USER MOD reduce.3.24.130724 H: found=0, std=0, add=571, rem=0, adj=16 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 132 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 134 THR OG1 : rot 180:sc= -1.1 USER MOD Set 2.1: A 122 LYS NZ :NH3+ -155:sc= -0.0857 (180deg=0) USER MOD Set 2.2: A 124 MET CE :methyl -113:sc= -2.54 (180deg=-5.2!) USER MOD Set 3.1: A 123 MET CE :methyl -140:sc= -9.33! (180deg=-13.1!) USER MOD Set 3.2: A 125 ASN : amide:sc= -1.61 K(o=-11,f=-11) USER MOD Single : A 81 HIS : no HE2:sc= -7.94! C(o=-7.9!,f=-8!) USER MOD Single : A 85 SER OG : rot -104:sc= -1.37! USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc=-1.52e-05 USER MOD Single : A 92 TYR OH : rot 180:sc= -0.0147 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 170:sc= -0.148 (180deg=-0.589) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 108 LYS NZ :NH3+ -149:sc= -6.5! (180deg=-8.46!) USER MOD Single : A 110 ASN : amide:sc= -0.354 K(o=-0.35,f=-3.6!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.147 USER MOD Single : A 116 CYS SG : rot -142:sc= -2.83! USER MOD Single : A 121 MET CE :methyl -175:sc= 0 (180deg=-0.0351) USER MOD Single : A 126 GLN : amide:sc= -0.332 X(o=-0.33,f=-0.032) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot -160:sc= -3.16! USER MOD Single : A 144 GLN : amide:sc= -2.43! C(o=-2.4!,f=-4.4!) USER MOD ----------------------------------------------------------------- ATOM 46 N GLY A 80 12.169 9.093 -3.511 1.00 0.00 N ATOM 47 CA GLY A 80 11.213 8.023 -3.727 1.00 0.00 C ATOM 48 C GLY A 80 9.913 8.519 -4.328 1.00 0.00 C ATOM 49 O GLY A 80 9.919 9.327 -5.257 1.00 0.00 O ATOM 0 HA2 GLY A 80 11.653 7.275 -4.387 1.00 0.00 H new ATOM 0 HA3 GLY A 80 11.006 7.528 -2.778 1.00 0.00 H new ATOM 53 N HIS A 81 8.794 8.035 -3.797 1.00 0.00 N ATOM 54 CA HIS A 81 7.481 8.435 -4.288 1.00 0.00 C ATOM 55 C HIS A 81 6.380 7.958 -3.345 1.00 0.00 C ATOM 56 O HIS A 81 6.576 7.021 -2.570 1.00 0.00 O ATOM 57 CB HIS A 81 7.245 7.875 -5.691 1.00 0.00 C ATOM 58 CG HIS A 81 7.104 6.385 -5.728 1.00 0.00 C ATOM 59 ND1 HIS A 81 5.929 5.731 -5.418 1.00 0.00 N ATOM 60 CD2 HIS A 81 7.998 5.418 -6.042 1.00 0.00 C ATOM 61 CE1 HIS A 81 6.108 4.428 -5.540 1.00 0.00 C ATOM 62 NE2 HIS A 81 7.354 4.212 -5.919 1.00 0.00 N ATOM 0 H HIS A 81 8.771 7.366 -3.027 1.00 0.00 H new ATOM 0 HA HIS A 81 7.453 9.524 -4.330 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.344 8.327 -6.106 1.00 0.00 H new ATOM 0 HB3 HIS A 81 8.074 8.169 -6.334 1.00 0.00 H new ATOM 0 HD1 HIS A 81 5.058 6.183 -5.138 1.00 0.00 H new ATOM 0 HD2 HIS A 81 9.027 5.568 -6.335 1.00 0.00 H new ATOM 0 HE1 HIS A 81 5.362 3.668 -5.360 1.00 0.00 H new ATOM 71 N ILE A 82 5.224 8.609 -3.416 1.00 0.00 N ATOM 72 CA ILE A 82 4.093 8.252 -2.570 1.00 0.00 C ATOM 73 C ILE A 82 3.036 7.486 -3.359 1.00 0.00 C ATOM 74 O ILE A 82 2.468 8.005 -4.320 1.00 0.00 O ATOM 75 CB ILE A 82 3.444 9.499 -1.941 1.00 0.00 C ATOM 76 CG1 ILE A 82 4.406 10.157 -0.951 1.00 0.00 C ATOM 77 CG2 ILE A 82 2.139 9.128 -1.252 1.00 0.00 C ATOM 78 CD1 ILE A 82 5.780 10.421 -1.527 1.00 0.00 C ATOM 0 H ILE A 82 5.046 9.387 -4.051 1.00 0.00 H new ATOM 0 HA ILE A 82 4.482 7.615 -1.776 1.00 0.00 H new ATOM 0 HB ILE A 82 3.223 10.213 -2.734 1.00 0.00 H new ATOM 0 HG12 ILE A 82 3.976 11.099 -0.611 1.00 0.00 H new ATOM 0 HG13 ILE A 82 4.505 9.517 -0.074 1.00 0.00 H new ATOM 0 HG21 ILE A 82 1.693 10.020 -0.813 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.451 8.700 -1.981 1.00 0.00 H new ATOM 0 HG23 ILE A 82 2.337 8.397 -0.468 1.00 0.00 H new ATOM 0 HD11 ILE A 82 6.409 10.889 -0.769 1.00 0.00 H new ATOM 0 HD12 ILE A 82 6.230 9.479 -1.841 1.00 0.00 H new ATOM 0 HD13 ILE A 82 5.693 11.086 -2.386 1.00 0.00 H new ATOM 90 N VAL A 83 2.778 6.250 -2.946 1.00 0.00 N ATOM 91 CA VAL A 83 1.789 5.411 -3.614 1.00 0.00 C ATOM 92 C VAL A 83 0.378 5.749 -3.148 1.00 0.00 C ATOM 93 O VAL A 83 -0.107 5.204 -2.158 1.00 0.00 O ATOM 94 CB VAL A 83 2.057 3.916 -3.359 1.00 0.00 C ATOM 95 CG1 VAL A 83 1.025 3.060 -4.075 1.00 0.00 C ATOM 96 CG2 VAL A 83 3.466 3.543 -3.796 1.00 0.00 C ATOM 0 H VAL A 83 3.240 5.807 -2.152 1.00 0.00 H new ATOM 0 HA VAL A 83 1.874 5.611 -4.682 1.00 0.00 H new ATOM 0 HB VAL A 83 1.972 3.728 -2.289 1.00 0.00 H new ATOM 0 HG11 VAL A 83 1.230 2.007 -3.884 1.00 0.00 H new ATOM 0 HG12 VAL A 83 0.029 3.308 -3.709 1.00 0.00 H new ATOM 0 HG13 VAL A 83 1.075 3.250 -5.147 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.637 2.483 -3.608 1.00 0.00 H new ATOM 0 HG22 VAL A 83 3.583 3.746 -4.861 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.190 4.132 -3.233 1.00 0.00 H new ATOM 106 N ARG A 84 -0.277 6.654 -3.869 1.00 0.00 N ATOM 107 CA ARG A 84 -1.634 7.065 -3.529 1.00 0.00 C ATOM 108 C ARG A 84 -2.661 6.150 -4.188 1.00 0.00 C ATOM 109 O ARG A 84 -2.462 5.682 -5.308 1.00 0.00 O ATOM 110 CB ARG A 84 -1.874 8.513 -3.961 1.00 0.00 C ATOM 111 CG ARG A 84 -2.085 8.676 -5.457 1.00 0.00 C ATOM 112 CD ARG A 84 -1.445 9.954 -5.974 1.00 0.00 C ATOM 113 NE ARG A 84 -0.774 9.751 -7.255 1.00 0.00 N ATOM 114 CZ ARG A 84 -0.137 10.713 -7.913 1.00 0.00 C ATOM 115 NH1 ARG A 84 -0.085 11.940 -7.411 1.00 0.00 N ATOM 116 NH2 ARG A 84 0.449 10.450 -9.073 1.00 0.00 N ATOM 0 H ARG A 84 0.110 7.116 -4.692 1.00 0.00 H new ATOM 0 HA ARG A 84 -1.749 6.991 -2.448 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -2.747 8.900 -3.435 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -1.022 9.120 -3.655 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -1.662 7.819 -5.981 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -3.153 8.688 -5.676 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -2.209 10.724 -6.083 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -0.725 10.321 -5.242 1.00 0.00 H new ATOM 0 HE ARG A 84 -0.796 8.818 -7.667 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -0.535 12.145 -6.519 1.00 0.00 H new ATOM 0 HH12 ARG A 84 0.405 12.678 -7.917 1.00 0.00 H new ATOM 0 HH21 ARG A 84 0.411 9.508 -9.461 1.00 0.00 H new ATOM 0 HH22 ARG A 84 0.938 11.190 -9.577 1.00 0.00 H new ATOM 130 N SER A 85 -3.760 5.898 -3.483 1.00 0.00 N ATOM 131 CA SER A 85 -4.818 5.039 -3.999 1.00 0.00 C ATOM 132 C SER A 85 -5.549 5.711 -5.157 1.00 0.00 C ATOM 133 O SER A 85 -5.809 6.914 -5.127 1.00 0.00 O ATOM 134 CB SER A 85 -5.810 4.692 -2.888 1.00 0.00 C ATOM 135 OG SER A 85 -6.756 3.731 -3.329 1.00 0.00 O ATOM 0 H SER A 85 -3.940 6.277 -2.553 1.00 0.00 H new ATOM 0 HA SER A 85 -4.359 4.121 -4.366 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.271 4.306 -2.023 1.00 0.00 H new ATOM 0 HB3 SER A 85 -6.328 5.595 -2.564 1.00 0.00 H new ATOM 0 HG SER A 85 -7.615 4.171 -3.499 1.00 0.00 H new ATOM 141 N PRO A 86 -5.891 4.935 -6.196 1.00 0.00 N ATOM 142 CA PRO A 86 -6.598 5.452 -7.373 1.00 0.00 C ATOM 143 C PRO A 86 -8.001 5.943 -7.035 1.00 0.00 C ATOM 144 O PRO A 86 -8.338 7.103 -7.276 1.00 0.00 O ATOM 145 CB PRO A 86 -6.665 4.243 -8.312 1.00 0.00 C ATOM 146 CG PRO A 86 -6.511 3.056 -7.424 1.00 0.00 C ATOM 147 CD PRO A 86 -5.616 3.493 -6.300 1.00 0.00 C ATOM 0 HA PRO A 86 -6.091 6.314 -7.806 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -7.613 4.213 -8.850 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -5.874 4.281 -9.061 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -7.478 2.723 -7.046 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -6.075 2.217 -7.966 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -5.849 2.970 -5.372 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -4.567 3.298 -6.521 1.00 0.00 H new ATOM 155 N MET A 87 -8.814 5.055 -6.474 1.00 0.00 N ATOM 156 CA MET A 87 -10.181 5.398 -6.101 1.00 0.00 C ATOM 157 C MET A 87 -10.493 4.919 -4.687 1.00 0.00 C ATOM 158 O MET A 87 -9.629 4.371 -4.003 1.00 0.00 O ATOM 159 CB MET A 87 -11.172 4.783 -7.091 1.00 0.00 C ATOM 160 CG MET A 87 -10.848 3.344 -7.462 1.00 0.00 C ATOM 161 SD MET A 87 -11.837 2.744 -8.844 1.00 0.00 S ATOM 162 CE MET A 87 -11.538 0.981 -8.733 1.00 0.00 C ATOM 0 H MET A 87 -8.550 4.092 -6.267 1.00 0.00 H new ATOM 0 HA MET A 87 -10.278 6.483 -6.129 1.00 0.00 H new ATOM 0 HB2 MET A 87 -12.173 4.822 -6.662 1.00 0.00 H new ATOM 0 HB3 MET A 87 -11.190 5.388 -7.998 1.00 0.00 H new ATOM 0 HG2 MET A 87 -9.791 3.268 -7.717 1.00 0.00 H new ATOM 0 HG3 MET A 87 -11.014 2.703 -6.596 1.00 0.00 H new ATOM 0 HE1 MET A 87 -12.084 0.469 -9.525 1.00 0.00 H new ATOM 0 HE2 MET A 87 -10.471 0.785 -8.843 1.00 0.00 H new ATOM 0 HE3 MET A 87 -11.876 0.615 -7.764 1.00 0.00 H new ATOM 172 N VAL A 88 -11.732 5.129 -4.255 1.00 0.00 N ATOM 173 CA VAL A 88 -12.154 4.716 -2.922 1.00 0.00 C ATOM 174 C VAL A 88 -11.994 3.212 -2.736 1.00 0.00 C ATOM 175 O VAL A 88 -11.877 2.465 -3.709 1.00 0.00 O ATOM 176 CB VAL A 88 -13.619 5.102 -2.650 1.00 0.00 C ATOM 177 CG1 VAL A 88 -14.110 4.457 -1.362 1.00 0.00 C ATOM 178 CG2 VAL A 88 -13.771 6.614 -2.589 1.00 0.00 C ATOM 0 H VAL A 88 -12.460 5.582 -4.808 1.00 0.00 H new ATOM 0 HA VAL A 88 -11.512 5.238 -2.213 1.00 0.00 H new ATOM 0 HB VAL A 88 -14.232 4.732 -3.472 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -15.147 4.741 -1.185 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -14.040 3.373 -1.448 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -13.495 4.795 -0.528 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -14.813 6.867 -2.396 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -13.147 7.010 -1.788 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -13.462 7.049 -3.539 1.00 0.00 H new ATOM 188 N GLY A 89 -11.988 2.772 -1.482 1.00 0.00 N ATOM 189 CA GLY A 89 -11.842 1.359 -1.191 1.00 0.00 C ATOM 190 C GLY A 89 -11.573 1.096 0.277 1.00 0.00 C ATOM 191 O GLY A 89 -11.989 1.869 1.139 1.00 0.00 O ATOM 0 H GLY A 89 -12.082 3.370 -0.661 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -12.749 0.833 -1.491 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -11.025 0.951 -1.786 1.00 0.00 H new ATOM 195 N THR A 90 -10.876 0.001 0.562 1.00 0.00 N ATOM 196 CA THR A 90 -10.552 -0.361 1.936 1.00 0.00 C ATOM 197 C THR A 90 -9.123 -0.885 2.039 1.00 0.00 C ATOM 198 O THR A 90 -8.826 -1.997 1.600 1.00 0.00 O ATOM 199 CB THR A 90 -11.533 -1.414 2.453 1.00 0.00 C ATOM 200 OG1 THR A 90 -12.796 -1.274 1.827 1.00 0.00 O ATOM 201 CG2 THR A 90 -11.752 -1.342 3.949 1.00 0.00 C ATOM 0 H THR A 90 -10.525 -0.650 -0.140 1.00 0.00 H new ATOM 0 HA THR A 90 -10.635 0.535 2.550 1.00 0.00 H new ATOM 0 HB THR A 90 -11.079 -2.375 2.213 1.00 0.00 H new ATOM 0 HG1 THR A 90 -13.409 -1.958 2.170 1.00 0.00 H new ATOM 0 HG21 THR A 90 -12.458 -2.115 4.251 1.00 0.00 H new ATOM 0 HG22 THR A 90 -10.803 -1.496 4.463 1.00 0.00 H new ATOM 0 HG23 THR A 90 -12.152 -0.363 4.211 1.00 0.00 H new ATOM 209 N PHE A 91 -8.243 -0.078 2.621 1.00 0.00 N ATOM 210 CA PHE A 91 -6.844 -0.460 2.783 1.00 0.00 C ATOM 211 C PHE A 91 -6.651 -1.283 4.052 1.00 0.00 C ATOM 212 O PHE A 91 -7.553 -1.376 4.883 1.00 0.00 O ATOM 213 CB PHE A 91 -5.958 0.785 2.830 1.00 0.00 C ATOM 214 CG PHE A 91 -4.492 0.474 2.937 1.00 0.00 C ATOM 215 CD1 PHE A 91 -3.783 0.018 1.831 1.00 0.00 C ATOM 216 CD2 PHE A 91 -3.823 0.633 4.145 1.00 0.00 C ATOM 217 CE1 PHE A 91 -2.432 -0.272 1.929 1.00 0.00 C ATOM 218 CE2 PHE A 91 -2.471 0.344 4.248 1.00 0.00 C ATOM 219 CZ PHE A 91 -1.775 -0.109 3.138 1.00 0.00 C ATOM 0 H PHE A 91 -8.473 0.845 2.989 1.00 0.00 H new ATOM 0 HA PHE A 91 -6.556 -1.071 1.927 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -6.131 1.378 1.932 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -6.254 1.400 3.680 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -4.291 -0.111 0.887 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -4.362 0.985 5.012 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -1.891 -0.625 1.063 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -1.961 0.472 5.191 1.00 0.00 H new ATOM 0 HZ PHE A 91 -0.722 -0.335 3.216 1.00 0.00 H new ATOM 229 N TYR A 92 -5.471 -1.880 4.197 1.00 0.00 N ATOM 230 CA TYR A 92 -5.166 -2.695 5.368 1.00 0.00 C ATOM 231 C TYR A 92 -3.661 -2.778 5.603 1.00 0.00 C ATOM 232 O TYR A 92 -2.878 -2.097 4.940 1.00 0.00 O ATOM 233 CB TYR A 92 -5.724 -4.106 5.200 1.00 0.00 C ATOM 234 CG TYR A 92 -7.226 -4.167 5.047 1.00 0.00 C ATOM 235 CD1 TYR A 92 -8.070 -3.621 6.013 1.00 0.00 C ATOM 236 CD2 TYR A 92 -7.802 -4.782 3.938 1.00 0.00 C ATOM 237 CE1 TYR A 92 -9.447 -3.685 5.876 1.00 0.00 C ATOM 238 CE2 TYR A 92 -9.178 -4.850 3.793 1.00 0.00 C ATOM 239 CZ TYR A 92 -9.996 -4.301 4.765 1.00 0.00 C ATOM 240 OH TYR A 92 -11.364 -4.368 4.626 1.00 0.00 O ATOM 0 H TYR A 92 -4.712 -1.815 3.519 1.00 0.00 H new ATOM 0 HA TYR A 92 -5.634 -2.218 6.229 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -5.263 -4.565 4.325 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -5.434 -4.704 6.064 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -7.644 -3.141 6.881 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -7.166 -5.213 3.179 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -10.088 -3.257 6.632 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -9.610 -5.329 2.927 1.00 0.00 H new ATOM 0 HH TYR A 92 -11.586 -4.831 3.791 1.00 0.00 H new ATOM 250 N ARG A 93 -3.267 -3.627 6.544 1.00 0.00 N ATOM 251 CA ARG A 93 -1.858 -3.819 6.867 1.00 0.00 C ATOM 252 C ARG A 93 -1.445 -5.266 6.612 1.00 0.00 C ATOM 253 O ARG A 93 -0.294 -5.546 6.274 1.00 0.00 O ATOM 254 CB ARG A 93 -1.591 -3.446 8.326 1.00 0.00 C ATOM 255 CG ARG A 93 -1.314 -1.967 8.534 1.00 0.00 C ATOM 256 CD ARG A 93 0.030 -1.564 7.948 1.00 0.00 C ATOM 257 NE ARG A 93 1.064 -1.458 8.974 1.00 0.00 N ATOM 258 CZ ARG A 93 1.018 -0.589 9.979 1.00 0.00 C ATOM 259 NH1 ARG A 93 -0.007 0.244 10.089 1.00 0.00 N ATOM 260 NH2 ARG A 93 1.997 -0.553 10.872 1.00 0.00 N ATOM 0 H ARG A 93 -3.906 -4.196 7.099 1.00 0.00 H new ATOM 0 HA ARG A 93 -1.266 -3.168 6.224 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -2.452 -3.734 8.929 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -0.740 -4.021 8.690 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -2.106 -1.379 8.070 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -1.331 -1.739 9.600 1.00 0.00 H new ATOM 0 HD2 ARG A 93 0.334 -2.297 7.201 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -0.070 -0.608 7.434 1.00 0.00 H new ATOM 0 HE ARG A 93 1.866 -2.086 8.916 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -0.761 0.218 9.402 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -0.042 0.911 10.860 1.00 0.00 H new ATOM 0 HH21 ARG A 93 2.787 -1.193 10.789 1.00 0.00 H new ATOM 0 HH22 ARG A 93 1.960 0.114 11.642 1.00 0.00 H new ATOM 274 N THR A 94 -2.399 -6.180 6.773 1.00 0.00 N ATOM 275 CA THR A 94 -2.148 -7.600 6.557 1.00 0.00 C ATOM 276 C THR A 94 -3.366 -8.266 5.923 1.00 0.00 C ATOM 277 O THR A 94 -4.503 -7.990 6.303 1.00 0.00 O ATOM 278 CB THR A 94 -1.808 -8.288 7.880 1.00 0.00 C ATOM 279 OG1 THR A 94 -2.978 -8.786 8.503 1.00 0.00 O ATOM 280 CG2 THR A 94 -1.114 -7.377 8.869 1.00 0.00 C ATOM 0 H THR A 94 -3.355 -5.960 7.053 1.00 0.00 H new ATOM 0 HA THR A 94 -1.300 -7.699 5.879 1.00 0.00 H new ATOM 0 HB THR A 94 -1.127 -9.097 7.616 1.00 0.00 H new ATOM 0 HG1 THR A 94 -2.738 -9.224 9.347 1.00 0.00 H new ATOM 0 HG21 THR A 94 -0.902 -7.929 9.785 1.00 0.00 H new ATOM 0 HG22 THR A 94 -0.180 -7.016 8.438 1.00 0.00 H new ATOM 0 HG23 THR A 94 -1.760 -6.529 9.097 1.00 0.00 H new ATOM 288 N PRO A 95 -3.140 -9.149 4.941 1.00 0.00 N ATOM 289 CA PRO A 95 -4.219 -9.852 4.249 1.00 0.00 C ATOM 290 C PRO A 95 -4.778 -11.010 5.067 1.00 0.00 C ATOM 291 O PRO A 95 -4.907 -12.129 4.572 1.00 0.00 O ATOM 292 CB PRO A 95 -3.540 -10.366 2.984 1.00 0.00 C ATOM 293 CG PRO A 95 -2.115 -10.567 3.376 1.00 0.00 C ATOM 294 CD PRO A 95 -1.812 -9.528 4.427 1.00 0.00 C ATOM 0 HA PRO A 95 -5.076 -9.206 4.060 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -3.992 -11.297 2.642 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -3.629 -9.650 2.167 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -1.958 -11.572 3.767 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -1.456 -10.453 2.516 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -1.178 -9.931 5.217 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -1.288 -8.671 4.003 1.00 0.00 H new ATOM 349 N LYS A 100 1.184 -11.866 8.568 1.00 0.00 N ATOM 350 CA LYS A 100 2.443 -11.207 8.894 1.00 0.00 C ATOM 351 C LYS A 100 2.556 -9.864 8.178 1.00 0.00 C ATOM 352 O LYS A 100 3.650 -9.324 8.019 1.00 0.00 O ATOM 353 CB LYS A 100 3.624 -12.101 8.510 1.00 0.00 C ATOM 354 CG LYS A 100 3.615 -12.529 7.053 1.00 0.00 C ATOM 355 CD LYS A 100 4.863 -13.320 6.696 1.00 0.00 C ATOM 356 CE LYS A 100 4.740 -13.971 5.329 1.00 0.00 C ATOM 357 NZ LYS A 100 3.777 -13.247 4.452 1.00 0.00 N ATOM 0 HA LYS A 100 2.463 -11.029 9.969 1.00 0.00 H new ATOM 0 HB2 LYS A 100 4.553 -11.570 8.718 1.00 0.00 H new ATOM 0 HB3 LYS A 100 3.616 -12.990 9.141 1.00 0.00 H new ATOM 0 HG2 LYS A 100 2.731 -13.135 6.856 1.00 0.00 H new ATOM 0 HG3 LYS A 100 3.546 -11.648 6.415 1.00 0.00 H new ATOM 0 HD2 LYS A 100 5.729 -12.659 6.708 1.00 0.00 H new ATOM 0 HD3 LYS A 100 5.037 -14.087 7.451 1.00 0.00 H new ATOM 0 HE2 LYS A 100 5.719 -13.996 4.850 1.00 0.00 H new ATOM 0 HE3 LYS A 100 4.416 -15.005 5.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 3.846 -13.615 3.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 2.810 -13.388 4.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 4.002 -12.232 4.454 1.00 0.00 H new ATOM 371 N ALA A 101 1.416 -9.331 7.750 1.00 0.00 N ATOM 372 CA ALA A 101 1.385 -8.051 7.053 1.00 0.00 C ATOM 373 C ALA A 101 2.249 -8.087 5.799 1.00 0.00 C ATOM 374 O ALA A 101 3.384 -8.566 5.828 1.00 0.00 O ATOM 375 CB ALA A 101 1.843 -6.937 7.981 1.00 0.00 C ATOM 0 H ALA A 101 0.502 -9.766 7.874 1.00 0.00 H new ATOM 0 HA ALA A 101 0.357 -7.856 6.747 1.00 0.00 H new ATOM 0 HB1 ALA A 101 1.816 -5.986 7.449 1.00 0.00 H new ATOM 0 HB2 ALA A 101 1.181 -6.888 8.846 1.00 0.00 H new ATOM 0 HB3 ALA A 101 2.861 -7.137 8.315 1.00 0.00 H new ATOM 381 N PHE A 102 1.709 -7.577 4.696 1.00 0.00 N ATOM 382 CA PHE A 102 2.436 -7.553 3.432 1.00 0.00 C ATOM 383 C PHE A 102 3.841 -6.992 3.629 1.00 0.00 C ATOM 384 O PHE A 102 4.764 -7.723 3.990 1.00 0.00 O ATOM 385 CB PHE A 102 1.677 -6.722 2.396 1.00 0.00 C ATOM 386 CG PHE A 102 0.588 -7.485 1.699 1.00 0.00 C ATOM 387 CD1 PHE A 102 0.881 -8.298 0.609 1.00 0.00 C ATOM 388 CD2 PHE A 102 -0.729 -7.393 2.131 1.00 0.00 C ATOM 389 CE1 PHE A 102 -0.122 -9.005 -0.036 1.00 0.00 C ATOM 390 CE2 PHE A 102 -1.736 -8.097 1.490 1.00 0.00 C ATOM 391 CZ PHE A 102 -1.432 -8.904 0.405 1.00 0.00 C ATOM 0 H PHE A 102 0.772 -7.176 4.652 1.00 0.00 H new ATOM 0 HA PHE A 102 2.520 -8.577 3.067 1.00 0.00 H new ATOM 0 HB2 PHE A 102 1.243 -5.851 2.887 1.00 0.00 H new ATOM 0 HB3 PHE A 102 2.382 -6.350 1.653 1.00 0.00 H new ATOM 0 HD1 PHE A 102 1.900 -8.379 0.262 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -0.971 -6.766 2.976 1.00 0.00 H new ATOM 0 HE1 PHE A 102 0.117 -9.634 -0.881 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -2.756 -8.017 1.835 1.00 0.00 H new ATOM 0 HZ PHE A 102 -2.215 -9.454 -0.096 1.00 0.00 H new ATOM 401 N ILE A 103 4.001 -5.692 3.398 1.00 0.00 N ATOM 402 CA ILE A 103 5.297 -5.046 3.560 1.00 0.00 C ATOM 403 C ILE A 103 5.213 -3.899 4.562 1.00 0.00 C ATOM 404 O ILE A 103 5.159 -2.730 4.182 1.00 0.00 O ATOM 405 CB ILE A 103 5.836 -4.512 2.219 1.00 0.00 C ATOM 406 CG1 ILE A 103 6.202 -5.674 1.294 1.00 0.00 C ATOM 407 CG2 ILE A 103 7.043 -3.616 2.452 1.00 0.00 C ATOM 408 CD1 ILE A 103 5.000 -6.401 0.731 1.00 0.00 C ATOM 0 H ILE A 103 3.251 -5.068 3.099 1.00 0.00 H new ATOM 0 HA ILE A 103 5.985 -5.804 3.935 1.00 0.00 H new ATOM 0 HB ILE A 103 5.055 -3.921 1.740 1.00 0.00 H new ATOM 0 HG12 ILE A 103 6.806 -5.295 0.470 1.00 0.00 H new ATOM 0 HG13 ILE A 103 6.821 -6.383 1.843 1.00 0.00 H new ATOM 0 HG21 ILE A 103 7.412 -3.247 1.495 1.00 0.00 H new ATOM 0 HG22 ILE A 103 6.754 -2.773 3.079 1.00 0.00 H new ATOM 0 HG23 ILE A 103 7.829 -4.186 2.949 1.00 0.00 H new ATOM 0 HD11 ILE A 103 5.335 -7.212 0.084 1.00 0.00 H new ATOM 0 HD12 ILE A 103 4.407 -6.810 1.549 1.00 0.00 H new ATOM 0 HD13 ILE A 103 4.391 -5.705 0.154 1.00 0.00 H new ATOM 420 N GLU A 104 5.200 -4.246 5.845 1.00 0.00 N ATOM 421 CA GLU A 104 5.120 -3.251 6.909 1.00 0.00 C ATOM 422 C GLU A 104 6.149 -2.143 6.707 1.00 0.00 C ATOM 423 O GLU A 104 7.169 -2.339 6.045 1.00 0.00 O ATOM 424 CB GLU A 104 5.328 -3.913 8.271 1.00 0.00 C ATOM 425 CG GLU A 104 4.089 -3.894 9.151 1.00 0.00 C ATOM 426 CD GLU A 104 4.232 -4.771 10.381 1.00 0.00 C ATOM 427 OE1 GLU A 104 4.372 -6.001 10.220 1.00 0.00 O ATOM 428 OE2 GLU A 104 4.205 -4.225 11.504 1.00 0.00 O ATOM 0 H GLU A 104 5.244 -5.211 6.174 1.00 0.00 H new ATOM 0 HA GLU A 104 4.126 -2.805 6.875 1.00 0.00 H new ATOM 0 HB2 GLU A 104 5.640 -4.946 8.120 1.00 0.00 H new ATOM 0 HB3 GLU A 104 6.141 -3.407 8.791 1.00 0.00 H new ATOM 0 HG2 GLU A 104 3.885 -2.869 9.462 1.00 0.00 H new ATOM 0 HG3 GLU A 104 3.230 -4.228 8.569 1.00 0.00 H new ATOM 435 N VAL A 105 5.872 -0.977 7.281 1.00 0.00 N ATOM 436 CA VAL A 105 6.769 0.166 7.166 1.00 0.00 C ATOM 437 C VAL A 105 8.131 -0.137 7.777 1.00 0.00 C ATOM 438 O VAL A 105 8.253 -0.989 8.658 1.00 0.00 O ATOM 439 CB VAL A 105 6.180 1.413 7.850 1.00 0.00 C ATOM 440 CG1 VAL A 105 7.133 2.591 7.727 1.00 0.00 C ATOM 441 CG2 VAL A 105 4.819 1.753 7.261 1.00 0.00 C ATOM 0 H VAL A 105 5.032 -0.799 7.831 1.00 0.00 H new ATOM 0 HA VAL A 105 6.889 0.365 6.101 1.00 0.00 H new ATOM 0 HB VAL A 105 6.046 1.194 8.909 1.00 0.00 H new ATOM 0 HG11 VAL A 105 6.699 3.463 8.217 1.00 0.00 H new ATOM 0 HG12 VAL A 105 8.082 2.343 8.203 1.00 0.00 H new ATOM 0 HG13 VAL A 105 7.303 2.813 6.673 1.00 0.00 H new ATOM 0 HG21 VAL A 105 4.418 2.637 7.757 1.00 0.00 H new ATOM 0 HG22 VAL A 105 4.923 1.951 6.194 1.00 0.00 H new ATOM 0 HG23 VAL A 105 4.139 0.914 7.409 1.00 0.00 H new ATOM 451 N GLY A 106 9.155 0.567 7.304 1.00 0.00 N ATOM 452 CA GLY A 106 10.496 0.360 7.814 1.00 0.00 C ATOM 453 C GLY A 106 11.229 -0.749 7.086 1.00 0.00 C ATOM 454 O GLY A 106 12.451 -0.702 6.940 1.00 0.00 O ATOM 0 H GLY A 106 9.079 1.277 6.576 1.00 0.00 H new ATOM 0 HA2 GLY A 106 11.063 1.287 7.723 1.00 0.00 H new ATOM 0 HA3 GLY A 106 10.444 0.121 8.876 1.00 0.00 H new ATOM 458 N GLN A 107 10.482 -1.749 6.628 1.00 0.00 N ATOM 459 CA GLN A 107 11.071 -2.871 5.911 1.00 0.00 C ATOM 460 C GLN A 107 10.793 -2.766 4.413 1.00 0.00 C ATOM 461 O GLN A 107 9.928 -1.996 3.987 1.00 0.00 O ATOM 462 CB GLN A 107 10.525 -4.193 6.451 1.00 0.00 C ATOM 463 CG GLN A 107 10.834 -5.388 5.564 1.00 0.00 C ATOM 464 CD GLN A 107 10.320 -6.692 6.142 1.00 0.00 C ATOM 465 OE1 GLN A 107 10.457 -6.951 7.337 1.00 0.00 O ATOM 466 NE2 GLN A 107 9.726 -7.521 5.292 1.00 0.00 N ATOM 0 H GLN A 107 9.470 -1.804 6.741 1.00 0.00 H new ATOM 0 HA GLN A 107 12.150 -2.842 6.066 1.00 0.00 H new ATOM 0 HB2 GLN A 107 10.941 -4.370 7.443 1.00 0.00 H new ATOM 0 HB3 GLN A 107 9.445 -4.109 6.569 1.00 0.00 H new ATOM 0 HG2 GLN A 107 10.390 -5.231 4.581 1.00 0.00 H new ATOM 0 HG3 GLN A 107 11.912 -5.459 5.419 1.00 0.00 H new ATOM 0 HE21 GLN A 107 9.635 -7.264 4.309 1.00 0.00 H new ATOM 0 HE22 GLN A 107 9.361 -8.414 5.622 1.00 0.00 H new ATOM 475 N LYS A 108 11.528 -3.547 3.623 1.00 0.00 N ATOM 476 CA LYS A 108 11.362 -3.544 2.173 1.00 0.00 C ATOM 477 C LYS A 108 12.624 -4.046 1.477 1.00 0.00 C ATOM 478 O LYS A 108 13.546 -4.543 2.124 1.00 0.00 O ATOM 479 CB LYS A 108 11.032 -2.138 1.677 1.00 0.00 C ATOM 480 CG LYS A 108 9.598 -1.978 1.200 1.00 0.00 C ATOM 481 CD LYS A 108 9.312 -2.858 -0.004 1.00 0.00 C ATOM 482 CE LYS A 108 8.085 -2.380 -0.765 1.00 0.00 C ATOM 483 NZ LYS A 108 7.001 -3.401 -0.772 1.00 0.00 N ATOM 0 H LYS A 108 12.244 -4.189 3.964 1.00 0.00 H new ATOM 0 HA LYS A 108 10.538 -4.215 1.931 1.00 0.00 H new ATOM 0 HB2 LYS A 108 11.220 -1.426 2.481 1.00 0.00 H new ATOM 0 HB3 LYS A 108 11.708 -1.883 0.861 1.00 0.00 H new ATOM 0 HG2 LYS A 108 8.913 -2.233 2.009 1.00 0.00 H new ATOM 0 HG3 LYS A 108 9.413 -0.935 0.942 1.00 0.00 H new ATOM 0 HD2 LYS A 108 10.176 -2.859 -0.669 1.00 0.00 H new ATOM 0 HD3 LYS A 108 9.160 -3.887 0.324 1.00 0.00 H new ATOM 0 HE2 LYS A 108 7.714 -1.460 -0.313 1.00 0.00 H new ATOM 0 HE3 LYS A 108 8.365 -2.141 -1.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 6.452 -3.318 -1.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 7.419 -4.351 -0.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 6.374 -3.247 0.044 1.00 0.00 H new ATOM 497 N VAL A 109 12.657 -3.910 0.153 1.00 0.00 N ATOM 498 CA VAL A 109 13.804 -4.349 -0.634 1.00 0.00 C ATOM 499 C VAL A 109 13.856 -3.635 -1.989 1.00 0.00 C ATOM 500 O VAL A 109 14.335 -2.504 -2.084 1.00 0.00 O ATOM 501 CB VAL A 109 13.776 -5.873 -0.846 1.00 0.00 C ATOM 502 CG1 VAL A 109 14.962 -6.321 -1.686 1.00 0.00 C ATOM 503 CG2 VAL A 109 13.757 -6.589 0.493 1.00 0.00 C ATOM 0 H VAL A 109 11.902 -3.499 -0.396 1.00 0.00 H new ATOM 0 HA VAL A 109 14.701 -4.089 -0.072 1.00 0.00 H new ATOM 0 HB VAL A 109 12.866 -6.133 -1.387 1.00 0.00 H new ATOM 0 HG11 VAL A 109 14.923 -7.402 -1.824 1.00 0.00 H new ATOM 0 HG12 VAL A 109 14.925 -5.830 -2.658 1.00 0.00 H new ATOM 0 HG13 VAL A 109 15.889 -6.053 -1.179 1.00 0.00 H new ATOM 0 HG21 VAL A 109 13.737 -7.666 0.329 1.00 0.00 H new ATOM 0 HG22 VAL A 109 14.650 -6.324 1.060 1.00 0.00 H new ATOM 0 HG23 VAL A 109 12.870 -6.291 1.053 1.00 0.00 H new ATOM 513 N ASN A 110 13.360 -4.292 -3.036 1.00 0.00 N ATOM 514 CA ASN A 110 13.359 -3.704 -4.372 1.00 0.00 C ATOM 515 C ASN A 110 12.186 -4.225 -5.196 1.00 0.00 C ATOM 516 O ASN A 110 11.439 -5.095 -4.749 1.00 0.00 O ATOM 517 CB ASN A 110 14.677 -4.011 -5.087 1.00 0.00 C ATOM 518 CG ASN A 110 14.782 -5.466 -5.502 1.00 0.00 C ATOM 519 OD1 ASN A 110 14.067 -6.325 -4.987 1.00 0.00 O ATOM 520 ND2 ASN A 110 15.680 -5.750 -6.439 1.00 0.00 N ATOM 0 H ASN A 110 12.956 -5.227 -2.985 1.00 0.00 H new ATOM 0 HA ASN A 110 13.253 -2.624 -4.267 1.00 0.00 H new ATOM 0 HB2 ASN A 110 14.765 -3.377 -5.969 1.00 0.00 H new ATOM 0 HB3 ASN A 110 15.511 -3.762 -4.430 1.00 0.00 H new ATOM 0 HD21 ASN A 110 15.797 -6.712 -6.758 1.00 0.00 H new ATOM 0 HD22 ASN A 110 16.252 -5.006 -6.839 1.00 0.00 H new ATOM 527 N VAL A 111 12.032 -3.686 -6.401 1.00 0.00 N ATOM 528 CA VAL A 111 10.950 -4.095 -7.289 1.00 0.00 C ATOM 529 C VAL A 111 10.734 -5.603 -7.232 1.00 0.00 C ATOM 530 O VAL A 111 11.678 -6.382 -7.372 1.00 0.00 O ATOM 531 CB VAL A 111 11.235 -3.686 -8.746 1.00 0.00 C ATOM 532 CG1 VAL A 111 10.160 -4.229 -9.675 1.00 0.00 C ATOM 533 CG2 VAL A 111 11.338 -2.173 -8.866 1.00 0.00 C ATOM 0 H VAL A 111 12.643 -2.965 -6.785 1.00 0.00 H new ATOM 0 HA VAL A 111 10.049 -3.587 -6.945 1.00 0.00 H new ATOM 0 HB VAL A 111 12.191 -4.117 -9.043 1.00 0.00 H new ATOM 0 HG11 VAL A 111 10.379 -3.929 -10.700 1.00 0.00 H new ATOM 0 HG12 VAL A 111 10.140 -5.317 -9.612 1.00 0.00 H new ATOM 0 HG13 VAL A 111 9.189 -3.830 -9.380 1.00 0.00 H new ATOM 0 HG21 VAL A 111 11.540 -1.903 -9.903 1.00 0.00 H new ATOM 0 HG22 VAL A 111 10.400 -1.718 -8.549 1.00 0.00 H new ATOM 0 HG23 VAL A 111 12.149 -1.812 -8.233 1.00 0.00 H new ATOM 543 N GLY A 112 9.485 -6.010 -7.028 1.00 0.00 N ATOM 544 CA GLY A 112 9.168 -7.424 -6.958 1.00 0.00 C ATOM 545 C GLY A 112 8.433 -7.793 -5.686 1.00 0.00 C ATOM 546 O GLY A 112 7.700 -8.782 -5.647 1.00 0.00 O ATOM 0 H GLY A 112 8.687 -5.386 -6.910 1.00 0.00 H new ATOM 0 HA2 GLY A 112 8.558 -7.699 -7.819 1.00 0.00 H new ATOM 0 HA3 GLY A 112 10.089 -8.003 -7.022 1.00 0.00 H new ATOM 550 N ASP A 113 8.628 -6.997 -4.640 1.00 0.00 N ATOM 551 CA ASP A 113 7.977 -7.245 -3.359 1.00 0.00 C ATOM 552 C ASP A 113 6.559 -6.684 -3.350 1.00 0.00 C ATOM 553 O ASP A 113 6.300 -5.614 -3.901 1.00 0.00 O ATOM 554 CB ASP A 113 8.789 -6.628 -2.222 1.00 0.00 C ATOM 555 CG ASP A 113 9.386 -7.676 -1.303 1.00 0.00 C ATOM 556 OD1 ASP A 113 9.269 -8.879 -1.619 1.00 0.00 O ATOM 557 OD2 ASP A 113 9.971 -7.294 -0.267 1.00 0.00 O ATOM 0 H ASP A 113 9.232 -6.175 -4.654 1.00 0.00 H new ATOM 0 HA ASP A 113 7.922 -8.324 -3.212 1.00 0.00 H new ATOM 0 HB2 ASP A 113 9.589 -6.017 -2.640 1.00 0.00 H new ATOM 0 HB3 ASP A 113 8.150 -5.962 -1.642 1.00 0.00 H new ATOM 562 N THR A 114 5.644 -7.413 -2.720 1.00 0.00 N ATOM 563 CA THR A 114 4.251 -6.989 -2.638 1.00 0.00 C ATOM 564 C THR A 114 4.125 -5.682 -1.864 1.00 0.00 C ATOM 565 O THR A 114 5.125 -5.082 -1.471 1.00 0.00 O ATOM 566 CB THR A 114 3.405 -8.073 -1.971 1.00 0.00 C ATOM 567 OG1 THR A 114 4.131 -9.285 -1.868 1.00 0.00 O ATOM 568 CG2 THR A 114 2.120 -8.371 -2.714 1.00 0.00 C ATOM 0 H THR A 114 5.842 -8.301 -2.258 1.00 0.00 H new ATOM 0 HA THR A 114 3.887 -6.826 -3.652 1.00 0.00 H new ATOM 0 HB THR A 114 3.155 -7.678 -0.987 1.00 0.00 H new ATOM 0 HG1 THR A 114 3.573 -9.965 -1.437 1.00 0.00 H new ATOM 0 HG21 THR A 114 1.567 -9.149 -2.187 1.00 0.00 H new ATOM 0 HG22 THR A 114 1.513 -7.467 -2.768 1.00 0.00 H new ATOM 0 HG23 THR A 114 2.354 -8.711 -3.723 1.00 0.00 H new ATOM 576 N LEU A 115 2.888 -5.247 -1.649 1.00 0.00 N ATOM 577 CA LEU A 115 2.628 -4.010 -0.921 1.00 0.00 C ATOM 578 C LEU A 115 1.481 -4.193 0.067 1.00 0.00 C ATOM 579 O LEU A 115 1.693 -4.230 1.281 1.00 0.00 O ATOM 580 CB LEU A 115 2.300 -2.879 -1.898 1.00 0.00 C ATOM 581 CG LEU A 115 2.752 -1.486 -1.455 1.00 0.00 C ATOM 582 CD1 LEU A 115 3.959 -1.036 -2.262 1.00 0.00 C ATOM 583 CD2 LEU A 115 1.612 -0.488 -1.595 1.00 0.00 C ATOM 0 H LEU A 115 2.050 -5.732 -1.968 1.00 0.00 H new ATOM 0 HA LEU A 115 3.527 -3.749 -0.363 1.00 0.00 H new ATOM 0 HB2 LEU A 115 2.762 -3.105 -2.859 1.00 0.00 H new ATOM 0 HB3 LEU A 115 1.222 -2.860 -2.059 1.00 0.00 H new ATOM 0 HG LEU A 115 3.040 -1.534 -0.405 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.267 -0.043 -1.933 1.00 0.00 H new ATOM 0 HD12 LEU A 115 4.779 -1.738 -2.112 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.698 -1.003 -3.320 1.00 0.00 H new ATOM 0 HD21 LEU A 115 1.950 0.498 -1.276 1.00 0.00 H new ATOM 0 HD22 LEU A 115 1.294 -0.443 -2.637 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.774 -0.803 -0.973 1.00 0.00 H new ATOM 595 N CYS A 116 0.266 -4.309 -0.462 1.00 0.00 N ATOM 596 CA CYS A 116 -0.916 -4.489 0.372 1.00 0.00 C ATOM 597 C CYS A 116 -2.191 -4.424 -0.463 1.00 0.00 C ATOM 598 O CYS A 116 -2.214 -3.817 -1.534 1.00 0.00 O ATOM 599 CB CYS A 116 -0.958 -3.427 1.471 1.00 0.00 C ATOM 600 SG CYS A 116 -0.525 -4.046 3.114 1.00 0.00 S ATOM 0 H CYS A 116 0.075 -4.281 -1.464 1.00 0.00 H new ATOM 0 HA CYS A 116 -0.856 -5.476 0.831 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -0.275 -2.620 1.207 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -1.959 -2.998 1.509 1.00 0.00 H new ATOM 0 HG CYS A 116 -1.272 -3.467 4.007 1.00 0.00 H new ATOM 606 N ILE A 117 -3.253 -5.053 0.035 1.00 0.00 N ATOM 607 CA ILE A 117 -4.533 -5.067 -0.663 1.00 0.00 C ATOM 608 C ILE A 117 -5.289 -3.759 -0.454 1.00 0.00 C ATOM 609 O ILE A 117 -5.239 -3.165 0.623 1.00 0.00 O ATOM 610 CB ILE A 117 -5.420 -6.239 -0.195 1.00 0.00 C ATOM 611 CG1 ILE A 117 -4.836 -7.573 -0.660 1.00 0.00 C ATOM 612 CG2 ILE A 117 -6.838 -6.073 -0.718 1.00 0.00 C ATOM 613 CD1 ILE A 117 -4.826 -8.635 0.420 1.00 0.00 C ATOM 0 H ILE A 117 -3.251 -5.560 0.920 1.00 0.00 H new ATOM 0 HA ILE A 117 -4.311 -5.191 -1.723 1.00 0.00 H new ATOM 0 HB ILE A 117 -5.448 -6.235 0.895 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -5.412 -7.936 -1.511 1.00 0.00 H new ATOM 0 HG13 ILE A 117 -3.816 -7.412 -1.011 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -7.451 -6.908 -0.379 1.00 0.00 H new ATOM 0 HG22 ILE A 117 -7.257 -5.139 -0.343 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -6.824 -6.052 -1.808 1.00 0.00 H new ATOM 0 HD11 ILE A 117 -4.399 -9.555 0.021 1.00 0.00 H new ATOM 0 HD12 ILE A 117 -4.226 -8.291 1.263 1.00 0.00 H new ATOM 0 HD13 ILE A 117 -5.846 -8.824 0.754 1.00 0.00 H new ATOM 625 N VAL A 118 -5.994 -3.319 -1.491 1.00 0.00 N ATOM 626 CA VAL A 118 -6.768 -2.086 -1.425 1.00 0.00 C ATOM 627 C VAL A 118 -8.238 -2.383 -1.153 1.00 0.00 C ATOM 628 O VAL A 118 -8.981 -1.523 -0.681 1.00 0.00 O ATOM 629 CB VAL A 118 -6.656 -1.277 -2.731 1.00 0.00 C ATOM 630 CG1 VAL A 118 -7.123 0.154 -2.515 1.00 0.00 C ATOM 631 CG2 VAL A 118 -5.230 -1.307 -3.259 1.00 0.00 C ATOM 0 H VAL A 118 -6.045 -3.800 -2.389 1.00 0.00 H new ATOM 0 HA VAL A 118 -6.355 -1.496 -0.607 1.00 0.00 H new ATOM 0 HB VAL A 118 -7.304 -1.737 -3.477 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -7.036 0.710 -3.449 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -8.163 0.152 -2.189 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -6.505 0.627 -1.752 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -5.172 -0.730 -4.182 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -4.558 -0.875 -2.517 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -4.937 -2.338 -3.457 1.00 0.00 H new ATOM 641 N GLU A 119 -8.648 -3.610 -1.455 1.00 0.00 N ATOM 642 CA GLU A 119 -10.027 -4.032 -1.248 1.00 0.00 C ATOM 643 C GLU A 119 -11.004 -3.004 -1.808 1.00 0.00 C ATOM 644 O GLU A 119 -11.965 -2.617 -1.143 1.00 0.00 O ATOM 645 CB GLU A 119 -10.298 -4.254 0.243 1.00 0.00 C ATOM 646 CG GLU A 119 -11.418 -5.244 0.519 1.00 0.00 C ATOM 647 CD GLU A 119 -12.696 -4.901 -0.221 1.00 0.00 C ATOM 648 OE1 GLU A 119 -12.700 -4.981 -1.467 1.00 0.00 O ATOM 649 OE2 GLU A 119 -13.692 -4.552 0.446 1.00 0.00 O ATOM 0 H GLU A 119 -8.042 -4.332 -1.845 1.00 0.00 H new ATOM 0 HA GLU A 119 -10.175 -4.972 -1.780 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -9.385 -4.609 0.720 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -10.548 -3.298 0.704 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -11.093 -6.244 0.231 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -11.619 -5.270 1.590 1.00 0.00 H new ATOM 656 N ALA A 120 -10.756 -2.570 -3.038 1.00 0.00 N ATOM 657 CA ALA A 120 -11.618 -1.593 -3.691 1.00 0.00 C ATOM 658 C ALA A 120 -12.675 -2.293 -4.537 1.00 0.00 C ATOM 659 O ALA A 120 -12.467 -2.541 -5.725 1.00 0.00 O ATOM 660 CB ALA A 120 -10.791 -0.645 -4.548 1.00 0.00 C ATOM 0 H ALA A 120 -9.965 -2.879 -3.603 1.00 0.00 H new ATOM 0 HA ALA A 120 -12.125 -1.011 -2.921 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -11.449 0.079 -5.029 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -10.072 -0.120 -3.919 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -10.259 -1.214 -5.310 1.00 0.00 H new ATOM 666 N MET A 121 -13.803 -2.618 -3.912 1.00 0.00 N ATOM 667 CA MET A 121 -14.896 -3.301 -4.596 1.00 0.00 C ATOM 668 C MET A 121 -14.707 -4.813 -4.521 1.00 0.00 C ATOM 669 O MET A 121 -15.286 -5.563 -5.307 1.00 0.00 O ATOM 670 CB MET A 121 -14.991 -2.841 -6.058 1.00 0.00 C ATOM 671 CG MET A 121 -14.289 -3.758 -7.053 1.00 0.00 C ATOM 672 SD MET A 121 -15.439 -4.826 -7.942 1.00 0.00 S ATOM 673 CE MET A 121 -14.303 -5.856 -8.867 1.00 0.00 C ATOM 0 H MET A 121 -13.984 -2.418 -2.928 1.00 0.00 H new ATOM 0 HA MET A 121 -15.830 -3.044 -4.096 1.00 0.00 H new ATOM 0 HB2 MET A 121 -16.043 -2.763 -6.334 1.00 0.00 H new ATOM 0 HB3 MET A 121 -14.564 -1.841 -6.140 1.00 0.00 H new ATOM 0 HG2 MET A 121 -13.733 -3.153 -7.769 1.00 0.00 H new ATOM 0 HG3 MET A 121 -13.562 -4.374 -6.524 1.00 0.00 H new ATOM 0 HE1 MET A 121 -14.865 -6.510 -9.534 1.00 0.00 H new ATOM 0 HE2 MET A 121 -13.636 -5.225 -9.454 1.00 0.00 H new ATOM 0 HE3 MET A 121 -13.716 -6.461 -8.176 1.00 0.00 H new ATOM 683 N LYS A 122 -13.888 -5.252 -3.571 1.00 0.00 N ATOM 684 CA LYS A 122 -13.613 -6.672 -3.392 1.00 0.00 C ATOM 685 C LYS A 122 -12.871 -7.231 -4.600 1.00 0.00 C ATOM 686 O LYS A 122 -13.285 -8.229 -5.190 1.00 0.00 O ATOM 687 CB LYS A 122 -14.916 -7.445 -3.173 1.00 0.00 C ATOM 688 CG LYS A 122 -14.707 -8.850 -2.628 1.00 0.00 C ATOM 689 CD LYS A 122 -13.496 -8.919 -1.713 1.00 0.00 C ATOM 690 CE LYS A 122 -13.611 -10.066 -0.721 1.00 0.00 C ATOM 691 NZ LYS A 122 -13.358 -9.628 0.649 1.00 0.00 N ATOM 0 H LYS A 122 -13.403 -4.643 -2.912 1.00 0.00 H new ATOM 0 HA LYS A 122 -12.982 -6.789 -2.511 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -15.548 -6.887 -2.482 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -15.455 -7.508 -4.118 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -15.596 -9.165 -2.081 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -14.579 -9.547 -3.456 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -12.593 -9.043 -2.311 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -13.393 -7.978 -1.172 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -14.608 -10.502 -0.784 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -12.902 -10.850 -0.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -13.029 -10.435 1.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -12.629 -8.886 0.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -14.235 -9.251 1.060 1.00 0.00 H new ATOM 702 N MET A 123 -11.774 -6.574 -4.963 1.00 0.00 N ATOM 703 CA MET A 123 -10.971 -6.999 -6.103 1.00 0.00 C ATOM 704 C MET A 123 -9.548 -7.344 -5.672 1.00 0.00 C ATOM 705 O MET A 123 -8.653 -7.486 -6.506 1.00 0.00 O ATOM 706 CB MET A 123 -10.948 -5.899 -7.169 1.00 0.00 C ATOM 707 CG MET A 123 -9.824 -4.891 -6.985 1.00 0.00 C ATOM 708 SD MET A 123 -10.088 -3.377 -7.929 1.00 0.00 S ATOM 709 CE MET A 123 -9.179 -2.195 -6.937 1.00 0.00 C ATOM 0 H MET A 123 -11.421 -5.745 -4.484 1.00 0.00 H new ATOM 0 HA MET A 123 -11.425 -7.896 -6.525 1.00 0.00 H new ATOM 0 HB2 MET A 123 -10.853 -6.360 -8.152 1.00 0.00 H new ATOM 0 HB3 MET A 123 -11.902 -5.372 -7.155 1.00 0.00 H new ATOM 0 HG2 MET A 123 -9.732 -4.644 -5.927 1.00 0.00 H new ATOM 0 HG3 MET A 123 -8.881 -5.345 -7.289 1.00 0.00 H new ATOM 0 HE1 MET A 123 -9.734 -1.258 -6.888 1.00 0.00 H new ATOM 0 HE2 MET A 123 -9.046 -2.591 -5.930 1.00 0.00 H new ATOM 0 HE3 MET A 123 -8.203 -2.015 -7.388 1.00 0.00 H new ATOM 719 N MET A 124 -9.344 -7.478 -4.364 1.00 0.00 N ATOM 720 CA MET A 124 -8.029 -7.804 -3.827 1.00 0.00 C ATOM 721 C MET A 124 -6.933 -7.102 -4.619 1.00 0.00 C ATOM 722 O MET A 124 -5.957 -7.726 -5.037 1.00 0.00 O ATOM 723 CB MET A 124 -7.807 -9.318 -3.854 1.00 0.00 C ATOM 724 CG MET A 124 -9.038 -10.120 -3.460 1.00 0.00 C ATOM 725 SD MET A 124 -9.084 -10.499 -1.698 1.00 0.00 S ATOM 726 CE MET A 124 -10.256 -9.274 -1.119 1.00 0.00 C ATOM 0 H MET A 124 -10.072 -7.366 -3.659 1.00 0.00 H new ATOM 0 HA MET A 124 -7.986 -7.457 -2.795 1.00 0.00 H new ATOM 0 HB2 MET A 124 -7.496 -9.614 -4.856 1.00 0.00 H new ATOM 0 HB3 MET A 124 -6.989 -9.569 -3.179 1.00 0.00 H new ATOM 0 HG2 MET A 124 -9.933 -9.561 -3.731 1.00 0.00 H new ATOM 0 HG3 MET A 124 -9.059 -11.050 -4.029 1.00 0.00 H new ATOM 0 HE1 MET A 124 -9.745 -8.556 -0.478 1.00 0.00 H new ATOM 0 HE2 MET A 124 -10.690 -8.753 -1.973 1.00 0.00 H new ATOM 0 HE3 MET A 124 -11.047 -9.766 -0.554 1.00 0.00 H new ATOM 736 N ASN A 125 -7.102 -5.800 -4.822 1.00 0.00 N ATOM 737 CA ASN A 125 -6.127 -5.010 -5.567 1.00 0.00 C ATOM 738 C ASN A 125 -4.859 -4.795 -4.747 1.00 0.00 C ATOM 739 O ASN A 125 -4.589 -3.689 -4.281 1.00 0.00 O ATOM 740 CB ASN A 125 -6.728 -3.661 -5.962 1.00 0.00 C ATOM 741 CG ASN A 125 -5.702 -2.727 -6.573 1.00 0.00 C ATOM 742 OD1 ASN A 125 -4.705 -3.169 -7.142 1.00 0.00 O ATOM 743 ND2 ASN A 125 -5.942 -1.426 -6.457 1.00 0.00 N ATOM 0 H ASN A 125 -7.904 -5.269 -4.482 1.00 0.00 H new ATOM 0 HA ASN A 125 -5.864 -5.561 -6.470 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -7.538 -3.822 -6.673 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -7.166 -3.190 -5.082 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -5.286 -0.750 -6.848 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -6.782 -1.103 -5.977 1.00 0.00 H new ATOM 750 N GLN A 126 -4.086 -5.862 -4.575 1.00 0.00 N ATOM 751 CA GLN A 126 -2.847 -5.791 -3.811 1.00 0.00 C ATOM 752 C GLN A 126 -1.708 -5.257 -4.671 1.00 0.00 C ATOM 753 O GLN A 126 -1.321 -5.875 -5.664 1.00 0.00 O ATOM 754 CB GLN A 126 -2.486 -7.170 -3.258 1.00 0.00 C ATOM 755 CG GLN A 126 -1.828 -8.082 -4.280 1.00 0.00 C ATOM 756 CD GLN A 126 -1.784 -9.528 -3.827 1.00 0.00 C ATOM 757 OE1 GLN A 126 -0.731 -10.166 -3.849 1.00 0.00 O ATOM 758 NE2 GLN A 126 -2.931 -10.054 -3.415 1.00 0.00 N ATOM 0 H GLN A 126 -4.296 -6.785 -4.954 1.00 0.00 H new ATOM 0 HA GLN A 126 -3.000 -5.104 -2.979 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -1.815 -7.047 -2.408 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -3.390 -7.650 -2.884 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -2.371 -8.017 -5.223 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -0.813 -7.734 -4.472 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -3.780 -9.489 -3.413 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -2.963 -11.024 -3.100 1.00 0.00 H new ATOM 767 N ILE A 127 -1.175 -4.103 -4.282 1.00 0.00 N ATOM 768 CA ILE A 127 -0.080 -3.480 -5.014 1.00 0.00 C ATOM 769 C ILE A 127 1.252 -4.150 -4.694 1.00 0.00 C ATOM 770 O ILE A 127 1.457 -4.649 -3.587 1.00 0.00 O ATOM 771 CB ILE A 127 0.028 -1.979 -4.693 1.00 0.00 C ATOM 772 CG1 ILE A 127 -1.350 -1.317 -4.760 1.00 0.00 C ATOM 773 CG2 ILE A 127 0.997 -1.300 -5.651 1.00 0.00 C ATOM 774 CD1 ILE A 127 -2.090 -1.594 -6.050 1.00 0.00 C ATOM 0 H ILE A 127 -1.485 -3.580 -3.463 1.00 0.00 H new ATOM 0 HA ILE A 127 -0.301 -3.605 -6.074 1.00 0.00 H new ATOM 0 HB ILE A 127 0.412 -1.868 -3.679 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -1.953 -1.666 -3.922 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -1.233 -0.240 -4.641 1.00 0.00 H new ATOM 0 HG21 ILE A 127 1.062 -0.239 -5.411 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.983 -1.755 -5.555 1.00 0.00 H new ATOM 0 HG23 ILE A 127 0.641 -1.419 -6.674 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -3.058 -1.094 -6.028 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -1.507 -1.220 -6.891 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -2.238 -2.668 -6.161 1.00 0.00 H new ATOM 786 N GLU A 128 2.152 -4.152 -5.670 1.00 0.00 N ATOM 787 CA GLU A 128 3.470 -4.753 -5.497 1.00 0.00 C ATOM 788 C GLU A 128 4.566 -3.765 -5.878 1.00 0.00 C ATOM 789 O GLU A 128 4.662 -3.341 -7.030 1.00 0.00 O ATOM 790 CB GLU A 128 3.592 -6.022 -6.343 1.00 0.00 C ATOM 791 CG GLU A 128 2.815 -7.203 -5.784 1.00 0.00 C ATOM 792 CD GLU A 128 2.174 -8.045 -6.869 1.00 0.00 C ATOM 793 OE1 GLU A 128 2.914 -8.734 -7.601 1.00 0.00 O ATOM 794 OE2 GLU A 128 0.930 -8.014 -6.988 1.00 0.00 O ATOM 0 H GLU A 128 1.993 -3.744 -6.591 1.00 0.00 H new ATOM 0 HA GLU A 128 3.589 -5.016 -4.446 1.00 0.00 H new ATOM 0 HB2 GLU A 128 3.239 -5.811 -7.353 1.00 0.00 H new ATOM 0 HB3 GLU A 128 4.644 -6.295 -6.423 1.00 0.00 H new ATOM 0 HG2 GLU A 128 3.485 -7.827 -5.193 1.00 0.00 H new ATOM 0 HG3 GLU A 128 2.042 -6.837 -5.108 1.00 0.00 H new ATOM 801 N ALA A 129 5.388 -3.397 -4.901 1.00 0.00 N ATOM 802 CA ALA A 129 6.477 -2.453 -5.128 1.00 0.00 C ATOM 803 C ALA A 129 7.075 -2.621 -6.522 1.00 0.00 C ATOM 804 O ALA A 129 7.939 -3.470 -6.740 1.00 0.00 O ATOM 805 CB ALA A 129 7.552 -2.624 -4.068 1.00 0.00 C ATOM 0 H ALA A 129 5.321 -3.739 -3.942 1.00 0.00 H new ATOM 0 HA ALA A 129 6.068 -1.445 -5.058 1.00 0.00 H new ATOM 0 HB1 ALA A 129 8.358 -1.913 -4.250 1.00 0.00 H new ATOM 0 HB2 ALA A 129 7.123 -2.442 -3.082 1.00 0.00 H new ATOM 0 HB3 ALA A 129 7.947 -3.639 -4.110 1.00 0.00 H new ATOM 811 N ASP A 130 6.613 -1.801 -7.460 1.00 0.00 N ATOM 812 CA ASP A 130 7.107 -1.852 -8.832 1.00 0.00 C ATOM 813 C ASP A 130 8.223 -0.832 -9.042 1.00 0.00 C ATOM 814 O ASP A 130 8.936 -0.874 -10.043 1.00 0.00 O ATOM 815 CB ASP A 130 5.968 -1.591 -9.820 1.00 0.00 C ATOM 816 CG ASP A 130 4.936 -0.624 -9.273 1.00 0.00 C ATOM 817 OD1 ASP A 130 5.186 0.598 -9.317 1.00 0.00 O ATOM 818 OD2 ASP A 130 3.877 -1.091 -8.802 1.00 0.00 O ATOM 0 H ASP A 130 5.897 -1.093 -7.296 1.00 0.00 H new ATOM 0 HA ASP A 130 7.509 -2.849 -9.011 1.00 0.00 H new ATOM 0 HB2 ASP A 130 6.380 -1.192 -10.747 1.00 0.00 H new ATOM 0 HB3 ASP A 130 5.482 -2.535 -10.067 1.00 0.00 H new ATOM 823 N LYS A 131 8.369 0.079 -8.084 1.00 0.00 N ATOM 824 CA LYS A 131 9.399 1.109 -8.153 1.00 0.00 C ATOM 825 C LYS A 131 10.208 1.137 -6.863 1.00 0.00 C ATOM 826 O LYS A 131 9.799 1.748 -5.876 1.00 0.00 O ATOM 827 CB LYS A 131 8.765 2.478 -8.404 1.00 0.00 C ATOM 828 CG LYS A 131 9.070 3.048 -9.780 1.00 0.00 C ATOM 829 CD LYS A 131 8.646 4.505 -9.885 1.00 0.00 C ATOM 830 CE LYS A 131 9.082 5.118 -11.207 1.00 0.00 C ATOM 831 NZ LYS A 131 7.919 5.442 -12.080 1.00 0.00 N ATOM 0 H LYS A 131 7.785 0.124 -7.249 1.00 0.00 H new ATOM 0 HA LYS A 131 10.068 0.874 -8.981 1.00 0.00 H new ATOM 0 HB2 LYS A 131 7.685 2.396 -8.286 1.00 0.00 H new ATOM 0 HB3 LYS A 131 9.117 3.176 -7.645 1.00 0.00 H new ATOM 0 HG2 LYS A 131 10.138 2.963 -9.982 1.00 0.00 H new ATOM 0 HG3 LYS A 131 8.554 2.462 -10.541 1.00 0.00 H new ATOM 0 HD2 LYS A 131 7.563 4.578 -9.789 1.00 0.00 H new ATOM 0 HD3 LYS A 131 9.078 5.071 -9.060 1.00 0.00 H new ATOM 0 HE2 LYS A 131 9.655 6.025 -11.015 1.00 0.00 H new ATOM 0 HE3 LYS A 131 9.745 4.426 -11.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 8.259 5.858 -12.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 7.386 4.573 -12.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 7.300 6.122 -11.595 1.00 0.00 H new ATOM 845 N SER A 132 11.353 0.462 -6.871 1.00 0.00 N ATOM 846 CA SER A 132 12.210 0.404 -5.695 1.00 0.00 C ATOM 847 C SER A 132 11.474 -0.270 -4.544 1.00 0.00 C ATOM 848 O SER A 132 10.243 -0.301 -4.519 1.00 0.00 O ATOM 849 CB SER A 132 12.653 1.809 -5.284 1.00 0.00 C ATOM 850 OG SER A 132 13.607 1.759 -4.239 1.00 0.00 O ATOM 0 H SER A 132 11.707 -0.051 -7.678 1.00 0.00 H new ATOM 0 HA SER A 132 13.096 -0.181 -5.941 1.00 0.00 H new ATOM 0 HB2 SER A 132 13.079 2.325 -6.144 1.00 0.00 H new ATOM 0 HB3 SER A 132 11.787 2.387 -4.962 1.00 0.00 H new ATOM 0 HG SER A 132 13.875 2.670 -3.997 1.00 0.00 H new ATOM 856 N GLY A 133 12.224 -0.808 -3.590 1.00 0.00 N ATOM 857 CA GLY A 133 11.610 -1.465 -2.461 1.00 0.00 C ATOM 858 C GLY A 133 12.048 -0.863 -1.148 1.00 0.00 C ATOM 859 O GLY A 133 13.057 -1.273 -0.575 1.00 0.00 O ATOM 0 H GLY A 133 13.244 -0.799 -3.581 1.00 0.00 H new ATOM 0 HA2 GLY A 133 10.526 -1.396 -2.547 1.00 0.00 H new ATOM 0 HA3 GLY A 133 11.864 -2.525 -2.476 1.00 0.00 H new ATOM 863 N THR A 134 11.288 0.112 -0.669 1.00 0.00 N ATOM 864 CA THR A 134 11.600 0.772 0.589 1.00 0.00 C ATOM 865 C THR A 134 10.396 1.557 1.098 1.00 0.00 C ATOM 866 O THR A 134 10.128 2.665 0.634 1.00 0.00 O ATOM 867 CB THR A 134 12.799 1.706 0.418 1.00 0.00 C ATOM 868 OG1 THR A 134 13.636 1.261 -0.635 1.00 0.00 O ATOM 869 CG2 THR A 134 13.648 1.815 1.665 1.00 0.00 C ATOM 0 H THR A 134 10.451 0.463 -1.134 1.00 0.00 H new ATOM 0 HA THR A 134 11.851 0.006 1.322 1.00 0.00 H new ATOM 0 HB THR A 134 12.376 2.686 0.196 1.00 0.00 H new ATOM 0 HG1 THR A 134 14.396 1.872 -0.729 1.00 0.00 H new ATOM 0 HG21 THR A 134 14.482 2.492 1.479 1.00 0.00 H new ATOM 0 HG22 THR A 134 13.043 2.202 2.485 1.00 0.00 H new ATOM 0 HG23 THR A 134 14.032 0.830 1.931 1.00 0.00 H new ATOM 877 N VAL A 135 9.669 0.980 2.052 1.00 0.00 N ATOM 878 CA VAL A 135 8.494 1.637 2.610 1.00 0.00 C ATOM 879 C VAL A 135 8.883 2.642 3.689 1.00 0.00 C ATOM 880 O VAL A 135 9.442 2.275 4.722 1.00 0.00 O ATOM 881 CB VAL A 135 7.502 0.618 3.205 1.00 0.00 C ATOM 882 CG1 VAL A 135 6.429 1.326 4.018 1.00 0.00 C ATOM 883 CG2 VAL A 135 6.874 -0.220 2.102 1.00 0.00 C ATOM 0 H VAL A 135 9.873 0.064 2.452 1.00 0.00 H new ATOM 0 HA VAL A 135 8.010 2.162 1.786 1.00 0.00 H new ATOM 0 HB VAL A 135 8.051 -0.047 3.872 1.00 0.00 H new ATOM 0 HG11 VAL A 135 5.739 0.589 4.429 1.00 0.00 H new ATOM 0 HG12 VAL A 135 6.896 1.880 4.832 1.00 0.00 H new ATOM 0 HG13 VAL A 135 5.882 2.016 3.376 1.00 0.00 H new ATOM 0 HG21 VAL A 135 6.176 -0.934 2.540 1.00 0.00 H new ATOM 0 HG22 VAL A 135 6.340 0.431 1.410 1.00 0.00 H new ATOM 0 HG23 VAL A 135 7.655 -0.758 1.565 1.00 0.00 H new ATOM 893 N LYS A 136 8.580 3.912 3.442 1.00 0.00 N ATOM 894 CA LYS A 136 8.893 4.972 4.392 1.00 0.00 C ATOM 895 C LYS A 136 7.820 5.067 5.470 1.00 0.00 C ATOM 896 O LYS A 136 8.126 5.221 6.653 1.00 0.00 O ATOM 897 CB LYS A 136 9.029 6.314 3.670 1.00 0.00 C ATOM 898 CG LYS A 136 10.306 7.063 4.010 1.00 0.00 C ATOM 899 CD LYS A 136 10.504 7.174 5.513 1.00 0.00 C ATOM 900 CE LYS A 136 11.720 6.387 5.976 1.00 0.00 C ATOM 901 NZ LYS A 136 12.023 6.626 7.413 1.00 0.00 N ATOM 0 H LYS A 136 8.118 4.232 2.591 1.00 0.00 H new ATOM 0 HA LYS A 136 9.843 4.729 4.868 1.00 0.00 H new ATOM 0 HB2 LYS A 136 8.994 6.143 2.594 1.00 0.00 H new ATOM 0 HB3 LYS A 136 8.173 6.940 3.921 1.00 0.00 H new ATOM 0 HG2 LYS A 136 11.159 6.549 3.567 1.00 0.00 H new ATOM 0 HG3 LYS A 136 10.271 8.061 3.572 1.00 0.00 H new ATOM 0 HD2 LYS A 136 10.621 8.222 5.789 1.00 0.00 H new ATOM 0 HD3 LYS A 136 9.615 6.807 6.026 1.00 0.00 H new ATOM 0 HE2 LYS A 136 11.547 5.323 5.814 1.00 0.00 H new ATOM 0 HE3 LYS A 136 12.584 6.665 5.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 12.858 6.071 7.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 12.214 7.637 7.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 11.209 6.337 7.992 1.00 0.00 H new ATOM 915 N ALA A 137 6.560 4.972 5.056 1.00 0.00 N ATOM 916 CA ALA A 137 5.444 5.047 5.993 1.00 0.00 C ATOM 917 C ALA A 137 4.105 5.101 5.262 1.00 0.00 C ATOM 918 O ALA A 137 3.991 5.709 4.198 1.00 0.00 O ATOM 919 CB ALA A 137 5.599 6.259 6.900 1.00 0.00 C ATOM 0 H ALA A 137 6.287 4.843 4.082 1.00 0.00 H new ATOM 0 HA ALA A 137 5.456 4.143 6.601 1.00 0.00 H new ATOM 0 HB1 ALA A 137 4.760 6.304 7.594 1.00 0.00 H new ATOM 0 HB2 ALA A 137 6.530 6.177 7.461 1.00 0.00 H new ATOM 0 HB3 ALA A 137 5.618 7.166 6.295 1.00 0.00 H new ATOM 925 N ILE A 138 3.094 4.461 5.844 1.00 0.00 N ATOM 926 CA ILE A 138 1.761 4.437 5.253 1.00 0.00 C ATOM 927 C ILE A 138 0.855 5.477 5.904 1.00 0.00 C ATOM 928 O ILE A 138 0.856 5.639 7.125 1.00 0.00 O ATOM 929 CB ILE A 138 1.106 3.046 5.391 1.00 0.00 C ATOM 930 CG1 ILE A 138 1.805 2.033 4.482 1.00 0.00 C ATOM 931 CG2 ILE A 138 -0.381 3.118 5.066 1.00 0.00 C ATOM 932 CD1 ILE A 138 1.084 0.706 4.387 1.00 0.00 C ATOM 0 H ILE A 138 3.174 3.952 6.725 1.00 0.00 H new ATOM 0 HA ILE A 138 1.881 4.670 4.195 1.00 0.00 H new ATOM 0 HB ILE A 138 1.215 2.716 6.424 1.00 0.00 H new ATOM 0 HG12 ILE A 138 1.899 2.458 3.483 1.00 0.00 H new ATOM 0 HG13 ILE A 138 2.816 1.862 4.852 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -0.824 2.128 5.169 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -0.871 3.808 5.753 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -0.513 3.470 4.043 1.00 0.00 H new ATOM 0 HD11 ILE A 138 1.637 0.038 3.726 1.00 0.00 H new ATOM 0 HD12 ILE A 138 1.013 0.259 5.378 1.00 0.00 H new ATOM 0 HD13 ILE A 138 0.082 0.864 3.988 1.00 0.00 H new ATOM 944 N LEU A 139 0.077 6.172 5.083 1.00 0.00 N ATOM 945 CA LEU A 139 -0.842 7.188 5.582 1.00 0.00 C ATOM 946 C LEU A 139 -2.148 6.554 6.026 1.00 0.00 C ATOM 947 O LEU A 139 -2.594 6.746 7.157 1.00 0.00 O ATOM 948 CB LEU A 139 -1.135 8.226 4.502 1.00 0.00 C ATOM 949 CG LEU A 139 0.011 9.192 4.198 1.00 0.00 C ATOM 950 CD1 LEU A 139 0.314 10.059 5.410 1.00 0.00 C ATOM 951 CD2 LEU A 139 1.251 8.424 3.766 1.00 0.00 C ATOM 0 H LEU A 139 0.064 6.051 4.070 1.00 0.00 H new ATOM 0 HA LEU A 139 -0.368 7.676 6.433 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -1.403 7.705 3.583 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -2.007 8.806 4.805 1.00 0.00 H new ATOM 0 HG LEU A 139 -0.294 9.844 3.379 1.00 0.00 H new ATOM 0 HD11 LEU A 139 1.132 10.740 5.175 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -0.572 10.635 5.676 1.00 0.00 H new ATOM 0 HD13 LEU A 139 0.600 9.425 6.249 1.00 0.00 H new ATOM 0 HD21 LEU A 139 2.058 9.125 3.553 1.00 0.00 H new ATOM 0 HD22 LEU A 139 1.558 7.749 4.565 1.00 0.00 H new ATOM 0 HD23 LEU A 139 1.027 7.846 2.869 1.00 0.00 H new ATOM 963 N VAL A 140 -2.759 5.800 5.119 1.00 0.00 N ATOM 964 CA VAL A 140 -4.019 5.138 5.407 1.00 0.00 C ATOM 965 C VAL A 140 -4.068 4.672 6.854 1.00 0.00 C ATOM 966 O VAL A 140 -3.080 4.173 7.393 1.00 0.00 O ATOM 967 CB VAL A 140 -4.256 3.935 4.476 1.00 0.00 C ATOM 968 CG1 VAL A 140 -5.729 3.557 4.463 1.00 0.00 C ATOM 969 CG2 VAL A 140 -3.766 4.241 3.068 1.00 0.00 C ATOM 0 H VAL A 140 -2.400 5.634 4.179 1.00 0.00 H new ATOM 0 HA VAL A 140 -4.808 5.870 5.235 1.00 0.00 H new ATOM 0 HB VAL A 140 -3.687 3.087 4.856 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.880 2.705 3.800 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -6.046 3.293 5.472 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -6.318 4.402 4.108 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -3.943 3.378 2.426 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -4.305 5.103 2.674 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -2.699 4.462 3.094 1.00 0.00 H new ATOM 979 N GLU A 141 -5.223 4.845 7.476 1.00 0.00 N ATOM 980 CA GLU A 141 -5.420 4.453 8.866 1.00 0.00 C ATOM 981 C GLU A 141 -5.636 2.949 8.992 1.00 0.00 C ATOM 982 O GLU A 141 -6.548 2.501 9.686 1.00 0.00 O ATOM 983 CB GLU A 141 -6.611 5.202 9.464 1.00 0.00 C ATOM 984 CG GLU A 141 -6.231 6.512 10.136 1.00 0.00 C ATOM 985 CD GLU A 141 -6.518 6.508 11.625 1.00 0.00 C ATOM 986 OE1 GLU A 141 -6.366 5.441 12.256 1.00 0.00 O ATOM 987 OE2 GLU A 141 -6.896 7.572 12.159 1.00 0.00 O ATOM 0 H GLU A 141 -6.046 5.258 7.037 1.00 0.00 H new ATOM 0 HA GLU A 141 -4.517 4.715 9.418 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -7.335 5.405 8.675 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -7.105 4.559 10.193 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -5.170 6.705 9.975 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -6.778 7.329 9.666 1.00 0.00 H new ATOM 994 N SER A 142 -4.782 2.176 8.329 1.00 0.00 N ATOM 995 CA SER A 142 -4.862 0.723 8.380 1.00 0.00 C ATOM 996 C SER A 142 -6.308 0.240 8.526 1.00 0.00 C ATOM 997 O SER A 142 -6.837 0.184 9.635 1.00 0.00 O ATOM 998 CB SER A 142 -4.031 0.223 9.553 1.00 0.00 C ATOM 999 OG SER A 142 -3.695 -1.145 9.402 1.00 0.00 O ATOM 0 H SER A 142 -4.024 2.535 7.748 1.00 0.00 H new ATOM 0 HA SER A 142 -4.475 0.324 7.443 1.00 0.00 H new ATOM 0 HB2 SER A 142 -3.120 0.816 9.635 1.00 0.00 H new ATOM 0 HB3 SER A 142 -4.587 0.363 10.480 1.00 0.00 H new ATOM 0 HG SER A 142 -3.452 -1.520 10.274 1.00 0.00 H new ATOM 1005 N GLY A 143 -6.944 -0.110 7.408 1.00 0.00 N ATOM 1006 CA GLY A 143 -8.314 -0.582 7.460 1.00 0.00 C ATOM 1007 C GLY A 143 -9.309 0.487 7.059 1.00 0.00 C ATOM 1008 O GLY A 143 -10.377 0.184 6.528 1.00 0.00 O ATOM 0 H GLY A 143 -6.535 -0.074 6.474 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -8.424 -1.443 6.800 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -8.540 -0.924 8.470 1.00 0.00 H new ATOM 1012 N GLN A 144 -8.957 1.741 7.313 1.00 0.00 N ATOM 1013 CA GLN A 144 -9.826 2.862 6.975 1.00 0.00 C ATOM 1014 C GLN A 144 -10.234 2.808 5.505 1.00 0.00 C ATOM 1015 O GLN A 144 -9.437 2.438 4.642 1.00 0.00 O ATOM 1016 CB GLN A 144 -9.125 4.188 7.275 1.00 0.00 C ATOM 1017 CG GLN A 144 -10.081 5.318 7.622 1.00 0.00 C ATOM 1018 CD GLN A 144 -9.362 6.561 8.107 1.00 0.00 C ATOM 1019 OE1 GLN A 144 -9.125 6.727 9.304 1.00 0.00 O ATOM 1020 NE2 GLN A 144 -9.012 7.443 7.179 1.00 0.00 N ATOM 0 H GLN A 144 -8.076 2.008 7.752 1.00 0.00 H new ATOM 0 HA GLN A 144 -10.725 2.790 7.586 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -8.431 4.043 8.103 1.00 0.00 H new ATOM 0 HB3 GLN A 144 -8.531 4.479 6.409 1.00 0.00 H new ATOM 0 HG2 GLN A 144 -10.677 5.567 6.744 1.00 0.00 H new ATOM 0 HG3 GLN A 144 -10.774 4.979 8.393 1.00 0.00 H new ATOM 0 HE21 GLN A 144 -9.229 7.265 6.198 1.00 0.00 H new ATOM 0 HE22 GLN A 144 -8.526 8.299 7.446 1.00 0.00 H new ATOM 1029 N PRO A 145 -11.487 3.180 5.205 1.00 0.00 N ATOM 1030 CA PRO A 145 -12.007 3.177 3.834 1.00 0.00 C ATOM 1031 C PRO A 145 -11.250 4.140 2.926 1.00 0.00 C ATOM 1032 O PRO A 145 -11.548 5.334 2.884 1.00 0.00 O ATOM 1033 CB PRO A 145 -13.465 3.627 3.995 1.00 0.00 C ATOM 1034 CG PRO A 145 -13.514 4.318 5.315 1.00 0.00 C ATOM 1035 CD PRO A 145 -12.493 3.633 6.177 1.00 0.00 C ATOM 0 HA PRO A 145 -11.902 2.199 3.365 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -13.762 4.297 3.188 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -14.145 2.776 3.970 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -13.287 5.379 5.209 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -14.508 4.247 5.756 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -12.065 4.313 6.913 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -12.926 2.798 6.728 1.00 0.00 H new ATOM 1043 N VAL A 146 -10.268 3.613 2.201 1.00 0.00 N ATOM 1044 CA VAL A 146 -9.468 4.426 1.295 1.00 0.00 C ATOM 1045 C VAL A 146 -10.325 5.477 0.598 1.00 0.00 C ATOM 1046 O VAL A 146 -11.521 5.279 0.389 1.00 0.00 O ATOM 1047 CB VAL A 146 -8.771 3.560 0.230 1.00 0.00 C ATOM 1048 CG1 VAL A 146 -7.769 4.386 -0.561 1.00 0.00 C ATOM 1049 CG2 VAL A 146 -8.093 2.361 0.878 1.00 0.00 C ATOM 0 H VAL A 146 -10.008 2.627 2.224 1.00 0.00 H new ATOM 0 HA VAL A 146 -8.710 4.922 1.901 1.00 0.00 H new ATOM 0 HB VAL A 146 -9.527 3.191 -0.463 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -7.287 3.756 -1.308 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -8.286 5.207 -1.058 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -7.015 4.788 0.115 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -7.605 1.760 0.110 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -7.349 2.707 1.595 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -8.839 1.756 1.393 1.00 0.00 H new ATOM 1059 N GLU A 147 -9.704 6.598 0.242 1.00 0.00 N ATOM 1060 CA GLU A 147 -10.410 7.681 -0.431 1.00 0.00 C ATOM 1061 C GLU A 147 -9.671 8.108 -1.694 1.00 0.00 C ATOM 1062 O GLU A 147 -8.449 7.993 -1.779 1.00 0.00 O ATOM 1063 CB GLU A 147 -10.568 8.876 0.512 1.00 0.00 C ATOM 1064 CG GLU A 147 -10.722 8.483 1.972 1.00 0.00 C ATOM 1065 CD GLU A 147 -11.135 9.648 2.849 1.00 0.00 C ATOM 1066 OE1 GLU A 147 -12.344 9.961 2.890 1.00 0.00 O ATOM 1067 OE2 GLU A 147 -10.250 10.248 3.495 1.00 0.00 O ATOM 0 H GLU A 147 -8.714 6.779 0.409 1.00 0.00 H new ATOM 0 HA GLU A 147 -11.398 7.318 -0.715 1.00 0.00 H new ATOM 0 HB2 GLU A 147 -9.699 9.527 0.409 1.00 0.00 H new ATOM 0 HB3 GLU A 147 -11.439 9.456 0.207 1.00 0.00 H new ATOM 0 HG2 GLU A 147 -11.465 7.690 2.054 1.00 0.00 H new ATOM 0 HG3 GLU A 147 -9.779 8.075 2.336 1.00 0.00 H new ATOM 1074 N PHE A 148 -10.421 8.602 -2.675 1.00 0.00 N ATOM 1075 CA PHE A 148 -9.836 9.045 -3.934 1.00 0.00 C ATOM 1076 C PHE A 148 -8.479 9.701 -3.704 1.00 0.00 C ATOM 1077 O PHE A 148 -8.397 10.816 -3.190 1.00 0.00 O ATOM 1078 CB PHE A 148 -10.774 10.022 -4.639 1.00 0.00 C ATOM 1079 CG PHE A 148 -10.728 9.924 -6.138 1.00 0.00 C ATOM 1080 CD1 PHE A 148 -9.543 9.598 -6.790 1.00 0.00 C ATOM 1081 CD2 PHE A 148 -11.868 10.158 -6.898 1.00 0.00 C ATOM 1082 CE1 PHE A 148 -9.498 9.507 -8.172 1.00 0.00 C ATOM 1083 CE2 PHE A 148 -11.829 10.069 -8.281 1.00 0.00 C ATOM 1084 CZ PHE A 148 -10.642 9.743 -8.919 1.00 0.00 C ATOM 0 H PHE A 148 -11.434 8.705 -2.621 1.00 0.00 H new ATOM 0 HA PHE A 148 -9.692 8.169 -4.566 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -11.795 9.840 -4.302 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -10.517 11.039 -4.342 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -8.649 9.414 -6.213 1.00 0.00 H new ATOM 0 HD2 PHE A 148 -12.795 10.412 -6.405 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -8.572 9.252 -8.667 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -12.722 10.253 -8.860 1.00 0.00 H new ATOM 0 HZ PHE A 148 -10.609 9.673 -9.996 1.00 0.00 H new ATOM 1094 N ASP A 149 -7.417 9.001 -4.089 1.00 0.00 N ATOM 1095 CA ASP A 149 -6.061 9.515 -3.926 1.00 0.00 C ATOM 1096 C ASP A 149 -5.650 9.517 -2.457 1.00 0.00 C ATOM 1097 O ASP A 149 -5.577 10.571 -1.825 1.00 0.00 O ATOM 1098 CB ASP A 149 -5.957 10.930 -4.500 1.00 0.00 C ATOM 1099 CG ASP A 149 -5.256 10.958 -5.844 1.00 0.00 C ATOM 1100 OD1 ASP A 149 -5.507 10.050 -6.664 1.00 0.00 O ATOM 1101 OD2 ASP A 149 -4.458 11.890 -6.077 1.00 0.00 O ATOM 0 H ASP A 149 -7.469 8.076 -4.516 1.00 0.00 H new ATOM 0 HA ASP A 149 -5.383 8.858 -4.471 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -6.957 11.351 -4.606 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -5.417 11.565 -3.798 1.00 0.00 H new ATOM 1106 N GLU A 150 -5.382 8.332 -1.919 1.00 0.00 N ATOM 1107 CA GLU A 150 -4.976 8.199 -0.525 1.00 0.00 C ATOM 1108 C GLU A 150 -3.631 7.489 -0.421 1.00 0.00 C ATOM 1109 O GLU A 150 -3.521 6.298 -0.713 1.00 0.00 O ATOM 1110 CB GLU A 150 -6.035 7.430 0.266 1.00 0.00 C ATOM 1111 CG GLU A 150 -6.334 8.033 1.629 1.00 0.00 C ATOM 1112 CD GLU A 150 -5.251 7.736 2.649 1.00 0.00 C ATOM 1113 OE1 GLU A 150 -4.141 8.291 2.515 1.00 0.00 O ATOM 1114 OE2 GLU A 150 -5.515 6.947 3.581 1.00 0.00 O ATOM 0 H GLU A 150 -5.439 7.450 -2.428 1.00 0.00 H new ATOM 0 HA GLU A 150 -4.875 9.199 -0.103 1.00 0.00 H new ATOM 0 HB2 GLU A 150 -6.956 7.394 -0.316 1.00 0.00 H new ATOM 0 HB3 GLU A 150 -5.701 6.401 0.399 1.00 0.00 H new ATOM 0 HG2 GLU A 150 -6.446 9.112 1.528 1.00 0.00 H new ATOM 0 HG3 GLU A 150 -7.286 7.646 1.992 1.00 0.00 H new ATOM 1121 N PRO A 151 -2.585 8.216 0.001 1.00 0.00 N ATOM 1122 CA PRO A 151 -1.242 7.657 0.146 1.00 0.00 C ATOM 1123 C PRO A 151 -1.252 6.300 0.842 1.00 0.00 C ATOM 1124 O PRO A 151 -1.205 6.219 2.069 1.00 0.00 O ATOM 1125 CB PRO A 151 -0.526 8.698 1.005 1.00 0.00 C ATOM 1126 CG PRO A 151 -1.199 9.984 0.673 1.00 0.00 C ATOM 1127 CD PRO A 151 -2.636 9.643 0.371 1.00 0.00 C ATOM 0 HA PRO A 151 -0.764 7.475 -0.817 1.00 0.00 H new ATOM 0 HB2 PRO A 151 -0.615 8.466 2.066 1.00 0.00 H new ATOM 0 HB3 PRO A 151 0.539 8.737 0.776 1.00 0.00 H new ATOM 0 HG2 PRO A 151 -1.132 10.684 1.506 1.00 0.00 H new ATOM 0 HG3 PRO A 151 -0.724 10.462 -0.184 1.00 0.00 H new ATOM 0 HD2 PRO A 151 -3.278 9.810 1.236 1.00 0.00 H new ATOM 0 HD3 PRO A 151 -3.031 10.254 -0.441 1.00 0.00 H new ATOM 1135 N LEU A 152 -1.318 5.235 0.048 1.00 0.00 N ATOM 1136 CA LEU A 152 -1.336 3.881 0.586 1.00 0.00 C ATOM 1137 C LEU A 152 -0.019 3.551 1.280 1.00 0.00 C ATOM 1138 O LEU A 152 0.003 3.226 2.467 1.00 0.00 O ATOM 1139 CB LEU A 152 -1.606 2.869 -0.529 1.00 0.00 C ATOM 1140 CG LEU A 152 -2.964 3.013 -1.220 1.00 0.00 C ATOM 1141 CD1 LEU A 152 -3.079 2.040 -2.381 1.00 0.00 C ATOM 1142 CD2 LEU A 152 -4.093 2.793 -0.223 1.00 0.00 C ATOM 0 H LEU A 152 -1.360 5.285 -0.970 1.00 0.00 H new ATOM 0 HA LEU A 152 -2.137 3.822 1.323 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -0.822 2.961 -1.280 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -1.532 1.864 -0.113 1.00 0.00 H new ATOM 0 HG LEU A 152 -3.045 4.026 -1.614 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -4.051 2.158 -2.859 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -2.291 2.244 -3.106 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -2.977 1.019 -2.012 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -5.052 2.899 -0.730 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -4.015 1.791 0.200 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -4.022 3.531 0.576 1.00 0.00 H new ATOM 1154 N VAL A 153 1.075 3.640 0.534 1.00 0.00 N ATOM 1155 CA VAL A 153 2.396 3.350 1.081 1.00 0.00 C ATOM 1156 C VAL A 153 3.475 4.152 0.366 1.00 0.00 C ATOM 1157 O VAL A 153 3.787 3.894 -0.797 1.00 0.00 O ATOM 1158 CB VAL A 153 2.732 1.851 0.975 1.00 0.00 C ATOM 1159 CG1 VAL A 153 3.628 1.422 2.126 1.00 0.00 C ATOM 1160 CG2 VAL A 153 1.458 1.020 0.940 1.00 0.00 C ATOM 0 H VAL A 153 1.075 3.910 -0.450 1.00 0.00 H new ATOM 0 HA VAL A 153 2.371 3.636 2.133 1.00 0.00 H new ATOM 0 HB VAL A 153 3.273 1.683 0.044 1.00 0.00 H new ATOM 0 HG11 VAL A 153 3.855 0.360 2.034 1.00 0.00 H new ATOM 0 HG12 VAL A 153 4.555 1.995 2.098 1.00 0.00 H new ATOM 0 HG13 VAL A 153 3.117 1.604 3.072 1.00 0.00 H new ATOM 0 HG21 VAL A 153 1.715 -0.037 0.865 1.00 0.00 H new ATOM 0 HG22 VAL A 153 0.887 1.191 1.853 1.00 0.00 H new ATOM 0 HG23 VAL A 153 0.858 1.310 0.077 1.00 0.00 H new ATOM 1170 N VAL A 154 4.045 5.126 1.068 1.00 0.00 N ATOM 1171 CA VAL A 154 5.091 5.965 0.498 1.00 0.00 C ATOM 1172 C VAL A 154 6.439 5.251 0.521 1.00 0.00 C ATOM 1173 O VAL A 154 6.932 4.868 1.583 1.00 0.00 O ATOM 1174 CB VAL A 154 5.211 7.305 1.249 1.00 0.00 C ATOM 1175 CG1 VAL A 154 3.834 7.885 1.531 1.00 0.00 C ATOM 1176 CG2 VAL A 154 5.997 7.131 2.542 1.00 0.00 C ATOM 0 H VAL A 154 3.800 5.353 2.032 1.00 0.00 H new ATOM 0 HA VAL A 154 4.809 6.166 -0.536 1.00 0.00 H new ATOM 0 HB VAL A 154 5.754 8.005 0.614 1.00 0.00 H new ATOM 0 HG11 VAL A 154 3.939 8.831 2.062 1.00 0.00 H new ATOM 0 HG12 VAL A 154 3.310 8.053 0.590 1.00 0.00 H new ATOM 0 HG13 VAL A 154 3.264 7.187 2.144 1.00 0.00 H new ATOM 0 HG21 VAL A 154 6.069 8.090 3.056 1.00 0.00 H new ATOM 0 HG22 VAL A 154 5.487 6.413 3.184 1.00 0.00 H new ATOM 0 HG23 VAL A 154 6.998 6.766 2.313 1.00 0.00 H new ATOM 1186 N ILE A 155 7.027 5.074 -0.659 1.00 0.00 N ATOM 1187 CA ILE A 155 8.317 4.404 -0.782 1.00 0.00 C ATOM 1188 C ILE A 155 9.469 5.398 -0.665 1.00 0.00 C ATOM 1189 O ILE A 155 9.393 6.513 -1.180 1.00 0.00 O ATOM 1190 CB ILE A 155 8.432 3.657 -2.125 1.00 0.00 C ATOM 1191 CG1 ILE A 155 7.288 2.653 -2.274 1.00 0.00 C ATOM 1192 CG2 ILE A 155 9.779 2.956 -2.234 1.00 0.00 C ATOM 1193 CD1 ILE A 155 7.013 2.256 -3.708 1.00 0.00 C ATOM 0 H ILE A 155 6.629 5.386 -1.545 1.00 0.00 H new ATOM 0 HA ILE A 155 8.380 3.685 0.035 1.00 0.00 H new ATOM 0 HB ILE A 155 8.360 4.385 -2.933 1.00 0.00 H new ATOM 0 HG12 ILE A 155 7.523 1.759 -1.697 1.00 0.00 H new ATOM 0 HG13 ILE A 155 6.382 3.081 -1.844 1.00 0.00 H new ATOM 0 HG21 ILE A 155 9.841 2.434 -3.189 1.00 0.00 H new ATOM 0 HG22 ILE A 155 10.579 3.693 -2.171 1.00 0.00 H new ATOM 0 HG23 ILE A 155 9.882 2.238 -1.421 1.00 0.00 H new ATOM 0 HD11 ILE A 155 6.190 1.542 -3.736 1.00 0.00 H new ATOM 0 HD12 ILE A 155 6.746 3.141 -4.286 1.00 0.00 H new ATOM 0 HD13 ILE A 155 7.905 1.798 -4.136 1.00 0.00 H new ATOM 1205 N GLU A 156 10.534 4.984 0.014 1.00 0.00 N ATOM 1206 CA GLU A 156 11.701 5.838 0.198 1.00 0.00 C ATOM 1207 C GLU A 156 12.577 5.838 -1.052 1.00 0.00 C ATOM 1208 O GLU A 156 13.354 6.801 -1.227 1.00 0.00 O ATOM 1209 CB GLU A 156 12.516 5.371 1.405 1.00 0.00 C ATOM 1210 CG GLU A 156 13.708 6.260 1.715 1.00 0.00 C ATOM 1211 CD GLU A 156 14.433 5.844 2.980 1.00 0.00 C ATOM 1212 OE1 GLU A 156 14.527 4.626 3.237 1.00 0.00 O ATOM 1213 OE2 GLU A 156 14.906 6.739 3.714 1.00 0.00 O ATOM 1214 OXT GLU A 156 12.478 4.878 -1.843 1.00 0.00 O ATOM 0 H GLU A 156 10.613 4.063 0.445 1.00 0.00 H new ATOM 0 HA GLU A 156 11.352 6.855 0.376 1.00 0.00 H new ATOM 0 HB2 GLU A 156 11.866 5.332 2.279 1.00 0.00 H new ATOM 0 HB3 GLU A 156 12.868 4.355 1.224 1.00 0.00 H new ATOM 0 HG2 GLU A 156 14.404 6.234 0.877 1.00 0.00 H new ATOM 0 HG3 GLU A 156 13.370 7.291 1.817 1.00 0.00 H new