USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 938 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 31 MET CE :methyl -102:sc= -3.25 (180deg=-5.32!) USER MOD Set 1.2: A 105 THR OG1 : rot 82:sc= -0.276 USER MOD Set 2.1: A 93 THR OG1 : rot -118:sc= 0.383 USER MOD Set 2.2: A 95 THR OG1 : rot 131:sc= 0.0825 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -154:sc= -0.111 (180deg=-0.63) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 76:sc= 0.832 USER MOD Single : A 8 SER OG : rot 180:sc= -0.0418 USER MOD Single : A 10 THR OG1 : rot 50:sc= 0.353 USER MOD Single : A 14 SER OG : rot -136:sc= -0.326 USER MOD Single : A 17 SER OG : rot -110:sc= 0 USER MOD Single : A 25 TYR OH : rot 60:sc= 0.461 USER MOD Single : A 27 MET CE :methyl 152:sc= -1.38 (180deg=-2.79!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= -0.158 K(o=-0.16,f=-1.8!) USER MOD Single : A 38 SER OG : rot 180:sc= -0.753 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= -0.25 K(o=-0.25,f=-2.8!) USER MOD Single : A 63 ASN : amide:sc= 0.257 X(o=0.26,f=0) USER MOD Single : A 64 ASN : amide:sc= -0.0326 K(o=-0.033,f=-0.7) USER MOD Single : A 67 LYS NZ :NH3+ -140:sc= 0.179 (180deg=0) USER MOD Single : A 72 SER OG : rot 125:sc= 0.097 USER MOD Single : A 73 SER OG : rot -105:sc= 0.303 USER MOD Single : A 77 ASN : amide:sc= -0.182 X(o=-0.18,f=0) USER MOD Single : A 83 ASN : amide:sc= -0.932 K(o=-0.93,f=-1.8) USER MOD Single : A 88 LYS NZ :NH3+ -158:sc= 0.0674 (180deg=-0.0817) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= -0.154 X(o=-0.15,f=-0.59) USER MOD Single : A 102 LYS NZ :NH3+ -145:sc= -0.353 (180deg=-0.978) USER MOD Single : A 108 ASN : amide:sc= -2.57! C(o=-2.6!,f=-5!) USER MOD Single : A 114 SER OG : rot 150:sc= 0.119 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.218 1.152 -4.291 1.00 0.00 N ATOM 2 CA MET A 1 7.136 0.520 -5.099 1.00 0.00 C ATOM 3 C MET A 1 5.865 0.408 -4.253 1.00 0.00 C ATOM 4 O MET A 1 5.691 -0.527 -3.498 1.00 0.00 O ATOM 5 CB MET A 1 7.579 -0.877 -5.541 1.00 0.00 C ATOM 6 CG MET A 1 8.720 -0.755 -6.552 1.00 0.00 C ATOM 7 SD MET A 1 8.053 -0.235 -8.153 1.00 0.00 S ATOM 8 CE MET A 1 9.634 -0.096 -9.021 1.00 0.00 C ATOM 0 H1 MET A 1 8.895 1.623 -4.925 1.00 0.00 H new ATOM 0 H2 MET A 1 7.804 1.853 -3.644 1.00 0.00 H new ATOM 0 H3 MET A 1 8.712 0.421 -3.740 1.00 0.00 H new ATOM 0 HA MET A 1 6.934 1.133 -5.978 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.905 -1.457 -4.677 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.740 -1.412 -5.986 1.00 0.00 H new ATOM 0 HG2 MET A 1 9.456 -0.032 -6.200 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.235 -1.711 -6.653 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.458 0.219 -10.049 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.262 0.640 -8.518 1.00 0.00 H new ATOM 0 HE3 MET A 1 10.136 -1.063 -9.019 1.00 0.00 H new ATOM 20 N LYS A 2 4.974 1.354 -4.376 1.00 0.00 N ATOM 21 CA LYS A 2 3.716 1.300 -3.581 1.00 0.00 C ATOM 22 C LYS A 2 2.648 0.550 -4.381 1.00 0.00 C ATOM 23 O LYS A 2 2.463 0.786 -5.560 1.00 0.00 O ATOM 24 CB LYS A 2 3.236 2.723 -3.287 1.00 0.00 C ATOM 25 CG LYS A 2 4.095 3.330 -2.174 1.00 0.00 C ATOM 26 CD LYS A 2 5.577 3.171 -2.524 1.00 0.00 C ATOM 27 CE LYS A 2 6.394 4.231 -1.784 1.00 0.00 C ATOM 28 NZ LYS A 2 7.106 5.090 -2.772 1.00 0.00 N ATOM 0 H LYS A 2 5.064 2.161 -4.993 1.00 0.00 H new ATOM 0 HA LYS A 2 3.897 0.781 -2.640 1.00 0.00 H new ATOM 0 HB2 LYS A 2 3.302 3.334 -4.187 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.188 2.710 -2.987 1.00 0.00 H new ATOM 0 HG2 LYS A 2 3.852 4.385 -2.048 1.00 0.00 H new ATOM 0 HG3 LYS A 2 3.880 2.838 -1.226 1.00 0.00 H new ATOM 0 HD2 LYS A 2 5.921 2.174 -2.249 1.00 0.00 H new ATOM 0 HD3 LYS A 2 5.720 3.272 -3.600 1.00 0.00 H new ATOM 0 HE2 LYS A 2 5.739 4.841 -1.161 1.00 0.00 H new ATOM 0 HE3 LYS A 2 7.112 3.752 -1.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 7.662 5.811 -2.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 7.742 4.502 -3.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 6.412 5.557 -3.390 1.00 0.00 H new ATOM 42 N ILE A 3 1.952 -0.359 -3.753 1.00 0.00 N ATOM 43 CA ILE A 3 0.907 -1.132 -4.482 1.00 0.00 C ATOM 44 C ILE A 3 -0.482 -0.576 -4.161 1.00 0.00 C ATOM 45 O ILE A 3 -1.031 -0.817 -3.104 1.00 0.00 O ATOM 46 CB ILE A 3 0.973 -2.601 -4.062 1.00 0.00 C ATOM 47 CG1 ILE A 3 2.436 -3.043 -3.988 1.00 0.00 C ATOM 48 CG2 ILE A 3 0.233 -3.460 -5.089 1.00 0.00 C ATOM 49 CD1 ILE A 3 3.037 -3.053 -5.394 1.00 0.00 C ATOM 0 H ILE A 3 2.062 -0.599 -2.768 1.00 0.00 H new ATOM 0 HA ILE A 3 1.087 -1.046 -5.554 1.00 0.00 H new ATOM 0 HB ILE A 3 0.506 -2.721 -3.085 1.00 0.00 H new ATOM 0 HG12 ILE A 3 2.999 -2.367 -3.345 1.00 0.00 H new ATOM 0 HG13 ILE A 3 2.505 -4.036 -3.544 1.00 0.00 H new ATOM 0 HG21 ILE A 3 0.280 -4.507 -4.789 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.809 -3.145 -5.144 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.700 -3.341 -6.067 1.00 0.00 H new ATOM 0 HD11 ILE A 3 4.079 -3.368 -5.342 1.00 0.00 H new ATOM 0 HD12 ILE A 3 2.479 -3.747 -6.023 1.00 0.00 H new ATOM 0 HD13 ILE A 3 2.981 -2.051 -5.821 1.00 0.00 H new ATOM 61 N ALA A 4 -1.059 0.151 -5.076 1.00 0.00 N ATOM 62 CA ALA A 4 -2.420 0.709 -4.846 1.00 0.00 C ATOM 63 C ALA A 4 -3.404 -0.014 -5.766 1.00 0.00 C ATOM 64 O ALA A 4 -3.652 0.406 -6.879 1.00 0.00 O ATOM 65 CB ALA A 4 -2.421 2.205 -5.166 1.00 0.00 C ATOM 0 H ALA A 4 -0.644 0.384 -5.978 1.00 0.00 H new ATOM 0 HA ALA A 4 -2.711 0.569 -3.805 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -3.418 2.612 -4.997 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -1.706 2.716 -4.521 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -2.140 2.354 -6.208 1.00 0.00 H new ATOM 71 N ILE A 5 -3.954 -1.108 -5.318 1.00 0.00 N ATOM 72 CA ILE A 5 -4.907 -1.868 -6.176 1.00 0.00 C ATOM 73 C ILE A 5 -6.347 -1.525 -5.790 1.00 0.00 C ATOM 74 O ILE A 5 -6.704 -1.513 -4.629 1.00 0.00 O ATOM 75 CB ILE A 5 -4.677 -3.368 -5.982 1.00 0.00 C ATOM 76 CG1 ILE A 5 -5.723 -4.151 -6.779 1.00 0.00 C ATOM 77 CG2 ILE A 5 -4.804 -3.717 -4.498 1.00 0.00 C ATOM 78 CD1 ILE A 5 -5.234 -5.587 -6.992 1.00 0.00 C ATOM 0 H ILE A 5 -3.785 -1.509 -4.395 1.00 0.00 H new ATOM 0 HA ILE A 5 -4.741 -1.599 -7.219 1.00 0.00 H new ATOM 0 HB ILE A 5 -3.679 -3.630 -6.333 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -6.674 -4.155 -6.246 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -5.899 -3.669 -7.741 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -4.640 -4.786 -4.360 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -4.061 -3.159 -3.928 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -5.802 -3.455 -4.147 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -5.979 -6.145 -7.560 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -4.294 -5.573 -7.543 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.081 -6.066 -6.025 1.00 0.00 H new ATOM 90 N ALA A 6 -7.178 -1.252 -6.759 1.00 0.00 N ATOM 91 CA ALA A 6 -8.597 -0.921 -6.449 1.00 0.00 C ATOM 92 C ALA A 6 -9.223 -2.081 -5.673 1.00 0.00 C ATOM 93 O ALA A 6 -8.769 -3.206 -5.751 1.00 0.00 O ATOM 94 CB ALA A 6 -9.368 -0.702 -7.752 1.00 0.00 C ATOM 0 H ALA A 6 -6.936 -1.244 -7.750 1.00 0.00 H new ATOM 0 HA ALA A 6 -8.640 -0.012 -5.849 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -10.406 -0.460 -7.524 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -8.917 0.120 -8.308 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -9.331 -1.610 -8.354 1.00 0.00 H new ATOM 100 N SER A 7 -10.259 -1.823 -4.923 1.00 0.00 N ATOM 101 CA SER A 7 -10.899 -2.923 -4.147 1.00 0.00 C ATOM 102 C SER A 7 -12.325 -2.525 -3.764 1.00 0.00 C ATOM 103 O SER A 7 -12.782 -1.441 -4.069 1.00 0.00 O ATOM 104 CB SER A 7 -10.087 -3.187 -2.878 1.00 0.00 C ATOM 105 OG SER A 7 -9.036 -2.234 -2.785 1.00 0.00 O ATOM 0 H SER A 7 -10.688 -0.904 -4.814 1.00 0.00 H new ATOM 0 HA SER A 7 -10.929 -3.825 -4.758 1.00 0.00 H new ATOM 0 HB2 SER A 7 -10.731 -3.122 -2.001 1.00 0.00 H new ATOM 0 HB3 SER A 7 -9.677 -4.197 -2.899 1.00 0.00 H new ATOM 0 HG SER A 7 -9.401 -1.372 -2.493 1.00 0.00 H new ATOM 111 N SER A 8 -13.030 -3.396 -3.095 1.00 0.00 N ATOM 112 CA SER A 8 -14.425 -3.074 -2.688 1.00 0.00 C ATOM 113 C SER A 8 -14.573 -3.295 -1.181 1.00 0.00 C ATOM 114 O SER A 8 -15.658 -3.515 -0.678 1.00 0.00 O ATOM 115 CB SER A 8 -15.396 -3.989 -3.436 1.00 0.00 C ATOM 116 OG SER A 8 -14.676 -5.077 -3.999 1.00 0.00 O ATOM 0 H SER A 8 -12.698 -4.318 -2.813 1.00 0.00 H new ATOM 0 HA SER A 8 -14.648 -2.035 -2.929 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.163 -4.359 -2.755 1.00 0.00 H new ATOM 0 HB3 SER A 8 -15.908 -3.432 -4.221 1.00 0.00 H new ATOM 0 HG SER A 8 -15.295 -5.666 -4.478 1.00 0.00 H new ATOM 122 N GLY A 9 -13.488 -3.240 -0.457 1.00 0.00 N ATOM 123 CA GLY A 9 -13.560 -3.448 1.017 1.00 0.00 C ATOM 124 C GLY A 9 -12.221 -3.993 1.517 1.00 0.00 C ATOM 125 O GLY A 9 -11.182 -3.736 0.943 1.00 0.00 O ATOM 0 H GLY A 9 -12.553 -3.060 -0.824 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.793 -2.508 1.517 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -14.362 -4.145 1.259 1.00 0.00 H new ATOM 129 N THR A 10 -12.236 -4.747 2.582 1.00 0.00 N ATOM 130 CA THR A 10 -10.963 -5.311 3.115 1.00 0.00 C ATOM 131 C THR A 10 -11.089 -6.831 3.225 1.00 0.00 C ATOM 132 O THR A 10 -11.697 -7.346 4.142 1.00 0.00 O ATOM 133 CB THR A 10 -10.683 -4.722 4.500 1.00 0.00 C ATOM 134 OG1 THR A 10 -11.868 -4.772 5.281 1.00 0.00 O ATOM 135 CG2 THR A 10 -10.222 -3.271 4.358 1.00 0.00 C ATOM 0 H THR A 10 -13.075 -4.997 3.106 1.00 0.00 H new ATOM 0 HA THR A 10 -10.144 -5.060 2.442 1.00 0.00 H new ATOM 0 HB THR A 10 -9.900 -5.301 4.990 1.00 0.00 H new ATOM 0 HG1 THR A 10 -12.249 -5.674 5.239 1.00 0.00 H new ATOM 0 HG21 THR A 10 -10.023 -2.854 5.345 1.00 0.00 H new ATOM 0 HG22 THR A 10 -9.312 -3.235 3.759 1.00 0.00 H new ATOM 0 HG23 THR A 10 -11.002 -2.688 3.868 1.00 0.00 H new ATOM 143 N ASP A 11 -10.522 -7.553 2.298 1.00 0.00 N ATOM 144 CA ASP A 11 -10.617 -9.039 2.354 1.00 0.00 C ATOM 145 C ASP A 11 -12.088 -9.449 2.458 1.00 0.00 C ATOM 146 O ASP A 11 -12.971 -8.732 2.033 1.00 0.00 O ATOM 147 CB ASP A 11 -9.855 -9.551 3.579 1.00 0.00 C ATOM 148 CG ASP A 11 -9.072 -10.810 3.205 1.00 0.00 C ATOM 149 OD1 ASP A 11 -9.645 -11.885 3.283 1.00 0.00 O ATOM 150 OD2 ASP A 11 -7.914 -10.680 2.848 1.00 0.00 O ATOM 0 H ASP A 11 -9.998 -7.180 1.506 1.00 0.00 H new ATOM 0 HA ASP A 11 -10.183 -9.468 1.451 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -9.174 -8.782 3.944 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -10.552 -9.770 4.388 1.00 0.00 H new ATOM 155 N LEU A 12 -12.358 -10.595 3.021 1.00 0.00 N ATOM 156 CA LEU A 12 -13.773 -11.045 3.151 1.00 0.00 C ATOM 157 C LEU A 12 -14.404 -11.160 1.762 1.00 0.00 C ATOM 158 O LEU A 12 -15.609 -11.194 1.617 1.00 0.00 O ATOM 159 CB LEU A 12 -14.558 -10.027 3.982 1.00 0.00 C ATOM 160 CG LEU A 12 -15.149 -10.717 5.212 1.00 0.00 C ATOM 161 CD1 LEU A 12 -14.567 -10.088 6.478 1.00 0.00 C ATOM 162 CD2 LEU A 12 -16.669 -10.546 5.213 1.00 0.00 C ATOM 0 H LEU A 12 -11.661 -11.238 3.396 1.00 0.00 H new ATOM 0 HA LEU A 12 -13.799 -12.017 3.644 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -13.904 -9.211 4.289 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -15.354 -9.588 3.381 1.00 0.00 H new ATOM 0 HG LEU A 12 -14.902 -11.778 5.185 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -14.988 -10.579 7.355 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -13.484 -10.209 6.479 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -14.814 -9.027 6.503 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -17.090 -11.038 6.090 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -16.916 -9.485 5.239 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -17.086 -10.993 4.311 1.00 0.00 H new ATOM 174 N GLY A 13 -13.597 -11.222 0.737 1.00 0.00 N ATOM 175 CA GLY A 13 -14.151 -11.336 -0.642 1.00 0.00 C ATOM 176 C GLY A 13 -13.717 -10.122 -1.466 1.00 0.00 C ATOM 177 O GLY A 13 -14.374 -9.736 -2.413 1.00 0.00 O ATOM 0 H GLY A 13 -12.579 -11.199 0.795 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -13.798 -12.254 -1.113 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -15.239 -11.394 -0.605 1.00 0.00 H new ATOM 181 N SER A 14 -12.615 -9.519 -1.115 1.00 0.00 N ATOM 182 CA SER A 14 -12.137 -8.333 -1.877 1.00 0.00 C ATOM 183 C SER A 14 -11.575 -8.791 -3.224 1.00 0.00 C ATOM 184 O SER A 14 -10.384 -8.976 -3.380 1.00 0.00 O ATOM 185 CB SER A 14 -11.041 -7.622 -1.081 1.00 0.00 C ATOM 186 OG SER A 14 -11.642 -6.768 -0.117 1.00 0.00 O ATOM 0 H SER A 14 -12.024 -9.798 -0.332 1.00 0.00 H new ATOM 0 HA SER A 14 -12.967 -7.646 -2.042 1.00 0.00 H new ATOM 0 HB2 SER A 14 -10.401 -8.353 -0.588 1.00 0.00 H new ATOM 0 HB3 SER A 14 -10.406 -7.043 -1.751 1.00 0.00 H new ATOM 0 HG SER A 14 -11.181 -5.903 -0.113 1.00 0.00 H new ATOM 192 N GLU A 15 -12.426 -8.980 -4.195 1.00 0.00 N ATOM 193 CA GLU A 15 -11.952 -9.428 -5.539 1.00 0.00 C ATOM 194 C GLU A 15 -11.379 -8.244 -6.333 1.00 0.00 C ATOM 195 O GLU A 15 -11.579 -8.142 -7.527 1.00 0.00 O ATOM 196 CB GLU A 15 -13.125 -10.034 -6.312 1.00 0.00 C ATOM 197 CG GLU A 15 -14.149 -8.942 -6.628 1.00 0.00 C ATOM 198 CD GLU A 15 -15.459 -9.244 -5.898 1.00 0.00 C ATOM 199 OE1 GLU A 15 -15.595 -8.813 -4.764 1.00 0.00 O ATOM 200 OE2 GLU A 15 -16.304 -9.900 -6.484 1.00 0.00 O ATOM 0 H GLU A 15 -13.434 -8.843 -4.117 1.00 0.00 H new ATOM 0 HA GLU A 15 -11.167 -10.172 -5.404 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -12.768 -10.491 -7.235 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -13.591 -10.825 -5.725 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -13.765 -7.969 -6.321 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -14.323 -8.892 -7.703 1.00 0.00 H new ATOM 207 N VAL A 16 -10.672 -7.349 -5.696 1.00 0.00 N ATOM 208 CA VAL A 16 -10.101 -6.190 -6.437 1.00 0.00 C ATOM 209 C VAL A 16 -11.239 -5.335 -6.999 1.00 0.00 C ATOM 210 O VAL A 16 -11.031 -4.474 -7.830 1.00 0.00 O ATOM 211 CB VAL A 16 -9.230 -6.701 -7.585 1.00 0.00 C ATOM 212 CG1 VAL A 16 -8.476 -5.529 -8.215 1.00 0.00 C ATOM 213 CG2 VAL A 16 -8.226 -7.722 -7.047 1.00 0.00 C ATOM 0 H VAL A 16 -10.466 -7.371 -4.697 1.00 0.00 H new ATOM 0 HA VAL A 16 -9.494 -5.587 -5.761 1.00 0.00 H new ATOM 0 HB VAL A 16 -9.862 -7.173 -8.338 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -7.855 -5.894 -9.033 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -9.191 -4.801 -8.598 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -7.844 -5.056 -7.463 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -7.605 -8.087 -7.865 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -7.595 -7.250 -6.294 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -8.762 -8.558 -6.598 1.00 0.00 H new ATOM 223 N SER A 17 -12.444 -5.566 -6.550 1.00 0.00 N ATOM 224 CA SER A 17 -13.594 -4.766 -7.058 1.00 0.00 C ATOM 225 C SER A 17 -13.810 -5.068 -8.542 1.00 0.00 C ATOM 226 O SER A 17 -13.080 -5.831 -9.143 1.00 0.00 O ATOM 227 CB SER A 17 -13.299 -3.276 -6.877 1.00 0.00 C ATOM 228 OG SER A 17 -14.504 -2.595 -6.557 1.00 0.00 O ATOM 0 H SER A 17 -12.681 -6.273 -5.854 1.00 0.00 H new ATOM 0 HA SER A 17 -14.493 -5.028 -6.500 1.00 0.00 H new ATOM 0 HB2 SER A 17 -12.565 -3.132 -6.084 1.00 0.00 H new ATOM 0 HB3 SER A 17 -12.867 -2.865 -7.790 1.00 0.00 H new ATOM 0 HG SER A 17 -14.772 -2.032 -7.313 1.00 0.00 H new ATOM 234 N ARG A 18 -14.810 -4.478 -9.139 1.00 0.00 N ATOM 235 CA ARG A 18 -15.071 -4.734 -10.584 1.00 0.00 C ATOM 236 C ARG A 18 -14.987 -3.418 -11.362 1.00 0.00 C ATOM 237 O ARG A 18 -15.288 -3.362 -12.537 1.00 0.00 O ATOM 238 CB ARG A 18 -16.468 -5.338 -10.749 1.00 0.00 C ATOM 239 CG ARG A 18 -16.484 -6.264 -11.968 1.00 0.00 C ATOM 240 CD ARG A 18 -17.457 -7.417 -11.723 1.00 0.00 C ATOM 241 NE ARG A 18 -17.754 -8.099 -13.015 1.00 0.00 N ATOM 242 CZ ARG A 18 -18.819 -8.843 -13.130 1.00 0.00 C ATOM 243 NH1 ARG A 18 -20.000 -8.289 -13.177 1.00 0.00 N ATOM 244 NH2 ARG A 18 -18.703 -10.141 -13.200 1.00 0.00 N ATOM 0 H ARG A 18 -15.457 -3.830 -8.689 1.00 0.00 H new ATOM 0 HA ARG A 18 -14.326 -5.429 -10.970 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -16.743 -5.894 -9.853 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -17.206 -4.545 -10.872 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -16.781 -5.707 -12.857 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -15.483 -6.653 -12.155 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -17.027 -8.126 -11.016 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -18.378 -7.041 -11.278 1.00 0.00 H new ATOM 0 HE ARG A 18 -17.124 -7.984 -13.809 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -20.090 -7.274 -13.124 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -20.833 -8.871 -13.267 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -17.780 -10.573 -13.165 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -19.536 -10.723 -13.290 1.00 0.00 H new ATOM 258 N PHE A 19 -14.578 -2.360 -10.718 1.00 0.00 N ATOM 259 CA PHE A 19 -14.473 -1.052 -11.423 1.00 0.00 C ATOM 260 C PHE A 19 -13.262 -0.284 -10.892 1.00 0.00 C ATOM 261 O PHE A 19 -12.702 -0.620 -9.867 1.00 0.00 O ATOM 262 CB PHE A 19 -15.744 -0.235 -11.181 1.00 0.00 C ATOM 263 CG PHE A 19 -16.795 -0.633 -12.189 1.00 0.00 C ATOM 264 CD1 PHE A 19 -16.589 -0.383 -13.552 1.00 0.00 C ATOM 265 CD2 PHE A 19 -17.976 -1.254 -11.761 1.00 0.00 C ATOM 266 CE1 PHE A 19 -17.565 -0.751 -14.488 1.00 0.00 C ATOM 267 CE2 PHE A 19 -18.952 -1.624 -12.696 1.00 0.00 C ATOM 268 CZ PHE A 19 -18.747 -1.373 -14.059 1.00 0.00 C ATOM 0 H PHE A 19 -14.312 -2.345 -9.733 1.00 0.00 H new ATOM 0 HA PHE A 19 -14.354 -1.225 -12.493 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -16.112 -0.405 -10.169 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -15.527 0.830 -11.266 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -15.678 0.094 -13.882 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -18.134 -1.448 -10.710 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -17.407 -0.556 -15.538 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -19.862 -2.103 -12.366 1.00 0.00 H new ATOM 0 HZ PHE A 19 -19.499 -1.658 -14.780 1.00 0.00 H new ATOM 278 N PHE A 20 -12.853 0.745 -11.581 1.00 0.00 N ATOM 279 CA PHE A 20 -11.677 1.533 -11.117 1.00 0.00 C ATOM 280 C PHE A 20 -12.012 3.027 -11.172 1.00 0.00 C ATOM 281 O PHE A 20 -11.772 3.689 -12.163 1.00 0.00 O ATOM 282 CB PHE A 20 -10.481 1.238 -12.028 1.00 0.00 C ATOM 283 CG PHE A 20 -9.399 2.268 -11.802 1.00 0.00 C ATOM 284 CD1 PHE A 20 -9.215 2.826 -10.531 1.00 0.00 C ATOM 285 CD2 PHE A 20 -8.580 2.667 -12.867 1.00 0.00 C ATOM 286 CE1 PHE A 20 -8.213 3.784 -10.323 1.00 0.00 C ATOM 287 CE2 PHE A 20 -7.577 3.624 -12.660 1.00 0.00 C ATOM 288 CZ PHE A 20 -7.394 4.182 -11.388 1.00 0.00 C ATOM 0 H PHE A 20 -13.282 1.074 -12.446 1.00 0.00 H new ATOM 0 HA PHE A 20 -11.429 1.257 -10.092 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -10.094 0.240 -11.823 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -10.795 1.250 -13.072 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -9.846 2.518 -9.710 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -8.722 2.237 -13.847 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -8.072 4.215 -9.343 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -6.946 3.931 -13.481 1.00 0.00 H new ATOM 0 HZ PHE A 20 -6.621 4.919 -11.228 1.00 0.00 H new ATOM 298 N GLY A 21 -12.562 3.564 -10.117 1.00 0.00 N ATOM 299 CA GLY A 21 -12.905 5.014 -10.117 1.00 0.00 C ATOM 300 C GLY A 21 -13.971 5.298 -9.055 1.00 0.00 C ATOM 301 O GLY A 21 -13.806 6.157 -8.213 1.00 0.00 O ATOM 0 H GLY A 21 -12.788 3.063 -9.258 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -12.013 5.608 -9.917 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -13.271 5.310 -11.100 1.00 0.00 H new ATOM 305 N ARG A 22 -15.064 4.586 -9.091 1.00 0.00 N ATOM 306 CA ARG A 22 -16.140 4.825 -8.084 1.00 0.00 C ATOM 307 C ARG A 22 -15.958 3.873 -6.900 1.00 0.00 C ATOM 308 O ARG A 22 -16.469 4.105 -5.822 1.00 0.00 O ATOM 309 CB ARG A 22 -17.506 4.583 -8.730 1.00 0.00 C ATOM 310 CG ARG A 22 -18.065 5.908 -9.254 1.00 0.00 C ATOM 311 CD ARG A 22 -18.301 5.801 -10.761 1.00 0.00 C ATOM 312 NE ARG A 22 -19.574 5.070 -11.013 1.00 0.00 N ATOM 313 CZ ARG A 22 -20.124 5.108 -12.197 1.00 0.00 C ATOM 314 NH1 ARG A 22 -19.458 4.691 -13.239 1.00 0.00 N ATOM 315 NH2 ARG A 22 -21.340 5.563 -12.337 1.00 0.00 N ATOM 0 H ARG A 22 -15.259 3.851 -9.771 1.00 0.00 H new ATOM 0 HA ARG A 22 -16.082 5.854 -7.731 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -17.412 3.867 -9.547 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -18.192 4.149 -8.003 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -18.999 6.148 -8.745 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -17.368 6.719 -9.041 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -18.346 6.796 -11.204 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -17.469 5.279 -11.234 1.00 0.00 H new ATOM 0 HE ARG A 22 -20.016 4.540 -10.262 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -18.508 4.336 -13.129 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -19.887 4.720 -14.164 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -21.860 5.888 -11.522 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -21.770 5.593 -13.261 1.00 0.00 H new ATOM 329 N ALA A 23 -15.236 2.803 -7.089 1.00 0.00 N ATOM 330 CA ALA A 23 -15.025 1.839 -5.971 1.00 0.00 C ATOM 331 C ALA A 23 -14.433 2.577 -4.762 1.00 0.00 C ATOM 332 O ALA A 23 -13.295 3.000 -4.802 1.00 0.00 O ATOM 333 CB ALA A 23 -14.053 0.747 -6.421 1.00 0.00 C ATOM 0 H ALA A 23 -14.783 2.554 -7.968 1.00 0.00 H new ATOM 0 HA ALA A 23 -15.979 1.391 -5.693 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -13.897 0.041 -5.606 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -14.468 0.222 -7.281 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -13.100 1.199 -6.697 1.00 0.00 H new ATOM 339 N PRO A 24 -15.224 2.715 -3.723 1.00 0.00 N ATOM 340 CA PRO A 24 -14.800 3.398 -2.486 1.00 0.00 C ATOM 341 C PRO A 24 -13.981 2.454 -1.599 1.00 0.00 C ATOM 342 O PRO A 24 -14.260 2.293 -0.427 1.00 0.00 O ATOM 343 CB PRO A 24 -16.124 3.753 -1.805 1.00 0.00 C ATOM 344 CG PRO A 24 -17.182 2.774 -2.368 1.00 0.00 C ATOM 345 CD PRO A 24 -16.612 2.214 -3.685 1.00 0.00 C ATOM 0 HA PRO A 24 -14.167 4.265 -2.676 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -16.042 3.656 -0.722 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -16.402 4.786 -2.012 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -17.381 1.970 -1.660 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -18.128 3.286 -2.543 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -16.642 1.125 -3.700 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -17.184 2.561 -4.546 1.00 0.00 H new ATOM 353 N TYR A 25 -12.972 1.828 -2.142 1.00 0.00 N ATOM 354 CA TYR A 25 -12.146 0.900 -1.321 1.00 0.00 C ATOM 355 C TYR A 25 -10.781 0.708 -1.983 1.00 0.00 C ATOM 356 O TYR A 25 -10.464 -0.356 -2.477 1.00 0.00 O ATOM 357 CB TYR A 25 -12.855 -0.451 -1.209 1.00 0.00 C ATOM 358 CG TYR A 25 -13.729 -0.455 0.022 1.00 0.00 C ATOM 359 CD1 TYR A 25 -13.177 -0.153 1.274 1.00 0.00 C ATOM 360 CD2 TYR A 25 -15.092 -0.759 -0.087 1.00 0.00 C ATOM 361 CE1 TYR A 25 -13.988 -0.155 2.416 1.00 0.00 C ATOM 362 CE2 TYR A 25 -15.904 -0.761 1.056 1.00 0.00 C ATOM 363 CZ TYR A 25 -15.352 -0.460 2.308 1.00 0.00 C ATOM 364 OH TYR A 25 -16.151 -0.462 3.433 1.00 0.00 O ATOM 0 H TYR A 25 -12.685 1.919 -3.117 1.00 0.00 H new ATOM 0 HA TYR A 25 -12.009 1.321 -0.325 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -13.459 -0.633 -2.098 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -12.122 -1.256 -1.151 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -12.126 0.081 1.358 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -15.518 -0.992 -1.052 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -13.562 0.079 3.381 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -16.955 -0.995 0.971 1.00 0.00 H new ATOM 0 HH TYR A 25 -16.134 0.426 3.848 1.00 0.00 H new ATOM 374 N PHE A 26 -9.968 1.728 -1.994 1.00 0.00 N ATOM 375 CA PHE A 26 -8.623 1.601 -2.621 1.00 0.00 C ATOM 376 C PHE A 26 -7.650 0.999 -1.606 1.00 0.00 C ATOM 377 O PHE A 26 -7.519 1.482 -0.498 1.00 0.00 O ATOM 378 CB PHE A 26 -8.127 2.982 -3.052 1.00 0.00 C ATOM 379 CG PHE A 26 -7.706 2.936 -4.501 1.00 0.00 C ATOM 380 CD1 PHE A 26 -8.673 2.997 -5.514 1.00 0.00 C ATOM 381 CD2 PHE A 26 -6.348 2.834 -4.833 1.00 0.00 C ATOM 382 CE1 PHE A 26 -8.282 2.954 -6.859 1.00 0.00 C ATOM 383 CE2 PHE A 26 -5.958 2.792 -6.177 1.00 0.00 C ATOM 384 CZ PHE A 26 -6.924 2.851 -7.191 1.00 0.00 C ATOM 0 H PHE A 26 -10.177 2.644 -1.596 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.686 0.953 -3.495 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.915 3.722 -2.915 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -7.288 3.290 -2.428 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -9.719 3.077 -5.258 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -5.603 2.788 -4.053 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -9.027 3.000 -7.640 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.912 2.714 -6.433 1.00 0.00 H new ATOM 0 HZ PHE A 26 -6.622 2.817 -8.227 1.00 0.00 H new ATOM 394 N MET A 27 -6.971 -0.053 -1.970 1.00 0.00 N ATOM 395 CA MET A 27 -6.012 -0.683 -1.019 1.00 0.00 C ATOM 396 C MET A 27 -4.584 -0.254 -1.362 1.00 0.00 C ATOM 397 O MET A 27 -4.103 -0.472 -2.457 1.00 0.00 O ATOM 398 CB MET A 27 -6.125 -2.206 -1.117 1.00 0.00 C ATOM 399 CG MET A 27 -7.154 -2.707 -0.102 1.00 0.00 C ATOM 400 SD MET A 27 -7.851 -4.277 -0.672 1.00 0.00 S ATOM 401 CE MET A 27 -7.965 -5.073 0.949 1.00 0.00 C ATOM 0 H MET A 27 -7.038 -0.503 -2.883 1.00 0.00 H new ATOM 0 HA MET A 27 -6.249 -0.363 -0.004 1.00 0.00 H new ATOM 0 HB2 MET A 27 -6.422 -2.495 -2.125 1.00 0.00 H new ATOM 0 HB3 MET A 27 -5.156 -2.666 -0.926 1.00 0.00 H new ATOM 0 HG2 MET A 27 -6.685 -2.838 0.873 1.00 0.00 H new ATOM 0 HG3 MET A 27 -7.947 -1.969 0.023 1.00 0.00 H new ATOM 0 HE1 MET A 27 -8.778 -5.799 0.941 1.00 0.00 H new ATOM 0 HE2 MET A 27 -7.027 -5.581 1.172 1.00 0.00 H new ATOM 0 HE3 MET A 27 -8.159 -4.319 1.712 1.00 0.00 H new ATOM 411 N ILE A 28 -3.900 0.350 -0.427 1.00 0.00 N ATOM 412 CA ILE A 28 -2.500 0.789 -0.686 1.00 0.00 C ATOM 413 C ILE A 28 -1.570 0.118 0.328 1.00 0.00 C ATOM 414 O ILE A 28 -1.833 0.112 1.514 1.00 0.00 O ATOM 415 CB ILE A 28 -2.403 2.309 -0.540 1.00 0.00 C ATOM 416 CG1 ILE A 28 -1.020 2.778 -1.005 1.00 0.00 C ATOM 417 CG2 ILE A 28 -2.602 2.695 0.926 1.00 0.00 C ATOM 418 CD1 ILE A 28 -1.119 3.337 -2.425 1.00 0.00 C ATOM 0 H ILE A 28 -4.253 0.558 0.507 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.208 0.506 -1.697 1.00 0.00 H new ATOM 0 HB ILE A 28 -3.174 2.782 -1.149 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.637 3.542 -0.328 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.315 1.947 -0.979 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.533 3.778 1.030 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.584 2.360 1.260 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -1.831 2.222 1.535 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -0.135 3.670 -2.754 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -1.483 2.560 -3.097 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.810 4.180 -2.437 1.00 0.00 H new ATOM 430 N VAL A 29 -0.486 -0.447 -0.127 1.00 0.00 N ATOM 431 CA VAL A 29 0.453 -1.117 0.815 1.00 0.00 C ATOM 432 C VAL A 29 1.894 -0.794 0.417 1.00 0.00 C ATOM 433 O VAL A 29 2.262 -0.875 -0.738 1.00 0.00 O ATOM 434 CB VAL A 29 0.236 -2.631 0.761 1.00 0.00 C ATOM 435 CG1 VAL A 29 0.570 -3.145 -0.641 1.00 0.00 C ATOM 436 CG2 VAL A 29 1.149 -3.310 1.784 1.00 0.00 C ATOM 0 H VAL A 29 -0.210 -0.474 -1.109 1.00 0.00 H new ATOM 0 HA VAL A 29 0.268 -0.759 1.828 1.00 0.00 H new ATOM 0 HB VAL A 29 -0.805 -2.859 0.992 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.416 -4.223 -0.680 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -0.078 -2.659 -1.371 1.00 0.00 H new ATOM 0 HG13 VAL A 29 1.611 -2.919 -0.873 1.00 0.00 H new ATOM 0 HG21 VAL A 29 0.997 -4.389 1.748 1.00 0.00 H new ATOM 0 HG22 VAL A 29 2.189 -3.082 1.551 1.00 0.00 H new ATOM 0 HG23 VAL A 29 0.912 -2.943 2.783 1.00 0.00 H new ATOM 446 N GLU A 30 2.713 -0.428 1.364 1.00 0.00 N ATOM 447 CA GLU A 30 4.129 -0.101 1.040 1.00 0.00 C ATOM 448 C GLU A 30 5.030 -1.264 1.461 1.00 0.00 C ATOM 449 O GLU A 30 4.853 -1.850 2.511 1.00 0.00 O ATOM 450 CB GLU A 30 4.544 1.165 1.792 1.00 0.00 C ATOM 451 CG GLU A 30 6.029 1.443 1.548 1.00 0.00 C ATOM 452 CD GLU A 30 6.665 1.975 2.833 1.00 0.00 C ATOM 453 OE1 GLU A 30 6.650 3.180 3.023 1.00 0.00 O ATOM 454 OE2 GLU A 30 7.155 1.170 3.607 1.00 0.00 O ATOM 0 H GLU A 30 2.462 -0.341 2.349 1.00 0.00 H new ATOM 0 HA GLU A 30 4.228 0.065 -0.033 1.00 0.00 H new ATOM 0 HB2 GLU A 30 3.945 2.012 1.457 1.00 0.00 H new ATOM 0 HB3 GLU A 30 4.357 1.044 2.859 1.00 0.00 H new ATOM 0 HG2 GLU A 30 6.534 0.530 1.230 1.00 0.00 H new ATOM 0 HG3 GLU A 30 6.147 2.169 0.743 1.00 0.00 H new ATOM 461 N MET A 31 5.996 -1.602 0.651 1.00 0.00 N ATOM 462 CA MET A 31 6.908 -2.725 1.007 1.00 0.00 C ATOM 463 C MET A 31 8.359 -2.274 0.836 1.00 0.00 C ATOM 464 O MET A 31 8.657 -1.390 0.058 1.00 0.00 O ATOM 465 CB MET A 31 6.631 -3.917 0.089 1.00 0.00 C ATOM 466 CG MET A 31 6.919 -3.522 -1.360 1.00 0.00 C ATOM 467 SD MET A 31 7.102 -5.014 -2.368 1.00 0.00 S ATOM 468 CE MET A 31 5.516 -5.773 -1.939 1.00 0.00 C ATOM 0 H MET A 31 6.193 -1.149 -0.241 1.00 0.00 H new ATOM 0 HA MET A 31 6.738 -3.019 2.043 1.00 0.00 H new ATOM 0 HB2 MET A 31 7.254 -4.764 0.377 1.00 0.00 H new ATOM 0 HB3 MET A 31 5.593 -4.235 0.191 1.00 0.00 H new ATOM 0 HG2 MET A 31 6.108 -2.905 -1.748 1.00 0.00 H new ATOM 0 HG3 MET A 31 7.828 -2.922 -1.411 1.00 0.00 H new ATOM 0 HE1 MET A 31 5.677 -6.562 -1.204 1.00 0.00 H new ATOM 0 HE2 MET A 31 4.852 -5.017 -1.520 1.00 0.00 H new ATOM 0 HE3 MET A 31 5.062 -6.198 -2.834 1.00 0.00 H new ATOM 478 N LYS A 32 9.265 -2.872 1.560 1.00 0.00 N ATOM 479 CA LYS A 32 10.695 -2.474 1.439 1.00 0.00 C ATOM 480 C LYS A 32 11.384 -3.342 0.385 1.00 0.00 C ATOM 481 O LYS A 32 11.624 -2.913 -0.726 1.00 0.00 O ATOM 482 CB LYS A 32 11.391 -2.661 2.790 1.00 0.00 C ATOM 483 CG LYS A 32 11.911 -1.311 3.288 1.00 0.00 C ATOM 484 CD LYS A 32 13.411 -1.412 3.567 1.00 0.00 C ATOM 485 CE LYS A 32 14.188 -0.689 2.464 1.00 0.00 C ATOM 486 NZ LYS A 32 15.051 0.364 3.072 1.00 0.00 N ATOM 0 H LYS A 32 9.077 -3.618 2.229 1.00 0.00 H new ATOM 0 HA LYS A 32 10.755 -1.428 1.139 1.00 0.00 H new ATOM 0 HB2 LYS A 32 10.695 -3.084 3.514 1.00 0.00 H new ATOM 0 HB3 LYS A 32 12.216 -3.366 2.691 1.00 0.00 H new ATOM 0 HG2 LYS A 32 11.720 -0.539 2.543 1.00 0.00 H new ATOM 0 HG3 LYS A 32 11.381 -1.017 4.194 1.00 0.00 H new ATOM 0 HD2 LYS A 32 13.641 -0.971 4.537 1.00 0.00 H new ATOM 0 HD3 LYS A 32 13.713 -2.458 3.613 1.00 0.00 H new ATOM 0 HE2 LYS A 32 14.800 -1.400 1.909 1.00 0.00 H new ATOM 0 HE3 LYS A 32 13.496 -0.240 1.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 15.579 0.855 2.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 14.457 1.048 3.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 15.720 -0.076 3.736 1.00 0.00 H new ATOM 500 N LYS A 33 11.707 -4.562 0.722 1.00 0.00 N ATOM 501 CA LYS A 33 12.383 -5.452 -0.263 1.00 0.00 C ATOM 502 C LYS A 33 11.369 -6.442 -0.843 1.00 0.00 C ATOM 503 O LYS A 33 10.957 -6.327 -1.980 1.00 0.00 O ATOM 504 CB LYS A 33 13.507 -6.222 0.432 1.00 0.00 C ATOM 505 CG LYS A 33 14.804 -6.057 -0.361 1.00 0.00 C ATOM 506 CD LYS A 33 15.729 -5.080 0.369 1.00 0.00 C ATOM 507 CE LYS A 33 17.184 -5.503 0.161 1.00 0.00 C ATOM 508 NZ LYS A 33 17.614 -5.140 -1.219 1.00 0.00 N ATOM 0 H LYS A 33 11.532 -4.979 1.636 1.00 0.00 H new ATOM 0 HA LYS A 33 12.800 -4.848 -1.069 1.00 0.00 H new ATOM 0 HB2 LYS A 33 13.640 -5.853 1.449 1.00 0.00 H new ATOM 0 HB3 LYS A 33 13.246 -7.278 0.508 1.00 0.00 H new ATOM 0 HG2 LYS A 33 15.297 -7.022 -0.478 1.00 0.00 H new ATOM 0 HG3 LYS A 33 14.585 -5.688 -1.363 1.00 0.00 H new ATOM 0 HD2 LYS A 33 15.576 -4.068 -0.007 1.00 0.00 H new ATOM 0 HD3 LYS A 33 15.492 -5.064 1.433 1.00 0.00 H new ATOM 0 HE2 LYS A 33 17.825 -5.013 0.894 1.00 0.00 H new ATOM 0 HE3 LYS A 33 17.287 -6.577 0.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 18.603 -5.427 -1.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 17.009 -5.627 -1.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 17.530 -4.112 -1.350 1.00 0.00 H new ATOM 522 N GLY A 34 10.964 -7.415 -0.073 1.00 0.00 N ATOM 523 CA GLY A 34 9.979 -8.409 -0.585 1.00 0.00 C ATOM 524 C GLY A 34 9.011 -8.796 0.534 1.00 0.00 C ATOM 525 O GLY A 34 8.454 -9.876 0.539 1.00 0.00 O ATOM 0 H GLY A 34 11.272 -7.564 0.888 1.00 0.00 H new ATOM 0 HA2 GLY A 34 9.428 -7.990 -1.427 1.00 0.00 H new ATOM 0 HA3 GLY A 34 10.498 -9.294 -0.953 1.00 0.00 H new ATOM 529 N ASN A 35 8.805 -7.924 1.483 1.00 0.00 N ATOM 530 CA ASN A 35 7.871 -8.246 2.598 1.00 0.00 C ATOM 531 C ASN A 35 7.051 -7.005 2.954 1.00 0.00 C ATOM 532 O ASN A 35 7.510 -6.127 3.659 1.00 0.00 O ATOM 533 CB ASN A 35 8.672 -8.696 3.823 1.00 0.00 C ATOM 534 CG ASN A 35 9.215 -10.106 3.588 1.00 0.00 C ATOM 535 OD1 ASN A 35 8.541 -10.942 3.020 1.00 0.00 O ATOM 536 ND2 ASN A 35 10.416 -10.408 4.003 1.00 0.00 N ATOM 0 H ASN A 35 9.243 -7.004 1.534 1.00 0.00 H new ATOM 0 HA ASN A 35 7.200 -9.047 2.287 1.00 0.00 H new ATOM 0 HB2 ASN A 35 9.494 -8.004 4.007 1.00 0.00 H new ATOM 0 HB3 ASN A 35 8.039 -8.682 4.710 1.00 0.00 H new ATOM 0 HD21 ASN A 35 10.788 -11.345 3.850 1.00 0.00 H new ATOM 0 HD22 ASN A 35 10.982 -9.706 4.480 1.00 0.00 H new ATOM 543 N ILE A 36 5.839 -6.923 2.474 1.00 0.00 N ATOM 544 CA ILE A 36 4.994 -5.737 2.790 1.00 0.00 C ATOM 545 C ILE A 36 5.007 -5.497 4.300 1.00 0.00 C ATOM 546 O ILE A 36 4.775 -6.396 5.084 1.00 0.00 O ATOM 547 CB ILE A 36 3.560 -5.992 2.324 1.00 0.00 C ATOM 548 CG1 ILE A 36 3.008 -7.236 3.022 1.00 0.00 C ATOM 549 CG2 ILE A 36 3.546 -6.210 0.810 1.00 0.00 C ATOM 550 CD1 ILE A 36 1.699 -7.657 2.351 1.00 0.00 C ATOM 0 H ILE A 36 5.399 -7.624 1.878 1.00 0.00 H new ATOM 0 HA ILE A 36 5.388 -4.860 2.277 1.00 0.00 H new ATOM 0 HB ILE A 36 2.940 -5.131 2.574 1.00 0.00 H new ATOM 0 HG12 ILE A 36 3.734 -8.048 2.970 1.00 0.00 H new ATOM 0 HG13 ILE A 36 2.838 -7.028 4.078 1.00 0.00 H new ATOM 0 HG21 ILE A 36 2.524 -6.392 0.478 1.00 0.00 H new ATOM 0 HG22 ILE A 36 3.937 -5.323 0.311 1.00 0.00 H new ATOM 0 HG23 ILE A 36 4.167 -7.070 0.561 1.00 0.00 H new ATOM 0 HD11 ILE A 36 1.304 -8.544 2.847 1.00 0.00 H new ATOM 0 HD12 ILE A 36 0.974 -6.846 2.426 1.00 0.00 H new ATOM 0 HD13 ILE A 36 1.884 -7.882 1.301 1.00 0.00 H new ATOM 562 N GLU A 37 5.282 -4.292 4.717 1.00 0.00 N ATOM 563 CA GLU A 37 5.318 -4.001 6.177 1.00 0.00 C ATOM 564 C GLU A 37 4.176 -3.050 6.545 1.00 0.00 C ATOM 565 O GLU A 37 4.020 -2.671 7.688 1.00 0.00 O ATOM 566 CB GLU A 37 6.655 -3.349 6.532 1.00 0.00 C ATOM 567 CG GLU A 37 6.726 -1.955 5.906 1.00 0.00 C ATOM 568 CD GLU A 37 8.062 -1.301 6.264 1.00 0.00 C ATOM 569 OE1 GLU A 37 8.263 -1.013 7.432 1.00 0.00 O ATOM 570 OE2 GLU A 37 8.862 -1.102 5.365 1.00 0.00 O ATOM 0 H GLU A 37 5.483 -3.497 4.110 1.00 0.00 H new ATOM 0 HA GLU A 37 5.204 -4.932 6.732 1.00 0.00 H new ATOM 0 HB2 GLU A 37 6.761 -3.279 7.615 1.00 0.00 H new ATOM 0 HB3 GLU A 37 7.479 -3.964 6.170 1.00 0.00 H new ATOM 0 HG2 GLU A 37 6.622 -2.026 4.823 1.00 0.00 H new ATOM 0 HG3 GLU A 37 5.901 -1.341 6.266 1.00 0.00 H new ATOM 577 N SER A 38 3.376 -2.658 5.591 1.00 0.00 N ATOM 578 CA SER A 38 2.253 -1.729 5.905 1.00 0.00 C ATOM 579 C SER A 38 1.151 -1.865 4.852 1.00 0.00 C ATOM 580 O SER A 38 1.309 -1.465 3.716 1.00 0.00 O ATOM 581 CB SER A 38 2.768 -0.290 5.916 1.00 0.00 C ATOM 582 OG SER A 38 4.092 -0.261 5.397 1.00 0.00 O ATOM 0 H SER A 38 3.450 -2.939 4.613 1.00 0.00 H new ATOM 0 HA SER A 38 1.846 -1.981 6.884 1.00 0.00 H new ATOM 0 HB2 SER A 38 2.116 0.346 5.317 1.00 0.00 H new ATOM 0 HB3 SER A 38 2.754 0.106 6.932 1.00 0.00 H new ATOM 0 HG SER A 38 4.425 0.661 5.401 1.00 0.00 H new ATOM 588 N SER A 39 0.028 -2.413 5.228 1.00 0.00 N ATOM 589 CA SER A 39 -1.094 -2.564 4.259 1.00 0.00 C ATOM 590 C SER A 39 -2.312 -1.811 4.791 1.00 0.00 C ATOM 591 O SER A 39 -3.021 -2.287 5.656 1.00 0.00 O ATOM 592 CB SER A 39 -1.439 -4.046 4.098 1.00 0.00 C ATOM 593 OG SER A 39 -0.411 -4.834 4.684 1.00 0.00 O ATOM 0 H SER A 39 -0.161 -2.764 6.167 1.00 0.00 H new ATOM 0 HA SER A 39 -0.801 -2.158 3.291 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.395 -4.262 4.574 1.00 0.00 H new ATOM 0 HB3 SER A 39 -1.546 -4.294 3.042 1.00 0.00 H new ATOM 0 HG SER A 39 -0.630 -5.784 4.584 1.00 0.00 H new ATOM 599 N GLU A 40 -2.556 -0.631 4.291 1.00 0.00 N ATOM 600 CA GLU A 40 -3.722 0.159 4.779 1.00 0.00 C ATOM 601 C GLU A 40 -4.812 0.194 3.708 1.00 0.00 C ATOM 602 O GLU A 40 -4.559 -0.026 2.539 1.00 0.00 O ATOM 603 CB GLU A 40 -3.276 1.589 5.096 1.00 0.00 C ATOM 604 CG GLU A 40 -1.819 1.581 5.564 1.00 0.00 C ATOM 605 CD GLU A 40 -1.668 2.496 6.781 1.00 0.00 C ATOM 606 OE1 GLU A 40 -2.677 2.815 7.387 1.00 0.00 O ATOM 607 OE2 GLU A 40 -0.544 2.862 7.086 1.00 0.00 O ATOM 0 H GLU A 40 -1.999 -0.180 3.566 1.00 0.00 H new ATOM 0 HA GLU A 40 -4.118 -0.310 5.680 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -3.381 2.218 4.212 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -3.914 2.017 5.869 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -1.513 0.566 5.819 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -1.166 1.918 4.759 1.00 0.00 H new ATOM 614 N VAL A 41 -6.026 0.473 4.100 1.00 0.00 N ATOM 615 CA VAL A 41 -7.138 0.529 3.111 1.00 0.00 C ATOM 616 C VAL A 41 -7.901 1.843 3.288 1.00 0.00 C ATOM 617 O VAL A 41 -8.400 2.143 4.354 1.00 0.00 O ATOM 618 CB VAL A 41 -8.086 -0.649 3.344 1.00 0.00 C ATOM 619 CG1 VAL A 41 -8.930 -0.883 2.088 1.00 0.00 C ATOM 620 CG2 VAL A 41 -7.269 -1.906 3.650 1.00 0.00 C ATOM 0 H VAL A 41 -6.295 0.665 5.065 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.735 0.473 2.100 1.00 0.00 H new ATOM 0 HB VAL A 41 -8.742 -0.426 4.185 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -9.605 -1.722 2.255 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -9.511 0.012 1.868 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -8.275 -1.106 1.246 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -7.943 -2.746 3.816 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -6.613 -2.128 2.808 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -6.668 -1.741 4.544 1.00 0.00 H new ATOM 630 N ILE A 42 -7.992 2.633 2.253 1.00 0.00 N ATOM 631 CA ILE A 42 -8.720 3.927 2.365 1.00 0.00 C ATOM 632 C ILE A 42 -9.998 3.870 1.528 1.00 0.00 C ATOM 633 O ILE A 42 -10.026 3.298 0.457 1.00 0.00 O ATOM 634 CB ILE A 42 -7.826 5.059 1.856 1.00 0.00 C ATOM 635 CG1 ILE A 42 -6.544 5.109 2.692 1.00 0.00 C ATOM 636 CG2 ILE A 42 -8.565 6.392 1.979 1.00 0.00 C ATOM 637 CD1 ILE A 42 -5.377 4.558 1.871 1.00 0.00 C ATOM 0 H ILE A 42 -7.593 2.437 1.335 1.00 0.00 H new ATOM 0 HA ILE A 42 -8.979 4.109 3.408 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.575 4.880 0.811 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -6.336 6.135 2.997 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -6.669 4.525 3.604 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -7.926 7.197 1.616 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -9.478 6.358 1.385 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -8.818 6.573 3.024 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -4.465 4.594 2.466 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -5.586 3.526 1.589 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -5.248 5.161 0.972 1.00 0.00 H new ATOM 649 N GLU A 43 -11.059 4.460 2.009 1.00 0.00 N ATOM 650 CA GLU A 43 -12.335 4.440 1.240 1.00 0.00 C ATOM 651 C GLU A 43 -12.365 5.631 0.278 1.00 0.00 C ATOM 652 O GLU A 43 -11.675 6.613 0.470 1.00 0.00 O ATOM 653 CB GLU A 43 -13.516 4.534 2.210 1.00 0.00 C ATOM 654 CG GLU A 43 -13.751 3.169 2.863 1.00 0.00 C ATOM 655 CD GLU A 43 -15.251 2.950 3.064 1.00 0.00 C ATOM 656 OE1 GLU A 43 -16.011 3.359 2.202 1.00 0.00 O ATOM 657 OE2 GLU A 43 -15.616 2.377 4.078 1.00 0.00 O ATOM 0 H GLU A 43 -11.097 4.954 2.900 1.00 0.00 H new ATOM 0 HA GLU A 43 -12.406 3.512 0.673 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.314 5.284 2.974 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -14.412 4.854 1.678 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -13.338 2.378 2.236 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -13.234 3.119 3.821 1.00 0.00 H new ATOM 664 N ASN A 44 -13.155 5.552 -0.756 1.00 0.00 N ATOM 665 CA ASN A 44 -13.223 6.679 -1.728 1.00 0.00 C ATOM 666 C ASN A 44 -14.651 7.236 -1.767 1.00 0.00 C ATOM 667 O ASN A 44 -15.523 6.646 -2.375 1.00 0.00 O ATOM 668 CB ASN A 44 -12.836 6.172 -3.119 1.00 0.00 C ATOM 669 CG ASN A 44 -12.102 7.279 -3.879 1.00 0.00 C ATOM 670 OD1 ASN A 44 -12.495 8.428 -3.832 1.00 0.00 O ATOM 671 ND2 ASN A 44 -11.044 6.980 -4.581 1.00 0.00 N ATOM 0 H ASN A 44 -13.756 4.756 -0.970 1.00 0.00 H new ATOM 0 HA ASN A 44 -12.535 7.467 -1.421 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -12.199 5.292 -3.033 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -13.727 5.868 -3.668 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -10.547 7.711 -5.090 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -10.714 6.016 -4.621 1.00 0.00 H new ATOM 678 N PRO A 45 -14.849 8.357 -1.119 1.00 0.00 N ATOM 679 CA PRO A 45 -16.166 9.016 -1.065 1.00 0.00 C ATOM 680 C PRO A 45 -16.454 9.745 -2.381 1.00 0.00 C ATOM 681 O PRO A 45 -15.756 9.576 -3.361 1.00 0.00 O ATOM 682 CB PRO A 45 -16.026 10.008 0.093 1.00 0.00 C ATOM 683 CG PRO A 45 -14.510 10.267 0.263 1.00 0.00 C ATOM 684 CD PRO A 45 -13.785 9.072 -0.385 1.00 0.00 C ATOM 0 HA PRO A 45 -16.990 8.317 -0.921 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -16.557 10.935 -0.123 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -16.456 9.600 1.008 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -14.220 11.202 -0.216 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -14.247 10.354 1.317 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -12.992 9.403 -1.056 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -13.321 8.433 0.366 1.00 0.00 H new ATOM 692 N SER A 46 -17.477 10.553 -2.410 1.00 0.00 N ATOM 693 CA SER A 46 -17.809 11.288 -3.662 1.00 0.00 C ATOM 694 C SER A 46 -17.974 10.288 -4.807 1.00 0.00 C ATOM 695 O SER A 46 -17.613 10.556 -5.936 1.00 0.00 O ATOM 696 CB SER A 46 -16.681 12.266 -3.995 1.00 0.00 C ATOM 697 OG SER A 46 -17.047 13.570 -3.563 1.00 0.00 O ATOM 0 H SER A 46 -18.097 10.736 -1.621 1.00 0.00 H new ATOM 0 HA SER A 46 -18.738 11.842 -3.525 1.00 0.00 H new ATOM 0 HB2 SER A 46 -15.758 11.954 -3.506 1.00 0.00 H new ATOM 0 HB3 SER A 46 -16.489 12.266 -5.068 1.00 0.00 H new ATOM 0 HG SER A 46 -16.325 14.199 -3.773 1.00 0.00 H new ATOM 703 N ALA A 47 -18.516 9.135 -4.526 1.00 0.00 N ATOM 704 CA ALA A 47 -18.702 8.116 -5.597 1.00 0.00 C ATOM 705 C ALA A 47 -19.826 8.561 -6.533 1.00 0.00 C ATOM 706 O ALA A 47 -19.644 8.672 -7.730 1.00 0.00 O ATOM 707 CB ALA A 47 -19.067 6.773 -4.964 1.00 0.00 C ATOM 0 H ALA A 47 -18.838 8.854 -3.600 1.00 0.00 H new ATOM 0 HA ALA A 47 -17.777 8.011 -6.164 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -19.203 6.027 -5.747 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -18.266 6.456 -4.296 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -19.992 6.877 -4.397 1.00 0.00 H new ATOM 713 N SER A 48 -20.991 8.815 -6.001 1.00 0.00 N ATOM 714 CA SER A 48 -22.125 9.250 -6.863 1.00 0.00 C ATOM 715 C SER A 48 -22.741 10.528 -6.293 1.00 0.00 C ATOM 716 O SER A 48 -23.835 10.519 -5.766 1.00 0.00 O ATOM 717 CB SER A 48 -23.185 8.149 -6.904 1.00 0.00 C ATOM 718 OG SER A 48 -22.604 6.923 -6.482 1.00 0.00 O ATOM 0 H SER A 48 -21.206 8.740 -5.007 1.00 0.00 H new ATOM 0 HA SER A 48 -21.760 9.442 -7.872 1.00 0.00 H new ATOM 0 HB2 SER A 48 -24.022 8.410 -6.257 1.00 0.00 H new ATOM 0 HB3 SER A 48 -23.582 8.048 -7.914 1.00 0.00 H new ATOM 0 HG SER A 48 -23.281 6.215 -6.505 1.00 0.00 H new ATOM 724 N ALA A 49 -22.049 11.630 -6.397 1.00 0.00 N ATOM 725 CA ALA A 49 -22.599 12.907 -5.864 1.00 0.00 C ATOM 726 C ALA A 49 -22.151 14.068 -6.756 1.00 0.00 C ATOM 727 O ALA A 49 -22.836 14.447 -7.686 1.00 0.00 O ATOM 728 CB ALA A 49 -22.084 13.131 -4.440 1.00 0.00 C ATOM 0 H ALA A 49 -21.127 11.700 -6.828 1.00 0.00 H new ATOM 0 HA ALA A 49 -23.688 12.856 -5.853 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -22.487 14.066 -4.050 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -22.403 12.305 -3.804 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -20.995 13.182 -4.451 1.00 0.00 H new ATOM 734 N SER A 50 -21.008 14.633 -6.482 1.00 0.00 N ATOM 735 CA SER A 50 -20.519 15.768 -7.317 1.00 0.00 C ATOM 736 C SER A 50 -20.592 15.380 -8.796 1.00 0.00 C ATOM 737 O SER A 50 -20.939 16.182 -9.640 1.00 0.00 O ATOM 738 CB SER A 50 -19.072 16.091 -6.945 1.00 0.00 C ATOM 739 OG SER A 50 -18.461 16.805 -8.010 1.00 0.00 O ATOM 0 H SER A 50 -20.391 14.359 -5.717 1.00 0.00 H new ATOM 0 HA SER A 50 -21.142 16.644 -7.139 1.00 0.00 H new ATOM 0 HB2 SER A 50 -19.043 16.684 -6.031 1.00 0.00 H new ATOM 0 HB3 SER A 50 -18.522 15.171 -6.746 1.00 0.00 H new ATOM 0 HG SER A 50 -17.533 17.015 -7.773 1.00 0.00 H new ATOM 745 N GLY A 51 -20.267 14.158 -9.116 1.00 0.00 N ATOM 746 CA GLY A 51 -20.319 13.722 -10.540 1.00 0.00 C ATOM 747 C GLY A 51 -19.726 12.316 -10.666 1.00 0.00 C ATOM 748 O GLY A 51 -19.498 11.639 -9.684 1.00 0.00 O ATOM 0 H GLY A 51 -19.968 13.443 -8.453 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -21.349 13.727 -10.895 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -19.763 14.420 -11.166 1.00 0.00 H new ATOM 752 N GLY A 52 -19.474 11.874 -11.868 1.00 0.00 N ATOM 753 CA GLY A 52 -18.894 10.514 -12.056 1.00 0.00 C ATOM 754 C GLY A 52 -17.380 10.627 -12.234 1.00 0.00 C ATOM 755 O GLY A 52 -16.873 10.617 -13.338 1.00 0.00 O ATOM 0 H GLY A 52 -19.645 12.396 -12.728 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -19.124 9.886 -11.195 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -19.339 10.034 -12.928 1.00 0.00 H new ATOM 759 N ALA A 53 -16.654 10.737 -11.155 1.00 0.00 N ATOM 760 CA ALA A 53 -15.173 10.854 -11.263 1.00 0.00 C ATOM 761 C ALA A 53 -14.561 9.471 -11.487 1.00 0.00 C ATOM 762 O ALA A 53 -14.834 8.534 -10.762 1.00 0.00 O ATOM 763 CB ALA A 53 -14.615 11.454 -9.972 1.00 0.00 C ATOM 0 H ALA A 53 -17.023 10.751 -10.204 1.00 0.00 H new ATOM 0 HA ALA A 53 -14.923 11.500 -12.105 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -13.531 11.540 -10.050 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -15.047 12.442 -9.813 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -14.868 10.808 -9.131 1.00 0.00 H new ATOM 769 N GLY A 54 -13.733 9.335 -12.486 1.00 0.00 N ATOM 770 CA GLY A 54 -13.100 8.014 -12.759 1.00 0.00 C ATOM 771 C GLY A 54 -11.651 8.227 -13.201 1.00 0.00 C ATOM 772 O GLY A 54 -10.723 7.785 -12.552 1.00 0.00 O ATOM 0 H GLY A 54 -13.467 10.083 -13.126 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -13.131 7.392 -11.865 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.655 7.486 -13.535 1.00 0.00 H new ATOM 776 N ILE A 55 -11.449 8.904 -14.298 1.00 0.00 N ATOM 777 CA ILE A 55 -10.061 9.147 -14.779 1.00 0.00 C ATOM 778 C ILE A 55 -9.414 10.241 -13.927 1.00 0.00 C ATOM 779 O ILE A 55 -8.208 10.392 -13.904 1.00 0.00 O ATOM 780 CB ILE A 55 -10.101 9.595 -16.241 1.00 0.00 C ATOM 781 CG1 ILE A 55 -10.910 8.587 -17.062 1.00 0.00 C ATOM 782 CG2 ILE A 55 -8.675 9.674 -16.792 1.00 0.00 C ATOM 783 CD1 ILE A 55 -10.383 7.174 -16.802 1.00 0.00 C ATOM 0 H ILE A 55 -12.186 9.299 -14.882 1.00 0.00 H new ATOM 0 HA ILE A 55 -9.479 8.229 -14.696 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.570 10.577 -16.306 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -11.965 8.648 -16.794 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -10.836 8.824 -18.123 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -8.705 9.993 -17.834 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -8.099 10.392 -16.209 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -8.205 8.693 -16.726 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -10.960 6.457 -17.387 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -9.334 7.118 -17.092 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -10.480 6.939 -15.742 1.00 0.00 H new ATOM 795 N ARG A 56 -10.207 11.005 -13.226 1.00 0.00 N ATOM 796 CA ARG A 56 -9.637 12.088 -12.374 1.00 0.00 C ATOM 797 C ARG A 56 -9.041 11.474 -11.108 1.00 0.00 C ATOM 798 O ARG A 56 -8.275 12.100 -10.403 1.00 0.00 O ATOM 799 CB ARG A 56 -10.745 13.072 -11.991 1.00 0.00 C ATOM 800 CG ARG A 56 -10.291 14.499 -12.298 1.00 0.00 C ATOM 801 CD ARG A 56 -10.981 14.991 -13.571 1.00 0.00 C ATOM 802 NE ARG A 56 -12.323 15.539 -13.227 1.00 0.00 N ATOM 803 CZ ARG A 56 -12.530 16.828 -13.261 1.00 0.00 C ATOM 804 NH1 ARG A 56 -11.962 17.554 -14.184 1.00 0.00 N ATOM 805 NH2 ARG A 56 -13.304 17.388 -12.373 1.00 0.00 N ATOM 0 H ARG A 56 -11.224 10.926 -13.206 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.859 12.615 -12.925 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -11.656 12.843 -12.543 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -10.982 12.975 -10.931 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.533 15.157 -11.463 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -9.209 14.529 -12.424 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -10.375 15.759 -14.053 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -11.082 14.172 -14.283 1.00 0.00 H new ATOM 0 HE ARG A 56 -13.080 14.908 -12.965 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -11.357 17.115 -14.878 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -12.123 18.561 -14.212 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -13.748 16.819 -11.652 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -13.466 18.395 -12.400 1.00 0.00 H new ATOM 819 N THR A 57 -9.389 10.251 -10.812 1.00 0.00 N ATOM 820 CA THR A 57 -8.844 9.595 -9.591 1.00 0.00 C ATOM 821 C THR A 57 -7.372 9.248 -9.813 1.00 0.00 C ATOM 822 O THR A 57 -6.604 9.128 -8.879 1.00 0.00 O ATOM 823 CB THR A 57 -9.635 8.316 -9.305 1.00 0.00 C ATOM 824 OG1 THR A 57 -9.303 7.835 -8.011 1.00 0.00 O ATOM 825 CG2 THR A 57 -9.290 7.255 -10.352 1.00 0.00 C ATOM 0 H THR A 57 -10.028 9.678 -11.364 1.00 0.00 H new ATOM 0 HA THR A 57 -8.932 10.273 -8.742 1.00 0.00 H new ATOM 0 HB THR A 57 -10.703 8.531 -9.349 1.00 0.00 H new ATOM 0 HG1 THR A 57 -9.810 7.017 -7.826 1.00 0.00 H new ATOM 0 HG21 THR A 57 -9.854 6.345 -10.147 1.00 0.00 H new ATOM 0 HG22 THR A 57 -9.547 7.626 -11.344 1.00 0.00 H new ATOM 0 HG23 THR A 57 -8.223 7.037 -10.312 1.00 0.00 H new ATOM 833 N ALA A 58 -6.968 9.087 -11.043 1.00 0.00 N ATOM 834 CA ALA A 58 -5.543 8.750 -11.322 1.00 0.00 C ATOM 835 C ALA A 58 -4.645 9.858 -10.770 1.00 0.00 C ATOM 836 O ALA A 58 -3.566 9.607 -10.272 1.00 0.00 O ATOM 837 CB ALA A 58 -5.333 8.626 -12.832 1.00 0.00 C ATOM 0 H ALA A 58 -7.563 9.174 -11.867 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.291 7.803 -10.844 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -4.291 8.380 -13.035 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -5.976 7.838 -13.225 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.583 9.572 -13.313 1.00 0.00 H new ATOM 843 N GLN A 59 -5.083 11.084 -10.856 1.00 0.00 N ATOM 844 CA GLN A 59 -4.257 12.210 -10.337 1.00 0.00 C ATOM 845 C GLN A 59 -4.244 12.172 -8.807 1.00 0.00 C ATOM 846 O GLN A 59 -3.351 12.695 -8.172 1.00 0.00 O ATOM 847 CB GLN A 59 -4.855 13.537 -10.809 1.00 0.00 C ATOM 848 CG GLN A 59 -5.331 13.396 -12.257 1.00 0.00 C ATOM 849 CD GLN A 59 -5.136 14.725 -12.989 1.00 0.00 C ATOM 850 OE1 GLN A 59 -4.702 15.696 -12.403 1.00 0.00 O ATOM 851 NE2 GLN A 59 -5.437 14.806 -14.256 1.00 0.00 N ATOM 0 H GLN A 59 -5.978 11.355 -11.264 1.00 0.00 H new ATOM 0 HA GLN A 59 -3.237 12.116 -10.710 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -5.689 13.821 -10.167 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -4.111 14.330 -10.735 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -4.772 12.606 -12.760 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -6.382 13.107 -12.279 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -5.801 13.989 -14.747 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -5.308 15.686 -14.756 1.00 0.00 H new ATOM 860 N ILE A 60 -5.229 11.558 -8.211 1.00 0.00 N ATOM 861 CA ILE A 60 -5.271 11.488 -6.722 1.00 0.00 C ATOM 862 C ILE A 60 -4.278 10.433 -6.233 1.00 0.00 C ATOM 863 O ILE A 60 -3.420 10.705 -5.417 1.00 0.00 O ATOM 864 CB ILE A 60 -6.682 11.109 -6.267 1.00 0.00 C ATOM 865 CG1 ILE A 60 -7.699 12.046 -6.923 1.00 0.00 C ATOM 866 CG2 ILE A 60 -6.780 11.237 -4.746 1.00 0.00 C ATOM 867 CD1 ILE A 60 -7.241 13.495 -6.753 1.00 0.00 C ATOM 0 H ILE A 60 -6.006 11.102 -8.690 1.00 0.00 H new ATOM 0 HA ILE A 60 -5.004 12.460 -6.306 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.893 10.080 -6.560 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.800 11.807 -7.982 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -8.681 11.908 -6.470 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -7.785 10.967 -4.422 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.056 10.570 -4.277 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -6.568 12.265 -4.453 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -7.965 14.163 -7.220 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -7.163 13.730 -5.691 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -6.268 13.627 -7.226 1.00 0.00 H new ATOM 879 N ILE A 61 -4.388 9.229 -6.724 1.00 0.00 N ATOM 880 CA ILE A 61 -3.450 8.156 -6.286 1.00 0.00 C ATOM 881 C ILE A 61 -2.038 8.481 -6.773 1.00 0.00 C ATOM 882 O ILE A 61 -1.057 8.083 -6.177 1.00 0.00 O ATOM 883 CB ILE A 61 -3.898 6.817 -6.874 1.00 0.00 C ATOM 884 CG1 ILE A 61 -4.344 7.020 -8.324 1.00 0.00 C ATOM 885 CG2 ILE A 61 -5.064 6.262 -6.057 1.00 0.00 C ATOM 886 CD1 ILE A 61 -3.748 5.917 -9.201 1.00 0.00 C ATOM 0 H ILE A 61 -5.087 8.942 -7.409 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.452 8.094 -5.198 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.067 6.113 -6.843 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.432 7.001 -8.387 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.021 7.998 -8.681 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -5.382 5.308 -6.478 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -4.748 6.116 -5.024 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -5.896 6.966 -6.085 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.066 6.062 -10.234 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.660 5.957 -9.147 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.093 4.945 -8.848 1.00 0.00 H new ATOM 898 N ALA A 62 -1.925 9.202 -7.855 1.00 0.00 N ATOM 899 CA ALA A 62 -0.575 9.552 -8.382 1.00 0.00 C ATOM 900 C ALA A 62 0.139 10.473 -7.391 1.00 0.00 C ATOM 901 O ALA A 62 1.343 10.420 -7.237 1.00 0.00 O ATOM 902 CB ALA A 62 -0.723 10.267 -9.727 1.00 0.00 C ATOM 0 H ALA A 62 -2.709 9.564 -8.397 1.00 0.00 H new ATOM 0 HA ALA A 62 0.009 8.642 -8.516 1.00 0.00 H new ATOM 0 HB1 ALA A 62 0.263 10.523 -10.113 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -1.230 9.611 -10.434 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -1.308 11.177 -9.593 1.00 0.00 H new ATOM 908 N ASN A 63 -0.592 11.320 -6.719 1.00 0.00 N ATOM 909 CA ASN A 63 0.047 12.244 -5.740 1.00 0.00 C ATOM 910 C ASN A 63 0.383 11.481 -4.457 1.00 0.00 C ATOM 911 O ASN A 63 1.071 11.980 -3.589 1.00 0.00 O ATOM 912 CB ASN A 63 -0.916 13.388 -5.415 1.00 0.00 C ATOM 913 CG ASN A 63 -0.560 14.612 -6.261 1.00 0.00 C ATOM 914 OD1 ASN A 63 0.225 15.442 -5.850 1.00 0.00 O ATOM 915 ND2 ASN A 63 -1.110 14.759 -7.435 1.00 0.00 N ATOM 0 H ASN A 63 -1.604 11.412 -6.806 1.00 0.00 H new ATOM 0 HA ASN A 63 0.963 12.649 -6.170 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -1.943 13.081 -5.615 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -0.858 13.636 -4.355 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -0.880 15.571 -8.008 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -1.769 14.062 -7.780 1.00 0.00 H new ATOM 922 N ASN A 64 -0.098 10.275 -4.330 1.00 0.00 N ATOM 923 CA ASN A 64 0.193 9.483 -3.099 1.00 0.00 C ATOM 924 C ASN A 64 1.554 8.799 -3.239 1.00 0.00 C ATOM 925 O ASN A 64 2.105 8.291 -2.283 1.00 0.00 O ATOM 926 CB ASN A 64 -0.894 8.423 -2.906 1.00 0.00 C ATOM 927 CG ASN A 64 -1.898 8.906 -1.858 1.00 0.00 C ATOM 928 OD1 ASN A 64 -2.127 10.092 -1.719 1.00 0.00 O ATOM 929 ND2 ASN A 64 -2.510 8.032 -1.109 1.00 0.00 N ATOM 0 H ASN A 64 -0.679 9.803 -5.023 1.00 0.00 H new ATOM 0 HA ASN A 64 0.210 10.148 -2.236 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -1.402 8.232 -3.851 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -0.446 7.481 -2.589 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -3.181 8.343 -0.406 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -2.318 7.037 -1.226 1.00 0.00 H new ATOM 936 N GLY A 65 2.104 8.783 -4.422 1.00 0.00 N ATOM 937 CA GLY A 65 3.430 8.131 -4.618 1.00 0.00 C ATOM 938 C GLY A 65 3.232 6.710 -5.150 1.00 0.00 C ATOM 939 O GLY A 65 4.178 5.982 -5.371 1.00 0.00 O ATOM 0 H GLY A 65 1.693 9.193 -5.261 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.031 8.711 -5.318 1.00 0.00 H new ATOM 0 HA3 GLY A 65 3.976 8.104 -3.675 1.00 0.00 H new ATOM 943 N VAL A 66 2.007 6.309 -5.359 1.00 0.00 N ATOM 944 CA VAL A 66 1.750 4.937 -5.879 1.00 0.00 C ATOM 945 C VAL A 66 2.655 4.661 -7.075 1.00 0.00 C ATOM 946 O VAL A 66 2.365 5.044 -8.191 1.00 0.00 O ATOM 947 CB VAL A 66 0.288 4.821 -6.314 1.00 0.00 C ATOM 948 CG1 VAL A 66 -0.624 5.097 -5.118 1.00 0.00 C ATOM 949 CG2 VAL A 66 0.003 5.841 -7.419 1.00 0.00 C ATOM 0 H VAL A 66 1.174 6.873 -5.192 1.00 0.00 H new ATOM 0 HA VAL A 66 1.957 4.211 -5.093 1.00 0.00 H new ATOM 0 HB VAL A 66 0.099 3.815 -6.690 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.666 5.014 -5.428 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.421 4.371 -4.331 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -0.436 6.103 -4.742 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.039 5.759 -7.730 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.192 6.847 -7.043 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.653 5.644 -8.272 1.00 0.00 H new ATOM 959 N LYS A 67 3.745 3.979 -6.855 1.00 0.00 N ATOM 960 CA LYS A 67 4.654 3.659 -7.985 1.00 0.00 C ATOM 961 C LYS A 67 4.056 2.484 -8.757 1.00 0.00 C ATOM 962 O LYS A 67 4.482 2.160 -9.848 1.00 0.00 O ATOM 963 CB LYS A 67 6.032 3.272 -7.445 1.00 0.00 C ATOM 964 CG LYS A 67 6.996 4.447 -7.610 1.00 0.00 C ATOM 965 CD LYS A 67 8.125 4.053 -8.566 1.00 0.00 C ATOM 966 CE LYS A 67 7.574 3.933 -9.988 1.00 0.00 C ATOM 967 NZ LYS A 67 8.226 4.949 -10.861 1.00 0.00 N ATOM 0 H LYS A 67 4.043 3.631 -5.943 1.00 0.00 H new ATOM 0 HA LYS A 67 4.764 4.525 -8.638 1.00 0.00 H new ATOM 0 HB2 LYS A 67 5.957 2.995 -6.393 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.411 2.400 -7.978 1.00 0.00 H new ATOM 0 HG2 LYS A 67 6.464 5.316 -7.998 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.408 4.731 -6.642 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.919 4.799 -8.534 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.565 3.106 -8.254 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.758 2.932 -10.377 1.00 0.00 H new ATOM 0 HE3 LYS A 67 6.494 4.080 -9.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 7.520 5.355 -11.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 8.631 5.704 -10.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.983 4.498 -11.413 1.00 0.00 H new ATOM 981 N ALA A 68 3.055 1.854 -8.200 1.00 0.00 N ATOM 982 CA ALA A 68 2.408 0.711 -8.896 1.00 0.00 C ATOM 983 C ALA A 68 0.899 0.811 -8.682 1.00 0.00 C ATOM 984 O ALA A 68 0.435 0.920 -7.569 1.00 0.00 O ATOM 985 CB ALA A 68 2.925 -0.607 -8.311 1.00 0.00 C ATOM 0 H ALA A 68 2.659 2.086 -7.289 1.00 0.00 H new ATOM 0 HA ALA A 68 2.639 0.739 -9.961 1.00 0.00 H new ATOM 0 HB1 ALA A 68 2.449 -1.444 -8.823 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.005 -0.666 -8.446 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.689 -0.651 -7.248 1.00 0.00 H new ATOM 991 N VAL A 69 0.128 0.796 -9.731 1.00 0.00 N ATOM 992 CA VAL A 69 -1.349 0.907 -9.560 1.00 0.00 C ATOM 993 C VAL A 69 -2.040 -0.258 -10.268 1.00 0.00 C ATOM 994 O VAL A 69 -1.846 -0.483 -11.444 1.00 0.00 O ATOM 995 CB VAL A 69 -1.832 2.228 -10.160 1.00 0.00 C ATOM 996 CG1 VAL A 69 -3.360 2.271 -10.138 1.00 0.00 C ATOM 997 CG2 VAL A 69 -1.277 3.393 -9.336 1.00 0.00 C ATOM 0 H VAL A 69 0.452 0.712 -10.695 1.00 0.00 H new ATOM 0 HA VAL A 69 -1.593 0.877 -8.498 1.00 0.00 H new ATOM 0 HB VAL A 69 -1.482 2.310 -11.189 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -3.704 3.213 -10.566 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -3.756 1.441 -10.723 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -3.711 2.190 -9.109 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -1.620 4.336 -9.762 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -1.628 3.311 -8.307 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.188 3.363 -9.351 1.00 0.00 H new ATOM 1007 N ILE A 70 -2.847 -1.001 -9.562 1.00 0.00 N ATOM 1008 CA ILE A 70 -3.549 -2.148 -10.201 1.00 0.00 C ATOM 1009 C ILE A 70 -5.012 -1.773 -10.446 1.00 0.00 C ATOM 1010 O ILE A 70 -5.845 -1.869 -9.565 1.00 0.00 O ATOM 1011 CB ILE A 70 -3.478 -3.369 -9.283 1.00 0.00 C ATOM 1012 CG1 ILE A 70 -2.030 -3.861 -9.203 1.00 0.00 C ATOM 1013 CG2 ILE A 70 -4.360 -4.485 -9.846 1.00 0.00 C ATOM 1014 CD1 ILE A 70 -1.302 -3.131 -8.072 1.00 0.00 C ATOM 0 H ILE A 70 -3.050 -0.863 -8.572 1.00 0.00 H new ATOM 0 HA ILE A 70 -3.070 -2.385 -11.151 1.00 0.00 H new ATOM 0 HB ILE A 70 -3.828 -3.095 -8.288 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -2.010 -4.937 -9.028 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -1.522 -3.683 -10.151 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.309 -5.355 -9.191 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.391 -4.138 -9.908 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -4.009 -4.759 -10.841 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -0.272 -3.482 -8.016 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.310 -2.059 -8.267 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.805 -3.332 -7.126 1.00 0.00 H new ATOM 1026 N ALA A 71 -5.328 -1.343 -11.636 1.00 0.00 N ATOM 1027 CA ALA A 71 -6.734 -0.959 -11.941 1.00 0.00 C ATOM 1028 C ALA A 71 -7.182 -1.647 -13.232 1.00 0.00 C ATOM 1029 O ALA A 71 -6.398 -2.270 -13.920 1.00 0.00 O ATOM 1030 CB ALA A 71 -6.820 0.559 -12.116 1.00 0.00 C ATOM 0 H ALA A 71 -4.673 -1.241 -12.411 1.00 0.00 H new ATOM 0 HA ALA A 71 -7.382 -1.268 -11.121 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -7.849 0.842 -12.339 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -6.500 1.050 -11.197 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -6.172 0.868 -12.937 1.00 0.00 H new ATOM 1036 N SER A 72 -8.439 -1.541 -13.564 1.00 0.00 N ATOM 1037 CA SER A 72 -8.936 -2.191 -14.808 1.00 0.00 C ATOM 1038 C SER A 72 -9.906 -1.249 -15.526 1.00 0.00 C ATOM 1039 O SER A 72 -10.860 -1.680 -16.143 1.00 0.00 O ATOM 1040 CB SER A 72 -9.657 -3.491 -14.451 1.00 0.00 C ATOM 1041 OG SER A 72 -9.258 -4.512 -15.357 1.00 0.00 O ATOM 0 H SER A 72 -9.142 -1.033 -13.028 1.00 0.00 H new ATOM 0 HA SER A 72 -8.093 -2.411 -15.463 1.00 0.00 H new ATOM 0 HB2 SER A 72 -9.420 -3.783 -13.428 1.00 0.00 H new ATOM 0 HB3 SER A 72 -10.736 -3.347 -14.499 1.00 0.00 H new ATOM 0 HG SER A 72 -8.909 -5.278 -14.854 1.00 0.00 H new ATOM 1047 N SER A 73 -9.670 0.032 -15.454 1.00 0.00 N ATOM 1048 CA SER A 73 -10.581 0.995 -16.136 1.00 0.00 C ATOM 1049 C SER A 73 -10.900 0.481 -17.543 1.00 0.00 C ATOM 1050 O SER A 73 -10.118 -0.240 -18.130 1.00 0.00 O ATOM 1051 CB SER A 73 -9.900 2.361 -16.233 1.00 0.00 C ATOM 1052 OG SER A 73 -10.231 2.964 -17.477 1.00 0.00 O ATOM 0 H SER A 73 -8.887 0.453 -14.954 1.00 0.00 H new ATOM 0 HA SER A 73 -11.504 1.091 -15.565 1.00 0.00 H new ATOM 0 HB2 SER A 73 -10.221 2.999 -15.410 1.00 0.00 H new ATOM 0 HB3 SER A 73 -8.819 2.248 -16.147 1.00 0.00 H new ATOM 0 HG SER A 73 -9.464 2.905 -18.084 1.00 0.00 H new ATOM 1058 N PRO A 74 -12.046 0.871 -18.042 1.00 0.00 N ATOM 1059 CA PRO A 74 -12.506 0.469 -19.382 1.00 0.00 C ATOM 1060 C PRO A 74 -11.800 1.300 -20.459 1.00 0.00 C ATOM 1061 O PRO A 74 -11.306 0.775 -21.436 1.00 0.00 O ATOM 1062 CB PRO A 74 -14.006 0.774 -19.351 1.00 0.00 C ATOM 1063 CG PRO A 74 -14.213 1.834 -18.244 1.00 0.00 C ATOM 1064 CD PRO A 74 -12.987 1.748 -17.317 1.00 0.00 C ATOM 0 HA PRO A 74 -12.293 -0.574 -19.616 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -14.346 1.149 -20.316 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -14.581 -0.127 -19.138 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -14.304 2.831 -18.675 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -15.132 1.641 -17.690 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -12.555 2.732 -17.136 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -13.251 1.332 -16.345 1.00 0.00 H new ATOM 1072 N GLY A 75 -11.750 2.593 -20.286 1.00 0.00 N ATOM 1073 CA GLY A 75 -11.076 3.453 -21.300 1.00 0.00 C ATOM 1074 C GLY A 75 -9.571 3.494 -21.011 1.00 0.00 C ATOM 1075 O GLY A 75 -9.165 3.540 -19.866 1.00 0.00 O ATOM 0 H GLY A 75 -12.146 3.090 -19.488 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -11.255 3.062 -22.302 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.491 4.461 -21.272 1.00 0.00 H new ATOM 1079 N PRO A 76 -8.788 3.480 -22.060 1.00 0.00 N ATOM 1080 CA PRO A 76 -7.320 3.515 -21.952 1.00 0.00 C ATOM 1081 C PRO A 76 -6.841 4.941 -21.668 1.00 0.00 C ATOM 1082 O PRO A 76 -5.660 5.194 -21.530 1.00 0.00 O ATOM 1083 CB PRO A 76 -6.847 3.045 -23.331 1.00 0.00 C ATOM 1084 CG PRO A 76 -8.018 3.312 -24.307 1.00 0.00 C ATOM 1085 CD PRO A 76 -9.291 3.426 -23.448 1.00 0.00 C ATOM 0 HA PRO A 76 -6.934 2.897 -21.141 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -5.952 3.586 -23.640 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -6.589 1.986 -23.313 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -7.849 4.228 -24.873 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -8.111 2.503 -25.031 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.862 4.319 -23.700 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -9.951 2.572 -23.599 1.00 0.00 H new ATOM 1093 N ASN A 77 -7.748 5.873 -21.581 1.00 0.00 N ATOM 1094 CA ASN A 77 -7.347 7.282 -21.307 1.00 0.00 C ATOM 1095 C ASN A 77 -6.628 7.356 -19.958 1.00 0.00 C ATOM 1096 O ASN A 77 -5.740 8.162 -19.762 1.00 0.00 O ATOM 1097 CB ASN A 77 -8.593 8.168 -21.268 1.00 0.00 C ATOM 1098 CG ASN A 77 -8.877 8.709 -22.671 1.00 0.00 C ATOM 1099 OD1 ASN A 77 -9.092 9.893 -22.846 1.00 0.00 O ATOM 1100 ND2 ASN A 77 -8.885 7.888 -23.685 1.00 0.00 N ATOM 0 H ASN A 77 -8.751 5.720 -21.688 1.00 0.00 H new ATOM 0 HA ASN A 77 -6.678 7.628 -22.095 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -9.448 7.596 -20.907 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -8.444 8.993 -20.571 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -9.072 8.239 -24.624 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -8.705 6.895 -23.538 1.00 0.00 H new ATOM 1107 N ALA A 78 -7.003 6.524 -19.027 1.00 0.00 N ATOM 1108 CA ALA A 78 -6.339 6.552 -17.694 1.00 0.00 C ATOM 1109 C ALA A 78 -4.907 6.029 -17.825 1.00 0.00 C ATOM 1110 O ALA A 78 -3.959 6.681 -17.436 1.00 0.00 O ATOM 1111 CB ALA A 78 -7.116 5.668 -16.717 1.00 0.00 C ATOM 0 H ALA A 78 -7.740 5.826 -19.131 1.00 0.00 H new ATOM 0 HA ALA A 78 -6.319 7.576 -17.321 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -6.630 5.689 -15.742 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.136 6.040 -16.622 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.137 4.644 -17.090 1.00 0.00 H new ATOM 1117 N PHE A 79 -4.743 4.855 -18.370 1.00 0.00 N ATOM 1118 CA PHE A 79 -3.374 4.288 -18.526 1.00 0.00 C ATOM 1119 C PHE A 79 -2.488 5.278 -19.286 1.00 0.00 C ATOM 1120 O PHE A 79 -1.278 5.260 -19.169 1.00 0.00 O ATOM 1121 CB PHE A 79 -3.453 2.973 -19.308 1.00 0.00 C ATOM 1122 CG PHE A 79 -4.443 2.044 -18.646 1.00 0.00 C ATOM 1123 CD1 PHE A 79 -4.737 2.180 -17.283 1.00 0.00 C ATOM 1124 CD2 PHE A 79 -5.069 1.040 -19.399 1.00 0.00 C ATOM 1125 CE1 PHE A 79 -5.655 1.315 -16.672 1.00 0.00 C ATOM 1126 CE2 PHE A 79 -5.987 0.175 -18.789 1.00 0.00 C ATOM 1127 CZ PHE A 79 -6.280 0.312 -17.426 1.00 0.00 C ATOM 0 H PHE A 79 -5.499 4.263 -18.714 1.00 0.00 H new ATOM 0 HA PHE A 79 -2.946 4.103 -17.541 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.755 3.168 -20.337 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.470 2.503 -19.348 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -4.255 2.953 -16.702 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -4.843 0.934 -20.450 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -5.881 1.421 -15.621 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -6.469 -0.598 -19.370 1.00 0.00 H new ATOM 0 HZ PHE A 79 -6.987 -0.355 -16.956 1.00 0.00 H new ATOM 1137 N GLU A 80 -3.078 6.141 -20.067 1.00 0.00 N ATOM 1138 CA GLU A 80 -2.266 7.128 -20.836 1.00 0.00 C ATOM 1139 C GLU A 80 -1.708 8.191 -19.885 1.00 0.00 C ATOM 1140 O GLU A 80 -0.595 8.653 -20.042 1.00 0.00 O ATOM 1141 CB GLU A 80 -3.149 7.802 -21.890 1.00 0.00 C ATOM 1142 CG GLU A 80 -2.503 7.651 -23.269 1.00 0.00 C ATOM 1143 CD GLU A 80 -1.029 8.051 -23.190 1.00 0.00 C ATOM 1144 OE1 GLU A 80 -0.757 9.159 -22.760 1.00 0.00 O ATOM 1145 OE2 GLU A 80 -0.195 7.239 -23.560 1.00 0.00 O ATOM 0 H GLU A 80 -4.086 6.206 -20.206 1.00 0.00 H new ATOM 0 HA GLU A 80 -1.440 6.612 -21.325 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.142 7.352 -21.890 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -3.278 8.858 -21.651 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -2.593 6.621 -23.613 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -3.022 8.276 -23.996 1.00 0.00 H new ATOM 1152 N VAL A 81 -2.471 8.585 -18.904 1.00 0.00 N ATOM 1153 CA VAL A 81 -1.982 9.622 -17.951 1.00 0.00 C ATOM 1154 C VAL A 81 -0.980 8.998 -16.976 1.00 0.00 C ATOM 1155 O VAL A 81 -0.016 9.622 -16.579 1.00 0.00 O ATOM 1156 CB VAL A 81 -3.166 10.191 -17.167 1.00 0.00 C ATOM 1157 CG1 VAL A 81 -2.664 11.243 -16.175 1.00 0.00 C ATOM 1158 CG2 VAL A 81 -4.156 10.839 -18.138 1.00 0.00 C ATOM 0 H VAL A 81 -3.411 8.235 -18.720 1.00 0.00 H new ATOM 0 HA VAL A 81 -1.493 10.421 -18.508 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.662 9.386 -16.624 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -3.508 11.648 -15.616 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.958 10.783 -15.483 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -2.168 12.048 -16.718 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -5.000 11.245 -17.580 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -3.660 11.643 -18.681 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -4.514 10.091 -18.845 1.00 0.00 H new ATOM 1168 N LEU A 82 -1.202 7.773 -16.584 1.00 0.00 N ATOM 1169 CA LEU A 82 -0.262 7.116 -15.633 1.00 0.00 C ATOM 1170 C LEU A 82 1.125 7.013 -16.271 1.00 0.00 C ATOM 1171 O LEU A 82 2.134 7.156 -15.611 1.00 0.00 O ATOM 1172 CB LEU A 82 -0.774 5.714 -15.297 1.00 0.00 C ATOM 1173 CG LEU A 82 -1.931 5.820 -14.303 1.00 0.00 C ATOM 1174 CD1 LEU A 82 -3.168 5.130 -14.882 1.00 0.00 C ATOM 1175 CD2 LEU A 82 -1.538 5.144 -12.989 1.00 0.00 C ATOM 0 H LEU A 82 -1.992 7.200 -16.881 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.197 7.709 -14.720 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.105 5.209 -16.204 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.030 5.113 -14.873 1.00 0.00 H new ATOM 0 HG LEU A 82 -2.155 6.871 -14.118 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -3.992 5.206 -14.173 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -3.449 5.612 -15.818 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -2.945 4.079 -15.068 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -2.363 5.219 -12.280 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.313 4.094 -13.173 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -0.658 5.636 -12.575 1.00 0.00 H new ATOM 1187 N ASN A 83 1.183 6.769 -17.552 1.00 0.00 N ATOM 1188 CA ASN A 83 2.506 6.657 -18.230 1.00 0.00 C ATOM 1189 C ASN A 83 3.129 8.048 -18.365 1.00 0.00 C ATOM 1190 O ASN A 83 4.332 8.193 -18.466 1.00 0.00 O ATOM 1191 CB ASN A 83 2.316 6.049 -19.622 1.00 0.00 C ATOM 1192 CG ASN A 83 3.683 5.762 -20.246 1.00 0.00 C ATOM 1193 OD1 ASN A 83 4.475 5.026 -19.690 1.00 0.00 O ATOM 1194 ND2 ASN A 83 3.996 6.317 -21.385 1.00 0.00 N ATOM 0 H ASN A 83 0.372 6.642 -18.158 1.00 0.00 H new ATOM 0 HA ASN A 83 3.163 6.019 -17.640 1.00 0.00 H new ATOM 0 HB2 ASN A 83 1.736 5.129 -19.552 1.00 0.00 H new ATOM 0 HB3 ASN A 83 1.752 6.734 -20.255 1.00 0.00 H new ATOM 0 HD21 ASN A 83 4.905 6.133 -21.809 1.00 0.00 H new ATOM 0 HD22 ASN A 83 3.331 6.934 -21.851 1.00 0.00 H new ATOM 1201 N GLU A 84 2.321 9.073 -18.370 1.00 0.00 N ATOM 1202 CA GLU A 84 2.866 10.453 -18.501 1.00 0.00 C ATOM 1203 C GLU A 84 3.465 10.895 -17.165 1.00 0.00 C ATOM 1204 O GLU A 84 4.434 11.627 -17.119 1.00 0.00 O ATOM 1205 CB GLU A 84 1.739 11.410 -18.895 1.00 0.00 C ATOM 1206 CG GLU A 84 2.283 12.839 -18.962 1.00 0.00 C ATOM 1207 CD GLU A 84 1.173 13.825 -18.595 1.00 0.00 C ATOM 1208 OE1 GLU A 84 0.618 13.688 -17.517 1.00 0.00 O ATOM 1209 OE2 GLU A 84 0.898 14.702 -19.398 1.00 0.00 O ATOM 0 H GLU A 84 1.306 9.014 -18.289 1.00 0.00 H new ATOM 0 HA GLU A 84 3.640 10.466 -19.268 1.00 0.00 H new ATOM 0 HB2 GLU A 84 1.324 11.122 -19.861 1.00 0.00 H new ATOM 0 HB3 GLU A 84 0.928 11.352 -18.169 1.00 0.00 H new ATOM 0 HG2 GLU A 84 3.125 12.952 -18.278 1.00 0.00 H new ATOM 0 HG3 GLU A 84 2.656 13.051 -19.964 1.00 0.00 H new ATOM 1216 N LEU A 85 2.896 10.458 -16.073 1.00 0.00 N ATOM 1217 CA LEU A 85 3.434 10.858 -14.743 1.00 0.00 C ATOM 1218 C LEU A 85 4.690 10.042 -14.432 1.00 0.00 C ATOM 1219 O LEU A 85 5.530 10.449 -13.653 1.00 0.00 O ATOM 1220 CB LEU A 85 2.378 10.602 -13.666 1.00 0.00 C ATOM 1221 CG LEU A 85 1.788 11.936 -13.206 1.00 0.00 C ATOM 1222 CD1 LEU A 85 0.628 12.324 -14.124 1.00 0.00 C ATOM 1223 CD2 LEU A 85 1.275 11.797 -11.770 1.00 0.00 C ATOM 0 H LEU A 85 2.083 9.842 -16.046 1.00 0.00 H new ATOM 0 HA LEU A 85 3.686 11.918 -14.759 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.590 9.960 -14.059 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.824 10.078 -12.821 1.00 0.00 H new ATOM 0 HG LEU A 85 2.557 12.707 -13.246 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.207 13.275 -13.797 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.991 12.421 -15.147 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -0.142 11.553 -14.083 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.854 12.747 -11.440 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.505 11.026 -11.732 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.100 11.519 -11.114 1.00 0.00 H new ATOM 1235 N GLY A 86 4.828 8.892 -15.033 1.00 0.00 N ATOM 1236 CA GLY A 86 6.032 8.055 -14.770 1.00 0.00 C ATOM 1237 C GLY A 86 5.684 6.961 -13.759 1.00 0.00 C ATOM 1238 O GLY A 86 6.547 6.410 -13.104 1.00 0.00 O ATOM 0 H GLY A 86 4.160 8.496 -15.694 1.00 0.00 H new ATOM 0 HA2 GLY A 86 6.386 7.607 -15.698 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.842 8.675 -14.386 1.00 0.00 H new ATOM 1242 N ILE A 87 4.426 6.639 -13.629 1.00 0.00 N ATOM 1243 CA ILE A 87 4.025 5.579 -12.663 1.00 0.00 C ATOM 1244 C ILE A 87 3.823 4.261 -13.411 1.00 0.00 C ATOM 1245 O ILE A 87 3.600 4.242 -14.606 1.00 0.00 O ATOM 1246 CB ILE A 87 2.718 5.982 -11.978 1.00 0.00 C ATOM 1247 CG1 ILE A 87 2.969 7.190 -11.072 1.00 0.00 C ATOM 1248 CG2 ILE A 87 2.201 4.814 -11.136 1.00 0.00 C ATOM 1249 CD1 ILE A 87 1.784 8.152 -11.164 1.00 0.00 C ATOM 0 H ILE A 87 3.659 7.064 -14.150 1.00 0.00 H new ATOM 0 HA ILE A 87 4.805 5.456 -11.912 1.00 0.00 H new ATOM 0 HB ILE A 87 1.977 6.241 -12.734 1.00 0.00 H new ATOM 0 HG12 ILE A 87 3.106 6.863 -10.041 1.00 0.00 H new ATOM 0 HG13 ILE A 87 3.887 7.697 -11.370 1.00 0.00 H new ATOM 0 HG21 ILE A 87 1.270 5.101 -10.648 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.023 3.952 -11.780 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.942 4.555 -10.380 1.00 0.00 H new ATOM 0 HD11 ILE A 87 1.963 9.012 -10.519 1.00 0.00 H new ATOM 0 HD12 ILE A 87 1.668 8.489 -12.194 1.00 0.00 H new ATOM 0 HD13 ILE A 87 0.875 7.642 -10.845 1.00 0.00 H new ATOM 1261 N LYS A 88 3.897 3.157 -12.721 1.00 0.00 N ATOM 1262 CA LYS A 88 3.707 1.843 -13.395 1.00 0.00 C ATOM 1263 C LYS A 88 2.228 1.457 -13.344 1.00 0.00 C ATOM 1264 O LYS A 88 1.610 1.468 -12.297 1.00 0.00 O ATOM 1265 CB LYS A 88 4.539 0.778 -12.677 1.00 0.00 C ATOM 1266 CG LYS A 88 6.026 1.060 -12.893 1.00 0.00 C ATOM 1267 CD LYS A 88 6.349 0.983 -14.386 1.00 0.00 C ATOM 1268 CE LYS A 88 6.957 2.309 -14.846 1.00 0.00 C ATOM 1269 NZ LYS A 88 6.199 2.821 -16.023 1.00 0.00 N ATOM 0 H LYS A 88 4.081 3.108 -11.719 1.00 0.00 H new ATOM 0 HA LYS A 88 4.029 1.915 -14.434 1.00 0.00 H new ATOM 0 HB2 LYS A 88 4.309 0.779 -11.612 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.287 -0.212 -13.057 1.00 0.00 H new ATOM 0 HG2 LYS A 88 6.280 2.047 -12.506 1.00 0.00 H new ATOM 0 HG3 LYS A 88 6.628 0.337 -12.342 1.00 0.00 H new ATOM 0 HD2 LYS A 88 7.045 0.166 -14.577 1.00 0.00 H new ATOM 0 HD3 LYS A 88 5.444 0.769 -14.954 1.00 0.00 H new ATOM 0 HE2 LYS A 88 6.925 3.037 -14.035 1.00 0.00 H new ATOM 0 HE3 LYS A 88 8.006 2.169 -15.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 6.795 3.484 -16.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 5.930 2.025 -16.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 5.342 3.312 -15.697 1.00 0.00 H new ATOM 1283 N ILE A 89 1.652 1.117 -14.465 1.00 0.00 N ATOM 1284 CA ILE A 89 0.213 0.734 -14.472 1.00 0.00 C ATOM 1285 C ILE A 89 0.096 -0.791 -14.468 1.00 0.00 C ATOM 1286 O ILE A 89 0.959 -1.489 -14.955 1.00 0.00 O ATOM 1287 CB ILE A 89 -0.460 1.299 -15.725 1.00 0.00 C ATOM 1288 CG1 ILE A 89 -0.121 2.786 -15.854 1.00 0.00 C ATOM 1289 CG2 ILE A 89 -1.976 1.132 -15.610 1.00 0.00 C ATOM 1290 CD1 ILE A 89 0.058 3.143 -17.331 1.00 0.00 C ATOM 0 H ILE A 89 2.115 1.088 -15.373 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.278 1.138 -13.587 1.00 0.00 H new ATOM 0 HB ILE A 89 -0.102 0.763 -16.604 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -0.916 3.390 -15.417 1.00 0.00 H new ATOM 0 HG13 ILE A 89 0.791 3.011 -15.301 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.455 1.534 -16.502 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -2.219 0.074 -15.513 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -2.336 1.668 -14.732 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.299 4.202 -17.423 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.868 2.548 -17.754 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -0.866 2.933 -17.871 1.00 0.00 H new ATOM 1302 N TYR A 90 -0.965 -1.311 -13.915 1.00 0.00 N ATOM 1303 CA TYR A 90 -1.137 -2.789 -13.872 1.00 0.00 C ATOM 1304 C TYR A 90 -2.593 -3.136 -14.187 1.00 0.00 C ATOM 1305 O TYR A 90 -3.507 -2.454 -13.768 1.00 0.00 O ATOM 1306 CB TYR A 90 -0.783 -3.302 -12.474 1.00 0.00 C ATOM 1307 CG TYR A 90 0.480 -4.127 -12.542 1.00 0.00 C ATOM 1308 CD1 TYR A 90 1.676 -3.545 -12.983 1.00 0.00 C ATOM 1309 CD2 TYR A 90 0.457 -5.476 -12.161 1.00 0.00 C ATOM 1310 CE1 TYR A 90 2.847 -4.312 -13.046 1.00 0.00 C ATOM 1311 CE2 TYR A 90 1.627 -6.242 -12.224 1.00 0.00 C ATOM 1312 CZ TYR A 90 2.824 -5.660 -12.666 1.00 0.00 C ATOM 1313 OH TYR A 90 3.977 -6.414 -12.728 1.00 0.00 O ATOM 0 H TYR A 90 -1.721 -0.774 -13.490 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.481 -3.256 -14.607 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -0.645 -2.463 -11.792 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.601 -3.903 -12.078 1.00 0.00 H new ATOM 0 HD1 TYR A 90 1.695 -2.505 -13.274 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -0.464 -5.924 -11.819 1.00 0.00 H new ATOM 0 HE1 TYR A 90 3.768 -3.863 -13.388 1.00 0.00 H new ATOM 0 HE2 TYR A 90 1.608 -7.282 -11.932 1.00 0.00 H new ATOM 0 HH TYR A 90 3.787 -7.327 -12.428 1.00 0.00 H new ATOM 1323 N ARG A 91 -2.818 -4.188 -14.925 1.00 0.00 N ATOM 1324 CA ARG A 91 -4.219 -4.568 -15.264 1.00 0.00 C ATOM 1325 C ARG A 91 -4.748 -5.566 -14.234 1.00 0.00 C ATOM 1326 O ARG A 91 -4.126 -6.570 -13.949 1.00 0.00 O ATOM 1327 CB ARG A 91 -4.256 -5.204 -16.655 1.00 0.00 C ATOM 1328 CG ARG A 91 -5.691 -5.180 -17.184 1.00 0.00 C ATOM 1329 CD ARG A 91 -6.059 -3.753 -17.594 1.00 0.00 C ATOM 1330 NE ARG A 91 -5.916 -3.611 -19.069 1.00 0.00 N ATOM 1331 CZ ARG A 91 -6.955 -3.759 -19.842 1.00 0.00 C ATOM 1332 NH1 ARG A 91 -7.896 -2.854 -19.853 1.00 0.00 N ATOM 1333 NH2 ARG A 91 -7.056 -4.814 -20.605 1.00 0.00 N ATOM 0 H ARG A 91 -2.096 -4.799 -15.307 1.00 0.00 H new ATOM 0 HA ARG A 91 -4.844 -3.675 -15.255 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.597 -4.662 -17.333 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -3.891 -6.230 -16.608 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -5.787 -5.851 -18.037 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -6.378 -5.539 -16.418 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -7.082 -3.529 -17.293 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -5.413 -3.038 -17.084 1.00 0.00 H new ATOM 0 HE ARG A 91 -5.005 -3.398 -19.475 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -7.818 -2.030 -19.256 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -8.709 -2.971 -20.458 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -6.322 -5.522 -20.596 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -7.869 -4.930 -21.210 1.00 0.00 H new ATOM 1347 N ALA A 92 -5.896 -5.297 -13.674 1.00 0.00 N ATOM 1348 CA ALA A 92 -6.471 -6.229 -12.662 1.00 0.00 C ATOM 1349 C ALA A 92 -7.149 -7.402 -13.375 1.00 0.00 C ATOM 1350 O ALA A 92 -8.054 -7.221 -14.165 1.00 0.00 O ATOM 1351 CB ALA A 92 -7.502 -5.484 -11.812 1.00 0.00 C ATOM 0 H ALA A 92 -6.461 -4.472 -13.874 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.674 -6.606 -12.020 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.923 -6.164 -11.072 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -7.020 -4.649 -11.304 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -8.299 -5.108 -12.454 1.00 0.00 H new ATOM 1357 N THR A 93 -6.718 -8.603 -13.101 1.00 0.00 N ATOM 1358 CA THR A 93 -7.336 -9.786 -13.763 1.00 0.00 C ATOM 1359 C THR A 93 -8.716 -10.049 -13.155 1.00 0.00 C ATOM 1360 O THR A 93 -9.595 -10.585 -13.799 1.00 0.00 O ATOM 1361 CB THR A 93 -6.444 -11.011 -13.552 1.00 0.00 C ATOM 1362 OG1 THR A 93 -5.752 -10.882 -12.316 1.00 0.00 O ATOM 1363 CG2 THR A 93 -5.434 -11.111 -14.696 1.00 0.00 C ATOM 0 H THR A 93 -5.965 -8.816 -12.447 1.00 0.00 H new ATOM 0 HA THR A 93 -7.441 -9.592 -14.830 1.00 0.00 H new ATOM 0 HB THR A 93 -7.059 -11.911 -13.533 1.00 0.00 H new ATOM 0 HG1 THR A 93 -4.786 -10.862 -12.482 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.799 -11.984 -14.545 1.00 0.00 H new ATOM 0 HG22 THR A 93 -5.965 -11.208 -15.643 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.817 -10.213 -14.716 1.00 0.00 H new ATOM 1371 N GLY A 94 -8.912 -9.678 -11.919 1.00 0.00 N ATOM 1372 CA GLY A 94 -10.235 -9.910 -11.274 1.00 0.00 C ATOM 1373 C GLY A 94 -10.183 -11.196 -10.448 1.00 0.00 C ATOM 1374 O GLY A 94 -10.908 -12.138 -10.700 1.00 0.00 O ATOM 0 H GLY A 94 -8.214 -9.225 -11.329 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -10.493 -9.065 -10.635 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -11.013 -9.985 -12.033 1.00 0.00 H new ATOM 1378 N THR A 95 -9.329 -11.245 -9.462 1.00 0.00 N ATOM 1379 CA THR A 95 -9.230 -12.471 -8.622 1.00 0.00 C ATOM 1380 C THR A 95 -9.285 -12.081 -7.142 1.00 0.00 C ATOM 1381 O THR A 95 -10.167 -12.493 -6.414 1.00 0.00 O ATOM 1382 CB THR A 95 -7.907 -13.184 -8.911 1.00 0.00 C ATOM 1383 OG1 THR A 95 -6.911 -12.222 -9.230 1.00 0.00 O ATOM 1384 CG2 THR A 95 -8.089 -14.142 -10.089 1.00 0.00 C ATOM 0 H THR A 95 -8.696 -10.489 -9.202 1.00 0.00 H new ATOM 0 HA THR A 95 -10.060 -13.138 -8.855 1.00 0.00 H new ATOM 0 HB THR A 95 -7.598 -13.748 -8.031 1.00 0.00 H new ATOM 0 HG1 THR A 95 -6.105 -12.398 -8.701 1.00 0.00 H new ATOM 0 HG21 THR A 95 -7.146 -14.649 -10.294 1.00 0.00 H new ATOM 0 HG22 THR A 95 -8.852 -14.880 -9.843 1.00 0.00 H new ATOM 0 HG23 THR A 95 -8.398 -13.580 -10.970 1.00 0.00 H new ATOM 1392 N SER A 96 -8.348 -11.292 -6.692 1.00 0.00 N ATOM 1393 CA SER A 96 -8.347 -10.880 -5.260 1.00 0.00 C ATOM 1394 C SER A 96 -7.254 -9.834 -5.029 1.00 0.00 C ATOM 1395 O SER A 96 -6.240 -9.823 -5.699 1.00 0.00 O ATOM 1396 CB SER A 96 -8.078 -12.101 -4.380 1.00 0.00 C ATOM 1397 OG SER A 96 -8.867 -12.012 -3.199 1.00 0.00 O ATOM 0 H SER A 96 -7.584 -10.915 -7.253 1.00 0.00 H new ATOM 0 HA SER A 96 -9.317 -10.453 -5.004 1.00 0.00 H new ATOM 0 HB2 SER A 96 -8.318 -13.015 -4.923 1.00 0.00 H new ATOM 0 HB3 SER A 96 -7.020 -12.152 -4.122 1.00 0.00 H new ATOM 0 HG SER A 96 -8.698 -12.794 -2.633 1.00 0.00 H new ATOM 1403 N VAL A 97 -7.451 -8.954 -4.085 1.00 0.00 N ATOM 1404 CA VAL A 97 -6.424 -7.910 -3.811 1.00 0.00 C ATOM 1405 C VAL A 97 -5.210 -8.550 -3.134 1.00 0.00 C ATOM 1406 O VAL A 97 -4.084 -8.143 -3.344 1.00 0.00 O ATOM 1407 CB VAL A 97 -7.015 -6.842 -2.888 1.00 0.00 C ATOM 1408 CG1 VAL A 97 -7.949 -5.933 -3.690 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -7.805 -7.520 -1.768 1.00 0.00 C ATOM 0 H VAL A 97 -8.280 -8.913 -3.492 1.00 0.00 H new ATOM 0 HA VAL A 97 -6.116 -7.451 -4.750 1.00 0.00 H new ATOM 0 HB VAL A 97 -6.209 -6.247 -2.459 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -8.370 -5.172 -3.032 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -7.388 -5.451 -4.490 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -8.755 -6.528 -4.119 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.227 -6.761 -1.109 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -8.610 -8.114 -2.199 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.142 -8.169 -1.196 1.00 0.00 H new ATOM 1419 N GLU A 98 -5.429 -9.547 -2.321 1.00 0.00 N ATOM 1420 CA GLU A 98 -4.286 -10.210 -1.631 1.00 0.00 C ATOM 1421 C GLU A 98 -3.397 -10.902 -2.667 1.00 0.00 C ATOM 1422 O GLU A 98 -2.202 -10.686 -2.716 1.00 0.00 O ATOM 1423 CB GLU A 98 -4.820 -11.248 -0.641 1.00 0.00 C ATOM 1424 CG GLU A 98 -4.143 -11.054 0.717 1.00 0.00 C ATOM 1425 CD GLU A 98 -4.376 -12.292 1.586 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -3.980 -13.368 1.168 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -4.945 -12.144 2.654 1.00 0.00 O ATOM 0 H GLU A 98 -6.349 -9.931 -2.105 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.703 -9.462 -1.093 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -5.900 -11.146 -0.538 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -4.629 -12.254 -1.014 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -3.074 -10.888 0.582 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.543 -10.169 1.212 1.00 0.00 H new ATOM 1434 N GLU A 99 -3.970 -11.733 -3.492 1.00 0.00 N ATOM 1435 CA GLU A 99 -3.159 -12.441 -4.524 1.00 0.00 C ATOM 1436 C GLU A 99 -2.455 -11.419 -5.417 1.00 0.00 C ATOM 1437 O GLU A 99 -1.285 -11.546 -5.720 1.00 0.00 O ATOM 1438 CB GLU A 99 -4.078 -13.317 -5.378 1.00 0.00 C ATOM 1439 CG GLU A 99 -3.267 -13.969 -6.501 1.00 0.00 C ATOM 1440 CD GLU A 99 -3.800 -13.498 -7.856 1.00 0.00 C ATOM 1441 OE1 GLU A 99 -3.966 -12.302 -8.023 1.00 0.00 O ATOM 1442 OE2 GLU A 99 -4.034 -14.345 -8.704 1.00 0.00 O ATOM 0 H GLU A 99 -4.966 -11.953 -3.497 1.00 0.00 H new ATOM 0 HA GLU A 99 -2.412 -13.064 -4.032 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -4.544 -14.084 -4.759 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -4.883 -12.715 -5.799 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -2.213 -13.708 -6.402 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -3.334 -15.055 -6.429 1.00 0.00 H new ATOM 1449 N ASN A 100 -3.159 -10.406 -5.846 1.00 0.00 N ATOM 1450 CA ASN A 100 -2.531 -9.378 -6.726 1.00 0.00 C ATOM 1451 C ASN A 100 -1.374 -8.700 -5.989 1.00 0.00 C ATOM 1452 O ASN A 100 -0.414 -8.264 -6.593 1.00 0.00 O ATOM 1453 CB ASN A 100 -3.576 -8.326 -7.105 1.00 0.00 C ATOM 1454 CG ASN A 100 -4.169 -8.662 -8.474 1.00 0.00 C ATOM 1455 OD1 ASN A 100 -4.002 -7.920 -9.421 1.00 0.00 O ATOM 1456 ND2 ASN A 100 -4.860 -9.760 -8.620 1.00 0.00 N ATOM 0 H ASN A 100 -4.142 -10.246 -5.625 1.00 0.00 H new ATOM 0 HA ASN A 100 -2.151 -9.860 -7.627 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -4.365 -8.295 -6.353 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -3.119 -7.337 -7.128 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -5.259 -9.994 -9.529 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -5.001 -10.384 -7.825 1.00 0.00 H new ATOM 1463 N LEU A 101 -1.457 -8.601 -4.691 1.00 0.00 N ATOM 1464 CA LEU A 101 -0.361 -7.943 -3.924 1.00 0.00 C ATOM 1465 C LEU A 101 0.934 -8.740 -4.091 1.00 0.00 C ATOM 1466 O LEU A 101 1.944 -8.217 -4.520 1.00 0.00 O ATOM 1467 CB LEU A 101 -0.738 -7.884 -2.444 1.00 0.00 C ATOM 1468 CG LEU A 101 0.469 -7.416 -1.630 1.00 0.00 C ATOM 1469 CD1 LEU A 101 0.960 -6.070 -2.169 1.00 0.00 C ATOM 1470 CD2 LEU A 101 0.066 -7.259 -0.163 1.00 0.00 C ATOM 0 H LEU A 101 -2.235 -8.946 -4.129 1.00 0.00 H new ATOM 0 HA LEU A 101 -0.213 -6.931 -4.301 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -1.576 -7.202 -2.298 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -1.063 -8.866 -2.101 1.00 0.00 H new ATOM 0 HG LEU A 101 1.268 -8.153 -1.712 1.00 0.00 H new ATOM 0 HD11 LEU A 101 1.820 -5.737 -1.588 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.249 -6.180 -3.214 1.00 0.00 H new ATOM 0 HD13 LEU A 101 0.161 -5.333 -2.089 1.00 0.00 H new ATOM 0 HD21 LEU A 101 0.926 -6.925 0.417 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -0.734 -6.523 -0.082 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -0.282 -8.217 0.223 1.00 0.00 H new ATOM 1482 N LYS A 102 0.917 -10.001 -3.756 1.00 0.00 N ATOM 1483 CA LYS A 102 2.152 -10.826 -3.896 1.00 0.00 C ATOM 1484 C LYS A 102 2.400 -11.127 -5.375 1.00 0.00 C ATOM 1485 O LYS A 102 3.454 -11.598 -5.755 1.00 0.00 O ATOM 1486 CB LYS A 102 1.980 -12.139 -3.130 1.00 0.00 C ATOM 1487 CG LYS A 102 3.106 -13.103 -3.509 1.00 0.00 C ATOM 1488 CD LYS A 102 2.608 -14.072 -4.582 1.00 0.00 C ATOM 1489 CE LYS A 102 1.388 -14.829 -4.056 1.00 0.00 C ATOM 1490 NZ LYS A 102 0.171 -14.385 -4.794 1.00 0.00 N ATOM 0 H LYS A 102 0.103 -10.496 -3.392 1.00 0.00 H new ATOM 0 HA LYS A 102 3.002 -10.278 -3.489 1.00 0.00 H new ATOM 0 HB2 LYS A 102 1.994 -11.951 -2.057 1.00 0.00 H new ATOM 0 HB3 LYS A 102 1.012 -12.584 -3.363 1.00 0.00 H new ATOM 0 HG2 LYS A 102 3.967 -12.546 -3.878 1.00 0.00 H new ATOM 0 HG3 LYS A 102 3.437 -13.656 -2.630 1.00 0.00 H new ATOM 0 HD2 LYS A 102 2.348 -13.526 -5.489 1.00 0.00 H new ATOM 0 HD3 LYS A 102 3.398 -14.774 -4.849 1.00 0.00 H new ATOM 0 HE2 LYS A 102 1.531 -15.902 -4.181 1.00 0.00 H new ATOM 0 HE3 LYS A 102 1.266 -14.646 -2.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -0.645 -14.385 -4.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 0.320 -13.425 -5.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -0.012 -15.036 -5.584 1.00 0.00 H new ATOM 1504 N LEU A 103 1.437 -10.859 -6.214 1.00 0.00 N ATOM 1505 CA LEU A 103 1.618 -11.132 -7.667 1.00 0.00 C ATOM 1506 C LEU A 103 2.513 -10.053 -8.282 1.00 0.00 C ATOM 1507 O LEU A 103 3.418 -10.340 -9.037 1.00 0.00 O ATOM 1508 CB LEU A 103 0.256 -11.117 -8.363 1.00 0.00 C ATOM 1509 CG LEU A 103 0.271 -12.094 -9.538 1.00 0.00 C ATOM 1510 CD1 LEU A 103 -0.580 -13.318 -9.195 1.00 0.00 C ATOM 1511 CD2 LEU A 103 -0.304 -11.407 -10.779 1.00 0.00 C ATOM 0 H LEU A 103 0.533 -10.463 -5.956 1.00 0.00 H new ATOM 0 HA LEU A 103 2.083 -12.109 -7.796 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.528 -11.393 -7.657 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.027 -10.111 -8.716 1.00 0.00 H new ATOM 0 HG LEU A 103 1.296 -12.407 -9.736 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -0.569 -14.015 -10.033 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -0.173 -13.808 -8.310 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.605 -13.005 -8.997 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.294 -12.103 -11.618 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.329 -11.094 -10.580 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.301 -10.534 -11.025 1.00 0.00 H new ATOM 1523 N PHE A 104 2.262 -8.813 -7.964 1.00 0.00 N ATOM 1524 CA PHE A 104 3.093 -7.714 -8.531 1.00 0.00 C ATOM 1525 C PHE A 104 4.440 -7.664 -7.803 1.00 0.00 C ATOM 1526 O PHE A 104 5.432 -7.216 -8.342 1.00 0.00 O ATOM 1527 CB PHE A 104 2.352 -6.384 -8.346 1.00 0.00 C ATOM 1528 CG PHE A 104 3.296 -5.228 -8.579 1.00 0.00 C ATOM 1529 CD1 PHE A 104 4.240 -4.882 -7.602 1.00 0.00 C ATOM 1530 CD2 PHE A 104 3.225 -4.496 -9.772 1.00 0.00 C ATOM 1531 CE1 PHE A 104 5.111 -3.806 -7.817 1.00 0.00 C ATOM 1532 CE2 PHE A 104 4.095 -3.419 -9.987 1.00 0.00 C ATOM 1533 CZ PHE A 104 5.038 -3.075 -9.010 1.00 0.00 C ATOM 0 H PHE A 104 1.517 -8.513 -7.335 1.00 0.00 H new ATOM 0 HA PHE A 104 3.269 -7.890 -9.592 1.00 0.00 H new ATOM 0 HB2 PHE A 104 1.514 -6.326 -9.041 1.00 0.00 H new ATOM 0 HB3 PHE A 104 1.936 -6.327 -7.340 1.00 0.00 H new ATOM 0 HD1 PHE A 104 4.296 -5.446 -6.682 1.00 0.00 H new ATOM 0 HD2 PHE A 104 2.499 -4.762 -10.526 1.00 0.00 H new ATOM 0 HE1 PHE A 104 5.838 -3.540 -7.064 1.00 0.00 H new ATOM 0 HE2 PHE A 104 4.039 -2.854 -10.906 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.709 -2.246 -9.176 1.00 0.00 H new ATOM 1543 N THR A 105 4.481 -8.118 -6.580 1.00 0.00 N ATOM 1544 CA THR A 105 5.762 -8.091 -5.815 1.00 0.00 C ATOM 1545 C THR A 105 6.807 -8.949 -6.530 1.00 0.00 C ATOM 1546 O THR A 105 7.987 -8.655 -6.507 1.00 0.00 O ATOM 1547 CB THR A 105 5.527 -8.642 -4.408 1.00 0.00 C ATOM 1548 OG1 THR A 105 4.388 -8.012 -3.838 1.00 0.00 O ATOM 1549 CG2 THR A 105 6.755 -8.367 -3.538 1.00 0.00 C ATOM 0 H THR A 105 3.683 -8.507 -6.077 1.00 0.00 H new ATOM 0 HA THR A 105 6.122 -7.064 -5.749 1.00 0.00 H new ATOM 0 HB THR A 105 5.358 -9.717 -4.462 1.00 0.00 H new ATOM 0 HG1 THR A 105 3.574 -8.450 -4.165 1.00 0.00 H new ATOM 0 HG21 THR A 105 6.586 -8.760 -2.536 1.00 0.00 H new ATOM 0 HG22 THR A 105 7.627 -8.852 -3.976 1.00 0.00 H new ATOM 0 HG23 THR A 105 6.928 -7.292 -3.482 1.00 0.00 H new ATOM 1557 N GLU A 106 6.389 -10.011 -7.163 1.00 0.00 N ATOM 1558 CA GLU A 106 7.366 -10.884 -7.873 1.00 0.00 C ATOM 1559 C GLU A 106 7.285 -10.625 -9.379 1.00 0.00 C ATOM 1560 O GLU A 106 7.873 -11.333 -10.172 1.00 0.00 O ATOM 1561 CB GLU A 106 7.039 -12.351 -7.590 1.00 0.00 C ATOM 1562 CG GLU A 106 6.824 -12.546 -6.087 1.00 0.00 C ATOM 1563 CD GLU A 106 8.027 -13.279 -5.491 1.00 0.00 C ATOM 1564 OE1 GLU A 106 9.136 -12.807 -5.677 1.00 0.00 O ATOM 1565 OE2 GLU A 106 7.818 -14.302 -4.858 1.00 0.00 O ATOM 0 H GLU A 106 5.416 -10.311 -7.219 1.00 0.00 H new ATOM 0 HA GLU A 106 8.373 -10.661 -7.521 1.00 0.00 H new ATOM 0 HB2 GLU A 106 6.144 -12.647 -8.137 1.00 0.00 H new ATOM 0 HB3 GLU A 106 7.851 -12.989 -7.938 1.00 0.00 H new ATOM 0 HG2 GLU A 106 6.695 -11.580 -5.599 1.00 0.00 H new ATOM 0 HG3 GLU A 106 5.912 -13.117 -5.910 1.00 0.00 H new ATOM 1572 N GLY A 107 6.562 -9.616 -9.780 1.00 0.00 N ATOM 1573 CA GLY A 107 6.446 -9.315 -11.235 1.00 0.00 C ATOM 1574 C GLY A 107 5.970 -10.567 -11.975 1.00 0.00 C ATOM 1575 O GLY A 107 6.638 -11.068 -12.858 1.00 0.00 O ATOM 0 H GLY A 107 6.047 -8.987 -9.164 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.744 -8.496 -11.394 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.409 -8.990 -11.629 1.00 0.00 H new ATOM 1579 N ASN A 108 4.824 -11.076 -11.619 1.00 0.00 N ATOM 1580 CA ASN A 108 4.307 -12.296 -12.298 1.00 0.00 C ATOM 1581 C ASN A 108 3.648 -11.905 -13.622 1.00 0.00 C ATOM 1582 O ASN A 108 3.773 -12.594 -14.614 1.00 0.00 O ATOM 1583 CB ASN A 108 3.274 -12.981 -11.401 1.00 0.00 C ATOM 1584 CG ASN A 108 2.699 -14.200 -12.124 1.00 0.00 C ATOM 1585 OD1 ASN A 108 2.874 -14.353 -13.316 1.00 0.00 O ATOM 1586 ND2 ASN A 108 2.013 -15.080 -11.447 1.00 0.00 N ATOM 0 H ASN A 108 4.223 -10.699 -10.886 1.00 0.00 H new ATOM 0 HA ASN A 108 5.134 -12.980 -12.491 1.00 0.00 H new ATOM 0 HB2 ASN A 108 3.737 -13.286 -10.463 1.00 0.00 H new ATOM 0 HB3 ASN A 108 2.475 -12.283 -11.150 1.00 0.00 H new ATOM 0 HD21 ASN A 108 1.624 -15.896 -11.919 1.00 0.00 H new ATOM 0 HD22 ASN A 108 1.866 -14.952 -10.446 1.00 0.00 H new ATOM 1593 N LEU A 109 2.947 -10.805 -13.648 1.00 0.00 N ATOM 1594 CA LEU A 109 2.284 -10.381 -14.913 1.00 0.00 C ATOM 1595 C LEU A 109 1.352 -9.201 -14.637 1.00 0.00 C ATOM 1596 O LEU A 109 1.519 -8.476 -13.677 1.00 0.00 O ATOM 1597 CB LEU A 109 1.474 -11.551 -15.477 1.00 0.00 C ATOM 1598 CG LEU A 109 1.945 -11.860 -16.898 1.00 0.00 C ATOM 1599 CD1 LEU A 109 2.366 -13.329 -16.987 1.00 0.00 C ATOM 1600 CD2 LEU A 109 0.804 -11.597 -17.883 1.00 0.00 C ATOM 0 H LEU A 109 2.805 -10.184 -12.852 1.00 0.00 H new ATOM 0 HA LEU A 109 3.042 -10.078 -15.635 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.595 -12.430 -14.843 1.00 0.00 H new ATOM 0 HB3 LEU A 109 0.412 -11.304 -15.480 1.00 0.00 H new ATOM 0 HG LEU A 109 2.793 -11.222 -17.146 1.00 0.00 H new ATOM 0 HD11 LEU A 109 2.702 -13.550 -18.000 1.00 0.00 H new ATOM 0 HD12 LEU A 109 3.179 -13.518 -16.286 1.00 0.00 H new ATOM 0 HD13 LEU A 109 1.517 -13.966 -16.739 1.00 0.00 H new ATOM 0 HD21 LEU A 109 1.140 -11.817 -18.896 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -0.045 -12.235 -17.635 1.00 0.00 H new ATOM 0 HD23 LEU A 109 0.503 -10.551 -17.820 1.00 0.00 H new ATOM 1612 N GLU A 110 0.372 -9.001 -15.476 1.00 0.00 N ATOM 1613 CA GLU A 110 -0.569 -7.866 -15.264 1.00 0.00 C ATOM 1614 C GLU A 110 0.211 -6.551 -15.298 1.00 0.00 C ATOM 1615 O GLU A 110 -0.154 -5.586 -14.658 1.00 0.00 O ATOM 1616 CB GLU A 110 -1.253 -8.019 -13.903 1.00 0.00 C ATOM 1617 CG GLU A 110 -1.609 -9.489 -13.672 1.00 0.00 C ATOM 1618 CD GLU A 110 -2.137 -9.670 -12.248 1.00 0.00 C ATOM 1619 OE1 GLU A 110 -1.932 -8.776 -11.444 1.00 0.00 O ATOM 1620 OE2 GLU A 110 -2.737 -10.700 -11.986 1.00 0.00 O ATOM 0 H GLU A 110 0.183 -9.574 -16.298 1.00 0.00 H new ATOM 0 HA GLU A 110 -1.324 -7.864 -16.051 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -0.593 -7.665 -13.111 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -2.153 -7.406 -13.866 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -2.361 -9.809 -14.393 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -0.731 -10.115 -13.828 1.00 0.00 H new ATOM 1627 N GLU A 111 1.284 -6.507 -16.039 1.00 0.00 N ATOM 1628 CA GLU A 111 2.088 -5.256 -16.110 1.00 0.00 C ATOM 1629 C GLU A 111 1.615 -4.406 -17.291 1.00 0.00 C ATOM 1630 O GLU A 111 1.237 -4.918 -18.326 1.00 0.00 O ATOM 1631 CB GLU A 111 3.566 -5.605 -16.292 1.00 0.00 C ATOM 1632 CG GLU A 111 4.425 -4.385 -15.954 1.00 0.00 C ATOM 1633 CD GLU A 111 5.305 -4.034 -17.155 1.00 0.00 C ATOM 1634 OE1 GLU A 111 5.478 -4.888 -18.008 1.00 0.00 O ATOM 1635 OE2 GLU A 111 5.792 -2.916 -17.201 1.00 0.00 O ATOM 0 H GLU A 111 1.638 -7.283 -16.598 1.00 0.00 H new ATOM 0 HA GLU A 111 1.960 -4.693 -15.185 1.00 0.00 H new ATOM 0 HB2 GLU A 111 3.835 -6.442 -15.647 1.00 0.00 H new ATOM 0 HB3 GLU A 111 3.752 -5.921 -17.319 1.00 0.00 H new ATOM 0 HG2 GLU A 111 3.788 -3.539 -15.696 1.00 0.00 H new ATOM 0 HG3 GLU A 111 5.046 -4.594 -15.083 1.00 0.00 H new ATOM 1642 N ILE A 112 1.636 -3.111 -17.140 1.00 0.00 N ATOM 1643 CA ILE A 112 1.190 -2.217 -18.245 1.00 0.00 C ATOM 1644 C ILE A 112 1.853 -0.844 -18.080 1.00 0.00 C ATOM 1645 O ILE A 112 1.755 -0.216 -17.043 1.00 0.00 O ATOM 1646 CB ILE A 112 -0.336 -2.064 -18.194 1.00 0.00 C ATOM 1647 CG1 ILE A 112 -0.995 -3.316 -18.780 1.00 0.00 C ATOM 1648 CG2 ILE A 112 -0.766 -0.843 -19.013 1.00 0.00 C ATOM 1649 CD1 ILE A 112 -0.535 -3.505 -20.227 1.00 0.00 C ATOM 0 H ILE A 112 1.944 -2.631 -16.294 1.00 0.00 H new ATOM 0 HA ILE A 112 1.476 -2.647 -19.205 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.645 -1.933 -17.157 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -0.731 -4.191 -18.186 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.080 -3.221 -18.742 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -1.850 -0.741 -18.972 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -0.301 0.053 -18.602 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -0.453 -0.971 -20.049 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -1.004 -4.396 -20.644 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -0.822 -2.634 -20.817 1.00 0.00 H new ATOM 0 HD13 ILE A 112 0.549 -3.620 -20.252 1.00 0.00 H new ATOM 1661 N ARG A 113 2.524 -0.374 -19.095 1.00 0.00 N ATOM 1662 CA ARG A 113 3.188 0.957 -18.996 1.00 0.00 C ATOM 1663 C ARG A 113 2.797 1.810 -20.205 1.00 0.00 C ATOM 1664 O ARG A 113 3.350 2.867 -20.435 1.00 0.00 O ATOM 1665 CB ARG A 113 4.707 0.770 -18.969 1.00 0.00 C ATOM 1666 CG ARG A 113 5.098 -0.397 -19.877 1.00 0.00 C ATOM 1667 CD ARG A 113 6.606 -0.634 -19.781 1.00 0.00 C ATOM 1668 NE ARG A 113 7.255 -0.218 -21.057 1.00 0.00 N ATOM 1669 CZ ARG A 113 8.316 -0.846 -21.485 1.00 0.00 C ATOM 1670 NH1 ARG A 113 9.324 -1.047 -20.680 1.00 0.00 N ATOM 1671 NH2 ARG A 113 8.370 -1.273 -22.716 1.00 0.00 N ATOM 0 H ARG A 113 2.641 -0.853 -19.988 1.00 0.00 H new ATOM 0 HA ARG A 113 2.870 1.456 -18.081 1.00 0.00 H new ATOM 0 HB2 ARG A 113 5.202 1.683 -19.300 1.00 0.00 H new ATOM 0 HB3 ARG A 113 5.042 0.578 -17.949 1.00 0.00 H new ATOM 0 HG2 ARG A 113 4.558 -1.297 -19.583 1.00 0.00 H new ATOM 0 HG3 ARG A 113 4.818 -0.180 -20.908 1.00 0.00 H new ATOM 0 HD2 ARG A 113 7.022 -0.068 -18.947 1.00 0.00 H new ATOM 0 HD3 ARG A 113 6.808 -1.687 -19.584 1.00 0.00 H new ATOM 0 HE ARG A 113 6.870 0.558 -21.596 1.00 0.00 H new ATOM 0 HH11 ARG A 113 9.282 -0.713 -19.717 1.00 0.00 H new ATOM 0 HH12 ARG A 113 10.153 -1.538 -21.014 1.00 0.00 H new ATOM 0 HH21 ARG A 113 7.583 -1.116 -23.345 1.00 0.00 H new ATOM 0 HH22 ARG A 113 9.200 -1.764 -23.050 1.00 0.00 H new ATOM 1685 N SER A 114 1.846 1.360 -20.978 1.00 0.00 N ATOM 1686 CA SER A 114 1.417 2.145 -22.169 1.00 0.00 C ATOM 1687 C SER A 114 2.651 2.646 -22.927 1.00 0.00 C ATOM 1688 O SER A 114 2.904 3.833 -22.979 1.00 0.00 O ATOM 1689 CB SER A 114 0.579 3.341 -21.716 1.00 0.00 C ATOM 1690 OG SER A 114 -0.615 2.872 -21.104 1.00 0.00 O ATOM 0 H SER A 114 1.348 0.482 -20.835 1.00 0.00 H new ATOM 0 HA SER A 114 0.822 1.510 -22.825 1.00 0.00 H new ATOM 0 HB2 SER A 114 1.146 3.952 -21.013 1.00 0.00 H new ATOM 0 HB3 SER A 114 0.339 3.976 -22.569 1.00 0.00 H new ATOM 0 HG SER A 114 -0.910 3.515 -20.426 1.00 0.00 H new ATOM 1696 N PRO A 115 3.382 1.719 -23.492 1.00 0.00 N ATOM 1697 CA PRO A 115 4.600 2.026 -24.260 1.00 0.00 C ATOM 1698 C PRO A 115 4.236 2.526 -25.661 1.00 0.00 C ATOM 1699 O PRO A 115 4.767 3.512 -26.137 1.00 0.00 O ATOM 1700 CB PRO A 115 5.328 0.681 -24.331 1.00 0.00 C ATOM 1701 CG PRO A 115 4.251 -0.410 -24.113 1.00 0.00 C ATOM 1702 CD PRO A 115 3.061 0.278 -23.418 1.00 0.00 C ATOM 0 HA PRO A 115 5.207 2.810 -23.807 1.00 0.00 H new ATOM 0 HB2 PRO A 115 5.819 0.555 -25.296 1.00 0.00 H new ATOM 0 HB3 PRO A 115 6.104 0.619 -23.568 1.00 0.00 H new ATOM 0 HG2 PRO A 115 3.945 -0.847 -25.063 1.00 0.00 H new ATOM 0 HG3 PRO A 115 4.641 -1.222 -23.500 1.00 0.00 H new ATOM 0 HD2 PRO A 115 2.121 0.053 -23.922 1.00 0.00 H new ATOM 0 HD3 PRO A 115 2.957 -0.054 -22.385 1.00 0.00 H new ATOM 1710 N GLY A 116 3.336 1.855 -26.327 1.00 0.00 N ATOM 1711 CA GLY A 116 2.939 2.293 -27.695 1.00 0.00 C ATOM 1712 C GLY A 116 1.758 1.451 -28.181 1.00 0.00 C ATOM 1713 O GLY A 116 1.848 0.245 -28.293 1.00 0.00 O ATOM 0 H GLY A 116 2.858 1.022 -25.983 1.00 0.00 H new ATOM 0 HA2 GLY A 116 2.667 3.348 -27.685 1.00 0.00 H new ATOM 0 HA3 GLY A 116 3.780 2.187 -28.380 1.00 0.00 H new ATOM 1717 N SER A 117 0.650 2.078 -28.473 1.00 0.00 N ATOM 1718 CA SER A 117 -0.535 1.312 -28.953 1.00 0.00 C ATOM 1719 C SER A 117 -0.654 1.455 -30.472 1.00 0.00 C ATOM 1720 O SER A 117 -1.706 1.249 -31.043 1.00 0.00 O ATOM 1721 CB SER A 117 -1.799 1.861 -28.290 1.00 0.00 C ATOM 1722 OG SER A 117 -1.545 2.085 -26.909 1.00 0.00 O ATOM 0 H SER A 117 0.515 3.086 -28.400 1.00 0.00 H new ATOM 0 HA SER A 117 -0.416 0.260 -28.695 1.00 0.00 H new ATOM 0 HB2 SER A 117 -2.102 2.791 -28.772 1.00 0.00 H new ATOM 0 HB3 SER A 117 -2.622 1.157 -28.411 1.00 0.00 H new ATOM 0 HG SER A 117 -2.353 2.439 -26.481 1.00 0.00 H new ATOM 1728 N GLY A 118 0.416 1.808 -31.130 1.00 0.00 N ATOM 1729 CA GLY A 118 0.361 1.964 -32.612 1.00 0.00 C ATOM 1730 C GLY A 118 0.504 0.593 -33.275 1.00 0.00 C ATOM 1731 O GLY A 118 1.510 -0.072 -33.137 1.00 0.00 O ATOM 0 H GLY A 118 1.325 1.995 -30.707 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -0.582 2.425 -32.905 1.00 0.00 H new ATOM 0 HA3 GLY A 118 1.158 2.627 -32.948 1.00 0.00 H new ATOM 1735 N ARG A 119 -0.497 0.166 -33.997 1.00 0.00 N ATOM 1736 CA ARG A 119 -0.418 -1.162 -34.670 1.00 0.00 C ATOM 1737 C ARG A 119 0.853 -1.226 -35.520 1.00 0.00 C ATOM 1738 O ARG A 119 1.341 -2.290 -35.847 1.00 0.00 O ATOM 1739 CB ARG A 119 -1.642 -1.352 -35.569 1.00 0.00 C ATOM 1740 CG ARG A 119 -2.058 -2.824 -35.560 1.00 0.00 C ATOM 1741 CD ARG A 119 -1.568 -3.502 -36.841 1.00 0.00 C ATOM 1742 NE ARG A 119 -2.469 -4.641 -37.176 1.00 0.00 N ATOM 1743 CZ ARG A 119 -3.346 -4.519 -38.133 1.00 0.00 C ATOM 1744 NH1 ARG A 119 -2.977 -4.086 -39.308 1.00 0.00 N ATOM 1745 NH2 ARG A 119 -4.595 -4.831 -37.918 1.00 0.00 N ATOM 0 H ARG A 119 -1.365 0.679 -34.150 1.00 0.00 H new ATOM 0 HA ARG A 119 -0.394 -1.951 -33.918 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -2.464 -0.729 -35.218 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -1.412 -1.034 -36.586 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -1.639 -3.326 -34.688 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -3.142 -2.906 -35.485 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -1.551 -2.784 -37.661 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -0.547 -3.859 -36.708 1.00 0.00 H new ATOM 0 HE ARG A 119 -2.400 -5.516 -36.657 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -2.001 -3.843 -39.478 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -3.664 -3.991 -40.056 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -4.885 -5.170 -37.001 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -5.281 -4.735 -38.667 1.00 0.00 H new ATOM 1759 N GLY A 120 1.395 -0.094 -35.877 1.00 0.00 N ATOM 1760 CA GLY A 120 2.635 -0.091 -36.704 1.00 0.00 C ATOM 1761 C GLY A 120 2.564 1.042 -37.731 1.00 0.00 C ATOM 1762 O GLY A 120 1.827 1.994 -37.570 1.00 0.00 O ATOM 0 H GLY A 120 1.033 0.828 -35.632 1.00 0.00 H new ATOM 0 HA2 GLY A 120 3.509 0.037 -36.066 1.00 0.00 H new ATOM 0 HA3 GLY A 120 2.748 -1.049 -37.211 1.00 0.00 H new ATOM 1766 N ARG A 121 3.326 0.943 -38.786 1.00 0.00 N ATOM 1767 CA ARG A 121 3.304 2.013 -39.824 1.00 0.00 C ATOM 1768 C ARG A 121 3.028 1.387 -41.193 1.00 0.00 C ATOM 1769 O ARG A 121 2.947 0.183 -41.330 1.00 0.00 O ATOM 1770 CB ARG A 121 4.657 2.728 -39.851 1.00 0.00 C ATOM 1771 CG ARG A 121 4.928 3.360 -38.485 1.00 0.00 C ATOM 1772 CD ARG A 121 4.533 4.837 -38.519 1.00 0.00 C ATOM 1773 NE ARG A 121 3.618 5.132 -37.381 1.00 0.00 N ATOM 1774 CZ ARG A 121 4.075 5.135 -36.158 1.00 0.00 C ATOM 1775 NH1 ARG A 121 5.281 5.571 -35.914 1.00 0.00 N ATOM 1776 NH2 ARG A 121 3.327 4.701 -35.181 1.00 0.00 N ATOM 0 H ARG A 121 3.962 0.168 -38.974 1.00 0.00 H new ATOM 0 HA ARG A 121 2.520 2.733 -39.588 1.00 0.00 H new ATOM 0 HB2 ARG A 121 5.449 2.021 -40.100 1.00 0.00 H new ATOM 0 HB3 ARG A 121 4.659 3.495 -40.625 1.00 0.00 H new ATOM 0 HG2 ARG A 121 4.362 2.839 -37.713 1.00 0.00 H new ATOM 0 HG3 ARG A 121 5.983 3.260 -38.229 1.00 0.00 H new ATOM 0 HD2 ARG A 121 5.422 5.464 -38.457 1.00 0.00 H new ATOM 0 HD3 ARG A 121 4.043 5.072 -39.464 1.00 0.00 H new ATOM 0 HE ARG A 121 2.633 5.332 -37.557 1.00 0.00 H new ATOM 0 HH11 ARG A 121 5.866 5.909 -36.679 1.00 0.00 H new ATOM 0 HH12 ARG A 121 5.639 5.574 -34.959 1.00 0.00 H new ATOM 0 HH21 ARG A 121 2.385 4.359 -35.373 1.00 0.00 H new ATOM 0 HH22 ARG A 121 3.684 4.703 -34.226 1.00 0.00 H new ATOM 1790 N ARG A 122 2.884 2.194 -42.208 1.00 0.00 N ATOM 1791 CA ARG A 122 2.613 1.642 -43.565 1.00 0.00 C ATOM 1792 C ARG A 122 3.901 1.659 -44.390 1.00 0.00 C ATOM 1793 O ARG A 122 4.043 0.929 -45.352 1.00 0.00 O ATOM 1794 CB ARG A 122 1.550 2.495 -44.260 1.00 0.00 C ATOM 1795 CG ARG A 122 0.163 2.098 -43.752 1.00 0.00 C ATOM 1796 CD ARG A 122 -0.048 2.666 -42.347 1.00 0.00 C ATOM 1797 NE ARG A 122 -1.179 3.636 -42.369 1.00 0.00 N ATOM 1798 CZ ARG A 122 -1.202 4.632 -41.525 1.00 0.00 C ATOM 1799 NH1 ARG A 122 -0.474 5.691 -41.746 1.00 0.00 N ATOM 1800 NH2 ARG A 122 -1.955 4.567 -40.461 1.00 0.00 N ATOM 0 H ARG A 122 2.942 3.211 -42.156 1.00 0.00 H new ATOM 0 HA ARG A 122 2.254 0.617 -43.475 1.00 0.00 H new ATOM 0 HB2 ARG A 122 1.732 3.552 -44.064 1.00 0.00 H new ATOM 0 HB3 ARG A 122 1.607 2.357 -45.340 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -0.605 2.475 -44.427 1.00 0.00 H new ATOM 0 HG3 ARG A 122 0.067 1.012 -43.735 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -0.260 1.860 -41.645 1.00 0.00 H new ATOM 0 HD3 ARG A 122 0.861 3.158 -42.002 1.00 0.00 H new ATOM 0 HE ARG A 122 -1.935 3.522 -43.044 1.00 0.00 H new ATOM 0 HH11 ARG A 122 0.114 5.741 -42.578 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -0.492 6.469 -41.087 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -2.525 3.739 -40.289 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -1.974 5.345 -39.801 1.00 0.00 H new ATOM 1814 N ARG A 123 4.842 2.485 -44.024 1.00 0.00 N ATOM 1815 CA ARG A 123 6.119 2.547 -44.788 1.00 0.00 C ATOM 1816 C ARG A 123 6.965 1.313 -44.470 1.00 0.00 C ATOM 1817 O ARG A 123 7.852 1.353 -43.641 1.00 0.00 O ATOM 1818 CB ARG A 123 6.888 3.810 -44.397 1.00 0.00 C ATOM 1819 CG ARG A 123 7.980 4.086 -45.433 1.00 0.00 C ATOM 1820 CD ARG A 123 9.190 4.718 -44.742 1.00 0.00 C ATOM 1821 NE ARG A 123 10.036 5.408 -45.757 1.00 0.00 N ATOM 1822 CZ ARG A 123 10.984 6.217 -45.373 1.00 0.00 C ATOM 1823 NH1 ARG A 123 11.884 5.812 -44.521 1.00 0.00 N ATOM 1824 NH2 ARG A 123 11.031 7.434 -45.842 1.00 0.00 N ATOM 0 H ARG A 123 4.781 3.120 -43.228 1.00 0.00 H new ATOM 0 HA ARG A 123 5.902 2.572 -45.856 1.00 0.00 H new ATOM 0 HB2 ARG A 123 6.207 4.659 -44.336 1.00 0.00 H new ATOM 0 HB3 ARG A 123 7.332 3.687 -43.409 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.272 3.158 -45.925 1.00 0.00 H new ATOM 0 HG3 ARG A 123 7.601 4.752 -46.208 1.00 0.00 H new ATOM 0 HD2 ARG A 123 8.860 5.429 -43.984 1.00 0.00 H new ATOM 0 HD3 ARG A 123 9.771 3.952 -44.229 1.00 0.00 H new ATOM 0 HE ARG A 123 9.874 5.248 -46.751 1.00 0.00 H new ATOM 0 HH11 ARG A 123 11.847 4.861 -44.154 1.00 0.00 H new ATOM 0 HH12 ARG A 123 12.625 6.446 -44.222 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.327 7.751 -46.508 1.00 0.00 H new ATOM 0 HH22 ARG A 123 11.772 8.068 -45.542 1.00 0.00 H new ATOM 1838 N ARG A 124 6.698 0.215 -45.123 1.00 0.00 N ATOM 1839 CA ARG A 124 7.487 -1.021 -44.859 1.00 0.00 C ATOM 1840 C ARG A 124 8.970 -0.743 -45.113 1.00 0.00 C ATOM 1841 O ARG A 124 9.287 -0.271 -46.193 1.00 0.00 O ATOM 1842 CB ARG A 124 7.011 -2.138 -45.790 1.00 0.00 C ATOM 1843 CG ARG A 124 7.859 -3.391 -45.559 1.00 0.00 C ATOM 1844 CD ARG A 124 7.158 -4.604 -46.173 1.00 0.00 C ATOM 1845 NE ARG A 124 8.100 -5.309 -47.087 1.00 0.00 N ATOM 1846 CZ ARG A 124 9.015 -6.101 -46.598 1.00 0.00 C ATOM 1847 NH1 ARG A 124 9.262 -6.102 -45.317 1.00 0.00 N ATOM 1848 NH2 ARG A 124 9.685 -6.892 -47.391 1.00 0.00 N ATOM 1849 OXT ARG A 124 9.762 -1.006 -44.225 1.00 0.00 O ATOM 0 H ARG A 124 5.967 0.121 -45.828 1.00 0.00 H new ATOM 0 HA ARG A 124 7.347 -1.327 -43.822 1.00 0.00 H new ATOM 0 HB2 ARG A 124 5.960 -2.358 -45.604 1.00 0.00 H new ATOM 0 HB3 ARG A 124 7.091 -1.819 -46.829 1.00 0.00 H new ATOM 0 HG2 ARG A 124 8.845 -3.263 -46.006 1.00 0.00 H new ATOM 0 HG3 ARG A 124 8.011 -3.548 -44.491 1.00 0.00 H new ATOM 0 HD2 ARG A 124 6.822 -5.280 -45.387 1.00 0.00 H new ATOM 0 HD3 ARG A 124 6.271 -4.287 -46.721 1.00 0.00 H new ATOM 0 HE ARG A 124 8.030 -5.173 -48.095 1.00 0.00 H new ATOM 0 HH11 ARG A 124 8.740 -5.483 -44.696 1.00 0.00 H new ATOM 0 HH12 ARG A 124 9.977 -6.721 -44.936 1.00 0.00 H new ATOM 0 HH21 ARG A 124 9.494 -6.891 -48.393 1.00 0.00 H new ATOM 0 HH22 ARG A 124 10.400 -7.511 -47.009 1.00 0.00 H new TER 1863 ARG A 124