARG A 122 12.665 -9.395 -5.631 1.00 0.00 N ATOM 1896 NH2 ARG A 122 13.536 -9.692 -7.759 1.00 0.00 N ATOM 0 H ARG A 122 7.626 -9.782 -2.050 1.00 0.00 H new ATOM 0 HA ARG A 122 10.141 -9.795 -3.465 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.497 -11.357 -4.759 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.622 -9.890 -5.152 1.00 0.00 H new ATOM 0 HG2 ARG A 122 9.058 -9.744 -6.924 1.00 0.00 H new ATOM 0 HG3 ARG A 122 10.198 -9.114 -5.752 1.00 0.00 H new ATOM 0 HD2 ARG A 122 10.930 -11.540 -5.310 1.00 0.00 H new ATOM 0 HD3 ARG A 122 9.943 -12.013 -6.679 1.00 0.00 H new ATOM 0 HE ARG A 122 11.609 -11.212 -8.112 1.00 0.00 H new ATOM 0 HH11 ARG A 122 11.946 -9.607 -4.939 1.00 0.00 H new ATOM 0 HH12 ARG A 122 13.425 -8.756 -5.398 1.00 0.00 H new ATOM 0 HH21 ARG A 122 13.488 -10.122 -8.682 1.00 0.00 H new ATOM 0 HH22 ARG A 122 14.299 -9.054 -7.533 1.00 0.00 H new ATOM 1909 N ILE A 123 9.771 -7.367 -3.873 1.00 0.00 N ATOM 1910 CA ILE A 123 9.613 -5.923 -3.926 1.00 0.00 C ATOM 1911 C ILE A 123 9.438 -5.485 -5.381 1.00 0.00 C ATOM 1912 O ILE A 123 10.133 -5.976 -6.269 1.00 0.00 O ATOM 1913 CB ILE A 123 10.777 -5.232 -3.211 1.00 0.00 C ATOM 1914 CG1 ILE A 123 10.587 -3.713 -3.198 1.00 0.00 C ATOM 1915 CG2 ILE A 123 12.116 -5.636 -3.828 1.00 0.00 C ATOM 1916 CD1 ILE A 123 10.530 -3.181 -1.765 1.00 0.00 C ATOM 0 H ILE A 123 10.714 -7.701 -4.072 1.00 0.00 H new ATOM 0 HA ILE A 123 8.713 -5.618 -3.392 1.00 0.00 H new ATOM 0 HB ILE A 123 10.787 -5.565 -2.173 1.00 0.00 H new ATOM 0 HG12 ILE A 123 11.407 -3.236 -3.735 1.00 0.00 H new ATOM 0 HG13 ILE A 123 9.668 -3.453 -3.723 1.00 0.00 H new ATOM 0 HG21 ILE A 123 12.926 -5.131 -3.302 1.00 0.00 H new ATOM 0 HG22 ILE A 123 12.245 -6.715 -3.743 1.00 0.00 H new ATOM 0 HG23 ILE A 123 12.133 -5.350 -4.880 1.00 0.00 H new ATOM 0 HD11 ILE A 123 10.395 -2.100 -1.783 1.00 0.00 H new ATOM 0 HD12 ILE A 123 9.694 -3.642 -1.239 1.00 0.00 H new ATOM 0 HD13 ILE A 123 11.460 -3.421 -1.250 1.00 0.00 H new ATOM 1928 N VAL A 124 8.504 -4.568 -5.581 1.00 0.00 N ATOM 1929 CA VAL A 124 8.227 -4.059 -6.913 1.00 0.00 C ATOM 1930 C VAL A 124 8.349 -2.534 -6.907 1.00 0.00 C ATOM 1931 O VAL A 124 7.781 -1.866 -6.046 1.00 0.00 O ATOM 1932 CB VAL A 124 6.855 -4.547 -7.387 1.00 0.00 C ATOM 1933 CG1 VAL A 124 6.402 -3.784 -8.632 1.00 0.00 C ATOM 1934 CG2 VAL A 124 6.869 -6.056 -7.641 1.00 0.00 C ATOM 0 H VAL A 124 7.929 -4.164 -4.842 1.00 0.00 H new ATOM 0 HA VAL A 124 8.957 -4.441 -7.626 1.00 0.00 H new ATOM 0 HB VAL A 124 6.135 -4.348 -6.593 1.00 0.00 H new ATOM 0 HG11 VAL A 124 5.425 -4.150 -8.948 1.00 0.00 H new ATOM 0 HG12 VAL A 124 6.334 -2.721 -8.402 1.00 0.00 H new ATOM 0 HG13 VAL A 124 7.123 -3.937 -9.435 1.00 0.00 H new ATOM 0 HG21 VAL A 124 5.883 -6.378 -7.977 1.00 0.00 H new ATOM 0 HG22 VAL A 124 7.607 -6.289 -8.408 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.127 -6.578 -6.719 1.00 0.00 H new ATOM 1944 N LYS A 125 9.094 -2.028 -7.880 1.00 0.00 N ATOM 1945 CA LYS A 125 9.297 -0.595 -7.998 1.00 0.00 C ATOM 1946 C LYS A 125 8.685 -0.104 -9.310 1.00 0.00 C ATOM 1947 O LYS A 125 8.882 -0.713 -10.360 1.00 0.00 O ATOM 1948 CB LYS A 125 10.781 -0.250 -7.845 1.00 0.00 C ATOM 1949 CG LYS A 125 11.589 -0.769 -9.035 1.00 0.00 C ATOM 1950 CD LYS A 125 13.091 -0.610 -8.789 1.00 0.00 C ATOM 1951 CE LYS A 125 13.886 -0.847 -10.076 1.00 0.00 C ATOM 1952 NZ LYS A 125 14.571 0.396 -10.497 1.00 0.00 N ATOM 0 H LYS A 125 9.564 -2.586 -8.593 1.00 0.00 H new ATOM 0 HA LYS A 125 8.786 -0.070 -7.191 1.00 0.00 H new ATOM 0 HB2 LYS A 125 10.900 0.830 -7.763 1.00 0.00 H new ATOM 0 HB3 LYS A 125 11.166 -0.684 -6.922 1.00 0.00 H new ATOM 0 HG2 LYS A 125 11.354 -1.819 -9.208 1.00 0.00 H new ATOM 0 HG3 LYS A 125 11.305 -0.226 -9.937 1.00 0.00 H new ATOM 0 HD2 LYS A 125 13.297 0.391 -8.409 1.00 0.00 H new ATOM 0 HD3 LYS A 125 13.414 -1.315 -8.023 1.00 0.00 H new ATOM 0 HE2 LYS A 125 14.619 -1.638 -9.917 1.00 0.00 H new ATOM 0 HE3 LYS A 125 13.217 -1.187 -10.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 15.106 0.219 -11.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 13.865 1.141 -10.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 15.224 0.703 -9.748 1.00 0.00 H new ATOM 1965 N GLY A 126 7.952 0.996 -9.208 1.00 0.00 N ATOM 1966 CA GLY A 126 7.309 1.577 -10.374 1.00 0.00 C ATOM 1967 C GLY A 126 5.784 1.516 -10.246 1.00 0.00 C ATOM 1968 O GLY A 126 5.252 1.484 -9.140 1.00 0.00 O ATOM 0 H GLY A 126 7.790 1.500 -8.336 1.00 0.00 H new ATOM 0 HA2 GLY A 126 7.627 2.613 -10.491 1.00 0.00 H new ATOM 0 HA3 GLY A 126 7.624 1.044 -11.271 1.00 0.00 H new ATOM 1972 N SER A 127 5.128 1.502 -11.397 1.00 0.00 N ATOM 1973 CA SER A 127 3.674 1.445 -11.428 1.00 0.00 C ATOM 1974 C SER A 127 3.216 0.249 -12.264 1.00 0.00 C ATOM 1975 O SER A 127 3.776 -0.023 -13.324 1.00 0.00 O ATOM 1976 CB SER A 127 3.085 2.742 -11.987 1.00 0.00 C ATOM 1977 OG SER A 127 3.899 3.872 -11.686 1.00 0.00 O ATOM 0 H SER A 127 5.574 1.529 -12.314 1.00 0.00 H new ATOM 0 HA SER A 127 3.313 1.325 -10.407 1.00 0.00 H new ATOM 0 HB2 SER A 127 2.974 2.653 -13.068 1.00 0.00 H new ATOM 0 HB3 SER A 127 2.087 2.894 -11.575 1.00 0.00 H new ATOM 0 HG SER A 127 3.490 4.679 -12.061 1.00 0.00 H new ATOM 1983 N ILE A 128 2.201 -0.433 -11.754 1.00 0.00 N ATOM 1984 CA ILE A 128 1.659 -1.594 -12.441 1.00 0.00 C ATOM 1985 C ILE A 128 0.217 -1.307 -12.859 1.00 0.00 C ATOM 1986 O ILE A 128 -0.411 -0.384 -12.342 1.00 0.00 O ATOM 1987 CB ILE A 128 1.813 -2.847 -11.578 1.00 0.00 C ATOM 1988 CG1 ILE A 128 1.252 -2.616 -10.173 1.00 0.00 C ATOM 1989 CG2 ILE A 128 3.270 -3.314 -11.544 1.00 0.00 C ATOM 1990 CD1 ILE A 128 0.910 -3.945 -9.495 1.00 0.00 C ATOM 0 H ILE A 128 1.740 -0.204 -10.874 1.00 0.00 H new ATOM 0 HA ILE A 128 2.221 -1.794 -13.354 1.00 0.00 H new ATOM 0 HB ILE A 128 1.229 -3.648 -12.031 1.00 0.00 H new ATOM 0 HG12 ILE A 128 1.981 -2.073 -9.571 1.00 0.00 H new ATOM 0 HG13 ILE A 128 0.360 -1.993 -10.232 1.00 0.00 H new ATOM 0 HG21 ILE A 128 3.352 -4.206 -10.924 1.00 0.00 H new ATOM 0 HG22 ILE A 128 3.602 -3.544 -12.556 1.00 0.00 H new ATOM 0 HG23 ILE A 128 3.896 -2.524 -11.128 1.00 0.00 H new ATOM 0 HD11 ILE A 128 0.513 -3.753 -8.498 1.00 0.00 H new ATOM 0 HD12 ILE A 128 0.163 -4.474 -10.087 1.00 0.00 H new ATOM 0 HD13 ILE A 128 1.810 -4.555 -9.416 1.00 0.00 H new ATOM 2002 N ASN A 129 -0.269 -2.116 -13.789 1.00 0.00 N ATOM 2003 CA ASN A 129 -1.628 -1.962 -14.282 1.00 0.00 C ATOM 2004 C ASN A 129 -2.486 -3.119 -13.770 1.00 0.00 C ATOM 2005 O ASN A 129 -1.960 -4.105 -13.254 1.00 0.00 O ATOM 2006 CB ASN A 129 -1.666 -1.984 -15.810 1.00 0.00 C ATOM 2007 CG ASN A 129 -0.650 -2.983 -16.369 1.00 0.00 C ATOM 2008 OD1 ASN A 129 -0.297 -3.966 -15.739 1.00 0.00 O ATOM 2009 ND2 ASN A 129 -0.201 -2.676 -17.583 1.00 0.00 N ATOM 0 H ASN A 129 0.254 -2.881 -14.215 1.00 0.00 H new ATOM 0 HA ASN A 129 -2.009 -1.004 -13.927 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -2.667 -2.250 -16.149 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -1.453 -0.988 -16.197 1.00 0.00 H new ATOM 0 HD21 ASN A 129 0.481 -3.280 -18.042 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -0.539 -1.837 -18.055 1.00 0.00 H new ATOM 2016 N GLU A 130 -3.792 -2.963 -13.931 1.00 0.00 N ATOM 2017 CA GLU A 130 -4.728 -3.984 -13.491 1.00 0.00 C ATOM 2018 C GLU A 130 -4.266 -5.364 -13.960 1.00 0.00 C ATOM 2019 O GLU A 130 -4.211 -6.305 -13.170 1.00 0.00 O ATOM 2020 CB GLU A 130 -6.143 -3.680 -13.988 1.00 0.00 C ATOM 2021 CG GLU A 130 -7.117 -4.786 -13.578 1.00 0.00 C ATOM 2022 CD GLU A 130 -8.130 -5.066 -14.690 1.00 0.00 C ATOM 2023 OE1 GLU A 130 -7.776 -5.019 -15.878 1.00 0.00 O ATOM 2024 OE2 GLU A 130 -9.323 -5.340 -14.284 1.00 0.00 O ATOM 0 H GLU A 130 -4.224 -2.145 -14.360 1.00 0.00 H new ATOM 0 HA GLU A 130 -4.753 -3.982 -12.401 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -6.478 -2.726 -13.581 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -6.137 -3.579 -15.073 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.563 -5.696 -13.348 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.642 -4.494 -12.668 1.00 0.00 H new ATOM 2032 N ALA A 131 -3.946 -5.442 -15.243 1.00 0.00 N ATOM 2033 CA ALA A 131 -3.491 -6.692 -15.827 1.00 0.00 C ATOM 2034 C ALA A 131 -2.400 -7.296 -14.941 1.00 0.00 C ATOM 2035 O ALA A 131 -2.500 -8.450 -14.528 1.00 0.00 O ATOM 2036 CB ALA A 131 -3.009 -6.442 -17.257 1.00 0.00 C ATOM 0 H ALA A 131 -3.993 -4.659 -15.895 1.00 0.00 H new ATOM 0 HA ALA A 131 -4.308 -7.411 -15.880 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -2.668 -7.380 -17.695 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -3.829 -6.041 -17.852 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -2.186 -5.727 -17.244 1.00 0.00 H new ATOM 2042 N GLN A 132 -1.384 -6.489 -14.676 1.00 0.00 N ATOM 2043 CA GLN A 132 -0.275 -6.930 -13.846 1.00 0.00 C ATOM 2044 C GLN A 132 -0.795 -7.523 -12.536 1.00 0.00 C ATOM 2045 O GLN A 132 -0.357 -8.594 -12.119 1.00 0.00 O ATOM 2046 CB GLN A 132 0.700 -5.781 -13.578 1.00 0.00 C ATOM 2047 CG GLN A 132 1.939 -5.894 -14.468 1.00 0.00 C ATOM 2048 CD GLN A 132 2.194 -4.587 -15.223 1.00 0.00 C ATOM 2049 OE1 GLN A 132 2.117 -3.499 -14.676 1.00 0.00 O ATOM 2050 NE2 GLN A 132 2.501 -4.753 -16.506 1.00 0.00 N ATOM 0 H GLN A 132 -1.305 -5.532 -15.021 1.00 0.00 H new ATOM 0 HA GLN A 132 0.268 -7.707 -14.384 1.00 0.00 H new ATOM 0 HB2 GLN A 132 0.203 -4.828 -13.760 1.00 0.00 H new ATOM 0 HB3 GLN A 132 0.999 -5.790 -12.530 1.00 0.00 H new ATOM 0 HG2 GLN A 132 2.808 -6.141 -13.858 1.00 0.00 H new ATOM 0 HG3 GLN A 132 1.807 -6.709 -15.179 1.00 0.00 H new ATOM 0 HE21 GLN A 132 2.549 -5.692 -16.902 1.00 0.00 H new ATOM 0 HE22 GLN A 132 2.689 -3.941 -17.095 1.00 0.00 H new ATOM 2059 N ALA A 133 -1.723 -6.803 -11.924 1.00 0.00 N ATOM 2060 CA ALA A 133 -2.308 -7.246 -10.670 1.00 0.00 C ATOM 2061 C ALA A 133 -2.808 -8.683 -10.825 1.00 0.00 C ATOM 2062 O ALA A 133 -2.559 -9.527 -9.965 1.00 0.00 O ATOM 2063 CB ALA A 133 -3.423 -6.282 -10.259 1.00 0.00 C ATOM 0 H ALA A 133 -2.085 -5.915 -12.273 1.00 0.00 H new ATOM 0 HA ALA A 133 -1.562 -7.241 -9.875 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -3.862 -6.614 -9.318 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -3.011 -5.281 -10.134 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -4.191 -6.264 -11.032 1.00 0.00 H new ATOM 2069 N LEU A 134 -3.504 -8.919 -11.929 1.00 0.00 N ATOM 2070 CA LEU A 134 -4.041 -10.240 -12.207 1.00 0.00 C ATOM 2071 C LEU A 134 -2.887 -11.215 -12.447 1.00 0.00 C ATOM 2072 O LEU A 134 -2.806 -12.258 -11.802 1.00 0.00 O ATOM 2073 CB LEU A 134 -5.045 -10.177 -13.360 1.00 0.00 C ATOM 2074 CG LEU A 134 -6.018 -8.997 -13.340 1.00 0.00 C ATOM 2075 CD1 LEU A 134 -7.035 -9.106 -14.477 1.00 0.00 C ATOM 2076 CD2 LEU A 134 -6.695 -8.870 -11.974 1.00 0.00 C ATOM 0 H LEU A 134 -3.708 -8.217 -12.641 1.00 0.00 H new ATOM 0 HA LEU A 134 -4.599 -10.614 -11.349 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -4.490 -10.148 -14.298 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -5.625 -11.100 -13.361 1.00 0.00 H new ATOM 0 HG LEU A 134 -5.450 -8.081 -13.504 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -7.715 -8.255 -14.440 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -6.512 -9.112 -15.433 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -7.604 -10.030 -14.369 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -7.382 -8.024 -11.986 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -7.248 -9.783 -11.756 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -5.938 -8.712 -11.206 1.00 0.00 H new ATOM 2088 N ALA A 135 -2.022 -10.839 -13.378 1.00 0.00 N ATOM 2089 CA ALA A 135 -0.876 -11.667 -13.713 1.00 0.00 C ATOM 2090 C ALA A 135 -0.088 -11.977 -12.438 1.00 0.00 C ATOM 2091 O ALA A 135 0.566 -13.016 -12.345 1.00 0.00 O ATOM 2092 CB ALA A 135 -0.022 -10.959 -14.766 1.00 0.00 C ATOM 0 H ALA A 135 -2.092 -9.972 -13.911 1.00 0.00 H new ATOM 0 HA ALA A 135 -1.201 -12.615 -14.141 1.00 0.00 H new ATOM 0 HB1 ALA A 135 0.837 -11.581 -15.016 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -0.618 -10.786 -15.662 1.00 0.00 H new ATOM 0 HB3 ALA A 135 0.325 -10.004 -14.371 1.00 0.00 H new ATOM 2098 N LEU A 136 -0.174 -11.059 -11.488 1.00 0.00 N ATOM 2099 CA LEU A 136 0.522 -11.221 -10.223 1.00 0.00 C ATOM 2100 C LEU A 136 -0.127 -12.357 -9.431 1.00 0.00 C ATOM 2101 O LEU A 136 0.566 -13.205 -8.872 1.00 0.00 O ATOM 2102 CB LEU A 136 0.574 -9.893 -9.465 1.00 0.00 C ATOM 2103 CG LEU A 136 0.919 -9.984 -7.977 1.00 0.00 C ATOM 2104 CD1 LEU A 136 2.000 -8.968 -7.602 1.00 0.00 C ATOM 2105 CD2 LEU A 136 -0.335 -9.831 -7.114 1.00 0.00 C ATOM 0 H LEU A 136 -0.716 -10.199 -11.569 1.00 0.00 H new ATOM 0 HA LEU A 136 1.561 -11.504 -10.393 1.00 0.00 H new ATOM 0 HB2 LEU A 136 1.308 -9.249 -9.949 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -0.394 -9.403 -9.564 1.00 0.00 H new ATOM 0 HG LEU A 136 1.327 -10.976 -7.780 1.00 0.00 H new ATOM 0 HD11 LEU A 136 2.227 -9.054 -6.539 1.00 0.00 H new ATOM 0 HD12 LEU A 136 2.901 -9.165 -8.182 1.00 0.00 H new ATOM 0 HD13 LEU A 136 1.643 -7.961 -7.817 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -0.062 -9.899 -6.061 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -0.794 -8.862 -7.308 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -1.043 -10.623 -7.358 1.00 0.00 H new ATOM 2117 N ILE A 137 -1.452 -12.336 -9.407 1.00 0.00 N ATOM 2118 CA ILE A 137 -2.204 -13.355 -8.692 1.00 0.00 C ATOM 2119 C ILE A 137 -2.198 -14.652 -9.505 1.00 0.00 C ATOM 2120 O ILE A 137 -2.327 -15.739 -8.944 1.00 0.00 O ATOM 2121 CB ILE A 137 -3.606 -12.846 -8.354 1.00 0.00 C ATOM 2122 CG1 ILE A 137 -3.544 -11.686 -7.358 1.00 0.00 C ATOM 2123 CG2 ILE A 137 -4.496 -13.985 -7.852 1.00 0.00 C ATOM 2124 CD1 ILE A 137 -4.508 -10.568 -7.759 1.00 0.00 C ATOM 0 H ILE A 137 -2.024 -11.630 -9.871 1.00 0.00 H new ATOM 0 HA ILE A 137 -1.732 -13.577 -7.735 1.00 0.00 H new ATOM 0 HB ILE A 137 -4.059 -12.461 -9.268 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -3.793 -12.045 -6.360 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -2.527 -11.295 -7.312 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -5.487 -13.596 -7.619 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -4.579 -14.750 -8.624 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -4.057 -14.421 -6.955 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -4.445 -9.756 -7.035 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -4.241 -10.195 -8.748 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -5.526 -10.956 -7.781 1.00 0.00 H new ATOM 2136 N ARG A 138 -2.048 -14.493 -10.810 1.00 0.00 N ATOM 2137 CA ARG A 138 -2.025 -15.637 -11.706 1.00 0.00 C ATOM 2138 C ARG A 138 -0.654 -16.317 -11.663 1.00 0.00 C ATOM 2139 O ARG A 138 -0.565 -17.537 -11.541 1.00 0.00 O ATOM 2140 CB ARG A 138 -2.334 -15.219 -13.144 1.00 0.00 C ATOM 2141 CG ARG A 138 -3.565 -15.955 -13.678 1.00 0.00 C ATOM 2142 CD ARG A 138 -4.782 -15.030 -13.714 1.00 0.00 C ATOM 2143 NE ARG A 138 -5.042 -14.589 -15.103 1.00 0.00 N ATOM 2144 CZ ARG A 138 -6.248 -14.185 -15.556 1.00 0.00 C ATOM 2145 NH1 ARG A 138 -7.318 -14.165 -14.733 1.00 0.00 N ATOM 2146 NH2 ARG A 138 -6.365 -13.813 -16.817 1.00 0.00 N ATOM 0 H ARG A 138 -1.941 -13.589 -11.270 1.00 0.00 H new ATOM 0 HA ARG A 138 -2.792 -16.335 -11.371 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -2.503 -14.143 -13.185 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -1.475 -15.431 -13.780 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -3.361 -16.333 -14.680 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -3.778 -16.819 -13.048 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -5.655 -15.549 -13.319 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -4.610 -14.164 -13.075 1.00 0.00 H new ATOM 0 HE ARG A 138 -4.261 -14.590 -15.759 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -7.219 -14.457 -13.761 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -8.225 -13.858 -15.084 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -5.552 -13.834 -17.432 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -7.269 -13.505 -17.176 1.00 0.00 H new ATOM 2159 N ASP A 139 0.381 -15.496 -11.765 1.00 0.00 N ATOM 2160 CA ASP A 139 1.743 -16.002 -11.739 1.00 0.00 C ATOM 2161 C ASP A 139 2.660 -14.953 -11.106 1.00 0.00 C ATOM 2162 O ASP A 139 2.742 -13.824 -11.586 1.00 0.00 O ATOM 2163 CB ASP A 139 2.253 -16.283 -13.155 1.00 0.00 C ATOM 2164 CG ASP A 139 3.407 -17.284 -13.239 1.00 0.00 C ATOM 2165 OD1 ASP A 139 4.212 -17.410 -12.304 1.00 0.00 O ATOM 2166 OD2 ASP A 139 3.463 -17.961 -14.336 1.00 0.00 O ATOM 0 H ASP A 139 0.304 -14.484 -11.866 1.00 0.00 H new ATOM 0 HA ASP A 139 1.748 -16.927 -11.163 1.00 0.00 H new ATOM 0 HB2 ASP A 139 1.424 -16.656 -13.756 1.00 0.00 H new ATOM 0 HB3 ASP A 139 2.574 -15.343 -13.603 1.00 0.00 H new ATOM 2172 N PRO A 140 3.345 -15.376 -10.010 1.00 0.00 N ATOM 2173 CA PRO A 140 4.253 -14.487 -9.307 1.00 0.00 C ATOM 2174 C PRO A 140 5.554 -14.299 -10.090 1.00 0.00 C ATOM 2175 O PRO A 140 6.335 -13.395 -9.797 1.00 0.00 O ATOM 2176 CB PRO A 140 4.465 -15.135 -7.949 1.00 0.00 C ATOM 2177 CG PRO A 140 4.044 -16.586 -8.109 1.00 0.00 C ATOM 2178 CD PRO A 140 3.272 -16.707 -9.413 1.00 0.00 C ATOM 0 HA PRO A 140 3.852 -13.480 -9.195 1.00 0.00 H new ATOM 0 HB2 PRO A 140 5.508 -15.063 -7.640 1.00 0.00 H new ATOM 0 HB3 PRO A 140 3.871 -14.638 -7.182 1.00 0.00 H new ATOM 0 HG2 PRO A 140 4.918 -17.238 -8.121 1.00 0.00 H new ATOM 0 HG3 PRO A 140 3.425 -16.899 -7.268 1.00 0.00 H new ATOM 0 HD2 PRO A 140 3.714 -17.459 -10.067 1.00 0.00 H new ATOM 0 HD3 PRO A 140 2.239 -17.006 -9.236 1.00 0.00 H new ATOM 2186 N ASN A 141 5.748 -15.170 -11.069 1.00 0.00 N ATOM 2187 CA ASN A 141 6.941 -15.113 -11.897 1.00 0.00 C ATOM 2188 C ASN A 141 6.789 -13.992 -12.926 1.00 0.00 C ATOM 2189 O ASN A 141 7.778 -13.513 -13.480 1.00 0.00 O ATOM 2190 CB ASN A 141 7.149 -16.425 -12.655 1.00 0.00 C ATOM 2191 CG ASN A 141 7.466 -17.570 -11.691 1.00 0.00 C ATOM 2192 OD1 ASN A 141 8.600 -17.793 -11.302 1.00 0.00 O ATOM 2193 ND2 ASN A 141 6.402 -18.282 -11.328 1.00 0.00 N ATOM 0 H ASN A 141 5.099 -15.920 -11.308 1.00 0.00 H new ATOM 0 HA ASN A 141 7.796 -14.934 -11.245 1.00 0.00 H new ATOM 0 HB2 ASN A 141 6.253 -16.664 -13.228 1.00 0.00 H new ATOM 0 HB3 ASN A 141 7.963 -16.311 -13.370 1.00 0.00 H new ATOM 0 HD21 ASN A 141 6.509 -19.068 -10.687 1.00 0.00 H new ATOM 0 HD22 ASN A 141 5.480 -18.042 -11.691 1.00 0.00 H new ATOM 2200 N ALA A 142 5.543 -13.603 -13.152 1.00 0.00 N ATOM 2201 CA ALA A 142 5.247 -12.547 -14.105 1.00 0.00 C ATOM 2202 C ALA A 142 5.704 -11.205 -13.529 1.00 0.00 C ATOM 2203 O ALA A 142 5.035 -10.633 -12.671 1.00 0.00 O ATOM 2204 CB ALA A 142 3.754 -12.561 -14.438 1.00 0.00 C ATOM 0 H ALA A 142 4.725 -14.001 -12.690 1.00 0.00 H new ATOM 0 HA ALA A 142 5.789 -12.708 -15.037 1.00 0.00 H new ATOM 0 HB1 ALA A 142 3.533 -11.768 -15.153 1.00 0.00 H new ATOM 0 HB2 ALA A 142 3.487 -13.525 -14.871 1.00 0.00 H new ATOM 0 HB3 ALA A 142 3.177 -12.400 -13.528 1.00 0.00 H new ATOM 2210 N ASP A 143 6.841 -10.741 -14.026 1.00 0.00 N ATOM 2211 CA ASP A 143 7.395 -9.477 -13.572 1.00 0.00 C ATOM 2212 C ASP A 143 8.483 -9.021 -14.549 1.00 0.00 C ATOM 2213 O ASP A 143 9.373 -9.797 -14.897 1.00 0.00 O ATOM 2214 CB ASP A 143 8.033 -9.620 -12.187 1.00 0.00 C ATOM 2215 CG ASP A 143 7.377 -8.787 -11.086 1.00 0.00 C ATOM 2216 OD1 ASP A 143 6.749 -7.752 -11.354 1.00 0.00 O ATOM 2217 OD2 ASP A 143 7.532 -9.247 -9.890 1.00 0.00 O ATOM 0 H ASP A 143 7.394 -11.218 -14.739 1.00 0.00 H new ATOM 0 HA ASP A 143 6.583 -8.752 -13.522 1.00 0.00 H new ATOM 0 HB2 ASP A 143 8.002 -10.670 -11.895 1.00 0.00 H new ATOM 0 HB3 ASP A 143 9.084 -9.340 -12.257 1.00 0.00 H new ATOM 2223 N LEU A 144 8.375 -7.767 -14.961 1.00 0.00 N ATOM 2224 CA LEU A 144 9.338 -7.200 -15.890 1.00 0.00 C ATOM 2225 C LEU A 144 9.264 -5.673 -15.824 1.00 0.00 C ATOM 2226 O LEU A 144 8.574 -5.117 -14.971 1.00 0.00 O ATOM 2227 CB LEU A 144 9.125 -7.766 -17.295 1.00 0.00 C ATOM 2228 CG LEU A 144 7.906 -7.237 -18.052 1.00 0.00 C ATOM 2229 CD1 LEU A 144 8.230 -7.026 -19.534 1.00 0.00 C ATOM 2230 CD2 LEU A 144 6.696 -8.155 -17.856 1.00 0.00 C ATOM 0 H LEU A 144 7.636 -7.128 -14.669 1.00 0.00 H new ATOM 0 HA LEU A 144 10.352 -7.484 -15.608 1.00 0.00 H new ATOM 0 HB2 LEU A 144 10.015 -7.557 -17.888 1.00 0.00 H new ATOM 0 HB3 LEU A 144 9.039 -8.850 -17.220 1.00 0.00 H new ATOM 0 HG LEU A 144 7.643 -6.264 -17.637 1.00 0.00 H new ATOM 0 HD11 LEU A 144 7.347 -6.650 -20.050 1.00 0.00 H new ATOM 0 HD12 LEU A 144 9.041 -6.304 -19.630 1.00 0.00 H new ATOM 0 HD13 LEU A 144 8.533 -7.974 -19.979 1.00 0.00 H new ATOM 0 HD21 LEU A 144 5.843 -7.755 -18.405 1.00 0.00 H new ATOM 0 HD22 LEU A 144 6.932 -9.152 -18.228 1.00 0.00 H new ATOM 0 HD23 LEU A 144 6.450 -8.212 -16.796 1.00 0.00 H new TER 2242 LEU A 144