USER MOD reduce.3.24.130724 H: found=0, std=0, add=1187, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1192 hydrogens (9 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 120 GLN : amide:sc= 0.051 X(o=0.1,f=-0.058) USER MOD Set 1.2: A 122 THR OG1 : rot 180:sc= 0.0525 USER MOD Set 2.1: A 35 THR OG1 : rot 100:sc= -0.0469! USER MOD Set 2.2: A 38 GLN : amide:sc= 0.666 K(o=0.62,f=-0.93!) USER MOD Single : A 1 MET CE :methyl -163:sc= -0.0588 (180deg=-0.399) USER MOD Single : A 1 MET N :NH3+ -174:sc= 1.14 (180deg=1.04) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 4 LYS NZ :NH3+ 168:sc= 1 (180deg=0.169) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -146:sc= 1.07 (180deg=0.495) USER MOD Single : A 12 SER OG : rot -45:sc= 0.111 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 172:sc= 1.73 (180deg=1.64) USER MOD Single : A 30 TYR OH : rot 180:sc= -0.321 USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 44 SER OG : rot 160:sc= 0.0258 USER MOD Single : A 49 ASN :FLIP amide:sc= -0.0372 F(o=-0.85,f=-0.037) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 GLN :FLIP amide:sc= -0.541 F(o=-1.1!,f=-0.54) USER MOD Single : A 56 ASN :FLIP amide:sc= -0.685 F(o=-1.3!,f=-0.68) USER MOD Single : A 58 SER OG : rot -160:sc= 0 USER MOD Single : A 62 HIS : no HD1:sc= 0.471 K(o=0.47,f=-2.5!) USER MOD Single : A 63 THR OG1 : rot 177:sc= 1.31 USER MOD Single : A 69 ASN : amide:sc= -0.133 K(o=-0.13,f=-2.1!) USER MOD Single : A 70 TYR OH : rot 76:sc= -1.11 USER MOD Single : A 71 GLN :FLIP amide:sc= -0.174 F(o=-1.2!,f=-0.17) USER MOD Single : A 73 THR OG1 : rot -74:sc= 2.57 USER MOD Single : A 74 ASN : amide:sc= -2.18! C(o=-2.2!,f=-5.2!) USER MOD Single : A 76 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.048) USER MOD Single : A 79 LYS NZ :NH3+ -113:sc= 1.62 (180deg=-0.727!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot -61:sc= 2.25 USER MOD Single : A 83 MET CE :methyl -145:sc= -0.817 (180deg=-3.68!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 173:sc= -0.0177 (180deg=-0.0911) USER MOD Single : A 90 ASN :FLIP amide:sc= -0.169 F(o=-1.6!,f=-0.17) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.887 USER MOD Single : A 94 LYS NZ :NH3+ -145:sc= 2.34 (180deg=1.22) USER MOD Single : A 95 TYR OH : rot -130:sc= -1.59! USER MOD Single : A 96 LYS NZ :NH3+ 156:sc= -0.0623 (180deg=-0.352) USER MOD Single : A 97 MET CE :methyl -167:sc= -0.518 (180deg=-0.77) USER MOD Single : A 98 THR OG1 : rot -16:sc= 0.499 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0038) USER MOD Single : A 106 THR OG1 : rot -40:sc= 0.907 USER MOD Single : A 114 GLN :FLIP amide:sc= -0.197 F(o=-1.3!,f=-0.2) USER MOD Single : A 115 LYS NZ :NH3+ -143:sc= 0.466 (180deg=-1.84!) USER MOD Single : A 117 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.038) USER MOD Single : A 119 LYS NZ :NH3+ -161:sc= 1.1 (180deg=0.611) USER MOD Single : A 125 THR OG1 : rot -120:sc= 0 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 ASN : amide:sc= -0.675 K(o=-0.67,f=-8.6!) USER MOD Single : A 132 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0557) USER MOD Single : A 133 THR OG1 : rot 180:sc= -0.486 USER MOD Single : A 138 LYS NZ :NH3+ 169:sc= 1.1 (180deg=0.774) USER MOD Single : A 140 LYS NZ :NH3+ -153:sc= -0.109 (180deg=-0.628) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.059 11.807 -4.719 1.00 0.00 N ATOM 2 CA MET A 1 -4.075 11.385 -5.709 1.00 0.00 C ATOM 3 C MET A 1 -3.643 10.102 -6.401 1.00 0.00 C ATOM 4 O MET A 1 -2.556 9.595 -6.136 1.00 0.00 O ATOM 5 CB MET A 1 -4.296 12.484 -6.748 1.00 0.00 C ATOM 6 CG MET A 1 -5.056 13.683 -6.213 1.00 0.00 C ATOM 7 SD MET A 1 -5.368 14.936 -7.476 1.00 0.00 S ATOM 8 CE MET A 1 -3.699 15.446 -7.893 1.00 0.00 C ATOM 0 H1 MET A 1 -3.414 12.625 -4.184 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.866 11.023 -4.064 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.182 12.070 -5.212 1.00 0.00 H new ATOM 0 HA MET A 1 -5.011 11.203 -5.181 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.328 12.816 -7.124 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.841 12.067 -7.595 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.006 13.349 -5.797 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.490 14.131 -5.396 1.00 0.00 H new ATOM 0 HE1 MET A 1 -3.731 16.400 -8.419 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.113 15.554 -6.980 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.238 14.694 -8.533 1.00 0.00 H new ATOM 17 N GLN A 2 -4.509 9.592 -7.282 1.00 0.00 N ATOM 18 CA GLN A 2 -4.255 8.367 -8.049 1.00 0.00 C ATOM 19 C GLN A 2 -4.291 7.134 -7.146 1.00 0.00 C ATOM 20 O GLN A 2 -4.015 6.014 -7.578 1.00 0.00 O ATOM 21 CB GLN A 2 -2.911 8.456 -8.788 1.00 0.00 C ATOM 22 CG GLN A 2 -2.664 7.320 -9.772 1.00 0.00 C ATOM 23 CD GLN A 2 -1.235 7.279 -10.265 1.00 0.00 C ATOM 24 OE1 GLN A 2 -0.893 7.905 -11.265 1.00 0.00 O ATOM 25 NE2 GLN A 2 -0.390 6.530 -9.576 1.00 0.00 N ATOM 0 H GLN A 2 -5.412 10.020 -7.485 1.00 0.00 H new ATOM 0 HA GLN A 2 -5.049 8.266 -8.789 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -2.866 9.403 -9.325 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -2.105 8.468 -8.054 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -2.907 6.371 -9.294 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -3.335 7.429 -10.624 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -0.712 6.025 -8.750 1.00 0.00 H new ATOM 0 HE22 GLN A 2 0.584 6.457 -9.870 1.00 0.00 H new ATOM 34 N ALA A 3 -4.675 7.343 -5.902 1.00 0.00 N ATOM 35 CA ALA A 3 -4.673 6.274 -4.920 1.00 0.00 C ATOM 36 C ALA A 3 -5.608 6.580 -3.761 1.00 0.00 C ATOM 37 O ALA A 3 -5.728 7.728 -3.331 1.00 0.00 O ATOM 38 CB ALA A 3 -3.260 6.033 -4.402 1.00 0.00 C ATOM 0 H ALA A 3 -4.993 8.244 -5.546 1.00 0.00 H new ATOM 0 HA ALA A 3 -5.033 5.371 -5.413 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -3.274 5.229 -3.666 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -2.611 5.754 -5.232 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -2.883 6.944 -3.937 1.00 0.00 H new ATOM 44 N LYS A 4 -6.283 5.548 -3.277 1.00 0.00 N ATOM 45 CA LYS A 4 -7.081 5.652 -2.068 1.00 0.00 C ATOM 46 C LYS A 4 -6.546 4.691 -1.022 1.00 0.00 C ATOM 47 O LYS A 4 -6.893 3.508 -1.008 1.00 0.00 O ATOM 48 CB LYS A 4 -8.555 5.381 -2.356 1.00 0.00 C ATOM 49 CG LYS A 4 -9.249 6.548 -3.035 1.00 0.00 C ATOM 50 CD LYS A 4 -9.333 7.750 -2.109 1.00 0.00 C ATOM 51 CE LYS A 4 -9.905 8.964 -2.819 1.00 0.00 C ATOM 52 NZ LYS A 4 -9.984 10.147 -1.924 1.00 0.00 N ATOM 0 H LYS A 4 -6.293 4.623 -3.708 1.00 0.00 H new ATOM 0 HA LYS A 4 -7.007 6.670 -1.685 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.640 4.497 -2.988 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -9.067 5.155 -1.421 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -8.707 6.820 -3.941 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -10.252 6.250 -3.341 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -9.955 7.504 -1.249 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -8.340 7.986 -1.727 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -9.285 9.204 -3.683 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -10.900 8.728 -3.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -10.184 10.997 -2.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -10.745 10.006 -1.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -9.079 10.267 -1.426 1.00 0.00 H new ATOM 66 N PRO A 5 -5.655 5.187 -0.163 1.00 0.00 N ATOM 67 CA PRO A 5 -5.011 4.378 0.864 1.00 0.00 C ATOM 68 C PRO A 5 -5.964 4.025 1.997 1.00 0.00 C ATOM 69 O PRO A 5 -6.487 4.899 2.695 1.00 0.00 O ATOM 70 CB PRO A 5 -3.875 5.268 1.359 1.00 0.00 C ATOM 71 CG PRO A 5 -4.341 6.659 1.097 1.00 0.00 C ATOM 72 CD PRO A 5 -5.209 6.591 -0.130 1.00 0.00 C ATOM 0 HA PRO A 5 -4.668 3.418 0.478 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -3.681 5.109 2.420 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -2.946 5.055 0.830 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -4.901 7.048 1.948 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -3.496 7.329 0.938 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -6.053 7.278 -0.063 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -4.653 6.856 -1.029 1.00 0.00 H new ATOM 80 N GLN A 6 -6.190 2.739 2.171 1.00 0.00 N ATOM 81 CA GLN A 6 -7.113 2.261 3.180 1.00 0.00 C ATOM 82 C GLN A 6 -6.397 1.386 4.188 1.00 0.00 C ATOM 83 O GLN A 6 -5.438 0.684 3.860 1.00 0.00 O ATOM 84 CB GLN A 6 -8.267 1.483 2.541 1.00 0.00 C ATOM 85 CG GLN A 6 -7.814 0.287 1.718 1.00 0.00 C ATOM 86 CD GLN A 6 -8.965 -0.614 1.323 1.00 0.00 C ATOM 87 OE1 GLN A 6 -9.309 -1.552 2.046 1.00 0.00 O ATOM 88 NE2 GLN A 6 -9.568 -0.340 0.177 1.00 0.00 N ATOM 0 H GLN A 6 -5.745 2.003 1.624 1.00 0.00 H new ATOM 0 HA GLN A 6 -7.523 3.130 3.695 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -8.941 1.139 3.326 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -8.839 2.157 1.903 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -7.308 0.639 0.819 1.00 0.00 H new ATOM 0 HG3 GLN A 6 -7.086 -0.288 2.290 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -9.251 0.446 -0.391 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -10.349 -0.915 -0.138 1.00 0.00 H new ATOM 97 N ILE A 7 -6.872 1.448 5.412 1.00 0.00 N ATOM 98 CA ILE A 7 -6.316 0.672 6.500 1.00 0.00 C ATOM 99 C ILE A 7 -6.921 -0.727 6.520 1.00 0.00 C ATOM 100 O ILE A 7 -8.141 -0.882 6.602 1.00 0.00 O ATOM 101 CB ILE A 7 -6.576 1.388 7.839 1.00 0.00 C ATOM 102 CG1 ILE A 7 -5.757 2.675 7.894 1.00 0.00 C ATOM 103 CG2 ILE A 7 -6.257 0.486 9.020 1.00 0.00 C ATOM 104 CD1 ILE A 7 -6.392 3.756 8.731 1.00 0.00 C ATOM 0 H ILE A 7 -7.657 2.040 5.683 1.00 0.00 H new ATOM 0 HA ILE A 7 -5.240 0.578 6.352 1.00 0.00 H new ATOM 0 HB ILE A 7 -7.635 1.637 7.904 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -4.768 2.450 8.294 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -5.613 3.049 6.880 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -6.451 1.021 9.949 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -6.883 -0.405 8.977 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -5.208 0.194 8.982 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -5.756 4.641 8.725 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -7.369 4.008 8.319 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -6.511 3.401 9.755 1.00 0.00 H new ATOM 116 N PRO A 8 -6.075 -1.761 6.418 1.00 0.00 N ATOM 117 CA PRO A 8 -6.529 -3.151 6.419 1.00 0.00 C ATOM 118 C PRO A 8 -6.987 -3.607 7.801 1.00 0.00 C ATOM 119 O PRO A 8 -7.020 -2.826 8.753 1.00 0.00 O ATOM 120 CB PRO A 8 -5.283 -3.928 5.987 1.00 0.00 C ATOM 121 CG PRO A 8 -4.143 -3.083 6.433 1.00 0.00 C ATOM 122 CD PRO A 8 -4.608 -1.658 6.294 1.00 0.00 C ATOM 0 HA PRO A 8 -7.390 -3.302 5.768 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -5.250 -4.914 6.449 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -5.265 -4.081 4.908 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -3.871 -3.306 7.465 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -3.258 -3.267 5.823 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -4.183 -1.020 7.069 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -4.315 -1.232 5.334 1.00 0.00 H new ATOM 130 N LYS A 9 -7.330 -4.880 7.909 1.00 0.00 N ATOM 131 CA LYS A 9 -7.757 -5.441 9.180 1.00 0.00 C ATOM 132 C LYS A 9 -6.593 -6.151 9.858 1.00 0.00 C ATOM 133 O LYS A 9 -6.758 -6.789 10.900 1.00 0.00 O ATOM 134 CB LYS A 9 -8.965 -6.382 9.009 1.00 0.00 C ATOM 135 CG LYS A 9 -8.878 -7.351 7.833 1.00 0.00 C ATOM 136 CD LYS A 9 -9.220 -6.678 6.505 1.00 0.00 C ATOM 137 CE LYS A 9 -10.623 -6.084 6.514 1.00 0.00 C ATOM 138 NZ LYS A 9 -10.957 -5.418 5.224 1.00 0.00 N ATOM 0 H LYS A 9 -7.321 -5.543 7.134 1.00 0.00 H new ATOM 0 HA LYS A 9 -8.082 -4.621 9.821 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -9.087 -6.959 9.925 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -9.863 -5.775 8.892 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.871 -7.766 7.780 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -9.558 -8.186 8.001 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -8.494 -5.891 6.299 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -9.139 -7.406 5.698 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -11.349 -6.872 6.713 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -10.706 -5.362 7.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -11.920 -5.028 5.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -10.281 -4.649 5.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -10.904 -6.112 4.451 1.00 0.00 H new ATOM 152 N ASP A 10 -5.417 -6.018 9.258 1.00 0.00 N ATOM 153 CA ASP A 10 -4.188 -6.530 9.842 1.00 0.00 C ATOM 154 C ASP A 10 -3.490 -5.406 10.596 1.00 0.00 C ATOM 155 O ASP A 10 -2.897 -4.513 9.989 1.00 0.00 O ATOM 156 CB ASP A 10 -3.265 -7.084 8.755 1.00 0.00 C ATOM 157 CG ASP A 10 -2.063 -7.813 9.322 1.00 0.00 C ATOM 158 OD1 ASP A 10 -1.221 -7.172 9.981 1.00 0.00 O ATOM 159 OD2 ASP A 10 -1.943 -9.035 9.090 1.00 0.00 O ATOM 0 H ASP A 10 -5.290 -5.555 8.358 1.00 0.00 H new ATOM 0 HA ASP A 10 -4.429 -7.341 10.529 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -3.829 -7.764 8.117 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -2.923 -6.265 8.123 1.00 0.00 H new ATOM 164 N LYS A 11 -3.586 -5.441 11.915 1.00 0.00 N ATOM 165 CA LYS A 11 -3.041 -4.386 12.760 1.00 0.00 C ATOM 166 C LYS A 11 -1.564 -4.608 13.077 1.00 0.00 C ATOM 167 O LYS A 11 -1.001 -3.949 13.951 1.00 0.00 O ATOM 168 CB LYS A 11 -3.850 -4.301 14.051 1.00 0.00 C ATOM 169 CG LYS A 11 -5.264 -3.792 13.838 1.00 0.00 C ATOM 170 CD LYS A 11 -6.056 -3.775 15.135 1.00 0.00 C ATOM 171 CE LYS A 11 -6.444 -5.177 15.566 1.00 0.00 C ATOM 172 NZ LYS A 11 -7.282 -5.853 14.542 1.00 0.00 N ATOM 0 H LYS A 11 -4.040 -6.195 12.429 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.114 -3.446 12.213 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -3.892 -5.288 14.512 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -3.336 -3.643 14.752 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -5.230 -2.786 13.419 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -5.772 -4.423 13.109 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -5.463 -3.303 15.919 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.954 -3.171 15.007 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.544 -5.765 15.746 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -6.988 -5.131 16.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -7.971 -6.474 15.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -7.787 -5.138 13.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.675 -6.421 13.917 1.00 0.00 H new ATOM 186 N SER A 12 -0.930 -5.526 12.365 1.00 0.00 N ATOM 187 CA SER A 12 0.485 -5.769 12.567 1.00 0.00 C ATOM 188 C SER A 12 1.277 -5.201 11.392 1.00 0.00 C ATOM 189 O SER A 12 2.510 -5.193 11.397 1.00 0.00 O ATOM 190 CB SER A 12 0.751 -7.268 12.738 1.00 0.00 C ATOM 191 OG SER A 12 2.061 -7.504 13.230 1.00 0.00 O ATOM 0 H SER A 12 -1.368 -6.108 11.651 1.00 0.00 H new ATOM 0 HA SER A 12 0.809 -5.267 13.479 1.00 0.00 H new ATOM 0 HB2 SER A 12 0.020 -7.694 13.425 1.00 0.00 H new ATOM 0 HB3 SER A 12 0.622 -7.774 11.781 1.00 0.00 H new ATOM 0 HG SER A 12 2.701 -6.949 12.737 1.00 0.00 H new ATOM 197 N LYS A 13 0.559 -4.721 10.382 1.00 0.00 N ATOM 198 CA LYS A 13 1.183 -4.083 9.231 1.00 0.00 C ATOM 199 C LYS A 13 1.301 -2.583 9.452 1.00 0.00 C ATOM 200 O LYS A 13 0.945 -2.073 10.511 1.00 0.00 O ATOM 201 CB LYS A 13 0.377 -4.336 7.955 1.00 0.00 C ATOM 202 CG LYS A 13 0.357 -5.784 7.510 1.00 0.00 C ATOM 203 CD LYS A 13 -0.361 -5.926 6.181 1.00 0.00 C ATOM 204 CE LYS A 13 -0.333 -7.358 5.674 1.00 0.00 C ATOM 205 NZ LYS A 13 -1.024 -7.493 4.365 1.00 0.00 N ATOM 0 H LYS A 13 -0.459 -4.763 10.338 1.00 0.00 H new ATOM 0 HA LYS A 13 2.176 -4.517 9.116 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -0.648 -4.002 8.114 1.00 0.00 H new ATOM 0 HB3 LYS A 13 0.789 -3.726 7.151 1.00 0.00 H new ATOM 0 HG2 LYS A 13 1.378 -6.156 7.419 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -0.139 -6.395 8.264 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -1.395 -5.599 6.290 1.00 0.00 H new ATOM 0 HD3 LYS A 13 0.104 -5.271 5.445 1.00 0.00 H new ATOM 0 HE2 LYS A 13 0.701 -7.689 5.575 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -0.808 -8.012 6.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -0.984 -8.484 4.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -2.017 -7.201 4.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -0.555 -6.888 3.661 1.00 0.00 H new ATOM 219 N VAL A 14 1.801 -1.883 8.447 1.00 0.00 N ATOM 220 CA VAL A 14 1.908 -0.435 8.499 1.00 0.00 C ATOM 221 C VAL A 14 0.960 0.206 7.483 1.00 0.00 C ATOM 222 O VAL A 14 0.816 -0.284 6.365 1.00 0.00 O ATOM 223 CB VAL A 14 3.364 0.017 8.240 1.00 0.00 C ATOM 224 CG1 VAL A 14 3.847 -0.423 6.870 1.00 0.00 C ATOM 225 CG2 VAL A 14 3.505 1.520 8.396 1.00 0.00 C ATOM 0 H VAL A 14 2.141 -2.298 7.580 1.00 0.00 H new ATOM 0 HA VAL A 14 1.622 -0.106 9.498 1.00 0.00 H new ATOM 0 HB VAL A 14 3.992 -0.466 8.989 1.00 0.00 H new ATOM 0 HG11 VAL A 14 4.874 -0.089 6.721 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.806 -1.510 6.802 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.209 0.013 6.102 1.00 0.00 H new ATOM 0 HG21 VAL A 14 4.539 1.810 8.208 1.00 0.00 H new ATOM 0 HG22 VAL A 14 2.852 2.023 7.683 1.00 0.00 H new ATOM 0 HG23 VAL A 14 3.226 1.808 9.409 1.00 0.00 H new ATOM 235 N ALA A 15 0.294 1.281 7.888 1.00 0.00 N ATOM 236 CA ALA A 15 -0.642 1.973 7.007 1.00 0.00 C ATOM 237 C ALA A 15 -0.002 3.222 6.411 1.00 0.00 C ATOM 238 O ALA A 15 -0.337 3.645 5.306 1.00 0.00 O ATOM 239 CB ALA A 15 -1.906 2.336 7.769 1.00 0.00 C ATOM 0 H ALA A 15 0.383 1.692 8.817 1.00 0.00 H new ATOM 0 HA ALA A 15 -0.905 1.303 6.188 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -2.597 2.852 7.102 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -2.376 1.428 8.147 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -1.652 2.989 8.604 1.00 0.00 H new ATOM 245 N GLY A 16 0.922 3.801 7.158 1.00 0.00 N ATOM 246 CA GLY A 16 1.624 4.983 6.713 1.00 0.00 C ATOM 247 C GLY A 16 2.840 5.228 7.573 1.00 0.00 C ATOM 248 O GLY A 16 2.951 4.660 8.655 1.00 0.00 O ATOM 0 H GLY A 16 1.202 3.466 8.080 1.00 0.00 H new ATOM 0 HA2 GLY A 16 1.925 4.865 5.672 1.00 0.00 H new ATOM 0 HA3 GLY A 16 0.960 5.846 6.757 1.00 0.00 H new ATOM 252 N TYR A 17 3.756 6.050 7.109 1.00 0.00 N ATOM 253 CA TYR A 17 4.951 6.346 7.876 1.00 0.00 C ATOM 254 C TYR A 17 4.896 7.773 8.388 1.00 0.00 C ATOM 255 O TYR A 17 4.521 8.692 7.658 1.00 0.00 O ATOM 256 CB TYR A 17 6.214 6.136 7.034 1.00 0.00 C ATOM 257 CG TYR A 17 6.329 4.747 6.448 1.00 0.00 C ATOM 258 CD1 TYR A 17 7.081 3.768 7.079 1.00 0.00 C ATOM 259 CD2 TYR A 17 5.680 4.418 5.265 1.00 0.00 C ATOM 260 CE1 TYR A 17 7.184 2.496 6.550 1.00 0.00 C ATOM 261 CE2 TYR A 17 5.777 3.151 4.730 1.00 0.00 C ATOM 262 CZ TYR A 17 6.531 2.192 5.375 1.00 0.00 C ATOM 263 OH TYR A 17 6.630 0.928 4.844 1.00 0.00 O ATOM 0 H TYR A 17 3.699 6.525 6.208 1.00 0.00 H new ATOM 0 HA TYR A 17 4.992 5.661 8.723 1.00 0.00 H new ATOM 0 HB2 TYR A 17 6.225 6.865 6.224 1.00 0.00 H new ATOM 0 HB3 TYR A 17 7.089 6.334 7.653 1.00 0.00 H new ATOM 0 HD1 TYR A 17 7.595 4.004 7.999 1.00 0.00 H new ATOM 0 HD2 TYR A 17 5.090 5.166 4.756 1.00 0.00 H new ATOM 0 HE1 TYR A 17 7.773 1.744 7.054 1.00 0.00 H new ATOM 0 HE2 TYR A 17 5.265 2.910 3.810 1.00 0.00 H new ATOM 0 HH TYR A 17 6.110 0.880 4.015 1.00 0.00 H new ATOM 273 N ILE A 18 5.254 7.951 9.645 1.00 0.00 N ATOM 274 CA ILE A 18 5.280 9.268 10.242 1.00 0.00 C ATOM 275 C ILE A 18 6.703 9.814 10.215 1.00 0.00 C ATOM 276 O ILE A 18 7.597 9.332 10.915 1.00 0.00 O ATOM 277 CB ILE A 18 4.713 9.268 11.685 1.00 0.00 C ATOM 278 CG1 ILE A 18 4.712 10.683 12.262 1.00 0.00 C ATOM 279 CG2 ILE A 18 5.489 8.325 12.590 1.00 0.00 C ATOM 280 CD1 ILE A 18 3.825 11.640 11.499 1.00 0.00 C ATOM 0 H ILE A 18 5.531 7.196 10.273 1.00 0.00 H new ATOM 0 HA ILE A 18 4.633 9.918 9.653 1.00 0.00 H new ATOM 0 HB ILE A 18 3.685 8.909 11.635 1.00 0.00 H new ATOM 0 HG12 ILE A 18 4.384 10.644 13.301 1.00 0.00 H new ATOM 0 HG13 ILE A 18 5.732 11.068 12.264 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.064 8.351 13.593 1.00 0.00 H new ATOM 0 HG22 ILE A 18 5.428 7.310 12.196 1.00 0.00 H new ATOM 0 HG23 ILE A 18 6.533 8.636 12.630 1.00 0.00 H new ATOM 0 HD11 ILE A 18 3.871 12.626 11.962 1.00 0.00 H new ATOM 0 HD12 ILE A 18 4.166 11.708 10.466 1.00 0.00 H new ATOM 0 HD13 ILE A 18 2.797 11.278 11.518 1.00 0.00 H new ATOM 292 N GLU A 19 6.912 10.792 9.365 1.00 0.00 N ATOM 293 CA GLU A 19 8.232 11.357 9.181 1.00 0.00 C ATOM 294 C GLU A 19 8.274 12.800 9.651 1.00 0.00 C ATOM 295 O GLU A 19 7.770 13.711 8.996 1.00 0.00 O ATOM 296 CB GLU A 19 8.673 11.247 7.720 1.00 0.00 C ATOM 297 CG GLU A 19 8.678 9.818 7.204 1.00 0.00 C ATOM 298 CD GLU A 19 9.153 9.701 5.769 1.00 0.00 C ATOM 299 OE1 GLU A 19 9.211 10.731 5.061 1.00 0.00 O ATOM 300 OE2 GLU A 19 9.460 8.571 5.334 1.00 0.00 O ATOM 0 H GLU A 19 6.185 11.215 8.788 1.00 0.00 H new ATOM 0 HA GLU A 19 8.932 10.784 9.789 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.008 11.848 7.100 1.00 0.00 H new ATOM 0 HB3 GLU A 19 9.673 11.668 7.616 1.00 0.00 H new ATOM 0 HG2 GLU A 19 9.319 9.211 7.843 1.00 0.00 H new ATOM 0 HG3 GLU A 19 7.671 9.408 7.281 1.00 0.00 H new ATOM 307 N ILE A 20 8.863 12.982 10.813 1.00 0.00 N ATOM 308 CA ILE A 20 9.063 14.292 11.383 1.00 0.00 C ATOM 309 C ILE A 20 10.552 14.501 11.603 1.00 0.00 C ATOM 310 O ILE A 20 11.098 14.107 12.637 1.00 0.00 O ATOM 311 CB ILE A 20 8.316 14.453 12.724 1.00 0.00 C ATOM 312 CG1 ILE A 20 6.855 14.035 12.562 1.00 0.00 C ATOM 313 CG2 ILE A 20 8.411 15.896 13.209 1.00 0.00 C ATOM 314 CD1 ILE A 20 6.118 13.878 13.872 1.00 0.00 C ATOM 0 H ILE A 20 9.218 12.220 11.390 1.00 0.00 H new ATOM 0 HA ILE A 20 8.664 15.036 10.693 1.00 0.00 H new ATOM 0 HB ILE A 20 8.781 13.808 13.470 1.00 0.00 H new ATOM 0 HG12 ILE A 20 6.340 14.777 11.952 1.00 0.00 H new ATOM 0 HG13 ILE A 20 6.815 13.092 12.018 1.00 0.00 H new ATOM 0 HG21 ILE A 20 7.880 15.997 14.156 1.00 0.00 H new ATOM 0 HG22 ILE A 20 9.458 16.164 13.349 1.00 0.00 H new ATOM 0 HG23 ILE A 20 7.963 16.559 12.469 1.00 0.00 H new ATOM 0 HD11 ILE A 20 5.088 13.580 13.677 1.00 0.00 H new ATOM 0 HD12 ILE A 20 6.608 13.114 14.476 1.00 0.00 H new ATOM 0 HD13 ILE A 20 6.126 14.826 14.410 1.00 0.00 H new ATOM 326 N PRO A 21 11.233 15.100 10.620 1.00 0.00 N ATOM 327 CA PRO A 21 12.688 15.281 10.650 1.00 0.00 C ATOM 328 C PRO A 21 13.107 16.186 11.791 1.00 0.00 C ATOM 329 O PRO A 21 14.252 16.165 12.241 1.00 0.00 O ATOM 330 CB PRO A 21 13.006 15.940 9.303 1.00 0.00 C ATOM 331 CG PRO A 21 11.803 15.701 8.459 1.00 0.00 C ATOM 332 CD PRO A 21 10.640 15.664 9.400 1.00 0.00 C ATOM 0 HA PRO A 21 13.217 14.340 10.802 1.00 0.00 H new ATOM 0 HB2 PRO A 21 13.198 17.006 9.422 1.00 0.00 H new ATOM 0 HB3 PRO A 21 13.897 15.504 8.852 1.00 0.00 H new ATOM 0 HG2 PRO A 21 11.682 16.493 7.720 1.00 0.00 H new ATOM 0 HG3 PRO A 21 11.891 14.763 7.911 1.00 0.00 H new ATOM 0 HD2 PRO A 21 10.226 16.658 9.572 1.00 0.00 H new ATOM 0 HD3 PRO A 21 9.830 15.043 9.019 1.00 0.00 H new ATOM 340 N ASP A 22 12.156 16.975 12.255 1.00 0.00 N ATOM 341 CA ASP A 22 12.388 17.893 13.355 1.00 0.00 C ATOM 342 C ASP A 22 12.500 17.141 14.676 1.00 0.00 C ATOM 343 O ASP A 22 13.224 17.558 15.575 1.00 0.00 O ATOM 344 CB ASP A 22 11.262 18.921 13.445 1.00 0.00 C ATOM 345 CG ASP A 22 11.626 20.085 14.338 1.00 0.00 C ATOM 346 OD1 ASP A 22 10.810 20.455 15.197 1.00 0.00 O ATOM 347 OD2 ASP A 22 12.734 20.639 14.176 1.00 0.00 O ATOM 0 H ASP A 22 11.207 16.998 11.883 1.00 0.00 H new ATOM 0 HA ASP A 22 13.328 18.410 13.163 1.00 0.00 H new ATOM 0 HB2 ASP A 22 11.028 19.290 12.446 1.00 0.00 H new ATOM 0 HB3 ASP A 22 10.362 18.440 13.826 1.00 0.00 H new ATOM 352 N ALA A 23 11.808 16.012 14.777 1.00 0.00 N ATOM 353 CA ALA A 23 11.769 15.257 16.020 1.00 0.00 C ATOM 354 C ALA A 23 12.531 13.946 15.878 1.00 0.00 C ATOM 355 O ALA A 23 12.458 13.078 16.747 1.00 0.00 O ATOM 356 CB ALA A 23 10.325 15.002 16.428 1.00 0.00 C ATOM 0 H ALA A 23 11.269 15.602 14.015 1.00 0.00 H new ATOM 0 HA ALA A 23 12.254 15.843 16.801 1.00 0.00 H new ATOM 0 HB1 ALA A 23 10.305 14.436 17.359 1.00 0.00 H new ATOM 0 HB2 ALA A 23 9.814 15.954 16.570 1.00 0.00 H new ATOM 0 HB3 ALA A 23 9.821 14.433 15.647 1.00 0.00 H new ATOM 362 N ASP A 24 13.267 13.824 14.773 1.00 0.00 N ATOM 363 CA ASP A 24 14.067 12.629 14.483 1.00 0.00 C ATOM 364 C ASP A 24 13.167 11.398 14.324 1.00 0.00 C ATOM 365 O ASP A 24 13.574 10.263 14.565 1.00 0.00 O ATOM 366 CB ASP A 24 15.115 12.408 15.585 1.00 0.00 C ATOM 367 CG ASP A 24 16.073 11.272 15.274 1.00 0.00 C ATOM 368 OD1 ASP A 24 16.598 11.223 14.141 1.00 0.00 O ATOM 369 OD2 ASP A 24 16.319 10.432 16.163 1.00 0.00 O ATOM 0 H ASP A 24 13.327 14.546 14.055 1.00 0.00 H new ATOM 0 HA ASP A 24 14.591 12.783 13.540 1.00 0.00 H new ATOM 0 HB2 ASP A 24 15.684 13.327 15.727 1.00 0.00 H new ATOM 0 HB3 ASP A 24 14.606 12.199 16.526 1.00 0.00 H new ATOM 374 N ILE A 25 11.946 11.634 13.873 1.00 0.00 N ATOM 375 CA ILE A 25 10.970 10.569 13.719 1.00 0.00 C ATOM 376 C ILE A 25 10.846 10.159 12.257 1.00 0.00 C ATOM 377 O ILE A 25 10.509 10.974 11.404 1.00 0.00 O ATOM 378 CB ILE A 25 9.595 11.015 14.256 1.00 0.00 C ATOM 379 CG1 ILE A 25 9.693 11.327 15.750 1.00 0.00 C ATOM 380 CG2 ILE A 25 8.540 9.949 14.002 1.00 0.00 C ATOM 381 CD1 ILE A 25 8.402 11.842 16.349 1.00 0.00 C ATOM 0 H ILE A 25 11.607 12.558 13.606 1.00 0.00 H new ATOM 0 HA ILE A 25 11.314 9.710 14.295 1.00 0.00 H new ATOM 0 HB ILE A 25 9.294 11.918 13.725 1.00 0.00 H new ATOM 0 HG12 ILE A 25 9.996 10.425 16.282 1.00 0.00 H new ATOM 0 HG13 ILE A 25 10.477 12.068 15.907 1.00 0.00 H new ATOM 0 HG21 ILE A 25 7.579 10.288 14.390 1.00 0.00 H new ATOM 0 HG22 ILE A 25 8.455 9.769 12.930 1.00 0.00 H new ATOM 0 HG23 ILE A 25 8.828 9.025 14.503 1.00 0.00 H new ATOM 0 HD11 ILE A 25 8.548 12.041 17.411 1.00 0.00 H new ATOM 0 HD12 ILE A 25 8.108 12.762 15.844 1.00 0.00 H new ATOM 0 HD13 ILE A 25 7.619 11.094 16.224 1.00 0.00 H new ATOM 393 N LYS A 26 11.157 8.905 11.973 1.00 0.00 N ATOM 394 CA LYS A 26 11.061 8.361 10.621 1.00 0.00 C ATOM 395 C LYS A 26 10.410 6.989 10.707 1.00 0.00 C ATOM 396 O LYS A 26 10.797 6.046 10.010 1.00 0.00 O ATOM 397 CB LYS A 26 12.453 8.230 9.971 1.00 0.00 C ATOM 398 CG LYS A 26 13.268 9.522 9.906 1.00 0.00 C ATOM 399 CD LYS A 26 13.962 9.840 11.229 1.00 0.00 C ATOM 400 CE LYS A 26 14.966 8.763 11.616 1.00 0.00 C ATOM 401 NZ LYS A 26 15.538 8.991 12.970 1.00 0.00 N ATOM 0 H LYS A 26 11.483 8.234 12.669 1.00 0.00 H new ATOM 0 HA LYS A 26 10.467 9.036 10.005 1.00 0.00 H new ATOM 0 HB2 LYS A 26 13.026 7.486 10.525 1.00 0.00 H new ATOM 0 HB3 LYS A 26 12.328 7.847 8.958 1.00 0.00 H new ATOM 0 HG2 LYS A 26 14.016 9.437 9.118 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.612 10.349 9.635 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.472 10.800 11.150 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.215 9.940 12.016 1.00 0.00 H new ATOM 0 HE2 LYS A 26 14.480 7.788 11.588 1.00 0.00 H new ATOM 0 HE3 LYS A 26 15.772 8.739 10.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 16.110 8.168 13.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.137 9.841 12.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 14.767 9.124 13.655 1.00 0.00 H new ATOM 415 N GLU A 27 9.391 6.902 11.545 1.00 0.00 N ATOM 416 CA GLU A 27 8.885 5.617 12.008 1.00 0.00 C ATOM 417 C GLU A 27 7.597 5.229 11.281 1.00 0.00 C ATOM 418 O GLU A 27 6.863 6.089 10.800 1.00 0.00 O ATOM 419 CB GLU A 27 8.623 5.681 13.515 1.00 0.00 C ATOM 420 CG GLU A 27 9.692 6.421 14.310 1.00 0.00 C ATOM 421 CD GLU A 27 11.092 5.902 14.062 1.00 0.00 C ATOM 422 OE1 GLU A 27 11.922 6.664 13.522 1.00 0.00 O ATOM 423 OE2 GLU A 27 11.366 4.732 14.395 1.00 0.00 O ATOM 0 H GLU A 27 8.894 7.709 11.921 1.00 0.00 H new ATOM 0 HA GLU A 27 9.638 4.859 11.792 1.00 0.00 H new ATOM 0 HB2 GLU A 27 7.661 6.166 13.684 1.00 0.00 H new ATOM 0 HB3 GLU A 27 8.540 4.665 13.900 1.00 0.00 H new ATOM 0 HG2 GLU A 27 9.655 7.480 14.056 1.00 0.00 H new ATOM 0 HG3 GLU A 27 9.465 6.340 15.373 1.00 0.00 H new ATOM 430 N PRO A 28 7.307 3.923 11.187 1.00 0.00 N ATOM 431 CA PRO A 28 6.069 3.436 10.584 1.00 0.00 C ATOM 432 C PRO A 28 4.893 3.484 11.562 1.00 0.00 C ATOM 433 O PRO A 28 5.058 3.240 12.756 1.00 0.00 O ATOM 434 CB PRO A 28 6.413 1.994 10.219 1.00 0.00 C ATOM 435 CG PRO A 28 7.431 1.572 11.223 1.00 0.00 C ATOM 436 CD PRO A 28 8.174 2.817 11.642 1.00 0.00 C ATOM 0 HA PRO A 28 5.751 4.041 9.735 1.00 0.00 H new ATOM 0 HB2 PRO A 28 5.530 1.356 10.260 1.00 0.00 H new ATOM 0 HB3 PRO A 28 6.808 1.927 9.205 1.00 0.00 H new ATOM 0 HG2 PRO A 28 6.954 1.099 12.082 1.00 0.00 H new ATOM 0 HG3 PRO A 28 8.115 0.839 10.795 1.00 0.00 H new ATOM 0 HD2 PRO A 28 8.325 2.847 12.721 1.00 0.00 H new ATOM 0 HD3 PRO A 28 9.160 2.867 11.180 1.00 0.00 H new ATOM 444 N VAL A 29 3.710 3.802 11.056 1.00 0.00 N ATOM 445 CA VAL A 29 2.513 3.880 11.886 1.00 0.00 C ATOM 446 C VAL A 29 1.652 2.643 11.686 1.00 0.00 C ATOM 447 O VAL A 29 1.301 2.291 10.556 1.00 0.00 O ATOM 448 CB VAL A 29 1.673 5.137 11.573 1.00 0.00 C ATOM 449 CG1 VAL A 29 0.436 5.197 12.458 1.00 0.00 C ATOM 450 CG2 VAL A 29 2.509 6.393 11.739 1.00 0.00 C ATOM 0 H VAL A 29 3.552 4.011 10.070 1.00 0.00 H new ATOM 0 HA VAL A 29 2.845 3.941 12.922 1.00 0.00 H new ATOM 0 HB VAL A 29 1.345 5.076 10.535 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -0.140 6.091 12.219 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -0.178 4.313 12.285 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.739 5.230 13.505 1.00 0.00 H new ATOM 0 HG21 VAL A 29 1.899 7.268 11.514 1.00 0.00 H new ATOM 0 HG22 VAL A 29 2.870 6.457 12.765 1.00 0.00 H new ATOM 0 HG23 VAL A 29 3.358 6.357 11.057 1.00 0.00 H new ATOM 460 N TYR A 30 1.308 1.992 12.783 1.00 0.00 N ATOM 461 CA TYR A 30 0.544 0.764 12.724 1.00 0.00 C ATOM 462 C TYR A 30 -0.921 1.033 13.032 1.00 0.00 C ATOM 463 O TYR A 30 -1.248 1.765 13.967 1.00 0.00 O ATOM 464 CB TYR A 30 1.118 -0.260 13.703 1.00 0.00 C ATOM 465 CG TYR A 30 2.602 -0.484 13.522 1.00 0.00 C ATOM 466 CD1 TYR A 30 3.516 0.033 14.428 1.00 0.00 C ATOM 467 CD2 TYR A 30 3.087 -1.200 12.437 1.00 0.00 C ATOM 468 CE1 TYR A 30 4.872 -0.159 14.258 1.00 0.00 C ATOM 469 CE2 TYR A 30 4.441 -1.398 12.259 1.00 0.00 C ATOM 470 CZ TYR A 30 5.330 -0.875 13.173 1.00 0.00 C ATOM 471 OH TYR A 30 6.682 -1.073 13.005 1.00 0.00 O ATOM 0 H TYR A 30 1.548 2.296 13.727 1.00 0.00 H new ATOM 0 HA TYR A 30 0.612 0.358 11.715 1.00 0.00 H new ATOM 0 HB2 TYR A 30 0.929 0.075 14.723 1.00 0.00 H new ATOM 0 HB3 TYR A 30 0.595 -1.208 13.577 1.00 0.00 H new ATOM 0 HD1 TYR A 30 3.161 0.594 15.280 1.00 0.00 H new ATOM 0 HD2 TYR A 30 2.392 -1.610 11.719 1.00 0.00 H new ATOM 0 HE1 TYR A 30 5.571 0.250 14.972 1.00 0.00 H new ATOM 0 HE2 TYR A 30 4.801 -1.959 11.409 1.00 0.00 H new ATOM 0 HH TYR A 30 6.837 -1.598 12.192 1.00 0.00 H new ATOM 481 N PRO A 31 -1.821 0.474 12.219 1.00 0.00 N ATOM 482 CA PRO A 31 -3.259 0.597 12.438 1.00 0.00 C ATOM 483 C PRO A 31 -3.713 -0.178 13.667 1.00 0.00 C ATOM 484 O PRO A 31 -3.170 -1.235 13.979 1.00 0.00 O ATOM 485 CB PRO A 31 -3.864 -0.013 11.175 1.00 0.00 C ATOM 486 CG PRO A 31 -2.821 -0.944 10.662 1.00 0.00 C ATOM 487 CD PRO A 31 -1.505 -0.324 11.021 1.00 0.00 C ATOM 0 HA PRO A 31 -3.561 1.629 12.614 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -4.791 -0.542 11.397 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -4.103 0.756 10.440 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -2.923 -1.931 11.112 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -2.910 -1.074 9.584 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -0.748 -1.080 11.230 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -1.120 0.298 10.213 1.00 0.00 H new ATOM 495 N GLY A 32 -4.699 0.351 14.367 1.00 0.00 N ATOM 496 CA GLY A 32 -5.221 -0.342 15.516 1.00 0.00 C ATOM 497 C GLY A 32 -6.066 0.553 16.390 1.00 0.00 C ATOM 498 O GLY A 32 -5.984 1.775 16.292 1.00 0.00 O ATOM 0 H GLY A 32 -5.145 1.245 14.160 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -5.818 -1.191 15.185 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -4.394 -0.743 16.102 1.00 0.00 H new ATOM 502 N PRO A 33 -6.888 -0.039 17.258 1.00 0.00 N ATOM 503 CA PRO A 33 -7.737 0.681 18.196 1.00 0.00 C ATOM 504 C PRO A 33 -7.009 0.970 19.500 1.00 0.00 C ATOM 505 O PRO A 33 -7.579 0.870 20.589 1.00 0.00 O ATOM 506 CB PRO A 33 -8.897 -0.289 18.428 1.00 0.00 C ATOM 507 CG PRO A 33 -8.533 -1.569 17.728 1.00 0.00 C ATOM 508 CD PRO A 33 -7.076 -1.476 17.399 1.00 0.00 C ATOM 0 HA PRO A 33 -8.052 1.654 17.818 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.052 -0.460 19.493 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -9.828 0.118 18.032 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -8.732 -2.430 18.366 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -9.127 -1.699 16.823 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -6.452 -1.893 18.189 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -6.830 -2.012 16.482 1.00 0.00 H new ATOM 516 N ALA A 34 -5.741 1.323 19.354 1.00 0.00 N ATOM 517 CA ALA A 34 -4.853 1.614 20.481 1.00 0.00 C ATOM 518 C ALA A 34 -4.654 0.367 21.340 1.00 0.00 C ATOM 519 O ALA A 34 -4.542 0.446 22.564 1.00 0.00 O ATOM 520 CB ALA A 34 -5.396 2.772 21.312 1.00 0.00 C ATOM 0 H ALA A 34 -5.291 1.418 18.444 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.882 1.913 20.087 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.720 2.971 22.144 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -5.475 3.662 20.688 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -6.381 2.512 21.699 1.00 0.00 H new ATOM 526 N THR A 35 -4.603 -0.783 20.684 1.00 0.00 N ATOM 527 CA THR A 35 -4.443 -2.056 21.369 1.00 0.00 C ATOM 528 C THR A 35 -2.998 -2.273 21.840 1.00 0.00 C ATOM 529 O THR A 35 -2.060 -1.745 21.240 1.00 0.00 O ATOM 530 CB THR A 35 -4.884 -3.203 20.448 1.00 0.00 C ATOM 531 OG1 THR A 35 -4.704 -2.809 19.083 1.00 0.00 O ATOM 532 CG2 THR A 35 -6.341 -3.572 20.690 1.00 0.00 C ATOM 0 H THR A 35 -4.671 -0.860 19.669 1.00 0.00 H new ATOM 0 HA THR A 35 -5.075 -2.041 22.257 1.00 0.00 H new ATOM 0 HB THR A 35 -4.273 -4.079 20.666 1.00 0.00 H new ATOM 0 HG1 THR A 35 -3.872 -3.196 18.738 1.00 0.00 H new ATOM 0 HG21 THR A 35 -6.625 -4.387 20.024 1.00 0.00 H new ATOM 0 HG22 THR A 35 -6.469 -3.888 21.725 1.00 0.00 H new ATOM 0 HG23 THR A 35 -6.973 -2.706 20.494 1.00 0.00 H new ATOM 540 N PRO A 36 -2.814 -3.061 22.924 1.00 0.00 N ATOM 541 CA PRO A 36 -1.507 -3.286 23.566 1.00 0.00 C ATOM 542 C PRO A 36 -0.397 -3.672 22.588 1.00 0.00 C ATOM 543 O PRO A 36 0.619 -2.990 22.508 1.00 0.00 O ATOM 544 CB PRO A 36 -1.771 -4.437 24.557 1.00 0.00 C ATOM 545 CG PRO A 36 -3.137 -4.948 24.235 1.00 0.00 C ATOM 546 CD PRO A 36 -3.877 -3.796 23.623 1.00 0.00 C ATOM 0 HA PRO A 36 -1.147 -2.370 24.034 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -1.024 -5.224 24.450 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -1.718 -4.085 25.587 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -3.086 -5.790 23.544 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -3.642 -5.303 25.133 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -4.654 -4.133 22.937 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -4.364 -3.181 24.379 1.00 0.00 H new ATOM 554 N GLU A 37 -0.602 -4.751 21.838 1.00 0.00 N ATOM 555 CA GLU A 37 0.427 -5.274 20.936 1.00 0.00 C ATOM 556 C GLU A 37 0.848 -4.250 19.882 1.00 0.00 C ATOM 557 O GLU A 37 2.015 -4.193 19.501 1.00 0.00 O ATOM 558 CB GLU A 37 -0.061 -6.552 20.256 1.00 0.00 C ATOM 559 CG GLU A 37 -0.115 -7.748 21.190 1.00 0.00 C ATOM 560 CD GLU A 37 1.246 -8.076 21.774 1.00 0.00 C ATOM 561 OE1 GLU A 37 2.078 -8.671 21.060 1.00 0.00 O ATOM 562 OE2 GLU A 37 1.493 -7.737 22.950 1.00 0.00 O ATOM 0 H GLU A 37 -1.472 -5.283 21.835 1.00 0.00 H new ATOM 0 HA GLU A 37 1.303 -5.497 21.545 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -1.054 -6.378 19.842 1.00 0.00 H new ATOM 0 HB3 GLU A 37 0.597 -6.784 19.419 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -0.817 -7.545 21.999 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -0.495 -8.614 20.648 1.00 0.00 H new ATOM 569 N GLN A 38 -0.095 -3.437 19.427 1.00 0.00 N ATOM 570 CA GLN A 38 0.195 -2.416 18.425 1.00 0.00 C ATOM 571 C GLN A 38 1.154 -1.375 18.993 1.00 0.00 C ATOM 572 O GLN A 38 2.124 -0.985 18.341 1.00 0.00 O ATOM 573 CB GLN A 38 -1.098 -1.749 17.946 1.00 0.00 C ATOM 574 CG GLN A 38 -1.864 -2.544 16.890 1.00 0.00 C ATOM 575 CD GLN A 38 -2.040 -4.012 17.242 1.00 0.00 C ATOM 576 OE1 GLN A 38 -2.983 -4.389 17.936 1.00 0.00 O ATOM 577 NE2 GLN A 38 -1.153 -4.855 16.739 1.00 0.00 N ATOM 0 H GLN A 38 -1.067 -3.463 19.734 1.00 0.00 H new ATOM 0 HA GLN A 38 0.670 -2.896 17.569 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -1.749 -1.588 18.805 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -0.857 -0.767 17.540 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -2.846 -2.093 16.749 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -1.339 -2.468 15.938 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -0.384 -4.505 16.168 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -1.238 -5.855 16.923 1.00 0.00 H new ATOM 586 N LEU A 39 0.890 -0.952 20.223 1.00 0.00 N ATOM 587 CA LEU A 39 1.759 -0.007 20.913 1.00 0.00 C ATOM 588 C LEU A 39 3.056 -0.693 21.326 1.00 0.00 C ATOM 589 O LEU A 39 4.117 -0.073 21.393 1.00 0.00 O ATOM 590 CB LEU A 39 1.052 0.554 22.149 1.00 0.00 C ATOM 591 CG LEU A 39 -0.276 1.261 21.875 1.00 0.00 C ATOM 592 CD1 LEU A 39 -0.971 1.603 23.183 1.00 0.00 C ATOM 593 CD2 LEU A 39 -0.056 2.519 21.047 1.00 0.00 C ATOM 0 H LEU A 39 0.078 -1.250 20.765 1.00 0.00 H new ATOM 0 HA LEU A 39 1.991 0.814 20.234 1.00 0.00 H new ATOM 0 HB2 LEU A 39 0.873 -0.263 22.847 1.00 0.00 H new ATOM 0 HB3 LEU A 39 1.723 1.255 22.645 1.00 0.00 H new ATOM 0 HG LEU A 39 -0.914 0.585 21.306 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -1.915 2.106 22.973 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -1.164 0.688 23.743 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -0.333 2.261 23.773 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -1.014 3.006 20.864 1.00 0.00 H new ATOM 0 HD22 LEU A 39 0.600 3.201 21.588 1.00 0.00 H new ATOM 0 HD23 LEU A 39 0.403 2.252 20.095 1.00 0.00 H new ATOM 605 N ASN A 40 2.955 -1.986 21.602 1.00 0.00 N ATOM 606 CA ASN A 40 4.107 -2.796 21.967 1.00 0.00 C ATOM 607 C ASN A 40 5.111 -2.855 20.817 1.00 0.00 C ATOM 608 O ASN A 40 6.320 -2.791 21.037 1.00 0.00 O ATOM 609 CB ASN A 40 3.649 -4.205 22.361 1.00 0.00 C ATOM 610 CG ASN A 40 4.790 -5.127 22.749 1.00 0.00 C ATOM 611 OD1 ASN A 40 5.833 -4.689 23.235 1.00 0.00 O ATOM 612 ND2 ASN A 40 4.586 -6.420 22.553 1.00 0.00 N ATOM 0 H ASN A 40 2.075 -2.501 21.579 1.00 0.00 H new ATOM 0 HA ASN A 40 4.603 -2.337 22.822 1.00 0.00 H new ATOM 0 HB2 ASN A 40 2.952 -4.132 23.196 1.00 0.00 H new ATOM 0 HB3 ASN A 40 3.103 -4.647 21.528 1.00 0.00 H new ATOM 0 HD21 ASN A 40 5.308 -7.094 22.808 1.00 0.00 H new ATOM 0 HD22 ASN A 40 3.707 -6.742 22.147 1.00 0.00 H new ATOM 619 N ARG A 41 4.613 -2.968 19.591 1.00 0.00 N ATOM 620 CA ARG A 41 5.486 -2.933 18.426 1.00 0.00 C ATOM 621 C ARG A 41 5.940 -1.516 18.142 1.00 0.00 C ATOM 622 O ARG A 41 7.132 -1.251 17.991 1.00 0.00 O ATOM 623 CB ARG A 41 4.785 -3.472 17.186 1.00 0.00 C ATOM 624 CG ARG A 41 4.164 -4.832 17.380 1.00 0.00 C ATOM 625 CD ARG A 41 3.890 -5.501 16.046 1.00 0.00 C ATOM 626 NE ARG A 41 5.137 -5.787 15.337 1.00 0.00 N ATOM 627 CZ ARG A 41 5.463 -5.274 14.151 1.00 0.00 C ATOM 628 NH1 ARG A 41 4.583 -4.547 13.471 1.00 0.00 N ATOM 629 NH2 ARG A 41 6.664 -5.506 13.631 1.00 0.00 N ATOM 0 H ARG A 41 3.622 -3.083 19.380 1.00 0.00 H new ATOM 0 HA ARG A 41 6.345 -3.563 18.654 1.00 0.00 H new ATOM 0 HB2 ARG A 41 4.009 -2.768 16.884 1.00 0.00 H new ATOM 0 HB3 ARG A 41 5.503 -3.524 16.368 1.00 0.00 H new ATOM 0 HG2 ARG A 41 4.829 -5.458 17.975 1.00 0.00 H new ATOM 0 HG3 ARG A 41 3.234 -4.734 17.940 1.00 0.00 H new ATOM 0 HD2 ARG A 41 3.338 -6.427 16.206 1.00 0.00 H new ATOM 0 HD3 ARG A 41 3.259 -4.856 15.434 1.00 0.00 H new ATOM 0 HE ARG A 41 5.802 -6.422 15.780 1.00 0.00 H new ATOM 0 HH11 ARG A 41 3.654 -4.380 13.856 1.00 0.00 H new ATOM 0 HH12 ARG A 41 4.837 -4.156 12.564 1.00 0.00 H new ATOM 0 HH21 ARG A 41 7.338 -6.078 14.140 1.00 0.00 H new ATOM 0 HH22 ARG A 41 6.911 -5.112 12.723 1.00 0.00 H new ATOM 643 N GLY A 42 4.981 -0.610 18.062 1.00 0.00 N ATOM 644 CA GLY A 42 5.297 0.745 17.701 1.00 0.00 C ATOM 645 C GLY A 42 4.265 1.742 18.187 1.00 0.00 C ATOM 646 O GLY A 42 4.224 2.075 19.369 1.00 0.00 O ATOM 0 H GLY A 42 3.993 -0.792 18.241 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.271 1.008 18.114 1.00 0.00 H new ATOM 0 HA3 GLY A 42 5.381 0.816 16.617 1.00 0.00 H new ATOM 650 N VAL A 43 3.444 2.230 17.269 1.00 0.00 N ATOM 651 CA VAL A 43 2.421 3.206 17.595 1.00 0.00 C ATOM 652 C VAL A 43 1.136 2.866 16.848 1.00 0.00 C ATOM 653 O VAL A 43 1.183 2.296 15.757 1.00 0.00 O ATOM 654 CB VAL A 43 2.886 4.641 17.245 1.00 0.00 C ATOM 655 CG1 VAL A 43 2.930 4.863 15.736 1.00 0.00 C ATOM 656 CG2 VAL A 43 2.007 5.675 17.926 1.00 0.00 C ATOM 0 H VAL A 43 3.469 1.962 16.285 1.00 0.00 H new ATOM 0 HA VAL A 43 2.235 3.171 18.669 1.00 0.00 H new ATOM 0 HB VAL A 43 3.902 4.761 17.621 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.260 5.881 15.527 1.00 0.00 H new ATOM 0 HG12 VAL A 43 3.626 4.156 15.284 1.00 0.00 H new ATOM 0 HG13 VAL A 43 1.935 4.711 15.317 1.00 0.00 H new ATOM 0 HG21 VAL A 43 2.353 6.675 17.665 1.00 0.00 H new ATOM 0 HG22 VAL A 43 0.976 5.550 17.596 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.060 5.543 19.007 1.00 0.00 H new ATOM 666 N SER A 44 0.000 3.208 17.430 1.00 0.00 N ATOM 667 CA SER A 44 -1.285 2.838 16.863 1.00 0.00 C ATOM 668 C SER A 44 -2.155 4.070 16.637 1.00 0.00 C ATOM 669 O SER A 44 -1.949 5.109 17.266 1.00 0.00 O ATOM 670 CB SER A 44 -1.993 1.854 17.802 1.00 0.00 C ATOM 671 OG SER A 44 -3.281 1.504 17.330 1.00 0.00 O ATOM 0 H SER A 44 -0.059 3.742 18.297 1.00 0.00 H new ATOM 0 HA SER A 44 -1.118 2.362 15.897 1.00 0.00 H new ATOM 0 HB2 SER A 44 -1.388 0.953 17.906 1.00 0.00 H new ATOM 0 HB3 SER A 44 -2.079 2.297 18.794 1.00 0.00 H new ATOM 0 HG SER A 44 -3.567 0.666 17.750 1.00 0.00 H new ATOM 677 N PHE A 45 -3.118 3.950 15.728 1.00 0.00 N ATOM 678 CA PHE A 45 -4.110 4.999 15.520 1.00 0.00 C ATOM 679 C PHE A 45 -5.065 5.073 16.705 1.00 0.00 C ATOM 680 O PHE A 45 -4.960 4.289 17.651 1.00 0.00 O ATOM 681 CB PHE A 45 -4.913 4.754 14.240 1.00 0.00 C ATOM 682 CG PHE A 45 -4.190 5.112 12.976 1.00 0.00 C ATOM 683 CD1 PHE A 45 -3.568 6.344 12.842 1.00 0.00 C ATOM 684 CD2 PHE A 45 -4.156 4.230 11.910 1.00 0.00 C ATOM 685 CE1 PHE A 45 -2.924 6.688 11.670 1.00 0.00 C ATOM 686 CE2 PHE A 45 -3.511 4.565 10.735 1.00 0.00 C ATOM 687 CZ PHE A 45 -2.895 5.798 10.615 1.00 0.00 C ATOM 0 H PHE A 45 -3.232 3.136 15.124 1.00 0.00 H new ATOM 0 HA PHE A 45 -3.574 5.943 15.424 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -5.194 3.702 14.198 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -5.838 5.329 14.290 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -3.587 7.043 13.665 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -4.639 3.268 11.998 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -2.444 7.651 11.579 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.488 3.866 9.912 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.392 6.064 9.697 1.00 0.00 H new ATOM 697 N ALA A 46 -5.994 6.018 16.647 1.00 0.00 N ATOM 698 CA ALA A 46 -7.004 6.161 17.684 1.00 0.00 C ATOM 699 C ALA A 46 -7.935 4.954 17.696 1.00 0.00 C ATOM 700 O ALA A 46 -8.224 4.388 18.752 1.00 0.00 O ATOM 701 CB ALA A 46 -7.795 7.444 17.478 1.00 0.00 C ATOM 0 H ALA A 46 -6.068 6.698 15.890 1.00 0.00 H new ATOM 0 HA ALA A 46 -6.502 6.215 18.650 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -8.547 7.538 18.261 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -7.120 8.298 17.520 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -8.286 7.417 16.505 1.00 0.00 H new ATOM 707 N GLU A 47 -8.393 4.562 16.514 1.00 0.00 N ATOM 708 CA GLU A 47 -9.280 3.419 16.376 1.00 0.00 C ATOM 709 C GLU A 47 -9.060 2.729 15.031 1.00 0.00 C ATOM 710 O GLU A 47 -8.185 3.122 14.260 1.00 0.00 O ATOM 711 CB GLU A 47 -10.740 3.847 16.541 1.00 0.00 C ATOM 712 CG GLU A 47 -11.203 4.891 15.541 1.00 0.00 C ATOM 713 CD GLU A 47 -12.644 5.294 15.773 1.00 0.00 C ATOM 714 OE1 GLU A 47 -13.546 4.564 15.311 1.00 0.00 O ATOM 715 OE2 GLU A 47 -12.879 6.328 16.432 1.00 0.00 O ATOM 0 H GLU A 47 -8.162 5.023 15.634 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.048 2.704 17.165 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -11.377 2.967 16.450 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.880 4.239 17.548 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -10.564 5.771 15.612 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -11.094 4.499 14.530 1.00 0.00 H new ATOM 722 N GLU A 48 -9.862 1.711 14.752 1.00 0.00 N ATOM 723 CA GLU A 48 -9.633 0.854 13.598 1.00 0.00 C ATOM 724 C GLU A 48 -10.454 1.320 12.392 1.00 0.00 C ATOM 725 O GLU A 48 -10.060 1.112 11.245 1.00 0.00 O ATOM 726 CB GLU A 48 -9.970 -0.597 13.966 1.00 0.00 C ATOM 727 CG GLU A 48 -9.441 -1.632 12.985 1.00 0.00 C ATOM 728 CD GLU A 48 -9.811 -3.047 13.385 1.00 0.00 C ATOM 729 OE1 GLU A 48 -8.929 -3.797 13.857 1.00 0.00 O ATOM 730 OE2 GLU A 48 -10.994 -3.414 13.238 1.00 0.00 O ATOM 0 H GLU A 48 -10.678 1.458 15.310 1.00 0.00 H new ATOM 0 HA GLU A 48 -8.582 0.915 13.316 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -9.566 -0.812 14.955 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -11.053 -0.700 14.035 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -9.837 -1.423 11.991 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -8.356 -1.547 12.921 1.00 0.00 H new ATOM 737 N ASN A 49 -11.583 1.970 12.653 1.00 0.00 N ATOM 738 CA ASN A 49 -12.463 2.440 11.580 1.00 0.00 C ATOM 739 C ASN A 49 -11.977 3.781 11.022 1.00 0.00 C ATOM 740 O ASN A 49 -12.463 4.255 9.992 1.00 0.00 O ATOM 741 CB ASN A 49 -13.899 2.575 12.096 1.00 0.00 C ATOM 742 CG ASN A 49 -14.919 2.826 10.993 1.00 0.00 C ATOM 743 OD1 ASN A 49 -14.736 2.194 9.840 1.00 0.00 O flip ATOM 744 ND2 ASN A 49 -15.891 3.556 11.193 1.00 0.00 N flip ATOM 0 H ASN A 49 -11.913 2.185 13.594 1.00 0.00 H new ATOM 0 HA ASN A 49 -12.441 1.706 10.775 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -14.171 1.666 12.632 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -13.943 3.394 12.814 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -15.999 4.026 12.092 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -16.587 3.690 10.460 1.00 0.00 H new ATOM 751 N GLU A 50 -11.006 4.385 11.703 1.00 0.00 N ATOM 752 CA GLU A 50 -10.447 5.664 11.279 1.00 0.00 C ATOM 753 C GLU A 50 -9.860 5.539 9.870 1.00 0.00 C ATOM 754 O GLU A 50 -9.302 4.502 9.513 1.00 0.00 O ATOM 755 CB GLU A 50 -9.383 6.130 12.278 1.00 0.00 C ATOM 756 CG GLU A 50 -8.909 7.553 12.049 1.00 0.00 C ATOM 757 CD GLU A 50 -8.094 8.081 13.208 1.00 0.00 C ATOM 758 OE1 GLU A 50 -8.696 8.558 14.194 1.00 0.00 O ATOM 759 OE2 GLU A 50 -6.853 8.027 13.134 1.00 0.00 O ATOM 0 H GLU A 50 -10.589 4.007 12.554 1.00 0.00 H new ATOM 0 HA GLU A 50 -11.240 6.411 11.253 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -9.786 6.049 13.288 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -8.526 5.458 12.222 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -8.310 7.592 11.139 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -9.772 8.200 11.890 1.00 0.00 H new ATOM 766 N SER A 51 -10.004 6.582 9.062 1.00 0.00 N ATOM 767 CA SER A 51 -9.645 6.499 7.651 1.00 0.00 C ATOM 768 C SER A 51 -8.579 7.529 7.276 1.00 0.00 C ATOM 769 O SER A 51 -8.578 8.646 7.785 1.00 0.00 O ATOM 770 CB SER A 51 -10.898 6.692 6.800 1.00 0.00 C ATOM 771 OG SER A 51 -11.905 5.764 7.177 1.00 0.00 O ATOM 0 H SER A 51 -10.364 7.490 9.356 1.00 0.00 H new ATOM 0 HA SER A 51 -9.220 5.513 7.461 1.00 0.00 H new ATOM 0 HB2 SER A 51 -11.271 7.709 6.917 1.00 0.00 H new ATOM 0 HB3 SER A 51 -10.652 6.562 5.746 1.00 0.00 H new ATOM 0 HG SER A 51 -12.701 5.903 6.623 1.00 0.00 H new ATOM 777 N LEU A 52 -7.695 7.146 6.358 1.00 0.00 N ATOM 778 CA LEU A 52 -6.561 7.983 5.962 1.00 0.00 C ATOM 779 C LEU A 52 -6.966 9.039 4.936 1.00 0.00 C ATOM 780 O LEU A 52 -6.190 9.944 4.621 1.00 0.00 O ATOM 781 CB LEU A 52 -5.453 7.104 5.375 1.00 0.00 C ATOM 782 CG LEU A 52 -4.932 6.008 6.304 1.00 0.00 C ATOM 783 CD1 LEU A 52 -3.939 5.117 5.576 1.00 0.00 C ATOM 784 CD2 LEU A 52 -4.294 6.623 7.538 1.00 0.00 C ATOM 0 H LEU A 52 -7.742 6.252 5.869 1.00 0.00 H new ATOM 0 HA LEU A 52 -6.202 8.499 6.853 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -5.826 6.638 4.463 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -4.618 7.743 5.088 1.00 0.00 H new ATOM 0 HG LEU A 52 -5.774 5.392 6.620 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -3.579 4.343 6.254 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -4.427 4.651 4.720 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -3.097 5.717 5.231 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -3.927 5.831 8.191 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -3.462 7.260 7.238 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.034 7.219 8.071 1.00 0.00 H new ATOM 796 N ASP A 53 -8.174 8.919 4.409 1.00 0.00 N ATOM 797 CA ASP A 53 -8.639 9.825 3.366 1.00 0.00 C ATOM 798 C ASP A 53 -9.557 10.893 3.954 1.00 0.00 C ATOM 799 O ASP A 53 -10.112 11.729 3.239 1.00 0.00 O ATOM 800 CB ASP A 53 -9.362 9.041 2.270 1.00 0.00 C ATOM 801 CG ASP A 53 -9.577 9.856 1.009 1.00 0.00 C ATOM 802 OD1 ASP A 53 -8.587 10.145 0.307 1.00 0.00 O ATOM 803 OD2 ASP A 53 -10.742 10.183 0.689 1.00 0.00 O ATOM 0 H ASP A 53 -8.850 8.206 4.684 1.00 0.00 H new ATOM 0 HA ASP A 53 -7.774 10.322 2.926 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -8.785 8.149 2.027 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -10.327 8.703 2.648 1.00 0.00 H new ATOM 808 N ASP A 54 -9.702 10.870 5.270 1.00 0.00 N ATOM 809 CA ASP A 54 -10.549 11.837 5.955 1.00 0.00 C ATOM 810 C ASP A 54 -9.695 12.992 6.463 1.00 0.00 C ATOM 811 O ASP A 54 -8.477 12.984 6.295 1.00 0.00 O ATOM 812 CB ASP A 54 -11.300 11.176 7.113 1.00 0.00 C ATOM 813 CG ASP A 54 -12.528 11.968 7.526 1.00 0.00 C ATOM 814 OD1 ASP A 54 -13.623 11.688 7.005 1.00 0.00 O ATOM 815 OD2 ASP A 54 -12.401 12.882 8.362 1.00 0.00 O ATOM 0 H ASP A 54 -9.246 10.195 5.884 1.00 0.00 H new ATOM 0 HA ASP A 54 -11.288 12.220 5.252 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -11.600 10.169 6.822 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -10.631 11.075 7.967 1.00 0.00 H new ATOM 820 N GLN A 55 -10.323 13.979 7.085 1.00 0.00 N ATOM 821 CA GLN A 55 -9.604 15.153 7.550 1.00 0.00 C ATOM 822 C GLN A 55 -9.252 15.037 9.025 1.00 0.00 C ATOM 823 O GLN A 55 -8.503 15.852 9.557 1.00 0.00 O ATOM 824 CB GLN A 55 -10.406 16.430 7.273 1.00 0.00 C ATOM 825 CG GLN A 55 -11.841 16.412 7.780 1.00 0.00 C ATOM 826 CD GLN A 55 -11.983 16.650 9.277 1.00 0.00 C ATOM 827 OE1 GLN A 55 -11.115 17.471 9.849 1.00 0.00 O flip ATOM 828 NE2 GLN A 55 -12.891 16.114 9.910 1.00 0.00 N flip ATOM 0 H GLN A 55 -11.324 13.990 7.278 1.00 0.00 H new ATOM 0 HA GLN A 55 -8.669 15.214 6.992 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.886 17.273 7.728 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -10.419 16.607 6.197 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -12.411 17.174 7.248 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -12.288 15.449 7.534 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -13.542 15.487 9.437 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -12.994 16.296 10.908 1.00 0.00 H new ATOM 837 N ASN A 56 -9.785 14.024 9.687 1.00 0.00 N ATOM 838 CA ASN A 56 -9.462 13.813 11.092 1.00 0.00 C ATOM 839 C ASN A 56 -8.805 12.452 11.297 1.00 0.00 C ATOM 840 O ASN A 56 -9.436 11.404 11.174 1.00 0.00 O ATOM 841 CB ASN A 56 -10.685 14.008 12.024 1.00 0.00 C ATOM 842 CG ASN A 56 -11.692 12.862 12.050 1.00 0.00 C ATOM 843 OD1 ASN A 56 -12.054 12.324 10.901 1.00 0.00 O flip ATOM 844 ND2 ASN A 56 -12.189 12.497 13.116 1.00 0.00 N flip ATOM 0 H ASN A 56 -10.432 13.345 9.286 1.00 0.00 H new ATOM 0 HA ASN A 56 -8.744 14.583 11.375 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -10.322 14.170 13.039 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -11.206 14.917 11.723 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -11.892 12.929 13.991 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -12.897 11.763 13.124 1.00 0.00 H new ATOM 851 N ILE A 57 -7.508 12.483 11.552 1.00 0.00 N ATOM 852 CA ILE A 57 -6.744 11.275 11.819 1.00 0.00 C ATOM 853 C ILE A 57 -5.980 11.454 13.122 1.00 0.00 C ATOM 854 O ILE A 57 -5.406 12.519 13.370 1.00 0.00 O ATOM 855 CB ILE A 57 -5.767 10.959 10.661 1.00 0.00 C ATOM 856 CG1 ILE A 57 -6.528 10.957 9.332 1.00 0.00 C ATOM 857 CG2 ILE A 57 -5.082 9.616 10.887 1.00 0.00 C ATOM 858 CD1 ILE A 57 -5.645 10.806 8.119 1.00 0.00 C ATOM 0 H ILE A 57 -6.957 13.341 11.580 1.00 0.00 H new ATOM 0 HA ILE A 57 -7.432 10.433 11.904 1.00 0.00 H new ATOM 0 HB ILE A 57 -4.996 11.729 10.628 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -7.255 10.145 9.343 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -7.090 11.887 9.246 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -4.399 9.412 10.062 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -4.523 9.646 11.822 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -5.834 8.828 10.939 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -6.259 10.814 7.219 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -4.935 11.632 8.081 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -5.102 9.863 8.179 1.00 0.00 H new ATOM 870 N SER A 58 -5.989 10.436 13.960 1.00 0.00 N ATOM 871 CA SER A 58 -5.428 10.554 15.288 1.00 0.00 C ATOM 872 C SER A 58 -4.509 9.381 15.597 1.00 0.00 C ATOM 873 O SER A 58 -4.854 8.223 15.377 1.00 0.00 O ATOM 874 CB SER A 58 -6.556 10.638 16.320 1.00 0.00 C ATOM 875 OG SER A 58 -6.041 10.808 17.628 1.00 0.00 O ATOM 0 H SER A 58 -6.379 9.519 13.743 1.00 0.00 H new ATOM 0 HA SER A 58 -4.833 11.466 15.335 1.00 0.00 H new ATOM 0 HB2 SER A 58 -7.216 11.470 16.075 1.00 0.00 H new ATOM 0 HB3 SER A 58 -7.159 9.731 16.279 1.00 0.00 H new ATOM 0 HG SER A 58 -6.721 10.546 18.284 1.00 0.00 H new ATOM 881 N ILE A 59 -3.334 9.692 16.119 1.00 0.00 N ATOM 882 CA ILE A 59 -2.367 8.671 16.470 1.00 0.00 C ATOM 883 C ILE A 59 -2.148 8.682 17.978 1.00 0.00 C ATOM 884 O ILE A 59 -1.881 9.731 18.569 1.00 0.00 O ATOM 885 CB ILE A 59 -1.019 8.888 15.746 1.00 0.00 C ATOM 886 CG1 ILE A 59 -1.245 9.120 14.246 1.00 0.00 C ATOM 887 CG2 ILE A 59 -0.111 7.684 15.960 1.00 0.00 C ATOM 888 CD1 ILE A 59 0.027 9.392 13.471 1.00 0.00 C ATOM 0 H ILE A 59 -3.028 10.647 16.309 1.00 0.00 H new ATOM 0 HA ILE A 59 -2.762 7.706 16.154 1.00 0.00 H new ATOM 0 HB ILE A 59 -0.539 9.773 16.164 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -1.737 8.244 13.823 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -1.925 9.962 14.117 1.00 0.00 H new ATOM 0 HG21 ILE A 59 0.836 7.847 15.446 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.073 7.552 17.026 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.591 6.791 15.561 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -0.214 9.546 12.419 1.00 0.00 H new ATOM 0 HD12 ILE A 59 0.510 10.285 13.867 1.00 0.00 H new ATOM 0 HD13 ILE A 59 0.701 8.541 13.568 1.00 0.00 H new ATOM 900 N ALA A 60 -2.276 7.523 18.600 1.00 0.00 N ATOM 901 CA ALA A 60 -2.181 7.420 20.043 1.00 0.00 C ATOM 902 C ALA A 60 -0.745 7.163 20.480 1.00 0.00 C ATOM 903 O ALA A 60 -0.186 6.095 20.228 1.00 0.00 O ATOM 904 CB ALA A 60 -3.101 6.320 20.555 1.00 0.00 C ATOM 0 H ALA A 60 -2.447 6.637 18.124 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.497 8.370 20.474 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -3.020 6.253 21.640 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.131 6.550 20.282 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -2.812 5.368 20.110 1.00 0.00 H new ATOM 910 N GLY A 61 -0.159 8.153 21.130 1.00 0.00 N ATOM 911 CA GLY A 61 1.201 8.033 21.616 1.00 0.00 C ATOM 912 C GLY A 61 1.241 7.778 23.107 1.00 0.00 C ATOM 913 O GLY A 61 0.489 8.386 23.870 1.00 0.00 O ATOM 0 H GLY A 61 -0.605 9.048 21.333 1.00 0.00 H new ATOM 0 HA2 GLY A 61 1.704 7.219 21.094 1.00 0.00 H new ATOM 0 HA3 GLY A 61 1.751 8.946 21.388 1.00 0.00 H new ATOM 917 N HIS A 62 2.114 6.877 23.525 1.00 0.00 N ATOM 918 CA HIS A 62 2.214 6.499 24.927 1.00 0.00 C ATOM 919 C HIS A 62 3.650 6.128 25.272 1.00 0.00 C ATOM 920 O HIS A 62 4.107 5.029 24.948 1.00 0.00 O ATOM 921 CB HIS A 62 1.276 5.322 25.221 1.00 0.00 C ATOM 922 CG HIS A 62 1.403 4.763 26.609 1.00 0.00 C ATOM 923 ND1 HIS A 62 2.249 3.720 26.918 1.00 0.00 N ATOM 924 CD2 HIS A 62 0.778 5.093 27.763 1.00 0.00 C ATOM 925 CE1 HIS A 62 2.137 3.431 28.201 1.00 0.00 C ATOM 926 NE2 HIS A 62 1.254 4.248 28.737 1.00 0.00 N ATOM 0 H HIS A 62 2.767 6.391 22.911 1.00 0.00 H new ATOM 0 HA HIS A 62 1.917 7.348 25.543 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.247 5.645 25.065 1.00 0.00 H new ATOM 0 HB3 HIS A 62 1.473 4.527 24.502 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.043 5.874 27.894 1.00 0.00 H new ATOM 0 HE1 HIS A 62 2.678 2.656 28.723 1.00 0.00 H new ATOM 0 HE2 HIS A 62 0.969 4.253 29.716 1.00 0.00 H new ATOM 934 N THR A 63 4.348 7.052 25.924 1.00 0.00 N ATOM 935 CA THR A 63 5.731 6.842 26.331 1.00 0.00 C ATOM 936 C THR A 63 5.852 5.587 27.201 1.00 0.00 C ATOM 937 O THR A 63 4.926 5.240 27.939 1.00 0.00 O ATOM 938 CB THR A 63 6.246 8.059 27.116 1.00 0.00 C ATOM 939 OG1 THR A 63 5.664 9.254 26.580 1.00 0.00 O ATOM 940 CG2 THR A 63 7.761 8.159 27.028 1.00 0.00 C ATOM 0 H THR A 63 3.972 7.964 26.184 1.00 0.00 H new ATOM 0 HA THR A 63 6.333 6.711 25.432 1.00 0.00 H new ATOM 0 HB THR A 63 5.963 7.939 28.162 1.00 0.00 H new ATOM 0 HG1 THR A 63 5.952 10.025 27.112 1.00 0.00 H new ATOM 0 HG21 THR A 63 8.102 9.028 27.591 1.00 0.00 H new ATOM 0 HG22 THR A 63 8.210 7.257 27.445 1.00 0.00 H new ATOM 0 HG23 THR A 63 8.059 8.263 25.985 1.00 0.00 H new ATOM 948 N PHE A 64 6.981 4.900 27.104 1.00 0.00 N ATOM 949 CA PHE A 64 7.185 3.674 27.857 1.00 0.00 C ATOM 950 C PHE A 64 8.608 3.621 28.402 1.00 0.00 C ATOM 951 O PHE A 64 9.535 4.135 27.780 1.00 0.00 O ATOM 952 CB PHE A 64 6.890 2.459 26.971 1.00 0.00 C ATOM 953 CG PHE A 64 6.919 1.143 27.700 1.00 0.00 C ATOM 954 CD1 PHE A 64 7.969 0.255 27.517 1.00 0.00 C ATOM 955 CD2 PHE A 64 5.897 0.797 28.568 1.00 0.00 C ATOM 956 CE1 PHE A 64 7.996 -0.952 28.188 1.00 0.00 C ATOM 957 CE2 PHE A 64 5.919 -0.409 29.240 1.00 0.00 C ATOM 958 CZ PHE A 64 6.970 -1.285 29.051 1.00 0.00 C ATOM 0 H PHE A 64 7.767 5.171 26.513 1.00 0.00 H new ATOM 0 HA PHE A 64 6.498 3.656 28.703 1.00 0.00 H new ATOM 0 HB2 PHE A 64 5.909 2.587 26.513 1.00 0.00 H new ATOM 0 HB3 PHE A 64 7.618 2.429 26.161 1.00 0.00 H new ATOM 0 HD1 PHE A 64 8.773 0.510 26.843 1.00 0.00 H new ATOM 0 HD2 PHE A 64 5.073 1.478 28.721 1.00 0.00 H new ATOM 0 HE1 PHE A 64 8.819 -1.635 28.038 1.00 0.00 H new ATOM 0 HE2 PHE A 64 5.115 -0.667 29.913 1.00 0.00 H new ATOM 0 HZ PHE A 64 6.990 -2.228 29.577 1.00 0.00 H new ATOM 968 N ILE A 65 8.761 2.990 29.560 1.00 0.00 N ATOM 969 CA ILE A 65 10.035 2.941 30.275 1.00 0.00 C ATOM 970 C ILE A 65 11.171 2.401 29.402 1.00 0.00 C ATOM 971 O ILE A 65 12.224 3.029 29.270 1.00 0.00 O ATOM 972 CB ILE A 65 9.914 2.053 31.534 1.00 0.00 C ATOM 973 CG1 ILE A 65 8.709 2.482 32.378 1.00 0.00 C ATOM 974 CG2 ILE A 65 11.192 2.125 32.359 1.00 0.00 C ATOM 975 CD1 ILE A 65 8.428 1.565 33.550 1.00 0.00 C ATOM 0 H ILE A 65 8.004 2.496 30.033 1.00 0.00 H new ATOM 0 HA ILE A 65 10.274 3.967 30.556 1.00 0.00 H new ATOM 0 HB ILE A 65 9.764 1.021 31.216 1.00 0.00 H new ATOM 0 HG12 ILE A 65 8.879 3.492 32.751 1.00 0.00 H new ATOM 0 HG13 ILE A 65 7.826 2.523 31.740 1.00 0.00 H new ATOM 0 HG21 ILE A 65 11.091 1.494 33.242 1.00 0.00 H new ATOM 0 HG22 ILE A 65 12.033 1.777 31.759 1.00 0.00 H new ATOM 0 HG23 ILE A 65 11.368 3.155 32.667 1.00 0.00 H new ATOM 0 HD11 ILE A 65 7.562 1.933 34.100 1.00 0.00 H new ATOM 0 HD12 ILE A 65 8.225 0.559 33.184 1.00 0.00 H new ATOM 0 HD13 ILE A 65 9.295 1.543 34.211 1.00 0.00 H new ATOM 987 N ASP A 66 10.941 1.249 28.788 1.00 0.00 N ATOM 988 CA ASP A 66 11.988 0.544 28.052 1.00 0.00 C ATOM 989 C ASP A 66 12.069 1.014 26.599 1.00 0.00 C ATOM 990 O ASP A 66 12.251 0.212 25.685 1.00 0.00 O ATOM 991 CB ASP A 66 11.723 -0.962 28.102 1.00 0.00 C ATOM 992 CG ASP A 66 12.941 -1.791 27.735 1.00 0.00 C ATOM 993 OD1 ASP A 66 12.840 -2.633 26.816 1.00 0.00 O ATOM 994 OD2 ASP A 66 14.001 -1.613 28.375 1.00 0.00 O ATOM 0 H ASP A 66 10.036 0.779 28.784 1.00 0.00 H new ATOM 0 HA ASP A 66 12.945 0.766 28.525 1.00 0.00 H new ATOM 0 HB2 ASP A 66 11.394 -1.234 29.105 1.00 0.00 H new ATOM 0 HB3 ASP A 66 10.907 -1.205 27.422 1.00 0.00 H new ATOM 999 N ARG A 67 11.934 2.313 26.383 1.00 0.00 N ATOM 1000 CA ARG A 67 12.075 2.880 25.049 1.00 0.00 C ATOM 1001 C ARG A 67 12.214 4.401 25.101 1.00 0.00 C ATOM 1002 O ARG A 67 11.228 5.134 25.052 1.00 0.00 O ATOM 1003 CB ARG A 67 10.908 2.465 24.141 1.00 0.00 C ATOM 1004 CG ARG A 67 9.538 2.650 24.766 1.00 0.00 C ATOM 1005 CD ARG A 67 8.432 2.185 23.830 1.00 0.00 C ATOM 1006 NE ARG A 67 8.463 0.740 23.604 1.00 0.00 N ATOM 1007 CZ ARG A 67 7.589 0.091 22.834 1.00 0.00 C ATOM 1008 NH1 ARG A 67 6.626 0.758 22.205 1.00 0.00 N ATOM 1009 NH2 ARG A 67 7.668 -1.225 22.711 1.00 0.00 N ATOM 0 H ARG A 67 11.727 2.995 27.113 1.00 0.00 H new ATOM 0 HA ARG A 67 12.992 2.478 24.619 1.00 0.00 H new ATOM 0 HB2 ARG A 67 10.956 3.045 23.219 1.00 0.00 H new ATOM 0 HB3 ARG A 67 11.031 1.418 23.866 1.00 0.00 H new ATOM 0 HG2 ARG A 67 9.484 2.091 25.700 1.00 0.00 H new ATOM 0 HG3 ARG A 67 9.389 3.701 25.014 1.00 0.00 H new ATOM 0 HD2 ARG A 67 7.465 2.464 24.248 1.00 0.00 H new ATOM 0 HD3 ARG A 67 8.527 2.701 22.875 1.00 0.00 H new ATOM 0 HE ARG A 67 9.195 0.198 24.062 1.00 0.00 H new ATOM 0 HH11 ARG A 67 6.554 1.770 22.311 1.00 0.00 H new ATOM 0 HH12 ARG A 67 5.959 0.258 21.617 1.00 0.00 H new ATOM 0 HH21 ARG A 67 8.397 -1.741 23.205 1.00 0.00 H new ATOM 0 HH22 ARG A 67 7.000 -1.723 22.122 1.00 0.00 H new ATOM 1023 N PRO A 68 13.460 4.885 25.226 1.00 0.00 N ATOM 1024 CA PRO A 68 13.769 6.319 25.218 1.00 0.00 C ATOM 1025 C PRO A 68 13.778 6.892 23.812 1.00 0.00 C ATOM 1026 O PRO A 68 13.940 8.099 23.613 1.00 0.00 O ATOM 1027 CB PRO A 68 15.183 6.378 25.789 1.00 0.00 C ATOM 1028 CG PRO A 68 15.792 5.063 25.439 1.00 0.00 C ATOM 1029 CD PRO A 68 14.669 4.061 25.403 1.00 0.00 C ATOM 0 HA PRO A 68 13.030 6.894 25.777 1.00 0.00 H new ATOM 0 HB2 PRO A 68 15.749 7.203 25.357 1.00 0.00 H new ATOM 0 HB3 PRO A 68 15.167 6.532 26.868 1.00 0.00 H new ATOM 0 HG2 PRO A 68 16.295 5.115 24.474 1.00 0.00 H new ATOM 0 HG3 PRO A 68 16.543 4.776 26.175 1.00 0.00 H new ATOM 0 HD2 PRO A 68 14.792 3.353 24.584 1.00 0.00 H new ATOM 0 HD3 PRO A 68 14.624 3.479 26.324 1.00 0.00 H new ATOM 1037 N ASN A 69 13.606 6.015 22.841 1.00 0.00 N ATOM 1038 CA ASN A 69 13.792 6.370 21.454 1.00 0.00 C ATOM 1039 C ASN A 69 12.970 5.449 20.566 1.00 0.00 C ATOM 1040 O ASN A 69 13.458 4.430 20.080 1.00 0.00 O ATOM 1041 CB ASN A 69 15.275 6.265 21.106 1.00 0.00 C ATOM 1042 CG ASN A 69 15.639 6.950 19.807 1.00 0.00 C ATOM 1043 OD1 ASN A 69 14.849 7.012 18.865 1.00 0.00 O ATOM 1044 ND2 ASN A 69 16.845 7.481 19.763 1.00 0.00 N ATOM 0 H ASN A 69 13.335 5.044 22.994 1.00 0.00 H new ATOM 0 HA ASN A 69 13.456 7.394 21.288 1.00 0.00 H new ATOM 0 HB2 ASN A 69 15.862 6.701 21.915 1.00 0.00 H new ATOM 0 HB3 ASN A 69 15.552 5.213 21.043 1.00 0.00 H new ATOM 0 HD21 ASN A 69 17.157 7.968 18.923 1.00 0.00 H new ATOM 0 HD22 ASN A 69 17.466 7.405 20.569 1.00 0.00 H new ATOM 1051 N TYR A 70 11.709 5.786 20.410 1.00 0.00 N ATOM 1052 CA TYR A 70 10.813 5.029 19.555 1.00 0.00 C ATOM 1053 C TYR A 70 9.924 5.996 18.772 1.00 0.00 C ATOM 1054 O TYR A 70 10.184 7.201 18.762 1.00 0.00 O ATOM 1055 CB TYR A 70 9.957 4.063 20.395 1.00 0.00 C ATOM 1056 CG TYR A 70 8.870 4.749 21.195 1.00 0.00 C ATOM 1057 CD1 TYR A 70 9.173 5.505 22.319 1.00 0.00 C ATOM 1058 CD2 TYR A 70 7.541 4.657 20.806 1.00 0.00 C ATOM 1059 CE1 TYR A 70 8.183 6.155 23.027 1.00 0.00 C ATOM 1060 CE2 TYR A 70 6.546 5.296 21.510 1.00 0.00 C ATOM 1061 CZ TYR A 70 6.870 6.045 22.617 1.00 0.00 C ATOM 1062 OH TYR A 70 5.882 6.699 23.304 1.00 0.00 O ATOM 0 H TYR A 70 11.275 6.587 20.868 1.00 0.00 H new ATOM 0 HA TYR A 70 11.399 4.435 18.853 1.00 0.00 H new ATOM 0 HB2 TYR A 70 9.499 3.328 19.733 1.00 0.00 H new ATOM 0 HB3 TYR A 70 10.607 3.516 21.077 1.00 0.00 H new ATOM 0 HD1 TYR A 70 10.200 5.586 22.644 1.00 0.00 H new ATOM 0 HD2 TYR A 70 7.283 4.073 19.935 1.00 0.00 H new ATOM 0 HE1 TYR A 70 8.434 6.746 23.896 1.00 0.00 H new ATOM 0 HE2 TYR A 70 5.517 5.210 21.195 1.00 0.00 H new ATOM 0 HH TYR A 70 5.907 7.654 23.084 1.00 0.00 H new ATOM 1072 N GLN A 71 8.891 5.439 18.134 1.00 0.00 N ATOM 1073 CA GLN A 71 7.864 6.184 17.378 1.00 0.00 C ATOM 1074 C GLN A 71 7.713 7.641 17.835 1.00 0.00 C ATOM 1075 O GLN A 71 8.172 8.562 17.164 1.00 0.00 O ATOM 1076 CB GLN A 71 6.512 5.482 17.533 1.00 0.00 C ATOM 1077 CG GLN A 71 6.552 3.978 17.295 1.00 0.00 C ATOM 1078 CD GLN A 71 6.706 3.603 15.837 1.00 0.00 C ATOM 1079 OE1 GLN A 71 6.127 4.399 14.960 1.00 0.00 O flip ATOM 1080 NE2 GLN A 71 7.320 2.588 15.507 1.00 0.00 N flip ATOM 0 H GLN A 71 8.736 4.431 18.125 1.00 0.00 H new ATOM 0 HA GLN A 71 8.190 6.199 16.338 1.00 0.00 H new ATOM 0 HB2 GLN A 71 6.133 5.668 18.538 1.00 0.00 H new ATOM 0 HB3 GLN A 71 5.803 5.929 16.837 1.00 0.00 H new ATOM 0 HG2 GLN A 71 7.379 3.550 17.862 1.00 0.00 H new ATOM 0 HG3 GLN A 71 5.636 3.532 17.682 1.00 0.00 H new ATOM 0 HE21 GLN A 71 7.753 2.000 16.219 1.00 0.00 H new ATOM 0 HE22 GLN A 71 7.395 2.335 14.522 1.00 0.00 H new ATOM 1089 N PHE A 72 7.066 7.844 18.979 1.00 0.00 N ATOM 1090 CA PHE A 72 6.852 9.188 19.503 1.00 0.00 C ATOM 1091 C PHE A 72 7.549 9.362 20.843 1.00 0.00 C ATOM 1092 O PHE A 72 7.016 8.979 21.881 1.00 0.00 O ATOM 1093 CB PHE A 72 5.357 9.491 19.665 1.00 0.00 C ATOM 1094 CG PHE A 72 4.603 9.639 18.374 1.00 0.00 C ATOM 1095 CD1 PHE A 72 3.245 9.376 18.324 1.00 0.00 C ATOM 1096 CD2 PHE A 72 5.245 10.048 17.216 1.00 0.00 C ATOM 1097 CE1 PHE A 72 2.541 9.519 17.145 1.00 0.00 C ATOM 1098 CE2 PHE A 72 4.547 10.191 16.034 1.00 0.00 C ATOM 1099 CZ PHE A 72 3.193 9.926 15.998 1.00 0.00 C ATOM 0 H PHE A 72 6.682 7.098 19.559 1.00 0.00 H new ATOM 0 HA PHE A 72 7.276 9.888 18.783 1.00 0.00 H new ATOM 0 HB2 PHE A 72 4.899 8.692 20.248 1.00 0.00 H new ATOM 0 HB3 PHE A 72 5.247 10.409 20.242 1.00 0.00 H new ATOM 0 HD1 PHE A 72 2.730 9.055 19.218 1.00 0.00 H new ATOM 0 HD2 PHE A 72 6.304 10.257 17.239 1.00 0.00 H new ATOM 0 HE1 PHE A 72 1.481 9.313 17.120 1.00 0.00 H new ATOM 0 HE2 PHE A 72 5.060 10.510 15.138 1.00 0.00 H new ATOM 0 HZ PHE A 72 2.644 10.037 15.074 1.00 0.00 H new ATOM 1109 N THR A 73 8.746 9.925 20.820 1.00 0.00 N ATOM 1110 CA THR A 73 9.481 10.179 22.052 1.00 0.00 C ATOM 1111 C THR A 73 10.075 11.584 22.045 1.00 0.00 C ATOM 1112 O THR A 73 9.902 12.355 22.985 1.00 0.00 O ATOM 1113 CB THR A 73 10.625 9.170 22.250 1.00 0.00 C ATOM 1114 OG1 THR A 73 10.419 8.021 21.418 1.00 0.00 O ATOM 1115 CG2 THR A 73 10.703 8.732 23.704 1.00 0.00 C ATOM 0 H THR A 73 9.228 10.214 19.969 1.00 0.00 H new ATOM 0 HA THR A 73 8.768 10.076 22.870 1.00 0.00 H new ATOM 0 HB THR A 73 11.561 9.655 21.973 1.00 0.00 H new ATOM 0 HG1 THR A 73 9.697 7.473 21.790 1.00 0.00 H new ATOM 0 HG21 THR A 73 11.518 8.018 23.826 1.00 0.00 H new ATOM 0 HG22 THR A 73 10.884 9.601 24.337 1.00 0.00 H new ATOM 0 HG23 THR A 73 9.763 8.262 23.993 1.00 0.00 H new ATOM 1123 N ASN A 74 10.757 11.917 20.956 1.00 0.00 N ATOM 1124 CA ASN A 74 11.474 13.184 20.845 1.00 0.00 C ATOM 1125 C ASN A 74 10.556 14.288 20.310 1.00 0.00 C ATOM 1126 O ASN A 74 10.996 15.221 19.641 1.00 0.00 O ATOM 1127 CB ASN A 74 12.696 12.996 19.936 1.00 0.00 C ATOM 1128 CG ASN A 74 13.638 14.186 19.946 1.00 0.00 C ATOM 1129 OD1 ASN A 74 13.730 14.911 20.933 1.00 0.00 O ATOM 1130 ND2 ASN A 74 14.348 14.388 18.847 1.00 0.00 N ATOM 0 H ASN A 74 10.829 11.323 20.130 1.00 0.00 H new ATOM 0 HA ASN A 74 11.810 13.493 21.835 1.00 0.00 H new ATOM 0 HB2 ASN A 74 13.242 12.106 20.251 1.00 0.00 H new ATOM 0 HB3 ASN A 74 12.357 12.818 18.915 1.00 0.00 H new ATOM 0 HD21 ASN A 74 15.001 15.170 18.798 1.00 0.00 H new ATOM 0 HD22 ASN A 74 14.242 13.762 18.049 1.00 0.00 H new ATOM 1137 N LEU A 75 9.277 14.205 20.656 1.00 0.00 N ATOM 1138 CA LEU A 75 8.296 15.183 20.199 1.00 0.00 C ATOM 1139 C LEU A 75 8.478 16.522 20.901 1.00 0.00 C ATOM 1140 O LEU A 75 7.843 17.510 20.542 1.00 0.00 O ATOM 1141 CB LEU A 75 6.872 14.668 20.420 1.00 0.00 C ATOM 1142 CG LEU A 75 6.398 13.624 19.412 1.00 0.00 C ATOM 1143 CD1 LEU A 75 5.013 13.125 19.783 1.00 0.00 C ATOM 1144 CD2 LEU A 75 6.388 14.216 18.011 1.00 0.00 C ATOM 0 H LEU A 75 8.894 13.471 21.252 1.00 0.00 H new ATOM 0 HA LEU A 75 8.457 15.331 19.131 1.00 0.00 H new ATOM 0 HB2 LEU A 75 6.808 14.240 21.420 1.00 0.00 H new ATOM 0 HB3 LEU A 75 6.187 15.515 20.391 1.00 0.00 H new ATOM 0 HG LEU A 75 7.088 12.780 19.431 1.00 0.00 H new ATOM 0 HD11 LEU A 75 4.687 12.381 19.056 1.00 0.00 H new ATOM 0 HD12 LEU A 75 5.042 12.674 20.775 1.00 0.00 H new ATOM 0 HD13 LEU A 75 4.314 13.961 19.785 1.00 0.00 H new ATOM 0 HD21 LEU A 75 6.048 13.463 17.300 1.00 0.00 H new ATOM 0 HD22 LEU A 75 5.714 15.072 17.983 1.00 0.00 H new ATOM 0 HD23 LEU A 75 7.395 14.538 17.745 1.00 0.00 H new ATOM 1156 N LYS A 76 9.357 16.561 21.896 1.00 0.00 N ATOM 1157 CA LYS A 76 9.623 17.798 22.613 1.00 0.00 C ATOM 1158 C LYS A 76 10.548 18.709 21.809 1.00 0.00 C ATOM 1159 O LYS A 76 10.722 19.884 22.136 1.00 0.00 O ATOM 1160 CB LYS A 76 10.198 17.502 24.011 1.00 0.00 C ATOM 1161 CG LYS A 76 11.422 16.585 24.025 1.00 0.00 C ATOM 1162 CD LYS A 76 12.697 17.313 23.613 1.00 0.00 C ATOM 1163 CE LYS A 76 13.899 16.382 23.587 1.00 0.00 C ATOM 1164 NZ LYS A 76 14.261 15.891 24.942 1.00 0.00 N ATOM 0 H LYS A 76 9.893 15.756 22.221 1.00 0.00 H new ATOM 0 HA LYS A 76 8.679 18.327 22.746 1.00 0.00 H new ATOM 0 HB2 LYS A 76 10.465 18.447 24.485 1.00 0.00 H new ATOM 0 HB3 LYS A 76 9.416 17.049 24.621 1.00 0.00 H new ATOM 0 HG2 LYS A 76 11.550 16.170 25.025 1.00 0.00 H new ATOM 0 HG3 LYS A 76 11.252 15.746 23.351 1.00 0.00 H new ATOM 0 HD2 LYS A 76 12.559 17.756 22.627 1.00 0.00 H new ATOM 0 HD3 LYS A 76 12.887 18.132 24.306 1.00 0.00 H new ATOM 0 HE2 LYS A 76 13.683 15.531 22.940 1.00 0.00 H new ATOM 0 HE3 LYS A 76 14.751 16.905 23.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 15.144 15.344 24.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 14.394 16.701 25.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 13.499 15.284 25.306 1.00 0.00 H new ATOM 1178 N ALA A 77 11.135 18.159 20.755 1.00 0.00 N ATOM 1179 CA ALA A 77 11.979 18.934 19.862 1.00 0.00 C ATOM 1180 C ALA A 77 11.124 19.598 18.794 1.00 0.00 C ATOM 1181 O ALA A 77 11.580 20.491 18.080 1.00 0.00 O ATOM 1182 CB ALA A 77 13.037 18.046 19.224 1.00 0.00 C ATOM 0 H ALA A 77 11.041 17.176 20.499 1.00 0.00 H new ATOM 0 HA ALA A 77 12.488 19.707 20.438 1.00 0.00 H new ATOM 0 HB1 ALA A 77 13.660 18.643 18.558 1.00 0.00 H new ATOM 0 HB2 ALA A 77 13.658 17.603 20.003 1.00 0.00 H new ATOM 0 HB3 ALA A 77 12.552 17.254 18.653 1.00 0.00 H new ATOM 1188 N ALA A 78 9.873 19.157 18.721 1.00 0.00 N ATOM 1189 CA ALA A 78 8.926 19.647 17.734 1.00 0.00 C ATOM 1190 C ALA A 78 8.283 20.950 18.201 1.00 0.00 C ATOM 1191 O ALA A 78 8.259 21.253 19.397 1.00 0.00 O ATOM 1192 CB ALA A 78 7.854 18.597 17.498 1.00 0.00 C ATOM 0 H ALA A 78 9.489 18.449 19.347 1.00 0.00 H new ATOM 0 HA ALA A 78 9.459 19.843 16.804 1.00 0.00 H new ATOM 0 HB1 ALA A 78 7.143 18.963 16.758 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.317 17.680 17.134 1.00 0.00 H new ATOM 0 HB3 ALA A 78 7.332 18.393 18.433 1.00 0.00 H new ATOM 1198 N LYS A 79 7.768 21.717 17.249 1.00 0.00 N ATOM 1199 CA LYS A 79 7.086 22.972 17.533 1.00 0.00 C ATOM 1200 C LYS A 79 6.144 23.330 16.388 1.00 0.00 C ATOM 1201 O LYS A 79 5.893 22.506 15.506 1.00 0.00 O ATOM 1202 CB LYS A 79 8.082 24.120 17.806 1.00 0.00 C ATOM 1203 CG LYS A 79 9.181 24.297 16.765 1.00 0.00 C ATOM 1204 CD LYS A 79 10.303 23.293 16.968 1.00 0.00 C ATOM 1205 CE LYS A 79 11.472 23.540 16.033 1.00 0.00 C ATOM 1206 NZ LYS A 79 12.495 22.473 16.158 1.00 0.00 N ATOM 0 H LYS A 79 7.812 21.486 16.257 1.00 0.00 H new ATOM 0 HA LYS A 79 6.500 22.834 18.442 1.00 0.00 H new ATOM 0 HB2 LYS A 79 7.523 25.053 17.881 1.00 0.00 H new ATOM 0 HB3 LYS A 79 8.549 23.950 18.776 1.00 0.00 H new ATOM 0 HG2 LYS A 79 8.761 24.178 15.766 1.00 0.00 H new ATOM 0 HG3 LYS A 79 9.581 25.309 16.824 1.00 0.00 H new ATOM 0 HD2 LYS A 79 10.649 23.342 18.000 1.00 0.00 H new ATOM 0 HD3 LYS A 79 9.919 22.285 16.808 1.00 0.00 H new ATOM 0 HE2 LYS A 79 11.115 23.586 15.004 1.00 0.00 H new ATOM 0 HE3 LYS A 79 11.922 24.507 16.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 13.364 22.872 16.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 12.136 21.718 16.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 12.703 22.080 15.218 1.00 0.00 H new ATOM 1220 N LYS A 80 5.637 24.561 16.414 1.00 0.00 N ATOM 1221 CA LYS A 80 4.608 25.026 15.482 1.00 0.00 C ATOM 1222 C LYS A 80 4.890 24.660 14.020 1.00 0.00 C ATOM 1223 O LYS A 80 3.976 24.288 13.285 1.00 0.00 O ATOM 1224 CB LYS A 80 4.433 26.539 15.619 1.00 0.00 C ATOM 1225 CG LYS A 80 5.722 27.326 15.441 1.00 0.00 C ATOM 1226 CD LYS A 80 5.531 28.791 15.796 1.00 0.00 C ATOM 1227 CE LYS A 80 4.512 29.469 14.890 1.00 0.00 C ATOM 1228 NZ LYS A 80 4.197 30.846 15.353 1.00 0.00 N ATOM 0 H LYS A 80 5.930 25.270 17.087 1.00 0.00 H new ATOM 0 HA LYS A 80 3.687 24.510 15.753 1.00 0.00 H new ATOM 0 HB2 LYS A 80 3.706 26.879 14.881 1.00 0.00 H new ATOM 0 HB3 LYS A 80 4.017 26.759 16.602 1.00 0.00 H new ATOM 0 HG2 LYS A 80 6.502 26.896 16.070 1.00 0.00 H new ATOM 0 HG3 LYS A 80 6.062 27.242 14.409 1.00 0.00 H new ATOM 0 HD2 LYS A 80 5.206 28.873 16.833 1.00 0.00 H new ATOM 0 HD3 LYS A 80 6.486 29.310 15.719 1.00 0.00 H new ATOM 0 HE2 LYS A 80 4.898 29.507 13.872 1.00 0.00 H new ATOM 0 HE3 LYS A 80 3.598 28.876 14.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 3.500 31.277 14.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 3.805 30.807 16.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 5.065 31.419 15.355 1.00 0.00 H new ATOM 1242 N GLY A 81 6.138 24.745 13.592 1.00 0.00 N ATOM 1243 CA GLY A 81 6.430 24.476 12.202 1.00 0.00 C ATOM 1244 C GLY A 81 7.474 23.400 12.011 1.00 0.00 C ATOM 1245 O GLY A 81 8.495 23.628 11.367 1.00 0.00 O ATOM 0 H GLY A 81 6.942 24.991 14.170 1.00 0.00 H new ATOM 0 HA2 GLY A 81 5.512 24.177 11.696 1.00 0.00 H new ATOM 0 HA3 GLY A 81 6.772 25.394 11.725 1.00 0.00 H new ATOM 1249 N SER A 82 7.216 22.222 12.556 1.00 0.00 N ATOM 1250 CA SER A 82 8.136 21.103 12.424 1.00 0.00 C ATOM 1251 C SER A 82 7.973 20.392 11.082 1.00 0.00 C ATOM 1252 O SER A 82 8.781 19.530 10.736 1.00 0.00 O ATOM 1253 CB SER A 82 7.908 20.118 13.563 1.00 0.00 C ATOM 1254 OG SER A 82 8.237 20.704 14.806 1.00 0.00 O ATOM 0 H SER A 82 6.375 22.015 13.095 1.00 0.00 H new ATOM 0 HA SER A 82 9.152 21.495 12.470 1.00 0.00 H new ATOM 0 HB2 SER A 82 6.866 19.799 13.571 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.514 19.226 13.405 1.00 0.00 H new ATOM 0 HG SER A 82 9.186 20.950 14.811 1.00 0.00 H new ATOM 1260 N MET A 83 6.950 20.795 10.323 1.00 0.00 N ATOM 1261 CA MET A 83 6.581 20.149 9.066 1.00 0.00 C ATOM 1262 C MET A 83 6.507 18.632 9.183 1.00 0.00 C ATOM 1263 O MET A 83 7.493 17.918 9.002 1.00 0.00 O ATOM 1264 CB MET A 83 7.530 20.562 7.955 1.00 0.00 C ATOM 1265 CG MET A 83 7.311 21.993 7.513 1.00 0.00 C ATOM 1266 SD MET A 83 5.668 22.254 6.820 1.00 0.00 S ATOM 1267 CE MET A 83 5.635 21.059 5.493 1.00 0.00 C ATOM 0 H MET A 83 6.352 21.584 10.568 1.00 0.00 H new ATOM 0 HA MET A 83 5.576 20.490 8.817 1.00 0.00 H new ATOM 0 HB2 MET A 83 8.558 20.443 8.296 1.00 0.00 H new ATOM 0 HB3 MET A 83 7.398 19.897 7.102 1.00 0.00 H new ATOM 0 HG2 MET A 83 7.453 22.659 8.364 1.00 0.00 H new ATOM 0 HG3 MET A 83 8.062 22.260 6.770 1.00 0.00 H new ATOM 0 HE1 MET A 83 5.067 21.462 4.654 1.00 0.00 H new ATOM 0 HE2 MET A 83 6.654 20.844 5.171 1.00 0.00 H new ATOM 0 HE3 MET A 83 5.163 20.140 5.842 1.00 0.00 H new ATOM 1277 N VAL A 84 5.317 18.157 9.491 1.00 0.00 N ATOM 1278 CA VAL A 84 5.063 16.739 9.625 1.00 0.00 C ATOM 1279 C VAL A 84 4.743 16.137 8.265 1.00 0.00 C ATOM 1280 O VAL A 84 3.790 16.555 7.602 1.00 0.00 O ATOM 1281 CB VAL A 84 3.887 16.477 10.589 1.00 0.00 C ATOM 1282 CG1 VAL A 84 3.636 14.989 10.743 1.00 0.00 C ATOM 1283 CG2 VAL A 84 4.151 17.119 11.942 1.00 0.00 C ATOM 0 H VAL A 84 4.499 18.744 9.655 1.00 0.00 H new ATOM 0 HA VAL A 84 5.960 16.272 10.032 1.00 0.00 H new ATOM 0 HB VAL A 84 2.991 16.929 10.163 1.00 0.00 H new ATOM 0 HG11 VAL A 84 2.803 14.829 11.427 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.395 14.558 9.771 1.00 0.00 H new ATOM 0 HG13 VAL A 84 4.530 14.509 11.142 1.00 0.00 H new ATOM 0 HG21 VAL A 84 3.311 16.923 12.608 1.00 0.00 H new ATOM 0 HG22 VAL A 84 5.060 16.700 12.372 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.272 18.195 11.817 1.00 0.00 H new ATOM 1293 N TYR A 85 5.551 15.182 7.840 1.00 0.00 N ATOM 1294 CA TYR A 85 5.324 14.511 6.574 1.00 0.00 C ATOM 1295 C TYR A 85 4.645 13.173 6.812 1.00 0.00 C ATOM 1296 O TYR A 85 5.258 12.236 7.327 1.00 0.00 O ATOM 1297 CB TYR A 85 6.644 14.302 5.825 1.00 0.00 C ATOM 1298 CG TYR A 85 7.429 15.575 5.593 1.00 0.00 C ATOM 1299 CD1 TYR A 85 8.585 15.837 6.314 1.00 0.00 C ATOM 1300 CD2 TYR A 85 7.018 16.510 4.651 1.00 0.00 C ATOM 1301 CE1 TYR A 85 9.312 16.990 6.103 1.00 0.00 C ATOM 1302 CE2 TYR A 85 7.740 17.668 4.434 1.00 0.00 C ATOM 1303 CZ TYR A 85 8.886 17.903 5.163 1.00 0.00 C ATOM 1304 OH TYR A 85 9.613 19.052 4.950 1.00 0.00 O ATOM 0 H TYR A 85 6.369 14.854 8.353 1.00 0.00 H new ATOM 0 HA TYR A 85 4.677 15.139 5.962 1.00 0.00 H new ATOM 0 HB2 TYR A 85 7.263 13.603 6.388 1.00 0.00 H new ATOM 0 HB3 TYR A 85 6.434 13.837 4.862 1.00 0.00 H new ATOM 0 HD1 TYR A 85 8.922 15.126 7.054 1.00 0.00 H new ATOM 0 HD2 TYR A 85 6.120 16.329 4.079 1.00 0.00 H new ATOM 0 HE1 TYR A 85 10.211 17.176 6.672 1.00 0.00 H new ATOM 0 HE2 TYR A 85 7.408 18.385 3.697 1.00 0.00 H new ATOM 0 HH TYR A 85 9.179 19.589 4.255 1.00 0.00 H new ATOM 1314 N PHE A 86 3.373 13.088 6.467 1.00 0.00 N ATOM 1315 CA PHE A 86 2.648 11.840 6.610 1.00 0.00 C ATOM 1316 C PHE A 86 2.775 11.032 5.329 1.00 0.00 C ATOM 1317 O PHE A 86 2.105 11.309 4.332 1.00 0.00 O ATOM 1318 CB PHE A 86 1.180 12.088 6.958 1.00 0.00 C ATOM 1319 CG PHE A 86 0.415 10.830 7.266 1.00 0.00 C ATOM 1320 CD1 PHE A 86 0.872 9.944 8.229 1.00 0.00 C ATOM 1321 CD2 PHE A 86 -0.764 10.540 6.598 1.00 0.00 C ATOM 1322 CE1 PHE A 86 0.169 8.790 8.518 1.00 0.00 C ATOM 1323 CE2 PHE A 86 -1.471 9.388 6.884 1.00 0.00 C ATOM 1324 CZ PHE A 86 -1.005 8.512 7.844 1.00 0.00 C ATOM 0 H PHE A 86 2.825 13.861 6.089 1.00 0.00 H new ATOM 0 HA PHE A 86 3.083 11.273 7.434 1.00 0.00 H new ATOM 0 HB2 PHE A 86 1.127 12.756 7.818 1.00 0.00 H new ATOM 0 HB3 PHE A 86 0.699 12.601 6.125 1.00 0.00 H new ATOM 0 HD1 PHE A 86 1.788 10.158 8.760 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -1.134 11.221 5.846 1.00 0.00 H new ATOM 0 HE1 PHE A 86 0.536 8.107 9.269 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -2.388 9.173 6.356 1.00 0.00 H new ATOM 0 HZ PHE A 86 -1.557 7.611 8.068 1.00 0.00 H new ATOM 1334 N LYS A 87 3.668 10.059 5.359 1.00 0.00 N ATOM 1335 CA LYS A 87 3.950 9.233 4.203 1.00 0.00 C ATOM 1336 C LYS A 87 2.927 8.114 4.095 1.00 0.00 C ATOM 1337 O LYS A 87 3.079 7.062 4.714 1.00 0.00 O ATOM 1338 CB LYS A 87 5.354 8.635 4.325 1.00 0.00 C ATOM 1339 CG LYS A 87 5.871 8.001 3.044 1.00 0.00 C ATOM 1340 CD LYS A 87 6.150 9.053 1.989 1.00 0.00 C ATOM 1341 CE LYS A 87 7.238 10.020 2.441 1.00 0.00 C ATOM 1342 NZ LYS A 87 8.531 9.331 2.697 1.00 0.00 N ATOM 0 H LYS A 87 4.217 9.821 6.185 1.00 0.00 H new ATOM 0 HA LYS A 87 3.895 9.851 3.307 1.00 0.00 H new ATOM 0 HB2 LYS A 87 6.045 9.419 4.635 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.350 7.883 5.114 1.00 0.00 H new ATOM 0 HG2 LYS A 87 6.782 7.441 3.254 1.00 0.00 H new ATOM 0 HG3 LYS A 87 5.138 7.288 2.666 1.00 0.00 H new ATOM 0 HD2 LYS A 87 6.455 8.568 1.061 1.00 0.00 H new ATOM 0 HD3 LYS A 87 5.236 9.606 1.774 1.00 0.00 H new ATOM 0 HE2 LYS A 87 7.381 10.786 1.678 1.00 0.00 H new ATOM 0 HE3 LYS A 87 6.914 10.530 3.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 9.270 10.038 2.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 8.433 8.704 3.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 8.796 8.769 1.863 1.00 0.00 H new ATOM 1356 N VAL A 88 1.878 8.340 3.330 1.00 0.00 N ATOM 1357 CA VAL A 88 0.829 7.348 3.197 1.00 0.00 C ATOM 1358 C VAL A 88 0.705 6.874 1.754 1.00 0.00 C ATOM 1359 O VAL A 88 0.491 7.668 0.836 1.00 0.00 O ATOM 1360 CB VAL A 88 -0.523 7.881 3.717 1.00 0.00 C ATOM 1361 CG1 VAL A 88 -0.903 9.185 3.036 1.00 0.00 C ATOM 1362 CG2 VAL A 88 -1.616 6.841 3.542 1.00 0.00 C ATOM 0 H VAL A 88 1.729 9.195 2.794 1.00 0.00 H new ATOM 0 HA VAL A 88 1.107 6.493 3.814 1.00 0.00 H new ATOM 0 HB VAL A 88 -0.412 8.084 4.782 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -1.860 9.533 3.425 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -0.137 9.935 3.233 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -0.985 9.024 1.961 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -2.560 7.239 3.915 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -1.719 6.595 2.485 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -1.355 5.942 4.100 1.00 0.00 H new ATOM 1372 N GLY A 89 0.860 5.570 1.568 1.00 0.00 N ATOM 1373 CA GLY A 89 0.829 4.989 0.237 1.00 0.00 C ATOM 1374 C GLY A 89 1.998 5.450 -0.610 1.00 0.00 C ATOM 1375 O GLY A 89 3.062 4.836 -0.606 1.00 0.00 O ATOM 0 H GLY A 89 1.008 4.898 2.321 1.00 0.00 H new ATOM 0 HA2 GLY A 89 0.844 3.902 0.315 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.105 5.260 -0.255 1.00 0.00 H new ATOM 1379 N ASN A 90 1.795 6.543 -1.328 1.00 0.00 N ATOM 1380 CA ASN A 90 2.844 7.134 -2.144 1.00 0.00 C ATOM 1381 C ASN A 90 2.783 8.654 -2.027 1.00 0.00 C ATOM 1382 O ASN A 90 3.477 9.380 -2.737 1.00 0.00 O ATOM 1383 CB ASN A 90 2.686 6.711 -3.605 1.00 0.00 C ATOM 1384 CG ASN A 90 3.984 6.793 -4.387 1.00 0.00 C ATOM 1385 OD1 ASN A 90 5.094 6.478 -3.735 1.00 0.00 O flip ATOM 1386 ND2 ASN A 90 3.987 7.109 -5.578 1.00 0.00 N flip ATOM 0 H ASN A 90 0.906 7.042 -1.362 1.00 0.00 H new ATOM 0 HA ASN A 90 3.813 6.783 -1.788 1.00 0.00 H new ATOM 0 HB2 ASN A 90 2.308 5.689 -3.643 1.00 0.00 H new ATOM 0 HB3 ASN A 90 1.939 7.345 -4.083 1.00 0.00 H new ATOM 0 HD21 ASN A 90 3.112 7.345 -6.045 1.00 0.00 H new ATOM 0 HD22 ASN A 90 4.865 7.135 -6.097 1.00 0.00 H new ATOM 1393 N GLU A 91 1.950 9.127 -1.111 1.00 0.00 N ATOM 1394 CA GLU A 91 1.732 10.552 -0.941 1.00 0.00 C ATOM 1395 C GLU A 91 2.516 11.099 0.238 1.00 0.00 C ATOM 1396 O GLU A 91 2.487 10.538 1.335 1.00 0.00 O ATOM 1397 CB GLU A 91 0.252 10.852 -0.724 1.00 0.00 C ATOM 1398 CG GLU A 91 -0.623 10.561 -1.928 1.00 0.00 C ATOM 1399 CD GLU A 91 -2.038 11.057 -1.733 1.00 0.00 C ATOM 1400 OE1 GLU A 91 -2.946 10.557 -2.426 1.00 0.00 O ATOM 1401 OE2 GLU A 91 -2.242 11.960 -0.889 1.00 0.00 O ATOM 0 H GLU A 91 1.413 8.540 -0.473 1.00 0.00 H new ATOM 0 HA GLU A 91 2.078 11.036 -1.855 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -0.106 10.265 0.122 1.00 0.00 H new ATOM 0 HB3 GLU A 91 0.141 11.902 -0.453 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -0.192 11.032 -2.812 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -0.638 9.487 -2.114 1.00 0.00 H new ATOM 1408 N THR A 92 3.213 12.193 0.002 1.00 0.00 N ATOM 1409 CA THR A 92 3.815 12.952 1.075 1.00 0.00 C ATOM 1410 C THR A 92 2.981 14.202 1.330 1.00 0.00 C ATOM 1411 O THR A 92 3.087 15.195 0.607 1.00 0.00 O ATOM 1412 CB THR A 92 5.270 13.350 0.760 1.00 0.00 C ATOM 1413 OG1 THR A 92 6.055 12.179 0.509 1.00 0.00 O ATOM 1414 CG2 THR A 92 5.883 14.131 1.915 1.00 0.00 C ATOM 0 H THR A 92 3.376 12.576 -0.929 1.00 0.00 H new ATOM 0 HA THR A 92 3.837 12.321 1.964 1.00 0.00 H new ATOM 0 HB THR A 92 5.263 13.984 -0.127 1.00 0.00 H new ATOM 0 HG1 THR A 92 6.978 12.441 0.308 1.00 0.00 H new ATOM 0 HG21 THR A 92 6.910 14.400 1.668 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.303 15.037 2.090 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.876 13.516 2.815 1.00 0.00 H new ATOM 1422 N ARG A 93 2.113 14.127 2.324 1.00 0.00 N ATOM 1423 CA ARG A 93 1.262 15.255 2.673 1.00 0.00 C ATOM 1424 C ARG A 93 1.875 16.027 3.833 1.00 0.00 C ATOM 1425 O ARG A 93 2.617 15.462 4.641 1.00 0.00 O ATOM 1426 CB ARG A 93 -0.162 14.780 2.982 1.00 0.00 C ATOM 1427 CG ARG A 93 -0.225 13.557 3.880 1.00 0.00 C ATOM 1428 CD ARG A 93 -1.637 13.003 3.967 1.00 0.00 C ATOM 1429 NE ARG A 93 -2.144 12.545 2.668 1.00 0.00 N ATOM 1430 CZ ARG A 93 -3.312 11.920 2.507 1.00 0.00 C ATOM 1431 NH1 ARG A 93 -4.098 11.700 3.559 1.00 0.00 N ATOM 1432 NH2 ARG A 93 -3.698 11.530 1.295 1.00 0.00 N ATOM 0 H ARG A 93 1.978 13.299 2.904 1.00 0.00 H new ATOM 0 HA ARG A 93 1.194 15.934 1.823 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -0.711 15.594 3.456 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -0.671 14.556 2.044 1.00 0.00 H new ATOM 0 HG2 ARG A 93 0.446 12.788 3.497 1.00 0.00 H new ATOM 0 HG3 ARG A 93 0.127 13.818 4.878 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -1.655 12.173 4.673 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -2.301 13.772 4.362 1.00 0.00 H new ATOM 0 HE ARG A 93 -1.571 12.714 1.841 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -3.807 12.009 4.486 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -4.991 11.222 3.437 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -3.101 11.709 0.488 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -4.591 11.052 1.173 1.00 0.00 H new ATOM 1446 N LYS A 94 1.561 17.312 3.914 1.00 0.00 N ATOM 1447 CA LYS A 94 2.293 18.227 4.778 1.00 0.00 C ATOM 1448 C LYS A 94 1.408 18.792 5.880 1.00 0.00 C ATOM 1449 O LYS A 94 0.390 19.424 5.616 1.00 0.00 O ATOM 1450 CB LYS A 94 2.915 19.374 3.960 1.00 0.00 C ATOM 1451 CG LYS A 94 1.965 20.063 2.980 1.00 0.00 C ATOM 1452 CD LYS A 94 1.795 19.266 1.692 1.00 0.00 C ATOM 1453 CE LYS A 94 0.823 19.932 0.725 1.00 0.00 C ATOM 1454 NZ LYS A 94 -0.535 20.086 1.310 1.00 0.00 N ATOM 0 H LYS A 94 0.801 17.746 3.390 1.00 0.00 H new ATOM 0 HA LYS A 94 3.092 17.654 5.249 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.304 20.122 4.651 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.765 18.982 3.402 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.992 20.199 3.453 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.346 21.056 2.744 1.00 0.00 H new ATOM 0 HD2 LYS A 94 2.765 19.151 1.208 1.00 0.00 H new ATOM 0 HD3 LYS A 94 1.437 18.265 1.931 1.00 0.00 H new ATOM 0 HE2 LYS A 94 1.208 20.912 0.443 1.00 0.00 H new ATOM 0 HE3 LYS A 94 0.758 19.340 -0.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -1.250 19.963 0.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -0.678 19.369 2.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -0.628 21.035 1.726 1.00 0.00 H new ATOM 1468 N TYR A 95 1.817 18.575 7.117 1.00 0.00 N ATOM 1469 CA TYR A 95 1.060 19.053 8.263 1.00 0.00 C ATOM 1470 C TYR A 95 1.913 19.966 9.133 1.00 0.00 C ATOM 1471 O TYR A 95 3.091 19.698 9.371 1.00 0.00 O ATOM 1472 CB TYR A 95 0.539 17.876 9.086 1.00 0.00 C ATOM 1473 CG TYR A 95 -0.413 16.987 8.323 1.00 0.00 C ATOM 1474 CD1 TYR A 95 0.026 15.812 7.731 1.00 0.00 C ATOM 1475 CD2 TYR A 95 -1.752 17.330 8.188 1.00 0.00 C ATOM 1476 CE1 TYR A 95 -0.843 15.004 7.026 1.00 0.00 C ATOM 1477 CE2 TYR A 95 -2.626 16.527 7.487 1.00 0.00 C ATOM 1478 CZ TYR A 95 -2.168 15.366 6.908 1.00 0.00 C ATOM 1479 OH TYR A 95 -3.036 14.567 6.202 1.00 0.00 O ATOM 0 H TYR A 95 2.671 18.070 7.355 1.00 0.00 H new ATOM 0 HA TYR A 95 0.210 19.627 7.893 1.00 0.00 H new ATOM 0 HB2 TYR A 95 1.384 17.280 9.430 1.00 0.00 H new ATOM 0 HB3 TYR A 95 0.035 18.258 9.974 1.00 0.00 H new ATOM 0 HD1 TYR A 95 1.063 15.525 7.823 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -2.115 18.241 8.640 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -0.487 14.093 6.569 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -3.665 16.808 7.393 1.00 0.00 H new ATOM 0 HH TYR A 95 -3.535 15.114 5.560 1.00 0.00 H new ATOM 1489 N LYS A 96 1.316 21.047 9.599 1.00 0.00 N ATOM 1490 CA LYS A 96 2.011 22.003 10.446 1.00 0.00 C ATOM 1491 C LYS A 96 1.427 21.956 11.847 1.00 0.00 C ATOM 1492 O LYS A 96 0.205 21.995 12.006 1.00 0.00 O ATOM 1493 CB LYS A 96 1.863 23.412 9.872 1.00 0.00 C ATOM 1494 CG LYS A 96 3.001 24.347 10.212 1.00 0.00 C ATOM 1495 CD LYS A 96 4.262 23.995 9.441 1.00 0.00 C ATOM 1496 CE LYS A 96 4.315 24.716 8.104 1.00 0.00 C ATOM 1497 NZ LYS A 96 4.513 26.181 8.277 1.00 0.00 N ATOM 0 H LYS A 96 0.344 21.288 9.404 1.00 0.00 H new ATOM 0 HA LYS A 96 3.069 21.746 10.485 1.00 0.00 H new ATOM 0 HB2 LYS A 96 1.778 23.342 8.788 1.00 0.00 H new ATOM 0 HB3 LYS A 96 0.932 23.844 10.238 1.00 0.00 H new ATOM 0 HG2 LYS A 96 2.710 25.373 9.986 1.00 0.00 H new ATOM 0 HG3 LYS A 96 3.203 24.301 11.282 1.00 0.00 H new ATOM 0 HD2 LYS A 96 5.138 24.259 10.033 1.00 0.00 H new ATOM 0 HD3 LYS A 96 4.301 22.918 9.277 1.00 0.00 H new ATOM 0 HE2 LYS A 96 5.127 24.308 7.502 1.00 0.00 H new ATOM 0 HE3 LYS A 96 3.390 24.536 7.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 4.941 26.578 7.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 3.595 26.637 8.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 5.142 26.353 9.087 1.00 0.00 H new ATOM 1511 N MET A 97 2.280 21.883 12.861 1.00 0.00 N ATOM 1512 CA MET A 97 1.802 21.781 14.239 1.00 0.00 C ATOM 1513 C MET A 97 1.414 23.158 14.764 1.00 0.00 C ATOM 1514 O MET A 97 1.990 23.668 15.719 1.00 0.00 O ATOM 1515 CB MET A 97 2.848 21.116 15.144 1.00 0.00 C ATOM 1516 CG MET A 97 2.975 19.618 14.918 1.00 0.00 C ATOM 1517 SD MET A 97 4.074 18.818 16.106 1.00 0.00 S ATOM 1518 CE MET A 97 3.859 17.095 15.660 1.00 0.00 C ATOM 0 H MET A 97 3.295 21.892 12.761 1.00 0.00 H new ATOM 0 HA MET A 97 0.916 21.146 14.249 1.00 0.00 H new ATOM 0 HB2 MET A 97 3.817 21.585 14.973 1.00 0.00 H new ATOM 0 HB3 MET A 97 2.585 21.298 16.186 1.00 0.00 H new ATOM 0 HG2 MET A 97 1.987 19.161 14.980 1.00 0.00 H new ATOM 0 HG3 MET A 97 3.346 19.438 13.909 1.00 0.00 H new ATOM 0 HE1 MET A 97 4.284 16.462 16.439 1.00 0.00 H new ATOM 0 HE2 MET A 97 2.796 16.876 15.555 1.00 0.00 H new ATOM 0 HE3 MET A 97 4.365 16.898 14.715 1.00 0.00 H new ATOM 1528 N THR A 98 0.417 23.741 14.120 1.00 0.00 N ATOM 1529 CA THR A 98 0.001 25.108 14.398 1.00 0.00 C ATOM 1530 C THR A 98 -0.800 25.203 15.699 1.00 0.00 C ATOM 1531 O THR A 98 -1.042 26.297 16.211 1.00 0.00 O ATOM 1532 CB THR A 98 -0.829 25.679 13.226 1.00 0.00 C ATOM 1533 OG1 THR A 98 -1.249 27.019 13.514 1.00 0.00 O ATOM 1534 CG2 THR A 98 -2.047 24.809 12.940 1.00 0.00 C ATOM 0 H THR A 98 -0.127 23.282 13.390 1.00 0.00 H new ATOM 0 HA THR A 98 0.907 25.702 14.514 1.00 0.00 H new ATOM 0 HB THR A 98 -0.192 25.685 12.341 1.00 0.00 H new ATOM 0 HG1 THR A 98 -1.144 27.196 14.472 1.00 0.00 H new ATOM 0 HG21 THR A 98 -2.612 25.235 12.111 1.00 0.00 H new ATOM 0 HG22 THR A 98 -1.722 23.802 12.678 1.00 0.00 H new ATOM 0 HG23 THR A 98 -2.680 24.766 13.826 1.00 0.00 H new ATOM 1542 N SER A 99 -1.217 24.062 16.227 1.00 0.00 N ATOM 1543 CA SER A 99 -1.943 24.037 17.482 1.00 0.00 C ATOM 1544 C SER A 99 -1.368 22.968 18.406 1.00 0.00 C ATOM 1545 O SER A 99 -1.673 21.779 18.279 1.00 0.00 O ATOM 1546 CB SER A 99 -3.430 23.797 17.227 1.00 0.00 C ATOM 1547 OG SER A 99 -3.960 24.782 16.350 1.00 0.00 O ATOM 0 H SER A 99 -1.064 23.146 15.806 1.00 0.00 H new ATOM 0 HA SER A 99 -1.833 25.004 17.973 1.00 0.00 H new ATOM 0 HB2 SER A 99 -3.574 22.806 16.797 1.00 0.00 H new ATOM 0 HB3 SER A 99 -3.973 23.816 18.172 1.00 0.00 H new ATOM 0 HG SER A 99 -4.913 24.608 16.200 1.00 0.00 H new ATOM 1553 N ILE A 100 -0.513 23.404 19.313 1.00 0.00 N ATOM 1554 CA ILE A 100 0.129 22.510 20.263 1.00 0.00 C ATOM 1555 C ILE A 100 -0.300 22.850 21.682 1.00 0.00 C ATOM 1556 O ILE A 100 -0.216 24.006 22.101 1.00 0.00 O ATOM 1557 CB ILE A 100 1.668 22.597 20.163 1.00 0.00 C ATOM 1558 CG1 ILE A 100 2.143 22.095 18.797 1.00 0.00 C ATOM 1559 CG2 ILE A 100 2.331 21.813 21.290 1.00 0.00 C ATOM 1560 CD1 ILE A 100 3.643 22.150 18.617 1.00 0.00 C ATOM 0 H ILE A 100 -0.244 24.383 19.413 1.00 0.00 H new ATOM 0 HA ILE A 100 -0.181 21.494 20.019 1.00 0.00 H new ATOM 0 HB ILE A 100 1.960 23.642 20.266 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.807 21.067 18.661 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.670 22.691 18.016 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.414 21.889 21.198 1.00 0.00 H new ATOM 0 HG22 ILE A 100 2.019 22.222 22.251 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.035 20.766 21.228 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.904 21.779 17.626 1.00 0.00 H new ATOM 0 HD12 ILE A 100 3.984 23.180 18.720 1.00 0.00 H new ATOM 0 HD13 ILE A 100 4.123 21.531 19.375 1.00 0.00 H new ATOM 1572 N ARG A 101 -0.762 21.848 22.416 1.00 0.00 N ATOM 1573 CA ARG A 101 -1.135 22.043 23.809 1.00 0.00 C ATOM 1574 C ARG A 101 -1.180 20.712 24.540 1.00 0.00 C ATOM 1575 O ARG A 101 -0.889 19.666 23.967 1.00 0.00 O ATOM 1576 CB ARG A 101 -2.497 22.735 23.929 1.00 0.00 C ATOM 1577 CG ARG A 101 -3.610 22.026 23.185 1.00 0.00 C ATOM 1578 CD ARG A 101 -4.966 22.345 23.783 1.00 0.00 C ATOM 1579 NE ARG A 101 -5.201 23.781 23.925 1.00 0.00 N ATOM 1580 CZ ARG A 101 -6.136 24.299 24.720 1.00 0.00 C ATOM 1581 NH1 ARG A 101 -6.902 23.498 25.456 1.00 0.00 N ATOM 1582 NH2 ARG A 101 -6.301 25.612 24.780 1.00 0.00 N ATOM 0 H ARG A 101 -0.887 20.896 22.072 1.00 0.00 H new ATOM 0 HA ARG A 101 -0.378 22.682 24.264 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -2.766 22.808 24.983 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -2.411 23.754 23.551 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -3.595 22.322 22.136 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -3.442 20.950 23.215 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -5.745 21.915 23.154 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -5.047 21.870 24.761 1.00 0.00 H new ATOM 0 HE ARG A 101 -4.617 24.421 23.386 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -6.773 22.487 25.412 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -7.618 23.895 26.065 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -5.712 26.226 24.217 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -7.017 26.009 25.389 1.00 0.00 H new ATOM 1596 N ASP A 102 -1.535 20.765 25.805 1.00 0.00 N ATOM 1597 CA ASP A 102 -1.739 19.567 26.595 1.00 0.00 C ATOM 1598 C ASP A 102 -3.180 19.525 27.069 1.00 0.00 C ATOM 1599 O ASP A 102 -3.777 20.565 27.346 1.00 0.00 O ATOM 1600 CB ASP A 102 -0.779 19.531 27.790 1.00 0.00 C ATOM 1601 CG ASP A 102 -0.883 20.764 28.671 1.00 0.00 C ATOM 1602 OD1 ASP A 102 -1.692 20.764 29.624 1.00 0.00 O ATOM 1603 OD2 ASP A 102 -0.144 21.739 28.414 1.00 0.00 O ATOM 0 H ASP A 102 -1.690 21.635 26.315 1.00 0.00 H new ATOM 0 HA ASP A 102 -1.533 18.692 25.978 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -0.986 18.644 28.389 1.00 0.00 H new ATOM 0 HB3 ASP A 102 0.244 19.437 27.425 1.00 0.00 H new ATOM 1608 N VAL A 103 -3.754 18.337 27.122 1.00 0.00 N ATOM 1609 CA VAL A 103 -5.116 18.177 27.600 1.00 0.00 C ATOM 1610 C VAL A 103 -5.196 17.062 28.631 1.00 0.00 C ATOM 1611 O VAL A 103 -4.235 16.319 28.840 1.00 0.00 O ATOM 1612 CB VAL A 103 -6.118 17.904 26.454 1.00 0.00 C ATOM 1613 CG1 VAL A 103 -6.342 19.158 25.623 1.00 0.00 C ATOM 1614 CG2 VAL A 103 -5.643 16.764 25.567 1.00 0.00 C ATOM 0 H VAL A 103 -3.299 17.469 26.840 1.00 0.00 H new ATOM 0 HA VAL A 103 -5.397 19.123 28.064 1.00 0.00 H new ATOM 0 HB VAL A 103 -7.065 17.611 26.907 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -7.050 18.943 24.823 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.741 19.949 26.258 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -5.395 19.483 25.192 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -6.368 16.596 24.771 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -4.678 17.021 25.130 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.542 15.857 26.163 1.00 0.00 H new ATOM 1624 N LYS A 104 -6.343 16.951 29.271 1.00 0.00 N ATOM 1625 CA LYS A 104 -6.547 15.963 30.318 1.00 0.00 C ATOM 1626 C LYS A 104 -7.305 14.770 29.760 1.00 0.00 C ATOM 1627 O LYS A 104 -8.151 14.935 28.892 1.00 0.00 O ATOM 1628 CB LYS A 104 -7.301 16.575 31.515 1.00 0.00 C ATOM 1629 CG LYS A 104 -8.439 17.516 31.135 1.00 0.00 C ATOM 1630 CD LYS A 104 -7.934 18.929 30.856 1.00 0.00 C ATOM 1631 CE LYS A 104 -9.009 19.810 30.229 1.00 0.00 C ATOM 1632 NZ LYS A 104 -10.192 19.985 31.113 1.00 0.00 N ATOM 0 H LYS A 104 -7.156 17.537 29.084 1.00 0.00 H new ATOM 0 HA LYS A 104 -5.573 15.628 30.675 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -7.704 15.767 32.125 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -6.589 17.119 32.136 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.950 17.131 30.252 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -9.172 17.544 31.941 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -7.593 19.382 31.787 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -7.072 18.880 30.190 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -8.584 20.787 29.999 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -9.328 19.371 29.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -10.877 20.619 30.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -10.636 19.061 31.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -9.891 20.398 32.019 1.00 0.00 H new ATOM 1646 N PRO A 105 -7.024 13.550 30.253 1.00 0.00 N ATOM 1647 CA PRO A 105 -7.674 12.318 29.765 1.00 0.00 C ATOM 1648 C PRO A 105 -9.188 12.319 29.979 1.00 0.00 C ATOM 1649 O PRO A 105 -9.888 11.386 29.585 1.00 0.00 O ATOM 1650 CB PRO A 105 -7.019 11.205 30.594 1.00 0.00 C ATOM 1651 CG PRO A 105 -5.758 11.800 31.113 1.00 0.00 C ATOM 1652 CD PRO A 105 -6.045 13.260 31.309 1.00 0.00 C ATOM 0 HA PRO A 105 -7.543 12.201 28.689 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -7.669 10.886 31.409 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -6.818 10.325 29.983 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -5.461 11.331 32.051 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -4.938 11.654 30.410 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -6.450 13.462 32.301 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -5.145 13.866 31.202 1.00 0.00 H new ATOM 1660 N THR A 106 -9.686 13.376 30.600 1.00 0.00 N ATOM 1661 CA THR A 106 -11.104 13.519 30.861 1.00 0.00 C ATOM 1662 C THR A 106 -11.614 14.859 30.322 1.00 0.00 C ATOM 1663 O THR A 106 -12.674 15.340 30.730 1.00 0.00 O ATOM 1664 CB THR A 106 -11.386 13.406 32.379 1.00 0.00 C ATOM 1665 OG1 THR A 106 -12.794 13.476 32.642 1.00 0.00 O ATOM 1666 CG2 THR A 106 -10.666 14.503 33.154 1.00 0.00 C ATOM 0 H THR A 106 -9.119 14.155 30.935 1.00 0.00 H new ATOM 0 HA THR A 106 -11.634 12.716 30.349 1.00 0.00 H new ATOM 0 HB THR A 106 -11.010 12.438 32.711 1.00 0.00 H new ATOM 0 HG1 THR A 106 -13.202 14.150 32.060 1.00 0.00 H new ATOM 0 HG21 THR A 106 -10.882 14.399 34.217 1.00 0.00 H new ATOM 0 HG22 THR A 106 -9.591 14.418 32.992 1.00 0.00 H new ATOM 0 HG23 THR A 106 -11.009 15.478 32.808 1.00 0.00 H new ATOM 1674 N ASP A 107 -10.857 15.459 29.396 1.00 0.00 N ATOM 1675 CA ASP A 107 -11.237 16.750 28.826 1.00 0.00 C ATOM 1676 C ASP A 107 -12.476 16.622 27.958 1.00 0.00 C ATOM 1677 O ASP A 107 -12.891 15.521 27.592 1.00 0.00 O ATOM 1678 CB ASP A 107 -10.093 17.374 28.006 1.00 0.00 C ATOM 1679 CG ASP A 107 -9.869 16.723 26.648 1.00 0.00 C ATOM 1680 OD1 ASP A 107 -10.698 16.922 25.735 1.00 0.00 O ATOM 1681 OD2 ASP A 107 -8.844 16.036 26.481 1.00 0.00 O ATOM 0 H ASP A 107 -9.986 15.073 29.030 1.00 0.00 H new ATOM 0 HA ASP A 107 -11.457 17.410 29.665 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -10.303 18.433 27.858 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -9.171 17.310 28.583 1.00 0.00 H new ATOM 1686 N VAL A 108 -13.050 17.761 27.624 1.00 0.00 N ATOM 1687 CA VAL A 108 -14.240 17.808 26.796 1.00 0.00 C ATOM 1688 C VAL A 108 -13.960 18.609 25.535 1.00 0.00 C ATOM 1689 O VAL A 108 -14.868 19.136 24.895 1.00 0.00 O ATOM 1690 CB VAL A 108 -15.436 18.425 27.558 1.00 0.00 C ATOM 1691 CG1 VAL A 108 -15.853 17.529 28.712 1.00 0.00 C ATOM 1692 CG2 VAL A 108 -15.094 19.818 28.069 1.00 0.00 C ATOM 0 H VAL A 108 -12.707 18.676 27.917 1.00 0.00 H new ATOM 0 HA VAL A 108 -14.505 16.785 26.528 1.00 0.00 H new ATOM 0 HB VAL A 108 -16.271 18.510 26.863 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -16.696 17.980 29.236 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -16.146 16.552 28.327 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -15.017 17.412 29.402 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -15.951 20.231 28.601 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -14.241 19.758 28.745 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -14.845 20.463 27.227 1.00 0.00 H new ATOM 1702 N GLU A 109 -12.687 18.674 25.171 1.00 0.00 N ATOM 1703 CA GLU A 109 -12.266 19.454 24.023 1.00 0.00 C ATOM 1704 C GLU A 109 -12.106 18.551 22.804 1.00 0.00 C ATOM 1705 O GLU A 109 -12.516 18.905 21.696 1.00 0.00 O ATOM 1706 CB GLU A 109 -10.937 20.182 24.292 1.00 0.00 C ATOM 1707 CG GLU A 109 -10.466 20.168 25.745 1.00 0.00 C ATOM 1708 CD GLU A 109 -11.381 20.920 26.692 1.00 0.00 C ATOM 1709 OE1 GLU A 109 -11.806 20.324 27.708 1.00 0.00 O ATOM 1710 OE2 GLU A 109 -11.673 22.104 26.431 1.00 0.00 O ATOM 0 H GLU A 109 -11.929 18.194 25.657 1.00 0.00 H new ATOM 0 HA GLU A 109 -13.037 20.201 23.833 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -10.163 19.730 23.672 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -11.038 21.219 23.970 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -10.382 19.134 26.080 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -9.468 20.602 25.798 1.00 0.00 H new ATOM 1717 N VAL A 110 -11.525 17.376 23.015 1.00 0.00 N ATOM 1718 CA VAL A 110 -11.210 16.471 21.912 1.00 0.00 C ATOM 1719 C VAL A 110 -12.385 15.558 21.571 1.00 0.00 C ATOM 1720 O VAL A 110 -12.353 14.836 20.578 1.00 0.00 O ATOM 1721 CB VAL A 110 -9.969 15.606 22.224 1.00 0.00 C ATOM 1722 CG1 VAL A 110 -8.773 16.485 22.550 1.00 0.00 C ATOM 1723 CG2 VAL A 110 -10.253 14.640 23.362 1.00 0.00 C ATOM 0 H VAL A 110 -11.262 17.027 23.937 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.996 17.104 21.050 1.00 0.00 H new ATOM 0 HB VAL A 110 -9.732 15.020 21.336 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -7.909 15.857 22.767 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -8.550 17.127 21.698 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -9.001 17.102 23.419 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.364 14.042 23.562 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.522 15.201 24.257 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -11.077 13.983 23.084 1.00 0.00 H new ATOM 1733 N LEU A 111 -13.424 15.592 22.389 1.00 0.00 N ATOM 1734 CA LEU A 111 -14.591 14.750 22.158 1.00 0.00 C ATOM 1735 C LEU A 111 -15.844 15.596 21.971 1.00 0.00 C ATOM 1736 O LEU A 111 -16.969 15.100 22.070 1.00 0.00 O ATOM 1737 CB LEU A 111 -14.759 13.740 23.304 1.00 0.00 C ATOM 1738 CG LEU A 111 -14.651 14.303 24.727 1.00 0.00 C ATOM 1739 CD1 LEU A 111 -15.877 15.123 25.088 1.00 0.00 C ATOM 1740 CD2 LEU A 111 -14.458 13.171 25.720 1.00 0.00 C ATOM 0 H LEU A 111 -13.486 16.188 23.214 1.00 0.00 H new ATOM 0 HA LEU A 111 -14.436 14.189 21.236 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -15.733 13.261 23.198 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -14.006 12.961 23.186 1.00 0.00 H new ATOM 0 HG LEU A 111 -13.785 14.964 24.768 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -15.771 15.509 26.102 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -15.976 15.956 24.392 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -16.765 14.494 25.030 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -14.382 13.580 26.728 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -15.309 12.492 25.667 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -13.544 12.628 25.479 1.00 0.00 H new ATOM 1752 N ASP A 112 -15.646 16.869 21.673 1.00 0.00 N ATOM 1753 CA ASP A 112 -16.760 17.797 21.558 1.00 0.00 C ATOM 1754 C ASP A 112 -16.435 18.925 20.605 1.00 0.00 C ATOM 1755 O ASP A 112 -15.332 19.465 20.632 1.00 0.00 O ATOM 1756 CB ASP A 112 -17.081 18.389 22.911 1.00 0.00 C ATOM 1757 CG ASP A 112 -18.293 19.289 22.881 1.00 0.00 C ATOM 1758 OD1 ASP A 112 -18.122 20.520 22.956 1.00 0.00 O ATOM 1759 OD2 ASP A 112 -19.423 18.764 22.786 1.00 0.00 O ATOM 0 H ASP A 112 -14.729 17.283 21.507 1.00 0.00 H new ATOM 0 HA ASP A 112 -17.616 17.241 21.175 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -17.250 17.583 23.625 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -16.221 18.956 23.268 1.00 0.00 H new ATOM 1764 N GLU A 113 -17.408 19.282 19.786 1.00 0.00 N ATOM 1765 CA GLU A 113 -17.251 20.340 18.798 1.00 0.00 C ATOM 1766 C GLU A 113 -16.040 20.106 17.915 1.00 0.00 C ATOM 1767 O GLU A 113 -15.066 20.855 17.971 1.00 0.00 O ATOM 1768 CB GLU A 113 -17.119 21.705 19.466 1.00 0.00 C ATOM 1769 CG GLU A 113 -18.403 22.224 20.063 1.00 0.00 C ATOM 1770 CD GLU A 113 -18.238 23.607 20.653 1.00 0.00 C ATOM 1771 OE1 GLU A 113 -17.083 24.058 20.810 1.00 0.00 O ATOM 1772 OE2 GLU A 113 -19.258 24.259 20.953 1.00 0.00 O ATOM 0 H GLU A 113 -18.331 18.848 19.785 1.00 0.00 H new ATOM 0 HA GLU A 113 -18.149 20.324 18.180 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -16.365 21.642 20.251 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -16.756 22.424 18.731 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -19.176 22.248 19.295 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -18.745 21.538 20.838 1.00 0.00 H new ATOM 1779 N GLN A 114 -16.075 19.057 17.122 1.00 0.00 N ATOM 1780 CA GLN A 114 -15.021 18.841 16.161 1.00 0.00 C ATOM 1781 C GLN A 114 -15.389 19.553 14.874 1.00 0.00 C ATOM 1782 O GLN A 114 -16.122 19.029 14.038 1.00 0.00 O ATOM 1783 CB GLN A 114 -14.788 17.355 15.926 1.00 0.00 C ATOM 1784 CG GLN A 114 -14.639 16.556 17.209 1.00 0.00 C ATOM 1785 CD GLN A 114 -13.511 17.039 18.112 1.00 0.00 C ATOM 1786 OE1 GLN A 114 -13.851 17.868 19.090 1.00 0.00 O flip ATOM 1787 NE2 GLN A 114 -12.361 16.641 17.956 1.00 0.00 N flip ATOM 0 H GLN A 114 -16.811 18.351 17.124 1.00 0.00 H new ATOM 0 HA GLN A 114 -14.086 19.248 16.545 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -15.621 16.951 15.350 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -13.890 17.227 15.321 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -15.577 16.598 17.762 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -14.465 15.510 16.956 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -12.141 16.003 17.191 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -11.625 16.948 18.592 1.00 0.00 H new ATOM 1796 N LYS A 115 -14.910 20.776 14.764 1.00 0.00 N ATOM 1797 CA LYS A 115 -15.287 21.663 13.671 1.00 0.00 C ATOM 1798 C LYS A 115 -14.765 21.176 12.330 1.00 0.00 C ATOM 1799 O LYS A 115 -13.859 20.343 12.266 1.00 0.00 O ATOM 1800 CB LYS A 115 -14.814 23.096 13.939 1.00 0.00 C ATOM 1801 CG LYS A 115 -15.658 23.860 14.959 1.00 0.00 C ATOM 1802 CD LYS A 115 -15.331 23.476 16.396 1.00 0.00 C ATOM 1803 CE LYS A 115 -16.073 24.354 17.388 1.00 0.00 C ATOM 1804 NZ LYS A 115 -15.416 24.377 18.727 1.00 0.00 N ATOM 0 H LYS A 115 -14.250 21.186 15.425 1.00 0.00 H new ATOM 0 HA LYS A 115 -16.376 21.656 13.621 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -13.782 23.065 14.290 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -14.815 23.648 12.999 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -15.499 24.930 14.828 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -16.714 23.669 14.767 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -15.595 22.432 16.564 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -14.257 23.564 16.562 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -16.132 25.370 16.997 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -17.096 23.994 17.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -16.143 24.403 19.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -14.834 23.523 18.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -14.812 25.221 18.803 1.00 0.00 H new ATOM 1818 N GLY A 116 -15.347 21.718 11.263 1.00 0.00 N ATOM 1819 CA GLY A 116 -15.019 21.299 9.914 1.00 0.00 C ATOM 1820 C GLY A 116 -13.686 21.832 9.443 1.00 0.00 C ATOM 1821 O GLY A 116 -13.596 22.494 8.404 1.00 0.00 O ATOM 0 H GLY A 116 -16.052 22.453 11.314 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -15.006 20.210 9.870 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -15.801 21.636 9.234 1.00 0.00 H new ATOM 1825 N LYS A 117 -12.659 21.570 10.232 1.00 0.00 N ATOM 1826 CA LYS A 117 -11.288 21.882 9.847 1.00 0.00 C ATOM 1827 C LYS A 117 -10.851 21.028 8.659 1.00 0.00 C ATOM 1828 O LYS A 117 -11.561 20.113 8.238 1.00 0.00 O ATOM 1829 CB LYS A 117 -10.333 21.658 11.026 1.00 0.00 C ATOM 1830 CG LYS A 117 -10.271 22.822 12.002 1.00 0.00 C ATOM 1831 CD LYS A 117 -9.505 23.997 11.416 1.00 0.00 C ATOM 1832 CE LYS A 117 -9.521 25.202 12.347 1.00 0.00 C ATOM 1833 NZ LYS A 117 -8.834 24.938 13.640 1.00 0.00 N ATOM 0 H LYS A 117 -12.747 21.138 11.152 1.00 0.00 H new ATOM 0 HA LYS A 117 -11.252 22.932 9.556 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -10.641 20.762 11.565 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -9.332 21.469 10.638 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -11.282 23.137 12.260 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -9.793 22.499 12.926 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -8.474 23.700 11.224 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -9.941 24.273 10.456 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -9.041 26.046 11.851 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -10.554 25.492 12.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -8.785 25.817 14.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -9.365 24.222 14.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -7.871 24.590 13.457 1.00 0.00 H new ATOM 1847 N ASP A 118 -9.682 21.336 8.115 1.00 0.00 N ATOM 1848 CA ASP A 118 -9.139 20.578 6.996 1.00 0.00 C ATOM 1849 C ASP A 118 -8.476 19.304 7.524 1.00 0.00 C ATOM 1850 O ASP A 118 -8.767 18.875 8.642 1.00 0.00 O ATOM 1851 CB ASP A 118 -8.128 21.434 6.226 1.00 0.00 C ATOM 1852 CG ASP A 118 -8.060 21.074 4.754 1.00 0.00 C ATOM 1853 OD1 ASP A 118 -8.503 21.890 3.919 1.00 0.00 O ATOM 1854 OD2 ASP A 118 -7.584 19.975 4.426 1.00 0.00 O ATOM 0 H ASP A 118 -9.091 22.105 8.430 1.00 0.00 H new ATOM 0 HA ASP A 118 -9.943 20.303 6.314 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -8.396 22.486 6.327 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -7.141 21.313 6.672 1.00 0.00 H new ATOM 1859 N LYS A 119 -7.607 18.688 6.731 1.00 0.00 N ATOM 1860 CA LYS A 119 -6.888 17.505 7.181 1.00 0.00 C ATOM 1861 C LYS A 119 -5.969 17.862 8.335 1.00 0.00 C ATOM 1862 O LYS A 119 -5.082 18.702 8.201 1.00 0.00 O ATOM 1863 CB LYS A 119 -6.073 16.863 6.050 1.00 0.00 C ATOM 1864 CG LYS A 119 -6.863 15.884 5.195 1.00 0.00 C ATOM 1865 CD LYS A 119 -7.933 16.591 4.389 1.00 0.00 C ATOM 1866 CE LYS A 119 -7.339 17.273 3.163 1.00 0.00 C ATOM 1867 NZ LYS A 119 -8.305 18.196 2.515 1.00 0.00 N ATOM 0 H LYS A 119 -7.385 18.986 5.781 1.00 0.00 H new ATOM 0 HA LYS A 119 -7.630 16.778 7.511 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -5.677 17.651 5.409 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.218 16.344 6.482 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -6.186 15.359 4.521 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -7.325 15.131 5.834 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -8.691 15.873 4.077 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -8.433 17.331 5.014 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -6.447 17.828 3.454 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -7.024 16.516 2.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -8.001 18.387 1.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -9.249 17.760 2.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -8.342 19.089 3.047 1.00 0.00 H new ATOM 1881 N GLN A 120 -6.207 17.245 9.468 1.00 0.00 N ATOM 1882 CA GLN A 120 -5.379 17.464 10.641 1.00 0.00 C ATOM 1883 C GLN A 120 -4.878 16.141 11.199 1.00 0.00 C ATOM 1884 O GLN A 120 -5.618 15.154 11.260 1.00 0.00 O ATOM 1885 CB GLN A 120 -6.147 18.237 11.720 1.00 0.00 C ATOM 1886 CG GLN A 120 -7.438 17.566 12.162 1.00 0.00 C ATOM 1887 CD GLN A 120 -8.091 18.278 13.329 1.00 0.00 C ATOM 1888 OE1 GLN A 120 -8.891 19.191 13.143 1.00 0.00 O ATOM 1889 NE2 GLN A 120 -7.758 17.861 14.542 1.00 0.00 N ATOM 0 H GLN A 120 -6.970 16.583 9.608 1.00 0.00 H new ATOM 0 HA GLN A 120 -4.520 18.062 10.337 1.00 0.00 H new ATOM 0 HB2 GLN A 120 -5.501 18.366 12.589 1.00 0.00 H new ATOM 0 HB3 GLN A 120 -6.378 19.233 11.343 1.00 0.00 H new ATOM 0 HG2 GLN A 120 -8.134 17.536 11.323 1.00 0.00 H new ATOM 0 HG3 GLN A 120 -7.230 16.533 12.441 1.00 0.00 H new ATOM 0 HE21 GLN A 120 -7.089 17.099 14.654 1.00 0.00 H new ATOM 0 HE22 GLN A 120 -8.171 18.302 15.364 1.00 0.00 H new ATOM 1898 N LEU A 121 -3.618 16.123 11.591 1.00 0.00 N ATOM 1899 CA LEU A 121 -3.023 14.953 12.199 1.00 0.00 C ATOM 1900 C LEU A 121 -2.909 15.187 13.692 1.00 0.00 C ATOM 1901 O LEU A 121 -2.108 16.010 14.143 1.00 0.00 O ATOM 1902 CB LEU A 121 -1.646 14.665 11.591 1.00 0.00 C ATOM 1903 CG LEU A 121 -1.039 13.312 11.965 1.00 0.00 C ATOM 1904 CD1 LEU A 121 -1.931 12.174 11.492 1.00 0.00 C ATOM 1905 CD2 LEU A 121 0.358 13.174 11.379 1.00 0.00 C ATOM 0 H LEU A 121 -2.983 16.916 11.497 1.00 0.00 H new ATOM 0 HA LEU A 121 -3.653 14.084 12.011 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -1.727 14.721 10.505 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -0.958 15.452 11.901 1.00 0.00 H new ATOM 0 HG LEU A 121 -0.964 13.259 13.051 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.481 11.220 11.768 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -2.912 12.262 11.960 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -2.040 12.224 10.409 1.00 0.00 H new ATOM 0 HD21 LEU A 121 0.774 12.205 11.655 1.00 0.00 H new ATOM 0 HD22 LEU A 121 0.306 13.250 10.293 1.00 0.00 H new ATOM 0 HD23 LEU A 121 0.996 13.967 11.768 1.00 0.00 H new ATOM 1917 N THR A 122 -3.736 14.495 14.447 1.00 0.00 N ATOM 1918 CA THR A 122 -3.789 14.678 15.881 1.00 0.00 C ATOM 1919 C THR A 122 -2.860 13.693 16.587 1.00 0.00 C ATOM 1920 O THR A 122 -3.139 12.494 16.651 1.00 0.00 O ATOM 1921 CB THR A 122 -5.228 14.493 16.397 1.00 0.00 C ATOM 1922 OG1 THR A 122 -6.140 15.248 15.582 1.00 0.00 O ATOM 1923 CG2 THR A 122 -5.349 14.941 17.844 1.00 0.00 C ATOM 0 H THR A 122 -4.385 13.795 14.087 1.00 0.00 H new ATOM 0 HA THR A 122 -3.459 15.693 16.102 1.00 0.00 H new ATOM 0 HB THR A 122 -5.476 13.433 16.341 1.00 0.00 H new ATOM 0 HG1 THR A 122 -7.054 15.125 15.914 1.00 0.00 H new ATOM 0 HG21 THR A 122 -6.375 14.800 18.184 1.00 0.00 H new ATOM 0 HG22 THR A 122 -4.676 14.350 18.465 1.00 0.00 H new ATOM 0 HG23 THR A 122 -5.083 15.995 17.922 1.00 0.00 H new ATOM 1931 N LEU A 123 -1.740 14.193 17.086 1.00 0.00 N ATOM 1932 CA LEU A 123 -0.812 13.355 17.830 1.00 0.00 C ATOM 1933 C LEU A 123 -1.129 13.442 19.315 1.00 0.00 C ATOM 1934 O LEU A 123 -0.812 14.438 19.966 1.00 0.00 O ATOM 1935 CB LEU A 123 0.649 13.772 17.591 1.00 0.00 C ATOM 1936 CG LEU A 123 1.087 13.923 16.127 1.00 0.00 C ATOM 1937 CD1 LEU A 123 2.601 13.890 16.028 1.00 0.00 C ATOM 1938 CD2 LEU A 123 0.472 12.841 15.247 1.00 0.00 C ATOM 0 H LEU A 123 -1.453 15.167 16.991 1.00 0.00 H new ATOM 0 HA LEU A 123 -0.930 12.330 17.479 1.00 0.00 H new ATOM 0 HB2 LEU A 123 0.820 14.722 18.098 1.00 0.00 H new ATOM 0 HB3 LEU A 123 1.296 13.035 18.067 1.00 0.00 H new ATOM 0 HG LEU A 123 0.728 14.887 15.766 1.00 0.00 H new ATOM 0 HD11 LEU A 123 2.900 13.998 14.985 1.00 0.00 H new ATOM 0 HD12 LEU A 123 3.022 14.708 16.613 1.00 0.00 H new ATOM 0 HD13 LEU A 123 2.970 12.940 16.415 1.00 0.00 H new ATOM 0 HD21 LEU A 123 0.803 12.978 14.217 1.00 0.00 H new ATOM 0 HD22 LEU A 123 0.788 11.860 15.602 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -0.615 12.910 15.291 1.00 0.00 H new ATOM 1950 N ILE A 124 -1.773 12.414 19.845 1.00 0.00 N ATOM 1951 CA ILE A 124 -2.125 12.390 21.257 1.00 0.00 C ATOM 1952 C ILE A 124 -1.102 11.584 22.033 1.00 0.00 C ATOM 1953 O ILE A 124 -1.199 10.365 22.121 1.00 0.00 O ATOM 1954 CB ILE A 124 -3.517 11.774 21.497 1.00 0.00 C ATOM 1955 CG1 ILE A 124 -4.559 12.433 20.599 1.00 0.00 C ATOM 1956 CG2 ILE A 124 -3.911 11.918 22.963 1.00 0.00 C ATOM 1957 CD1 ILE A 124 -5.888 11.716 20.611 1.00 0.00 C ATOM 0 H ILE A 124 -2.062 11.588 19.321 1.00 0.00 H new ATOM 0 HA ILE A 124 -2.140 13.425 21.599 1.00 0.00 H new ATOM 0 HB ILE A 124 -3.473 10.714 21.249 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -4.706 13.464 20.919 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -4.180 12.467 19.577 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -4.896 11.479 23.120 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -3.181 11.404 23.588 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -3.938 12.974 23.231 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -6.586 12.233 19.953 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -5.752 10.692 20.263 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -6.286 11.705 21.626 1.00 0.00 H new ATOM 1969 N THR A 125 -0.117 12.262 22.581 1.00 0.00 N ATOM 1970 CA THR A 125 0.943 11.595 23.304 1.00 0.00 C ATOM 1971 C THR A 125 0.769 11.793 24.804 1.00 0.00 C ATOM 1972 O THR A 125 1.109 12.843 25.347 1.00 0.00 O ATOM 1973 CB THR A 125 2.319 12.118 22.860 1.00 0.00 C ATOM 1974 OG1 THR A 125 2.373 12.147 21.428 1.00 0.00 O ATOM 1975 CG2 THR A 125 3.436 11.233 23.396 1.00 0.00 C ATOM 0 H THR A 125 -0.028 13.277 22.539 1.00 0.00 H new ATOM 0 HA THR A 125 0.888 10.530 23.080 1.00 0.00 H new ATOM 0 HB THR A 125 2.457 13.123 23.259 1.00 0.00 H new ATOM 0 HG1 THR A 125 3.101 11.570 21.116 1.00 0.00 H new ATOM 0 HG21 THR A 125 4.399 11.624 23.068 1.00 0.00 H new ATOM 0 HG22 THR A 125 3.401 11.222 24.485 1.00 0.00 H new ATOM 0 HG23 THR A 125 3.309 10.218 23.019 1.00 0.00 H new ATOM 1983 N CYS A 126 0.205 10.800 25.472 1.00 0.00 N ATOM 1984 CA CYS A 126 0.010 10.887 26.909 1.00 0.00 C ATOM 1985 C CYS A 126 1.334 10.652 27.627 1.00 0.00 C ATOM 1986 O CYS A 126 1.762 9.516 27.823 1.00 0.00 O ATOM 1987 CB CYS A 126 -1.073 9.905 27.373 1.00 0.00 C ATOM 1988 SG CYS A 126 -0.896 8.205 26.733 1.00 0.00 S ATOM 0 H CYS A 126 -0.123 9.933 25.047 1.00 0.00 H new ATOM 0 HA CYS A 126 -0.338 11.889 27.162 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -1.068 9.870 28.462 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -2.046 10.292 27.071 1.00 0.00 H new ATOM 1993 N ASP A 127 1.990 11.751 27.980 1.00 0.00 N ATOM 1994 CA ASP A 127 3.313 11.704 28.581 1.00 0.00 C ATOM 1995 C ASP A 127 3.322 12.458 29.904 1.00 0.00 C ATOM 1996 O ASP A 127 3.731 13.617 29.982 1.00 0.00 O ATOM 1997 CB ASP A 127 4.350 12.290 27.619 1.00 0.00 C ATOM 1998 CG ASP A 127 5.758 12.252 28.175 1.00 0.00 C ATOM 1999 OD1 ASP A 127 6.342 13.333 28.404 1.00 0.00 O ATOM 2000 OD2 ASP A 127 6.292 11.143 28.379 1.00 0.00 O ATOM 0 H ASP A 127 1.621 12.694 27.858 1.00 0.00 H new ATOM 0 HA ASP A 127 3.572 10.664 28.779 1.00 0.00 H new ATOM 0 HB2 ASP A 127 4.321 11.737 26.680 1.00 0.00 H new ATOM 0 HB3 ASP A 127 4.083 13.322 27.390 1.00 0.00 H new ATOM 2005 N ASP A 128 2.818 11.798 30.931 1.00 0.00 N ATOM 2006 CA ASP A 128 2.758 12.355 32.275 1.00 0.00 C ATOM 2007 C ASP A 128 2.384 11.241 33.240 1.00 0.00 C ATOM 2008 O ASP A 128 1.211 11.020 33.539 1.00 0.00 O ATOM 2009 CB ASP A 128 1.746 13.500 32.343 1.00 0.00 C ATOM 2010 CG ASP A 128 1.835 14.286 33.632 1.00 0.00 C ATOM 2011 OD1 ASP A 128 2.890 14.908 33.879 1.00 0.00 O ATOM 2012 OD2 ASP A 128 0.841 14.315 34.385 1.00 0.00 O ATOM 0 H ASP A 128 2.436 10.855 30.858 1.00 0.00 H new ATOM 0 HA ASP A 128 3.730 12.766 32.549 1.00 0.00 H new ATOM 0 HB2 ASP A 128 1.908 14.173 31.501 1.00 0.00 H new ATOM 0 HB3 ASP A 128 0.739 13.096 32.238 1.00 0.00 H new ATOM 2017 N TYR A 129 3.394 10.517 33.687 1.00 0.00 N ATOM 2018 CA TYR A 129 3.199 9.261 34.399 1.00 0.00 C ATOM 2019 C TYR A 129 3.129 9.461 35.905 1.00 0.00 C ATOM 2020 O TYR A 129 4.024 10.056 36.506 1.00 0.00 O ATOM 2021 CB TYR A 129 4.342 8.305 34.042 1.00 0.00 C ATOM 2022 CG TYR A 129 4.320 6.986 34.781 1.00 0.00 C ATOM 2023 CD1 TYR A 129 5.297 6.685 35.720 1.00 0.00 C ATOM 2024 CD2 TYR A 129 3.339 6.035 34.528 1.00 0.00 C ATOM 2025 CE1 TYR A 129 5.300 5.478 36.384 1.00 0.00 C ATOM 2026 CE2 TYR A 129 3.332 4.825 35.194 1.00 0.00 C ATOM 2027 CZ TYR A 129 4.318 4.551 36.119 1.00 0.00 C ATOM 2028 OH TYR A 129 4.321 3.348 36.788 1.00 0.00 O ATOM 0 H TYR A 129 4.372 10.780 33.568 1.00 0.00 H new ATOM 0 HA TYR A 129 2.243 8.837 34.091 1.00 0.00 H new ATOM 0 HB2 TYR A 129 4.309 8.106 32.971 1.00 0.00 H new ATOM 0 HB3 TYR A 129 5.290 8.803 34.245 1.00 0.00 H new ATOM 0 HD1 TYR A 129 6.068 7.410 35.934 1.00 0.00 H new ATOM 0 HD2 TYR A 129 2.570 6.245 33.799 1.00 0.00 H new ATOM 0 HE1 TYR A 129 6.070 5.260 37.110 1.00 0.00 H new ATOM 0 HE2 TYR A 129 2.559 4.098 34.992 1.00 0.00 H new ATOM 0 HH TYR A 129 3.562 2.805 36.489 1.00 0.00 H new ATOM 2038 N ASN A 130 2.055 8.962 36.503 1.00 0.00 N ATOM 2039 CA ASN A 130 1.936 8.904 37.954 1.00 0.00 C ATOM 2040 C ASN A 130 2.333 7.509 38.426 1.00 0.00 C ATOM 2041 O ASN A 130 1.606 6.541 38.202 1.00 0.00 O ATOM 2042 CB ASN A 130 0.502 9.239 38.393 1.00 0.00 C ATOM 2043 CG ASN A 130 0.318 9.260 39.904 1.00 0.00 C ATOM 2044 OD1 ASN A 130 0.942 8.495 40.642 1.00 0.00 O ATOM 2045 ND2 ASN A 130 -0.543 10.149 40.377 1.00 0.00 N ATOM 0 H ASN A 130 1.249 8.589 36.002 1.00 0.00 H new ATOM 0 HA ASN A 130 2.600 9.642 38.404 1.00 0.00 H new ATOM 0 HB2 ASN A 130 0.225 10.212 37.988 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -0.182 8.508 37.962 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -0.707 10.216 41.382 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -1.042 10.766 39.737 1.00 0.00 H new ATOM 2052 N GLU A 131 3.490 7.419 39.066 1.00 0.00 N ATOM 2053 CA GLU A 131 4.074 6.137 39.468 1.00 0.00 C ATOM 2054 C GLU A 131 3.163 5.323 40.385 1.00 0.00 C ATOM 2055 O GLU A 131 3.152 4.092 40.319 1.00 0.00 O ATOM 2056 CB GLU A 131 5.402 6.377 40.179 1.00 0.00 C ATOM 2057 CG GLU A 131 6.422 7.105 39.328 1.00 0.00 C ATOM 2058 CD GLU A 131 7.631 7.529 40.128 1.00 0.00 C ATOM 2059 OE1 GLU A 131 7.662 8.689 40.594 1.00 0.00 O ATOM 2060 OE2 GLU A 131 8.546 6.703 40.310 1.00 0.00 O ATOM 0 H GLU A 131 4.054 8.229 39.323 1.00 0.00 H new ATOM 0 HA GLU A 131 4.218 5.561 38.554 1.00 0.00 H new ATOM 0 HB2 GLU A 131 5.220 6.953 41.086 1.00 0.00 H new ATOM 0 HB3 GLU A 131 5.817 5.418 40.489 1.00 0.00 H new ATOM 0 HG2 GLU A 131 6.738 6.458 38.509 1.00 0.00 H new ATOM 0 HG3 GLU A 131 5.958 7.984 38.879 1.00 0.00 H new ATOM 2067 N LYS A 132 2.399 6.003 41.228 1.00 0.00 N ATOM 2068 CA LYS A 132 1.637 5.347 42.273 1.00 0.00 C ATOM 2069 C LYS A 132 0.453 4.550 41.727 1.00 0.00 C ATOM 2070 O LYS A 132 0.010 3.588 42.353 1.00 0.00 O ATOM 2071 CB LYS A 132 1.161 6.389 43.277 1.00 0.00 C ATOM 2072 CG LYS A 132 2.267 6.922 44.176 1.00 0.00 C ATOM 2073 CD LYS A 132 2.896 5.812 45.007 1.00 0.00 C ATOM 2074 CE LYS A 132 3.927 6.359 45.981 1.00 0.00 C ATOM 2075 NZ LYS A 132 5.083 6.987 45.286 1.00 0.00 N ATOM 0 H LYS A 132 2.292 7.017 41.205 1.00 0.00 H new ATOM 0 HA LYS A 132 2.294 4.628 42.763 1.00 0.00 H new ATOM 0 HB2 LYS A 132 0.711 7.222 42.737 1.00 0.00 H new ATOM 0 HB3 LYS A 132 0.379 5.952 43.898 1.00 0.00 H new ATOM 0 HG2 LYS A 132 3.034 7.400 43.566 1.00 0.00 H new ATOM 0 HG3 LYS A 132 1.862 7.688 44.837 1.00 0.00 H new ATOM 0 HD2 LYS A 132 2.118 5.284 45.558 1.00 0.00 H new ATOM 0 HD3 LYS A 132 3.368 5.085 44.346 1.00 0.00 H new ATOM 0 HE2 LYS A 132 3.454 7.094 46.632 1.00 0.00 H new ATOM 0 HE3 LYS A 132 4.285 5.551 46.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 5.813 7.238 45.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 5.479 6.317 44.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 4.766 7.846 44.792 1.00 0.00 H new ATOM 2089 N THR A 133 -0.055 4.935 40.565 1.00 0.00 N ATOM 2090 CA THR A 133 -1.219 4.263 40.001 1.00 0.00 C ATOM 2091 C THR A 133 -0.951 3.754 38.586 1.00 0.00 C ATOM 2092 O THR A 133 -1.496 2.730 38.171 1.00 0.00 O ATOM 2093 CB THR A 133 -2.463 5.184 40.012 1.00 0.00 C ATOM 2094 OG1 THR A 133 -3.540 4.589 39.277 1.00 0.00 O ATOM 2095 CG2 THR A 133 -2.136 6.549 39.430 1.00 0.00 C ATOM 0 H THR A 133 0.314 5.699 39.999 1.00 0.00 H new ATOM 0 HA THR A 133 -1.422 3.401 40.636 1.00 0.00 H new ATOM 0 HB THR A 133 -2.770 5.313 41.050 1.00 0.00 H new ATOM 0 HG1 THR A 133 -4.318 5.185 39.296 1.00 0.00 H new ATOM 0 HG21 THR A 133 -3.027 7.176 39.450 1.00 0.00 H new ATOM 0 HG22 THR A 133 -1.349 7.018 40.021 1.00 0.00 H new ATOM 0 HG23 THR A 133 -1.796 6.434 38.401 1.00 0.00 H new ATOM 2103 N GLY A 134 -0.097 4.455 37.851 1.00 0.00 N ATOM 2104 CA GLY A 134 0.189 4.060 36.488 1.00 0.00 C ATOM 2105 C GLY A 134 -0.645 4.827 35.486 1.00 0.00 C ATOM 2106 O GLY A 134 -0.587 4.566 34.283 1.00 0.00 O ATOM 0 H GLY A 134 0.400 5.286 38.173 1.00 0.00 H new ATOM 0 HA2 GLY A 134 1.246 4.222 36.278 1.00 0.00 H new ATOM 0 HA3 GLY A 134 0.001 2.992 36.374 1.00 0.00 H new ATOM 2110 N VAL A 135 -1.422 5.778 35.988 1.00 0.00 N ATOM 2111 CA VAL A 135 -2.263 6.607 35.143 1.00 0.00 C ATOM 2112 C VAL A 135 -1.462 7.780 34.595 1.00 0.00 C ATOM 2113 O VAL A 135 -0.651 8.377 35.306 1.00 0.00 O ATOM 2114 CB VAL A 135 -3.496 7.139 35.915 1.00 0.00 C ATOM 2115 CG1 VAL A 135 -4.330 8.074 35.053 1.00 0.00 C ATOM 2116 CG2 VAL A 135 -4.351 5.988 36.414 1.00 0.00 C ATOM 0 H VAL A 135 -1.485 5.993 36.983 1.00 0.00 H new ATOM 0 HA VAL A 135 -2.616 5.986 34.320 1.00 0.00 H new ATOM 0 HB VAL A 135 -3.129 7.705 36.771 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -5.187 8.429 35.625 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -3.722 8.925 34.745 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -4.680 7.540 34.170 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -5.212 6.382 36.954 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -4.694 5.395 35.566 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -3.761 5.359 37.081 1.00 0.00 H new ATOM 2126 N TRP A 136 -1.675 8.083 33.328 1.00 0.00 N ATOM 2127 CA TRP A 136 -1.039 9.220 32.694 1.00 0.00 C ATOM 2128 C TRP A 136 -1.996 10.400 32.744 1.00 0.00 C ATOM 2129 O TRP A 136 -2.982 10.451 32.010 1.00 0.00 O ATOM 2130 CB TRP A 136 -0.632 8.860 31.263 1.00 0.00 C ATOM 2131 CG TRP A 136 0.309 7.690 31.229 1.00 0.00 C ATOM 2132 CD1 TRP A 136 -0.005 6.384 31.479 1.00 0.00 C ATOM 2133 CD2 TRP A 136 1.714 7.712 30.947 1.00 0.00 C ATOM 2134 NE1 TRP A 136 1.116 5.601 31.384 1.00 0.00 N ATOM 2135 CE2 TRP A 136 2.182 6.390 31.051 1.00 0.00 C ATOM 2136 CE3 TRP A 136 2.620 8.720 30.613 1.00 0.00 C ATOM 2137 CZ2 TRP A 136 3.517 6.053 30.839 1.00 0.00 C ATOM 2138 CZ3 TRP A 136 3.944 8.385 30.402 1.00 0.00 C ATOM 2139 CH2 TRP A 136 4.379 7.061 30.513 1.00 0.00 C ATOM 0 H TRP A 136 -2.290 7.550 32.713 1.00 0.00 H new ATOM 0 HA TRP A 136 -0.127 9.497 33.222 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -1.523 8.627 30.679 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -0.158 9.721 30.792 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -0.994 6.021 31.717 1.00 0.00 H new ATOM 0 HE1 TRP A 136 1.150 4.593 31.537 1.00 0.00 H new ATOM 0 HE3 TRP A 136 2.292 9.745 30.521 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 3.858 5.032 30.929 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 4.654 9.158 30.147 1.00 0.00 H new ATOM 0 HH2 TRP A 136 5.419 6.830 30.337 1.00 0.00 H new ATOM 2150 N GLU A 137 -1.695 11.333 33.635 1.00 0.00 N ATOM 2151 CA GLU A 137 -2.649 12.358 34.040 1.00 0.00 C ATOM 2152 C GLU A 137 -2.758 13.494 33.028 1.00 0.00 C ATOM 2153 O GLU A 137 -3.707 14.276 33.065 1.00 0.00 O ATOM 2154 CB GLU A 137 -2.255 12.908 35.410 1.00 0.00 C ATOM 2155 CG GLU A 137 -2.126 11.828 36.477 1.00 0.00 C ATOM 2156 CD GLU A 137 -1.840 12.391 37.851 1.00 0.00 C ATOM 2157 OE1 GLU A 137 -2.803 12.632 38.606 1.00 0.00 O ATOM 2158 OE2 GLU A 137 -0.654 12.589 38.186 1.00 0.00 O ATOM 0 H GLU A 137 -0.788 11.402 34.096 1.00 0.00 H new ATOM 0 HA GLU A 137 -3.631 11.889 34.092 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -1.307 13.438 35.322 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -2.999 13.638 35.729 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -3.048 11.247 36.512 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -1.327 11.141 36.197 1.00 0.00 H new ATOM 2165 N LYS A 138 -1.791 13.594 32.135 1.00 0.00 N ATOM 2166 CA LYS A 138 -1.819 14.617 31.113 1.00 0.00 C ATOM 2167 C LYS A 138 -1.499 14.017 29.750 1.00 0.00 C ATOM 2168 O LYS A 138 -0.520 13.285 29.597 1.00 0.00 O ATOM 2169 CB LYS A 138 -0.817 15.718 31.451 1.00 0.00 C ATOM 2170 CG LYS A 138 -0.913 16.923 30.541 1.00 0.00 C ATOM 2171 CD LYS A 138 -2.182 17.724 30.800 1.00 0.00 C ATOM 2172 CE LYS A 138 -2.082 18.549 32.077 1.00 0.00 C ATOM 2173 NZ LYS A 138 -1.092 19.651 31.944 1.00 0.00 N ATOM 0 H LYS A 138 -0.978 12.979 32.099 1.00 0.00 H new ATOM 0 HA LYS A 138 -2.820 15.046 31.075 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -0.974 16.037 32.481 1.00 0.00 H new ATOM 0 HB3 LYS A 138 0.192 15.310 31.394 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -0.043 17.562 30.690 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -0.895 16.596 29.501 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -2.373 18.385 29.955 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -3.032 17.045 30.872 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -3.060 18.966 32.319 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -1.797 17.902 32.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -1.183 20.299 32.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -0.131 19.254 31.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -1.269 20.172 31.062 1.00 0.00 H new ATOM 2187 N ARG A 139 -2.327 14.318 28.764 1.00 0.00 N ATOM 2188 CA ARG A 139 -2.080 13.855 27.415 1.00 0.00 C ATOM 2189 C ARG A 139 -1.717 15.031 26.513 1.00 0.00 C ATOM 2190 O ARG A 139 -2.524 15.930 26.273 1.00 0.00 O ATOM 2191 CB ARG A 139 -3.272 13.057 26.862 1.00 0.00 C ATOM 2192 CG ARG A 139 -4.620 13.762 26.932 1.00 0.00 C ATOM 2193 CD ARG A 139 -5.733 12.852 26.433 1.00 0.00 C ATOM 2194 NE ARG A 139 -7.044 13.503 26.428 1.00 0.00 N ATOM 2195 CZ ARG A 139 -8.207 12.844 26.431 1.00 0.00 C ATOM 2196 NH1 ARG A 139 -8.237 11.524 26.564 1.00 0.00 N ATOM 2197 NH2 ARG A 139 -9.344 13.516 26.346 1.00 0.00 N ATOM 0 H ARG A 139 -3.172 14.879 28.874 1.00 0.00 H new ATOM 0 HA ARG A 139 -1.232 13.171 27.438 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -3.067 12.805 25.822 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -3.344 12.117 27.410 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -4.824 14.064 27.959 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -4.591 14.671 26.332 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -5.496 12.517 25.423 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -5.777 11.963 27.062 1.00 0.00 H new ATOM 0 HE ARG A 139 -7.072 14.523 26.422 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -7.367 11.002 26.665 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -9.130 11.032 26.565 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -9.331 14.534 26.278 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -10.233 13.016 26.348 1.00 0.00 H new ATOM 2211 N LYS A 140 -0.477 15.026 26.050 1.00 0.00 N ATOM 2212 CA LYS A 140 0.044 16.083 25.198 1.00 0.00 C ATOM 2213 C LYS A 140 -0.493 15.918 23.783 1.00 0.00 C ATOM 2214 O LYS A 140 -0.384 14.846 23.194 1.00 0.00 O ATOM 2215 CB LYS A 140 1.577 16.031 25.215 1.00 0.00 C ATOM 2216 CG LYS A 140 2.266 17.061 24.333 1.00 0.00 C ATOM 2217 CD LYS A 140 1.884 18.477 24.716 1.00 0.00 C ATOM 2218 CE LYS A 140 3.007 19.455 24.422 1.00 0.00 C ATOM 2219 NZ LYS A 140 4.213 19.185 25.254 1.00 0.00 N ATOM 0 H LYS A 140 0.197 14.288 26.255 1.00 0.00 H new ATOM 0 HA LYS A 140 -0.279 17.055 25.570 1.00 0.00 H new ATOM 0 HB2 LYS A 140 1.919 16.167 26.241 1.00 0.00 H new ATOM 0 HB3 LYS A 140 1.895 15.036 24.902 1.00 0.00 H new ATOM 0 HG2 LYS A 140 3.347 16.942 24.412 1.00 0.00 H new ATOM 0 HG3 LYS A 140 2.001 16.882 23.291 1.00 0.00 H new ATOM 0 HD2 LYS A 140 0.989 18.774 24.169 1.00 0.00 H new ATOM 0 HD3 LYS A 140 1.636 18.514 25.777 1.00 0.00 H new ATOM 0 HE2 LYS A 140 3.273 19.395 23.367 1.00 0.00 H new ATOM 0 HE3 LYS A 140 2.660 20.472 24.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 4.750 20.066 25.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 3.920 18.819 26.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 4.813 18.481 24.778 1.00 0.00 H new ATOM 2233 N ILE A 141 -1.073 16.973 23.240 1.00 0.00 N ATOM 2234 CA ILE A 141 -1.726 16.878 21.949 1.00 0.00 C ATOM 2235 C ILE A 141 -1.111 17.840 20.943 1.00 0.00 C ATOM 2236 O ILE A 141 -0.963 19.040 21.198 1.00 0.00 O ATOM 2237 CB ILE A 141 -3.247 17.125 22.066 1.00 0.00 C ATOM 2238 CG1 ILE A 141 -3.934 16.939 20.710 1.00 0.00 C ATOM 2239 CG2 ILE A 141 -3.533 18.509 22.623 1.00 0.00 C ATOM 2240 CD1 ILE A 141 -5.438 17.101 20.765 1.00 0.00 C ATOM 0 H ILE A 141 -1.105 17.898 23.669 1.00 0.00 H new ATOM 0 HA ILE A 141 -1.572 15.861 21.587 1.00 0.00 H new ATOM 0 HB ILE A 141 -3.653 16.389 22.760 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -3.525 17.661 20.003 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -3.698 15.947 20.325 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -4.611 18.657 22.695 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -3.087 18.602 23.613 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -3.107 19.263 21.961 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -5.856 16.956 19.769 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -5.859 16.362 21.447 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -5.683 18.102 21.119 1.00 0.00 H new ATOM 2252 N PHE A 142 -0.730 17.292 19.810 1.00 0.00 N ATOM 2253 CA PHE A 142 -0.181 18.078 18.724 1.00 0.00 C ATOM 2254 C PHE A 142 -1.125 18.025 17.531 1.00 0.00 C ATOM 2255 O PHE A 142 -1.263 16.985 16.887 1.00 0.00 O ATOM 2256 CB PHE A 142 1.195 17.549 18.306 1.00 0.00 C ATOM 2257 CG PHE A 142 2.222 17.541 19.404 1.00 0.00 C ATOM 2258 CD1 PHE A 142 2.483 16.384 20.121 1.00 0.00 C ATOM 2259 CD2 PHE A 142 2.938 18.686 19.708 1.00 0.00 C ATOM 2260 CE1 PHE A 142 3.439 16.371 21.118 1.00 0.00 C ATOM 2261 CE2 PHE A 142 3.892 18.680 20.706 1.00 0.00 C ATOM 2262 CZ PHE A 142 4.144 17.521 21.411 1.00 0.00 C ATOM 0 H PHE A 142 -0.791 16.293 19.615 1.00 0.00 H new ATOM 0 HA PHE A 142 -0.068 19.107 19.066 1.00 0.00 H new ATOM 0 HB2 PHE A 142 1.080 16.534 17.927 1.00 0.00 H new ATOM 0 HB3 PHE A 142 1.568 18.157 17.482 1.00 0.00 H new ATOM 0 HD1 PHE A 142 1.933 15.482 19.898 1.00 0.00 H new ATOM 0 HD2 PHE A 142 2.748 19.596 19.158 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.635 15.462 21.668 1.00 0.00 H new ATOM 0 HE2 PHE A 142 4.441 19.582 20.935 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.891 17.514 22.191 1.00 0.00 H new ATOM 2272 N VAL A 143 -1.791 19.133 17.255 1.00 0.00 N ATOM 2273 CA VAL A 143 -2.701 19.204 16.124 1.00 0.00 C ATOM 2274 C VAL A 143 -1.997 19.820 14.929 1.00 0.00 C ATOM 2275 O VAL A 143 -1.791 21.037 14.863 1.00 0.00 O ATOM 2276 CB VAL A 143 -3.964 20.026 16.451 1.00 0.00 C ATOM 2277 CG1 VAL A 143 -4.947 20.004 15.287 1.00 0.00 C ATOM 2278 CG2 VAL A 143 -4.621 19.518 17.723 1.00 0.00 C ATOM 0 H VAL A 143 -1.719 19.994 17.797 1.00 0.00 H new ATOM 0 HA VAL A 143 -3.011 18.185 15.892 1.00 0.00 H new ATOM 0 HB VAL A 143 -3.661 21.060 16.614 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -5.829 20.591 15.544 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -4.473 20.429 14.402 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -5.244 18.976 15.081 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -5.510 20.112 17.935 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -4.905 18.473 17.594 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -3.920 19.604 18.554 1.00 0.00 H new ATOM 2288 N ALA A 144 -1.606 18.972 14.000 1.00 0.00 N ATOM 2289 CA ALA A 144 -0.930 19.419 12.802 1.00 0.00 C ATOM 2290 C ALA A 144 -1.904 19.471 11.633 1.00 0.00 C ATOM 2291 O ALA A 144 -2.337 18.438 11.134 1.00 0.00 O ATOM 2292 CB ALA A 144 0.245 18.508 12.489 1.00 0.00 C ATOM 0 H ALA A 144 -1.747 17.963 14.054 1.00 0.00 H new ATOM 0 HA ALA A 144 -0.546 20.425 12.969 1.00 0.00 H new ATOM 0 HB1 ALA A 144 0.745 18.856 11.585 1.00 0.00 H new ATOM 0 HB2 ALA A 144 0.949 18.523 13.321 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -0.114 17.490 12.336 1.00 0.00 H new ATOM 2298 N THR A 145 -2.262 20.675 11.220 1.00 0.00 N ATOM 2299 CA THR A 145 -3.207 20.860 10.129 1.00 0.00 C ATOM 2300 C THR A 145 -2.461 20.946 8.796 1.00 0.00 C ATOM 2301 O THR A 145 -1.345 21.475 8.742 1.00 0.00 O ATOM 2302 CB THR A 145 -4.045 22.139 10.351 1.00 0.00 C ATOM 2303 OG1 THR A 145 -4.360 22.268 11.747 1.00 0.00 O ATOM 2304 CG2 THR A 145 -5.342 22.103 9.547 1.00 0.00 C ATOM 0 H THR A 145 -1.911 21.543 11.625 1.00 0.00 H new ATOM 0 HA THR A 145 -3.880 20.003 10.104 1.00 0.00 H new ATOM 0 HB THR A 145 -3.455 22.992 10.014 1.00 0.00 H new ATOM 0 HG1 THR A 145 -4.890 23.080 11.889 1.00 0.00 H new ATOM 0 HG21 THR A 145 -5.907 23.018 9.727 1.00 0.00 H new ATOM 0 HG22 THR A 145 -5.110 22.023 8.485 1.00 0.00 H new ATOM 0 HG23 THR A 145 -5.937 21.243 9.854 1.00 0.00 H new ATOM 2312 N GLU A 146 -3.066 20.394 7.745 1.00 0.00 N ATOM 2313 CA GLU A 146 -2.480 20.384 6.404 1.00 0.00 C ATOM 2314 C GLU A 146 -2.029 21.781 5.989 1.00 0.00 C ATOM 2315 O GLU A 146 -2.719 22.775 6.236 1.00 0.00 O ATOM 2316 CB GLU A 146 -3.497 19.848 5.390 1.00 0.00 C ATOM 2317 CG GLU A 146 -2.948 19.690 3.975 1.00 0.00 C ATOM 2318 CD GLU A 146 -2.178 18.399 3.760 1.00 0.00 C ATOM 2319 OE1 GLU A 146 -2.756 17.315 3.988 1.00 0.00 O ATOM 2320 OE2 GLU A 146 -1.014 18.464 3.306 1.00 0.00 O ATOM 0 H GLU A 146 -3.978 19.940 7.799 1.00 0.00 H new ATOM 0 HA GLU A 146 -1.606 19.732 6.424 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -3.862 18.881 5.736 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -4.354 20.521 5.362 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -3.776 19.731 3.267 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -2.295 20.534 3.752 1.00 0.00 H new ATOM 2327 N VAL A 147 -0.868 21.843 5.365 1.00 0.00 N ATOM 2328 CA VAL A 147 -0.293 23.102 4.924 1.00 0.00 C ATOM 2329 C VAL A 147 -0.618 23.323 3.452 1.00 0.00 C ATOM 2330 O VAL A 147 -0.846 22.361 2.718 1.00 0.00 O ATOM 2331 CB VAL A 147 1.242 23.123 5.132 1.00 0.00 C ATOM 2332 CG1 VAL A 147 1.823 24.502 4.860 1.00 0.00 C ATOM 2333 CG2 VAL A 147 1.587 22.678 6.539 1.00 0.00 C ATOM 0 H VAL A 147 -0.297 21.025 5.149 1.00 0.00 H new ATOM 0 HA VAL A 147 -0.725 23.904 5.522 1.00 0.00 H new ATOM 0 HB VAL A 147 1.684 22.428 4.418 1.00 0.00 H new ATOM 0 HG11 VAL A 147 2.902 24.480 5.016 1.00 0.00 H new ATOM 0 HG12 VAL A 147 1.611 24.790 3.830 1.00 0.00 H new ATOM 0 HG13 VAL A 147 1.373 25.227 5.539 1.00 0.00 H new ATOM 0 HG21 VAL A 147 2.669 22.697 6.672 1.00 0.00 H new ATOM 0 HG22 VAL A 147 1.121 23.352 7.258 1.00 0.00 H new ATOM 0 HG23 VAL A 147 1.220 21.665 6.700 1.00 0.00 H new ATOM 2343 N LYS A 148 -0.659 24.584 3.038 1.00 0.00 N ATOM 2344 CA LYS A 148 -0.945 24.939 1.654 1.00 0.00 C ATOM 2345 C LYS A 148 0.010 24.226 0.695 1.00 0.00 C ATOM 2346 O LYS A 148 -0.455 23.352 -0.064 1.00 0.00 O ATOM 2347 CB LYS A 148 -0.871 26.457 1.468 1.00 0.00 C ATOM 2348 CG LYS A 148 0.442 27.077 1.923 1.00 0.00 C ATOM 2349 CD LYS A 148 0.427 28.585 1.763 1.00 0.00 C ATOM 2350 CE LYS A 148 0.141 28.987 0.327 1.00 0.00 C ATOM 2351 NZ LYS A 148 0.010 30.457 0.180 1.00 0.00 N ATOM 0 H LYS A 148 -0.496 25.385 3.649 1.00 0.00 H new ATOM 0 HA LYS A 148 -1.958 24.611 1.419 1.00 0.00 H new ATOM 0 HB2 LYS A 148 -1.025 26.691 0.415 1.00 0.00 H new ATOM 0 HB3 LYS A 148 -1.689 26.920 2.020 1.00 0.00 H new ATOM 0 HG2 LYS A 148 0.624 26.822 2.967 1.00 0.00 H new ATOM 0 HG3 LYS A 148 1.264 26.656 1.344 1.00 0.00 H new ATOM 0 HD2 LYS A 148 -0.329 29.015 2.420 1.00 0.00 H new ATOM 0 HD3 LYS A 148 1.388 28.995 2.073 1.00 0.00 H new ATOM 0 HE2 LYS A 148 0.943 28.628 -0.317 1.00 0.00 H new ATOM 0 HE3 LYS A 148 -0.777 28.505 -0.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 -0.185 30.690 -0.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 -0.772 30.797 0.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 0.895 30.916 0.476 1.00 0.00 H new TER 2365 LYS A 148 HETATM 2366 C7 JPT A 201 -2.499 7.571 27.166 1.00 0.00 C HETATM 2367 C8 JPT A 201 -2.640 6.107 26.750 1.00 0.00 C HETATM 2368 C11 JPT A 201 -3.219 5.189 27.552 1.00 0.00 C HETATM 2369 S2 JPT A 201 -3.209 3.765 26.698 1.00 0.00 S HETATM 2370 C12 JPT A 201 -2.463 4.329 25.318 1.00 0.00 C HETATM 2371 C13 JPT A 201 -2.209 5.650 25.509 1.00 0.00 C HETATM 2372 C6 JPT A 201 -4.866 8.029 23.294 1.00 0.00 C HETATM 2373 O3 JPT A 201 -4.455 8.974 22.304 1.00 0.00 O HETATM 2374 C5 JPT A 201 -4.490 8.983 27.199 1.00 0.00 C HETATM 2375 C4 JPT A 201 -3.489 8.299 26.521 1.00 0.00 C HETATM 2376 O4 JPT A 201 -4.391 9.130 28.547 1.00 0.00 O HETATM 2377 C1 JPT A 201 -5.577 9.508 26.554 1.00 0.00 C HETATM 2378 O2 JPT A 201 -6.415 10.183 27.149 1.00 0.00 O HETATM 2379 C2 JPT A 201 -5.697 9.258 25.210 1.00 0.00 C HETATM 2380 C3 JPT A 201 -4.680 8.564 24.563 1.00 0.00 C HETATM 2381 O1 JPT A 201 -3.449 8.335 25.141 1.00 0.00 O