USER MOD reduce.3.24.130724 H: found=0, std=0, add=867, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 865 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 103 GLN :FLIP amide:sc= 0.172 F(o=1.1,f=1.7) USER MOD Set 1.2: A 107 TYR OH : rot -162:sc= 1.49 USER MOD Set 2.1: A 74 SER OG : rot -132:sc= 0.543 USER MOD Set 2.2: A 130 SER OG : rot -179:sc= 0.33 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 147:sc= 0.0334 (180deg=-0.182) USER MOD Single : A 62 THR OG1 : rot 78:sc= 0.31 USER MOD Single : A 63 ASN : amide:sc= -0.39 X(o=-0.39,f=-0.86) USER MOD Single : A 67 CYS SG : rot 180:sc= 0.327 USER MOD Single : A 69 THR OG1 : rot 20:sc= -0.488 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= -1.11 K(o=-1.1,f=-8.5!) USER MOD Single : A 78 GLN :FLIP amide:sc= -6.37! C(o=-8.9!,f=-6.4!) USER MOD Single : A 79 ASN : amide:sc= -1.03! C(o=-1!,f=-5.8!) USER MOD Single : A 80 GLN :FLIP amide:sc= 0 F(o=-0.54,f=0) USER MOD Single : A 82 GLN :FLIP amide:sc= -1.22 F(o=-5.6!,f=-1.2) USER MOD Single : A 85 LYS NZ :NH3+ -162:sc= -1.22 (180deg=-2.53!) USER MOD Single : A 91 ASN : amide:sc= -3.03! C(o=-3!,f=-6.6!) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ -159:sc= 0.0256 (180deg=0) USER MOD Single : A 94 HIS : no HD1:sc= -8! C(o=-8!,f=-12!) USER MOD Single : A 95 ASN : amide:sc= -0.397 K(o=-0.4,f=-1.9) USER MOD Single : A 96 ASN : amide:sc= 0.04 K(o=0.04,f=-6.5!) USER MOD Single : A 97 MET CE :methyl 156:sc= -0.0924 (180deg=-1.09) USER MOD Single : A 99 SER OG : rot 133:sc= -1.67 USER MOD Single : A 105 ASN : amide:sc= -9.65! C(o=-9.6!,f=-9.6!) USER MOD Single : A 106 MET CE :methyl -158:sc= 0 (180deg=-0.532) USER MOD Single : A 110 HIS : no HE2:sc= -2 K(o=-2,f=-3.3) USER MOD Single : A 111 LYS NZ :NH3+ 135:sc= -2.62! (180deg=-5.33!) USER MOD Single : A 113 THR OG1 : rot -170:sc= 0.843 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= -1.17 K(o=-1.2,f=-8.4!) USER MOD Single : A 131 HIS : no HD1:sc= -5.22 K(o=-5.2,f=-8.1!) USER MOD Single : A 135 LYS NZ :NH3+ 142:sc= -1.37 (180deg=-3.41!) USER MOD Single : A 137 ASN : amide:sc= -0.845 K(o=-0.85,f=-6.2!) USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 144 GLN :FLIP amide:sc= -8.79! C(o=-13!,f=-8.8!) USER MOD Single : A 146 LYS NZ :NH3+ -168:sc= -2.62! (180deg=-2.86) USER MOD Single : A 148 LYS NZ :NH3+ 174:sc= -2.33! (180deg=-2.44) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 43 19.810 2.533 -2.908 1.00 0.00 N ATOM 2 CA GLY A 43 20.454 3.872 -2.787 1.00 0.00 C ATOM 3 C GLY A 43 21.279 3.930 -1.501 1.00 0.00 C ATOM 4 O GLY A 43 22.256 4.646 -1.410 1.00 0.00 O ATOM 0 HA2 GLY A 43 21.093 4.059 -3.650 1.00 0.00 H new ATOM 0 HA3 GLY A 43 19.694 4.653 -2.779 1.00 0.00 H new ATOM 8 N SER A 44 20.894 3.180 -0.505 1.00 0.00 N ATOM 9 CA SER A 44 21.655 3.191 0.775 1.00 0.00 C ATOM 10 C SER A 44 21.306 1.941 1.585 1.00 0.00 C ATOM 11 O SER A 44 21.295 1.960 2.799 1.00 0.00 O ATOM 12 CB SER A 44 21.283 4.437 1.580 1.00 0.00 C ATOM 13 OG SER A 44 19.867 4.544 1.651 1.00 0.00 O ATOM 0 H SER A 44 20.084 2.560 -0.523 1.00 0.00 H new ATOM 0 HA SER A 44 22.724 3.202 0.561 1.00 0.00 H new ATOM 0 HB2 SER A 44 21.705 4.376 2.583 1.00 0.00 H new ATOM 0 HB3 SER A 44 21.704 5.326 1.111 1.00 0.00 H new ATOM 0 HG SER A 44 19.625 5.341 2.168 1.00 0.00 H new ATOM 19 N GLY A 45 21.020 0.854 0.921 1.00 0.00 N ATOM 20 CA GLY A 45 20.670 -0.397 1.652 1.00 0.00 C ATOM 21 C GLY A 45 19.208 -0.333 2.098 1.00 0.00 C ATOM 22 O GLY A 45 18.875 -0.670 3.217 1.00 0.00 O ATOM 0 H GLY A 45 21.014 0.778 -0.096 1.00 0.00 H new ATOM 0 HA2 GLY A 45 20.828 -1.263 1.009 1.00 0.00 H new ATOM 0 HA3 GLY A 45 21.321 -0.520 2.518 1.00 0.00 H new ATOM 26 N VAL A 46 18.333 0.098 1.231 1.00 0.00 N ATOM 27 CA VAL A 46 16.894 0.184 1.605 1.00 0.00 C ATOM 28 C VAL A 46 16.455 -1.178 2.192 1.00 0.00 C ATOM 29 O VAL A 46 16.777 -2.198 1.616 1.00 0.00 O ATOM 30 CB VAL A 46 16.074 0.484 0.344 1.00 0.00 C ATOM 31 CG1 VAL A 46 14.601 0.691 0.709 1.00 0.00 C ATOM 32 CG2 VAL A 46 16.613 1.753 -0.320 1.00 0.00 C ATOM 0 H VAL A 46 18.553 0.394 0.280 1.00 0.00 H new ATOM 0 HA VAL A 46 16.737 0.972 2.341 1.00 0.00 H new ATOM 0 HB VAL A 46 16.156 -0.359 -0.343 1.00 0.00 H new ATOM 0 HG11 VAL A 46 14.029 0.903 -0.194 1.00 0.00 H new ATOM 0 HG12 VAL A 46 14.213 -0.212 1.181 1.00 0.00 H new ATOM 0 HG13 VAL A 46 14.512 1.529 1.400 1.00 0.00 H new ATOM 0 HG21 VAL A 46 16.032 1.969 -1.217 1.00 0.00 H new ATOM 0 HG22 VAL A 46 16.533 2.589 0.375 1.00 0.00 H new ATOM 0 HG23 VAL A 46 17.658 1.606 -0.591 1.00 0.00 H new ATOM 42 N PRO A 47 15.735 -1.193 3.308 1.00 0.00 N ATOM 43 CA PRO A 47 15.292 -2.470 3.898 1.00 0.00 C ATOM 44 C PRO A 47 14.506 -3.280 2.857 1.00 0.00 C ATOM 45 O PRO A 47 14.025 -2.749 1.876 1.00 0.00 O ATOM 46 CB PRO A 47 14.403 -2.074 5.102 1.00 0.00 C ATOM 47 CG PRO A 47 14.413 -0.521 5.199 1.00 0.00 C ATOM 48 CD PRO A 47 15.309 0.012 4.058 1.00 0.00 C ATOM 0 HA PRO A 47 16.124 -3.099 4.216 1.00 0.00 H new ATOM 0 HB2 PRO A 47 13.386 -2.443 4.966 1.00 0.00 H new ATOM 0 HB3 PRO A 47 14.783 -2.518 6.022 1.00 0.00 H new ATOM 0 HG2 PRO A 47 13.401 -0.125 5.108 1.00 0.00 H new ATOM 0 HG3 PRO A 47 14.795 -0.200 6.168 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.762 0.703 3.417 1.00 0.00 H new ATOM 0 HD3 PRO A 47 16.168 0.555 4.452 1.00 0.00 H new ATOM 56 N ALA A 48 14.373 -4.561 3.067 1.00 0.00 N ATOM 57 CA ALA A 48 13.621 -5.403 2.094 1.00 0.00 C ATOM 58 C ALA A 48 12.119 -5.269 2.358 1.00 0.00 C ATOM 59 O ALA A 48 11.340 -6.134 2.011 1.00 0.00 O ATOM 60 CB ALA A 48 14.040 -6.866 2.258 1.00 0.00 C ATOM 0 H ALA A 48 14.753 -5.061 3.871 1.00 0.00 H new ATOM 0 HA ALA A 48 13.842 -5.073 1.079 1.00 0.00 H new ATOM 0 HB1 ALA A 48 13.491 -7.484 1.547 1.00 0.00 H new ATOM 0 HB2 ALA A 48 15.110 -6.961 2.071 1.00 0.00 H new ATOM 0 HB3 ALA A 48 13.818 -7.196 3.273 1.00 0.00 H new ATOM 66 N PHE A 49 11.707 -4.190 2.971 1.00 0.00 N ATOM 67 CA PHE A 49 10.254 -3.989 3.263 1.00 0.00 C ATOM 68 C PHE A 49 9.643 -3.072 2.201 1.00 0.00 C ATOM 69 O PHE A 49 8.700 -3.432 1.523 1.00 0.00 O ATOM 70 CB PHE A 49 10.100 -3.342 4.641 1.00 0.00 C ATOM 71 CG PHE A 49 8.635 -3.271 5.005 1.00 0.00 C ATOM 72 CD1 PHE A 49 7.856 -2.180 4.575 1.00 0.00 C ATOM 73 CD2 PHE A 49 8.049 -4.294 5.775 1.00 0.00 C ATOM 74 CE1 PHE A 49 6.491 -2.113 4.914 1.00 0.00 C ATOM 75 CE2 PHE A 49 6.683 -4.227 6.113 1.00 0.00 C ATOM 76 CZ PHE A 49 5.905 -3.135 5.683 1.00 0.00 C ATOM 0 H PHE A 49 12.317 -3.435 3.284 1.00 0.00 H new ATOM 0 HA PHE A 49 9.743 -4.952 3.251 1.00 0.00 H new ATOM 0 HB2 PHE A 49 10.644 -3.920 5.388 1.00 0.00 H new ATOM 0 HB3 PHE A 49 10.533 -2.342 4.635 1.00 0.00 H new ATOM 0 HD1 PHE A 49 8.305 -1.395 3.985 1.00 0.00 H new ATOM 0 HD2 PHE A 49 8.647 -5.130 6.107 1.00 0.00 H new ATOM 0 HE1 PHE A 49 5.893 -1.276 4.583 1.00 0.00 H new ATOM 0 HE2 PHE A 49 6.233 -5.013 6.702 1.00 0.00 H new ATOM 0 HZ PHE A 49 4.858 -3.082 5.944 1.00 0.00 H new ATOM 86 N LEU A 50 10.170 -1.889 2.052 1.00 0.00 N ATOM 87 CA LEU A 50 9.618 -0.947 1.037 1.00 0.00 C ATOM 88 C LEU A 50 10.009 -1.418 -0.363 1.00 0.00 C ATOM 89 O LEU A 50 9.186 -1.487 -1.254 1.00 0.00 O ATOM 90 CB LEU A 50 10.183 0.456 1.278 1.00 0.00 C ATOM 91 CG LEU A 50 9.847 0.918 2.705 1.00 0.00 C ATOM 92 CD1 LEU A 50 10.754 2.088 3.088 1.00 0.00 C ATOM 93 CD2 LEU A 50 8.381 1.368 2.789 1.00 0.00 C ATOM 0 H LEU A 50 10.960 -1.533 2.590 1.00 0.00 H new ATOM 0 HA LEU A 50 8.532 -0.921 1.122 1.00 0.00 H new ATOM 0 HB2 LEU A 50 11.263 0.452 1.133 1.00 0.00 H new ATOM 0 HB3 LEU A 50 9.766 1.155 0.553 1.00 0.00 H new ATOM 0 HG LEU A 50 10.004 0.085 3.390 1.00 0.00 H new ATOM 0 HD11 LEU A 50 10.516 2.416 4.100 1.00 0.00 H new ATOM 0 HD12 LEU A 50 11.796 1.770 3.045 1.00 0.00 H new ATOM 0 HD13 LEU A 50 10.597 2.913 2.393 1.00 0.00 H new ATOM 0 HD21 LEU A 50 8.158 1.692 3.805 1.00 0.00 H new ATOM 0 HD22 LEU A 50 8.214 2.195 2.099 1.00 0.00 H new ATOM 0 HD23 LEU A 50 7.729 0.536 2.522 1.00 0.00 H new ATOM 105 N ALA A 51 11.255 -1.746 -0.569 1.00 0.00 N ATOM 106 CA ALA A 51 11.687 -2.215 -1.917 1.00 0.00 C ATOM 107 C ALA A 51 10.715 -3.289 -2.412 1.00 0.00 C ATOM 108 O ALA A 51 10.488 -3.439 -3.596 1.00 0.00 O ATOM 109 CB ALA A 51 13.098 -2.800 -1.829 1.00 0.00 C ATOM 0 H ALA A 51 11.991 -1.710 0.136 1.00 0.00 H new ATOM 0 HA ALA A 51 11.690 -1.376 -2.613 1.00 0.00 H new ATOM 0 HB1 ALA A 51 13.412 -3.142 -2.815 1.00 0.00 H new ATOM 0 HB2 ALA A 51 13.788 -2.034 -1.474 1.00 0.00 H new ATOM 0 HB3 ALA A 51 13.101 -3.641 -1.135 1.00 0.00 H new ATOM 115 N LYS A 52 10.132 -4.032 -1.509 1.00 0.00 N ATOM 116 CA LYS A 52 9.168 -5.086 -1.925 1.00 0.00 C ATOM 117 C LYS A 52 7.880 -4.420 -2.414 1.00 0.00 C ATOM 118 O LYS A 52 7.360 -4.750 -3.460 1.00 0.00 O ATOM 119 CB LYS A 52 8.857 -6.000 -0.733 1.00 0.00 C ATOM 120 CG LYS A 52 9.996 -7.003 -0.536 1.00 0.00 C ATOM 121 CD LYS A 52 9.632 -7.977 0.587 1.00 0.00 C ATOM 122 CE LYS A 52 10.792 -8.947 0.821 1.00 0.00 C ATOM 123 NZ LYS A 52 10.316 -10.099 1.639 1.00 0.00 N ATOM 0 H LYS A 52 10.283 -3.953 -0.503 1.00 0.00 H new ATOM 0 HA LYS A 52 9.600 -5.683 -2.728 1.00 0.00 H new ATOM 0 HB2 LYS A 52 8.726 -5.403 0.170 1.00 0.00 H new ATOM 0 HB3 LYS A 52 7.920 -6.530 -0.904 1.00 0.00 H new ATOM 0 HG2 LYS A 52 10.177 -7.550 -1.461 1.00 0.00 H new ATOM 0 HG3 LYS A 52 10.919 -6.477 -0.291 1.00 0.00 H new ATOM 0 HD2 LYS A 52 9.414 -7.427 1.503 1.00 0.00 H new ATOM 0 HD3 LYS A 52 8.730 -8.530 0.325 1.00 0.00 H new ATOM 0 HE2 LYS A 52 11.183 -9.301 -0.133 1.00 0.00 H new ATOM 0 HE3 LYS A 52 11.609 -8.438 1.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 10.828 -10.959 1.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 10.490 -9.905 2.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 9.297 -10.237 1.484 1.00 0.00 H new ATOM 137 N LEU A 53 7.361 -3.480 -1.668 1.00 0.00 N ATOM 138 CA LEU A 53 6.109 -2.799 -2.105 1.00 0.00 C ATOM 139 C LEU A 53 6.286 -2.314 -3.547 1.00 0.00 C ATOM 140 O LEU A 53 5.337 -2.221 -4.301 1.00 0.00 O ATOM 141 CB LEU A 53 5.814 -1.603 -1.179 1.00 0.00 C ATOM 142 CG LEU A 53 5.050 -2.072 0.076 1.00 0.00 C ATOM 143 CD1 LEU A 53 5.277 -1.081 1.225 1.00 0.00 C ATOM 144 CD2 LEU A 53 3.544 -2.149 -0.223 1.00 0.00 C ATOM 0 H LEU A 53 7.748 -3.157 -0.781 1.00 0.00 H new ATOM 0 HA LEU A 53 5.272 -3.496 -2.053 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.747 -1.122 -0.886 1.00 0.00 H new ATOM 0 HB3 LEU A 53 5.226 -0.857 -1.714 1.00 0.00 H new ATOM 0 HG LEU A 53 5.418 -3.058 0.360 1.00 0.00 H new ATOM 0 HD11 LEU A 53 4.735 -1.418 2.109 1.00 0.00 H new ATOM 0 HD12 LEU A 53 6.342 -1.025 1.452 1.00 0.00 H new ATOM 0 HD13 LEU A 53 4.916 -0.095 0.932 1.00 0.00 H new ATOM 0 HD21 LEU A 53 3.013 -2.481 0.669 1.00 0.00 H new ATOM 0 HD22 LEU A 53 3.181 -1.164 -0.516 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.370 -2.856 -1.034 1.00 0.00 H new ATOM 156 N TRP A 54 7.493 -2.011 -3.938 1.00 0.00 N ATOM 157 CA TRP A 54 7.724 -1.542 -5.333 1.00 0.00 C ATOM 158 C TRP A 54 7.466 -2.706 -6.293 1.00 0.00 C ATOM 159 O TRP A 54 6.752 -2.574 -7.267 1.00 0.00 O ATOM 160 CB TRP A 54 9.176 -1.052 -5.474 1.00 0.00 C ATOM 161 CG TRP A 54 9.288 -0.097 -6.623 1.00 0.00 C ATOM 162 CD1 TRP A 54 9.403 1.247 -6.504 1.00 0.00 C ATOM 163 CD2 TRP A 54 9.299 -0.383 -8.053 1.00 0.00 C ATOM 164 NE1 TRP A 54 9.483 1.806 -7.767 1.00 0.00 N ATOM 165 CE2 TRP A 54 9.424 0.846 -8.756 1.00 0.00 C ATOM 166 CE3 TRP A 54 9.212 -1.578 -8.807 1.00 0.00 C ATOM 167 CZ2 TRP A 54 9.462 0.889 -10.157 1.00 0.00 C ATOM 168 CZ3 TRP A 54 9.250 -1.539 -10.217 1.00 0.00 C ATOM 169 CH2 TRP A 54 9.374 -0.307 -10.890 1.00 0.00 C ATOM 0 H TRP A 54 8.327 -2.068 -3.354 1.00 0.00 H new ATOM 0 HA TRP A 54 7.050 -0.719 -5.570 1.00 0.00 H new ATOM 0 HB2 TRP A 54 9.494 -0.564 -4.553 1.00 0.00 H new ATOM 0 HB3 TRP A 54 9.841 -1.901 -5.631 1.00 0.00 H new ATOM 0 HD1 TRP A 54 9.428 1.794 -5.573 1.00 0.00 H new ATOM 0 HE1 TRP A 54 9.574 2.806 -7.945 1.00 0.00 H new ATOM 0 HE3 TRP A 54 9.116 -2.526 -8.299 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 9.558 1.835 -10.669 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 9.184 -2.457 -10.783 1.00 0.00 H new ATOM 0 HH2 TRP A 54 9.401 -0.282 -11.969 1.00 0.00 H new ATOM 180 N ARG A 55 8.038 -3.848 -6.020 1.00 0.00 N ATOM 181 CA ARG A 55 7.820 -5.023 -6.912 1.00 0.00 C ATOM 182 C ARG A 55 6.361 -5.469 -6.797 1.00 0.00 C ATOM 183 O ARG A 55 5.665 -5.606 -7.784 1.00 0.00 O ATOM 184 CB ARG A 55 8.736 -6.177 -6.487 1.00 0.00 C ATOM 185 CG ARG A 55 10.171 -5.663 -6.286 1.00 0.00 C ATOM 186 CD ARG A 55 10.764 -5.163 -7.624 1.00 0.00 C ATOM 187 NE ARG A 55 12.165 -5.672 -7.785 1.00 0.00 N ATOM 188 CZ ARG A 55 13.033 -5.592 -6.810 1.00 0.00 C ATOM 189 NH1 ARG A 55 12.734 -4.967 -5.705 1.00 0.00 N ATOM 190 NH2 ARG A 55 14.221 -6.114 -6.955 1.00 0.00 N ATOM 0 H ARG A 55 8.646 -4.018 -5.219 1.00 0.00 H new ATOM 0 HA ARG A 55 8.047 -4.746 -7.941 1.00 0.00 H new ATOM 0 HB2 ARG A 55 8.368 -6.623 -5.563 1.00 0.00 H new ATOM 0 HB3 ARG A 55 8.724 -6.960 -7.245 1.00 0.00 H new ATOM 0 HG2 ARG A 55 10.174 -4.854 -5.556 1.00 0.00 H new ATOM 0 HG3 ARG A 55 10.795 -6.460 -5.881 1.00 0.00 H new ATOM 0 HD2 ARG A 55 10.147 -5.504 -8.455 1.00 0.00 H new ATOM 0 HD3 ARG A 55 10.759 -4.073 -7.649 1.00 0.00 H new ATOM 0 HE ARG A 55 12.447 -6.089 -8.672 1.00 0.00 H new ATOM 0 HH11 ARG A 55 11.816 -4.535 -5.596 1.00 0.00 H new ATOM 0 HH12 ARG A 55 13.418 -4.910 -4.950 1.00 0.00 H new ATOM 0 HH21 ARG A 55 14.469 -6.582 -7.826 1.00 0.00 H new ATOM 0 HH22 ARG A 55 14.901 -6.054 -6.197 1.00 0.00 H new ATOM 204 N LEU A 56 5.889 -5.687 -5.598 1.00 0.00 N ATOM 205 CA LEU A 56 4.470 -6.112 -5.412 1.00 0.00 C ATOM 206 C LEU A 56 3.571 -5.210 -6.258 1.00 0.00 C ATOM 207 O LEU A 56 2.692 -5.669 -6.961 1.00 0.00 O ATOM 208 CB LEU A 56 4.096 -5.981 -3.930 1.00 0.00 C ATOM 209 CG LEU A 56 2.589 -6.189 -3.731 1.00 0.00 C ATOM 210 CD1 LEU A 56 2.151 -7.505 -4.384 1.00 0.00 C ATOM 211 CD2 LEU A 56 2.285 -6.238 -2.229 1.00 0.00 C ATOM 0 H LEU A 56 6.427 -5.589 -4.737 1.00 0.00 H new ATOM 0 HA LEU A 56 4.342 -7.149 -5.723 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.650 -6.714 -3.344 1.00 0.00 H new ATOM 0 HB3 LEU A 56 4.384 -4.996 -3.563 1.00 0.00 H new ATOM 0 HG LEU A 56 2.045 -5.365 -4.194 1.00 0.00 H new ATOM 0 HD11 LEU A 56 1.080 -7.645 -4.238 1.00 0.00 H new ATOM 0 HD12 LEU A 56 2.371 -7.472 -5.451 1.00 0.00 H new ATOM 0 HD13 LEU A 56 2.691 -8.335 -3.928 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.216 -6.386 -2.079 1.00 0.00 H new ATOM 0 HD22 LEU A 56 2.833 -7.063 -1.774 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.590 -5.300 -1.765 1.00 0.00 H new ATOM 223 N VAL A 57 3.799 -3.927 -6.205 1.00 0.00 N ATOM 224 CA VAL A 57 2.976 -2.988 -7.013 1.00 0.00 C ATOM 225 C VAL A 57 3.316 -3.185 -8.492 1.00 0.00 C ATOM 226 O VAL A 57 4.401 -2.866 -8.934 1.00 0.00 O ATOM 227 CB VAL A 57 3.295 -1.549 -6.592 1.00 0.00 C ATOM 228 CG1 VAL A 57 2.642 -0.565 -7.565 1.00 0.00 C ATOM 229 CG2 VAL A 57 2.755 -1.299 -5.180 1.00 0.00 C ATOM 0 H VAL A 57 4.522 -3.488 -5.635 1.00 0.00 H new ATOM 0 HA VAL A 57 1.915 -3.181 -6.853 1.00 0.00 H new ATOM 0 HB VAL A 57 4.375 -1.404 -6.604 1.00 0.00 H new ATOM 0 HG11 VAL A 57 2.873 0.456 -7.260 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.026 -0.739 -8.570 1.00 0.00 H new ATOM 0 HG13 VAL A 57 1.562 -0.710 -7.559 1.00 0.00 H new ATOM 0 HG21 VAL A 57 2.981 -0.276 -4.880 1.00 0.00 H new ATOM 0 HG22 VAL A 57 1.675 -1.449 -5.171 1.00 0.00 H new ATOM 0 HG23 VAL A 57 3.224 -1.994 -4.483 1.00 0.00 H new ATOM 239 N ASP A 58 2.399 -3.717 -9.256 1.00 0.00 N ATOM 240 CA ASP A 58 2.663 -3.947 -10.707 1.00 0.00 C ATOM 241 C ASP A 58 3.699 -5.066 -10.869 1.00 0.00 C ATOM 242 O ASP A 58 4.092 -5.703 -9.912 1.00 0.00 O ATOM 243 CB ASP A 58 3.190 -2.649 -11.349 1.00 0.00 C ATOM 244 CG ASP A 58 2.849 -2.627 -12.843 1.00 0.00 C ATOM 245 OD1 ASP A 58 1.672 -2.641 -13.163 1.00 0.00 O ATOM 246 OD2 ASP A 58 3.773 -2.597 -13.641 1.00 0.00 O ATOM 0 H ASP A 58 1.474 -4.004 -8.936 1.00 0.00 H new ATOM 0 HA ASP A 58 1.737 -4.241 -11.202 1.00 0.00 H new ATOM 0 HB2 ASP A 58 2.749 -1.784 -10.854 1.00 0.00 H new ATOM 0 HB3 ASP A 58 4.269 -2.578 -11.213 1.00 0.00 H new ATOM 251 N ASP A 59 4.144 -5.302 -12.074 1.00 0.00 N ATOM 252 CA ASP A 59 5.158 -6.371 -12.307 1.00 0.00 C ATOM 253 C ASP A 59 4.620 -7.723 -11.827 1.00 0.00 C ATOM 254 O ASP A 59 5.278 -8.432 -11.093 1.00 0.00 O ATOM 255 CB ASP A 59 6.440 -6.033 -11.541 1.00 0.00 C ATOM 256 CG ASP A 59 6.769 -4.550 -11.722 1.00 0.00 C ATOM 257 OD1 ASP A 59 6.495 -4.029 -12.791 1.00 0.00 O ATOM 258 OD2 ASP A 59 7.288 -3.960 -10.789 1.00 0.00 O ATOM 0 H ASP A 59 3.848 -4.799 -12.910 1.00 0.00 H new ATOM 0 HA ASP A 59 5.371 -6.432 -13.374 1.00 0.00 H new ATOM 0 HB2 ASP A 59 6.314 -6.262 -10.483 1.00 0.00 H new ATOM 0 HB3 ASP A 59 7.265 -6.646 -11.904 1.00 0.00 H new ATOM 263 N ALA A 60 3.437 -8.089 -12.242 1.00 0.00 N ATOM 264 CA ALA A 60 2.864 -9.401 -11.814 1.00 0.00 C ATOM 265 C ALA A 60 1.373 -9.440 -12.159 1.00 0.00 C ATOM 266 O ALA A 60 0.855 -8.571 -12.830 1.00 0.00 O ATOM 267 CB ALA A 60 3.051 -9.578 -10.297 1.00 0.00 C ATOM 0 H ALA A 60 2.841 -7.537 -12.859 1.00 0.00 H new ATOM 0 HA ALA A 60 3.378 -10.210 -12.334 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.632 -10.536 -9.988 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.114 -9.552 -10.056 1.00 0.00 H new ATOM 0 HB3 ALA A 60 2.540 -8.772 -9.771 1.00 0.00 H new ATOM 273 N ASP A 61 0.680 -10.451 -11.699 1.00 0.00 N ATOM 274 CA ASP A 61 -0.777 -10.560 -11.989 1.00 0.00 C ATOM 275 C ASP A 61 -1.578 -9.937 -10.844 1.00 0.00 C ATOM 276 O ASP A 61 -2.553 -10.494 -10.380 1.00 0.00 O ATOM 277 CB ASP A 61 -1.158 -12.035 -12.136 1.00 0.00 C ATOM 278 CG ASP A 61 -0.637 -12.567 -13.473 1.00 0.00 C ATOM 279 OD1 ASP A 61 -0.626 -11.807 -14.427 1.00 0.00 O ATOM 280 OD2 ASP A 61 -0.261 -13.727 -13.520 1.00 0.00 O ATOM 0 H ASP A 61 1.065 -11.207 -11.133 1.00 0.00 H new ATOM 0 HA ASP A 61 -1.002 -10.031 -12.915 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -0.737 -12.614 -11.314 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -2.241 -12.149 -12.085 1.00 0.00 H new ATOM 285 N THR A 62 -1.172 -8.783 -10.385 1.00 0.00 N ATOM 286 CA THR A 62 -1.900 -8.107 -9.268 1.00 0.00 C ATOM 287 C THR A 62 -2.815 -7.024 -9.845 1.00 0.00 C ATOM 288 O THR A 62 -3.204 -6.100 -9.161 1.00 0.00 O ATOM 289 CB THR A 62 -0.881 -7.459 -8.329 1.00 0.00 C ATOM 290 OG1 THR A 62 -0.506 -6.188 -8.845 1.00 0.00 O ATOM 291 CG2 THR A 62 0.354 -8.351 -8.220 1.00 0.00 C ATOM 0 H THR A 62 -0.361 -8.275 -10.738 1.00 0.00 H new ATOM 0 HA THR A 62 -2.497 -8.836 -8.720 1.00 0.00 H new ATOM 0 HB THR A 62 -1.324 -7.335 -7.341 1.00 0.00 H new ATOM 0 HG1 THR A 62 -1.212 -5.536 -8.653 1.00 0.00 H new ATOM 0 HG21 THR A 62 1.079 -7.888 -7.551 1.00 0.00 H new ATOM 0 HG22 THR A 62 0.066 -9.325 -7.825 1.00 0.00 H new ATOM 0 HG23 THR A 62 0.800 -8.477 -9.207 1.00 0.00 H new ATOM 299 N ASN A 63 -3.160 -7.130 -11.102 1.00 0.00 N ATOM 300 CA ASN A 63 -4.048 -6.105 -11.726 1.00 0.00 C ATOM 301 C ASN A 63 -5.457 -6.234 -11.145 1.00 0.00 C ATOM 302 O ASN A 63 -6.371 -6.689 -11.802 1.00 0.00 O ATOM 303 CB ASN A 63 -4.096 -6.325 -13.239 1.00 0.00 C ATOM 304 CG ASN A 63 -5.101 -5.354 -13.864 1.00 0.00 C ATOM 305 OD1 ASN A 63 -6.168 -5.753 -14.284 1.00 0.00 O ATOM 306 ND2 ASN A 63 -4.800 -4.087 -13.945 1.00 0.00 N ATOM 0 H ASN A 63 -2.865 -7.883 -11.724 1.00 0.00 H new ATOM 0 HA ASN A 63 -3.658 -5.109 -11.518 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -3.107 -6.170 -13.671 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -4.383 -7.353 -13.459 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -5.461 -3.431 -14.361 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -3.903 -3.752 -13.592 1.00 0.00 H new ATOM 313 N ARG A 64 -5.629 -5.838 -9.912 1.00 0.00 N ATOM 314 CA ARG A 64 -6.966 -5.932 -9.251 1.00 0.00 C ATOM 315 C ARG A 64 -6.751 -5.813 -7.742 1.00 0.00 C ATOM 316 O ARG A 64 -7.445 -5.090 -7.055 1.00 0.00 O ATOM 317 CB ARG A 64 -7.624 -7.293 -9.602 1.00 0.00 C ATOM 318 CG ARG A 64 -8.481 -7.833 -8.427 1.00 0.00 C ATOM 319 CD ARG A 64 -9.508 -8.886 -8.921 1.00 0.00 C ATOM 320 NE ARG A 64 -9.433 -10.126 -8.075 1.00 0.00 N ATOM 321 CZ ARG A 64 -8.310 -10.776 -7.908 1.00 0.00 C ATOM 322 NH1 ARG A 64 -7.235 -10.405 -8.549 1.00 0.00 N ATOM 323 NH2 ARG A 64 -8.272 -11.813 -7.119 1.00 0.00 N ATOM 0 H ARG A 64 -4.891 -5.448 -9.326 1.00 0.00 H new ATOM 0 HA ARG A 64 -7.627 -5.136 -9.595 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -8.250 -7.178 -10.487 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -6.850 -8.018 -9.852 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -7.831 -8.280 -7.674 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -9.005 -7.007 -7.946 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -10.514 -8.470 -8.879 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -9.310 -9.136 -9.963 1.00 0.00 H new ATOM 0 HE ARG A 64 -10.279 -10.469 -7.620 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -7.269 -9.606 -9.182 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -6.361 -10.914 -8.417 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -9.117 -12.116 -6.634 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.398 -12.322 -6.987 1.00 0.00 H new ATOM 337 N LEU A 65 -5.808 -6.540 -7.228 1.00 0.00 N ATOM 338 CA LEU A 65 -5.546 -6.509 -5.769 1.00 0.00 C ATOM 339 C LEU A 65 -4.727 -5.266 -5.415 1.00 0.00 C ATOM 340 O LEU A 65 -4.850 -4.720 -4.337 1.00 0.00 O ATOM 341 CB LEU A 65 -4.768 -7.769 -5.368 1.00 0.00 C ATOM 342 CG LEU A 65 -5.431 -9.037 -5.951 1.00 0.00 C ATOM 343 CD1 LEU A 65 -4.429 -10.187 -5.969 1.00 0.00 C ATOM 344 CD2 LEU A 65 -6.634 -9.454 -5.094 1.00 0.00 C ATOM 0 H LEU A 65 -5.200 -7.162 -7.762 1.00 0.00 H new ATOM 0 HA LEU A 65 -6.494 -6.476 -5.231 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -3.740 -7.695 -5.724 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -4.724 -7.844 -4.281 1.00 0.00 H new ATOM 0 HG LEU A 65 -5.763 -8.812 -6.965 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.904 -11.077 -6.381 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -3.573 -9.914 -6.586 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -4.093 -10.393 -4.953 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -7.090 -10.349 -5.518 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -6.301 -9.663 -4.077 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -7.366 -8.647 -5.077 1.00 0.00 H new ATOM 356 N ILE A 66 -3.892 -4.804 -6.310 1.00 0.00 N ATOM 357 CA ILE A 66 -3.081 -3.591 -6.003 1.00 0.00 C ATOM 358 C ILE A 66 -2.570 -2.958 -7.301 1.00 0.00 C ATOM 359 O ILE A 66 -2.218 -3.637 -8.245 1.00 0.00 O ATOM 360 CB ILE A 66 -1.900 -3.976 -5.097 1.00 0.00 C ATOM 361 CG1 ILE A 66 -0.952 -2.765 -4.929 1.00 0.00 C ATOM 362 CG2 ILE A 66 -1.142 -5.168 -5.702 1.00 0.00 C ATOM 363 CD1 ILE A 66 -0.195 -2.867 -3.596 1.00 0.00 C ATOM 0 H ILE A 66 -3.738 -5.211 -7.232 1.00 0.00 H new ATOM 0 HA ILE A 66 -3.705 -2.863 -5.484 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.279 -4.265 -4.117 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -0.243 -2.731 -5.757 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.525 -1.838 -4.961 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -0.307 -5.435 -5.054 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.816 -6.019 -5.794 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -0.764 -4.897 -6.688 1.00 0.00 H new ATOM 0 HD11 ILE A 66 0.469 -2.010 -3.488 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -0.909 -2.879 -2.772 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.392 -3.785 -3.580 1.00 0.00 H new ATOM 375 N CYS A 67 -2.538 -1.652 -7.355 1.00 0.00 N ATOM 376 CA CYS A 67 -2.060 -0.962 -8.586 1.00 0.00 C ATOM 377 C CYS A 67 -1.655 0.476 -8.242 1.00 0.00 C ATOM 378 O CYS A 67 -1.571 0.847 -7.088 1.00 0.00 O ATOM 379 CB CYS A 67 -3.184 -0.946 -9.626 1.00 0.00 C ATOM 380 SG CYS A 67 -2.491 -0.581 -11.259 1.00 0.00 S ATOM 0 H CYS A 67 -2.824 -1.033 -6.596 1.00 0.00 H new ATOM 0 HA CYS A 67 -1.198 -1.491 -8.991 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -3.693 -1.910 -9.642 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -3.930 -0.197 -9.360 1.00 0.00 H new ATOM 0 HG CYS A 67 -3.445 -0.570 -12.142 1.00 0.00 H new ATOM 386 N TRP A 68 -1.402 1.287 -9.236 1.00 0.00 N ATOM 387 CA TRP A 68 -1.001 2.704 -8.972 1.00 0.00 C ATOM 388 C TRP A 68 -2.248 3.593 -8.933 1.00 0.00 C ATOM 389 O TRP A 68 -3.334 3.165 -9.266 1.00 0.00 O ATOM 390 CB TRP A 68 -0.080 3.183 -10.095 1.00 0.00 C ATOM 391 CG TRP A 68 1.211 2.432 -10.045 1.00 0.00 C ATOM 392 CD1 TRP A 68 1.443 1.239 -10.644 1.00 0.00 C ATOM 393 CD2 TRP A 68 2.450 2.801 -9.374 1.00 0.00 C ATOM 394 NE1 TRP A 68 2.746 0.853 -10.386 1.00 0.00 N ATOM 395 CE2 TRP A 68 3.410 1.779 -9.607 1.00 0.00 C ATOM 396 CE3 TRP A 68 2.836 3.915 -8.592 1.00 0.00 C ATOM 397 CZ2 TRP A 68 4.708 1.858 -9.082 1.00 0.00 C ATOM 398 CZ3 TRP A 68 4.141 3.998 -8.060 1.00 0.00 C ATOM 399 CH2 TRP A 68 5.075 2.972 -8.306 1.00 0.00 C ATOM 0 H TRP A 68 -1.455 1.030 -10.222 1.00 0.00 H new ATOM 0 HA TRP A 68 -0.482 2.762 -8.015 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -0.561 3.033 -11.061 1.00 0.00 H new ATOM 0 HB3 TRP A 68 0.106 4.252 -9.994 1.00 0.00 H new ATOM 0 HD1 TRP A 68 0.727 0.680 -11.228 1.00 0.00 H new ATOM 0 HE1 TRP A 68 3.165 -0.011 -10.730 1.00 0.00 H new ATOM 0 HE3 TRP A 68 2.127 4.707 -8.401 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 5.421 1.069 -9.272 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 4.425 4.851 -7.462 1.00 0.00 H new ATOM 0 HH2 TRP A 68 6.073 3.041 -7.899 1.00 0.00 H new ATOM 410 N THR A 69 -2.095 4.835 -8.533 1.00 0.00 N ATOM 411 CA THR A 69 -3.266 5.773 -8.474 1.00 0.00 C ATOM 412 C THR A 69 -2.895 7.087 -9.165 1.00 0.00 C ATOM 413 O THR A 69 -1.744 7.344 -9.454 1.00 0.00 O ATOM 414 CB THR A 69 -3.626 6.061 -7.014 1.00 0.00 C ATOM 415 OG1 THR A 69 -2.510 6.652 -6.363 1.00 0.00 O ATOM 416 CG2 THR A 69 -4.000 4.760 -6.307 1.00 0.00 C ATOM 0 H THR A 69 -1.206 5.242 -8.243 1.00 0.00 H new ATOM 0 HA THR A 69 -4.119 5.316 -8.975 1.00 0.00 H new ATOM 0 HB THR A 69 -4.475 6.744 -6.979 1.00 0.00 H new ATOM 0 HG1 THR A 69 -1.898 7.021 -7.033 1.00 0.00 H new ATOM 0 HG21 THR A 69 -4.255 4.971 -5.268 1.00 0.00 H new ATOM 0 HG22 THR A 69 -4.857 4.308 -6.807 1.00 0.00 H new ATOM 0 HG23 THR A 69 -3.155 4.072 -6.341 1.00 0.00 H new ATOM 424 N LYS A 70 -3.864 7.923 -9.429 1.00 0.00 N ATOM 425 CA LYS A 70 -3.570 9.222 -10.099 1.00 0.00 C ATOM 426 C LYS A 70 -2.642 8.987 -11.294 1.00 0.00 C ATOM 427 O LYS A 70 -2.556 7.895 -11.820 1.00 0.00 O ATOM 428 CB LYS A 70 -2.891 10.166 -9.105 1.00 0.00 C ATOM 429 CG LYS A 70 -3.836 10.443 -7.934 1.00 0.00 C ATOM 430 CD LYS A 70 -3.296 11.608 -7.104 1.00 0.00 C ATOM 431 CE LYS A 70 -4.310 11.979 -6.021 1.00 0.00 C ATOM 432 NZ LYS A 70 -3.746 13.057 -5.158 1.00 0.00 N ATOM 0 H LYS A 70 -4.847 7.762 -9.209 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.502 9.668 -10.447 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -1.965 9.722 -8.741 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -2.624 11.100 -9.599 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -4.833 10.680 -8.306 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -3.931 9.553 -7.312 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -2.345 11.333 -6.647 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -3.104 12.467 -7.746 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -5.240 12.315 -6.479 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -4.550 11.104 -5.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -4.436 13.309 -4.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -2.869 12.721 -4.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -3.539 13.894 -5.739 1.00 0.00 H new ATOM 446 N ASP A 71 -1.945 10.003 -11.724 1.00 0.00 N ATOM 447 CA ASP A 71 -1.023 9.836 -12.884 1.00 0.00 C ATOM 448 C ASP A 71 0.040 8.791 -12.541 1.00 0.00 C ATOM 449 O ASP A 71 0.841 8.414 -13.373 1.00 0.00 O ATOM 450 CB ASP A 71 -0.345 11.172 -13.190 1.00 0.00 C ATOM 451 CG ASP A 71 -1.392 12.180 -13.667 1.00 0.00 C ATOM 452 OD1 ASP A 71 -1.793 12.088 -14.816 1.00 0.00 O ATOM 453 OD2 ASP A 71 -1.775 13.026 -12.876 1.00 0.00 O ATOM 0 H ASP A 71 -1.974 10.940 -11.323 1.00 0.00 H new ATOM 0 HA ASP A 71 -1.588 9.507 -13.756 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.158 11.549 -12.299 1.00 0.00 H new ATOM 0 HB3 ASP A 71 0.420 11.037 -13.955 1.00 0.00 H new ATOM 458 N GLY A 72 0.050 8.318 -11.321 1.00 0.00 N ATOM 459 CA GLY A 72 1.059 7.290 -10.912 1.00 0.00 C ATOM 460 C GLY A 72 1.573 7.602 -9.503 1.00 0.00 C ATOM 461 O GLY A 72 2.489 6.970 -9.013 1.00 0.00 O ATOM 0 H GLY A 72 -0.599 8.600 -10.586 1.00 0.00 H new ATOM 0 HA2 GLY A 72 0.610 6.297 -10.934 1.00 0.00 H new ATOM 0 HA3 GLY A 72 1.889 7.280 -11.618 1.00 0.00 H new ATOM 465 N GLN A 73 0.996 8.575 -8.845 1.00 0.00 N ATOM 466 CA GLN A 73 1.455 8.933 -7.471 1.00 0.00 C ATOM 467 C GLN A 73 0.667 8.130 -6.430 1.00 0.00 C ATOM 468 O GLN A 73 -0.546 8.082 -6.461 1.00 0.00 O ATOM 469 CB GLN A 73 1.223 10.427 -7.237 1.00 0.00 C ATOM 470 CG GLN A 73 1.727 11.218 -8.447 1.00 0.00 C ATOM 471 CD GLN A 73 3.193 10.866 -8.714 1.00 0.00 C ATOM 472 OE1 GLN A 73 3.492 9.800 -9.215 1.00 0.00 O ATOM 473 NE2 GLN A 73 4.125 11.724 -8.401 1.00 0.00 N ATOM 0 H GLN A 73 0.224 9.138 -9.202 1.00 0.00 H new ATOM 0 HA GLN A 73 2.516 8.701 -7.374 1.00 0.00 H new ATOM 0 HB2 GLN A 73 0.162 10.621 -7.079 1.00 0.00 H new ATOM 0 HB3 GLN A 73 1.744 10.750 -6.336 1.00 0.00 H new ATOM 0 HG2 GLN A 73 1.121 10.987 -9.323 1.00 0.00 H new ATOM 0 HG3 GLN A 73 1.627 12.288 -8.263 1.00 0.00 H new ATOM 0 HE21 GLN A 73 3.874 12.619 -7.981 1.00 0.00 H new ATOM 0 HE22 GLN A 73 5.104 11.500 -8.577 1.00 0.00 H new ATOM 482 N SER A 74 1.354 7.508 -5.508 1.00 0.00 N ATOM 483 CA SER A 74 0.661 6.711 -4.453 1.00 0.00 C ATOM 484 C SER A 74 0.134 5.405 -5.055 1.00 0.00 C ATOM 485 O SER A 74 0.299 5.149 -6.233 1.00 0.00 O ATOM 486 CB SER A 74 -0.493 7.538 -3.865 1.00 0.00 C ATOM 487 OG SER A 74 -0.165 8.918 -3.946 1.00 0.00 O ATOM 0 H SER A 74 2.372 7.518 -5.440 1.00 0.00 H new ATOM 0 HA SER A 74 1.363 6.467 -3.655 1.00 0.00 H new ATOM 0 HB2 SER A 74 -1.415 7.338 -4.411 1.00 0.00 H new ATOM 0 HB3 SER A 74 -0.669 7.254 -2.828 1.00 0.00 H new ATOM 0 HG SER A 74 -0.335 9.346 -3.081 1.00 0.00 H new ATOM 493 N PHE A 75 -0.494 4.569 -4.261 1.00 0.00 N ATOM 494 CA PHE A 75 -1.020 3.274 -4.803 1.00 0.00 C ATOM 495 C PHE A 75 -2.353 2.943 -4.134 1.00 0.00 C ATOM 496 O PHE A 75 -2.805 3.647 -3.253 1.00 0.00 O ATOM 497 CB PHE A 75 -0.012 2.157 -4.523 1.00 0.00 C ATOM 498 CG PHE A 75 0.138 1.966 -3.032 1.00 0.00 C ATOM 499 CD1 PHE A 75 0.809 2.935 -2.262 1.00 0.00 C ATOM 500 CD2 PHE A 75 -0.389 0.816 -2.411 1.00 0.00 C ATOM 501 CE1 PHE A 75 0.953 2.755 -0.872 1.00 0.00 C ATOM 502 CE2 PHE A 75 -0.245 0.636 -1.023 1.00 0.00 C ATOM 503 CZ PHE A 75 0.425 1.605 -0.254 1.00 0.00 C ATOM 0 H PHE A 75 -0.664 4.726 -3.268 1.00 0.00 H new ATOM 0 HA PHE A 75 -1.170 3.365 -5.879 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -0.346 1.229 -4.986 1.00 0.00 H new ATOM 0 HB3 PHE A 75 0.952 2.405 -4.966 1.00 0.00 H new ATOM 0 HD1 PHE A 75 1.213 3.817 -2.737 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -0.904 0.072 -3.001 1.00 0.00 H new ATOM 0 HE1 PHE A 75 1.468 3.498 -0.281 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -0.649 -0.246 -0.548 1.00 0.00 H new ATOM 0 HZ PHE A 75 0.535 1.467 0.812 1.00 0.00 H new ATOM 513 N VAL A 76 -2.994 1.875 -4.543 1.00 0.00 N ATOM 514 CA VAL A 76 -4.305 1.505 -3.926 1.00 0.00 C ATOM 515 C VAL A 76 -4.445 -0.011 -3.853 1.00 0.00 C ATOM 516 O VAL A 76 -3.739 -0.751 -4.506 1.00 0.00 O ATOM 517 CB VAL A 76 -5.455 2.079 -4.762 1.00 0.00 C ATOM 518 CG1 VAL A 76 -5.295 1.651 -6.223 1.00 0.00 C ATOM 519 CG2 VAL A 76 -6.803 1.569 -4.229 1.00 0.00 C ATOM 0 H VAL A 76 -2.667 1.245 -5.276 1.00 0.00 H new ATOM 0 HA VAL A 76 -4.344 1.918 -2.918 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.430 3.167 -4.693 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -6.114 2.061 -6.814 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -4.347 2.024 -6.610 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -5.310 0.563 -6.287 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -7.612 1.983 -4.830 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -6.829 0.481 -4.286 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -6.926 1.881 -3.192 1.00 0.00 H new ATOM 529 N ILE A 77 -5.370 -0.466 -3.056 1.00 0.00 N ATOM 530 CA ILE A 77 -5.614 -1.931 -2.902 1.00 0.00 C ATOM 531 C ILE A 77 -7.132 -2.155 -2.890 1.00 0.00 C ATOM 532 O ILE A 77 -7.824 -1.729 -1.990 1.00 0.00 O ATOM 533 CB ILE A 77 -4.975 -2.414 -1.584 1.00 0.00 C ATOM 534 CG1 ILE A 77 -3.440 -2.487 -1.750 1.00 0.00 C ATOM 535 CG2 ILE A 77 -5.527 -3.802 -1.216 1.00 0.00 C ATOM 536 CD1 ILE A 77 -2.748 -2.305 -0.394 1.00 0.00 C ATOM 0 H ILE A 77 -5.980 0.126 -2.493 1.00 0.00 H new ATOM 0 HA ILE A 77 -5.169 -2.495 -3.722 1.00 0.00 H new ATOM 0 HB ILE A 77 -5.218 -1.712 -0.786 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.160 -3.447 -2.183 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.105 -1.715 -2.443 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -5.073 -4.139 -0.284 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -6.608 -3.742 -1.092 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.292 -4.510 -2.011 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -1.667 -2.359 -0.527 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -3.014 -1.334 0.023 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -3.069 -3.093 0.287 1.00 0.00 H new ATOM 548 N GLN A 78 -7.656 -2.791 -3.902 1.00 0.00 N ATOM 549 CA GLN A 78 -9.131 -3.010 -3.968 1.00 0.00 C ATOM 550 C GLN A 78 -9.606 -3.903 -2.819 1.00 0.00 C ATOM 551 O GLN A 78 -9.999 -3.427 -1.772 1.00 0.00 O ATOM 552 CB GLN A 78 -9.487 -3.668 -5.304 1.00 0.00 C ATOM 553 CG GLN A 78 -9.001 -2.785 -6.454 1.00 0.00 C ATOM 554 CD GLN A 78 -9.490 -3.360 -7.785 1.00 0.00 C ATOM 555 OE1 GLN A 78 -10.649 -3.960 -7.840 1.00 0.00 O flip ATOM 556 NE2 GLN A 78 -8.810 -3.264 -8.788 1.00 0.00 N flip ATOM 0 H GLN A 78 -7.127 -3.169 -4.687 1.00 0.00 H new ATOM 0 HA GLN A 78 -9.628 -2.044 -3.881 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -9.027 -4.654 -5.370 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -10.565 -3.814 -5.374 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -9.373 -1.768 -6.327 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -7.912 -2.730 -6.448 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -7.905 -2.796 -8.747 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -9.145 -3.652 -9.670 1.00 0.00 H new ATOM 565 N ASN A 79 -9.597 -5.194 -3.013 1.00 0.00 N ATOM 566 CA ASN A 79 -10.076 -6.114 -1.941 1.00 0.00 C ATOM 567 C ASN A 79 -8.993 -6.305 -0.881 1.00 0.00 C ATOM 568 O ASN A 79 -7.823 -6.083 -1.123 1.00 0.00 O ATOM 569 CB ASN A 79 -10.426 -7.468 -2.560 1.00 0.00 C ATOM 570 CG ASN A 79 -11.406 -7.264 -3.716 1.00 0.00 C ATOM 571 OD1 ASN A 79 -11.615 -6.153 -4.161 1.00 0.00 O ATOM 572 ND2 ASN A 79 -12.020 -8.296 -4.225 1.00 0.00 N ATOM 0 H ASN A 79 -9.279 -5.652 -3.867 1.00 0.00 H new ATOM 0 HA ASN A 79 -10.958 -5.681 -1.469 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -9.522 -7.960 -2.919 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -10.867 -8.121 -1.807 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -12.675 -8.170 -4.996 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -11.845 -9.229 -3.852 1.00 0.00 H new ATOM 579 N GLN A 80 -9.384 -6.721 0.297 1.00 0.00 N ATOM 580 CA GLN A 80 -8.400 -6.943 1.401 1.00 0.00 C ATOM 581 C GLN A 80 -8.179 -8.448 1.575 1.00 0.00 C ATOM 582 O GLN A 80 -7.136 -8.887 2.020 1.00 0.00 O ATOM 583 CB GLN A 80 -8.959 -6.360 2.700 1.00 0.00 C ATOM 584 CG GLN A 80 -8.896 -4.832 2.642 1.00 0.00 C ATOM 585 CD GLN A 80 -9.658 -4.246 3.833 1.00 0.00 C ATOM 586 OE1 GLN A 80 -10.840 -3.725 3.642 1.00 0.00 O flip ATOM 587 NE2 GLN A 80 -9.175 -4.261 4.947 1.00 0.00 N flip ATOM 0 H GLN A 80 -10.354 -6.919 0.544 1.00 0.00 H new ATOM 0 HA GLN A 80 -7.455 -6.456 1.160 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -9.989 -6.687 2.844 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -8.386 -6.726 3.552 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -7.858 -4.499 2.661 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -9.329 -4.474 1.708 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -8.252 -4.668 5.097 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -9.693 -3.867 5.733 1.00 0.00 H new ATOM 596 N ALA A 81 -9.159 -9.241 1.230 1.00 0.00 N ATOM 597 CA ALA A 81 -9.020 -10.717 1.373 1.00 0.00 C ATOM 598 C ALA A 81 -8.004 -11.241 0.363 1.00 0.00 C ATOM 599 O ALA A 81 -6.818 -11.304 0.623 1.00 0.00 O ATOM 600 CB ALA A 81 -10.367 -11.387 1.096 1.00 0.00 C ATOM 0 H ALA A 81 -10.053 -8.927 0.854 1.00 0.00 H new ATOM 0 HA ALA A 81 -8.688 -10.943 2.386 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -10.265 -12.467 1.201 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -11.108 -11.022 1.807 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -10.690 -11.150 0.082 1.00 0.00 H new ATOM 606 N GLN A 82 -8.476 -11.629 -0.788 1.00 0.00 N ATOM 607 CA GLN A 82 -7.575 -12.169 -1.843 1.00 0.00 C ATOM 608 C GLN A 82 -6.317 -11.301 -1.949 1.00 0.00 C ATOM 609 O GLN A 82 -5.308 -11.713 -2.486 1.00 0.00 O ATOM 610 CB GLN A 82 -8.346 -12.182 -3.178 1.00 0.00 C ATOM 611 CG GLN A 82 -8.059 -13.473 -3.944 1.00 0.00 C ATOM 612 CD GLN A 82 -6.574 -13.539 -4.305 1.00 0.00 C ATOM 613 OE1 GLN A 82 -6.068 -12.637 -5.101 1.00 0.00 O flip ATOM 614 NE2 GLN A 82 -5.867 -14.420 -3.857 1.00 0.00 N flip ATOM 0 H GLN A 82 -9.462 -11.594 -1.046 1.00 0.00 H new ATOM 0 HA GLN A 82 -7.262 -13.183 -1.594 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -9.416 -12.094 -2.989 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -8.057 -11.321 -3.781 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -8.334 -14.336 -3.338 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -8.665 -13.513 -4.849 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -6.263 -15.125 -3.235 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -4.878 -14.455 -4.103 1.00 0.00 H new ATOM 623 N PHE A 83 -6.370 -10.111 -1.433 1.00 0.00 N ATOM 624 CA PHE A 83 -5.184 -9.217 -1.489 1.00 0.00 C ATOM 625 C PHE A 83 -4.129 -9.719 -0.489 1.00 0.00 C ATOM 626 O PHE A 83 -3.217 -9.012 -0.110 1.00 0.00 O ATOM 627 CB PHE A 83 -5.649 -7.782 -1.172 1.00 0.00 C ATOM 628 CG PHE A 83 -4.499 -6.919 -0.694 1.00 0.00 C ATOM 629 CD1 PHE A 83 -3.512 -6.477 -1.596 1.00 0.00 C ATOM 630 CD2 PHE A 83 -4.409 -6.577 0.669 1.00 0.00 C ATOM 631 CE1 PHE A 83 -2.435 -5.694 -1.130 1.00 0.00 C ATOM 632 CE2 PHE A 83 -3.338 -5.794 1.132 1.00 0.00 C ATOM 633 CZ PHE A 83 -2.351 -5.354 0.235 1.00 0.00 C ATOM 0 H PHE A 83 -7.189 -9.715 -0.971 1.00 0.00 H new ATOM 0 HA PHE A 83 -4.726 -9.220 -2.478 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -6.093 -7.337 -2.062 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -6.426 -7.810 -0.408 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -3.579 -6.737 -2.642 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -5.165 -6.918 1.361 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -1.675 -5.355 -1.819 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -3.274 -5.531 2.177 1.00 0.00 H new ATOM 0 HZ PHE A 83 -1.527 -4.754 0.592 1.00 0.00 H new ATOM 643 N ALA A 84 -4.233 -10.949 -0.074 1.00 0.00 N ATOM 644 CA ALA A 84 -3.231 -11.495 0.884 1.00 0.00 C ATOM 645 C ALA A 84 -3.093 -13.002 0.680 1.00 0.00 C ATOM 646 O ALA A 84 -2.024 -13.557 0.813 1.00 0.00 O ATOM 647 CB ALA A 84 -3.692 -11.209 2.317 1.00 0.00 C ATOM 0 H ALA A 84 -4.966 -11.600 -0.355 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.265 -11.021 0.710 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.961 -11.607 3.021 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -3.785 -10.133 2.461 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -4.658 -11.683 2.490 1.00 0.00 H new ATOM 653 N LYS A 85 -4.167 -13.666 0.368 1.00 0.00 N ATOM 654 CA LYS A 85 -4.106 -15.143 0.170 1.00 0.00 C ATOM 655 C LYS A 85 -2.929 -15.521 -0.742 1.00 0.00 C ATOM 656 O LYS A 85 -2.620 -16.686 -0.896 1.00 0.00 O ATOM 657 CB LYS A 85 -5.419 -15.625 -0.469 1.00 0.00 C ATOM 658 CG LYS A 85 -6.496 -15.786 0.607 1.00 0.00 C ATOM 659 CD LYS A 85 -6.628 -14.484 1.400 1.00 0.00 C ATOM 660 CE LYS A 85 -7.878 -14.547 2.273 1.00 0.00 C ATOM 661 NZ LYS A 85 -9.091 -14.552 1.408 1.00 0.00 N ATOM 0 H LYS A 85 -5.090 -13.250 0.240 1.00 0.00 H new ATOM 0 HA LYS A 85 -3.964 -15.620 1.140 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -5.750 -14.911 -1.223 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -5.258 -16.575 -0.979 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -7.450 -16.041 0.146 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -6.236 -16.606 1.276 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.745 -14.332 2.021 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.689 -13.635 0.719 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -7.857 -15.444 2.892 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -7.905 -13.693 2.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -9.923 -14.290 1.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -8.969 -13.867 0.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -9.229 -15.503 1.009 1.00 0.00 H new ATOM 675 N GLU A 86 -2.275 -14.574 -1.370 1.00 0.00 N ATOM 676 CA GLU A 86 -1.146 -14.953 -2.277 1.00 0.00 C ATOM 677 C GLU A 86 -0.139 -13.806 -2.446 1.00 0.00 C ATOM 678 O GLU A 86 0.829 -13.946 -3.166 1.00 0.00 O ATOM 679 CB GLU A 86 -1.715 -15.308 -3.657 1.00 0.00 C ATOM 680 CG GLU A 86 -2.477 -16.638 -3.591 1.00 0.00 C ATOM 681 CD GLU A 86 -2.720 -17.155 -5.009 1.00 0.00 C ATOM 682 OE1 GLU A 86 -2.457 -16.415 -5.943 1.00 0.00 O ATOM 683 OE2 GLU A 86 -3.166 -18.284 -5.139 1.00 0.00 O ATOM 0 H GLU A 86 -2.468 -13.575 -1.297 1.00 0.00 H new ATOM 0 HA GLU A 86 -0.628 -15.802 -1.831 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -2.381 -14.516 -3.998 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -0.906 -15.380 -4.384 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -1.906 -17.369 -3.019 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -3.427 -16.500 -3.075 1.00 0.00 H new ATOM 690 N LEU A 87 -0.347 -12.672 -1.815 1.00 0.00 N ATOM 691 CA LEU A 87 0.619 -11.530 -1.983 1.00 0.00 C ATOM 692 C LEU A 87 1.490 -11.352 -0.732 1.00 0.00 C ATOM 693 O LEU A 87 2.621 -10.915 -0.829 1.00 0.00 O ATOM 694 CB LEU A 87 -0.160 -10.236 -2.244 1.00 0.00 C ATOM 695 CG LEU A 87 -0.978 -10.356 -3.540 1.00 0.00 C ATOM 696 CD1 LEU A 87 -1.772 -9.063 -3.747 1.00 0.00 C ATOM 697 CD2 LEU A 87 -0.045 -10.588 -4.748 1.00 0.00 C ATOM 0 H LEU A 87 -1.136 -12.486 -1.196 1.00 0.00 H new ATOM 0 HA LEU A 87 1.270 -11.755 -2.828 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -0.824 -10.028 -1.405 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.531 -9.397 -2.319 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.657 -11.205 -3.458 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.356 -9.138 -4.664 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.442 -8.908 -2.901 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.083 -8.221 -3.823 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.641 -10.671 -5.657 1.00 0.00 H new ATOM 0 HD22 LEU A 87 0.645 -9.749 -4.841 1.00 0.00 H new ATOM 0 HD23 LEU A 87 0.520 -11.508 -4.600 1.00 0.00 H new ATOM 709 N LEU A 88 0.996 -11.665 0.440 1.00 0.00 N ATOM 710 CA LEU A 88 1.836 -11.482 1.670 1.00 0.00 C ATOM 711 C LEU A 88 2.681 -12.737 2.010 1.00 0.00 C ATOM 712 O LEU A 88 3.756 -12.588 2.556 1.00 0.00 O ATOM 713 CB LEU A 88 0.943 -11.121 2.865 1.00 0.00 C ATOM 714 CG LEU A 88 0.117 -9.864 2.543 1.00 0.00 C ATOM 715 CD1 LEU A 88 -0.911 -9.630 3.656 1.00 0.00 C ATOM 716 CD2 LEU A 88 1.035 -8.633 2.428 1.00 0.00 C ATOM 0 H LEU A 88 0.059 -12.035 0.601 1.00 0.00 H new ATOM 0 HA LEU A 88 2.532 -10.670 1.462 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.279 -11.953 3.098 1.00 0.00 H new ATOM 0 HB3 LEU A 88 1.557 -10.946 3.749 1.00 0.00 H new ATOM 0 HG LEU A 88 -0.394 -10.013 1.592 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -1.497 -8.739 3.429 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.574 -10.492 3.726 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -0.394 -9.492 4.606 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.435 -7.752 2.200 1.00 0.00 H new ATOM 0 HD22 LEU A 88 1.559 -8.481 3.371 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.761 -8.794 1.631 1.00 0.00 H new ATOM 728 N PRO A 89 2.204 -13.937 1.717 1.00 0.00 N ATOM 729 CA PRO A 89 2.968 -15.157 2.046 1.00 0.00 C ATOM 730 C PRO A 89 4.234 -15.241 1.182 1.00 0.00 C ATOM 731 O PRO A 89 5.302 -15.565 1.663 1.00 0.00 O ATOM 732 CB PRO A 89 1.999 -16.328 1.747 1.00 0.00 C ATOM 733 CG PRO A 89 0.678 -15.708 1.207 1.00 0.00 C ATOM 734 CD PRO A 89 0.907 -14.188 1.060 1.00 0.00 C ATOM 0 HA PRO A 89 3.305 -15.173 3.082 1.00 0.00 H new ATOM 0 HB2 PRO A 89 2.432 -17.008 1.014 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.810 -16.910 2.649 1.00 0.00 H new ATOM 0 HG2 PRO A 89 0.411 -16.150 0.247 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -0.147 -15.907 1.891 1.00 0.00 H new ATOM 0 HD2 PRO A 89 0.931 -13.891 0.011 1.00 0.00 H new ATOM 0 HD3 PRO A 89 0.107 -13.620 1.534 1.00 0.00 H new ATOM 742 N LEU A 90 4.126 -14.953 -0.087 1.00 0.00 N ATOM 743 CA LEU A 90 5.327 -15.020 -0.967 1.00 0.00 C ATOM 744 C LEU A 90 6.146 -13.740 -0.802 1.00 0.00 C ATOM 745 O LEU A 90 6.836 -13.312 -1.707 1.00 0.00 O ATOM 746 CB LEU A 90 4.895 -15.165 -2.434 1.00 0.00 C ATOM 747 CG LEU A 90 4.156 -16.514 -2.648 1.00 0.00 C ATOM 748 CD1 LEU A 90 2.640 -16.315 -2.528 1.00 0.00 C ATOM 749 CD2 LEU A 90 4.473 -17.069 -4.045 1.00 0.00 C ATOM 0 H LEU A 90 3.261 -14.675 -0.551 1.00 0.00 H new ATOM 0 HA LEU A 90 5.931 -15.883 -0.686 1.00 0.00 H new ATOM 0 HB2 LEU A 90 4.242 -14.337 -2.711 1.00 0.00 H new ATOM 0 HB3 LEU A 90 5.768 -15.114 -3.084 1.00 0.00 H new ATOM 0 HG LEU A 90 4.493 -17.215 -1.885 1.00 0.00 H new ATOM 0 HD11 LEU A 90 2.135 -17.269 -2.680 1.00 0.00 H new ATOM 0 HD12 LEU A 90 2.401 -15.932 -1.536 1.00 0.00 H new ATOM 0 HD13 LEU A 90 2.306 -15.603 -3.282 1.00 0.00 H new ATOM 0 HD21 LEU A 90 3.951 -18.015 -4.188 1.00 0.00 H new ATOM 0 HD22 LEU A 90 4.146 -16.357 -4.802 1.00 0.00 H new ATOM 0 HD23 LEU A 90 5.547 -17.230 -4.138 1.00 0.00 H new ATOM 761 N ASN A 91 6.079 -13.125 0.350 1.00 0.00 N ATOM 762 CA ASN A 91 6.854 -11.870 0.579 1.00 0.00 C ATOM 763 C ASN A 91 7.218 -11.757 2.062 1.00 0.00 C ATOM 764 O ASN A 91 8.365 -11.887 2.440 1.00 0.00 O ATOM 765 CB ASN A 91 6.002 -10.666 0.172 1.00 0.00 C ATOM 766 CG ASN A 91 5.789 -10.680 -1.343 1.00 0.00 C ATOM 767 OD1 ASN A 91 5.105 -11.539 -1.864 1.00 0.00 O ATOM 768 ND2 ASN A 91 6.350 -9.759 -2.077 1.00 0.00 N ATOM 0 H ASN A 91 5.520 -13.439 1.143 1.00 0.00 H new ATOM 0 HA ASN A 91 7.766 -11.892 -0.018 1.00 0.00 H new ATOM 0 HB2 ASN A 91 5.041 -10.697 0.685 1.00 0.00 H new ATOM 0 HB3 ASN A 91 6.494 -9.741 0.472 1.00 0.00 H new ATOM 0 HD21 ASN A 91 6.215 -9.760 -3.088 1.00 0.00 H new ATOM 0 HD22 ASN A 91 6.924 -9.038 -1.640 1.00 0.00 H new ATOM 775 N TYR A 92 6.249 -11.510 2.905 1.00 0.00 N ATOM 776 CA TYR A 92 6.533 -11.381 4.367 1.00 0.00 C ATOM 777 C TYR A 92 6.345 -12.740 5.049 1.00 0.00 C ATOM 778 O TYR A 92 6.374 -12.847 6.260 1.00 0.00 O ATOM 779 CB TYR A 92 5.570 -10.362 4.977 1.00 0.00 C ATOM 780 CG TYR A 92 5.665 -9.066 4.209 1.00 0.00 C ATOM 781 CD1 TYR A 92 6.660 -8.125 4.535 1.00 0.00 C ATOM 782 CD2 TYR A 92 4.761 -8.800 3.163 1.00 0.00 C ATOM 783 CE1 TYR A 92 6.750 -6.918 3.817 1.00 0.00 C ATOM 784 CE2 TYR A 92 4.851 -7.594 2.444 1.00 0.00 C ATOM 785 CZ TYR A 92 5.846 -6.652 2.770 1.00 0.00 C ATOM 786 OH TYR A 92 5.934 -5.470 2.065 1.00 0.00 O ATOM 0 H TYR A 92 5.270 -11.392 2.644 1.00 0.00 H new ATOM 0 HA TYR A 92 7.560 -11.047 4.513 1.00 0.00 H new ATOM 0 HB2 TYR A 92 4.550 -10.744 4.944 1.00 0.00 H new ATOM 0 HB3 TYR A 92 5.815 -10.195 6.026 1.00 0.00 H new ATOM 0 HD1 TYR A 92 7.355 -8.329 5.336 1.00 0.00 H new ATOM 0 HD2 TYR A 92 3.998 -9.522 2.912 1.00 0.00 H new ATOM 0 HE1 TYR A 92 7.512 -6.196 4.069 1.00 0.00 H new ATOM 0 HE2 TYR A 92 4.157 -7.391 1.642 1.00 0.00 H new ATOM 0 HH TYR A 92 5.236 -5.447 1.377 1.00 0.00 H new ATOM 796 N LYS A 93 6.164 -13.776 4.278 1.00 0.00 N ATOM 797 CA LYS A 93 5.986 -15.136 4.865 1.00 0.00 C ATOM 798 C LYS A 93 4.868 -15.120 5.915 1.00 0.00 C ATOM 799 O LYS A 93 5.031 -15.619 7.011 1.00 0.00 O ATOM 800 CB LYS A 93 7.296 -15.590 5.530 1.00 0.00 C ATOM 801 CG LYS A 93 8.364 -15.913 4.465 1.00 0.00 C ATOM 802 CD LYS A 93 9.056 -14.627 3.992 1.00 0.00 C ATOM 803 CE LYS A 93 10.261 -14.989 3.122 1.00 0.00 C ATOM 804 NZ LYS A 93 11.051 -13.760 2.832 1.00 0.00 N ATOM 0 H LYS A 93 6.131 -13.740 3.259 1.00 0.00 H new ATOM 0 HA LYS A 93 5.718 -15.828 4.066 1.00 0.00 H new ATOM 0 HB2 LYS A 93 7.663 -14.808 6.194 1.00 0.00 H new ATOM 0 HB3 LYS A 93 7.111 -16.470 6.146 1.00 0.00 H new ATOM 0 HG2 LYS A 93 9.103 -16.600 4.878 1.00 0.00 H new ATOM 0 HG3 LYS A 93 7.900 -16.417 3.617 1.00 0.00 H new ATOM 0 HD2 LYS A 93 8.357 -14.012 3.426 1.00 0.00 H new ATOM 0 HD3 LYS A 93 9.377 -14.037 4.850 1.00 0.00 H new ATOM 0 HE2 LYS A 93 10.884 -15.723 3.633 1.00 0.00 H new ATOM 0 HE3 LYS A 93 9.927 -15.447 2.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 11.636 -13.915 1.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 10.404 -12.963 2.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 11.665 -13.543 3.643 1.00 0.00 H new ATOM 818 N HIS A 94 3.729 -14.571 5.587 1.00 0.00 N ATOM 819 CA HIS A 94 2.603 -14.550 6.567 1.00 0.00 C ATOM 820 C HIS A 94 1.322 -14.081 5.872 1.00 0.00 C ATOM 821 O HIS A 94 1.355 -13.253 4.982 1.00 0.00 O ATOM 822 CB HIS A 94 2.941 -13.618 7.741 1.00 0.00 C ATOM 823 CG HIS A 94 2.916 -12.177 7.300 1.00 0.00 C ATOM 824 ND1 HIS A 94 1.810 -11.603 6.693 1.00 0.00 N ATOM 825 CD2 HIS A 94 3.852 -11.178 7.392 1.00 0.00 C ATOM 826 CE1 HIS A 94 2.106 -10.313 6.446 1.00 0.00 C ATOM 827 NE2 HIS A 94 3.338 -10.002 6.852 1.00 0.00 N ATOM 0 H HIS A 94 3.529 -14.137 4.686 1.00 0.00 H new ATOM 0 HA HIS A 94 2.449 -15.557 6.955 1.00 0.00 H new ATOM 0 HB2 HIS A 94 2.226 -13.769 8.549 1.00 0.00 H new ATOM 0 HB3 HIS A 94 3.926 -13.866 8.137 1.00 0.00 H new ATOM 0 HD2 HIS A 94 4.838 -11.287 7.819 1.00 0.00 H new ATOM 0 HE1 HIS A 94 1.429 -9.615 5.976 1.00 0.00 H new ATOM 0 HE2 HIS A 94 3.804 -9.097 6.782 1.00 0.00 H new ATOM 835 N ASN A 95 0.192 -14.609 6.267 1.00 0.00 N ATOM 836 CA ASN A 95 -1.100 -14.204 5.632 1.00 0.00 C ATOM 837 C ASN A 95 -1.775 -13.126 6.484 1.00 0.00 C ATOM 838 O ASN A 95 -2.724 -12.493 6.063 1.00 0.00 O ATOM 839 CB ASN A 95 -2.019 -15.425 5.533 1.00 0.00 C ATOM 840 CG ASN A 95 -1.207 -16.640 5.080 1.00 0.00 C ATOM 841 OD1 ASN A 95 -0.438 -16.556 4.143 1.00 0.00 O ATOM 842 ND2 ASN A 95 -1.348 -17.774 5.710 1.00 0.00 N ATOM 0 H ASN A 95 0.108 -15.307 7.006 1.00 0.00 H new ATOM 0 HA ASN A 95 -0.907 -13.808 4.635 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -2.482 -15.624 6.499 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -2.826 -15.230 4.827 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -0.812 -18.591 5.416 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -1.994 -17.844 6.496 1.00 0.00 H new ATOM 849 N ASN A 96 -1.298 -12.914 7.680 1.00 0.00 N ATOM 850 CA ASN A 96 -1.915 -11.881 8.560 1.00 0.00 C ATOM 851 C ASN A 96 -2.126 -10.586 7.768 1.00 0.00 C ATOM 852 O ASN A 96 -1.191 -9.989 7.275 1.00 0.00 O ATOM 853 CB ASN A 96 -0.990 -11.608 9.747 1.00 0.00 C ATOM 854 CG ASN A 96 -0.756 -12.906 10.521 1.00 0.00 C ATOM 855 OD1 ASN A 96 -0.495 -13.938 9.936 1.00 0.00 O ATOM 856 ND2 ASN A 96 -0.836 -12.898 11.824 1.00 0.00 N ATOM 0 H ASN A 96 -0.506 -13.412 8.086 1.00 0.00 H new ATOM 0 HA ASN A 96 -2.878 -12.242 8.922 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -0.040 -11.205 9.396 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -1.433 -10.857 10.401 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -0.679 -13.758 12.350 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -1.055 -12.032 12.316 1.00 0.00 H new ATOM 863 N MET A 97 -3.355 -10.152 7.637 1.00 0.00 N ATOM 864 CA MET A 97 -3.639 -8.899 6.871 1.00 0.00 C ATOM 865 C MET A 97 -3.699 -7.710 7.837 1.00 0.00 C ATOM 866 O MET A 97 -2.907 -6.793 7.754 1.00 0.00 O ATOM 867 CB MET A 97 -4.985 -9.053 6.147 1.00 0.00 C ATOM 868 CG MET A 97 -5.440 -7.710 5.559 1.00 0.00 C ATOM 869 SD MET A 97 -4.104 -6.976 4.579 1.00 0.00 S ATOM 870 CE MET A 97 -4.932 -5.417 4.173 1.00 0.00 C ATOM 0 H MET A 97 -4.176 -10.613 8.029 1.00 0.00 H new ATOM 0 HA MET A 97 -2.849 -8.722 6.141 1.00 0.00 H new ATOM 0 HB2 MET A 97 -4.893 -9.792 5.351 1.00 0.00 H new ATOM 0 HB3 MET A 97 -5.737 -9.425 6.842 1.00 0.00 H new ATOM 0 HG2 MET A 97 -6.321 -7.857 4.935 1.00 0.00 H new ATOM 0 HG3 MET A 97 -5.728 -7.031 6.362 1.00 0.00 H new ATOM 0 HE1 MET A 97 -4.185 -4.655 3.953 1.00 0.00 H new ATOM 0 HE2 MET A 97 -5.571 -5.561 3.302 1.00 0.00 H new ATOM 0 HE3 MET A 97 -5.539 -5.096 5.019 1.00 0.00 H new ATOM 880 N ALA A 98 -4.634 -7.716 8.748 1.00 0.00 N ATOM 881 CA ALA A 98 -4.744 -6.582 9.714 1.00 0.00 C ATOM 882 C ALA A 98 -3.369 -6.286 10.315 1.00 0.00 C ATOM 883 O ALA A 98 -3.065 -5.163 10.665 1.00 0.00 O ATOM 884 CB ALA A 98 -5.719 -6.957 10.831 1.00 0.00 C ATOM 0 H ALA A 98 -5.326 -8.456 8.866 1.00 0.00 H new ATOM 0 HA ALA A 98 -5.110 -5.697 9.194 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -5.800 -6.130 11.536 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -6.699 -7.166 10.403 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -5.354 -7.843 11.351 1.00 0.00 H new ATOM 890 N SER A 99 -2.530 -7.279 10.432 1.00 0.00 N ATOM 891 CA SER A 99 -1.177 -7.036 11.003 1.00 0.00 C ATOM 892 C SER A 99 -0.394 -6.146 10.042 1.00 0.00 C ATOM 893 O SER A 99 0.391 -5.311 10.446 1.00 0.00 O ATOM 894 CB SER A 99 -0.444 -8.366 11.178 1.00 0.00 C ATOM 895 OG SER A 99 -0.207 -8.940 9.900 1.00 0.00 O ATOM 0 H SER A 99 -2.722 -8.243 10.158 1.00 0.00 H new ATOM 0 HA SER A 99 -1.267 -6.550 11.974 1.00 0.00 H new ATOM 0 HB2 SER A 99 0.500 -8.209 11.700 1.00 0.00 H new ATOM 0 HB3 SER A 99 -1.038 -9.045 11.790 1.00 0.00 H new ATOM 0 HG SER A 99 0.724 -9.240 9.844 1.00 0.00 H new ATOM 901 N PHE A 100 -0.612 -6.315 8.768 1.00 0.00 N ATOM 902 CA PHE A 100 0.104 -5.476 7.772 1.00 0.00 C ATOM 903 C PHE A 100 -0.369 -4.028 7.908 1.00 0.00 C ATOM 904 O PHE A 100 0.424 -3.111 7.998 1.00 0.00 O ATOM 905 CB PHE A 100 -0.203 -5.986 6.362 1.00 0.00 C ATOM 906 CG PHE A 100 0.403 -5.044 5.347 1.00 0.00 C ATOM 907 CD1 PHE A 100 1.803 -4.949 5.227 1.00 0.00 C ATOM 908 CD2 PHE A 100 -0.429 -4.254 4.530 1.00 0.00 C ATOM 909 CE1 PHE A 100 2.370 -4.065 4.291 1.00 0.00 C ATOM 910 CE2 PHE A 100 0.139 -3.370 3.593 1.00 0.00 C ATOM 911 CZ PHE A 100 1.540 -3.276 3.473 1.00 0.00 C ATOM 0 H PHE A 100 -1.257 -7.000 8.374 1.00 0.00 H new ATOM 0 HA PHE A 100 1.178 -5.529 7.948 1.00 0.00 H new ATOM 0 HB2 PHE A 100 0.201 -6.990 6.230 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -1.281 -6.054 6.214 1.00 0.00 H new ATOM 0 HD1 PHE A 100 2.441 -5.555 5.853 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -1.503 -4.326 4.622 1.00 0.00 H new ATOM 0 HE1 PHE A 100 3.444 -3.992 4.200 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -0.499 -2.764 2.966 1.00 0.00 H new ATOM 0 HZ PHE A 100 1.976 -2.599 2.754 1.00 0.00 H new ATOM 921 N ILE A 101 -1.656 -3.813 7.928 1.00 0.00 N ATOM 922 CA ILE A 101 -2.172 -2.423 8.064 1.00 0.00 C ATOM 923 C ILE A 101 -1.606 -1.816 9.350 1.00 0.00 C ATOM 924 O ILE A 101 -1.234 -0.661 9.387 1.00 0.00 O ATOM 925 CB ILE A 101 -3.722 -2.455 8.080 1.00 0.00 C ATOM 926 CG1 ILE A 101 -4.219 -2.643 6.631 1.00 0.00 C ATOM 927 CG2 ILE A 101 -4.297 -1.148 8.665 1.00 0.00 C ATOM 928 CD1 ILE A 101 -5.750 -2.562 6.560 1.00 0.00 C ATOM 0 H ILE A 101 -2.370 -4.538 7.856 1.00 0.00 H new ATOM 0 HA ILE A 101 -1.858 -1.805 7.223 1.00 0.00 H new ATOM 0 HB ILE A 101 -4.059 -3.279 8.710 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -3.781 -1.878 5.990 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -3.884 -3.608 6.250 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -5.386 -1.197 8.664 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -3.940 -1.019 9.687 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -3.972 -0.303 8.058 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -6.074 -2.698 5.528 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -6.185 -3.344 7.183 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -6.080 -1.587 6.919 1.00 0.00 H new ATOM 940 N ARG A 102 -1.529 -2.581 10.403 1.00 0.00 N ATOM 941 CA ARG A 102 -0.976 -2.029 11.671 1.00 0.00 C ATOM 942 C ARG A 102 0.402 -1.426 11.386 1.00 0.00 C ATOM 943 O ARG A 102 0.737 -0.364 11.869 1.00 0.00 O ATOM 944 CB ARG A 102 -0.845 -3.152 12.709 1.00 0.00 C ATOM 945 CG ARG A 102 -2.202 -3.404 13.370 1.00 0.00 C ATOM 946 CD ARG A 102 -2.058 -4.493 14.432 1.00 0.00 C ATOM 947 NE ARG A 102 -3.325 -4.603 15.208 1.00 0.00 N ATOM 948 CZ ARG A 102 -3.545 -5.648 15.956 1.00 0.00 C ATOM 949 NH1 ARG A 102 -2.655 -6.601 16.025 1.00 0.00 N ATOM 950 NH2 ARG A 102 -4.654 -5.742 16.638 1.00 0.00 N ATOM 0 H ARG A 102 -1.823 -3.557 10.441 1.00 0.00 H new ATOM 0 HA ARG A 102 -1.642 -1.260 12.063 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -0.488 -4.064 12.230 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -0.107 -2.879 13.463 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -2.573 -2.485 13.824 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -2.933 -3.707 12.620 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -1.825 -5.447 13.960 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -1.230 -4.257 15.100 1.00 0.00 H new ATOM 0 HE ARG A 102 -4.021 -3.860 15.154 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -1.787 -6.528 15.494 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -2.827 -7.418 16.610 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -5.349 -4.998 16.586 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -4.825 -6.560 17.223 1.00 0.00 H new ATOM 964 N GLN A 103 1.201 -2.095 10.604 1.00 0.00 N ATOM 965 CA GLN A 103 2.554 -1.563 10.289 1.00 0.00 C ATOM 966 C GLN A 103 2.425 -0.261 9.494 1.00 0.00 C ATOM 967 O GLN A 103 3.291 0.590 9.540 1.00 0.00 O ATOM 968 CB GLN A 103 3.319 -2.597 9.460 1.00 0.00 C ATOM 969 CG GLN A 103 3.787 -3.736 10.369 1.00 0.00 C ATOM 970 CD GLN A 103 4.528 -4.783 9.535 1.00 0.00 C ATOM 971 OE1 GLN A 103 3.949 -5.923 9.276 1.00 0.00 O flip ATOM 972 NE2 GLN A 103 5.647 -4.561 9.115 1.00 0.00 N flip ATOM 0 H GLN A 103 0.974 -2.989 10.169 1.00 0.00 H new ATOM 0 HA GLN A 103 3.093 -1.363 11.215 1.00 0.00 H new ATOM 0 HB2 GLN A 103 2.680 -2.989 8.668 1.00 0.00 H new ATOM 0 HB3 GLN A 103 4.176 -2.129 8.976 1.00 0.00 H new ATOM 0 HG2 GLN A 103 4.442 -3.347 11.149 1.00 0.00 H new ATOM 0 HG3 GLN A 103 2.932 -4.192 10.868 1.00 0.00 H new ATOM 0 HE21 GLN A 103 6.100 -3.670 9.317 1.00 0.00 H new ATOM 0 HE22 GLN A 103 6.133 -5.266 8.560 1.00 0.00 H new ATOM 981 N LEU A 104 1.354 -0.094 8.764 1.00 0.00 N ATOM 982 CA LEU A 104 1.190 1.159 7.975 1.00 0.00 C ATOM 983 C LEU A 104 0.973 2.336 8.927 1.00 0.00 C ATOM 984 O LEU A 104 1.520 3.405 8.735 1.00 0.00 O ATOM 985 CB LEU A 104 -0.012 1.033 7.029 1.00 0.00 C ATOM 986 CG LEU A 104 0.198 -0.127 6.043 1.00 0.00 C ATOM 987 CD1 LEU A 104 -1.020 -0.222 5.112 1.00 0.00 C ATOM 988 CD2 LEU A 104 1.470 0.111 5.202 1.00 0.00 C ATOM 0 H LEU A 104 0.592 -0.766 8.681 1.00 0.00 H new ATOM 0 HA LEU A 104 2.090 1.328 7.384 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -0.921 0.867 7.607 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -0.149 1.964 6.480 1.00 0.00 H new ATOM 0 HG LEU A 104 0.314 -1.056 6.602 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -0.878 -1.043 4.409 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -1.917 -0.402 5.704 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -1.130 0.712 4.561 1.00 0.00 H new ATOM 0 HD21 LEU A 104 1.607 -0.718 4.508 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.367 1.040 4.642 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.335 0.179 5.862 1.00 0.00 H new ATOM 1000 N ASN A 105 0.188 2.159 9.955 1.00 0.00 N ATOM 1001 CA ASN A 105 -0.042 3.284 10.903 1.00 0.00 C ATOM 1002 C ASN A 105 1.284 3.653 11.581 1.00 0.00 C ATOM 1003 O ASN A 105 1.492 4.779 11.986 1.00 0.00 O ATOM 1004 CB ASN A 105 -1.092 2.877 11.952 1.00 0.00 C ATOM 1005 CG ASN A 105 -0.471 1.956 13.007 1.00 0.00 C ATOM 1006 OD1 ASN A 105 0.460 2.335 13.689 1.00 0.00 O ATOM 1007 ND2 ASN A 105 -0.957 0.757 13.175 1.00 0.00 N ATOM 0 H ASN A 105 -0.300 1.291 10.178 1.00 0.00 H new ATOM 0 HA ASN A 105 -0.417 4.152 10.361 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -1.498 3.767 12.432 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -1.924 2.370 11.464 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -0.555 0.138 13.879 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -1.739 0.439 12.602 1.00 0.00 H new ATOM 1014 N MET A 106 2.184 2.713 11.698 1.00 0.00 N ATOM 1015 CA MET A 106 3.496 3.014 12.339 1.00 0.00 C ATOM 1016 C MET A 106 4.329 3.877 11.382 1.00 0.00 C ATOM 1017 O MET A 106 5.057 4.756 11.800 1.00 0.00 O ATOM 1018 CB MET A 106 4.247 1.695 12.636 1.00 0.00 C ATOM 1019 CG MET A 106 3.887 1.153 14.029 1.00 0.00 C ATOM 1020 SD MET A 106 2.262 0.351 13.970 1.00 0.00 S ATOM 1021 CE MET A 106 2.820 -1.368 14.094 1.00 0.00 C ATOM 0 H MET A 106 2.067 1.752 11.378 1.00 0.00 H new ATOM 0 HA MET A 106 3.335 3.549 13.275 1.00 0.00 H new ATOM 0 HB2 MET A 106 3.997 0.952 11.878 1.00 0.00 H new ATOM 0 HB3 MET A 106 5.322 1.864 12.575 1.00 0.00 H new ATOM 0 HG2 MET A 106 4.643 0.441 14.360 1.00 0.00 H new ATOM 0 HG3 MET A 106 3.876 1.966 14.755 1.00 0.00 H new ATOM 0 HE1 MET A 106 2.051 -2.030 13.695 1.00 0.00 H new ATOM 0 HE2 MET A 106 3.740 -1.494 13.523 1.00 0.00 H new ATOM 0 HE3 MET A 106 3.005 -1.616 15.139 1.00 0.00 H new ATOM 1031 N TYR A 107 4.231 3.631 10.104 1.00 0.00 N ATOM 1032 CA TYR A 107 5.018 4.434 9.131 1.00 0.00 C ATOM 1033 C TYR A 107 4.329 5.784 8.902 1.00 0.00 C ATOM 1034 O TYR A 107 4.795 6.604 8.137 1.00 0.00 O ATOM 1035 CB TYR A 107 5.110 3.683 7.796 1.00 0.00 C ATOM 1036 CG TYR A 107 5.470 2.217 7.994 1.00 0.00 C ATOM 1037 CD1 TYR A 107 6.396 1.815 8.982 1.00 0.00 C ATOM 1038 CD2 TYR A 107 4.872 1.246 7.162 1.00 0.00 C ATOM 1039 CE1 TYR A 107 6.716 0.452 9.134 1.00 0.00 C ATOM 1040 CE2 TYR A 107 5.195 -0.115 7.315 1.00 0.00 C ATOM 1041 CZ TYR A 107 6.117 -0.511 8.303 1.00 0.00 C ATOM 1042 OH TYR A 107 6.437 -1.846 8.452 1.00 0.00 O ATOM 0 H TYR A 107 3.640 2.908 9.694 1.00 0.00 H new ATOM 0 HA TYR A 107 6.020 4.596 9.529 1.00 0.00 H new ATOM 0 HB2 TYR A 107 4.157 3.755 7.272 1.00 0.00 H new ATOM 0 HB3 TYR A 107 5.859 4.159 7.163 1.00 0.00 H new ATOM 0 HD1 TYR A 107 6.859 2.553 9.621 1.00 0.00 H new ATOM 0 HD2 TYR A 107 4.164 1.549 6.405 1.00 0.00 H new ATOM 0 HE1 TYR A 107 7.423 0.146 9.891 1.00 0.00 H new ATOM 0 HE2 TYR A 107 4.736 -0.855 6.676 1.00 0.00 H new ATOM 0 HH TYR A 107 6.170 -2.338 7.648 1.00 0.00 H new ATOM 1052 N GLY A 108 3.228 6.026 9.561 1.00 0.00 N ATOM 1053 CA GLY A 108 2.522 7.329 9.379 1.00 0.00 C ATOM 1054 C GLY A 108 1.707 7.300 8.084 1.00 0.00 C ATOM 1055 O GLY A 108 1.875 8.132 7.214 1.00 0.00 O ATOM 0 H GLY A 108 2.787 5.380 10.216 1.00 0.00 H new ATOM 0 HA2 GLY A 108 1.866 7.519 10.228 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.245 8.144 9.346 1.00 0.00 H new ATOM 1059 N PHE A 109 0.822 6.347 7.953 1.00 0.00 N ATOM 1060 CA PHE A 109 -0.020 6.245 6.721 1.00 0.00 C ATOM 1061 C PHE A 109 -1.411 6.823 7.001 1.00 0.00 C ATOM 1062 O PHE A 109 -1.873 6.854 8.125 1.00 0.00 O ATOM 1063 CB PHE A 109 -0.141 4.761 6.328 1.00 0.00 C ATOM 1064 CG PHE A 109 1.006 4.358 5.421 1.00 0.00 C ATOM 1065 CD1 PHE A 109 2.328 4.718 5.743 1.00 0.00 C ATOM 1066 CD2 PHE A 109 0.747 3.610 4.256 1.00 0.00 C ATOM 1067 CE1 PHE A 109 3.389 4.333 4.898 1.00 0.00 C ATOM 1068 CE2 PHE A 109 1.807 3.226 3.413 1.00 0.00 C ATOM 1069 CZ PHE A 109 3.127 3.588 3.733 1.00 0.00 C ATOM 0 H PHE A 109 0.644 5.627 8.653 1.00 0.00 H new ATOM 0 HA PHE A 109 0.439 6.806 5.907 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -0.140 4.140 7.224 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -1.091 4.589 5.822 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.530 5.289 6.637 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -0.267 3.331 4.009 1.00 0.00 H new ATOM 0 HE1 PHE A 109 4.403 4.610 5.145 1.00 0.00 H new ATOM 0 HE2 PHE A 109 1.606 2.653 2.520 1.00 0.00 H new ATOM 0 HZ PHE A 109 3.940 3.295 3.085 1.00 0.00 H new ATOM 1079 N HIS A 110 -2.082 7.273 5.976 1.00 0.00 N ATOM 1080 CA HIS A 110 -3.449 7.844 6.150 1.00 0.00 C ATOM 1081 C HIS A 110 -4.249 7.592 4.873 1.00 0.00 C ATOM 1082 O HIS A 110 -4.225 8.381 3.950 1.00 0.00 O ATOM 1083 CB HIS A 110 -3.354 9.349 6.406 1.00 0.00 C ATOM 1084 CG HIS A 110 -2.325 9.956 5.494 1.00 0.00 C ATOM 1085 ND1 HIS A 110 -0.998 10.095 5.866 1.00 0.00 N ATOM 1086 CD2 HIS A 110 -2.415 10.475 4.225 1.00 0.00 C ATOM 1087 CE1 HIS A 110 -0.348 10.677 4.843 1.00 0.00 C ATOM 1088 NE2 HIS A 110 -1.165 10.930 3.817 1.00 0.00 N ATOM 0 H HIS A 110 -1.738 7.270 5.016 1.00 0.00 H new ATOM 0 HA HIS A 110 -3.942 7.372 7.000 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -4.324 9.818 6.238 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -3.086 9.534 7.446 1.00 0.00 H new ATOM 0 HD1 HIS A 110 -0.588 9.808 6.755 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -3.318 10.523 3.634 1.00 0.00 H new ATOM 0 HE1 HIS A 110 0.706 10.911 4.850 1.00 0.00 H new ATOM 1096 N LYS A 111 -4.946 6.495 4.804 1.00 0.00 N ATOM 1097 CA LYS A 111 -5.727 6.196 3.578 1.00 0.00 C ATOM 1098 C LYS A 111 -6.945 7.110 3.494 1.00 0.00 C ATOM 1099 O LYS A 111 -7.314 7.765 4.449 1.00 0.00 O ATOM 1100 CB LYS A 111 -6.208 4.744 3.611 1.00 0.00 C ATOM 1101 CG LYS A 111 -6.921 4.441 4.956 1.00 0.00 C ATOM 1102 CD LYS A 111 -8.145 3.527 4.723 1.00 0.00 C ATOM 1103 CE LYS A 111 -8.408 2.672 5.968 1.00 0.00 C ATOM 1104 NZ LYS A 111 -8.070 3.454 7.190 1.00 0.00 N ATOM 0 H LYS A 111 -5.008 5.794 5.543 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.086 6.358 2.712 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -6.891 4.561 2.781 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -5.361 4.070 3.481 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -6.225 3.960 5.643 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -7.239 5.373 5.424 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -9.023 4.132 4.496 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -7.969 2.884 3.861 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -9.454 2.366 5.997 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -7.810 1.761 5.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -8.823 3.336 7.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -7.170 3.112 7.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -7.981 4.461 6.944 1.00 0.00 H new ATOM 1118 N ILE A 112 -7.582 7.141 2.350 1.00 0.00 N ATOM 1119 CA ILE A 112 -8.797 7.993 2.168 1.00 0.00 C ATOM 1120 C ILE A 112 -10.028 7.079 2.229 1.00 0.00 C ATOM 1121 O ILE A 112 -10.819 7.001 1.310 1.00 0.00 O ATOM 1122 CB ILE A 112 -8.721 8.742 0.802 1.00 0.00 C ATOM 1123 CG1 ILE A 112 -7.283 8.722 0.244 1.00 0.00 C ATOM 1124 CG2 ILE A 112 -9.170 10.198 0.971 1.00 0.00 C ATOM 1125 CD1 ILE A 112 -6.327 9.499 1.163 1.00 0.00 C ATOM 0 H ILE A 112 -7.309 6.606 1.526 1.00 0.00 H new ATOM 0 HA ILE A 112 -8.862 8.746 2.953 1.00 0.00 H new ATOM 0 HB ILE A 112 -9.382 8.231 0.103 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -6.941 7.692 0.145 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -7.270 9.159 -0.754 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -9.112 10.710 0.011 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -10.197 10.222 1.334 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -8.520 10.698 1.689 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -5.320 9.470 0.748 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -6.658 10.535 1.240 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -6.324 9.044 2.153 1.00 0.00 H new ATOM 1137 N THR A 113 -10.188 6.375 3.315 1.00 0.00 N ATOM 1138 CA THR A 113 -11.352 5.456 3.441 1.00 0.00 C ATOM 1139 C THR A 113 -11.588 5.150 4.927 1.00 0.00 C ATOM 1140 O THR A 113 -12.312 4.247 5.294 1.00 0.00 O ATOM 1141 CB THR A 113 -11.064 4.203 2.576 1.00 0.00 C ATOM 1142 OG1 THR A 113 -11.824 4.297 1.381 1.00 0.00 O ATOM 1143 CG2 THR A 113 -11.413 2.879 3.276 1.00 0.00 C ATOM 0 H THR A 113 -9.563 6.397 4.120 1.00 0.00 H new ATOM 0 HA THR A 113 -12.277 5.899 3.072 1.00 0.00 H new ATOM 0 HB THR A 113 -9.992 4.187 2.382 1.00 0.00 H new ATOM 0 HG1 THR A 113 -11.776 3.447 0.895 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.186 2.045 2.612 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.827 2.785 4.190 1.00 0.00 H new ATOM 0 HG23 THR A 113 -12.475 2.867 3.523 1.00 0.00 H new ATOM 1151 N SER A 114 -11.000 5.933 5.783 1.00 0.00 N ATOM 1152 CA SER A 114 -11.190 5.733 7.250 1.00 0.00 C ATOM 1153 C SER A 114 -12.378 6.574 7.722 1.00 0.00 C ATOM 1154 O SER A 114 -12.243 7.744 8.016 1.00 0.00 O ATOM 1155 CB SER A 114 -9.930 6.176 7.993 1.00 0.00 C ATOM 1156 OG SER A 114 -10.120 5.993 9.390 1.00 0.00 O ATOM 0 H SER A 114 -10.390 6.711 5.531 1.00 0.00 H new ATOM 0 HA SER A 114 -11.380 4.679 7.454 1.00 0.00 H new ATOM 0 HB2 SER A 114 -9.071 5.598 7.652 1.00 0.00 H new ATOM 0 HB3 SER A 114 -9.716 7.223 7.777 1.00 0.00 H new ATOM 0 HG SER A 114 -9.313 6.275 9.870 1.00 0.00 H new ATOM 1162 N ILE A 115 -13.543 5.988 7.795 1.00 0.00 N ATOM 1163 CA ILE A 115 -14.738 6.757 8.247 1.00 0.00 C ATOM 1164 C ILE A 115 -15.773 5.792 8.829 1.00 0.00 C ATOM 1165 O ILE A 115 -16.050 4.750 8.269 1.00 0.00 O ATOM 1166 CB ILE A 115 -15.325 7.527 7.046 1.00 0.00 C ATOM 1167 CG1 ILE A 115 -16.761 8.049 7.374 1.00 0.00 C ATOM 1168 CG2 ILE A 115 -15.308 6.634 5.789 1.00 0.00 C ATOM 1169 CD1 ILE A 115 -17.876 7.071 6.929 1.00 0.00 C ATOM 0 H ILE A 115 -13.719 5.011 7.561 1.00 0.00 H new ATOM 0 HA ILE A 115 -14.456 7.471 9.021 1.00 0.00 H new ATOM 0 HB ILE A 115 -14.706 8.401 6.843 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -16.843 8.221 8.447 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -16.913 9.011 6.885 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -15.724 7.185 4.946 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -14.282 6.344 5.562 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -15.906 5.741 5.969 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -18.850 7.489 7.184 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -17.817 6.918 5.851 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -17.747 6.116 7.438 1.00 0.00 H new ATOM 1181 N ASP A 116 -16.348 6.134 9.950 1.00 0.00 N ATOM 1182 CA ASP A 116 -17.366 5.239 10.570 1.00 0.00 C ATOM 1183 C ASP A 116 -18.711 5.437 9.865 1.00 0.00 C ATOM 1184 O ASP A 116 -18.864 5.113 8.704 1.00 0.00 O ATOM 1185 CB ASP A 116 -17.510 5.583 12.054 1.00 0.00 C ATOM 1186 CG ASP A 116 -17.790 7.079 12.208 1.00 0.00 C ATOM 1187 OD1 ASP A 116 -17.524 7.812 11.269 1.00 0.00 O ATOM 1188 OD2 ASP A 116 -18.265 7.467 13.262 1.00 0.00 O ATOM 0 H ASP A 116 -16.157 6.995 10.463 1.00 0.00 H new ATOM 0 HA ASP A 116 -17.051 4.200 10.468 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -18.321 5.003 12.495 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -16.599 5.316 12.590 1.00 0.00 H new ATOM 1193 N ASN A 117 -19.684 5.969 10.554 1.00 0.00 N ATOM 1194 CA ASN A 117 -21.013 6.187 9.915 1.00 0.00 C ATOM 1195 C ASN A 117 -20.932 7.393 8.979 1.00 0.00 C ATOM 1196 O ASN A 117 -20.411 8.433 9.331 1.00 0.00 O ATOM 1197 CB ASN A 117 -22.067 6.445 10.994 1.00 0.00 C ATOM 1198 CG ASN A 117 -21.755 7.759 11.713 1.00 0.00 C ATOM 1199 OD1 ASN A 117 -20.614 8.169 11.784 1.00 0.00 O ATOM 1200 ND2 ASN A 117 -22.729 8.441 12.251 1.00 0.00 N ATOM 0 H ASN A 117 -19.616 6.261 11.529 1.00 0.00 H new ATOM 0 HA ASN A 117 -21.292 5.301 9.345 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -23.059 6.492 10.544 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -22.080 5.622 11.708 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -22.532 9.319 12.731 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -23.687 8.096 12.191 1.00 0.00 H new ATOM 1207 N GLY A 118 -21.443 7.261 7.786 1.00 0.00 N ATOM 1208 CA GLY A 118 -21.396 8.396 6.823 1.00 0.00 C ATOM 1209 C GLY A 118 -21.533 7.858 5.397 1.00 0.00 C ATOM 1210 O GLY A 118 -20.557 7.670 4.699 1.00 0.00 O ATOM 0 H GLY A 118 -21.892 6.414 7.436 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -22.199 9.102 7.036 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -20.457 8.940 6.930 1.00 0.00 H new ATOM 1214 N GLY A 119 -22.737 7.608 4.960 1.00 0.00 N ATOM 1215 CA GLY A 119 -22.934 7.079 3.581 1.00 0.00 C ATOM 1216 C GLY A 119 -22.532 5.604 3.541 1.00 0.00 C ATOM 1217 O GLY A 119 -21.496 5.220 4.045 1.00 0.00 O ATOM 0 H GLY A 119 -23.592 7.747 5.498 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -23.976 7.192 3.282 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -22.335 7.650 2.871 1.00 0.00 H new ATOM 1221 N LEU A 120 -23.344 4.773 2.946 1.00 0.00 N ATOM 1222 CA LEU A 120 -23.008 3.323 2.876 1.00 0.00 C ATOM 1223 C LEU A 120 -22.037 3.084 1.714 1.00 0.00 C ATOM 1224 O LEU A 120 -21.957 2.000 1.176 1.00 0.00 O ATOM 1225 CB LEU A 120 -24.292 2.501 2.657 1.00 0.00 C ATOM 1226 CG LEU A 120 -25.251 3.248 1.697 1.00 0.00 C ATOM 1227 CD1 LEU A 120 -26.054 2.237 0.868 1.00 0.00 C ATOM 1228 CD2 LEU A 120 -26.227 4.126 2.501 1.00 0.00 C ATOM 0 H LEU A 120 -24.226 5.036 2.505 1.00 0.00 H new ATOM 0 HA LEU A 120 -22.541 3.012 3.811 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -24.041 1.524 2.244 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -24.787 2.325 3.612 1.00 0.00 H new ATOM 0 HG LEU A 120 -24.658 3.877 1.034 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -26.726 2.770 0.195 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -25.370 1.620 0.284 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -26.637 1.601 1.534 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -26.897 4.647 1.816 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -26.812 3.498 3.173 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -25.665 4.856 3.083 1.00 0.00 H new ATOM 1240 N ARG A 121 -21.301 4.091 1.324 1.00 0.00 N ATOM 1241 CA ARG A 121 -20.336 3.923 0.197 1.00 0.00 C ATOM 1242 C ARG A 121 -19.532 2.635 0.399 1.00 0.00 C ATOM 1243 O ARG A 121 -18.964 2.404 1.447 1.00 0.00 O ATOM 1244 CB ARG A 121 -19.377 5.120 0.159 1.00 0.00 C ATOM 1245 CG ARG A 121 -20.167 6.433 0.034 1.00 0.00 C ATOM 1246 CD ARG A 121 -20.566 6.677 -1.425 1.00 0.00 C ATOM 1247 NE ARG A 121 -21.192 8.024 -1.548 1.00 0.00 N ATOM 1248 CZ ARG A 121 -21.335 8.572 -2.723 1.00 0.00 C ATOM 1249 NH1 ARG A 121 -20.929 7.943 -3.792 1.00 0.00 N ATOM 1250 NH2 ARG A 121 -21.886 9.751 -2.829 1.00 0.00 N ATOM 0 H ARG A 121 -21.326 5.023 1.737 1.00 0.00 H new ATOM 0 HA ARG A 121 -20.885 3.867 -0.743 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -18.770 5.137 1.064 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -18.691 5.019 -0.682 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -21.059 6.390 0.660 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -19.563 7.265 0.397 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -19.689 6.611 -2.069 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -21.264 5.908 -1.756 1.00 0.00 H new ATOM 0 HE ARG A 121 -21.509 8.517 -0.713 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -20.499 7.022 -3.709 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -21.041 8.373 -4.710 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -22.204 10.242 -1.994 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -21.998 10.181 -3.747 1.00 0.00 H new ATOM 1264 N PHE A 122 -19.483 1.793 -0.598 1.00 0.00 N ATOM 1265 CA PHE A 122 -18.717 0.521 -0.462 1.00 0.00 C ATOM 1266 C PHE A 122 -18.384 -0.028 -1.857 1.00 0.00 C ATOM 1267 O PHE A 122 -18.663 -1.168 -2.173 1.00 0.00 O ATOM 1268 CB PHE A 122 -19.555 -0.495 0.334 1.00 0.00 C ATOM 1269 CG PHE A 122 -20.659 -1.074 -0.532 1.00 0.00 C ATOM 1270 CD1 PHE A 122 -21.668 -0.237 -1.048 1.00 0.00 C ATOM 1271 CD2 PHE A 122 -20.676 -2.455 -0.824 1.00 0.00 C ATOM 1272 CE1 PHE A 122 -22.691 -0.778 -1.852 1.00 0.00 C ATOM 1273 CE2 PHE A 122 -21.698 -2.993 -1.629 1.00 0.00 C ATOM 1274 CZ PHE A 122 -22.705 -2.155 -2.143 1.00 0.00 C ATOM 0 H PHE A 122 -19.940 1.931 -1.500 1.00 0.00 H new ATOM 0 HA PHE A 122 -17.785 0.703 0.072 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -18.913 -1.297 0.699 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -19.988 -0.011 1.209 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -21.657 0.820 -0.827 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -19.904 -3.099 -0.430 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -23.465 -0.136 -2.245 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -21.709 -4.050 -1.852 1.00 0.00 H new ATOM 0 HZ PHE A 122 -23.488 -2.568 -2.761 1.00 0.00 H new ATOM 1284 N ASP A 123 -17.788 0.781 -2.693 1.00 0.00 N ATOM 1285 CA ASP A 123 -17.437 0.321 -4.070 1.00 0.00 C ATOM 1286 C ASP A 123 -16.836 -1.088 -4.019 1.00 0.00 C ATOM 1287 O ASP A 123 -17.280 -1.984 -4.710 1.00 0.00 O ATOM 1288 CB ASP A 123 -16.420 1.286 -4.683 1.00 0.00 C ATOM 1289 CG ASP A 123 -17.118 2.598 -5.047 1.00 0.00 C ATOM 1290 OD1 ASP A 123 -17.286 3.421 -4.163 1.00 0.00 O ATOM 1291 OD2 ASP A 123 -17.474 2.755 -6.203 1.00 0.00 O ATOM 0 H ASP A 123 -17.528 1.744 -2.481 1.00 0.00 H new ATOM 0 HA ASP A 123 -18.340 0.300 -4.680 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -15.611 1.475 -3.977 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -15.971 0.842 -5.571 1.00 0.00 H new ATOM 1296 N ARG A 124 -15.832 -1.294 -3.211 1.00 0.00 N ATOM 1297 CA ARG A 124 -15.212 -2.645 -3.124 1.00 0.00 C ATOM 1298 C ARG A 124 -14.206 -2.645 -1.981 1.00 0.00 C ATOM 1299 O ARG A 124 -13.185 -3.299 -2.036 1.00 0.00 O ATOM 1300 CB ARG A 124 -14.495 -2.962 -4.439 1.00 0.00 C ATOM 1301 CG ARG A 124 -13.437 -1.886 -4.722 1.00 0.00 C ATOM 1302 CD ARG A 124 -13.052 -1.915 -6.202 1.00 0.00 C ATOM 1303 NE ARG A 124 -12.112 -0.796 -6.492 1.00 0.00 N ATOM 1304 CZ ARG A 124 -11.433 -0.786 -7.606 1.00 0.00 C ATOM 1305 NH1 ARG A 124 -11.582 -1.752 -8.471 1.00 0.00 N ATOM 1306 NH2 ARG A 124 -10.605 0.192 -7.858 1.00 0.00 N ATOM 0 H ARG A 124 -15.415 -0.585 -2.608 1.00 0.00 H new ATOM 0 HA ARG A 124 -15.979 -3.399 -2.945 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -14.024 -3.943 -4.380 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -15.215 -3.002 -5.257 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -13.825 -0.903 -4.457 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -12.556 -2.058 -4.104 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -12.586 -2.869 -6.449 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -13.944 -1.825 -6.823 1.00 0.00 H new ATOM 0 HE ARG A 124 -11.999 -0.038 -5.819 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -12.230 -2.516 -8.276 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -11.051 -1.743 -9.342 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -10.489 0.948 -7.184 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -10.074 0.199 -8.729 1.00 0.00 H new ATOM 1320 N ASP A 125 -14.483 -1.882 -0.960 1.00 0.00 N ATOM 1321 CA ASP A 125 -13.553 -1.783 0.196 1.00 0.00 C ATOM 1322 C ASP A 125 -12.390 -0.900 -0.232 1.00 0.00 C ATOM 1323 O ASP A 125 -11.252 -1.109 0.132 1.00 0.00 O ATOM 1324 CB ASP A 125 -13.050 -3.175 0.624 1.00 0.00 C ATOM 1325 CG ASP A 125 -14.159 -4.208 0.416 1.00 0.00 C ATOM 1326 OD1 ASP A 125 -15.212 -4.045 1.010 1.00 0.00 O ATOM 1327 OD2 ASP A 125 -13.936 -5.145 -0.332 1.00 0.00 O ATOM 0 H ASP A 125 -15.327 -1.315 -0.878 1.00 0.00 H new ATOM 0 HA ASP A 125 -14.066 -1.353 1.057 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -12.170 -3.449 0.042 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -12.747 -3.157 1.671 1.00 0.00 H new ATOM 1332 N GLU A 126 -12.697 0.083 -1.026 1.00 0.00 N ATOM 1333 CA GLU A 126 -11.663 1.017 -1.539 1.00 0.00 C ATOM 1334 C GLU A 126 -10.722 1.439 -0.396 1.00 0.00 C ATOM 1335 O GLU A 126 -10.922 2.441 0.259 1.00 0.00 O ATOM 1336 CB GLU A 126 -12.389 2.243 -2.151 1.00 0.00 C ATOM 1337 CG GLU A 126 -11.877 2.522 -3.572 1.00 0.00 C ATOM 1338 CD GLU A 126 -12.292 3.931 -4.003 1.00 0.00 C ATOM 1339 OE1 GLU A 126 -13.458 4.255 -3.855 1.00 0.00 O ATOM 1340 OE2 GLU A 126 -11.436 4.661 -4.475 1.00 0.00 O ATOM 0 H GLU A 126 -13.644 0.282 -1.348 1.00 0.00 H new ATOM 0 HA GLU A 126 -11.053 0.536 -2.304 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -13.463 2.061 -2.175 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -12.228 3.119 -1.522 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -10.792 2.427 -3.603 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -12.282 1.785 -4.266 1.00 0.00 H new ATOM 1347 N ILE A 127 -9.681 0.681 -0.180 1.00 0.00 N ATOM 1348 CA ILE A 127 -8.681 1.012 0.884 1.00 0.00 C ATOM 1349 C ILE A 127 -7.449 1.577 0.165 1.00 0.00 C ATOM 1350 O ILE A 127 -6.547 0.863 -0.224 1.00 0.00 O ATOM 1351 CB ILE A 127 -8.351 -0.264 1.698 1.00 0.00 C ATOM 1352 CG1 ILE A 127 -7.106 -0.051 2.583 1.00 0.00 C ATOM 1353 CG2 ILE A 127 -8.117 -1.453 0.763 1.00 0.00 C ATOM 1354 CD1 ILE A 127 -6.759 -1.354 3.320 1.00 0.00 C ATOM 0 H ILE A 127 -9.475 -0.170 -0.704 1.00 0.00 H new ATOM 0 HA ILE A 127 -9.059 1.747 1.594 1.00 0.00 H new ATOM 0 HB ILE A 127 -9.205 -0.476 2.341 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -6.263 0.266 1.969 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -7.293 0.746 3.303 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -7.887 -2.340 1.353 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -9.015 -1.633 0.172 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -7.283 -1.233 0.097 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -5.879 -1.196 3.943 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -7.599 -1.652 3.947 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -6.553 -2.139 2.593 1.00 0.00 H new ATOM 1366 N GLU A 128 -7.441 2.864 -0.067 1.00 0.00 N ATOM 1367 CA GLU A 128 -6.307 3.499 -0.811 1.00 0.00 C ATOM 1368 C GLU A 128 -5.296 4.117 0.153 1.00 0.00 C ATOM 1369 O GLU A 128 -5.607 5.019 0.897 1.00 0.00 O ATOM 1370 CB GLU A 128 -6.862 4.596 -1.724 1.00 0.00 C ATOM 1371 CG GLU A 128 -5.707 5.308 -2.430 1.00 0.00 C ATOM 1372 CD GLU A 128 -6.254 6.138 -3.593 1.00 0.00 C ATOM 1373 OE1 GLU A 128 -7.449 6.080 -3.826 1.00 0.00 O ATOM 1374 OE2 GLU A 128 -5.467 6.817 -4.231 1.00 0.00 O ATOM 0 H GLU A 128 -8.175 3.508 0.228 1.00 0.00 H new ATOM 0 HA GLU A 128 -5.802 2.731 -1.397 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -7.540 4.163 -2.460 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -7.441 5.311 -1.140 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -5.178 5.952 -1.727 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -4.986 4.578 -2.798 1.00 0.00 H new ATOM 1381 N PHE A 129 -4.075 3.646 0.122 1.00 0.00 N ATOM 1382 CA PHE A 129 -3.019 4.207 1.018 1.00 0.00 C ATOM 1383 C PHE A 129 -2.187 5.228 0.236 1.00 0.00 C ATOM 1384 O PHE A 129 -1.683 4.945 -0.842 1.00 0.00 O ATOM 1385 CB PHE A 129 -2.109 3.074 1.493 1.00 0.00 C ATOM 1386 CG PHE A 129 -2.810 2.276 2.570 1.00 0.00 C ATOM 1387 CD1 PHE A 129 -3.080 2.868 3.820 1.00 0.00 C ATOM 1388 CD2 PHE A 129 -3.191 0.943 2.327 1.00 0.00 C ATOM 1389 CE1 PHE A 129 -3.733 2.127 4.824 1.00 0.00 C ATOM 1390 CE2 PHE A 129 -3.842 0.201 3.330 1.00 0.00 C ATOM 1391 CZ PHE A 129 -4.114 0.793 4.578 1.00 0.00 C ATOM 0 H PHE A 129 -3.763 2.892 -0.490 1.00 0.00 H new ATOM 0 HA PHE A 129 -3.483 4.691 1.878 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -1.852 2.426 0.655 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -1.175 3.482 1.879 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -2.786 3.890 4.008 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -2.983 0.489 1.369 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -3.942 2.581 5.782 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -4.133 -0.822 3.142 1.00 0.00 H new ATOM 0 HZ PHE A 129 -4.615 0.224 5.347 1.00 0.00 H new ATOM 1401 N SER A 130 -2.038 6.420 0.761 1.00 0.00 N ATOM 1402 CA SER A 130 -1.240 7.451 0.036 1.00 0.00 C ATOM 1403 C SER A 130 -0.608 8.436 1.022 1.00 0.00 C ATOM 1404 O SER A 130 -1.293 9.089 1.785 1.00 0.00 O ATOM 1405 CB SER A 130 -2.157 8.217 -0.918 1.00 0.00 C ATOM 1406 OG SER A 130 -1.387 9.159 -1.654 1.00 0.00 O ATOM 0 H SER A 130 -2.432 6.720 1.653 1.00 0.00 H new ATOM 0 HA SER A 130 -0.447 6.952 -0.521 1.00 0.00 H new ATOM 0 HB2 SER A 130 -2.653 7.525 -1.598 1.00 0.00 H new ATOM 0 HB3 SER A 130 -2.939 8.728 -0.357 1.00 0.00 H new ATOM 0 HG SER A 130 -1.974 9.662 -2.256 1.00 0.00 H new ATOM 1412 N HIS A 131 0.697 8.575 0.984 1.00 0.00 N ATOM 1413 CA HIS A 131 1.387 9.551 1.887 1.00 0.00 C ATOM 1414 C HIS A 131 2.537 10.212 1.082 1.00 0.00 C ATOM 1415 O HIS A 131 3.091 9.572 0.211 1.00 0.00 O ATOM 1416 CB HIS A 131 1.915 8.832 3.141 1.00 0.00 C ATOM 1417 CG HIS A 131 2.994 7.845 2.797 1.00 0.00 C ATOM 1418 ND1 HIS A 131 4.333 8.187 2.827 1.00 0.00 N ATOM 1419 CD2 HIS A 131 2.954 6.509 2.483 1.00 0.00 C ATOM 1420 CE1 HIS A 131 5.042 7.078 2.546 1.00 0.00 C ATOM 1421 NE2 HIS A 131 4.249 6.027 2.327 1.00 0.00 N ATOM 0 H HIS A 131 1.316 8.052 0.364 1.00 0.00 H new ATOM 0 HA HIS A 131 0.694 10.320 2.228 1.00 0.00 H new ATOM 0 HB2 HIS A 131 2.304 9.567 3.846 1.00 0.00 H new ATOM 0 HB3 HIS A 131 1.094 8.316 3.639 1.00 0.00 H new ATOM 0 HD2 HIS A 131 2.054 5.922 2.374 1.00 0.00 H new ATOM 0 HE1 HIS A 131 6.121 7.043 2.503 1.00 0.00 H new ATOM 0 HE2 HIS A 131 4.532 5.075 2.095 1.00 0.00 H new ATOM 1429 N PRO A 132 2.838 11.481 1.340 1.00 0.00 N ATOM 1430 CA PRO A 132 3.889 12.210 0.576 1.00 0.00 C ATOM 1431 C PRO A 132 5.311 11.634 0.785 1.00 0.00 C ATOM 1432 O PRO A 132 6.270 12.378 0.854 1.00 0.00 O ATOM 1433 CB PRO A 132 3.804 13.669 1.100 1.00 0.00 C ATOM 1434 CG PRO A 132 2.912 13.652 2.368 1.00 0.00 C ATOM 1435 CD PRO A 132 2.172 12.300 2.387 1.00 0.00 C ATOM 0 HA PRO A 132 3.717 12.125 -0.497 1.00 0.00 H new ATOM 0 HB2 PRO A 132 4.797 14.052 1.334 1.00 0.00 H new ATOM 0 HB3 PRO A 132 3.380 14.326 0.341 1.00 0.00 H new ATOM 0 HG2 PRO A 132 3.518 13.772 3.266 1.00 0.00 H new ATOM 0 HG3 PRO A 132 2.202 14.479 2.350 1.00 0.00 H new ATOM 0 HD2 PRO A 132 2.244 11.824 3.365 1.00 0.00 H new ATOM 0 HD3 PRO A 132 1.111 12.428 2.172 1.00 0.00 H new ATOM 1443 N PHE A 133 5.489 10.338 0.858 1.00 0.00 N ATOM 1444 CA PHE A 133 6.882 9.807 1.032 1.00 0.00 C ATOM 1445 C PHE A 133 7.023 8.406 0.419 1.00 0.00 C ATOM 1446 O PHE A 133 7.755 7.577 0.922 1.00 0.00 O ATOM 1447 CB PHE A 133 7.240 9.765 2.520 1.00 0.00 C ATOM 1448 CG PHE A 133 7.409 11.174 3.034 1.00 0.00 C ATOM 1449 CD1 PHE A 133 6.294 11.887 3.514 1.00 0.00 C ATOM 1450 CD2 PHE A 133 8.682 11.776 3.034 1.00 0.00 C ATOM 1451 CE1 PHE A 133 6.451 13.200 3.997 1.00 0.00 C ATOM 1452 CE2 PHE A 133 8.840 13.090 3.516 1.00 0.00 C ATOM 1453 CZ PHE A 133 7.724 13.802 3.997 1.00 0.00 C ATOM 0 H PHE A 133 4.751 9.636 0.806 1.00 0.00 H new ATOM 0 HA PHE A 133 7.569 10.475 0.511 1.00 0.00 H new ATOM 0 HB2 PHE A 133 6.457 9.253 3.080 1.00 0.00 H new ATOM 0 HB3 PHE A 133 8.160 9.199 2.668 1.00 0.00 H new ATOM 0 HD1 PHE A 133 5.317 11.426 3.512 1.00 0.00 H new ATOM 0 HD2 PHE A 133 9.537 11.230 2.664 1.00 0.00 H new ATOM 0 HE1 PHE A 133 5.596 13.745 4.367 1.00 0.00 H new ATOM 0 HE2 PHE A 133 9.816 13.551 3.517 1.00 0.00 H new ATOM 0 HZ PHE A 133 7.845 14.810 4.366 1.00 0.00 H new ATOM 1463 N PHE A 134 6.353 8.134 -0.674 1.00 0.00 N ATOM 1464 CA PHE A 134 6.485 6.785 -1.316 1.00 0.00 C ATOM 1465 C PHE A 134 6.259 6.903 -2.825 1.00 0.00 C ATOM 1466 O PHE A 134 5.241 6.485 -3.340 1.00 0.00 O ATOM 1467 CB PHE A 134 5.457 5.819 -0.726 1.00 0.00 C ATOM 1468 CG PHE A 134 5.691 4.437 -1.291 1.00 0.00 C ATOM 1469 CD1 PHE A 134 6.762 3.657 -0.813 1.00 0.00 C ATOM 1470 CD2 PHE A 134 4.846 3.930 -2.298 1.00 0.00 C ATOM 1471 CE1 PHE A 134 6.988 2.371 -1.340 1.00 0.00 C ATOM 1472 CE2 PHE A 134 5.073 2.644 -2.824 1.00 0.00 C ATOM 1473 CZ PHE A 134 6.144 1.865 -2.345 1.00 0.00 C ATOM 0 H PHE A 134 5.724 8.782 -1.148 1.00 0.00 H new ATOM 0 HA PHE A 134 7.488 6.404 -1.126 1.00 0.00 H new ATOM 0 HB2 PHE A 134 5.541 5.799 0.361 1.00 0.00 H new ATOM 0 HB3 PHE A 134 4.447 6.155 -0.962 1.00 0.00 H new ATOM 0 HD1 PHE A 134 7.410 4.046 -0.042 1.00 0.00 H new ATOM 0 HD2 PHE A 134 4.025 4.527 -2.666 1.00 0.00 H new ATOM 0 HE1 PHE A 134 7.809 1.773 -0.973 1.00 0.00 H new ATOM 0 HE2 PHE A 134 4.425 2.255 -3.595 1.00 0.00 H new ATOM 0 HZ PHE A 134 6.317 0.879 -2.749 1.00 0.00 H new ATOM 1483 N LYS A 135 7.201 7.464 -3.540 1.00 0.00 N ATOM 1484 CA LYS A 135 7.042 7.609 -5.021 1.00 0.00 C ATOM 1485 C LYS A 135 8.407 7.449 -5.699 1.00 0.00 C ATOM 1486 O LYS A 135 9.404 7.196 -5.053 1.00 0.00 O ATOM 1487 CB LYS A 135 6.465 8.991 -5.333 1.00 0.00 C ATOM 1488 CG LYS A 135 5.278 9.260 -4.405 1.00 0.00 C ATOM 1489 CD LYS A 135 4.560 10.542 -4.834 1.00 0.00 C ATOM 1490 CE LYS A 135 3.630 11.020 -3.708 1.00 0.00 C ATOM 1491 NZ LYS A 135 4.409 11.836 -2.734 1.00 0.00 N ATOM 0 H LYS A 135 8.075 7.829 -3.162 1.00 0.00 H new ATOM 0 HA LYS A 135 6.365 6.842 -5.396 1.00 0.00 H new ATOM 0 HB2 LYS A 135 7.229 9.757 -5.198 1.00 0.00 H new ATOM 0 HB3 LYS A 135 6.146 9.039 -6.374 1.00 0.00 H new ATOM 0 HG2 LYS A 135 4.586 8.419 -4.433 1.00 0.00 H new ATOM 0 HG3 LYS A 135 5.624 9.354 -3.376 1.00 0.00 H new ATOM 0 HD2 LYS A 135 5.290 11.317 -5.069 1.00 0.00 H new ATOM 0 HD3 LYS A 135 3.984 10.361 -5.741 1.00 0.00 H new ATOM 0 HE2 LYS A 135 2.813 11.611 -4.122 1.00 0.00 H new ATOM 0 HE3 LYS A 135 3.181 10.164 -3.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 3.825 12.630 -2.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 4.682 11.243 -1.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 5.264 12.205 -3.196 1.00 0.00 H new ATOM 1505 N ARG A 136 8.461 7.586 -6.998 1.00 0.00 N ATOM 1506 CA ARG A 136 9.763 7.432 -7.711 1.00 0.00 C ATOM 1507 C ARG A 136 10.596 8.710 -7.543 1.00 0.00 C ATOM 1508 O ARG A 136 11.705 8.676 -7.050 1.00 0.00 O ATOM 1509 CB ARG A 136 9.494 7.164 -9.207 1.00 0.00 C ATOM 1510 CG ARG A 136 10.605 6.288 -9.805 1.00 0.00 C ATOM 1511 CD ARG A 136 11.942 7.031 -9.757 1.00 0.00 C ATOM 1512 NE ARG A 136 11.778 8.390 -10.345 1.00 0.00 N ATOM 1513 CZ ARG A 136 12.696 9.298 -10.157 1.00 0.00 C ATOM 1514 NH1 ARG A 136 13.758 9.016 -9.453 1.00 0.00 N ATOM 1515 NH2 ARG A 136 12.555 10.487 -10.675 1.00 0.00 N ATOM 0 H ARG A 136 7.661 7.797 -7.595 1.00 0.00 H new ATOM 0 HA ARG A 136 10.318 6.593 -7.291 1.00 0.00 H new ATOM 0 HB2 ARG A 136 8.530 6.670 -9.326 1.00 0.00 H new ATOM 0 HB3 ARG A 136 9.437 8.109 -9.747 1.00 0.00 H new ATOM 0 HG2 ARG A 136 10.680 5.353 -9.251 1.00 0.00 H new ATOM 0 HG3 ARG A 136 10.360 6.029 -10.835 1.00 0.00 H new ATOM 0 HD2 ARG A 136 12.290 7.109 -8.727 1.00 0.00 H new ATOM 0 HD3 ARG A 136 12.700 6.474 -10.308 1.00 0.00 H new ATOM 0 HE ARG A 136 10.948 8.611 -10.895 1.00 0.00 H new ATOM 0 HH11 ARG A 136 13.870 8.086 -9.050 1.00 0.00 H new ATOM 0 HH12 ARG A 136 14.476 9.726 -9.306 1.00 0.00 H new ATOM 0 HH21 ARG A 136 11.727 10.708 -11.228 1.00 0.00 H new ATOM 0 HH22 ARG A 136 13.273 11.196 -10.527 1.00 0.00 H new ATOM 1529 N ASN A 137 10.068 9.834 -7.950 1.00 0.00 N ATOM 1530 CA ASN A 137 10.829 11.113 -7.816 1.00 0.00 C ATOM 1531 C ASN A 137 11.439 11.204 -6.415 1.00 0.00 C ATOM 1532 O ASN A 137 11.118 10.426 -5.538 1.00 0.00 O ATOM 1533 CB ASN A 137 9.882 12.294 -8.036 1.00 0.00 C ATOM 1534 CG ASN A 137 8.709 12.199 -7.058 1.00 0.00 C ATOM 1535 OD1 ASN A 137 8.047 11.183 -6.982 1.00 0.00 O ATOM 1536 ND2 ASN A 137 8.422 13.222 -6.301 1.00 0.00 N ATOM 0 H ASN A 137 9.143 9.923 -8.370 1.00 0.00 H new ATOM 0 HA ASN A 137 11.625 11.140 -8.560 1.00 0.00 H new ATOM 0 HB2 ASN A 137 10.415 13.233 -7.890 1.00 0.00 H new ATOM 0 HB3 ASN A 137 9.514 12.292 -9.062 1.00 0.00 H new ATOM 0 HD21 ASN A 137 7.642 13.169 -5.646 1.00 0.00 H new ATOM 0 HD22 ASN A 137 8.977 14.075 -6.364 1.00 0.00 H new ATOM 1543 N SER A 138 12.320 12.144 -6.195 1.00 0.00 N ATOM 1544 CA SER A 138 12.943 12.270 -4.848 1.00 0.00 C ATOM 1545 C SER A 138 13.469 10.893 -4.405 1.00 0.00 C ATOM 1546 O SER A 138 12.804 10.201 -3.664 1.00 0.00 O ATOM 1547 CB SER A 138 11.886 12.753 -3.855 1.00 0.00 C ATOM 1548 OG SER A 138 11.584 14.117 -4.117 1.00 0.00 O ATOM 0 H SER A 138 12.633 12.826 -6.886 1.00 0.00 H new ATOM 0 HA SER A 138 13.768 12.982 -4.883 1.00 0.00 H new ATOM 0 HB2 SER A 138 10.985 12.146 -3.942 1.00 0.00 H new ATOM 0 HB3 SER A 138 12.250 12.639 -2.834 1.00 0.00 H new ATOM 0 HG SER A 138 10.905 14.429 -3.483 1.00 0.00 H new ATOM 1554 N PRO A 139 14.638 10.514 -4.887 1.00 0.00 N ATOM 1555 CA PRO A 139 15.230 9.203 -4.545 1.00 0.00 C ATOM 1556 C PRO A 139 15.631 9.152 -3.056 1.00 0.00 C ATOM 1557 O PRO A 139 16.614 8.532 -2.699 1.00 0.00 O ATOM 1558 CB PRO A 139 16.468 9.077 -5.469 1.00 0.00 C ATOM 1559 CG PRO A 139 16.575 10.394 -6.292 1.00 0.00 C ATOM 1560 CD PRO A 139 15.448 11.334 -5.813 1.00 0.00 C ATOM 0 HA PRO A 139 14.529 8.381 -4.691 1.00 0.00 H new ATOM 0 HB2 PRO A 139 17.371 8.919 -4.880 1.00 0.00 H new ATOM 0 HB3 PRO A 139 16.365 8.218 -6.132 1.00 0.00 H new ATOM 0 HG2 PRO A 139 17.550 10.859 -6.146 1.00 0.00 H new ATOM 0 HG3 PRO A 139 16.476 10.189 -7.358 1.00 0.00 H new ATOM 0 HD2 PRO A 139 15.853 12.213 -5.312 1.00 0.00 H new ATOM 0 HD3 PRO A 139 14.849 11.692 -6.651 1.00 0.00 H new ATOM 1568 N PHE A 140 14.881 9.787 -2.186 1.00 0.00 N ATOM 1569 CA PHE A 140 15.225 9.759 -0.727 1.00 0.00 C ATOM 1570 C PHE A 140 13.947 9.579 0.104 1.00 0.00 C ATOM 1571 O PHE A 140 13.991 9.519 1.317 1.00 0.00 O ATOM 1572 CB PHE A 140 15.925 11.072 -0.339 1.00 0.00 C ATOM 1573 CG PHE A 140 14.929 12.210 -0.290 1.00 0.00 C ATOM 1574 CD1 PHE A 140 14.183 12.441 0.882 1.00 0.00 C ATOM 1575 CD2 PHE A 140 14.749 13.041 -1.413 1.00 0.00 C ATOM 1576 CE1 PHE A 140 13.258 13.499 0.931 1.00 0.00 C ATOM 1577 CE2 PHE A 140 13.824 14.102 -1.363 1.00 0.00 C ATOM 1578 CZ PHE A 140 13.078 14.330 -0.190 1.00 0.00 C ATOM 0 H PHE A 140 14.046 10.323 -2.423 1.00 0.00 H new ATOM 0 HA PHE A 140 15.896 8.923 -0.528 1.00 0.00 H new ATOM 0 HB2 PHE A 140 16.407 10.961 0.632 1.00 0.00 H new ATOM 0 HB3 PHE A 140 16.710 11.299 -1.060 1.00 0.00 H new ATOM 0 HD1 PHE A 140 14.321 11.805 1.744 1.00 0.00 H new ATOM 0 HD2 PHE A 140 15.320 12.865 -2.312 1.00 0.00 H new ATOM 0 HE1 PHE A 140 12.685 13.674 1.830 1.00 0.00 H new ATOM 0 HE2 PHE A 140 13.687 14.740 -2.223 1.00 0.00 H new ATOM 0 HZ PHE A 140 12.368 15.143 -0.151 1.00 0.00 H new ATOM 1588 N LEU A 141 12.810 9.490 -0.533 1.00 0.00 N ATOM 1589 CA LEU A 141 11.542 9.312 0.235 1.00 0.00 C ATOM 1590 C LEU A 141 11.564 7.967 0.960 1.00 0.00 C ATOM 1591 O LEU A 141 10.962 7.811 2.001 1.00 0.00 O ATOM 1592 CB LEU A 141 10.339 9.342 -0.713 1.00 0.00 C ATOM 1593 CG LEU A 141 10.287 10.667 -1.484 1.00 0.00 C ATOM 1594 CD1 LEU A 141 9.041 10.675 -2.377 1.00 0.00 C ATOM 1595 CD2 LEU A 141 10.229 11.854 -0.505 1.00 0.00 C ATOM 0 H LEU A 141 12.704 9.532 -1.547 1.00 0.00 H new ATOM 0 HA LEU A 141 11.456 10.124 0.957 1.00 0.00 H new ATOM 0 HB2 LEU A 141 10.402 8.510 -1.414 1.00 0.00 H new ATOM 0 HB3 LEU A 141 9.419 9.210 -0.144 1.00 0.00 H new ATOM 0 HG LEU A 141 11.184 10.763 -2.095 1.00 0.00 H new ATOM 0 HD11 LEU A 141 8.995 11.614 -2.929 1.00 0.00 H new ATOM 0 HD12 LEU A 141 9.091 9.843 -3.079 1.00 0.00 H new ATOM 0 HD13 LEU A 141 8.149 10.574 -1.758 1.00 0.00 H new ATOM 0 HD21 LEU A 141 10.193 12.787 -1.067 1.00 0.00 H new ATOM 0 HD22 LEU A 141 9.338 11.770 0.117 1.00 0.00 H new ATOM 0 HD23 LEU A 141 11.116 11.846 0.129 1.00 0.00 H new ATOM 1607 N LEU A 142 12.238 6.990 0.418 1.00 0.00 N ATOM 1608 CA LEU A 142 12.277 5.659 1.083 1.00 0.00 C ATOM 1609 C LEU A 142 13.051 5.757 2.401 1.00 0.00 C ATOM 1610 O LEU A 142 12.508 5.552 3.468 1.00 0.00 O ATOM 1611 CB LEU A 142 12.969 4.651 0.161 1.00 0.00 C ATOM 1612 CG LEU A 142 12.419 4.782 -1.264 1.00 0.00 C ATOM 1613 CD1 LEU A 142 12.958 3.635 -2.123 1.00 0.00 C ATOM 1614 CD2 LEU A 142 10.887 4.722 -1.237 1.00 0.00 C ATOM 0 H LEU A 142 12.762 7.056 -0.455 1.00 0.00 H new ATOM 0 HA LEU A 142 11.258 5.331 1.289 1.00 0.00 H new ATOM 0 HB2 LEU A 142 14.045 4.824 0.162 1.00 0.00 H new ATOM 0 HB3 LEU A 142 12.809 3.638 0.530 1.00 0.00 H new ATOM 0 HG LEU A 142 12.734 5.737 -1.686 1.00 0.00 H new ATOM 0 HD11 LEU A 142 12.568 3.726 -3.137 1.00 0.00 H new ATOM 0 HD12 LEU A 142 14.047 3.679 -2.147 1.00 0.00 H new ATOM 0 HD13 LEU A 142 12.643 2.682 -1.697 1.00 0.00 H new ATOM 0 HD21 LEU A 142 10.501 4.816 -2.252 1.00 0.00 H new ATOM 0 HD22 LEU A 142 10.568 3.770 -0.814 1.00 0.00 H new ATOM 0 HD23 LEU A 142 10.502 5.538 -0.626 1.00 0.00 H new ATOM 1626 N ASP A 143 14.318 6.059 2.334 1.00 0.00 N ATOM 1627 CA ASP A 143 15.130 6.159 3.580 1.00 0.00 C ATOM 1628 C ASP A 143 14.489 7.155 4.551 1.00 0.00 C ATOM 1629 O ASP A 143 14.937 7.316 5.669 1.00 0.00 O ATOM 1630 CB ASP A 143 16.541 6.633 3.228 1.00 0.00 C ATOM 1631 CG ASP A 143 17.473 6.397 4.417 1.00 0.00 C ATOM 1632 OD1 ASP A 143 17.577 7.283 5.249 1.00 0.00 O ATOM 1633 OD2 ASP A 143 18.068 5.333 4.476 1.00 0.00 O ATOM 0 H ASP A 143 14.827 6.241 1.469 1.00 0.00 H new ATOM 0 HA ASP A 143 15.175 5.179 4.054 1.00 0.00 H new ATOM 0 HB2 ASP A 143 16.908 6.096 2.353 1.00 0.00 H new ATOM 0 HB3 ASP A 143 16.526 7.692 2.969 1.00 0.00 H new ATOM 1638 N GLN A 144 13.449 7.833 4.139 1.00 0.00 N ATOM 1639 CA GLN A 144 12.793 8.822 5.046 1.00 0.00 C ATOM 1640 C GLN A 144 11.679 8.141 5.847 1.00 0.00 C ATOM 1641 O GLN A 144 11.293 8.606 6.900 1.00 0.00 O ATOM 1642 CB GLN A 144 12.208 9.968 4.211 1.00 0.00 C ATOM 1643 CG GLN A 144 11.356 10.896 5.098 1.00 0.00 C ATOM 1644 CD GLN A 144 9.916 10.369 5.219 1.00 0.00 C ATOM 1645 OE1 GLN A 144 9.581 9.237 4.659 1.00 0.00 O flip ATOM 1646 NE2 GLN A 144 9.083 11.002 5.836 1.00 0.00 N flip ATOM 0 H GLN A 144 13.026 7.745 3.215 1.00 0.00 H new ATOM 0 HA GLN A 144 13.533 9.219 5.741 1.00 0.00 H new ATOM 0 HB2 GLN A 144 13.014 10.537 3.747 1.00 0.00 H new ATOM 0 HB3 GLN A 144 11.597 9.564 3.404 1.00 0.00 H new ATOM 0 HG2 GLN A 144 11.804 10.971 6.089 1.00 0.00 H new ATOM 0 HG3 GLN A 144 11.346 11.901 4.676 1.00 0.00 H new ATOM 0 HE21 GLN A 144 9.337 11.886 6.276 1.00 0.00 H new ATOM 0 HE22 GLN A 144 8.129 10.649 5.914 1.00 0.00 H new ATOM 1655 N ILE A 145 11.153 7.048 5.361 1.00 0.00 N ATOM 1656 CA ILE A 145 10.062 6.357 6.110 1.00 0.00 C ATOM 1657 C ILE A 145 10.661 5.595 7.299 1.00 0.00 C ATOM 1658 O ILE A 145 11.598 4.836 7.148 1.00 0.00 O ATOM 1659 CB ILE A 145 9.336 5.373 5.178 1.00 0.00 C ATOM 1660 CG1 ILE A 145 9.221 5.989 3.783 1.00 0.00 C ATOM 1661 CG2 ILE A 145 7.936 5.072 5.726 1.00 0.00 C ATOM 1662 CD1 ILE A 145 8.383 5.077 2.885 1.00 0.00 C ATOM 0 H ILE A 145 11.429 6.606 4.484 1.00 0.00 H new ATOM 0 HA ILE A 145 9.350 7.097 6.475 1.00 0.00 H new ATOM 0 HB ILE A 145 9.903 4.444 5.122 1.00 0.00 H new ATOM 0 HG12 ILE A 145 8.761 6.975 3.847 1.00 0.00 H new ATOM 0 HG13 ILE A 145 10.213 6.127 3.353 1.00 0.00 H new ATOM 0 HG21 ILE A 145 7.427 4.374 5.061 1.00 0.00 H new ATOM 0 HG22 ILE A 145 8.021 4.630 6.719 1.00 0.00 H new ATOM 0 HG23 ILE A 145 7.363 5.997 5.788 1.00 0.00 H new ATOM 0 HD11 ILE A 145 8.303 5.519 1.892 1.00 0.00 H new ATOM 0 HD12 ILE A 145 8.861 4.100 2.810 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.387 4.961 3.312 1.00 0.00 H new ATOM 1674 N LYS A 146 10.128 5.792 8.482 1.00 0.00 N ATOM 1675 CA LYS A 146 10.662 5.081 9.692 1.00 0.00 C ATOM 1676 C LYS A 146 9.480 4.564 10.528 1.00 0.00 C ATOM 1677 O LYS A 146 8.345 4.938 10.311 1.00 0.00 O ATOM 1678 CB LYS A 146 11.543 6.044 10.547 1.00 0.00 C ATOM 1679 CG LYS A 146 11.718 7.402 9.842 1.00 0.00 C ATOM 1680 CD LYS A 146 10.405 8.221 9.917 1.00 0.00 C ATOM 1681 CE LYS A 146 10.434 9.167 11.126 1.00 0.00 C ATOM 1682 NZ LYS A 146 11.054 8.478 12.292 1.00 0.00 N ATOM 0 H LYS A 146 9.343 6.417 8.664 1.00 0.00 H new ATOM 0 HA LYS A 146 11.283 4.244 9.375 1.00 0.00 H new ATOM 0 HB2 LYS A 146 11.082 6.194 11.524 1.00 0.00 H new ATOM 0 HB3 LYS A 146 12.519 5.592 10.721 1.00 0.00 H new ATOM 0 HG2 LYS A 146 12.530 7.960 10.309 1.00 0.00 H new ATOM 0 HG3 LYS A 146 11.998 7.245 8.800 1.00 0.00 H new ATOM 0 HD2 LYS A 146 10.274 8.796 9.000 1.00 0.00 H new ATOM 0 HD3 LYS A 146 9.552 7.547 9.995 1.00 0.00 H new ATOM 0 HE2 LYS A 146 10.998 10.067 10.882 1.00 0.00 H new ATOM 0 HE3 LYS A 146 9.421 9.484 11.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 10.890 9.038 13.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 10.628 7.536 12.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 12.077 8.379 12.133 1.00 0.00 H new ATOM 1696 N ARG A 147 9.743 3.710 11.483 1.00 0.00 N ATOM 1697 CA ARG A 147 8.639 3.173 12.331 1.00 0.00 C ATOM 1698 C ARG A 147 8.306 4.176 13.437 1.00 0.00 C ATOM 1699 O ARG A 147 8.406 3.877 14.610 1.00 0.00 O ATOM 1700 CB ARG A 147 9.073 1.848 12.963 1.00 0.00 C ATOM 1701 CG ARG A 147 7.840 1.113 13.495 1.00 0.00 C ATOM 1702 CD ARG A 147 8.274 0.036 14.486 1.00 0.00 C ATOM 1703 NE ARG A 147 9.212 -0.910 13.818 1.00 0.00 N ATOM 1704 CZ ARG A 147 9.948 -1.713 14.537 1.00 0.00 C ATOM 1705 NH1 ARG A 147 9.864 -1.685 15.839 1.00 0.00 N ATOM 1706 NH2 ARG A 147 10.769 -2.544 13.954 1.00 0.00 N ATOM 0 H ARG A 147 10.674 3.362 11.712 1.00 0.00 H new ATOM 0 HA ARG A 147 7.758 3.009 11.710 1.00 0.00 H new ATOM 0 HB2 ARG A 147 9.588 1.232 12.226 1.00 0.00 H new ATOM 0 HB3 ARG A 147 9.778 2.032 13.773 1.00 0.00 H new ATOM 0 HG2 ARG A 147 7.165 1.818 13.981 1.00 0.00 H new ATOM 0 HG3 ARG A 147 7.289 0.662 12.670 1.00 0.00 H new ATOM 0 HD2 ARG A 147 8.757 0.495 15.348 1.00 0.00 H new ATOM 0 HD3 ARG A 147 7.402 -0.502 14.858 1.00 0.00 H new ATOM 0 HE ARG A 147 9.279 -0.930 12.800 1.00 0.00 H new ATOM 0 HH11 ARG A 147 9.223 -1.036 16.295 1.00 0.00 H new ATOM 0 HH12 ARG A 147 10.439 -2.313 16.401 1.00 0.00 H new ATOM 0 HH21 ARG A 147 10.835 -2.566 12.936 1.00 0.00 H new ATOM 0 HH22 ARG A 147 11.344 -3.171 14.516 1.00 0.00 H new ATOM 1720 N LYS A 148 7.909 5.362 13.072 1.00 0.00 N ATOM 1721 CA LYS A 148 7.568 6.388 14.098 1.00 0.00 C ATOM 1722 C LYS A 148 6.666 7.451 13.453 1.00 0.00 C ATOM 1723 O LYS A 148 5.466 7.286 13.356 1.00 0.00 O ATOM 1724 CB LYS A 148 8.876 7.031 14.627 1.00 0.00 C ATOM 1725 CG LYS A 148 9.169 6.558 16.064 1.00 0.00 C ATOM 1726 CD LYS A 148 10.451 7.235 16.605 1.00 0.00 C ATOM 1727 CE LYS A 148 11.677 6.342 16.357 1.00 0.00 C ATOM 1728 NZ LYS A 148 11.549 5.662 15.038 1.00 0.00 N ATOM 0 H LYS A 148 7.805 5.667 12.104 1.00 0.00 H new ATOM 0 HA LYS A 148 7.039 5.932 14.935 1.00 0.00 H new ATOM 0 HB2 LYS A 148 9.708 6.766 13.974 1.00 0.00 H new ATOM 0 HB3 LYS A 148 8.788 8.117 14.607 1.00 0.00 H new ATOM 0 HG2 LYS A 148 8.324 6.795 16.711 1.00 0.00 H new ATOM 0 HG3 LYS A 148 9.288 5.475 16.080 1.00 0.00 H new ATOM 0 HD2 LYS A 148 10.592 8.200 16.119 1.00 0.00 H new ATOM 0 HD3 LYS A 148 10.345 7.428 17.672 1.00 0.00 H new ATOM 0 HE2 LYS A 148 12.586 6.943 16.380 1.00 0.00 H new ATOM 0 HE3 LYS A 148 11.765 5.601 17.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 12.424 5.140 14.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 10.749 4.998 15.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 11.384 6.372 14.296 1.00 0.00 H new TER 1742 LYS A 148