USER MOD reduce.3.24.130724 H: found=0, std=0, add=571, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 570 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 122 LYS NZ :NH3+ 155:sc= -0.0145 (180deg=0) USER MOD Set 1.2: A 124 MET CE :methyl -122:sc= -2.87 (180deg=-11!) USER MOD Set 2.1: A 123 MET CE :methyl -137:sc= -5.69! (180deg=-10.1!) USER MOD Set 2.2: A 125 ASN : amide:sc= -1.8! C(o=-7.5!,f=-11!) USER MOD Single : A 81 HIS : no HD1:sc= -4.08! K(o=-4.1!,f=-2.9) USER MOD Single : A 85 SER OG : rot 65:sc= -3.26! USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -35:sc= 0.0712! USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 47:sc= 0.083 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= -1.17 K(o=-1.2,f=-1.7!) USER MOD Single : A 108 LYS NZ :NH3+ -135:sc= -0.0171 (180deg=-1.83!) USER MOD Single : A 110 ASN : amide:sc= -0.0369 X(o=-0.037,f=-0.04) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.0824 USER MOD Single : A 116 CYS SG : rot 168:sc= -1.57 USER MOD Single : A 121 MET CE :methyl -168:sc= -0.503 (180deg=-0.956) USER MOD Single : A 126 GLN : amide:sc= -0.525 K(o=-0.52,f=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= -2.02! USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.288) USER MOD Single : A 142 SER OG : rot 140:sc= -0.463 USER MOD Single : A 144 GLN : amide:sc= -3.92! C(o=-3.9!,f=-4.7!) USER MOD ----------------------------------------------------------------- ATOM 46 N GLY A 80 12.323 10.881 -2.346 1.00 0.00 N ATOM 47 CA GLY A 80 11.637 9.609 -2.479 1.00 0.00 C ATOM 48 C GLY A 80 10.467 9.678 -3.440 1.00 0.00 C ATOM 49 O GLY A 80 10.495 10.435 -4.410 1.00 0.00 O ATOM 0 HA2 GLY A 80 12.343 8.854 -2.825 1.00 0.00 H new ATOM 0 HA3 GLY A 80 11.281 9.288 -1.500 1.00 0.00 H new ATOM 53 N HIS A 81 9.436 8.885 -3.170 1.00 0.00 N ATOM 54 CA HIS A 81 8.250 8.857 -4.019 1.00 0.00 C ATOM 55 C HIS A 81 7.051 8.302 -3.259 1.00 0.00 C ATOM 56 O HIS A 81 6.965 7.100 -3.006 1.00 0.00 O ATOM 57 CB HIS A 81 8.513 8.015 -5.268 1.00 0.00 C ATOM 58 CG HIS A 81 9.598 6.999 -5.087 1.00 0.00 C ATOM 59 ND1 HIS A 81 10.397 6.558 -6.120 1.00 0.00 N ATOM 60 CD2 HIS A 81 10.017 6.338 -3.980 1.00 0.00 C ATOM 61 CE1 HIS A 81 11.259 5.669 -5.658 1.00 0.00 C ATOM 62 NE2 HIS A 81 11.049 5.519 -4.364 1.00 0.00 N ATOM 0 H HIS A 81 9.397 8.253 -2.370 1.00 0.00 H new ATOM 0 HA HIS A 81 8.023 9.880 -4.320 1.00 0.00 H new ATOM 0 HB2 HIS A 81 7.593 7.505 -5.553 1.00 0.00 H new ATOM 0 HB3 HIS A 81 8.779 8.676 -6.093 1.00 0.00 H new ATOM 0 HD2 HIS A 81 9.614 6.437 -2.983 1.00 0.00 H new ATOM 0 HE1 HIS A 81 12.008 5.153 -6.241 1.00 0.00 H new ATOM 0 HE2 HIS A 81 11.570 4.895 -3.748 1.00 0.00 H new ATOM 71 N ILE A 82 6.126 9.185 -2.896 1.00 0.00 N ATOM 72 CA ILE A 82 4.931 8.784 -2.163 1.00 0.00 C ATOM 73 C ILE A 82 3.942 8.068 -3.075 1.00 0.00 C ATOM 74 O ILE A 82 3.613 8.555 -4.156 1.00 0.00 O ATOM 75 CB ILE A 82 4.234 10.000 -1.521 1.00 0.00 C ATOM 76 CG1 ILE A 82 5.126 10.618 -0.444 1.00 0.00 C ATOM 77 CG2 ILE A 82 2.891 9.593 -0.935 1.00 0.00 C ATOM 78 CD1 ILE A 82 6.510 10.979 -0.939 1.00 0.00 C ATOM 0 H ILE A 82 6.181 10.183 -3.098 1.00 0.00 H new ATOM 0 HA ILE A 82 5.254 8.102 -1.377 1.00 0.00 H new ATOM 0 HB ILE A 82 4.059 10.749 -2.294 1.00 0.00 H new ATOM 0 HG12 ILE A 82 4.643 11.514 -0.054 1.00 0.00 H new ATOM 0 HG13 ILE A 82 5.217 9.918 0.387 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.412 10.463 -0.486 1.00 0.00 H new ATOM 0 HG22 ILE A 82 2.254 9.196 -1.726 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.043 8.828 -0.173 1.00 0.00 H new ATOM 0 HD11 ILE A 82 7.087 11.412 -0.122 1.00 0.00 H new ATOM 0 HD12 ILE A 82 7.012 10.082 -1.302 1.00 0.00 H new ATOM 0 HD13 ILE A 82 6.429 11.703 -1.750 1.00 0.00 H new ATOM 90 N VAL A 83 3.470 6.906 -2.631 1.00 0.00 N ATOM 91 CA VAL A 83 2.517 6.123 -3.408 1.00 0.00 C ATOM 92 C VAL A 83 1.083 6.433 -2.993 1.00 0.00 C ATOM 93 O VAL A 83 0.587 5.908 -1.996 1.00 0.00 O ATOM 94 CB VAL A 83 2.770 4.611 -3.248 1.00 0.00 C ATOM 95 CG1 VAL A 83 1.764 3.812 -4.063 1.00 0.00 C ATOM 96 CG2 VAL A 83 4.193 4.262 -3.654 1.00 0.00 C ATOM 0 H VAL A 83 3.732 6.487 -1.739 1.00 0.00 H new ATOM 0 HA VAL A 83 2.658 6.399 -4.453 1.00 0.00 H new ATOM 0 HB VAL A 83 2.642 4.349 -2.198 1.00 0.00 H new ATOM 0 HG11 VAL A 83 1.958 2.747 -3.938 1.00 0.00 H new ATOM 0 HG12 VAL A 83 0.755 4.040 -3.720 1.00 0.00 H new ATOM 0 HG13 VAL A 83 1.857 4.076 -5.116 1.00 0.00 H new ATOM 0 HG21 VAL A 83 4.353 3.190 -3.534 1.00 0.00 H new ATOM 0 HG22 VAL A 83 4.352 4.539 -4.696 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.895 4.806 -3.023 1.00 0.00 H new ATOM 106 N ARG A 84 0.423 7.292 -3.764 1.00 0.00 N ATOM 107 CA ARG A 84 -0.954 7.676 -3.476 1.00 0.00 C ATOM 108 C ARG A 84 -1.933 6.629 -4.000 1.00 0.00 C ATOM 109 O ARG A 84 -1.588 5.819 -4.860 1.00 0.00 O ATOM 110 CB ARG A 84 -1.267 9.037 -4.099 1.00 0.00 C ATOM 111 CG ARG A 84 -1.050 10.204 -3.151 1.00 0.00 C ATOM 112 CD ARG A 84 -0.696 11.476 -3.904 1.00 0.00 C ATOM 113 NE ARG A 84 -1.012 12.674 -3.132 1.00 0.00 N ATOM 114 CZ ARG A 84 -1.022 13.900 -3.647 1.00 0.00 C ATOM 115 NH1 ARG A 84 -0.733 14.087 -4.927 1.00 0.00 N ATOM 116 NH2 ARG A 84 -1.322 14.940 -2.880 1.00 0.00 N ATOM 0 H ARG A 84 0.820 7.735 -4.593 1.00 0.00 H new ATOM 0 HA ARG A 84 -1.066 7.744 -2.394 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -0.642 9.176 -4.981 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -2.303 9.043 -4.438 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -1.952 10.368 -2.562 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -0.251 9.961 -2.450 1.00 0.00 H new ATOM 0 HD2 ARG A 84 0.367 11.470 -4.146 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -1.238 11.500 -4.849 1.00 0.00 H new ATOM 0 HE ARG A 84 -1.238 12.565 -2.143 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -0.502 13.289 -5.520 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -0.741 15.028 -5.319 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -1.545 14.799 -1.895 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -1.329 15.880 -3.276 1.00 0.00 H new ATOM 130 N SER A 85 -3.153 6.655 -3.474 1.00 0.00 N ATOM 131 CA SER A 85 -4.183 5.709 -3.886 1.00 0.00 C ATOM 132 C SER A 85 -4.872 6.173 -5.166 1.00 0.00 C ATOM 133 O SER A 85 -4.983 7.371 -5.426 1.00 0.00 O ATOM 134 CB SER A 85 -5.219 5.535 -2.775 1.00 0.00 C ATOM 135 OG SER A 85 -4.599 5.196 -1.547 1.00 0.00 O ATOM 0 H SER A 85 -3.452 7.321 -2.762 1.00 0.00 H new ATOM 0 HA SER A 85 -3.701 4.751 -4.080 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.788 6.457 -2.656 1.00 0.00 H new ATOM 0 HB3 SER A 85 -5.929 4.757 -3.054 1.00 0.00 H new ATOM 0 HG SER A 85 -4.035 5.940 -1.249 1.00 0.00 H new ATOM 141 N PRO A 86 -5.342 5.218 -5.982 1.00 0.00 N ATOM 142 CA PRO A 86 -6.022 5.509 -7.235 1.00 0.00 C ATOM 143 C PRO A 86 -7.524 5.711 -7.053 1.00 0.00 C ATOM 144 O PRO A 86 -8.020 6.836 -7.113 1.00 0.00 O ATOM 145 CB PRO A 86 -5.740 4.261 -8.070 1.00 0.00 C ATOM 146 CG PRO A 86 -5.526 3.150 -7.086 1.00 0.00 C ATOM 147 CD PRO A 86 -5.245 3.775 -5.737 1.00 0.00 C ATOM 0 HA PRO A 86 -5.674 6.436 -7.690 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -6.575 4.039 -8.735 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -4.860 4.402 -8.698 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -6.407 2.510 -7.035 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -4.692 2.520 -7.396 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -5.967 3.449 -4.989 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -4.257 3.499 -5.368 1.00 0.00 H new ATOM 155 N MET A 87 -8.244 4.615 -6.830 1.00 0.00 N ATOM 156 CA MET A 87 -9.690 4.674 -6.639 1.00 0.00 C ATOM 157 C MET A 87 -10.076 4.178 -5.250 1.00 0.00 C ATOM 158 O MET A 87 -9.782 3.041 -4.881 1.00 0.00 O ATOM 159 CB MET A 87 -10.403 3.840 -7.706 1.00 0.00 C ATOM 160 CG MET A 87 -11.913 3.800 -7.536 1.00 0.00 C ATOM 161 SD MET A 87 -12.769 3.297 -9.042 1.00 0.00 S ATOM 162 CE MET A 87 -14.229 4.332 -8.963 1.00 0.00 C ATOM 0 H MET A 87 -7.850 3.676 -6.777 1.00 0.00 H new ATOM 0 HA MET A 87 -10.000 5.715 -6.734 1.00 0.00 H new ATOM 0 HB2 MET A 87 -10.167 4.245 -8.690 1.00 0.00 H new ATOM 0 HB3 MET A 87 -10.015 2.822 -7.679 1.00 0.00 H new ATOM 0 HG2 MET A 87 -12.166 3.110 -6.731 1.00 0.00 H new ATOM 0 HG3 MET A 87 -12.267 4.786 -7.234 1.00 0.00 H new ATOM 0 HE1 MET A 87 -14.861 4.136 -9.829 1.00 0.00 H new ATOM 0 HE2 MET A 87 -14.784 4.110 -8.051 1.00 0.00 H new ATOM 0 HE3 MET A 87 -13.932 5.381 -8.960 1.00 0.00 H new ATOM 172 N VAL A 88 -10.735 5.041 -4.483 1.00 0.00 N ATOM 173 CA VAL A 88 -11.160 4.696 -3.132 1.00 0.00 C ATOM 174 C VAL A 88 -11.553 3.225 -3.028 1.00 0.00 C ATOM 175 O VAL A 88 -12.161 2.664 -3.939 1.00 0.00 O ATOM 176 CB VAL A 88 -12.344 5.572 -2.678 1.00 0.00 C ATOM 177 CG1 VAL A 88 -12.996 4.999 -1.427 1.00 0.00 C ATOM 178 CG2 VAL A 88 -11.886 7.002 -2.437 1.00 0.00 C ATOM 0 H VAL A 88 -10.986 5.985 -4.775 1.00 0.00 H new ATOM 0 HA VAL A 88 -10.308 4.880 -2.477 1.00 0.00 H new ATOM 0 HB VAL A 88 -13.089 5.577 -3.474 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -13.829 5.635 -1.127 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -13.364 3.994 -1.636 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -12.263 4.957 -0.621 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -12.735 7.607 -2.117 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -11.120 7.013 -1.662 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -11.475 7.413 -3.359 1.00 0.00 H new ATOM 188 N GLY A 89 -11.200 2.610 -1.903 1.00 0.00 N ATOM 189 CA GLY A 89 -11.518 1.212 -1.682 1.00 0.00 C ATOM 190 C GLY A 89 -11.446 0.837 -0.214 1.00 0.00 C ATOM 191 O GLY A 89 -12.311 1.219 0.572 1.00 0.00 O ATOM 0 H GLY A 89 -10.697 3.058 -1.137 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -12.519 1.004 -2.060 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -10.827 0.589 -2.249 1.00 0.00 H new ATOM 195 N THR A 90 -10.410 0.090 0.156 1.00 0.00 N ATOM 196 CA THR A 90 -10.226 -0.331 1.541 1.00 0.00 C ATOM 197 C THR A 90 -8.783 -0.760 1.786 1.00 0.00 C ATOM 198 O THR A 90 -8.412 -1.905 1.527 1.00 0.00 O ATOM 199 CB THR A 90 -11.175 -1.481 1.880 1.00 0.00 C ATOM 200 OG1 THR A 90 -12.459 -1.250 1.325 1.00 0.00 O ATOM 201 CG2 THR A 90 -11.350 -1.694 3.369 1.00 0.00 C ATOM 0 H THR A 90 -9.685 -0.236 -0.484 1.00 0.00 H new ATOM 0 HA THR A 90 -10.453 0.517 2.187 1.00 0.00 H new ATOM 0 HB THR A 90 -10.714 -2.372 1.454 1.00 0.00 H new ATOM 0 HG1 THR A 90 -12.661 -0.292 1.357 1.00 0.00 H new ATOM 0 HG21 THR A 90 -12.035 -2.524 3.540 1.00 0.00 H new ATOM 0 HG22 THR A 90 -10.384 -1.922 3.820 1.00 0.00 H new ATOM 0 HG23 THR A 90 -11.757 -0.789 3.821 1.00 0.00 H new ATOM 209 N PHE A 91 -7.970 0.166 2.286 1.00 0.00 N ATOM 210 CA PHE A 91 -6.568 -0.123 2.562 1.00 0.00 C ATOM 211 C PHE A 91 -6.438 -1.163 3.670 1.00 0.00 C ATOM 212 O PHE A 91 -7.426 -1.529 4.307 1.00 0.00 O ATOM 213 CB PHE A 91 -5.825 1.156 2.947 1.00 0.00 C ATOM 214 CG PHE A 91 -4.336 1.051 2.787 1.00 0.00 C ATOM 215 CD1 PHE A 91 -3.773 0.867 1.528 1.00 0.00 C ATOM 216 CD2 PHE A 91 -3.496 1.133 3.891 1.00 0.00 C ATOM 217 CE1 PHE A 91 -2.399 0.769 1.375 1.00 0.00 C ATOM 218 CE2 PHE A 91 -2.121 1.036 3.744 1.00 0.00 C ATOM 219 CZ PHE A 91 -1.572 0.852 2.485 1.00 0.00 C ATOM 0 H PHE A 91 -8.257 1.119 2.507 1.00 0.00 H new ATOM 0 HA PHE A 91 -6.119 -0.529 1.655 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -6.192 1.979 2.334 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -6.055 1.403 3.983 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -4.413 0.800 0.661 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -3.919 1.274 4.875 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -1.973 0.628 0.393 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -1.479 1.104 4.609 1.00 0.00 H new ATOM 0 HZ PHE A 91 -0.501 0.773 2.368 1.00 0.00 H new ATOM 229 N TYR A 92 -5.217 -1.641 3.895 1.00 0.00 N ATOM 230 CA TYR A 92 -4.975 -2.643 4.926 1.00 0.00 C ATOM 231 C TYR A 92 -3.482 -2.894 5.119 1.00 0.00 C ATOM 232 O TYR A 92 -2.686 -2.705 4.200 1.00 0.00 O ATOM 233 CB TYR A 92 -5.675 -3.950 4.560 1.00 0.00 C ATOM 234 CG TYR A 92 -7.070 -4.073 5.129 1.00 0.00 C ATOM 235 CD1 TYR A 92 -7.285 -4.063 6.506 1.00 0.00 C ATOM 236 CD2 TYR A 92 -8.175 -4.203 4.289 1.00 0.00 C ATOM 237 CE1 TYR A 92 -8.563 -4.178 7.031 1.00 0.00 C ATOM 238 CE2 TYR A 92 -9.456 -4.319 4.806 1.00 0.00 C ATOM 239 CZ TYR A 92 -9.645 -4.306 6.176 1.00 0.00 C ATOM 240 OH TYR A 92 -10.914 -4.421 6.693 1.00 0.00 O ATOM 0 H TYR A 92 -4.385 -1.352 3.380 1.00 0.00 H new ATOM 0 HA TYR A 92 -5.380 -2.262 5.864 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -5.727 -4.032 3.474 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -5.073 -4.786 4.915 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -6.443 -3.964 7.175 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -8.031 -4.214 3.219 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -8.714 -4.168 8.100 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -10.302 -4.419 4.142 1.00 0.00 H new ATOM 0 HH TYR A 92 -11.560 -4.501 5.960 1.00 0.00 H new ATOM 250 N ARG A 93 -3.115 -3.328 6.320 1.00 0.00 N ATOM 251 CA ARG A 93 -1.721 -3.616 6.641 1.00 0.00 C ATOM 252 C ARG A 93 -1.538 -5.090 6.986 1.00 0.00 C ATOM 253 O ARG A 93 -0.441 -5.636 6.869 1.00 0.00 O ATOM 254 CB ARG A 93 -1.253 -2.746 7.808 1.00 0.00 C ATOM 255 CG ARG A 93 -0.537 -1.478 7.373 1.00 0.00 C ATOM 256 CD ARG A 93 -1.040 -0.263 8.135 1.00 0.00 C ATOM 257 NE ARG A 93 -0.724 -0.341 9.558 1.00 0.00 N ATOM 258 CZ ARG A 93 0.457 -0.008 10.069 1.00 0.00 C ATOM 259 NH1 ARG A 93 1.425 0.427 9.275 1.00 0.00 N ATOM 260 NH2 ARG A 93 0.669 -0.109 11.374 1.00 0.00 N ATOM 0 H ARG A 93 -3.765 -3.489 7.089 1.00 0.00 H new ATOM 0 HA ARG A 93 -1.117 -3.387 5.763 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -2.115 -2.475 8.417 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -0.586 -3.331 8.442 1.00 0.00 H new ATOM 0 HG2 ARG A 93 0.535 -1.591 7.534 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -0.684 -1.325 6.304 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -0.596 0.639 7.714 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -2.119 -0.176 8.007 1.00 0.00 H new ATOM 0 HE ARG A 93 -1.450 -0.669 10.195 1.00 0.00 H new ATOM 0 HH11 ARG A 93 1.264 0.506 8.271 1.00 0.00 H new ATOM 0 HH12 ARG A 93 2.331 0.682 9.668 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -0.075 -0.443 11.987 1.00 0.00 H new ATOM 0 HH22 ARG A 93 1.576 0.147 11.765 1.00 0.00 H new ATOM 274 N THR A 94 -2.624 -5.728 7.410 1.00 0.00 N ATOM 275 CA THR A 94 -2.594 -7.140 7.770 1.00 0.00 C ATOM 276 C THR A 94 -3.863 -7.836 7.296 1.00 0.00 C ATOM 277 O THR A 94 -4.933 -7.663 7.878 1.00 0.00 O ATOM 278 CB THR A 94 -2.444 -7.299 9.284 1.00 0.00 C ATOM 279 OG1 THR A 94 -3.281 -6.384 9.969 1.00 0.00 O ATOM 280 CG2 THR A 94 -1.029 -7.080 9.773 1.00 0.00 C ATOM 0 H THR A 94 -3.538 -5.287 7.513 1.00 0.00 H new ATOM 0 HA THR A 94 -1.737 -7.603 7.281 1.00 0.00 H new ATOM 0 HB THR A 94 -2.728 -8.330 9.495 1.00 0.00 H new ATOM 0 HG1 THR A 94 -4.180 -6.408 9.579 1.00 0.00 H new ATOM 0 HG21 THR A 94 -0.994 -7.208 10.855 1.00 0.00 H new ATOM 0 HG22 THR A 94 -0.365 -7.803 9.300 1.00 0.00 H new ATOM 0 HG23 THR A 94 -0.708 -6.071 9.516 1.00 0.00 H new ATOM 288 N PRO A 95 -3.757 -8.633 6.224 1.00 0.00 N ATOM 289 CA PRO A 95 -4.900 -9.355 5.665 1.00 0.00 C ATOM 290 C PRO A 95 -5.577 -10.254 6.692 1.00 0.00 C ATOM 291 O PRO A 95 -5.647 -9.912 7.873 1.00 0.00 O ATOM 292 CB PRO A 95 -4.293 -10.189 4.536 1.00 0.00 C ATOM 293 CG PRO A 95 -3.005 -9.517 4.202 1.00 0.00 C ATOM 294 CD PRO A 95 -2.516 -8.887 5.476 1.00 0.00 C ATOM 0 HA PRO A 95 -5.680 -8.673 5.327 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -4.129 -11.219 4.852 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -4.956 -10.222 3.671 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -2.279 -10.235 3.820 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -3.148 -8.765 3.426 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -1.846 -9.551 6.022 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -1.966 -7.966 5.284 1.00 0.00 H new ATOM 349 N LYS A 100 0.526 -11.970 8.564 1.00 0.00 N ATOM 350 CA LYS A 100 1.735 -11.367 9.116 1.00 0.00 C ATOM 351 C LYS A 100 2.041 -10.039 8.433 1.00 0.00 C ATOM 352 O LYS A 100 3.202 -9.695 8.214 1.00 0.00 O ATOM 353 CB LYS A 100 2.921 -12.321 8.960 1.00 0.00 C ATOM 354 CG LYS A 100 2.752 -13.630 9.713 1.00 0.00 C ATOM 355 CD LYS A 100 4.002 -13.983 10.504 1.00 0.00 C ATOM 356 CE LYS A 100 4.205 -13.035 11.676 1.00 0.00 C ATOM 357 NZ LYS A 100 4.118 -13.743 12.983 1.00 0.00 N ATOM 0 HA LYS A 100 1.567 -11.178 10.176 1.00 0.00 H new ATOM 0 HB2 LYS A 100 3.066 -12.537 7.901 1.00 0.00 H new ATOM 0 HB3 LYS A 100 3.825 -11.824 9.311 1.00 0.00 H new ATOM 0 HG2 LYS A 100 1.901 -13.554 10.390 1.00 0.00 H new ATOM 0 HG3 LYS A 100 2.528 -14.430 9.008 1.00 0.00 H new ATOM 0 HD2 LYS A 100 3.925 -15.006 10.871 1.00 0.00 H new ATOM 0 HD3 LYS A 100 4.872 -13.945 9.848 1.00 0.00 H new ATOM 0 HE2 LYS A 100 5.178 -12.552 11.588 1.00 0.00 H new ATOM 0 HE3 LYS A 100 3.454 -12.246 11.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 4.262 -13.063 13.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 3.180 -14.182 13.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 4.851 -14.479 13.029 1.00 0.00 H new ATOM 371 N ALA A 101 0.989 -9.294 8.100 1.00 0.00 N ATOM 372 CA ALA A 101 1.142 -8.002 7.441 1.00 0.00 C ATOM 373 C ALA A 101 1.930 -8.137 6.142 1.00 0.00 C ATOM 374 O ALA A 101 3.033 -8.684 6.126 1.00 0.00 O ATOM 375 CB ALA A 101 1.825 -7.012 8.374 1.00 0.00 C ATOM 0 H ALA A 101 0.021 -9.564 8.277 1.00 0.00 H new ATOM 0 HA ALA A 101 0.148 -7.628 7.195 1.00 0.00 H new ATOM 0 HB1 ALA A 101 1.933 -6.052 7.870 1.00 0.00 H new ATOM 0 HB2 ALA A 101 1.222 -6.884 9.273 1.00 0.00 H new ATOM 0 HB3 ALA A 101 2.810 -7.390 8.648 1.00 0.00 H new ATOM 381 N PHE A 102 1.358 -7.636 5.052 1.00 0.00 N ATOM 382 CA PHE A 102 2.013 -7.703 3.751 1.00 0.00 C ATOM 383 C PHE A 102 3.385 -7.039 3.801 1.00 0.00 C ATOM 384 O PHE A 102 4.379 -7.675 4.154 1.00 0.00 O ATOM 385 CB PHE A 102 1.145 -7.039 2.680 1.00 0.00 C ATOM 386 CG PHE A 102 0.245 -8.000 1.958 1.00 0.00 C ATOM 387 CD1 PHE A 102 0.777 -8.980 1.128 1.00 0.00 C ATOM 388 CD2 PHE A 102 -1.135 -7.926 2.109 1.00 0.00 C ATOM 389 CE1 PHE A 102 -0.052 -9.869 0.460 1.00 0.00 C ATOM 390 CE2 PHE A 102 -1.969 -8.812 1.444 1.00 0.00 C ATOM 391 CZ PHE A 102 -1.426 -9.784 0.619 1.00 0.00 C ATOM 0 H PHE A 102 0.445 -7.181 5.044 1.00 0.00 H new ATOM 0 HA PHE A 102 2.147 -8.753 3.493 1.00 0.00 H new ATOM 0 HB2 PHE A 102 0.537 -6.264 3.146 1.00 0.00 H new ATOM 0 HB3 PHE A 102 1.791 -6.544 1.955 1.00 0.00 H new ATOM 0 HD1 PHE A 102 1.847 -9.050 1.002 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -1.562 -7.170 2.751 1.00 0.00 H new ATOM 0 HE1 PHE A 102 0.372 -10.626 -0.183 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -3.040 -8.745 1.569 1.00 0.00 H new ATOM 0 HZ PHE A 102 -2.074 -10.475 0.100 1.00 0.00 H new ATOM 401 N ILE A 103 3.436 -5.758 3.449 1.00 0.00 N ATOM 402 CA ILE A 103 4.690 -5.014 3.459 1.00 0.00 C ATOM 403 C ILE A 103 4.665 -3.914 4.514 1.00 0.00 C ATOM 404 O ILE A 103 4.444 -2.745 4.200 1.00 0.00 O ATOM 405 CB ILE A 103 4.983 -4.386 2.084 1.00 0.00 C ATOM 406 CG1 ILE A 103 4.856 -5.437 0.981 1.00 0.00 C ATOM 407 CG2 ILE A 103 6.371 -3.762 2.072 1.00 0.00 C ATOM 408 CD1 ILE A 103 5.612 -6.715 1.273 1.00 0.00 C ATOM 0 H ILE A 103 2.625 -5.215 3.154 1.00 0.00 H new ATOM 0 HA ILE A 103 5.479 -5.727 3.698 1.00 0.00 H new ATOM 0 HB ILE A 103 4.251 -3.601 1.896 1.00 0.00 H new ATOM 0 HG12 ILE A 103 3.802 -5.673 0.835 1.00 0.00 H new ATOM 0 HG13 ILE A 103 5.220 -5.015 0.044 1.00 0.00 H new ATOM 0 HG21 ILE A 103 6.564 -3.322 1.093 1.00 0.00 H new ATOM 0 HG22 ILE A 103 6.428 -2.987 2.836 1.00 0.00 H new ATOM 0 HG23 ILE A 103 7.117 -4.530 2.278 1.00 0.00 H new ATOM 0 HD11 ILE A 103 5.477 -7.414 0.448 1.00 0.00 H new ATOM 0 HD12 ILE A 103 6.673 -6.492 1.389 1.00 0.00 H new ATOM 0 HD13 ILE A 103 5.232 -7.161 2.192 1.00 0.00 H new ATOM 420 N GLU A 104 4.893 -4.297 5.767 1.00 0.00 N ATOM 421 CA GLU A 104 4.895 -3.343 6.870 1.00 0.00 C ATOM 422 C GLU A 104 5.892 -2.217 6.618 1.00 0.00 C ATOM 423 O GLU A 104 6.743 -2.314 5.732 1.00 0.00 O ATOM 424 CB GLU A 104 5.228 -4.050 8.182 1.00 0.00 C ATOM 425 CG GLU A 104 4.075 -4.067 9.173 1.00 0.00 C ATOM 426 CD GLU A 104 4.501 -4.526 10.554 1.00 0.00 C ATOM 427 OE1 GLU A 104 5.000 -3.685 11.331 1.00 0.00 O ATOM 428 OE2 GLU A 104 4.334 -5.726 10.859 1.00 0.00 O ATOM 0 H GLU A 104 5.079 -5.261 6.043 1.00 0.00 H new ATOM 0 HA GLU A 104 3.898 -2.909 6.942 1.00 0.00 H new ATOM 0 HB2 GLU A 104 5.526 -5.076 7.967 1.00 0.00 H new ATOM 0 HB3 GLU A 104 6.085 -3.559 8.643 1.00 0.00 H new ATOM 0 HG2 GLU A 104 3.646 -3.068 9.243 1.00 0.00 H new ATOM 0 HG3 GLU A 104 3.290 -4.726 8.801 1.00 0.00 H new ATOM 435 N VAL A 105 5.783 -1.151 7.403 1.00 0.00 N ATOM 436 CA VAL A 105 6.675 -0.006 7.268 1.00 0.00 C ATOM 437 C VAL A 105 8.105 -0.375 7.649 1.00 0.00 C ATOM 438 O VAL A 105 8.329 -1.243 8.491 1.00 0.00 O ATOM 439 CB VAL A 105 6.212 1.173 8.143 1.00 0.00 C ATOM 440 CG1 VAL A 105 7.264 2.270 8.162 1.00 0.00 C ATOM 441 CG2 VAL A 105 4.878 1.712 7.649 1.00 0.00 C ATOM 0 H VAL A 105 5.085 -1.056 8.140 1.00 0.00 H new ATOM 0 HA VAL A 105 6.646 0.295 6.221 1.00 0.00 H new ATOM 0 HB VAL A 105 6.078 0.814 9.163 1.00 0.00 H new ATOM 0 HG11 VAL A 105 6.919 3.095 8.786 1.00 0.00 H new ATOM 0 HG12 VAL A 105 8.195 1.874 8.567 1.00 0.00 H new ATOM 0 HG13 VAL A 105 7.434 2.629 7.147 1.00 0.00 H new ATOM 0 HG21 VAL A 105 4.566 2.545 8.279 1.00 0.00 H new ATOM 0 HG22 VAL A 105 4.983 2.055 6.620 1.00 0.00 H new ATOM 0 HG23 VAL A 105 4.128 0.923 7.693 1.00 0.00 H new ATOM 451 N GLY A 106 9.070 0.292 7.021 1.00 0.00 N ATOM 452 CA GLY A 106 10.466 0.021 7.308 1.00 0.00 C ATOM 453 C GLY A 106 10.986 -1.192 6.563 1.00 0.00 C ATOM 454 O GLY A 106 12.191 -1.446 6.541 1.00 0.00 O ATOM 0 H GLY A 106 8.909 1.015 6.319 1.00 0.00 H new ATOM 0 HA2 GLY A 106 11.064 0.892 7.041 1.00 0.00 H new ATOM 0 HA3 GLY A 106 10.590 -0.134 8.380 1.00 0.00 H new ATOM 458 N GLN A 107 10.077 -1.945 5.953 1.00 0.00 N ATOM 459 CA GLN A 107 10.451 -3.138 5.203 1.00 0.00 C ATOM 460 C GLN A 107 11.043 -2.764 3.847 1.00 0.00 C ATOM 461 O GLN A 107 10.950 -1.616 3.414 1.00 0.00 O ATOM 462 CB GLN A 107 9.233 -4.045 5.011 1.00 0.00 C ATOM 463 CG GLN A 107 9.503 -5.248 4.122 1.00 0.00 C ATOM 464 CD GLN A 107 8.369 -6.254 4.144 1.00 0.00 C ATOM 465 OE1 GLN A 107 7.616 -6.337 5.115 1.00 0.00 O ATOM 466 NE2 GLN A 107 8.241 -7.027 3.071 1.00 0.00 N ATOM 0 H GLN A 107 9.076 -1.750 5.963 1.00 0.00 H new ATOM 0 HA GLN A 107 11.209 -3.675 5.773 1.00 0.00 H new ATOM 0 HB2 GLN A 107 8.893 -4.394 5.986 1.00 0.00 H new ATOM 0 HB3 GLN A 107 8.420 -3.461 4.580 1.00 0.00 H new ATOM 0 HG2 GLN A 107 9.664 -4.910 3.098 1.00 0.00 H new ATOM 0 HG3 GLN A 107 10.423 -5.735 4.446 1.00 0.00 H new ATOM 0 HE21 GLN A 107 8.887 -6.924 2.289 1.00 0.00 H new ATOM 0 HE22 GLN A 107 7.496 -7.723 3.030 1.00 0.00 H new ATOM 475 N LYS A 108 11.651 -3.741 3.179 1.00 0.00 N ATOM 476 CA LYS A 108 12.257 -3.510 1.873 1.00 0.00 C ATOM 477 C LYS A 108 11.322 -3.962 0.755 1.00 0.00 C ATOM 478 O LYS A 108 10.744 -5.047 0.816 1.00 0.00 O ATOM 479 CB LYS A 108 13.592 -4.250 1.767 1.00 0.00 C ATOM 480 CG LYS A 108 13.652 -5.519 2.599 1.00 0.00 C ATOM 481 CD LYS A 108 14.096 -5.231 4.024 1.00 0.00 C ATOM 482 CE LYS A 108 13.549 -6.263 4.997 1.00 0.00 C ATOM 483 NZ LYS A 108 13.006 -5.630 6.231 1.00 0.00 N ATOM 0 H LYS A 108 11.736 -4.698 3.521 1.00 0.00 H new ATOM 0 HA LYS A 108 12.435 -2.440 1.766 1.00 0.00 H new ATOM 0 HB2 LYS A 108 13.776 -4.501 0.723 1.00 0.00 H new ATOM 0 HB3 LYS A 108 14.394 -3.582 2.081 1.00 0.00 H new ATOM 0 HG2 LYS A 108 12.671 -5.994 2.612 1.00 0.00 H new ATOM 0 HG3 LYS A 108 14.342 -6.225 2.138 1.00 0.00 H new ATOM 0 HD2 LYS A 108 15.185 -5.225 4.073 1.00 0.00 H new ATOM 0 HD3 LYS A 108 13.758 -4.237 4.318 1.00 0.00 H new ATOM 0 HE2 LYS A 108 12.764 -6.841 4.510 1.00 0.00 H new ATOM 0 HE3 LYS A 108 14.340 -6.963 5.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 13.336 -6.156 7.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 13.336 -4.646 6.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 11.967 -5.645 6.201 1.00 0.00 H new ATOM 497 N VAL A 109 11.177 -3.121 -0.264 1.00 0.00 N ATOM 498 CA VAL A 109 10.312 -3.434 -1.394 1.00 0.00 C ATOM 499 C VAL A 109 11.025 -3.185 -2.718 1.00 0.00 C ATOM 500 O VAL A 109 11.487 -2.077 -2.988 1.00 0.00 O ATOM 501 CB VAL A 109 9.017 -2.601 -1.357 1.00 0.00 C ATOM 502 CG1 VAL A 109 7.922 -3.346 -0.612 1.00 0.00 C ATOM 503 CG2 VAL A 109 9.274 -1.242 -0.723 1.00 0.00 C ATOM 0 H VAL A 109 11.647 -2.218 -0.330 1.00 0.00 H new ATOM 0 HA VAL A 109 10.058 -4.491 -1.315 1.00 0.00 H new ATOM 0 HB VAL A 109 8.681 -2.441 -2.382 1.00 0.00 H new ATOM 0 HG11 VAL A 109 7.016 -2.741 -0.597 1.00 0.00 H new ATOM 0 HG12 VAL A 109 7.719 -4.292 -1.114 1.00 0.00 H new ATOM 0 HG13 VAL A 109 8.245 -3.541 0.411 1.00 0.00 H new ATOM 0 HG21 VAL A 109 8.348 -0.668 -0.706 1.00 0.00 H new ATOM 0 HG22 VAL A 109 9.636 -1.379 0.296 1.00 0.00 H new ATOM 0 HG23 VAL A 109 10.023 -0.705 -1.305 1.00 0.00 H new ATOM 513 N ASN A 110 11.110 -4.225 -3.543 1.00 0.00 N ATOM 514 CA ASN A 110 11.766 -4.120 -4.842 1.00 0.00 C ATOM 515 C ASN A 110 10.804 -4.492 -5.965 1.00 0.00 C ATOM 516 O ASN A 110 10.056 -5.463 -5.859 1.00 0.00 O ATOM 517 CB ASN A 110 13.002 -5.020 -4.891 1.00 0.00 C ATOM 518 CG ASN A 110 12.979 -6.099 -3.825 1.00 0.00 C ATOM 519 OD1 ASN A 110 12.252 -7.085 -3.940 1.00 0.00 O ATOM 520 ND2 ASN A 110 13.777 -5.915 -2.780 1.00 0.00 N ATOM 0 H ASN A 110 10.733 -5.150 -3.335 1.00 0.00 H new ATOM 0 HA ASN A 110 12.078 -3.085 -4.981 1.00 0.00 H new ATOM 0 HB2 ASN A 110 13.069 -5.487 -5.874 1.00 0.00 H new ATOM 0 HB3 ASN A 110 13.897 -4.410 -4.766 1.00 0.00 H new ATOM 0 HD21 ASN A 110 13.804 -6.607 -2.031 1.00 0.00 H new ATOM 0 HD22 ASN A 110 14.363 -5.082 -2.726 1.00 0.00 H new ATOM 527 N VAL A 111 10.831 -3.713 -7.042 1.00 0.00 N ATOM 528 CA VAL A 111 9.962 -3.958 -8.185 1.00 0.00 C ATOM 529 C VAL A 111 9.763 -5.453 -8.414 1.00 0.00 C ATOM 530 O VAL A 111 10.549 -6.095 -9.109 1.00 0.00 O ATOM 531 CB VAL A 111 10.532 -3.326 -9.470 1.00 0.00 C ATOM 532 CG1 VAL A 111 9.720 -3.753 -10.682 1.00 0.00 C ATOM 533 CG2 VAL A 111 10.564 -1.809 -9.348 1.00 0.00 C ATOM 0 H VAL A 111 11.446 -2.906 -7.146 1.00 0.00 H new ATOM 0 HA VAL A 111 9.001 -3.496 -7.956 1.00 0.00 H new ATOM 0 HB VAL A 111 11.554 -3.680 -9.605 1.00 0.00 H new ATOM 0 HG11 VAL A 111 10.138 -3.297 -11.579 1.00 0.00 H new ATOM 0 HG12 VAL A 111 9.753 -4.838 -10.778 1.00 0.00 H new ATOM 0 HG13 VAL A 111 8.686 -3.431 -10.559 1.00 0.00 H new ATOM 0 HG21 VAL A 111 10.969 -1.379 -10.264 1.00 0.00 H new ATOM 0 HG22 VAL A 111 9.553 -1.435 -9.188 1.00 0.00 H new ATOM 0 HG23 VAL A 111 11.193 -1.525 -8.504 1.00 0.00 H new ATOM 543 N GLY A 112 8.704 -6.000 -7.824 1.00 0.00 N ATOM 544 CA GLY A 112 8.420 -7.416 -7.975 1.00 0.00 C ATOM 545 C GLY A 112 7.769 -8.013 -6.743 1.00 0.00 C ATOM 546 O GLY A 112 7.244 -9.126 -6.789 1.00 0.00 O ATOM 0 H GLY A 112 8.038 -5.489 -7.245 1.00 0.00 H new ATOM 0 HA2 GLY A 112 7.766 -7.562 -8.834 1.00 0.00 H new ATOM 0 HA3 GLY A 112 9.347 -7.949 -8.186 1.00 0.00 H new ATOM 550 N ASP A 113 7.803 -7.274 -5.640 1.00 0.00 N ATOM 551 CA ASP A 113 7.213 -7.738 -4.389 1.00 0.00 C ATOM 552 C ASP A 113 5.799 -7.193 -4.217 1.00 0.00 C ATOM 553 O ASP A 113 5.407 -6.235 -4.884 1.00 0.00 O ATOM 554 CB ASP A 113 8.082 -7.317 -3.205 1.00 0.00 C ATOM 555 CG ASP A 113 8.731 -8.501 -2.515 1.00 0.00 C ATOM 556 OD1 ASP A 113 8.624 -9.627 -3.043 1.00 0.00 O ATOM 557 OD2 ASP A 113 9.346 -8.301 -1.447 1.00 0.00 O ATOM 0 H ASP A 113 8.233 -6.351 -5.586 1.00 0.00 H new ATOM 0 HA ASP A 113 7.160 -8.826 -4.424 1.00 0.00 H new ATOM 0 HB2 ASP A 113 8.856 -6.632 -3.551 1.00 0.00 H new ATOM 0 HB3 ASP A 113 7.472 -6.771 -2.486 1.00 0.00 H new ATOM 562 N THR A 114 5.037 -7.809 -3.319 1.00 0.00 N ATOM 563 CA THR A 114 3.667 -7.385 -3.059 1.00 0.00 C ATOM 564 C THR A 114 3.641 -6.087 -2.259 1.00 0.00 C ATOM 565 O THR A 114 4.683 -5.480 -2.009 1.00 0.00 O ATOM 566 CB THR A 114 2.906 -8.478 -2.308 1.00 0.00 C ATOM 567 OG1 THR A 114 3.636 -9.692 -2.313 1.00 0.00 O ATOM 568 CG2 THR A 114 1.537 -8.762 -2.889 1.00 0.00 C ATOM 0 H THR A 114 5.346 -8.604 -2.759 1.00 0.00 H new ATOM 0 HA THR A 114 3.180 -7.208 -4.018 1.00 0.00 H new ATOM 0 HB THR A 114 2.780 -8.098 -1.294 1.00 0.00 H new ATOM 0 HG1 THR A 114 3.133 -10.378 -1.826 1.00 0.00 H new ATOM 0 HG21 THR A 114 1.051 -9.547 -2.309 1.00 0.00 H new ATOM 0 HG22 THR A 114 0.931 -7.857 -2.853 1.00 0.00 H new ATOM 0 HG23 THR A 114 1.641 -9.087 -3.924 1.00 0.00 H new ATOM 576 N LEU A 115 2.445 -5.666 -1.858 1.00 0.00 N ATOM 577 CA LEU A 115 2.287 -4.437 -1.088 1.00 0.00 C ATOM 578 C LEU A 115 1.116 -4.550 -0.117 1.00 0.00 C ATOM 579 O LEU A 115 1.309 -4.649 1.097 1.00 0.00 O ATOM 580 CB LEU A 115 2.075 -3.248 -2.027 1.00 0.00 C ATOM 581 CG LEU A 115 2.221 -1.872 -1.375 1.00 0.00 C ATOM 582 CD1 LEU A 115 3.613 -1.310 -1.621 1.00 0.00 C ATOM 583 CD2 LEU A 115 1.159 -0.920 -1.903 1.00 0.00 C ATOM 0 H LEU A 115 1.573 -6.157 -2.053 1.00 0.00 H new ATOM 0 HA LEU A 115 3.198 -4.278 -0.511 1.00 0.00 H new ATOM 0 HB2 LEU A 115 2.788 -3.321 -2.848 1.00 0.00 H new ATOM 0 HB3 LEU A 115 1.079 -3.322 -2.463 1.00 0.00 H new ATOM 0 HG LEU A 115 2.081 -1.982 -0.300 1.00 0.00 H new ATOM 0 HD11 LEU A 115 3.699 -0.331 -1.150 1.00 0.00 H new ATOM 0 HD12 LEU A 115 4.358 -1.983 -1.196 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.782 -1.213 -2.693 1.00 0.00 H new ATOM 0 HD21 LEU A 115 1.276 0.055 -1.429 1.00 0.00 H new ATOM 0 HD22 LEU A 115 1.269 -0.815 -2.982 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.169 -1.317 -1.676 1.00 0.00 H new ATOM 595 N CYS A 116 -0.099 -4.532 -0.657 1.00 0.00 N ATOM 596 CA CYS A 116 -1.304 -4.630 0.161 1.00 0.00 C ATOM 597 C CYS A 116 -2.551 -4.726 -0.712 1.00 0.00 C ATOM 598 O CYS A 116 -2.512 -4.415 -1.903 1.00 0.00 O ATOM 599 CB CYS A 116 -1.411 -3.421 1.092 1.00 0.00 C ATOM 600 SG CYS A 116 -1.504 -1.836 0.228 1.00 0.00 S ATOM 0 H CYS A 116 -0.275 -4.450 -1.658 1.00 0.00 H new ATOM 0 HA CYS A 116 -1.233 -5.538 0.760 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -2.296 -3.535 1.718 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -0.548 -3.410 1.758 1.00 0.00 H new ATOM 0 HG CYS A 116 -1.838 -0.902 1.069 1.00 0.00 H new ATOM 606 N ILE A 117 -3.657 -5.162 -0.114 1.00 0.00 N ATOM 607 CA ILE A 117 -4.915 -5.302 -0.840 1.00 0.00 C ATOM 608 C ILE A 117 -5.860 -4.140 -0.543 1.00 0.00 C ATOM 609 O ILE A 117 -5.981 -3.698 0.600 1.00 0.00 O ATOM 610 CB ILE A 117 -5.618 -6.634 -0.495 1.00 0.00 C ATOM 611 CG1 ILE A 117 -4.883 -7.807 -1.142 1.00 0.00 C ATOM 612 CG2 ILE A 117 -7.069 -6.610 -0.950 1.00 0.00 C ATOM 613 CD1 ILE A 117 -4.678 -8.980 -0.208 1.00 0.00 C ATOM 0 H ILE A 117 -3.707 -5.424 0.871 1.00 0.00 H new ATOM 0 HA ILE A 117 -4.669 -5.296 -1.902 1.00 0.00 H new ATOM 0 HB ILE A 117 -5.597 -6.760 0.587 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -5.445 -8.141 -2.014 1.00 0.00 H new ATOM 0 HG13 ILE A 117 -3.912 -7.464 -1.500 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -7.545 -7.557 -0.697 1.00 0.00 H new ATOM 0 HG22 ILE A 117 -7.594 -5.796 -0.450 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -7.110 -6.460 -2.029 1.00 0.00 H new ATOM 0 HD11 ILE A 117 -4.150 -9.776 -0.734 1.00 0.00 H new ATOM 0 HD12 ILE A 117 -4.090 -8.661 0.653 1.00 0.00 H new ATOM 0 HD13 ILE A 117 -5.646 -9.349 0.131 1.00 0.00 H new ATOM 625 N VAL A 118 -6.532 -3.658 -1.584 1.00 0.00 N ATOM 626 CA VAL A 118 -7.476 -2.556 -1.445 1.00 0.00 C ATOM 627 C VAL A 118 -8.840 -3.065 -0.998 1.00 0.00 C ATOM 628 O VAL A 118 -9.631 -2.325 -0.412 1.00 0.00 O ATOM 629 CB VAL A 118 -7.636 -1.786 -2.770 1.00 0.00 C ATOM 630 CG1 VAL A 118 -8.501 -0.551 -2.571 1.00 0.00 C ATOM 631 CG2 VAL A 118 -6.277 -1.410 -3.338 1.00 0.00 C ATOM 0 H VAL A 118 -6.439 -4.015 -2.535 1.00 0.00 H new ATOM 0 HA VAL A 118 -7.074 -1.881 -0.689 1.00 0.00 H new ATOM 0 HB VAL A 118 -8.135 -2.437 -3.488 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -8.602 -0.021 -3.518 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -9.487 -0.851 -2.216 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -8.035 0.105 -1.836 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -6.411 -0.867 -4.274 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -5.747 -0.779 -2.625 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -5.697 -2.314 -3.523 1.00 0.00 H new ATOM 641 N GLU A 119 -9.107 -4.334 -1.280 1.00 0.00 N ATOM 642 CA GLU A 119 -10.372 -4.954 -0.910 1.00 0.00 C ATOM 643 C GLU A 119 -11.532 -3.980 -1.085 1.00 0.00 C ATOM 644 O GLU A 119 -12.315 -3.758 -0.161 1.00 0.00 O ATOM 645 CB GLU A 119 -10.316 -5.448 0.536 1.00 0.00 C ATOM 646 CG GLU A 119 -11.659 -5.915 1.074 1.00 0.00 C ATOM 647 CD GLU A 119 -11.534 -7.116 1.990 1.00 0.00 C ATOM 648 OE1 GLU A 119 -10.745 -8.029 1.667 1.00 0.00 O ATOM 649 OE2 GLU A 119 -12.224 -7.144 3.031 1.00 0.00 O ATOM 0 H GLU A 119 -8.461 -4.956 -1.766 1.00 0.00 H new ATOM 0 HA GLU A 119 -10.538 -5.804 -1.572 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -9.602 -6.269 0.603 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -9.939 -4.646 1.171 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -12.133 -5.097 1.616 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -12.313 -6.166 0.239 1.00 0.00 H new ATOM 656 N ALA A 120 -11.638 -3.402 -2.277 1.00 0.00 N ATOM 657 CA ALA A 120 -12.706 -2.455 -2.573 1.00 0.00 C ATOM 658 C ALA A 120 -14.009 -3.187 -2.867 1.00 0.00 C ATOM 659 O ALA A 120 -14.942 -3.164 -2.064 1.00 0.00 O ATOM 660 CB ALA A 120 -12.315 -1.572 -3.747 1.00 0.00 C ATOM 0 H ALA A 120 -10.998 -3.573 -3.053 1.00 0.00 H new ATOM 0 HA ALA A 120 -12.860 -1.824 -1.698 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -13.121 -0.869 -3.958 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -11.408 -1.020 -3.501 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -12.136 -2.192 -4.625 1.00 0.00 H new ATOM 666 N MET A 121 -14.063 -3.843 -4.021 1.00 0.00 N ATOM 667 CA MET A 121 -15.246 -4.591 -4.422 1.00 0.00 C ATOM 668 C MET A 121 -15.017 -6.088 -4.244 1.00 0.00 C ATOM 669 O MET A 121 -15.515 -6.901 -5.023 1.00 0.00 O ATOM 670 CB MET A 121 -15.601 -4.286 -5.879 1.00 0.00 C ATOM 671 CG MET A 121 -14.453 -4.520 -6.849 1.00 0.00 C ATOM 672 SD MET A 121 -14.847 -4.001 -8.530 1.00 0.00 S ATOM 673 CE MET A 121 -16.611 -4.310 -8.577 1.00 0.00 C ATOM 0 H MET A 121 -13.299 -3.871 -4.696 1.00 0.00 H new ATOM 0 HA MET A 121 -16.077 -4.286 -3.786 1.00 0.00 H new ATOM 0 HB2 MET A 121 -16.447 -4.906 -6.175 1.00 0.00 H new ATOM 0 HB3 MET A 121 -15.924 -3.248 -5.956 1.00 0.00 H new ATOM 0 HG2 MET A 121 -13.573 -3.978 -6.502 1.00 0.00 H new ATOM 0 HG3 MET A 121 -14.194 -5.579 -6.851 1.00 0.00 H new ATOM 0 HE1 MET A 121 -16.965 -4.243 -9.606 1.00 0.00 H new ATOM 0 HE2 MET A 121 -16.816 -5.307 -8.187 1.00 0.00 H new ATOM 0 HE3 MET A 121 -17.127 -3.568 -7.967 1.00 0.00 H new ATOM 683 N LYS A 122 -14.254 -6.442 -3.214 1.00 0.00 N ATOM 684 CA LYS A 122 -13.950 -7.839 -2.932 1.00 0.00 C ATOM 685 C LYS A 122 -13.158 -8.460 -4.078 1.00 0.00 C ATOM 686 O LYS A 122 -13.325 -9.637 -4.396 1.00 0.00 O ATOM 687 CB LYS A 122 -15.237 -8.631 -2.696 1.00 0.00 C ATOM 688 CG LYS A 122 -14.999 -10.042 -2.181 1.00 0.00 C ATOM 689 CD LYS A 122 -13.783 -10.107 -1.271 1.00 0.00 C ATOM 690 CE LYS A 122 -13.437 -11.540 -0.902 1.00 0.00 C ATOM 691 NZ LYS A 122 -12.603 -11.612 0.294 1.00 0.00 N ATOM 0 H LYS A 122 -13.835 -5.779 -2.561 1.00 0.00 H new ATOM 0 HA LYS A 122 -13.343 -7.878 -2.028 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -15.859 -8.092 -1.981 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -15.797 -8.684 -3.629 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -15.880 -10.385 -1.638 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -14.860 -10.719 -3.024 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -12.931 -9.643 -1.767 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -13.975 -9.533 -0.364 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -14.355 -12.104 -0.738 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -12.917 -12.013 -1.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -12.732 -12.537 0.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -11.604 -11.493 0.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -12.878 -10.857 0.955 1.00 0.00 H new ATOM 702 N MET A 123 -12.298 -7.658 -4.695 1.00 0.00 N ATOM 703 CA MET A 123 -11.480 -8.121 -5.810 1.00 0.00 C ATOM 704 C MET A 123 -10.042 -8.382 -5.367 1.00 0.00 C ATOM 705 O MET A 123 -9.212 -8.827 -6.158 1.00 0.00 O ATOM 706 CB MET A 123 -11.497 -7.089 -6.941 1.00 0.00 C ATOM 707 CG MET A 123 -10.455 -5.993 -6.780 1.00 0.00 C ATOM 708 SD MET A 123 -10.969 -4.431 -7.518 1.00 0.00 S ATOM 709 CE MET A 123 -10.323 -3.263 -6.325 1.00 0.00 C ATOM 0 H MET A 123 -12.149 -6.681 -4.441 1.00 0.00 H new ATOM 0 HA MET A 123 -11.902 -9.059 -6.171 1.00 0.00 H new ATOM 0 HB2 MET A 123 -11.332 -7.599 -7.890 1.00 0.00 H new ATOM 0 HB3 MET A 123 -12.486 -6.634 -6.992 1.00 0.00 H new ATOM 0 HG2 MET A 123 -10.255 -5.841 -5.719 1.00 0.00 H new ATOM 0 HG3 MET A 123 -9.520 -6.316 -7.238 1.00 0.00 H new ATOM 0 HE1 MET A 123 -11.065 -2.487 -6.137 1.00 0.00 H new ATOM 0 HE2 MET A 123 -10.096 -3.782 -5.394 1.00 0.00 H new ATOM 0 HE3 MET A 123 -9.414 -2.808 -6.717 1.00 0.00 H new ATOM 719 N MET A 124 -9.754 -8.102 -4.099 1.00 0.00 N ATOM 720 CA MET A 124 -8.418 -8.304 -3.558 1.00 0.00 C ATOM 721 C MET A 124 -7.377 -7.568 -4.393 1.00 0.00 C ATOM 722 O MET A 124 -6.316 -8.110 -4.697 1.00 0.00 O ATOM 723 CB MET A 124 -8.084 -9.797 -3.505 1.00 0.00 C ATOM 724 CG MET A 124 -8.956 -10.582 -2.539 1.00 0.00 C ATOM 725 SD MET A 124 -8.976 -9.866 -0.884 1.00 0.00 S ATOM 726 CE MET A 124 -10.526 -8.971 -0.923 1.00 0.00 C ATOM 0 H MET A 124 -10.429 -7.735 -3.429 1.00 0.00 H new ATOM 0 HA MET A 124 -8.399 -7.900 -2.546 1.00 0.00 H new ATOM 0 HB2 MET A 124 -8.191 -10.220 -4.504 1.00 0.00 H new ATOM 0 HB3 MET A 124 -7.039 -9.917 -3.218 1.00 0.00 H new ATOM 0 HG2 MET A 124 -9.974 -10.623 -2.926 1.00 0.00 H new ATOM 0 HG3 MET A 124 -8.595 -11.609 -2.482 1.00 0.00 H new ATOM 0 HE1 MET A 124 -10.342 -7.916 -0.720 1.00 0.00 H new ATOM 0 HE2 MET A 124 -10.983 -9.077 -1.907 1.00 0.00 H new ATOM 0 HE3 MET A 124 -11.198 -9.374 -0.166 1.00 0.00 H new ATOM 736 N ASN A 125 -7.687 -6.327 -4.758 1.00 0.00 N ATOM 737 CA ASN A 125 -6.774 -5.517 -5.556 1.00 0.00 C ATOM 738 C ASN A 125 -5.455 -5.316 -4.818 1.00 0.00 C ATOM 739 O ASN A 125 -5.190 -4.241 -4.280 1.00 0.00 O ATOM 740 CB ASN A 125 -7.404 -4.162 -5.879 1.00 0.00 C ATOM 741 CG ASN A 125 -6.419 -3.205 -6.522 1.00 0.00 C ATOM 742 OD1 ASN A 125 -5.286 -3.576 -6.829 1.00 0.00 O ATOM 743 ND2 ASN A 125 -6.848 -1.966 -6.730 1.00 0.00 N ATOM 0 H ASN A 125 -8.561 -5.862 -4.514 1.00 0.00 H new ATOM 0 HA ASN A 125 -6.577 -6.044 -6.490 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -8.253 -4.309 -6.547 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -7.793 -3.718 -4.963 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -6.230 -1.278 -7.160 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -7.795 -1.702 -6.460 1.00 0.00 H new ATOM 750 N GLN A 126 -4.638 -6.362 -4.790 1.00 0.00 N ATOM 751 CA GLN A 126 -3.350 -6.310 -4.110 1.00 0.00 C ATOM 752 C GLN A 126 -2.300 -5.616 -4.970 1.00 0.00 C ATOM 753 O GLN A 126 -2.077 -5.988 -6.122 1.00 0.00 O ATOM 754 CB GLN A 126 -2.889 -7.722 -3.750 1.00 0.00 C ATOM 755 CG GLN A 126 -2.563 -8.583 -4.958 1.00 0.00 C ATOM 756 CD GLN A 126 -1.859 -9.873 -4.581 1.00 0.00 C ATOM 757 OE1 GLN A 126 -0.999 -10.362 -5.314 1.00 0.00 O ATOM 758 NE2 GLN A 126 -2.223 -10.431 -3.433 1.00 0.00 N ATOM 0 H GLN A 126 -4.845 -7.258 -5.231 1.00 0.00 H new ATOM 0 HA GLN A 126 -3.473 -5.730 -3.195 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -2.007 -7.656 -3.113 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -3.668 -8.211 -3.165 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -3.484 -8.818 -5.491 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -1.933 -8.017 -5.644 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -2.940 -9.991 -2.857 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -1.785 -11.300 -3.127 1.00 0.00 H new ATOM 767 N ILE A 127 -1.657 -4.603 -4.398 1.00 0.00 N ATOM 768 CA ILE A 127 -0.628 -3.851 -5.104 1.00 0.00 C ATOM 769 C ILE A 127 0.749 -4.467 -4.883 1.00 0.00 C ATOM 770 O ILE A 127 1.052 -4.959 -3.795 1.00 0.00 O ATOM 771 CB ILE A 127 -0.595 -2.380 -4.650 1.00 0.00 C ATOM 772 CG1 ILE A 127 -2.005 -1.786 -4.662 1.00 0.00 C ATOM 773 CG2 ILE A 127 0.335 -1.572 -5.542 1.00 0.00 C ATOM 774 CD1 ILE A 127 -2.674 -1.843 -6.017 1.00 0.00 C ATOM 0 H ILE A 127 -1.832 -4.284 -3.445 1.00 0.00 H new ATOM 0 HA ILE A 127 -0.878 -3.891 -6.164 1.00 0.00 H new ATOM 0 HB ILE A 127 -0.214 -2.339 -3.629 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -2.621 -2.320 -3.939 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -1.956 -0.748 -4.334 1.00 0.00 H new ATOM 0 HG21 ILE A 127 0.348 -0.534 -5.209 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.343 -1.984 -5.485 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -0.018 -1.618 -6.572 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -3.670 -1.405 -5.950 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -2.080 -1.284 -6.740 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -2.756 -2.881 -6.339 1.00 0.00 H new ATOM 786 N GLU A 128 1.579 -4.434 -5.921 1.00 0.00 N ATOM 787 CA GLU A 128 2.926 -4.988 -5.842 1.00 0.00 C ATOM 788 C GLU A 128 3.975 -3.891 -5.990 1.00 0.00 C ATOM 789 O GLU A 128 4.139 -3.317 -7.067 1.00 0.00 O ATOM 790 CB GLU A 128 3.125 -6.051 -6.925 1.00 0.00 C ATOM 791 CG GLU A 128 1.961 -7.019 -7.048 1.00 0.00 C ATOM 792 CD GLU A 128 0.889 -6.523 -8.000 1.00 0.00 C ATOM 793 OE1 GLU A 128 1.041 -5.404 -8.533 1.00 0.00 O ATOM 794 OE2 GLU A 128 -0.102 -7.253 -8.211 1.00 0.00 O ATOM 0 H GLU A 128 1.342 -4.029 -6.827 1.00 0.00 H new ATOM 0 HA GLU A 128 3.047 -5.450 -4.862 1.00 0.00 H new ATOM 0 HB2 GLU A 128 3.278 -5.556 -7.884 1.00 0.00 H new ATOM 0 HB3 GLU A 128 4.033 -6.613 -6.708 1.00 0.00 H new ATOM 0 HG2 GLU A 128 2.331 -7.984 -7.394 1.00 0.00 H new ATOM 0 HG3 GLU A 128 1.521 -7.180 -6.064 1.00 0.00 H new ATOM 801 N ALA A 129 4.680 -3.603 -4.902 1.00 0.00 N ATOM 802 CA ALA A 129 5.713 -2.572 -4.911 1.00 0.00 C ATOM 803 C ALA A 129 6.467 -2.564 -6.235 1.00 0.00 C ATOM 804 O ALA A 129 7.208 -3.497 -6.546 1.00 0.00 O ATOM 805 CB ALA A 129 6.677 -2.781 -3.753 1.00 0.00 C ATOM 0 H ALA A 129 4.556 -4.068 -4.003 1.00 0.00 H new ATOM 0 HA ALA A 129 5.227 -1.603 -4.794 1.00 0.00 H new ATOM 0 HB1 ALA A 129 7.442 -2.005 -3.772 1.00 0.00 H new ATOM 0 HB2 ALA A 129 6.131 -2.729 -2.811 1.00 0.00 H new ATOM 0 HB3 ALA A 129 7.150 -3.759 -3.845 1.00 0.00 H new ATOM 811 N ASP A 130 6.274 -1.505 -7.014 1.00 0.00 N ATOM 812 CA ASP A 130 6.937 -1.374 -8.306 1.00 0.00 C ATOM 813 C ASP A 130 7.647 -0.029 -8.420 1.00 0.00 C ATOM 814 O ASP A 130 7.726 0.552 -9.503 1.00 0.00 O ATOM 815 CB ASP A 130 5.923 -1.526 -9.441 1.00 0.00 C ATOM 816 CG ASP A 130 4.564 -0.962 -9.080 1.00 0.00 C ATOM 817 OD1 ASP A 130 4.506 0.198 -8.619 1.00 0.00 O ATOM 818 OD2 ASP A 130 3.556 -1.679 -9.256 1.00 0.00 O ATOM 0 H ASP A 130 5.663 -0.724 -6.773 1.00 0.00 H new ATOM 0 HA ASP A 130 7.682 -2.166 -8.385 1.00 0.00 H new ATOM 0 HB2 ASP A 130 6.299 -1.020 -10.330 1.00 0.00 H new ATOM 0 HB3 ASP A 130 5.820 -2.581 -9.694 1.00 0.00 H new ATOM 823 N LYS A 131 8.161 0.460 -7.297 1.00 0.00 N ATOM 824 CA LYS A 131 8.864 1.737 -7.270 1.00 0.00 C ATOM 825 C LYS A 131 10.325 1.545 -6.878 1.00 0.00 C ATOM 826 O LYS A 131 11.143 2.453 -7.029 1.00 0.00 O ATOM 827 CB LYS A 131 8.184 2.697 -6.293 1.00 0.00 C ATOM 828 CG LYS A 131 8.269 4.155 -6.714 1.00 0.00 C ATOM 829 CD LYS A 131 7.116 4.539 -7.626 1.00 0.00 C ATOM 830 CE LYS A 131 6.371 5.755 -7.098 1.00 0.00 C ATOM 831 NZ LYS A 131 4.903 5.650 -7.325 1.00 0.00 N ATOM 0 H LYS A 131 8.104 -0.009 -6.393 1.00 0.00 H new ATOM 0 HA LYS A 131 8.828 2.164 -8.272 1.00 0.00 H new ATOM 0 HB2 LYS A 131 7.135 2.417 -6.192 1.00 0.00 H new ATOM 0 HB3 LYS A 131 8.640 2.584 -5.309 1.00 0.00 H new ATOM 0 HG2 LYS A 131 8.262 4.791 -5.829 1.00 0.00 H new ATOM 0 HG3 LYS A 131 9.214 4.332 -7.227 1.00 0.00 H new ATOM 0 HD2 LYS A 131 7.496 4.749 -8.626 1.00 0.00 H new ATOM 0 HD3 LYS A 131 6.427 3.699 -7.717 1.00 0.00 H new ATOM 0 HE2 LYS A 131 6.566 5.865 -6.031 1.00 0.00 H new ATOM 0 HE3 LYS A 131 6.750 6.653 -7.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 4.432 6.499 -6.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 4.714 5.571 -8.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 4.536 4.807 -6.838 1.00 0.00 H new ATOM 845 N SER A 132 10.646 0.359 -6.375 1.00 0.00 N ATOM 846 CA SER A 132 12.009 0.048 -5.960 1.00 0.00 C ATOM 847 C SER A 132 12.506 1.058 -4.930 1.00 0.00 C ATOM 848 O SER A 132 12.743 2.221 -5.252 1.00 0.00 O ATOM 849 CB SER A 132 12.943 0.035 -7.171 1.00 0.00 C ATOM 850 OG SER A 132 13.092 -1.277 -7.687 1.00 0.00 O ATOM 0 H SER A 132 9.981 -0.403 -6.245 1.00 0.00 H new ATOM 0 HA SER A 132 12.007 -0.941 -5.502 1.00 0.00 H new ATOM 0 HB2 SER A 132 12.547 0.691 -7.946 1.00 0.00 H new ATOM 0 HB3 SER A 132 13.918 0.430 -6.886 1.00 0.00 H new ATOM 0 HG SER A 132 13.692 -1.258 -8.461 1.00 0.00 H new ATOM 856 N GLY A 133 12.661 0.603 -3.691 1.00 0.00 N ATOM 857 CA GLY A 133 13.128 1.480 -2.633 1.00 0.00 C ATOM 858 C GLY A 133 12.750 0.977 -1.254 1.00 0.00 C ATOM 859 O GLY A 133 12.196 -0.113 -1.113 1.00 0.00 O ATOM 0 H GLY A 133 12.472 -0.356 -3.401 1.00 0.00 H new ATOM 0 HA2 GLY A 133 14.212 1.576 -2.697 1.00 0.00 H new ATOM 0 HA3 GLY A 133 12.710 2.476 -2.780 1.00 0.00 H new ATOM 863 N THR A 134 13.053 1.772 -0.233 1.00 0.00 N ATOM 864 CA THR A 134 12.743 1.402 1.142 1.00 0.00 C ATOM 865 C THR A 134 11.528 2.171 1.653 1.00 0.00 C ATOM 866 O THR A 134 11.513 3.401 1.647 1.00 0.00 O ATOM 867 CB THR A 134 13.947 1.668 2.047 1.00 0.00 C ATOM 868 OG1 THR A 134 15.120 1.091 1.502 1.00 0.00 O ATOM 869 CG2 THR A 134 13.776 1.123 3.448 1.00 0.00 C ATOM 0 H THR A 134 13.513 2.677 -0.333 1.00 0.00 H new ATOM 0 HA THR A 134 12.510 0.337 1.161 1.00 0.00 H new ATOM 0 HB THR A 134 14.030 2.753 2.105 1.00 0.00 H new ATOM 0 HG1 THR A 134 15.880 1.273 2.094 1.00 0.00 H new ATOM 0 HG21 THR A 134 14.666 1.346 4.036 1.00 0.00 H new ATOM 0 HG22 THR A 134 12.907 1.586 3.915 1.00 0.00 H new ATOM 0 HG23 THR A 134 13.632 0.043 3.403 1.00 0.00 H new ATOM 877 N VAL A 135 10.512 1.436 2.093 1.00 0.00 N ATOM 878 CA VAL A 135 9.293 2.048 2.606 1.00 0.00 C ATOM 879 C VAL A 135 9.581 2.892 3.843 1.00 0.00 C ATOM 880 O VAL A 135 10.101 2.391 4.841 1.00 0.00 O ATOM 881 CB VAL A 135 8.235 0.985 2.959 1.00 0.00 C ATOM 882 CG1 VAL A 135 7.022 1.633 3.607 1.00 0.00 C ATOM 883 CG2 VAL A 135 7.832 0.201 1.719 1.00 0.00 C ATOM 0 H VAL A 135 10.509 0.416 2.104 1.00 0.00 H new ATOM 0 HA VAL A 135 8.903 2.688 1.814 1.00 0.00 H new ATOM 0 HB VAL A 135 8.671 0.289 3.675 1.00 0.00 H new ATOM 0 HG11 VAL A 135 6.286 0.866 3.849 1.00 0.00 H new ATOM 0 HG12 VAL A 135 7.327 2.144 4.520 1.00 0.00 H new ATOM 0 HG13 VAL A 135 6.582 2.353 2.917 1.00 0.00 H new ATOM 0 HG21 VAL A 135 7.084 -0.545 1.987 1.00 0.00 H new ATOM 0 HG22 VAL A 135 7.415 0.882 0.977 1.00 0.00 H new ATOM 0 HG23 VAL A 135 8.708 -0.297 1.303 1.00 0.00 H new ATOM 893 N LYS A 136 9.239 4.174 3.772 1.00 0.00 N ATOM 894 CA LYS A 136 9.460 5.087 4.887 1.00 0.00 C ATOM 895 C LYS A 136 8.354 4.953 5.929 1.00 0.00 C ATOM 896 O LYS A 136 8.624 4.744 7.111 1.00 0.00 O ATOM 897 CB LYS A 136 9.530 6.530 4.385 1.00 0.00 C ATOM 898 CG LYS A 136 10.110 7.500 5.401 1.00 0.00 C ATOM 899 CD LYS A 136 11.577 7.212 5.673 1.00 0.00 C ATOM 900 CE LYS A 136 11.803 6.794 7.116 1.00 0.00 C ATOM 901 NZ LYS A 136 12.417 5.441 7.214 1.00 0.00 N ATOM 0 H LYS A 136 8.808 4.604 2.954 1.00 0.00 H new ATOM 0 HA LYS A 136 10.409 4.825 5.355 1.00 0.00 H new ATOM 0 HB2 LYS A 136 10.135 6.562 3.479 1.00 0.00 H new ATOM 0 HB3 LYS A 136 8.528 6.860 4.111 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.001 8.521 5.034 1.00 0.00 H new ATOM 0 HG3 LYS A 136 9.547 7.433 6.332 1.00 0.00 H new ATOM 0 HD2 LYS A 136 11.924 6.423 5.006 1.00 0.00 H new ATOM 0 HD3 LYS A 136 12.170 8.100 5.453 1.00 0.00 H new ATOM 0 HE2 LYS A 136 12.449 7.522 7.608 1.00 0.00 H new ATOM 0 HE3 LYS A 136 10.852 6.800 7.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 12.875 5.334 8.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 11.679 4.716 7.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 13.127 5.327 6.462 1.00 0.00 H new ATOM 915 N ALA A 137 7.109 5.074 5.481 1.00 0.00 N ATOM 916 CA ALA A 137 5.962 4.968 6.376 1.00 0.00 C ATOM 917 C ALA A 137 4.653 5.155 5.617 1.00 0.00 C ATOM 918 O ALA A 137 4.615 5.805 4.573 1.00 0.00 O ATOM 919 CB ALA A 137 6.074 5.985 7.501 1.00 0.00 C ATOM 0 H ALA A 137 6.868 5.245 4.505 1.00 0.00 H new ATOM 0 HA ALA A 137 5.960 3.967 6.807 1.00 0.00 H new ATOM 0 HB1 ALA A 137 5.211 5.894 8.161 1.00 0.00 H new ATOM 0 HB2 ALA A 137 6.986 5.801 8.069 1.00 0.00 H new ATOM 0 HB3 ALA A 137 6.105 6.990 7.081 1.00 0.00 H new ATOM 925 N ILE A 138 3.579 4.583 6.152 1.00 0.00 N ATOM 926 CA ILE A 138 2.265 4.687 5.528 1.00 0.00 C ATOM 927 C ILE A 138 1.407 5.733 6.231 1.00 0.00 C ATOM 928 O ILE A 138 1.500 5.914 7.445 1.00 0.00 O ATOM 929 CB ILE A 138 1.523 3.335 5.549 1.00 0.00 C ATOM 930 CG1 ILE A 138 2.199 2.339 4.607 1.00 0.00 C ATOM 931 CG2 ILE A 138 0.062 3.523 5.167 1.00 0.00 C ATOM 932 CD1 ILE A 138 1.368 1.101 4.340 1.00 0.00 C ATOM 0 H ILE A 138 3.593 4.042 7.017 1.00 0.00 H new ATOM 0 HA ILE A 138 2.429 4.987 4.493 1.00 0.00 H new ATOM 0 HB ILE A 138 1.565 2.934 6.562 1.00 0.00 H new ATOM 0 HG12 ILE A 138 2.413 2.834 3.660 1.00 0.00 H new ATOM 0 HG13 ILE A 138 3.156 2.039 5.034 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -0.446 2.559 5.187 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -0.415 4.200 5.876 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -0.000 3.945 4.164 1.00 0.00 H new ATOM 0 HD11 ILE A 138 1.909 0.439 3.664 1.00 0.00 H new ATOM 0 HD12 ILE A 138 1.175 0.583 5.279 1.00 0.00 H new ATOM 0 HD13 ILE A 138 0.421 1.390 3.884 1.00 0.00 H new ATOM 944 N LEU A 139 0.567 6.416 5.460 1.00 0.00 N ATOM 945 CA LEU A 139 -0.315 7.439 6.009 1.00 0.00 C ATOM 946 C LEU A 139 -1.757 6.949 6.028 1.00 0.00 C ATOM 947 O LEU A 139 -2.479 7.141 7.006 1.00 0.00 O ATOM 948 CB LEU A 139 -0.221 8.725 5.188 1.00 0.00 C ATOM 949 CG LEU A 139 0.951 9.641 5.546 1.00 0.00 C ATOM 950 CD1 LEU A 139 2.268 9.011 5.121 1.00 0.00 C ATOM 951 CD2 LEU A 139 0.776 11.006 4.898 1.00 0.00 C ATOM 0 H LEU A 139 0.479 6.279 4.453 1.00 0.00 H new ATOM 0 HA LEU A 139 0.003 7.645 7.031 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -0.145 8.459 4.134 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -1.149 9.284 5.310 1.00 0.00 H new ATOM 0 HG LEU A 139 0.968 9.774 6.628 1.00 0.00 H new ATOM 0 HD11 LEU A 139 3.091 9.676 5.383 1.00 0.00 H new ATOM 0 HD12 LEU A 139 2.396 8.056 5.631 1.00 0.00 H new ATOM 0 HD13 LEU A 139 2.262 8.848 4.043 1.00 0.00 H new ATOM 0 HD21 LEU A 139 1.618 11.645 5.163 1.00 0.00 H new ATOM 0 HD22 LEU A 139 0.734 10.892 3.815 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -0.150 11.461 5.251 1.00 0.00 H new ATOM 963 N VAL A 140 -2.167 6.315 4.935 1.00 0.00 N ATOM 964 CA VAL A 140 -3.521 5.797 4.816 1.00 0.00 C ATOM 965 C VAL A 140 -3.946 5.066 6.084 1.00 0.00 C ATOM 966 O VAL A 140 -3.295 4.115 6.518 1.00 0.00 O ATOM 967 CB VAL A 140 -3.653 4.841 3.617 1.00 0.00 C ATOM 968 CG1 VAL A 140 -4.984 4.106 3.659 1.00 0.00 C ATOM 969 CG2 VAL A 140 -3.499 5.604 2.310 1.00 0.00 C ATOM 0 H VAL A 140 -1.579 6.148 4.119 1.00 0.00 H new ATOM 0 HA VAL A 140 -4.174 6.656 4.661 1.00 0.00 H new ATOM 0 HB VAL A 140 -2.856 4.100 3.678 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.057 3.436 2.803 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -5.051 3.527 4.580 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -5.800 4.828 3.625 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -3.595 4.913 1.472 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -4.274 6.368 2.241 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -2.518 6.078 2.279 1.00 0.00 H new ATOM 979 N GLU A 141 -5.052 5.513 6.667 1.00 0.00 N ATOM 980 CA GLU A 141 -5.585 4.907 7.877 1.00 0.00 C ATOM 981 C GLU A 141 -6.063 3.495 7.579 1.00 0.00 C ATOM 982 O GLU A 141 -7.248 3.184 7.704 1.00 0.00 O ATOM 983 CB GLU A 141 -6.734 5.747 8.436 1.00 0.00 C ATOM 984 CG GLU A 141 -6.358 7.196 8.696 1.00 0.00 C ATOM 985 CD GLU A 141 -6.542 8.077 7.475 1.00 0.00 C ATOM 986 OE1 GLU A 141 -5.889 7.806 6.445 1.00 0.00 O ATOM 987 OE2 GLU A 141 -7.338 9.036 7.549 1.00 0.00 O ATOM 0 H GLU A 141 -5.599 6.299 6.317 1.00 0.00 H new ATOM 0 HA GLU A 141 -4.794 4.865 8.626 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -7.569 5.717 7.736 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -7.082 5.298 9.366 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -6.966 7.584 9.514 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -5.319 7.245 9.021 1.00 0.00 H new ATOM 994 N SER A 142 -5.124 2.652 7.173 1.00 0.00 N ATOM 995 CA SER A 142 -5.413 1.269 6.836 1.00 0.00 C ATOM 996 C SER A 142 -6.567 0.718 7.672 1.00 0.00 C ATOM 997 O SER A 142 -6.811 1.178 8.788 1.00 0.00 O ATOM 998 CB SER A 142 -4.160 0.429 7.045 1.00 0.00 C ATOM 999 OG SER A 142 -4.339 -0.514 8.088 1.00 0.00 O ATOM 0 H SER A 142 -4.142 2.909 7.069 1.00 0.00 H new ATOM 0 HA SER A 142 -5.717 1.223 5.790 1.00 0.00 H new ATOM 0 HB2 SER A 142 -3.910 -0.092 6.120 1.00 0.00 H new ATOM 0 HB3 SER A 142 -3.318 1.080 7.281 1.00 0.00 H new ATOM 0 HG SER A 142 -3.922 -1.364 7.835 1.00 0.00 H new ATOM 1005 N GLY A 143 -7.281 -0.265 7.124 1.00 0.00 N ATOM 1006 CA GLY A 143 -8.402 -0.848 7.835 1.00 0.00 C ATOM 1007 C GLY A 143 -9.701 -0.130 7.536 1.00 0.00 C ATOM 1008 O GLY A 143 -10.782 -0.625 7.855 1.00 0.00 O ATOM 0 H GLY A 143 -7.102 -0.665 6.203 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -8.498 -1.899 7.561 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -8.208 -0.814 8.907 1.00 0.00 H new ATOM 1012 N GLN A 144 -9.592 1.043 6.919 1.00 0.00 N ATOM 1013 CA GLN A 144 -10.766 1.836 6.573 1.00 0.00 C ATOM 1014 C GLN A 144 -10.959 1.890 5.060 1.00 0.00 C ATOM 1015 O GLN A 144 -10.017 1.680 4.293 1.00 0.00 O ATOM 1016 CB GLN A 144 -10.636 3.255 7.139 1.00 0.00 C ATOM 1017 CG GLN A 144 -9.998 4.248 6.176 1.00 0.00 C ATOM 1018 CD GLN A 144 -9.797 5.623 6.788 1.00 0.00 C ATOM 1019 OE1 GLN A 144 -8.961 6.400 6.328 1.00 0.00 O ATOM 1020 NE2 GLN A 144 -10.564 5.933 7.828 1.00 0.00 N ATOM 0 H GLN A 144 -8.703 1.465 6.649 1.00 0.00 H new ATOM 0 HA GLN A 144 -11.641 1.358 7.014 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -11.626 3.617 7.416 1.00 0.00 H new ATOM 0 HB3 GLN A 144 -10.043 3.218 8.053 1.00 0.00 H new ATOM 0 HG2 GLN A 144 -9.035 3.859 5.847 1.00 0.00 H new ATOM 0 HG3 GLN A 144 -10.625 4.339 5.289 1.00 0.00 H new ATOM 0 HE21 GLN A 144 -11.245 5.259 8.178 1.00 0.00 H new ATOM 0 HE22 GLN A 144 -10.472 6.845 8.276 1.00 0.00 H new ATOM 1029 N PRO A 145 -12.190 2.177 4.614 1.00 0.00 N ATOM 1030 CA PRO A 145 -12.517 2.264 3.190 1.00 0.00 C ATOM 1031 C PRO A 145 -12.015 3.559 2.559 1.00 0.00 C ATOM 1032 O PRO A 145 -12.607 4.621 2.750 1.00 0.00 O ATOM 1033 CB PRO A 145 -14.043 2.220 3.182 1.00 0.00 C ATOM 1034 CG PRO A 145 -14.443 2.814 4.488 1.00 0.00 C ATOM 1035 CD PRO A 145 -13.363 2.438 5.470 1.00 0.00 C ATOM 0 HA PRO A 145 -12.049 1.468 2.610 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -14.452 2.788 2.346 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -14.410 1.198 3.082 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -14.538 3.897 4.410 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -15.412 2.431 4.809 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -13.170 3.242 6.180 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -13.639 1.558 6.051 1.00 0.00 H new ATOM 1043 N VAL A 146 -10.925 3.464 1.805 1.00 0.00 N ATOM 1044 CA VAL A 146 -10.351 4.631 1.146 1.00 0.00 C ATOM 1045 C VAL A 146 -9.245 4.234 0.176 1.00 0.00 C ATOM 1046 O VAL A 146 -8.637 3.172 0.310 1.00 0.00 O ATOM 1047 CB VAL A 146 -9.781 5.635 2.164 1.00 0.00 C ATOM 1048 CG1 VAL A 146 -8.693 4.984 3.005 1.00 0.00 C ATOM 1049 CG2 VAL A 146 -9.248 6.868 1.449 1.00 0.00 C ATOM 0 H VAL A 146 -10.422 2.593 1.635 1.00 0.00 H new ATOM 0 HA VAL A 146 -11.164 5.104 0.594 1.00 0.00 H new ATOM 0 HB VAL A 146 -10.584 5.947 2.832 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -8.302 5.709 3.719 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -9.110 4.133 3.544 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -7.887 4.643 2.356 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -8.848 7.569 2.182 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -8.457 6.575 0.758 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -10.056 7.345 0.894 1.00 0.00 H new ATOM 1059 N GLU A 147 -8.996 5.094 -0.805 1.00 0.00 N ATOM 1060 CA GLU A 147 -7.966 4.838 -1.807 1.00 0.00 C ATOM 1061 C GLU A 147 -8.008 5.882 -2.923 1.00 0.00 C ATOM 1062 O GLU A 147 -7.675 5.588 -4.071 1.00 0.00 O ATOM 1063 CB GLU A 147 -8.136 3.437 -2.398 1.00 0.00 C ATOM 1064 CG GLU A 147 -6.940 2.528 -2.165 1.00 0.00 C ATOM 1065 CD GLU A 147 -6.489 1.822 -3.429 1.00 0.00 C ATOM 1066 OE1 GLU A 147 -7.334 1.609 -4.324 1.00 0.00 O ATOM 1067 OE2 GLU A 147 -5.291 1.483 -3.524 1.00 0.00 O ATOM 0 H GLU A 147 -9.494 5.976 -0.929 1.00 0.00 H new ATOM 0 HA GLU A 147 -6.996 4.904 -1.313 1.00 0.00 H new ATOM 0 HB2 GLU A 147 -9.023 2.974 -1.965 1.00 0.00 H new ATOM 0 HB3 GLU A 147 -8.313 3.523 -3.470 1.00 0.00 H new ATOM 0 HG2 GLU A 147 -6.113 3.116 -1.767 1.00 0.00 H new ATOM 0 HG3 GLU A 147 -7.195 1.785 -1.409 1.00 0.00 H new ATOM 1074 N PHE A 148 -8.414 7.103 -2.582 1.00 0.00 N ATOM 1075 CA PHE A 148 -8.492 8.185 -3.557 1.00 0.00 C ATOM 1076 C PHE A 148 -7.518 9.302 -3.201 1.00 0.00 C ATOM 1077 O PHE A 148 -7.885 10.268 -2.532 1.00 0.00 O ATOM 1078 CB PHE A 148 -9.916 8.736 -3.628 1.00 0.00 C ATOM 1079 CG PHE A 148 -10.001 10.121 -4.208 1.00 0.00 C ATOM 1080 CD1 PHE A 148 -9.485 10.393 -5.470 1.00 0.00 C ATOM 1081 CD2 PHE A 148 -10.596 11.153 -3.490 1.00 0.00 C ATOM 1082 CE1 PHE A 148 -9.562 11.669 -6.007 1.00 0.00 C ATOM 1083 CE2 PHE A 148 -10.676 12.431 -4.022 1.00 0.00 C ATOM 1084 CZ PHE A 148 -10.158 12.689 -5.281 1.00 0.00 C ATOM 0 H PHE A 148 -8.694 7.367 -1.637 1.00 0.00 H new ATOM 0 HA PHE A 148 -8.219 7.784 -4.533 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -10.527 8.062 -4.229 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -10.343 8.745 -2.625 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -9.019 9.602 -6.038 1.00 0.00 H new ATOM 0 HD2 PHE A 148 -11.000 10.957 -2.508 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -9.159 11.868 -6.989 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -11.141 13.224 -3.456 1.00 0.00 H new ATOM 0 HZ PHE A 148 -10.218 13.684 -5.697 1.00 0.00 H new ATOM 1094 N ASP A 149 -6.275 9.160 -3.646 1.00 0.00 N ATOM 1095 CA ASP A 149 -5.249 10.158 -3.367 1.00 0.00 C ATOM 1096 C ASP A 149 -4.744 10.024 -1.935 1.00 0.00 C ATOM 1097 O ASP A 149 -4.357 11.011 -1.308 1.00 0.00 O ATOM 1098 CB ASP A 149 -5.799 11.566 -3.597 1.00 0.00 C ATOM 1099 CG ASP A 149 -4.753 12.510 -4.160 1.00 0.00 C ATOM 1100 OD1 ASP A 149 -3.720 12.717 -3.491 1.00 0.00 O ATOM 1101 OD2 ASP A 149 -4.968 13.038 -5.270 1.00 0.00 O ATOM 0 H ASP A 149 -5.954 8.366 -4.200 1.00 0.00 H new ATOM 0 HA ASP A 149 -4.415 9.989 -4.048 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -6.645 11.515 -4.282 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -6.175 11.965 -2.655 1.00 0.00 H new ATOM 1106 N GLU A 150 -4.748 8.797 -1.425 1.00 0.00 N ATOM 1107 CA GLU A 150 -4.289 8.533 -0.068 1.00 0.00 C ATOM 1108 C GLU A 150 -2.965 7.779 -0.091 1.00 0.00 C ATOM 1109 O GLU A 150 -2.915 6.601 -0.443 1.00 0.00 O ATOM 1110 CB GLU A 150 -5.338 7.728 0.701 1.00 0.00 C ATOM 1111 CG GLU A 150 -5.456 8.123 2.165 1.00 0.00 C ATOM 1112 CD GLU A 150 -6.540 9.155 2.403 1.00 0.00 C ATOM 1113 OE1 GLU A 150 -6.989 9.783 1.421 1.00 0.00 O ATOM 1114 OE2 GLU A 150 -6.941 9.336 3.573 1.00 0.00 O ATOM 0 H GLU A 150 -5.064 7.970 -1.932 1.00 0.00 H new ATOM 0 HA GLU A 150 -4.139 9.487 0.437 1.00 0.00 H new ATOM 0 HB2 GLU A 150 -6.307 7.857 0.219 1.00 0.00 H new ATOM 0 HB3 GLU A 150 -5.089 6.669 0.638 1.00 0.00 H new ATOM 0 HG2 GLU A 150 -5.667 7.235 2.761 1.00 0.00 H new ATOM 0 HG3 GLU A 150 -4.500 8.519 2.509 1.00 0.00 H new ATOM 1121 N PRO A 151 -1.871 8.457 0.282 1.00 0.00 N ATOM 1122 CA PRO A 151 -0.539 7.857 0.299 1.00 0.00 C ATOM 1123 C PRO A 151 -0.533 6.465 0.922 1.00 0.00 C ATOM 1124 O PRO A 151 -0.416 6.318 2.139 1.00 0.00 O ATOM 1125 CB PRO A 151 0.269 8.834 1.150 1.00 0.00 C ATOM 1126 CG PRO A 151 -0.385 10.154 0.925 1.00 0.00 C ATOM 1127 CD PRO A 151 -1.850 9.868 0.710 1.00 0.00 C ATOM 0 HA PRO A 151 -0.141 7.712 -0.705 1.00 0.00 H new ATOM 0 HB2 PRO A 151 0.247 8.555 2.203 1.00 0.00 H new ATOM 0 HB3 PRO A 151 1.316 8.853 0.847 1.00 0.00 H new ATOM 0 HG2 PRO A 151 -0.239 10.812 1.782 1.00 0.00 H new ATOM 0 HG3 PRO A 151 0.044 10.658 0.059 1.00 0.00 H new ATOM 0 HD2 PRO A 151 -2.426 10.018 1.623 1.00 0.00 H new ATOM 0 HD3 PRO A 151 -2.279 10.523 -0.048 1.00 0.00 H new ATOM 1135 N LEU A 152 -0.658 5.448 0.076 1.00 0.00 N ATOM 1136 CA LEU A 152 -0.668 4.064 0.535 1.00 0.00 C ATOM 1137 C LEU A 152 0.640 3.718 1.238 1.00 0.00 C ATOM 1138 O LEU A 152 0.639 3.212 2.361 1.00 0.00 O ATOM 1139 CB LEU A 152 -0.892 3.117 -0.644 1.00 0.00 C ATOM 1140 CG LEU A 152 -2.299 3.147 -1.240 1.00 0.00 C ATOM 1141 CD1 LEU A 152 -2.613 1.832 -1.939 1.00 0.00 C ATOM 1142 CD2 LEU A 152 -3.326 3.436 -0.157 1.00 0.00 C ATOM 0 H LEU A 152 -0.754 5.557 -0.934 1.00 0.00 H new ATOM 0 HA LEU A 152 -1.486 3.947 1.246 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -0.176 3.363 -1.429 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -0.673 2.100 -0.320 1.00 0.00 H new ATOM 0 HG LEU A 152 -2.344 3.946 -1.981 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -3.619 1.873 -2.357 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -1.894 1.665 -2.741 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -2.552 1.014 -1.221 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -4.323 3.454 -0.597 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -3.280 2.658 0.605 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -3.112 4.403 0.298 1.00 0.00 H new ATOM 1154 N VAL A 153 1.754 3.993 0.569 1.00 0.00 N ATOM 1155 CA VAL A 153 3.070 3.711 1.128 1.00 0.00 C ATOM 1156 C VAL A 153 4.134 4.602 0.495 1.00 0.00 C ATOM 1157 O VAL A 153 4.359 4.555 -0.714 1.00 0.00 O ATOM 1158 CB VAL A 153 3.463 2.236 0.923 1.00 0.00 C ATOM 1159 CG1 VAL A 153 4.539 1.825 1.917 1.00 0.00 C ATOM 1160 CG2 VAL A 153 2.242 1.337 1.046 1.00 0.00 C ATOM 0 H VAL A 153 1.772 4.411 -0.361 1.00 0.00 H new ATOM 0 HA VAL A 153 3.013 3.918 2.197 1.00 0.00 H new ATOM 0 HB VAL A 153 3.869 2.124 -0.082 1.00 0.00 H new ATOM 0 HG11 VAL A 153 4.803 0.780 1.756 1.00 0.00 H new ATOM 0 HG12 VAL A 153 5.422 2.448 1.776 1.00 0.00 H new ATOM 0 HG13 VAL A 153 4.164 1.952 2.933 1.00 0.00 H new ATOM 0 HG21 VAL A 153 2.538 0.299 0.898 1.00 0.00 H new ATOM 0 HG22 VAL A 153 1.804 1.452 2.038 1.00 0.00 H new ATOM 0 HG23 VAL A 153 1.507 1.616 0.290 1.00 0.00 H new ATOM 1170 N VAL A 154 4.784 5.415 1.321 1.00 0.00 N ATOM 1171 CA VAL A 154 5.821 6.319 0.843 1.00 0.00 C ATOM 1172 C VAL A 154 7.207 5.702 1.005 1.00 0.00 C ATOM 1173 O VAL A 154 7.610 5.336 2.109 1.00 0.00 O ATOM 1174 CB VAL A 154 5.778 7.667 1.586 1.00 0.00 C ATOM 1175 CG1 VAL A 154 4.350 8.181 1.677 1.00 0.00 C ATOM 1176 CG2 VAL A 154 6.393 7.536 2.971 1.00 0.00 C ATOM 0 H VAL A 154 4.610 5.466 2.325 1.00 0.00 H new ATOM 0 HA VAL A 154 5.627 6.492 -0.216 1.00 0.00 H new ATOM 0 HB VAL A 154 6.366 8.390 1.020 1.00 0.00 H new ATOM 0 HG11 VAL A 154 4.339 9.134 2.205 1.00 0.00 H new ATOM 0 HG12 VAL A 154 3.948 8.318 0.673 1.00 0.00 H new ATOM 0 HG13 VAL A 154 3.737 7.460 2.218 1.00 0.00 H new ATOM 0 HG21 VAL A 154 6.353 8.499 3.480 1.00 0.00 H new ATOM 0 HG22 VAL A 154 5.836 6.798 3.548 1.00 0.00 H new ATOM 0 HG23 VAL A 154 7.431 7.217 2.879 1.00 0.00 H new ATOM 1186 N ILE A 155 7.932 5.591 -0.104 1.00 0.00 N ATOM 1187 CA ILE A 155 9.273 5.019 -0.086 1.00 0.00 C ATOM 1188 C ILE A 155 10.334 6.111 -0.014 1.00 0.00 C ATOM 1189 O ILE A 155 10.219 7.146 -0.672 1.00 0.00 O ATOM 1190 CB ILE A 155 9.532 4.152 -1.333 1.00 0.00 C ATOM 1191 CG1 ILE A 155 8.233 3.500 -1.807 1.00 0.00 C ATOM 1192 CG2 ILE A 155 10.584 3.095 -1.035 1.00 0.00 C ATOM 1193 CD1 ILE A 155 7.696 4.085 -3.095 1.00 0.00 C ATOM 0 H ILE A 155 7.613 5.890 -1.026 1.00 0.00 H new ATOM 0 HA ILE A 155 9.337 4.392 0.803 1.00 0.00 H new ATOM 0 HB ILE A 155 9.906 4.793 -2.131 1.00 0.00 H new ATOM 0 HG12 ILE A 155 8.402 2.432 -1.945 1.00 0.00 H new ATOM 0 HG13 ILE A 155 7.478 3.605 -1.028 1.00 0.00 H new ATOM 0 HG21 ILE A 155 10.755 2.491 -1.926 1.00 0.00 H new ATOM 0 HG22 ILE A 155 11.515 3.581 -0.741 1.00 0.00 H new ATOM 0 HG23 ILE A 155 10.237 2.455 -0.224 1.00 0.00 H new ATOM 0 HD11 ILE A 155 6.773 3.574 -3.370 1.00 0.00 H new ATOM 0 HD12 ILE A 155 7.495 5.147 -2.956 1.00 0.00 H new ATOM 0 HD13 ILE A 155 8.433 3.956 -3.888 1.00 0.00 H new ATOM 1205 N GLU A 156 11.367 5.875 0.786 1.00 0.00 N ATOM 1206 CA GLU A 156 12.450 6.840 0.942 1.00 0.00 C ATOM 1207 C GLU A 156 13.675 6.416 0.139 1.00 0.00 C ATOM 1208 O GLU A 156 13.779 5.215 -0.190 1.00 0.00 O ATOM 1209 CB GLU A 156 12.818 6.991 2.419 1.00 0.00 C ATOM 1210 CG GLU A 156 12.717 8.419 2.927 1.00 0.00 C ATOM 1211 CD GLU A 156 13.993 8.891 3.597 1.00 0.00 C ATOM 1212 OE1 GLU A 156 15.034 8.222 3.430 1.00 0.00 O ATOM 1213 OE2 GLU A 156 13.952 9.930 4.290 1.00 0.00 O ATOM 1214 OXT GLU A 156 14.521 7.286 -0.152 1.00 0.00 O ATOM 0 H GLU A 156 11.478 5.024 1.337 1.00 0.00 H new ATOM 0 HA GLU A 156 12.105 7.802 0.562 1.00 0.00 H new ATOM 0 HB2 GLU A 156 12.164 6.355 3.015 1.00 0.00 H new ATOM 0 HB3 GLU A 156 13.836 6.631 2.570 1.00 0.00 H new ATOM 0 HG2 GLU A 156 12.482 9.081 2.094 1.00 0.00 H new ATOM 0 HG3 GLU A 156 11.891 8.491 3.635 1.00 0.00 H new