USER MOD reduce.3.24.130724 H: found=0, std=0, add=953, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 952 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 90 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 116 CYS SG : rot -68:sc= -16.7! USER MOD Set 2.1: A 54 ASN : amide:sc= 0 X(o=0,f=0.0017) USER MOD Set 2.2: A 84 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 24 ASN : amide:sc= 0 K(o=-0.42,f=0.39) USER MOD Set 3.2: A 28 GLN : amide:sc= -0.416 K(o=-0.42,f=0.68) USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 HIS : no HD1:sc= -1.6 X(o=-1.6,f=-1.6) USER MOD Single : A 16 THR OG1 : rot -120:sc= -0.339 USER MOD Single : A 17 THR OG1 : rot 76:sc= 0.747 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -165:sc=-0.00567 (180deg=-0.152) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot 152:sc= 0.525 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 HIS : no HE2:sc= -0.335 K(o=-0.33,f=-3.9) USER MOD Single : A 62 TYR OH : rot -70:sc= -1.09 USER MOD Single : A 64 THR OG1 : rot 109:sc= 0.607 USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0443) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.062) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 81:sc= 0.218 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.603 X(o=-0.6,f=-0.61) USER MOD Single : A 111 ASN : amide:sc= 0 K(o=0,f=0.59) USER MOD Single : A 115 TYR OH : rot 180:sc= -1.19 USER MOD Single : A 119 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.138) USER MOD Single : A 120 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 4 -9.589 -19.426 -12.584 1.00 0.00 N ATOM 2 CA TYR A 4 -9.924 -18.044 -12.955 1.00 0.00 C ATOM 3 C TYR A 4 -9.515 -17.158 -11.778 1.00 0.00 C ATOM 4 O TYR A 4 -9.956 -17.358 -10.646 1.00 0.00 O ATOM 5 CB TYR A 4 -11.414 -17.918 -13.280 1.00 0.00 C ATOM 6 CG TYR A 4 -11.744 -16.666 -14.075 1.00 0.00 C ATOM 7 CD1 TYR A 4 -11.995 -15.491 -13.437 1.00 0.00 C ATOM 8 CD2 TYR A 4 -11.810 -16.720 -15.434 1.00 0.00 C ATOM 9 CE1 TYR A 4 -12.315 -14.383 -14.152 1.00 0.00 C ATOM 10 CE2 TYR A 4 -12.124 -15.610 -16.150 1.00 0.00 C ATOM 11 CZ TYR A 4 -12.377 -14.439 -15.509 1.00 0.00 C ATOM 12 OH TYR A 4 -12.690 -13.317 -16.229 1.00 0.00 O ATOM 0 HA TYR A 4 -9.393 -17.734 -13.855 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -11.733 -18.795 -13.844 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -11.984 -17.913 -12.351 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -11.939 -15.440 -12.360 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -11.612 -17.651 -15.945 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -12.521 -13.454 -13.642 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -12.173 -15.658 -17.228 1.00 0.00 H new ATOM 0 HH TYR A 4 -12.690 -13.531 -17.185 1.00 0.00 H new ATOM 22 N LYS A 5 -8.616 -16.219 -12.028 1.00 0.00 N ATOM 23 CA LYS A 5 -7.933 -15.538 -10.936 1.00 0.00 C ATOM 24 C LYS A 5 -8.703 -14.294 -10.488 1.00 0.00 C ATOM 25 O LYS A 5 -9.246 -13.538 -11.294 1.00 0.00 O ATOM 26 CB LYS A 5 -6.547 -15.153 -11.463 1.00 0.00 C ATOM 27 CG LYS A 5 -5.646 -16.369 -11.720 1.00 0.00 C ATOM 28 CD LYS A 5 -4.247 -15.943 -12.168 1.00 0.00 C ATOM 29 CE LYS A 5 -3.362 -17.164 -12.430 1.00 0.00 C ATOM 30 NZ LYS A 5 -2.023 -16.738 -12.868 1.00 0.00 N ATOM 0 H LYS A 5 -8.344 -15.913 -12.962 1.00 0.00 H new ATOM 0 HA LYS A 5 -7.860 -16.188 -10.064 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -6.660 -14.589 -12.389 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -6.061 -14.493 -10.744 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -5.572 -16.967 -10.812 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -6.097 -17.003 -12.484 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.319 -15.340 -13.073 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -3.791 -15.316 -11.402 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -3.282 -17.765 -11.524 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -3.818 -17.796 -13.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -1.432 -17.576 -13.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -2.104 -16.183 -13.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -1.585 -16.154 -12.127 1.00 0.00 H new ATOM 44 N THR A 6 -8.703 -14.071 -9.178 1.00 0.00 N ATOM 45 CA THR A 6 -9.257 -12.825 -8.627 1.00 0.00 C ATOM 46 C THR A 6 -8.071 -11.877 -8.405 1.00 0.00 C ATOM 47 O THR A 6 -7.001 -12.315 -7.976 1.00 0.00 O ATOM 48 CB THR A 6 -9.929 -13.252 -7.306 1.00 0.00 C ATOM 49 OG1 THR A 6 -11.041 -14.089 -7.599 1.00 0.00 O ATOM 50 CG2 THR A 6 -10.422 -12.094 -6.441 1.00 0.00 C ATOM 0 H THR A 6 -8.334 -14.720 -8.483 1.00 0.00 H new ATOM 0 HA THR A 6 -9.980 -12.312 -9.261 1.00 0.00 H new ATOM 0 HB THR A 6 -9.157 -13.767 -6.734 1.00 0.00 H new ATOM 0 HG1 THR A 6 -11.472 -14.365 -6.763 1.00 0.00 H new ATOM 0 HG21 THR A 6 -10.880 -12.487 -5.533 1.00 0.00 H new ATOM 0 HG22 THR A 6 -9.580 -11.455 -6.175 1.00 0.00 H new ATOM 0 HG23 THR A 6 -11.158 -11.513 -6.996 1.00 0.00 H new ATOM 58 N GLY A 7 -8.228 -10.579 -8.675 1.00 0.00 N ATOM 59 CA GLY A 7 -7.151 -9.642 -8.307 1.00 0.00 C ATOM 60 C GLY A 7 -7.596 -8.362 -7.613 1.00 0.00 C ATOM 61 O GLY A 7 -8.657 -8.272 -6.993 1.00 0.00 O ATOM 0 H GLY A 7 -9.044 -10.163 -9.124 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.450 -10.162 -7.654 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.605 -9.372 -9.211 1.00 0.00 H new ATOM 65 N LEU A 8 -6.703 -7.377 -7.703 1.00 0.00 N ATOM 66 CA LEU A 8 -6.894 -6.101 -7.014 1.00 0.00 C ATOM 67 C LEU A 8 -6.576 -4.970 -7.986 1.00 0.00 C ATOM 68 O LEU A 8 -5.581 -5.020 -8.709 1.00 0.00 O ATOM 69 CB LEU A 8 -5.884 -6.052 -5.846 1.00 0.00 C ATOM 70 CG LEU A 8 -6.523 -5.896 -4.466 1.00 0.00 C ATOM 71 CD1 LEU A 8 -5.405 -5.740 -3.434 1.00 0.00 C ATOM 72 CD2 LEU A 8 -7.484 -4.711 -4.394 1.00 0.00 C ATOM 0 H LEU A 8 -5.841 -7.438 -8.245 1.00 0.00 H new ATOM 0 HA LEU A 8 -7.917 -5.999 -6.651 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -5.290 -6.966 -5.857 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -5.196 -5.222 -6.011 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.119 -6.785 -4.259 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.840 -5.627 -2.441 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -4.767 -6.624 -3.452 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -4.810 -4.858 -3.672 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -7.909 -4.647 -3.392 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.944 -3.791 -4.618 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -8.286 -4.848 -5.120 1.00 0.00 H new ATOM 84 N LEU A 9 -7.369 -3.904 -7.955 1.00 0.00 N ATOM 85 CA LEU A 9 -6.984 -2.668 -8.604 1.00 0.00 C ATOM 86 C LEU A 9 -7.037 -1.549 -7.553 1.00 0.00 C ATOM 87 O LEU A 9 -7.940 -1.452 -6.722 1.00 0.00 O ATOM 88 CB LEU A 9 -7.900 -2.531 -9.815 1.00 0.00 C ATOM 89 CG LEU A 9 -8.016 -1.110 -10.340 1.00 0.00 C ATOM 90 CD1 LEU A 9 -6.690 -0.720 -10.961 1.00 0.00 C ATOM 91 CD2 LEU A 9 -9.111 -1.098 -11.386 1.00 0.00 C ATOM 0 H LEU A 9 -8.276 -3.876 -7.489 1.00 0.00 H new ATOM 0 HA LEU A 9 -5.964 -2.628 -8.987 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -7.530 -3.174 -10.613 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -8.894 -2.892 -9.550 1.00 0.00 H new ATOM 0 HG LEU A 9 -8.257 -0.404 -9.545 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -6.753 0.298 -11.344 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -5.905 -0.776 -10.207 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -6.457 -1.402 -11.779 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -9.222 -0.090 -11.785 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -8.850 -1.782 -12.194 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.051 -1.414 -10.933 1.00 0.00 H new ATOM 103 N LEU A 10 -6.023 -0.704 -7.638 1.00 0.00 N ATOM 104 CA LEU A 10 -5.887 0.462 -6.756 1.00 0.00 C ATOM 105 C LEU A 10 -5.724 1.716 -7.612 1.00 0.00 C ATOM 106 O LEU A 10 -4.859 1.799 -8.479 1.00 0.00 O ATOM 107 CB LEU A 10 -4.742 0.294 -5.749 1.00 0.00 C ATOM 108 CG LEU A 10 -5.215 -0.511 -4.536 1.00 0.00 C ATOM 109 CD1 LEU A 10 -4.390 -1.772 -4.311 1.00 0.00 C ATOM 110 CD2 LEU A 10 -5.162 0.382 -3.303 1.00 0.00 C ATOM 0 H LEU A 10 -5.268 -0.800 -8.317 1.00 0.00 H new ATOM 0 HA LEU A 10 -6.791 0.560 -6.156 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -3.902 -0.212 -6.225 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.385 1.272 -5.428 1.00 0.00 H new ATOM 0 HG LEU A 10 -6.237 -0.839 -4.726 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -4.769 -2.304 -3.438 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -4.462 -2.415 -5.188 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.348 -1.500 -4.146 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -5.497 -0.181 -2.432 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -4.139 0.722 -3.144 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -5.812 1.244 -3.450 1.00 0.00 H new ATOM 122 N ILE A 11 -6.648 2.652 -7.442 1.00 0.00 N ATOM 123 CA ILE A 11 -6.870 3.685 -8.466 1.00 0.00 C ATOM 124 C ILE A 11 -6.852 5.086 -7.855 1.00 0.00 C ATOM 125 O ILE A 11 -7.441 5.349 -6.807 1.00 0.00 O ATOM 126 CB ILE A 11 -8.210 3.353 -9.154 1.00 0.00 C ATOM 127 CG1 ILE A 11 -8.586 4.333 -10.274 1.00 0.00 C ATOM 128 CG2 ILE A 11 -9.376 3.225 -8.151 1.00 0.00 C ATOM 129 CD1 ILE A 11 -9.774 3.807 -11.090 1.00 0.00 C ATOM 0 H ILE A 11 -7.251 2.725 -6.622 1.00 0.00 H new ATOM 0 HA ILE A 11 -6.068 3.686 -9.204 1.00 0.00 H new ATOM 0 HB ILE A 11 -8.044 2.380 -9.616 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -8.837 5.303 -9.844 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.729 4.487 -10.930 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.295 2.991 -8.689 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -9.159 2.428 -7.440 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -9.500 4.166 -7.615 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -10.020 4.521 -11.877 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -9.512 2.849 -11.538 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -10.636 3.678 -10.436 1.00 0.00 H new ATOM 141 N HIS A 12 -6.233 6.006 -8.585 1.00 0.00 N ATOM 142 CA HIS A 12 -6.382 7.429 -8.272 1.00 0.00 C ATOM 143 C HIS A 12 -7.287 8.055 -9.355 1.00 0.00 C ATOM 144 O HIS A 12 -7.028 7.861 -10.546 1.00 0.00 O ATOM 145 CB HIS A 12 -4.988 8.063 -8.284 1.00 0.00 C ATOM 146 CG HIS A 12 -4.975 9.585 -8.246 1.00 0.00 C ATOM 147 ND1 HIS A 12 -5.657 10.392 -7.343 1.00 0.00 N ATOM 148 CD2 HIS A 12 -4.380 10.355 -9.249 1.00 0.00 C ATOM 149 CE1 HIS A 12 -5.383 11.612 -7.918 1.00 0.00 C ATOM 150 NE2 HIS A 12 -4.597 11.694 -9.030 1.00 0.00 N ATOM 0 H HIS A 12 -5.633 5.802 -9.384 1.00 0.00 H new ATOM 0 HA HIS A 12 -6.834 7.590 -7.293 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -4.427 7.688 -7.428 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -4.462 7.732 -9.180 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -3.825 9.952 -10.083 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -5.794 12.512 -7.485 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -4.267 12.509 -9.547 1.00 0.00 H new ATOM 158 N PRO A 13 -8.339 8.804 -9.001 1.00 0.00 N ATOM 159 CA PRO A 13 -9.347 9.246 -9.982 1.00 0.00 C ATOM 160 C PRO A 13 -8.927 10.116 -11.174 1.00 0.00 C ATOM 161 O PRO A 13 -9.724 10.281 -12.101 1.00 0.00 O ATOM 162 CB PRO A 13 -10.252 10.090 -9.093 1.00 0.00 C ATOM 163 CG PRO A 13 -10.278 9.332 -7.773 1.00 0.00 C ATOM 164 CD PRO A 13 -8.840 8.841 -7.616 1.00 0.00 C ATOM 0 HA PRO A 13 -9.738 8.364 -10.489 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -9.860 11.099 -8.967 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.251 10.187 -9.518 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -10.575 9.977 -6.946 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.985 8.503 -7.800 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -8.251 9.515 -6.993 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -8.800 7.858 -7.148 1.00 0.00 H new ATOM 172 N ALA A 14 -7.743 10.725 -11.151 1.00 0.00 N ATOM 173 CA ALA A 14 -7.426 11.776 -12.140 1.00 0.00 C ATOM 174 C ALA A 14 -7.539 11.267 -13.584 1.00 0.00 C ATOM 175 O ALA A 14 -8.171 11.916 -14.418 1.00 0.00 O ATOM 176 CB ALA A 14 -6.058 12.378 -11.810 1.00 0.00 C ATOM 0 H ALA A 14 -7.000 10.523 -10.482 1.00 0.00 H new ATOM 0 HA ALA A 14 -8.168 12.572 -12.072 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -5.818 13.155 -12.536 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -6.083 12.811 -10.810 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.298 11.597 -11.849 1.00 0.00 H new ATOM 182 N VAL A 15 -6.916 10.137 -13.904 1.00 0.00 N ATOM 183 CA VAL A 15 -6.826 9.700 -15.308 1.00 0.00 C ATOM 184 C VAL A 15 -8.127 8.934 -15.640 1.00 0.00 C ATOM 185 O VAL A 15 -8.614 8.980 -16.769 1.00 0.00 O ATOM 186 CB VAL A 15 -5.569 8.848 -15.571 1.00 0.00 C ATOM 187 CG1 VAL A 15 -4.392 9.763 -15.911 1.00 0.00 C ATOM 188 CG2 VAL A 15 -5.189 7.901 -14.424 1.00 0.00 C ATOM 0 H VAL A 15 -6.472 9.513 -13.231 1.00 0.00 H new ATOM 0 HA VAL A 15 -6.726 10.566 -15.962 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.813 8.201 -16.413 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -3.504 9.159 -16.097 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.629 10.344 -16.802 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.204 10.439 -15.077 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.294 7.342 -14.696 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.995 8.481 -13.522 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -6.009 7.207 -14.239 1.00 0.00 H new ATOM 198 N THR A 16 -8.675 8.213 -14.658 1.00 0.00 N ATOM 199 CA THR A 16 -9.787 7.287 -14.901 1.00 0.00 C ATOM 200 C THR A 16 -11.183 7.948 -14.867 1.00 0.00 C ATOM 201 O THR A 16 -12.171 7.272 -15.164 1.00 0.00 O ATOM 202 CB THR A 16 -9.691 6.162 -13.861 1.00 0.00 C ATOM 203 OG1 THR A 16 -9.532 6.710 -12.558 1.00 0.00 O ATOM 204 CG2 THR A 16 -8.524 5.216 -14.168 1.00 0.00 C ATOM 0 H THR A 16 -8.367 8.252 -13.686 1.00 0.00 H new ATOM 0 HA THR A 16 -9.689 6.904 -15.917 1.00 0.00 H new ATOM 0 HB THR A 16 -10.617 5.589 -13.905 1.00 0.00 H new ATOM 0 HG1 THR A 16 -8.690 6.393 -12.170 1.00 0.00 H new ATOM 0 HG21 THR A 16 -8.484 4.431 -13.413 1.00 0.00 H new ATOM 0 HG22 THR A 16 -8.668 4.767 -15.151 1.00 0.00 H new ATOM 0 HG23 THR A 16 -7.589 5.776 -14.159 1.00 0.00 H new ATOM 212 N THR A 17 -11.298 9.261 -14.630 1.00 0.00 N ATOM 213 CA THR A 17 -12.565 9.961 -14.940 1.00 0.00 C ATOM 214 C THR A 17 -12.719 10.216 -16.465 1.00 0.00 C ATOM 215 O THR A 17 -13.798 10.563 -16.943 1.00 0.00 O ATOM 216 CB THR A 17 -12.576 11.277 -14.142 1.00 0.00 C ATOM 217 OG1 THR A 17 -12.463 10.986 -12.755 1.00 0.00 O ATOM 218 CG2 THR A 17 -13.860 12.084 -14.349 1.00 0.00 C ATOM 0 H THR A 17 -10.562 9.849 -14.239 1.00 0.00 H new ATOM 0 HA THR A 17 -13.415 9.342 -14.653 1.00 0.00 H new ATOM 0 HB THR A 17 -11.736 11.872 -14.501 1.00 0.00 H new ATOM 0 HG1 THR A 17 -11.536 10.748 -12.545 1.00 0.00 H new ATOM 0 HG21 THR A 17 -13.812 13.001 -13.762 1.00 0.00 H new ATOM 0 HG22 THR A 17 -13.967 12.334 -15.405 1.00 0.00 H new ATOM 0 HG23 THR A 17 -14.717 11.492 -14.028 1.00 0.00 H new ATOM 226 N THR A 18 -11.661 9.940 -17.224 1.00 0.00 N ATOM 227 CA THR A 18 -11.716 9.811 -18.687 1.00 0.00 C ATOM 228 C THR A 18 -11.454 8.316 -18.993 1.00 0.00 C ATOM 229 O THR A 18 -10.302 7.951 -19.232 1.00 0.00 O ATOM 230 CB THR A 18 -10.738 10.753 -19.395 1.00 0.00 C ATOM 231 OG1 THR A 18 -10.935 12.084 -18.936 1.00 0.00 O ATOM 232 CG2 THR A 18 -11.021 10.709 -20.895 1.00 0.00 C ATOM 0 H THR A 18 -10.727 9.797 -16.840 1.00 0.00 H new ATOM 0 HA THR A 18 -12.689 10.113 -19.073 1.00 0.00 H new ATOM 0 HB THR A 18 -9.714 10.442 -19.185 1.00 0.00 H new ATOM 0 HG1 THR A 18 -10.306 12.683 -19.390 1.00 0.00 H new ATOM 0 HG21 THR A 18 -10.332 11.375 -21.415 1.00 0.00 H new ATOM 0 HG22 THR A 18 -10.887 9.691 -21.261 1.00 0.00 H new ATOM 0 HG23 THR A 18 -12.046 11.029 -21.081 1.00 0.00 H new ATOM 240 N PRO A 19 -12.416 7.430 -18.690 1.00 0.00 N ATOM 241 CA PRO A 19 -12.172 6.000 -18.406 1.00 0.00 C ATOM 242 C PRO A 19 -11.711 5.122 -19.594 1.00 0.00 C ATOM 243 O PRO A 19 -12.265 4.050 -19.842 1.00 0.00 O ATOM 244 CB PRO A 19 -13.561 5.587 -17.893 1.00 0.00 C ATOM 245 CG PRO A 19 -14.560 6.482 -18.619 1.00 0.00 C ATOM 246 CD PRO A 19 -13.828 7.811 -18.760 1.00 0.00 C ATOM 0 HA PRO A 19 -11.333 5.857 -17.725 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -13.757 4.535 -18.101 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -13.633 5.718 -16.813 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -14.832 6.071 -19.591 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -15.483 6.593 -18.051 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -14.065 8.302 -19.704 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -14.097 8.504 -17.963 1.00 0.00 H new ATOM 254 N GLU A 20 -10.651 5.518 -20.294 1.00 0.00 N ATOM 255 CA GLU A 20 -9.959 4.601 -21.211 1.00 0.00 C ATOM 256 C GLU A 20 -9.112 3.553 -20.473 1.00 0.00 C ATOM 257 O GLU A 20 -9.171 2.366 -20.789 1.00 0.00 O ATOM 258 CB GLU A 20 -9.063 5.460 -22.106 1.00 0.00 C ATOM 259 CG GLU A 20 -8.429 4.699 -23.278 1.00 0.00 C ATOM 260 CD GLU A 20 -9.468 4.166 -24.258 1.00 0.00 C ATOM 261 OE1 GLU A 20 -9.947 4.946 -25.111 1.00 0.00 O ATOM 262 OE2 GLU A 20 -9.809 2.966 -24.183 1.00 0.00 O ATOM 0 H GLU A 20 -10.252 6.456 -20.249 1.00 0.00 H new ATOM 0 HA GLU A 20 -10.698 4.043 -21.787 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -9.651 6.289 -22.501 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -8.270 5.894 -21.497 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -7.741 5.359 -23.806 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -7.839 3.868 -22.891 1.00 0.00 H new ATOM 269 N LEU A 21 -8.294 4.000 -19.515 1.00 0.00 N ATOM 270 CA LEU A 21 -7.391 3.088 -18.792 1.00 0.00 C ATOM 271 C LEU A 21 -8.154 2.030 -17.976 1.00 0.00 C ATOM 272 O LEU A 21 -7.664 0.916 -17.788 1.00 0.00 O ATOM 273 CB LEU A 21 -6.476 3.878 -17.838 1.00 0.00 C ATOM 274 CG LEU A 21 -5.351 4.677 -18.518 1.00 0.00 C ATOM 275 CD1 LEU A 21 -5.860 5.919 -19.254 1.00 0.00 C ATOM 276 CD2 LEU A 21 -4.339 5.118 -17.458 1.00 0.00 C ATOM 0 H LEU A 21 -8.235 4.975 -19.222 1.00 0.00 H new ATOM 0 HA LEU A 21 -6.799 2.576 -19.551 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -7.091 4.568 -17.260 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -6.028 3.181 -17.131 1.00 0.00 H new ATOM 0 HG LEU A 21 -4.895 4.020 -19.259 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -5.020 6.440 -19.713 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -6.567 5.619 -20.028 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -6.356 6.583 -18.547 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.538 5.685 -17.933 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.837 5.744 -16.718 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -3.920 4.240 -16.968 1.00 0.00 H new ATOM 288 N VAL A 22 -9.352 2.371 -17.498 1.00 0.00 N ATOM 289 CA VAL A 22 -10.183 1.379 -16.784 1.00 0.00 C ATOM 290 C VAL A 22 -10.680 0.280 -17.740 1.00 0.00 C ATOM 291 O VAL A 22 -10.563 -0.907 -17.436 1.00 0.00 O ATOM 292 CB VAL A 22 -11.282 2.107 -15.980 1.00 0.00 C ATOM 293 CG1 VAL A 22 -12.467 2.566 -16.830 1.00 0.00 C ATOM 294 CG2 VAL A 22 -11.802 1.217 -14.847 1.00 0.00 C ATOM 0 H VAL A 22 -9.767 3.299 -17.584 1.00 0.00 H new ATOM 0 HA VAL A 22 -9.587 0.839 -16.048 1.00 0.00 H new ATOM 0 HB VAL A 22 -10.803 3.001 -15.580 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.197 3.069 -16.195 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -12.118 3.256 -17.598 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -12.932 1.701 -17.303 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -12.576 1.748 -14.293 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -12.220 0.302 -15.266 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -10.981 0.967 -14.175 1.00 0.00 H new ATOM 304 N GLU A 23 -11.176 0.647 -18.918 1.00 0.00 N ATOM 305 CA GLU A 23 -11.591 -0.343 -19.910 1.00 0.00 C ATOM 306 C GLU A 23 -10.446 -1.236 -20.416 1.00 0.00 C ATOM 307 O GLU A 23 -10.655 -2.414 -20.698 1.00 0.00 O ATOM 308 CB GLU A 23 -12.181 0.490 -21.052 1.00 0.00 C ATOM 309 CG GLU A 23 -13.045 -0.368 -21.962 1.00 0.00 C ATOM 310 CD GLU A 23 -13.604 0.436 -23.129 1.00 0.00 C ATOM 311 OE1 GLU A 23 -12.912 0.556 -24.164 1.00 0.00 O ATOM 312 OE2 GLU A 23 -14.737 0.954 -23.017 1.00 0.00 O ATOM 0 H GLU A 23 -11.300 1.617 -19.209 1.00 0.00 H new ATOM 0 HA GLU A 23 -12.299 -1.048 -19.474 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -12.777 1.306 -20.642 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -11.376 0.943 -21.630 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -12.456 -1.202 -22.343 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -13.867 -0.795 -21.387 1.00 0.00 H new ATOM 319 N ASN A 24 -9.246 -0.679 -20.534 1.00 0.00 N ATOM 320 CA ASN A 24 -8.082 -1.440 -21.009 1.00 0.00 C ATOM 321 C ASN A 24 -7.574 -2.460 -19.994 1.00 0.00 C ATOM 322 O ASN A 24 -7.329 -3.613 -20.341 1.00 0.00 O ATOM 323 CB ASN A 24 -6.968 -0.429 -21.263 1.00 0.00 C ATOM 324 CG ASN A 24 -6.112 -0.770 -22.479 1.00 0.00 C ATOM 325 OD1 ASN A 24 -5.238 -1.634 -22.432 1.00 0.00 O ATOM 326 ND2 ASN A 24 -6.353 -0.094 -23.590 1.00 0.00 N ATOM 0 H ASN A 24 -9.047 0.296 -20.309 1.00 0.00 H new ATOM 0 HA ASN A 24 -8.376 -1.995 -21.900 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -7.407 0.559 -21.402 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -6.329 -0.373 -20.381 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -5.809 -0.285 -24.431 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -7.083 0.618 -23.605 1.00 0.00 H new ATOM 333 N THR A 25 -7.400 -2.037 -18.740 1.00 0.00 N ATOM 334 CA THR A 25 -6.979 -2.993 -17.696 1.00 0.00 C ATOM 335 C THR A 25 -8.017 -4.118 -17.534 1.00 0.00 C ATOM 336 O THR A 25 -7.658 -5.296 -17.435 1.00 0.00 O ATOM 337 CB THR A 25 -6.617 -2.300 -16.367 1.00 0.00 C ATOM 338 OG1 THR A 25 -5.903 -3.224 -15.557 1.00 0.00 O ATOM 339 CG2 THR A 25 -7.811 -1.786 -15.558 1.00 0.00 C ATOM 0 H THR A 25 -7.536 -1.077 -18.423 1.00 0.00 H new ATOM 0 HA THR A 25 -6.052 -3.461 -18.029 1.00 0.00 H new ATOM 0 HB THR A 25 -6.029 -1.423 -16.638 1.00 0.00 H new ATOM 0 HG1 THR A 25 -5.664 -2.798 -14.708 1.00 0.00 H new ATOM 0 HG21 THR A 25 -7.454 -1.315 -14.642 1.00 0.00 H new ATOM 0 HG22 THR A 25 -8.364 -1.056 -16.149 1.00 0.00 H new ATOM 0 HG23 THR A 25 -8.466 -2.620 -15.306 1.00 0.00 H new ATOM 347 N LYS A 26 -9.306 -3.771 -17.575 1.00 0.00 N ATOM 348 CA LYS A 26 -10.351 -4.793 -17.578 1.00 0.00 C ATOM 349 C LYS A 26 -10.358 -5.613 -18.881 1.00 0.00 C ATOM 350 O LYS A 26 -10.674 -6.800 -18.833 1.00 0.00 O ATOM 351 CB LYS A 26 -11.697 -4.100 -17.344 1.00 0.00 C ATOM 352 CG LYS A 26 -11.721 -3.311 -16.025 1.00 0.00 C ATOM 353 CD LYS A 26 -13.045 -2.572 -15.855 1.00 0.00 C ATOM 354 CE LYS A 26 -13.262 -2.078 -14.421 1.00 0.00 C ATOM 355 NZ LYS A 26 -13.510 -3.200 -13.501 1.00 0.00 N ATOM 0 H LYS A 26 -9.645 -2.809 -17.606 1.00 0.00 H new ATOM 0 HA LYS A 26 -10.157 -5.508 -16.779 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -11.905 -3.424 -18.174 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -12.491 -4.846 -17.334 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -11.570 -3.992 -15.187 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -10.897 -2.597 -16.009 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -13.073 -1.722 -16.537 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -13.865 -3.233 -16.136 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -12.386 -1.520 -14.090 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -14.107 -1.390 -14.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -13.899 -2.837 -12.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -14.189 -3.859 -13.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -12.617 -3.698 -13.312 1.00 0.00 H new ATOM 369 N ALA A 27 -10.014 -5.032 -20.039 1.00 0.00 N ATOM 370 CA ALA A 27 -9.940 -5.837 -21.275 1.00 0.00 C ATOM 371 C ALA A 27 -8.775 -6.840 -21.294 1.00 0.00 C ATOM 372 O ALA A 27 -8.946 -7.992 -21.695 1.00 0.00 O ATOM 373 CB ALA A 27 -9.871 -4.909 -22.490 1.00 0.00 C ATOM 0 H ALA A 27 -9.789 -4.043 -20.150 1.00 0.00 H new ATOM 0 HA ALA A 27 -10.848 -6.439 -21.312 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -9.816 -5.505 -23.401 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -10.762 -4.282 -22.520 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -8.985 -4.278 -22.416 1.00 0.00 H new ATOM 379 N GLN A 28 -7.597 -6.404 -20.851 1.00 0.00 N ATOM 380 CA GLN A 28 -6.443 -7.304 -20.694 1.00 0.00 C ATOM 381 C GLN A 28 -6.773 -8.505 -19.804 1.00 0.00 C ATOM 382 O GLN A 28 -6.609 -9.656 -20.213 1.00 0.00 O ATOM 383 CB GLN A 28 -5.334 -6.526 -19.983 1.00 0.00 C ATOM 384 CG GLN A 28 -4.649 -5.436 -20.821 1.00 0.00 C ATOM 385 CD GLN A 28 -3.982 -4.372 -19.943 1.00 0.00 C ATOM 386 OE1 GLN A 28 -3.834 -3.217 -20.341 1.00 0.00 O ATOM 387 NE2 GLN A 28 -3.595 -4.729 -18.727 1.00 0.00 N ATOM 0 H GLN A 28 -7.411 -5.435 -20.593 1.00 0.00 H new ATOM 0 HA GLN A 28 -6.154 -7.657 -21.684 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -5.754 -6.063 -19.090 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.575 -7.233 -19.648 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -3.901 -5.893 -21.468 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -5.385 -4.961 -21.470 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -3.725 -5.690 -18.412 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -3.167 -4.042 -18.106 1.00 0.00 H new ATOM 396 N ALA A 29 -7.248 -8.229 -18.587 1.00 0.00 N ATOM 397 CA ALA A 29 -7.673 -9.317 -17.691 1.00 0.00 C ATOM 398 C ALA A 29 -8.770 -10.191 -18.324 1.00 0.00 C ATOM 399 O ALA A 29 -8.701 -11.418 -18.268 1.00 0.00 O ATOM 400 CB ALA A 29 -8.137 -8.698 -16.371 1.00 0.00 C ATOM 0 H ALA A 29 -7.348 -7.289 -18.203 1.00 0.00 H new ATOM 0 HA ALA A 29 -6.830 -9.984 -17.509 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.457 -9.488 -15.691 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -7.314 -8.143 -15.921 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.971 -8.022 -16.559 1.00 0.00 H new ATOM 406 N ALA A 30 -9.788 -9.562 -18.914 1.00 0.00 N ATOM 407 CA ALA A 30 -10.986 -10.302 -19.355 1.00 0.00 C ATOM 408 C ALA A 30 -10.678 -11.335 -20.446 1.00 0.00 C ATOM 409 O ALA A 30 -11.109 -12.484 -20.343 1.00 0.00 O ATOM 410 CB ALA A 30 -12.055 -9.319 -19.839 1.00 0.00 C ATOM 0 H ALA A 30 -9.814 -8.559 -19.098 1.00 0.00 H new ATOM 0 HA ALA A 30 -11.358 -10.858 -18.494 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -12.937 -9.871 -20.163 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -12.327 -8.647 -19.025 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -11.664 -8.738 -20.674 1.00 0.00 H new ATOM 416 N SER A 31 -9.974 -10.943 -21.510 1.00 0.00 N ATOM 417 CA SER A 31 -9.829 -11.833 -22.674 1.00 0.00 C ATOM 418 C SER A 31 -8.936 -13.056 -22.377 1.00 0.00 C ATOM 419 O SER A 31 -9.049 -14.086 -23.045 1.00 0.00 O ATOM 420 CB SER A 31 -9.253 -11.015 -23.835 1.00 0.00 C ATOM 421 OG SER A 31 -9.198 -11.806 -25.015 1.00 0.00 O ATOM 0 H SER A 31 -9.505 -10.041 -21.595 1.00 0.00 H new ATOM 0 HA SER A 31 -10.811 -12.229 -22.933 1.00 0.00 H new ATOM 0 HB2 SER A 31 -9.869 -10.133 -24.009 1.00 0.00 H new ATOM 0 HB3 SER A 31 -8.254 -10.661 -23.579 1.00 0.00 H new ATOM 0 HG SER A 31 -8.830 -11.272 -25.750 1.00 0.00 H new ATOM 427 N LYS A 32 -8.097 -12.974 -21.346 1.00 0.00 N ATOM 428 CA LYS A 32 -7.368 -14.143 -20.852 1.00 0.00 C ATOM 429 C LYS A 32 -8.244 -14.905 -19.850 1.00 0.00 C ATOM 430 O LYS A 32 -9.147 -15.652 -20.228 1.00 0.00 O ATOM 431 CB LYS A 32 -6.024 -13.650 -20.284 1.00 0.00 C ATOM 432 CG LYS A 32 -5.097 -13.069 -21.358 1.00 0.00 C ATOM 433 CD LYS A 32 -3.768 -12.605 -20.757 1.00 0.00 C ATOM 434 CE LYS A 32 -2.856 -12.006 -21.828 1.00 0.00 C ATOM 435 NZ LYS A 32 -1.585 -11.569 -21.231 1.00 0.00 N ATOM 0 H LYS A 32 -7.905 -12.112 -20.836 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.141 -14.860 -21.641 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -6.213 -12.890 -19.525 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -5.520 -14.479 -19.787 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -4.909 -13.821 -22.124 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -5.589 -12.230 -21.850 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -3.956 -11.864 -19.980 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -3.268 -13.448 -20.280 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -2.665 -12.744 -22.607 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -3.351 -11.160 -22.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -0.975 -11.164 -21.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -1.772 -10.849 -20.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -1.107 -12.384 -20.796 1.00 0.00 H new ATOM 449 N LYS A 33 -7.942 -14.737 -18.574 1.00 0.00 N ATOM 450 CA LYS A 33 -8.553 -15.573 -17.524 1.00 0.00 C ATOM 451 C LYS A 33 -8.545 -14.938 -16.123 1.00 0.00 C ATOM 452 O LYS A 33 -8.994 -15.543 -15.149 1.00 0.00 O ATOM 453 CB LYS A 33 -7.763 -16.886 -17.466 1.00 0.00 C ATOM 454 CG LYS A 33 -8.622 -18.089 -17.073 1.00 0.00 C ATOM 455 CD LYS A 33 -9.667 -18.382 -18.154 1.00 0.00 C ATOM 456 CE LYS A 33 -10.503 -19.617 -17.811 1.00 0.00 C ATOM 457 NZ LYS A 33 -11.488 -19.877 -18.870 1.00 0.00 N ATOM 0 H LYS A 33 -7.284 -14.038 -18.230 1.00 0.00 H new ATOM 0 HA LYS A 33 -9.601 -15.711 -17.789 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -7.310 -17.073 -18.440 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.948 -16.781 -16.750 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -7.988 -18.963 -16.926 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -9.119 -17.893 -16.123 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -10.323 -17.519 -18.270 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -9.168 -18.534 -19.111 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -9.852 -20.483 -17.690 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -11.013 -19.466 -16.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -12.048 -20.718 -18.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -12.119 -19.056 -18.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -10.994 -20.041 -19.771 1.00 0.00 H new ATOM 471 N VAL A 34 -8.091 -13.699 -16.032 1.00 0.00 N ATOM 472 CA VAL A 34 -8.222 -12.917 -14.791 1.00 0.00 C ATOM 473 C VAL A 34 -9.421 -11.958 -14.855 1.00 0.00 C ATOM 474 O VAL A 34 -9.722 -11.371 -15.891 1.00 0.00 O ATOM 475 CB VAL A 34 -6.932 -12.089 -14.566 1.00 0.00 C ATOM 476 CG1 VAL A 34 -6.887 -11.503 -13.151 1.00 0.00 C ATOM 477 CG2 VAL A 34 -5.641 -12.889 -14.778 1.00 0.00 C ATOM 0 H VAL A 34 -7.628 -13.205 -16.795 1.00 0.00 H new ATOM 0 HA VAL A 34 -8.379 -13.615 -13.969 1.00 0.00 H new ATOM 0 HB VAL A 34 -6.977 -11.299 -15.316 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -5.970 -10.928 -13.024 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -7.748 -10.852 -12.999 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -6.911 -12.312 -12.421 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -4.780 -12.244 -14.603 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -5.614 -13.727 -14.082 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -5.610 -13.266 -15.800 1.00 0.00 H new ATOM 487 N LYS A 35 -9.998 -11.671 -13.695 1.00 0.00 N ATOM 488 CA LYS A 35 -10.856 -10.483 -13.561 1.00 0.00 C ATOM 489 C LYS A 35 -10.336 -9.719 -12.348 1.00 0.00 C ATOM 490 O LYS A 35 -10.111 -10.285 -11.277 1.00 0.00 O ATOM 491 CB LYS A 35 -12.331 -10.869 -13.409 1.00 0.00 C ATOM 492 CG LYS A 35 -13.348 -9.724 -13.329 1.00 0.00 C ATOM 493 CD LYS A 35 -14.774 -10.277 -13.240 1.00 0.00 C ATOM 494 CE LYS A 35 -15.797 -9.145 -13.144 1.00 0.00 C ATOM 495 NZ LYS A 35 -17.160 -9.694 -13.059 1.00 0.00 N ATOM 0 H LYS A 35 -9.896 -12.226 -12.845 1.00 0.00 H new ATOM 0 HA LYS A 35 -10.813 -9.862 -14.455 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -12.603 -11.505 -14.252 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -12.431 -11.474 -12.508 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -13.138 -9.103 -12.458 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -13.254 -9.084 -14.207 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -14.985 -10.889 -14.117 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -14.862 -10.926 -12.369 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -15.589 -8.532 -12.267 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -15.713 -8.495 -14.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -17.845 -8.914 -12.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -17.360 -10.261 -13.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -17.240 -10.296 -12.215 1.00 0.00 H new ATOM 509 N PHE A 36 -10.214 -8.410 -12.509 1.00 0.00 N ATOM 510 CA PHE A 36 -10.002 -7.559 -11.326 1.00 0.00 C ATOM 511 C PHE A 36 -11.379 -7.169 -10.801 1.00 0.00 C ATOM 512 O PHE A 36 -12.310 -6.900 -11.563 1.00 0.00 O ATOM 513 CB PHE A 36 -9.142 -6.307 -11.578 1.00 0.00 C ATOM 514 CG PHE A 36 -7.777 -6.583 -12.203 1.00 0.00 C ATOM 515 CD1 PHE A 36 -6.767 -7.135 -11.470 1.00 0.00 C ATOM 516 CD2 PHE A 36 -7.548 -6.239 -13.502 1.00 0.00 C ATOM 517 CE1 PHE A 36 -5.567 -7.393 -12.050 1.00 0.00 C ATOM 518 CE2 PHE A 36 -6.347 -6.497 -14.078 1.00 0.00 C ATOM 519 CZ PHE A 36 -5.366 -7.096 -13.360 1.00 0.00 C ATOM 0 H PHE A 36 -10.254 -7.920 -13.403 1.00 0.00 H new ATOM 0 HA PHE A 36 -9.430 -8.134 -10.597 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -9.694 -5.629 -12.230 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -8.994 -5.788 -10.631 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -6.923 -7.367 -10.427 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -8.327 -5.759 -14.076 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -4.771 -7.835 -11.469 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -6.173 -6.225 -15.109 1.00 0.00 H new ATOM 0 HZ PHE A 36 -4.424 -7.337 -13.830 1.00 0.00 H new ATOM 529 N VAL A 37 -11.512 -7.173 -9.480 1.00 0.00 N ATOM 530 CA VAL A 37 -12.865 -7.180 -8.894 1.00 0.00 C ATOM 531 C VAL A 37 -12.993 -6.356 -7.604 1.00 0.00 C ATOM 532 O VAL A 37 -14.098 -6.052 -7.152 1.00 0.00 O ATOM 533 CB VAL A 37 -13.263 -8.655 -8.698 1.00 0.00 C ATOM 534 CG1 VAL A 37 -12.604 -9.331 -7.494 1.00 0.00 C ATOM 535 CG2 VAL A 37 -14.770 -8.806 -8.569 1.00 0.00 C ATOM 0 H VAL A 37 -10.742 -7.172 -8.811 1.00 0.00 H new ATOM 0 HA VAL A 37 -13.554 -6.682 -9.576 1.00 0.00 H new ATOM 0 HB VAL A 37 -12.899 -9.157 -9.595 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -12.939 -10.366 -7.430 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -11.521 -9.307 -7.611 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -12.883 -8.802 -6.582 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -15.020 -9.858 -8.432 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -15.121 -8.235 -7.710 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -15.252 -8.434 -9.473 1.00 0.00 H new ATOM 545 N ASP A 38 -11.859 -6.003 -7.017 1.00 0.00 N ATOM 546 CA ASP A 38 -11.851 -5.348 -5.703 1.00 0.00 C ATOM 547 C ASP A 38 -11.145 -4.000 -5.858 1.00 0.00 C ATOM 548 O ASP A 38 -10.011 -3.920 -6.331 1.00 0.00 O ATOM 549 CB ASP A 38 -11.191 -6.207 -4.617 1.00 0.00 C ATOM 550 CG ASP A 38 -11.715 -7.637 -4.561 1.00 0.00 C ATOM 551 OD1 ASP A 38 -12.858 -7.850 -4.101 1.00 0.00 O ATOM 552 OD2 ASP A 38 -10.988 -8.557 -4.993 1.00 0.00 O ATOM 0 H ASP A 38 -10.935 -6.155 -7.421 1.00 0.00 H new ATOM 0 HA ASP A 38 -12.878 -5.203 -5.369 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -10.115 -6.231 -4.790 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -11.348 -5.734 -3.648 1.00 0.00 H new ATOM 557 N GLN A 39 -11.863 -2.926 -5.549 1.00 0.00 N ATOM 558 CA GLN A 39 -11.439 -1.588 -6.000 1.00 0.00 C ATOM 559 C GLN A 39 -11.085 -0.756 -4.781 1.00 0.00 C ATOM 560 O GLN A 39 -11.877 -0.623 -3.848 1.00 0.00 O ATOM 561 CB GLN A 39 -12.547 -0.841 -6.763 1.00 0.00 C ATOM 562 CG GLN A 39 -13.413 -1.779 -7.595 1.00 0.00 C ATOM 563 CD GLN A 39 -14.339 -1.028 -8.546 1.00 0.00 C ATOM 564 OE1 GLN A 39 -15.381 -0.506 -8.154 1.00 0.00 O ATOM 565 NE2 GLN A 39 -13.972 -0.965 -9.815 1.00 0.00 N ATOM 0 H GLN A 39 -12.723 -2.943 -5.001 1.00 0.00 H new ATOM 0 HA GLN A 39 -10.591 -1.726 -6.671 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -13.176 -0.305 -6.052 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -12.095 -0.094 -7.415 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -12.771 -2.447 -8.170 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -14.009 -2.404 -6.930 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -13.103 -1.406 -10.117 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -14.558 -0.476 -10.492 1.00 0.00 H new ATOM 574 N PHE A 40 -9.871 -0.220 -4.780 1.00 0.00 N ATOM 575 CA PHE A 40 -9.420 0.519 -3.590 1.00 0.00 C ATOM 576 C PHE A 40 -8.863 1.875 -4.036 1.00 0.00 C ATOM 577 O PHE A 40 -7.753 1.992 -4.553 1.00 0.00 O ATOM 578 CB PHE A 40 -8.446 -0.341 -2.774 1.00 0.00 C ATOM 579 CG PHE A 40 -9.135 -1.442 -1.979 1.00 0.00 C ATOM 580 CD1 PHE A 40 -9.450 -2.619 -2.583 1.00 0.00 C ATOM 581 CD2 PHE A 40 -9.415 -1.274 -0.659 1.00 0.00 C ATOM 582 CE1 PHE A 40 -10.034 -3.618 -1.874 1.00 0.00 C ATOM 583 CE2 PHE A 40 -9.991 -2.275 0.052 1.00 0.00 C ATOM 584 CZ PHE A 40 -10.304 -3.447 -0.553 1.00 0.00 C ATOM 0 H PHE A 40 -9.202 -0.273 -5.548 1.00 0.00 H new ATOM 0 HA PHE A 40 -10.246 0.731 -2.912 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -7.717 -0.791 -3.448 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -7.892 0.301 -2.088 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -9.234 -2.759 -3.632 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -9.177 -0.339 -0.174 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -10.284 -4.550 -2.360 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -10.201 -2.138 1.103 1.00 0.00 H new ATOM 0 HZ PHE A 40 -10.766 -4.242 0.013 1.00 0.00 H new ATOM 594 N LEU A 41 -9.678 2.908 -3.844 1.00 0.00 N ATOM 595 CA LEU A 41 -9.332 4.253 -4.336 1.00 0.00 C ATOM 596 C LEU A 41 -8.453 4.954 -3.298 1.00 0.00 C ATOM 597 O LEU A 41 -8.560 4.713 -2.097 1.00 0.00 O ATOM 598 CB LEU A 41 -10.688 4.940 -4.580 1.00 0.00 C ATOM 599 CG LEU A 41 -10.701 6.247 -5.385 1.00 0.00 C ATOM 600 CD1 LEU A 41 -12.105 6.436 -5.969 1.00 0.00 C ATOM 601 CD2 LEU A 41 -10.375 7.476 -4.530 1.00 0.00 C ATOM 0 H LEU A 41 -10.573 2.850 -3.359 1.00 0.00 H new ATOM 0 HA LEU A 41 -8.748 4.262 -5.257 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.336 4.227 -5.090 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -11.139 5.142 -3.609 1.00 0.00 H new ATOM 0 HG LEU A 41 -9.936 6.166 -6.157 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -12.138 7.360 -6.546 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -12.345 5.594 -6.618 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -12.832 6.488 -5.159 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -10.399 8.370 -5.153 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -11.112 7.570 -3.732 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -9.382 7.364 -4.095 1.00 0.00 H new ATOM 613 N ILE A 42 -7.569 5.824 -3.770 1.00 0.00 N ATOM 614 CA ILE A 42 -6.556 6.429 -2.888 1.00 0.00 C ATOM 615 C ILE A 42 -7.116 7.312 -1.753 1.00 0.00 C ATOM 616 O ILE A 42 -6.646 7.221 -0.618 1.00 0.00 O ATOM 617 CB ILE A 42 -5.503 7.100 -3.803 1.00 0.00 C ATOM 618 CG1 ILE A 42 -4.263 7.591 -3.058 1.00 0.00 C ATOM 619 CG2 ILE A 42 -6.026 8.300 -4.604 1.00 0.00 C ATOM 620 CD1 ILE A 42 -3.703 6.554 -2.086 1.00 0.00 C ATOM 0 H ILE A 42 -7.525 6.129 -4.742 1.00 0.00 H new ATOM 0 HA ILE A 42 -6.073 5.653 -2.295 1.00 0.00 H new ATOM 0 HB ILE A 42 -5.248 6.285 -4.480 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -3.492 7.857 -3.782 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -4.511 8.499 -2.509 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -5.222 8.707 -5.217 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -6.845 7.979 -5.247 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -6.383 9.068 -3.918 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.823 6.961 -1.587 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -4.460 6.306 -1.342 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -3.425 5.654 -2.634 1.00 0.00 H new ATOM 632 N ASN A 43 -8.145 8.117 -2.011 1.00 0.00 N ATOM 633 CA ASN A 43 -8.723 8.939 -0.934 1.00 0.00 C ATOM 634 C ASN A 43 -9.712 8.154 -0.050 1.00 0.00 C ATOM 635 O ASN A 43 -9.809 8.421 1.148 1.00 0.00 O ATOM 636 CB ASN A 43 -9.405 10.158 -1.576 1.00 0.00 C ATOM 637 CG ASN A 43 -9.874 11.186 -0.548 1.00 0.00 C ATOM 638 OD1 ASN A 43 -11.010 11.156 -0.075 1.00 0.00 O ATOM 639 ND2 ASN A 43 -9.003 12.115 -0.188 1.00 0.00 N ATOM 0 H ASN A 43 -8.589 8.221 -2.924 1.00 0.00 H new ATOM 0 HA ASN A 43 -7.921 9.257 -0.268 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -8.710 10.634 -2.268 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -10.260 9.822 -2.163 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -9.268 12.825 0.494 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -8.067 12.121 -0.593 1.00 0.00 H new ATOM 646 N LYS A 44 -10.408 7.158 -0.599 1.00 0.00 N ATOM 647 CA LYS A 44 -11.319 6.339 0.212 1.00 0.00 C ATOM 648 C LYS A 44 -10.576 5.309 1.074 1.00 0.00 C ATOM 649 O LYS A 44 -11.048 4.971 2.161 1.00 0.00 O ATOM 650 CB LYS A 44 -12.301 5.624 -0.723 1.00 0.00 C ATOM 651 CG LYS A 44 -13.249 6.591 -1.443 1.00 0.00 C ATOM 652 CD LYS A 44 -14.230 5.837 -2.345 1.00 0.00 C ATOM 653 CE LYS A 44 -15.166 6.807 -3.069 1.00 0.00 C ATOM 654 NZ LYS A 44 -16.094 6.067 -3.940 1.00 0.00 N ATOM 0 H LYS A 44 -10.363 6.899 -1.585 1.00 0.00 H new ATOM 0 HA LYS A 44 -11.848 7.001 0.897 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -11.740 5.054 -1.464 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.888 4.909 -0.147 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -13.803 7.176 -0.708 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -12.670 7.295 -2.040 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -13.677 5.246 -3.075 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -14.816 5.139 -1.747 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -15.728 7.392 -2.341 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.583 7.511 -3.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -16.724 6.737 -4.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -15.553 5.528 -4.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -16.662 5.412 -3.365 1.00 0.00 H new ATOM 668 N LEU A 45 -9.424 4.804 0.626 1.00 0.00 N ATOM 669 CA LEU A 45 -8.662 3.855 1.453 1.00 0.00 C ATOM 670 C LEU A 45 -8.007 4.535 2.670 1.00 0.00 C ATOM 671 O LEU A 45 -8.001 3.985 3.771 1.00 0.00 O ATOM 672 CB LEU A 45 -7.519 3.234 0.628 1.00 0.00 C ATOM 673 CG LEU A 45 -7.606 1.712 0.504 1.00 0.00 C ATOM 674 CD1 LEU A 45 -6.381 1.214 -0.262 1.00 0.00 C ATOM 675 CD2 LEU A 45 -7.673 0.993 1.856 1.00 0.00 C ATOM 0 H LEU A 45 -9.005 5.025 -0.277 1.00 0.00 H new ATOM 0 HA LEU A 45 -9.376 3.104 1.791 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -7.524 3.672 -0.370 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.566 3.498 1.087 1.00 0.00 H new ATOM 0 HG LEU A 45 -8.533 1.484 -0.022 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.429 0.129 -0.359 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -6.363 1.666 -1.254 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -5.476 1.491 0.279 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -7.733 -0.083 1.693 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -6.779 1.223 2.435 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -8.555 1.327 2.402 1.00 0.00 H new ATOM 687 N ASN A 46 -7.468 5.738 2.470 1.00 0.00 N ATOM 688 CA ASN A 46 -6.815 6.469 3.568 1.00 0.00 C ATOM 689 C ASN A 46 -7.817 7.165 4.507 1.00 0.00 C ATOM 690 O ASN A 46 -7.506 7.449 5.666 1.00 0.00 O ATOM 691 CB ASN A 46 -5.851 7.467 2.917 1.00 0.00 C ATOM 692 CG ASN A 46 -4.848 8.064 3.903 1.00 0.00 C ATOM 693 OD1 ASN A 46 -3.938 7.389 4.382 1.00 0.00 O ATOM 694 ND2 ASN A 46 -4.998 9.338 4.214 1.00 0.00 N ATOM 0 H ASN A 46 -7.467 6.225 1.574 1.00 0.00 H new ATOM 0 HA ASN A 46 -6.280 5.772 4.213 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.309 6.968 2.114 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -6.426 8.273 2.460 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -4.351 9.784 4.865 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -5.761 9.877 3.804 1.00 0.00 H new ATOM 701 N ASP A 47 -9.033 7.393 4.021 1.00 0.00 N ATOM 702 CA ASP A 47 -10.128 7.850 4.888 1.00 0.00 C ATOM 703 C ASP A 47 -10.748 6.684 5.682 1.00 0.00 C ATOM 704 O ASP A 47 -11.205 6.891 6.807 1.00 0.00 O ATOM 705 CB ASP A 47 -11.207 8.540 4.036 1.00 0.00 C ATOM 706 CG ASP A 47 -10.826 9.952 3.591 1.00 0.00 C ATOM 707 OD1 ASP A 47 -9.629 10.224 3.354 1.00 0.00 O ATOM 708 OD2 ASP A 47 -11.736 10.803 3.474 1.00 0.00 O ATOM 0 H ASP A 47 -9.290 7.272 3.041 1.00 0.00 H new ATOM 0 HA ASP A 47 -9.718 8.559 5.607 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -11.406 7.931 3.154 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -12.134 8.586 4.607 1.00 0.00 H new ATOM 713 N GLY A 48 -10.748 5.464 5.139 1.00 0.00 N ATOM 714 CA GLY A 48 -11.143 4.293 5.937 1.00 0.00 C ATOM 715 C GLY A 48 -12.476 3.639 5.547 1.00 0.00 C ATOM 716 O GLY A 48 -13.023 2.859 6.327 1.00 0.00 O ATOM 0 H GLY A 48 -10.486 5.260 4.175 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -10.356 3.543 5.861 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -11.199 4.592 6.984 1.00 0.00 H new ATOM 720 N SER A 49 -13.020 3.949 4.372 1.00 0.00 N ATOM 721 CA SER A 49 -14.338 3.417 3.992 1.00 0.00 C ATOM 722 C SER A 49 -14.320 1.955 3.504 1.00 0.00 C ATOM 723 O SER A 49 -15.290 1.228 3.721 1.00 0.00 O ATOM 724 CB SER A 49 -14.919 4.330 2.907 1.00 0.00 C ATOM 725 OG SER A 49 -16.243 3.931 2.578 1.00 0.00 O ATOM 0 H SER A 49 -12.584 4.553 3.675 1.00 0.00 H new ATOM 0 HA SER A 49 -14.957 3.407 4.889 1.00 0.00 H new ATOM 0 HB2 SER A 49 -14.920 5.363 3.255 1.00 0.00 H new ATOM 0 HB3 SER A 49 -14.290 4.294 2.017 1.00 0.00 H new ATOM 0 HG SER A 49 -16.601 4.524 1.885 1.00 0.00 H new ATOM 731 N ILE A 50 -13.260 1.528 2.818 1.00 0.00 N ATOM 732 CA ILE A 50 -13.297 0.241 2.100 1.00 0.00 C ATOM 733 C ILE A 50 -12.289 -0.714 2.739 1.00 0.00 C ATOM 734 O ILE A 50 -11.083 -0.469 2.752 1.00 0.00 O ATOM 735 CB ILE A 50 -12.936 0.406 0.610 1.00 0.00 C ATOM 736 CG1 ILE A 50 -13.729 1.531 -0.062 1.00 0.00 C ATOM 737 CG2 ILE A 50 -13.126 -0.894 -0.196 1.00 0.00 C ATOM 738 CD1 ILE A 50 -12.984 1.969 -1.312 1.00 0.00 C ATOM 0 H ILE A 50 -12.380 2.037 2.741 1.00 0.00 H new ATOM 0 HA ILE A 50 -14.312 -0.151 2.168 1.00 0.00 H new ATOM 0 HB ILE A 50 -11.878 0.667 0.604 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -14.730 1.186 -0.320 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -13.847 2.371 0.622 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -12.857 -0.719 -1.238 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -12.488 -1.675 0.217 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -14.168 -1.209 -0.138 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -13.536 2.770 -1.803 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -11.992 2.327 -1.037 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -12.889 1.124 -1.994 1.00 0.00 H new ATOM 750 N THR A 51 -12.804 -1.834 3.223 1.00 0.00 N ATOM 751 CA THR A 51 -11.929 -2.998 3.423 1.00 0.00 C ATOM 752 C THR A 51 -12.650 -4.219 2.832 1.00 0.00 C ATOM 753 O THR A 51 -13.878 -4.257 2.737 1.00 0.00 O ATOM 754 CB THR A 51 -11.689 -3.128 4.940 1.00 0.00 C ATOM 755 OG1 THR A 51 -11.034 -1.958 5.412 1.00 0.00 O ATOM 756 CG2 THR A 51 -10.830 -4.331 5.325 1.00 0.00 C ATOM 0 H THR A 51 -13.782 -1.969 3.478 1.00 0.00 H new ATOM 0 HA THR A 51 -10.961 -2.905 2.930 1.00 0.00 H new ATOM 0 HB THR A 51 -12.671 -3.264 5.393 1.00 0.00 H new ATOM 0 HG1 THR A 51 -10.881 -2.036 6.377 1.00 0.00 H new ATOM 0 HG21 THR A 51 -10.704 -4.357 6.407 1.00 0.00 H new ATOM 0 HG22 THR A 51 -11.318 -5.248 4.994 1.00 0.00 H new ATOM 0 HG23 THR A 51 -9.853 -4.248 4.848 1.00 0.00 H new ATOM 764 N LEU A 52 -11.887 -5.262 2.512 1.00 0.00 N ATOM 765 CA LEU A 52 -12.485 -6.547 2.121 1.00 0.00 C ATOM 766 C LEU A 52 -11.790 -7.674 2.921 1.00 0.00 C ATOM 767 O LEU A 52 -11.510 -7.515 4.110 1.00 0.00 O ATOM 768 CB LEU A 52 -12.467 -6.652 0.582 1.00 0.00 C ATOM 769 CG LEU A 52 -13.577 -5.819 -0.087 1.00 0.00 C ATOM 770 CD1 LEU A 52 -13.356 -5.782 -1.596 1.00 0.00 C ATOM 771 CD2 LEU A 52 -14.972 -6.387 0.195 1.00 0.00 C ATOM 0 H LEU A 52 -10.867 -5.249 2.514 1.00 0.00 H new ATOM 0 HA LEU A 52 -13.539 -6.641 2.382 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -11.497 -6.321 0.211 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -12.579 -7.697 0.292 1.00 0.00 H new ATOM 0 HG LEU A 52 -13.526 -4.814 0.333 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -14.143 -5.192 -2.065 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -12.387 -5.331 -1.811 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -13.379 -6.797 -1.992 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -15.723 -5.768 -0.296 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -15.034 -7.406 -0.188 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -15.152 -6.392 1.270 1.00 0.00 H new ATOM 783 N GLU A 53 -11.486 -8.805 2.283 1.00 0.00 N ATOM 784 CA GLU A 53 -10.772 -9.899 2.960 1.00 0.00 C ATOM 785 C GLU A 53 -9.274 -9.846 2.607 1.00 0.00 C ATOM 786 O GLU A 53 -8.805 -8.969 1.880 1.00 0.00 O ATOM 787 CB GLU A 53 -11.395 -11.238 2.525 1.00 0.00 C ATOM 788 CG GLU A 53 -12.844 -11.398 2.999 1.00 0.00 C ATOM 789 CD GLU A 53 -13.413 -12.746 2.576 1.00 0.00 C ATOM 790 OE1 GLU A 53 -13.986 -12.838 1.468 1.00 0.00 O ATOM 791 OE2 GLU A 53 -13.292 -13.721 3.348 1.00 0.00 O ATOM 0 H GLU A 53 -11.719 -8.991 1.307 1.00 0.00 H new ATOM 0 HA GLU A 53 -10.864 -9.797 4.041 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -11.362 -11.313 1.438 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -10.795 -12.058 2.920 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -12.887 -11.306 4.084 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -13.456 -10.596 2.586 1.00 0.00 H new ATOM 798 N ASN A 54 -8.509 -10.773 3.180 1.00 0.00 N ATOM 799 CA ASN A 54 -7.039 -10.694 3.110 1.00 0.00 C ATOM 800 C ASN A 54 -6.448 -11.933 2.415 1.00 0.00 C ATOM 801 O ASN A 54 -5.796 -12.757 3.060 1.00 0.00 O ATOM 802 CB ASN A 54 -6.531 -10.586 4.560 1.00 0.00 C ATOM 803 CG ASN A 54 -6.900 -9.264 5.233 1.00 0.00 C ATOM 804 OD1 ASN A 54 -7.812 -9.192 6.055 1.00 0.00 O ATOM 805 ND2 ASN A 54 -6.200 -8.199 4.889 1.00 0.00 N ATOM 0 H ASN A 54 -8.869 -11.578 3.692 1.00 0.00 H new ATOM 0 HA ASN A 54 -6.729 -9.830 2.522 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -6.941 -11.410 5.144 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -5.447 -10.699 4.567 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -6.411 -7.293 5.307 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -5.448 -8.282 4.205 1.00 0.00 H new ATOM 812 N ALA A 55 -6.693 -12.109 1.112 1.00 0.00 N ATOM 813 CA ALA A 55 -6.322 -13.397 0.481 1.00 0.00 C ATOM 814 C ALA A 55 -6.163 -13.457 -1.057 1.00 0.00 C ATOM 815 O ALA A 55 -5.051 -13.679 -1.539 1.00 0.00 O ATOM 816 CB ALA A 55 -7.303 -14.479 0.941 1.00 0.00 C ATOM 0 H ALA A 55 -7.123 -11.421 0.494 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.301 -13.558 0.828 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -7.037 -15.431 0.481 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.257 -14.575 2.026 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.315 -14.203 0.644 1.00 0.00 H new ATOM 822 N LYS A 56 -7.263 -13.512 -1.812 1.00 0.00 N ATOM 823 CA LYS A 56 -7.215 -14.059 -3.195 1.00 0.00 C ATOM 824 C LYS A 56 -6.760 -13.107 -4.303 1.00 0.00 C ATOM 825 O LYS A 56 -6.862 -13.416 -5.491 1.00 0.00 O ATOM 826 CB LYS A 56 -8.623 -14.521 -3.581 1.00 0.00 C ATOM 827 CG LYS A 56 -9.020 -15.817 -2.886 1.00 0.00 C ATOM 828 CD LYS A 56 -10.493 -16.122 -3.170 1.00 0.00 C ATOM 829 CE LYS A 56 -10.948 -17.394 -2.453 1.00 0.00 C ATOM 830 NZ LYS A 56 -12.366 -17.663 -2.741 1.00 0.00 N ATOM 0 H LYS A 56 -8.184 -13.195 -1.510 1.00 0.00 H new ATOM 0 HA LYS A 56 -6.465 -14.848 -3.141 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -9.341 -13.741 -3.327 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -8.673 -14.661 -4.661 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -8.394 -16.637 -3.238 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -8.857 -15.730 -1.812 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -11.109 -15.282 -2.849 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -10.642 -16.235 -4.244 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -10.338 -18.238 -2.774 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -10.802 -17.286 -1.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -12.662 -18.530 -2.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -12.945 -16.863 -2.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -12.495 -17.787 -3.766 1.00 0.00 H new ATOM 844 N TYR A 57 -6.301 -11.937 -3.921 1.00 0.00 N ATOM 845 CA TYR A 57 -6.087 -10.849 -4.886 1.00 0.00 C ATOM 846 C TYR A 57 -4.670 -10.849 -5.496 1.00 0.00 C ATOM 847 O TYR A 57 -4.179 -9.769 -5.828 1.00 0.00 O ATOM 848 CB TYR A 57 -6.388 -9.439 -4.361 1.00 0.00 C ATOM 849 CG TYR A 57 -7.481 -9.316 -3.305 1.00 0.00 C ATOM 850 CD1 TYR A 57 -8.701 -9.884 -3.507 1.00 0.00 C ATOM 851 CD2 TYR A 57 -7.253 -8.601 -2.170 1.00 0.00 C ATOM 852 CE1 TYR A 57 -9.676 -9.764 -2.568 1.00 0.00 C ATOM 853 CE2 TYR A 57 -8.234 -8.466 -1.240 1.00 0.00 C ATOM 854 CZ TYR A 57 -9.443 -9.054 -1.437 1.00 0.00 C ATOM 855 OH TYR A 57 -10.435 -8.915 -0.505 1.00 0.00 O ATOM 0 H TYR A 57 -6.066 -11.701 -2.957 1.00 0.00 H new ATOM 0 HA TYR A 57 -6.824 -11.077 -5.656 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -5.468 -9.027 -3.947 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -6.664 -8.813 -5.209 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -8.895 -10.432 -4.417 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -6.290 -8.140 -2.008 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -10.636 -10.234 -2.723 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -8.053 -7.891 -0.344 1.00 0.00 H new ATOM 0 HH TYR A 57 -10.036 -8.799 0.383 1.00 0.00 H new ATOM 865 N GLU A 58 -3.938 -11.973 -5.480 1.00 0.00 N ATOM 866 CA GLU A 58 -2.481 -11.973 -5.791 1.00 0.00 C ATOM 867 C GLU A 58 -2.074 -11.508 -7.217 1.00 0.00 C ATOM 868 O GLU A 58 -0.974 -11.788 -7.694 1.00 0.00 O ATOM 869 CB GLU A 58 -1.895 -13.374 -5.532 1.00 0.00 C ATOM 870 CG GLU A 58 -2.605 -14.503 -6.291 1.00 0.00 C ATOM 871 CD GLU A 58 -1.874 -15.828 -6.124 1.00 0.00 C ATOM 872 OE1 GLU A 58 -1.896 -16.398 -5.011 1.00 0.00 O ATOM 873 OE2 GLU A 58 -1.273 -16.312 -7.109 1.00 0.00 O ATOM 0 H GLU A 58 -4.318 -12.893 -5.258 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.066 -11.219 -5.123 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.841 -13.372 -5.810 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.943 -13.584 -4.463 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -3.628 -14.601 -5.927 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -2.666 -14.250 -7.349 1.00 0.00 H new ATOM 880 N THR A 59 -2.906 -10.671 -7.825 1.00 0.00 N ATOM 881 CA THR A 59 -2.497 -9.859 -8.980 1.00 0.00 C ATOM 882 C THR A 59 -2.988 -8.448 -8.702 1.00 0.00 C ATOM 883 O THR A 59 -4.181 -8.186 -8.560 1.00 0.00 O ATOM 884 CB THR A 59 -2.998 -10.394 -10.329 1.00 0.00 C ATOM 885 OG1 THR A 59 -2.594 -9.516 -11.372 1.00 0.00 O ATOM 886 CG2 THR A 59 -4.504 -10.624 -10.427 1.00 0.00 C ATOM 0 H THR A 59 -3.875 -10.532 -7.540 1.00 0.00 H new ATOM 0 HA THR A 59 -1.413 -9.891 -9.085 1.00 0.00 H new ATOM 0 HB THR A 59 -2.543 -11.380 -10.427 1.00 0.00 H new ATOM 0 HG1 THR A 59 -2.914 -9.861 -12.232 1.00 0.00 H new ATOM 0 HG21 THR A 59 -4.751 -11.002 -11.419 1.00 0.00 H new ATOM 0 HG22 THR A 59 -4.811 -11.351 -9.675 1.00 0.00 H new ATOM 0 HG23 THR A 59 -5.028 -9.683 -10.256 1.00 0.00 H new ATOM 894 N VAL A 60 -2.028 -7.554 -8.551 1.00 0.00 N ATOM 895 CA VAL A 60 -2.324 -6.228 -8.019 1.00 0.00 C ATOM 896 C VAL A 60 -1.990 -5.248 -9.148 1.00 0.00 C ATOM 897 O VAL A 60 -0.942 -5.339 -9.787 1.00 0.00 O ATOM 898 CB VAL A 60 -1.422 -6.107 -6.781 1.00 0.00 C ATOM 899 CG1 VAL A 60 -1.242 -4.670 -6.314 1.00 0.00 C ATOM 900 CG2 VAL A 60 -1.935 -6.939 -5.606 1.00 0.00 C ATOM 0 H VAL A 60 -1.048 -7.714 -8.784 1.00 0.00 H new ATOM 0 HA VAL A 60 -3.353 -6.034 -7.717 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.456 -6.493 -7.105 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.595 -4.651 -5.437 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -0.789 -4.082 -7.112 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -2.213 -4.246 -6.058 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -1.264 -6.820 -4.756 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -2.934 -6.601 -5.330 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.974 -7.990 -5.894 1.00 0.00 H new ATOM 910 N HIS A 61 -2.886 -4.298 -9.385 1.00 0.00 N ATOM 911 CA HIS A 61 -2.619 -3.235 -10.360 1.00 0.00 C ATOM 912 C HIS A 61 -2.746 -1.890 -9.629 1.00 0.00 C ATOM 913 O HIS A 61 -3.738 -1.685 -8.931 1.00 0.00 O ATOM 914 CB HIS A 61 -3.591 -3.430 -11.557 1.00 0.00 C ATOM 915 CG HIS A 61 -2.830 -4.036 -12.722 1.00 0.00 C ATOM 916 ND1 HIS A 61 -2.762 -5.400 -12.973 1.00 0.00 N ATOM 917 CD2 HIS A 61 -1.848 -3.357 -13.442 1.00 0.00 C ATOM 918 CE1 HIS A 61 -1.730 -5.399 -13.879 1.00 0.00 C ATOM 919 NE2 HIS A 61 -1.156 -4.222 -14.261 1.00 0.00 N ATOM 0 H HIS A 61 -3.794 -4.237 -8.925 1.00 0.00 H new ATOM 0 HA HIS A 61 -1.613 -3.264 -10.779 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -4.417 -4.080 -11.269 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -4.025 -2.474 -11.848 1.00 0.00 H new ATOM 0 HD1 HIS A 61 -3.313 -6.171 -12.597 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -1.656 -2.297 -13.368 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -1.372 -6.332 -14.290 1.00 0.00 H new ATOM 927 N TYR A 62 -1.823 -0.934 -9.812 1.00 0.00 N ATOM 928 CA TYR A 62 -2.144 0.449 -9.421 1.00 0.00 C ATOM 929 C TYR A 62 -2.276 1.246 -10.725 1.00 0.00 C ATOM 930 O TYR A 62 -1.488 1.099 -11.663 1.00 0.00 O ATOM 931 CB TYR A 62 -1.096 1.028 -8.443 1.00 0.00 C ATOM 932 CG TYR A 62 -1.634 1.956 -7.369 1.00 0.00 C ATOM 933 CD1 TYR A 62 -2.275 3.106 -7.701 1.00 0.00 C ATOM 934 CD2 TYR A 62 -1.388 1.675 -6.058 1.00 0.00 C ATOM 935 CE1 TYR A 62 -2.749 3.930 -6.730 1.00 0.00 C ATOM 936 CE2 TYR A 62 -1.834 2.517 -5.089 1.00 0.00 C ATOM 937 CZ TYR A 62 -2.529 3.633 -5.425 1.00 0.00 C ATOM 938 OH TYR A 62 -2.989 4.474 -4.451 1.00 0.00 O ATOM 0 H TYR A 62 -0.894 -1.078 -10.207 1.00 0.00 H new ATOM 0 HA TYR A 62 -3.079 0.501 -8.863 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.584 0.198 -7.956 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -0.347 1.569 -9.022 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.409 3.367 -8.741 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -0.839 0.784 -5.790 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.300 4.820 -6.997 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -1.635 2.298 -4.050 1.00 0.00 H new ATOM 0 HH TYR A 62 -2.470 5.305 -4.465 1.00 0.00 H new ATOM 948 N LEU A 63 -3.233 2.164 -10.732 1.00 0.00 N ATOM 949 CA LEU A 63 -3.367 3.146 -11.807 1.00 0.00 C ATOM 950 C LEU A 63 -3.325 4.559 -11.220 1.00 0.00 C ATOM 951 O LEU A 63 -4.311 5.060 -10.677 1.00 0.00 O ATOM 952 CB LEU A 63 -4.713 2.858 -12.487 1.00 0.00 C ATOM 953 CG LEU A 63 -4.723 1.554 -13.294 1.00 0.00 C ATOM 954 CD1 LEU A 63 -6.118 1.362 -13.877 1.00 0.00 C ATOM 955 CD2 LEU A 63 -3.700 1.562 -14.435 1.00 0.00 C ATOM 0 H LEU A 63 -3.936 2.252 -9.998 1.00 0.00 H new ATOM 0 HA LEU A 63 -2.555 3.077 -12.531 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.493 2.812 -11.727 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -4.962 3.688 -13.149 1.00 0.00 H new ATOM 0 HG LEU A 63 -4.453 0.739 -12.623 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -6.147 0.439 -14.456 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -6.846 1.306 -13.068 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -6.360 2.204 -14.525 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -3.749 0.616 -14.974 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.924 2.381 -15.119 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -2.699 1.695 -14.025 1.00 0.00 H new ATOM 967 N THR A 64 -2.178 5.212 -11.366 1.00 0.00 N ATOM 968 CA THR A 64 -2.067 6.643 -11.043 1.00 0.00 C ATOM 969 C THR A 64 -1.184 7.236 -12.170 1.00 0.00 C ATOM 970 O THR A 64 -0.338 6.525 -12.719 1.00 0.00 O ATOM 971 CB THR A 64 -1.474 6.747 -9.627 1.00 0.00 C ATOM 972 OG1 THR A 64 -2.246 5.951 -8.744 1.00 0.00 O ATOM 973 CG2 THR A 64 -1.517 8.162 -9.064 1.00 0.00 C ATOM 0 H THR A 64 -1.315 4.785 -11.702 1.00 0.00 H new ATOM 0 HA THR A 64 -3.004 7.199 -11.015 1.00 0.00 H new ATOM 0 HB THR A 64 -0.436 6.423 -9.705 1.00 0.00 H new ATOM 0 HG1 THR A 64 -1.732 5.158 -8.484 1.00 0.00 H new ATOM 0 HG21 THR A 64 -1.085 8.169 -8.063 1.00 0.00 H new ATOM 0 HG22 THR A 64 -0.946 8.828 -9.711 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.551 8.503 -9.014 1.00 0.00 H new ATOM 981 N PRO A 65 -1.262 8.531 -12.508 1.00 0.00 N ATOM 982 CA PRO A 65 -0.309 9.175 -13.424 1.00 0.00 C ATOM 983 C PRO A 65 1.177 8.953 -13.126 1.00 0.00 C ATOM 984 O PRO A 65 1.630 9.036 -11.983 1.00 0.00 O ATOM 985 CB PRO A 65 -0.660 10.659 -13.263 1.00 0.00 C ATOM 986 CG PRO A 65 -2.136 10.664 -12.878 1.00 0.00 C ATOM 987 CD PRO A 65 -2.297 9.427 -12.000 1.00 0.00 C ATOM 0 HA PRO A 65 -0.410 8.757 -14.426 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -0.048 11.130 -12.494 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -0.489 11.210 -14.188 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -2.404 11.573 -12.339 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -2.777 10.614 -13.758 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -2.149 9.658 -10.945 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -3.291 8.991 -12.095 1.00 0.00 H new ATOM 995 N GLU A 66 1.919 8.623 -14.178 1.00 0.00 N ATOM 996 CA GLU A 66 3.313 8.175 -14.010 1.00 0.00 C ATOM 997 C GLU A 66 4.325 9.333 -14.177 1.00 0.00 C ATOM 998 O GLU A 66 5.537 9.110 -14.158 1.00 0.00 O ATOM 999 CB GLU A 66 3.548 7.046 -15.032 1.00 0.00 C ATOM 1000 CG GLU A 66 4.846 6.252 -14.829 1.00 0.00 C ATOM 1001 CD GLU A 66 4.896 5.535 -13.484 1.00 0.00 C ATOM 1002 OE1 GLU A 66 4.255 4.469 -13.345 1.00 0.00 O ATOM 1003 OE2 GLU A 66 5.577 6.030 -12.560 1.00 0.00 O ATOM 0 H GLU A 66 1.593 8.653 -15.144 1.00 0.00 H new ATOM 0 HA GLU A 66 3.472 7.809 -12.996 1.00 0.00 H new ATOM 0 HB2 GLU A 66 2.706 6.355 -14.989 1.00 0.00 H new ATOM 0 HB3 GLU A 66 3.556 7.477 -16.033 1.00 0.00 H new ATOM 0 HG2 GLU A 66 4.948 5.520 -15.630 1.00 0.00 H new ATOM 0 HG3 GLU A 66 5.697 6.929 -14.906 1.00 0.00 H new ATOM 1010 N ALA A 67 3.851 10.578 -14.264 1.00 0.00 N ATOM 1011 CA ALA A 67 4.750 11.740 -14.208 1.00 0.00 C ATOM 1012 C ALA A 67 4.723 12.338 -12.795 1.00 0.00 C ATOM 1013 O ALA A 67 4.069 11.816 -11.887 1.00 0.00 O ATOM 1014 CB ALA A 67 4.275 12.752 -15.255 1.00 0.00 C ATOM 0 H ALA A 67 2.863 10.809 -14.372 1.00 0.00 H new ATOM 0 HA ALA A 67 5.779 11.455 -14.426 1.00 0.00 H new ATOM 0 HB1 ALA A 67 4.925 13.627 -15.236 1.00 0.00 H new ATOM 0 HB2 ALA A 67 4.309 12.295 -16.244 1.00 0.00 H new ATOM 0 HB3 ALA A 67 3.252 13.055 -15.031 1.00 0.00 H new ATOM 1020 N GLN A 68 5.479 13.413 -12.587 1.00 0.00 N ATOM 1021 CA GLN A 68 5.681 13.918 -11.222 1.00 0.00 C ATOM 1022 C GLN A 68 4.514 14.807 -10.773 1.00 0.00 C ATOM 1023 O GLN A 68 4.514 16.024 -10.973 1.00 0.00 O ATOM 1024 CB GLN A 68 7.024 14.663 -11.168 1.00 0.00 C ATOM 1025 CG GLN A 68 7.423 15.038 -9.735 1.00 0.00 C ATOM 1026 CD GLN A 68 8.766 15.761 -9.702 1.00 0.00 C ATOM 1027 OE1 GLN A 68 8.845 16.978 -9.865 1.00 0.00 O ATOM 1028 NE2 GLN A 68 9.841 15.023 -9.488 1.00 0.00 N ATOM 0 H GLN A 68 5.952 13.942 -13.320 1.00 0.00 H new ATOM 0 HA GLN A 68 5.709 13.081 -10.524 1.00 0.00 H new ATOM 0 HB2 GLN A 68 7.802 14.039 -11.608 1.00 0.00 H new ATOM 0 HB3 GLN A 68 6.960 15.567 -11.774 1.00 0.00 H new ATOM 0 HG2 GLN A 68 6.655 15.675 -9.297 1.00 0.00 H new ATOM 0 HG3 GLN A 68 7.478 14.137 -9.123 1.00 0.00 H new ATOM 0 HE21 GLN A 68 9.750 14.016 -9.356 1.00 0.00 H new ATOM 0 HE22 GLN A 68 10.762 15.461 -9.455 1.00 0.00 H new ATOM 1037 N THR A 69 3.552 14.193 -10.089 1.00 0.00 N ATOM 1038 CA THR A 69 2.544 14.968 -9.348 1.00 0.00 C ATOM 1039 C THR A 69 3.128 15.222 -7.949 1.00 0.00 C ATOM 1040 O THR A 69 3.476 16.354 -7.610 1.00 0.00 O ATOM 1041 CB THR A 69 1.204 14.208 -9.325 1.00 0.00 C ATOM 1042 OG1 THR A 69 0.776 13.970 -10.659 1.00 0.00 O ATOM 1043 CG2 THR A 69 0.113 15.002 -8.604 1.00 0.00 C ATOM 0 H THR A 69 3.444 13.181 -10.028 1.00 0.00 H new ATOM 0 HA THR A 69 2.325 15.926 -9.820 1.00 0.00 H new ATOM 0 HB THR A 69 1.364 13.272 -8.790 1.00 0.00 H new ATOM 0 HG1 THR A 69 -0.076 13.485 -10.648 1.00 0.00 H new ATOM 0 HG21 THR A 69 -0.816 14.432 -8.610 1.00 0.00 H new ATOM 0 HG22 THR A 69 0.418 15.188 -7.574 1.00 0.00 H new ATOM 0 HG23 THR A 69 -0.042 15.953 -9.114 1.00 0.00 H new ATOM 1051 N ASP A 70 3.346 14.148 -7.188 1.00 0.00 N ATOM 1052 CA ASP A 70 4.208 14.230 -6.003 1.00 0.00 C ATOM 1053 C ASP A 70 5.307 13.163 -6.154 1.00 0.00 C ATOM 1054 O ASP A 70 5.318 12.380 -7.110 1.00 0.00 O ATOM 1055 CB ASP A 70 3.380 14.011 -4.724 1.00 0.00 C ATOM 1056 CG ASP A 70 2.370 15.128 -4.476 1.00 0.00 C ATOM 1057 OD1 ASP A 70 2.768 16.198 -3.967 1.00 0.00 O ATOM 1058 OD2 ASP A 70 1.174 14.939 -4.786 1.00 0.00 O ATOM 0 H ASP A 70 2.947 13.226 -7.364 1.00 0.00 H new ATOM 0 HA ASP A 70 4.663 15.217 -5.920 1.00 0.00 H new ATOM 0 HB2 ASP A 70 2.853 13.060 -4.796 1.00 0.00 H new ATOM 0 HB3 ASP A 70 4.052 13.939 -3.869 1.00 0.00 H new ATOM 1063 N ILE A 71 6.217 13.093 -5.189 1.00 0.00 N ATOM 1064 CA ILE A 71 7.176 11.968 -5.139 1.00 0.00 C ATOM 1065 C ILE A 71 6.901 10.971 -3.994 1.00 0.00 C ATOM 1066 O ILE A 71 7.731 10.095 -3.745 1.00 0.00 O ATOM 1067 CB ILE A 71 8.629 12.492 -5.086 1.00 0.00 C ATOM 1068 CG1 ILE A 71 8.899 13.365 -3.847 1.00 0.00 C ATOM 1069 CG2 ILE A 71 8.970 13.245 -6.379 1.00 0.00 C ATOM 1070 CD1 ILE A 71 10.379 13.714 -3.676 1.00 0.00 C ATOM 0 H ILE A 71 6.320 13.779 -4.441 1.00 0.00 H new ATOM 0 HA ILE A 71 7.035 11.405 -6.061 1.00 0.00 H new ATOM 0 HB ILE A 71 9.284 11.625 -4.999 1.00 0.00 H new ATOM 0 HG12 ILE A 71 8.320 14.285 -3.924 1.00 0.00 H new ATOM 0 HG13 ILE A 71 8.549 12.842 -2.957 1.00 0.00 H new ATOM 0 HG21 ILE A 71 9.996 13.609 -6.328 1.00 0.00 H new ATOM 0 HG22 ILE A 71 8.865 12.572 -7.230 1.00 0.00 H new ATOM 0 HG23 ILE A 71 8.291 14.090 -6.498 1.00 0.00 H new ATOM 0 HD11 ILE A 71 10.507 14.331 -2.786 1.00 0.00 H new ATOM 0 HD12 ILE A 71 10.959 12.797 -3.569 1.00 0.00 H new ATOM 0 HD13 ILE A 71 10.727 14.263 -4.551 1.00 0.00 H new ATOM 1082 N LYS A 72 5.781 11.087 -3.278 1.00 0.00 N ATOM 1083 CA LYS A 72 5.613 10.307 -2.040 1.00 0.00 C ATOM 1084 C LYS A 72 4.370 9.418 -2.089 1.00 0.00 C ATOM 1085 O LYS A 72 3.272 9.839 -2.460 1.00 0.00 O ATOM 1086 CB LYS A 72 5.473 11.262 -0.842 1.00 0.00 C ATOM 1087 CG LYS A 72 6.724 12.112 -0.594 1.00 0.00 C ATOM 1088 CD LYS A 72 6.550 13.005 0.636 1.00 0.00 C ATOM 1089 CE LYS A 72 7.791 13.870 0.871 1.00 0.00 C ATOM 1090 NZ LYS A 72 7.599 14.724 2.053 1.00 0.00 N ATOM 0 H LYS A 72 4.996 11.692 -3.519 1.00 0.00 H new ATOM 0 HA LYS A 72 6.493 9.673 -1.935 1.00 0.00 H new ATOM 0 HB2 LYS A 72 4.622 11.922 -1.010 1.00 0.00 H new ATOM 0 HB3 LYS A 72 5.254 10.680 0.054 1.00 0.00 H new ATOM 0 HG2 LYS A 72 7.588 11.461 -0.455 1.00 0.00 H new ATOM 0 HG3 LYS A 72 6.927 12.729 -1.469 1.00 0.00 H new ATOM 0 HD2 LYS A 72 5.677 13.644 0.504 1.00 0.00 H new ATOM 0 HD3 LYS A 72 6.362 12.387 1.514 1.00 0.00 H new ATOM 0 HE2 LYS A 72 8.665 13.234 1.011 1.00 0.00 H new ATOM 0 HE3 LYS A 72 7.984 14.488 -0.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 8.448 15.306 2.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 6.776 15.343 1.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 7.437 14.128 2.889 1.00 0.00 H new ATOM 1104 N PHE A 73 4.544 8.210 -1.562 1.00 0.00 N ATOM 1105 CA PHE A 73 3.403 7.366 -1.181 1.00 0.00 C ATOM 1106 C PHE A 73 3.705 6.913 0.248 1.00 0.00 C ATOM 1107 O PHE A 73 4.875 6.681 0.572 1.00 0.00 O ATOM 1108 CB PHE A 73 3.375 6.199 -2.189 1.00 0.00 C ATOM 1109 CG PHE A 73 2.353 5.080 -1.992 1.00 0.00 C ATOM 1110 CD1 PHE A 73 1.065 5.349 -1.646 1.00 0.00 C ATOM 1111 CD2 PHE A 73 2.718 3.791 -2.250 1.00 0.00 C ATOM 1112 CE1 PHE A 73 0.166 4.344 -1.513 1.00 0.00 C ATOM 1113 CE2 PHE A 73 1.801 2.794 -2.161 1.00 0.00 C ATOM 1114 CZ PHE A 73 0.545 3.063 -1.738 1.00 0.00 C ATOM 0 H PHE A 73 5.457 7.790 -1.387 1.00 0.00 H new ATOM 0 HA PHE A 73 2.429 7.854 -1.203 1.00 0.00 H new ATOM 0 HB2 PHE A 73 3.213 6.623 -3.180 1.00 0.00 H new ATOM 0 HB3 PHE A 73 4.365 5.744 -2.195 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.757 6.370 -1.476 1.00 0.00 H new ATOM 0 HD2 PHE A 73 3.737 3.564 -2.525 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -0.852 4.564 -1.228 1.00 0.00 H new ATOM 0 HE2 PHE A 73 2.075 1.784 -2.428 1.00 0.00 H new ATOM 0 HZ PHE A 73 -0.156 2.257 -1.580 1.00 0.00 H new ATOM 1124 N PRO A 74 2.721 6.675 1.123 1.00 0.00 N ATOM 1125 CA PRO A 74 3.073 6.350 2.503 1.00 0.00 C ATOM 1126 C PRO A 74 3.429 4.872 2.619 1.00 0.00 C ATOM 1127 O PRO A 74 2.904 4.023 1.895 1.00 0.00 O ATOM 1128 CB PRO A 74 1.800 6.718 3.264 1.00 0.00 C ATOM 1129 CG PRO A 74 1.029 7.682 2.373 1.00 0.00 C ATOM 1130 CD PRO A 74 1.358 7.204 0.970 1.00 0.00 C ATOM 0 HA PRO A 74 3.947 6.876 2.888 1.00 0.00 H new ATOM 0 HB2 PRO A 74 1.206 5.830 3.480 1.00 0.00 H new ATOM 0 HB3 PRO A 74 2.040 7.181 4.221 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -0.042 7.642 2.570 1.00 0.00 H new ATOM 0 HG3 PRO A 74 1.344 8.714 2.530 1.00 0.00 H new ATOM 0 HD2 PRO A 74 0.662 6.438 0.629 1.00 0.00 H new ATOM 0 HD3 PRO A 74 1.318 8.017 0.245 1.00 0.00 H new ATOM 1138 N LYS A 75 4.322 4.563 3.549 1.00 0.00 N ATOM 1139 CA LYS A 75 4.681 3.153 3.785 1.00 0.00 C ATOM 1140 C LYS A 75 3.497 2.296 4.269 1.00 0.00 C ATOM 1141 O LYS A 75 3.367 1.127 3.901 1.00 0.00 O ATOM 1142 CB LYS A 75 5.857 3.044 4.765 1.00 0.00 C ATOM 1143 CG LYS A 75 7.151 3.640 4.194 1.00 0.00 C ATOM 1144 CD LYS A 75 8.321 3.461 5.163 1.00 0.00 C ATOM 1145 CE LYS A 75 9.613 4.035 4.578 1.00 0.00 C ATOM 1146 NZ LYS A 75 10.727 3.850 5.522 1.00 0.00 N ATOM 0 H LYS A 75 4.804 5.239 4.141 1.00 0.00 H new ATOM 0 HA LYS A 75 4.982 2.751 2.817 1.00 0.00 H new ATOM 0 HB2 LYS A 75 5.602 3.557 5.693 1.00 0.00 H new ATOM 0 HB3 LYS A 75 6.022 1.996 5.015 1.00 0.00 H new ATOM 0 HG2 LYS A 75 7.386 3.160 3.244 1.00 0.00 H new ATOM 0 HG3 LYS A 75 7.006 4.700 3.988 1.00 0.00 H new ATOM 0 HD2 LYS A 75 8.094 3.956 6.107 1.00 0.00 H new ATOM 0 HD3 LYS A 75 8.457 2.402 5.383 1.00 0.00 H new ATOM 0 HE2 LYS A 75 9.843 3.543 3.633 1.00 0.00 H new ATOM 0 HE3 LYS A 75 9.483 5.095 4.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 11.598 4.244 5.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 10.511 4.340 6.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 10.860 2.835 5.708 1.00 0.00 H new ATOM 1160 N LYS A 76 2.640 2.871 5.116 1.00 0.00 N ATOM 1161 CA LYS A 76 1.490 2.129 5.664 1.00 0.00 C ATOM 1162 C LYS A 76 0.505 1.637 4.591 1.00 0.00 C ATOM 1163 O LYS A 76 -0.060 0.553 4.732 1.00 0.00 O ATOM 1164 CB LYS A 76 0.745 3.000 6.684 1.00 0.00 C ATOM 1165 CG LYS A 76 1.602 3.332 7.914 1.00 0.00 C ATOM 1166 CD LYS A 76 0.815 4.165 8.930 1.00 0.00 C ATOM 1167 CE LYS A 76 1.657 4.543 10.155 1.00 0.00 C ATOM 1168 NZ LYS A 76 2.013 3.356 10.951 1.00 0.00 N ATOM 0 H LYS A 76 2.714 3.836 5.437 1.00 0.00 H new ATOM 0 HA LYS A 76 1.900 1.240 6.143 1.00 0.00 H new ATOM 0 HB2 LYS A 76 0.430 3.927 6.204 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.160 2.484 7.005 1.00 0.00 H new ATOM 0 HG2 LYS A 76 1.943 2.409 8.383 1.00 0.00 H new ATOM 0 HG3 LYS A 76 2.492 3.879 7.603 1.00 0.00 H new ATOM 0 HD2 LYS A 76 0.452 5.073 8.448 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -0.062 3.604 9.254 1.00 0.00 H new ATOM 0 HE2 LYS A 76 2.565 5.051 9.831 1.00 0.00 H new ATOM 0 HE3 LYS A 76 1.103 5.246 10.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 2.494 3.655 11.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 1.150 2.829 11.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 2.647 2.745 10.398 1.00 0.00 H new ATOM 1182 N LEU A 77 0.319 2.386 3.501 1.00 0.00 N ATOM 1183 CA LEU A 77 -0.592 1.908 2.439 1.00 0.00 C ATOM 1184 C LEU A 77 0.070 0.808 1.585 1.00 0.00 C ATOM 1185 O LEU A 77 -0.626 -0.103 1.142 1.00 0.00 O ATOM 1186 CB LEU A 77 -1.145 3.036 1.546 1.00 0.00 C ATOM 1187 CG LEU A 77 -1.820 4.190 2.303 1.00 0.00 C ATOM 1188 CD1 LEU A 77 -2.443 5.198 1.332 1.00 0.00 C ATOM 1189 CD2 LEU A 77 -2.914 3.693 3.253 1.00 0.00 C ATOM 0 H LEU A 77 0.762 3.288 3.326 1.00 0.00 H new ATOM 0 HA LEU A 77 -1.450 1.481 2.958 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.327 3.441 0.950 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -1.865 2.608 0.849 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.035 4.671 2.886 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -2.913 6.003 1.896 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.666 5.611 0.688 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -3.193 4.698 0.720 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.363 4.543 3.767 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.680 3.167 2.683 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.478 3.015 3.987 1.00 0.00 H new ATOM 1201 N ILE A 78 1.398 0.810 1.412 1.00 0.00 N ATOM 1202 CA ILE A 78 2.103 -0.343 0.841 1.00 0.00 C ATOM 1203 C ILE A 78 1.957 -1.598 1.739 1.00 0.00 C ATOM 1204 O ILE A 78 1.826 -2.704 1.210 1.00 0.00 O ATOM 1205 CB ILE A 78 3.569 0.103 0.659 1.00 0.00 C ATOM 1206 CG1 ILE A 78 3.783 1.295 -0.277 1.00 0.00 C ATOM 1207 CG2 ILE A 78 4.425 -1.067 0.196 1.00 0.00 C ATOM 1208 CD1 ILE A 78 5.197 1.877 -0.213 1.00 0.00 C ATOM 0 H ILE A 78 2.003 1.594 1.658 1.00 0.00 H new ATOM 0 HA ILE A 78 1.680 -0.642 -0.118 1.00 0.00 H new ATOM 0 HB ILE A 78 3.876 0.448 1.646 1.00 0.00 H new ATOM 0 HG12 ILE A 78 3.572 0.985 -1.301 1.00 0.00 H new ATOM 0 HG13 ILE A 78 3.066 2.076 -0.027 1.00 0.00 H new ATOM 0 HG21 ILE A 78 5.456 -0.737 0.072 1.00 0.00 H new ATOM 0 HG22 ILE A 78 4.386 -1.863 0.939 1.00 0.00 H new ATOM 0 HG23 ILE A 78 4.047 -1.440 -0.756 1.00 0.00 H new ATOM 0 HD11 ILE A 78 5.276 2.718 -0.902 1.00 0.00 H new ATOM 0 HD12 ILE A 78 5.404 2.218 0.801 1.00 0.00 H new ATOM 0 HD13 ILE A 78 5.919 1.110 -0.493 1.00 0.00 H new ATOM 1220 N SER A 79 1.954 -1.467 3.072 1.00 0.00 N ATOM 1221 CA SER A 79 1.710 -2.634 3.937 1.00 0.00 C ATOM 1222 C SER A 79 0.266 -3.162 3.835 1.00 0.00 C ATOM 1223 O SER A 79 0.046 -4.371 3.872 1.00 0.00 O ATOM 1224 CB SER A 79 2.047 -2.250 5.382 1.00 0.00 C ATOM 1225 OG SER A 79 1.937 -3.385 6.231 1.00 0.00 O ATOM 0 H SER A 79 2.113 -0.590 3.567 1.00 0.00 H new ATOM 0 HA SER A 79 2.352 -3.448 3.600 1.00 0.00 H new ATOM 0 HB2 SER A 79 3.058 -1.846 5.432 1.00 0.00 H new ATOM 0 HB3 SER A 79 1.373 -1.465 5.724 1.00 0.00 H new ATOM 0 HG SER A 79 2.156 -3.128 7.151 1.00 0.00 H new ATOM 1231 N VAL A 80 -0.714 -2.271 3.680 1.00 0.00 N ATOM 1232 CA VAL A 80 -2.104 -2.695 3.416 1.00 0.00 C ATOM 1233 C VAL A 80 -2.220 -3.454 2.078 1.00 0.00 C ATOM 1234 O VAL A 80 -2.910 -4.471 2.013 1.00 0.00 O ATOM 1235 CB VAL A 80 -3.053 -1.477 3.476 1.00 0.00 C ATOM 1236 CG1 VAL A 80 -4.493 -1.840 3.094 1.00 0.00 C ATOM 1237 CG2 VAL A 80 -3.088 -0.874 4.886 1.00 0.00 C ATOM 0 H VAL A 80 -0.582 -1.261 3.731 1.00 0.00 H new ATOM 0 HA VAL A 80 -2.406 -3.395 4.195 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.658 -0.758 2.758 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -5.120 -0.950 3.152 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -4.512 -2.232 2.077 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -4.872 -2.596 3.781 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -3.764 -0.019 4.899 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -3.439 -1.625 5.594 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -2.086 -0.550 5.168 1.00 0.00 H new ATOM 1247 N LEU A 81 -1.534 -3.002 1.023 1.00 0.00 N ATOM 1248 CA LEU A 81 -1.485 -3.776 -0.224 1.00 0.00 C ATOM 1249 C LEU A 81 -0.867 -5.173 -0.023 1.00 0.00 C ATOM 1250 O LEU A 81 -1.413 -6.161 -0.513 1.00 0.00 O ATOM 1251 CB LEU A 81 -0.668 -3.001 -1.272 1.00 0.00 C ATOM 1252 CG LEU A 81 -1.488 -2.049 -2.152 1.00 0.00 C ATOM 1253 CD1 LEU A 81 -1.879 -0.760 -1.423 1.00 0.00 C ATOM 1254 CD2 LEU A 81 -0.647 -1.665 -3.368 1.00 0.00 C ATOM 0 H LEU A 81 -1.015 -2.124 1.004 1.00 0.00 H new ATOM 0 HA LEU A 81 -2.511 -3.918 -0.564 1.00 0.00 H new ATOM 0 HB2 LEU A 81 0.102 -2.426 -0.759 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -0.156 -3.717 -1.915 1.00 0.00 H new ATOM 0 HG LEU A 81 -2.404 -2.570 -2.432 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.458 -0.124 -2.093 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -2.480 -1.005 -0.547 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.979 -0.232 -1.109 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -1.216 -0.988 -4.005 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.266 -1.171 -3.037 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -0.390 -2.562 -3.931 1.00 0.00 H new ATOM 1266 N ALA A 82 0.260 -5.268 0.680 1.00 0.00 N ATOM 1267 CA ALA A 82 0.898 -6.568 0.932 1.00 0.00 C ATOM 1268 C ALA A 82 0.079 -7.516 1.824 1.00 0.00 C ATOM 1269 O ALA A 82 0.220 -8.736 1.726 1.00 0.00 O ATOM 1270 CB ALA A 82 2.250 -6.274 1.587 1.00 0.00 C ATOM 0 H ALA A 82 0.750 -4.470 1.084 1.00 0.00 H new ATOM 0 HA ALA A 82 0.993 -7.091 -0.019 1.00 0.00 H new ATOM 0 HB1 ALA A 82 2.765 -7.212 1.795 1.00 0.00 H new ATOM 0 HB2 ALA A 82 2.857 -5.668 0.914 1.00 0.00 H new ATOM 0 HB3 ALA A 82 2.092 -5.732 2.520 1.00 0.00 H new ATOM 1276 N ASP A 83 -0.723 -6.969 2.737 1.00 0.00 N ATOM 1277 CA ASP A 83 -1.378 -7.802 3.767 1.00 0.00 C ATOM 1278 C ASP A 83 -2.565 -8.658 3.275 1.00 0.00 C ATOM 1279 O ASP A 83 -3.065 -9.522 3.995 1.00 0.00 O ATOM 1280 CB ASP A 83 -1.790 -6.883 4.926 1.00 0.00 C ATOM 1281 CG ASP A 83 -2.227 -7.647 6.174 1.00 0.00 C ATOM 1282 OD1 ASP A 83 -1.359 -8.241 6.851 1.00 0.00 O ATOM 1283 OD2 ASP A 83 -3.437 -7.652 6.485 1.00 0.00 O ATOM 0 H ASP A 83 -0.937 -5.973 2.792 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.650 -8.547 4.087 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -0.953 -6.233 5.181 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -2.606 -6.239 4.598 1.00 0.00 H new ATOM 1288 N SER A 84 -3.009 -8.417 2.053 1.00 0.00 N ATOM 1289 CA SER A 84 -4.167 -9.120 1.490 1.00 0.00 C ATOM 1290 C SER A 84 -3.807 -10.207 0.460 1.00 0.00 C ATOM 1291 O SER A 84 -4.616 -10.548 -0.404 1.00 0.00 O ATOM 1292 CB SER A 84 -5.012 -8.037 0.823 1.00 0.00 C ATOM 1293 OG SER A 84 -5.544 -7.144 1.793 1.00 0.00 O ATOM 0 H SER A 84 -2.587 -7.736 1.422 1.00 0.00 H new ATOM 0 HA SER A 84 -4.686 -9.653 2.287 1.00 0.00 H new ATOM 0 HB2 SER A 84 -4.404 -7.484 0.107 1.00 0.00 H new ATOM 0 HB3 SER A 84 -5.825 -8.498 0.261 1.00 0.00 H new ATOM 0 HG SER A 84 -6.081 -6.457 1.346 1.00 0.00 H new ATOM 1299 N LEU A 85 -2.587 -10.731 0.522 1.00 0.00 N ATOM 1300 CA LEU A 85 -2.035 -11.486 -0.605 1.00 0.00 C ATOM 1301 C LEU A 85 -1.377 -12.791 -0.120 1.00 0.00 C ATOM 1302 O LEU A 85 -1.590 -13.256 1.002 1.00 0.00 O ATOM 1303 CB LEU A 85 -0.973 -10.561 -1.227 1.00 0.00 C ATOM 1304 CG LEU A 85 -1.432 -9.172 -1.703 1.00 0.00 C ATOM 1305 CD1 LEU A 85 -0.233 -8.434 -2.307 1.00 0.00 C ATOM 1306 CD2 LEU A 85 -2.540 -9.249 -2.758 1.00 0.00 C ATOM 0 H LEU A 85 -1.966 -10.651 1.327 1.00 0.00 H new ATOM 0 HA LEU A 85 -2.810 -11.768 -1.318 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -0.179 -10.420 -0.494 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -0.532 -11.080 -2.078 1.00 0.00 H new ATOM 0 HG LEU A 85 -1.832 -8.644 -0.837 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.547 -7.448 -2.648 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.546 -8.326 -1.552 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.157 -9.003 -3.151 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.827 -8.241 -3.059 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -2.177 -9.798 -3.627 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.406 -9.763 -2.340 1.00 0.00 H new ATOM 1318 N LYS A 86 -0.609 -13.409 -1.016 1.00 0.00 N ATOM 1319 CA LYS A 86 -0.072 -14.757 -0.792 1.00 0.00 C ATOM 1320 C LYS A 86 1.400 -14.729 -1.260 1.00 0.00 C ATOM 1321 O LYS A 86 1.832 -13.767 -1.897 1.00 0.00 O ATOM 1322 CB LYS A 86 -0.901 -15.784 -1.584 1.00 0.00 C ATOM 1323 CG LYS A 86 -2.308 -15.970 -1.003 1.00 0.00 C ATOM 1324 CD LYS A 86 -3.094 -17.039 -1.770 1.00 0.00 C ATOM 1325 CE LYS A 86 -4.515 -17.231 -1.224 1.00 0.00 C ATOM 1326 NZ LYS A 86 -4.495 -17.782 0.141 1.00 0.00 N ATOM 0 H LYS A 86 -0.342 -12.997 -1.910 1.00 0.00 H new ATOM 0 HA LYS A 86 -0.124 -15.048 0.257 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -0.979 -15.461 -2.622 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -0.382 -16.742 -1.586 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.235 -16.254 0.047 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -2.847 -15.023 -1.041 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.148 -16.760 -2.822 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -2.558 -17.986 -1.718 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -5.039 -16.275 -1.225 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -5.071 -17.900 -1.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -5.467 -17.995 0.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -3.929 -18.654 0.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -4.075 -17.086 0.790 1.00 0.00 H new ATOM 1340 N PRO A 87 2.174 -15.803 -1.077 1.00 0.00 N ATOM 1341 CA PRO A 87 3.514 -15.911 -1.679 1.00 0.00 C ATOM 1342 C PRO A 87 3.708 -15.670 -3.195 1.00 0.00 C ATOM 1343 O PRO A 87 4.825 -15.349 -3.599 1.00 0.00 O ATOM 1344 CB PRO A 87 3.933 -17.320 -1.247 1.00 0.00 C ATOM 1345 CG PRO A 87 3.253 -17.514 0.109 1.00 0.00 C ATOM 1346 CD PRO A 87 1.918 -16.776 -0.004 1.00 0.00 C ATOM 0 HA PRO A 87 4.128 -15.081 -1.331 1.00 0.00 H new ATOM 0 HB2 PRO A 87 3.607 -18.071 -1.967 1.00 0.00 H new ATOM 0 HB3 PRO A 87 5.017 -17.406 -1.165 1.00 0.00 H new ATOM 0 HG2 PRO A 87 3.102 -18.571 0.326 1.00 0.00 H new ATOM 0 HG3 PRO A 87 3.861 -17.107 0.917 1.00 0.00 H new ATOM 0 HD2 PRO A 87 1.102 -17.453 -0.258 1.00 0.00 H new ATOM 0 HD3 PRO A 87 1.647 -16.285 0.931 1.00 0.00 H new ATOM 1354 N ASN A 88 2.685 -15.809 -4.046 1.00 0.00 N ATOM 1355 CA ASN A 88 2.818 -15.368 -5.453 1.00 0.00 C ATOM 1356 C ASN A 88 2.103 -14.022 -5.663 1.00 0.00 C ATOM 1357 O ASN A 88 1.380 -13.836 -6.642 1.00 0.00 O ATOM 1358 CB ASN A 88 2.283 -16.452 -6.415 1.00 0.00 C ATOM 1359 CG ASN A 88 2.921 -17.824 -6.194 1.00 0.00 C ATOM 1360 OD1 ASN A 88 2.296 -18.750 -5.681 1.00 0.00 O ATOM 1361 ND2 ASN A 88 4.179 -17.970 -6.572 1.00 0.00 N ATOM 0 H ASN A 88 1.779 -16.210 -3.803 1.00 0.00 H new ATOM 0 HA ASN A 88 3.875 -15.222 -5.677 1.00 0.00 H new ATOM 0 HB2 ASN A 88 1.203 -16.537 -6.292 1.00 0.00 H new ATOM 0 HB3 ASN A 88 2.463 -16.137 -7.443 1.00 0.00 H new ATOM 0 HD21 ASN A 88 4.651 -18.865 -6.440 1.00 0.00 H new ATOM 0 HD22 ASN A 88 4.678 -17.188 -6.996 1.00 0.00 H new ATOM 1368 N GLY A 89 2.312 -13.067 -4.756 1.00 0.00 N ATOM 1369 CA GLY A 89 1.718 -11.737 -4.917 1.00 0.00 C ATOM 1370 C GLY A 89 2.550 -10.944 -5.906 1.00 0.00 C ATOM 1371 O GLY A 89 3.773 -11.022 -5.877 1.00 0.00 O ATOM 0 H GLY A 89 2.878 -13.184 -3.916 1.00 0.00 H new ATOM 0 HA2 GLY A 89 0.691 -11.823 -5.272 1.00 0.00 H new ATOM 0 HA3 GLY A 89 1.681 -11.222 -3.957 1.00 0.00 H new ATOM 1375 N SER A 90 1.912 -10.205 -6.798 1.00 0.00 N ATOM 1376 CA SER A 90 2.671 -9.498 -7.834 1.00 0.00 C ATOM 1377 C SER A 90 1.971 -8.153 -8.065 1.00 0.00 C ATOM 1378 O SER A 90 0.869 -8.046 -8.599 1.00 0.00 O ATOM 1379 CB SER A 90 2.786 -10.358 -9.089 1.00 0.00 C ATOM 1380 OG SER A 90 3.315 -9.604 -10.171 1.00 0.00 O ATOM 0 H SER A 90 0.901 -10.076 -6.834 1.00 0.00 H new ATOM 0 HA SER A 90 3.699 -9.305 -7.529 1.00 0.00 H new ATOM 0 HB2 SER A 90 3.428 -11.216 -8.890 1.00 0.00 H new ATOM 0 HB3 SER A 90 1.805 -10.750 -9.358 1.00 0.00 H new ATOM 0 HG SER A 90 3.382 -10.174 -10.965 1.00 0.00 H new ATOM 1386 N LEU A 91 2.671 -7.134 -7.605 1.00 0.00 N ATOM 1387 CA LEU A 91 2.226 -5.740 -7.607 1.00 0.00 C ATOM 1388 C LEU A 91 2.710 -5.185 -8.953 1.00 0.00 C ATOM 1389 O LEU A 91 3.887 -5.314 -9.283 1.00 0.00 O ATOM 1390 CB LEU A 91 2.954 -5.265 -6.327 1.00 0.00 C ATOM 1391 CG LEU A 91 3.194 -3.816 -5.885 1.00 0.00 C ATOM 1392 CD1 LEU A 91 3.716 -2.864 -6.951 1.00 0.00 C ATOM 1393 CD2 LEU A 91 2.026 -3.197 -5.129 1.00 0.00 C ATOM 0 H LEU A 91 3.601 -7.251 -7.203 1.00 0.00 H new ATOM 0 HA LEU A 91 1.172 -5.466 -7.560 1.00 0.00 H new ATOM 0 HB2 LEU A 91 2.422 -5.735 -5.500 1.00 0.00 H new ATOM 0 HB3 LEU A 91 3.943 -5.722 -6.370 1.00 0.00 H new ATOM 0 HG LEU A 91 4.020 -3.940 -5.185 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.846 -1.871 -6.520 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.674 -3.226 -7.324 1.00 0.00 H new ATOM 0 HD13 LEU A 91 3.002 -2.812 -7.773 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.274 -2.173 -4.852 1.00 0.00 H new ATOM 0 HD22 LEU A 91 1.141 -3.196 -5.765 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.826 -3.778 -4.229 1.00 0.00 H new ATOM 1405 N ILE A 92 1.831 -4.539 -9.717 1.00 0.00 N ATOM 1406 CA ILE A 92 2.270 -3.813 -10.916 1.00 0.00 C ATOM 1407 C ILE A 92 2.098 -2.328 -10.686 1.00 0.00 C ATOM 1408 O ILE A 92 1.010 -1.764 -10.817 1.00 0.00 O ATOM 1409 CB ILE A 92 1.461 -4.228 -12.148 1.00 0.00 C ATOM 1410 CG1 ILE A 92 1.569 -5.726 -12.444 1.00 0.00 C ATOM 1411 CG2 ILE A 92 1.869 -3.422 -13.395 1.00 0.00 C ATOM 1412 CD1 ILE A 92 3.031 -6.130 -12.572 1.00 0.00 C ATOM 0 H ILE A 92 0.828 -4.501 -9.536 1.00 0.00 H new ATOM 0 HA ILE A 92 3.317 -4.054 -11.098 1.00 0.00 H new ATOM 0 HB ILE A 92 0.421 -4.006 -11.909 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.094 -6.297 -11.646 1.00 0.00 H new ATOM 0 HG13 ILE A 92 1.036 -5.962 -13.365 1.00 0.00 H new ATOM 0 HG21 ILE A 92 1.273 -3.745 -14.248 1.00 0.00 H new ATOM 0 HG22 ILE A 92 1.698 -2.361 -13.214 1.00 0.00 H new ATOM 0 HG23 ILE A 92 2.925 -3.589 -13.606 1.00 0.00 H new ATOM 0 HD11 ILE A 92 3.096 -7.197 -12.783 1.00 0.00 H new ATOM 0 HD12 ILE A 92 3.493 -5.571 -13.385 1.00 0.00 H new ATOM 0 HD13 ILE A 92 3.552 -5.911 -11.640 1.00 0.00 H new ATOM 1424 N GLY A 93 3.188 -1.726 -10.264 1.00 0.00 N ATOM 1425 CA GLY A 93 3.119 -0.299 -9.964 1.00 0.00 C ATOM 1426 C GLY A 93 4.289 0.614 -10.261 1.00 0.00 C ATOM 1427 O GLY A 93 4.276 1.404 -11.204 1.00 0.00 O ATOM 0 H GLY A 93 4.096 -2.169 -10.123 1.00 0.00 H new ATOM 0 HA2 GLY A 93 2.258 0.099 -10.501 1.00 0.00 H new ATOM 0 HA3 GLY A 93 2.903 -0.206 -8.900 1.00 0.00 H new ATOM 1431 N LEU A 94 5.226 0.636 -9.323 1.00 0.00 N ATOM 1432 CA LEU A 94 5.759 1.937 -8.884 1.00 0.00 C ATOM 1433 C LEU A 94 7.256 2.001 -9.251 1.00 0.00 C ATOM 1434 O LEU A 94 7.847 1.042 -9.748 1.00 0.00 O ATOM 1435 CB LEU A 94 5.546 2.076 -7.357 1.00 0.00 C ATOM 1436 CG LEU A 94 4.161 1.780 -6.739 1.00 0.00 C ATOM 1437 CD1 LEU A 94 4.284 0.584 -5.795 1.00 0.00 C ATOM 1438 CD2 LEU A 94 3.697 2.929 -5.863 1.00 0.00 C ATOM 0 H LEU A 94 5.623 -0.184 -8.864 1.00 0.00 H new ATOM 0 HA LEU A 94 5.243 2.761 -9.377 1.00 0.00 H new ATOM 0 HB2 LEU A 94 6.266 1.419 -6.868 1.00 0.00 H new ATOM 0 HB3 LEU A 94 5.811 3.098 -7.085 1.00 0.00 H new ATOM 0 HG LEU A 94 3.467 1.608 -7.561 1.00 0.00 H new ATOM 0 HD11 LEU A 94 3.311 0.367 -5.354 1.00 0.00 H new ATOM 0 HD12 LEU A 94 4.631 -0.286 -6.353 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.997 0.816 -5.004 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.720 2.693 -5.441 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.413 3.083 -5.056 1.00 0.00 H new ATOM 0 HD23 LEU A 94 3.624 3.837 -6.462 1.00 0.00 H new ATOM 1450 N SER A 95 7.853 3.179 -9.117 1.00 0.00 N ATOM 1451 CA SER A 95 9.055 3.512 -9.906 1.00 0.00 C ATOM 1452 C SER A 95 10.353 3.413 -9.080 1.00 0.00 C ATOM 1453 O SER A 95 10.541 2.463 -8.319 1.00 0.00 O ATOM 1454 CB SER A 95 8.826 4.879 -10.578 1.00 0.00 C ATOM 1455 OG SER A 95 8.628 5.894 -9.604 1.00 0.00 O ATOM 0 H SER A 95 7.539 3.915 -8.484 1.00 0.00 H new ATOM 0 HA SER A 95 9.205 2.772 -10.692 1.00 0.00 H new ATOM 0 HB2 SER A 95 9.683 5.130 -11.202 1.00 0.00 H new ATOM 0 HB3 SER A 95 7.958 4.825 -11.235 1.00 0.00 H new ATOM 0 HG SER A 95 8.486 6.754 -10.052 1.00 0.00 H new ATOM 1461 N ASP A 96 11.291 4.340 -9.292 1.00 0.00 N ATOM 1462 CA ASP A 96 12.682 4.116 -8.853 1.00 0.00 C ATOM 1463 C ASP A 96 12.942 4.327 -7.360 1.00 0.00 C ATOM 1464 O ASP A 96 13.602 3.495 -6.736 1.00 0.00 O ATOM 1465 CB ASP A 96 13.631 5.009 -9.660 1.00 0.00 C ATOM 1466 CG ASP A 96 13.655 4.664 -11.146 1.00 0.00 C ATOM 1467 OD1 ASP A 96 14.360 3.706 -11.532 1.00 0.00 O ATOM 1468 OD2 ASP A 96 12.969 5.350 -11.936 1.00 0.00 O ATOM 0 H ASP A 96 11.125 5.234 -9.753 1.00 0.00 H new ATOM 0 HA ASP A 96 12.868 3.058 -9.037 1.00 0.00 H new ATOM 0 HB2 ASP A 96 13.332 6.050 -9.539 1.00 0.00 H new ATOM 0 HB3 ASP A 96 14.639 4.918 -9.255 1.00 0.00 H new ATOM 1473 N ILE A 97 12.429 5.397 -6.760 1.00 0.00 N ATOM 1474 CA ILE A 97 12.427 5.486 -5.287 1.00 0.00 C ATOM 1475 C ILE A 97 11.707 4.290 -4.621 1.00 0.00 C ATOM 1476 O ILE A 97 12.058 3.764 -3.551 1.00 0.00 O ATOM 1477 CB ILE A 97 11.795 6.841 -4.908 1.00 0.00 C ATOM 1478 CG1 ILE A 97 11.898 7.061 -3.404 1.00 0.00 C ATOM 1479 CG2 ILE A 97 10.323 7.022 -5.301 1.00 0.00 C ATOM 1480 CD1 ILE A 97 13.346 7.315 -2.995 1.00 0.00 C ATOM 0 H ILE A 97 12.019 6.196 -7.244 1.00 0.00 H new ATOM 0 HA ILE A 97 13.449 5.433 -4.911 1.00 0.00 H new ATOM 0 HB ILE A 97 12.366 7.570 -5.483 1.00 0.00 H new ATOM 0 HG12 ILE A 97 11.278 7.909 -3.112 1.00 0.00 H new ATOM 0 HG13 ILE A 97 11.513 6.188 -2.876 1.00 0.00 H new ATOM 0 HG21 ILE A 97 9.981 8.008 -4.987 1.00 0.00 H new ATOM 0 HG22 ILE A 97 10.221 6.930 -6.382 1.00 0.00 H new ATOM 0 HG23 ILE A 97 9.719 6.257 -4.813 1.00 0.00 H new ATOM 0 HD11 ILE A 97 13.398 7.470 -1.917 1.00 0.00 H new ATOM 0 HD12 ILE A 97 13.957 6.455 -3.268 1.00 0.00 H new ATOM 0 HD13 ILE A 97 13.718 8.202 -3.507 1.00 0.00 H new ATOM 1492 N TYR A 98 10.696 3.822 -5.331 1.00 0.00 N ATOM 1493 CA TYR A 98 9.875 2.747 -4.812 1.00 0.00 C ATOM 1494 C TYR A 98 10.600 1.378 -4.932 1.00 0.00 C ATOM 1495 O TYR A 98 10.176 0.401 -4.323 1.00 0.00 O ATOM 1496 CB TYR A 98 8.503 2.760 -5.464 1.00 0.00 C ATOM 1497 CG TYR A 98 7.795 4.105 -5.300 1.00 0.00 C ATOM 1498 CD1 TYR A 98 7.267 4.440 -4.088 1.00 0.00 C ATOM 1499 CD2 TYR A 98 7.748 5.003 -6.320 1.00 0.00 C ATOM 1500 CE1 TYR A 98 6.678 5.650 -3.911 1.00 0.00 C ATOM 1501 CE2 TYR A 98 7.135 6.204 -6.151 1.00 0.00 C ATOM 1502 CZ TYR A 98 6.596 6.527 -4.946 1.00 0.00 C ATOM 1503 OH TYR A 98 6.001 7.747 -4.764 1.00 0.00 O ATOM 0 H TYR A 98 10.428 4.164 -6.254 1.00 0.00 H new ATOM 0 HA TYR A 98 9.715 2.908 -3.746 1.00 0.00 H new ATOM 0 HB2 TYR A 98 8.605 2.533 -6.525 1.00 0.00 H new ATOM 0 HB3 TYR A 98 7.888 1.973 -5.027 1.00 0.00 H new ATOM 0 HD1 TYR A 98 7.318 3.741 -3.267 1.00 0.00 H new ATOM 0 HD2 TYR A 98 8.201 4.760 -7.270 1.00 0.00 H new ATOM 0 HE1 TYR A 98 6.274 5.916 -2.946 1.00 0.00 H new ATOM 0 HE2 TYR A 98 7.076 6.901 -6.974 1.00 0.00 H new ATOM 0 HH TYR A 98 6.640 8.364 -4.350 1.00 0.00 H new ATOM 1513 N LYS A 99 11.723 1.303 -5.661 1.00 0.00 N ATOM 1514 CA LYS A 99 12.620 0.128 -5.612 1.00 0.00 C ATOM 1515 C LYS A 99 13.144 -0.147 -4.190 1.00 0.00 C ATOM 1516 O LYS A 99 13.038 -1.269 -3.697 1.00 0.00 O ATOM 1517 CB LYS A 99 13.786 0.379 -6.579 1.00 0.00 C ATOM 1518 CG LYS A 99 14.770 -0.795 -6.624 1.00 0.00 C ATOM 1519 CD LYS A 99 15.922 -0.522 -7.594 1.00 0.00 C ATOM 1520 CE LYS A 99 16.892 -1.705 -7.643 1.00 0.00 C ATOM 1521 NZ LYS A 99 17.988 -1.424 -8.582 1.00 0.00 N ATOM 0 H LYS A 99 12.036 2.040 -6.293 1.00 0.00 H new ATOM 0 HA LYS A 99 12.059 -0.758 -5.908 1.00 0.00 H new ATOM 0 HB2 LYS A 99 13.393 0.558 -7.580 1.00 0.00 H new ATOM 0 HB3 LYS A 99 14.316 1.283 -6.278 1.00 0.00 H new ATOM 0 HG2 LYS A 99 15.168 -0.976 -5.626 1.00 0.00 H new ATOM 0 HG3 LYS A 99 14.244 -1.701 -6.927 1.00 0.00 H new ATOM 0 HD2 LYS A 99 15.525 -0.332 -8.591 1.00 0.00 H new ATOM 0 HD3 LYS A 99 16.455 0.377 -7.286 1.00 0.00 H new ATOM 0 HE2 LYS A 99 17.295 -1.896 -6.648 1.00 0.00 H new ATOM 0 HE3 LYS A 99 16.362 -2.607 -7.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 18.640 -2.234 -8.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 17.598 -1.264 -9.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 18.502 -0.575 -8.271 1.00 0.00 H new ATOM 1535 N VAL A 100 13.703 0.865 -3.525 1.00 0.00 N ATOM 1536 CA VAL A 100 14.107 0.705 -2.113 1.00 0.00 C ATOM 1537 C VAL A 100 12.883 0.456 -1.206 1.00 0.00 C ATOM 1538 O VAL A 100 12.955 -0.325 -0.255 1.00 0.00 O ATOM 1539 CB VAL A 100 14.913 1.940 -1.655 1.00 0.00 C ATOM 1540 CG1 VAL A 100 15.385 1.798 -0.202 1.00 0.00 C ATOM 1541 CG2 VAL A 100 16.151 2.165 -2.533 1.00 0.00 C ATOM 0 H VAL A 100 13.886 1.786 -3.923 1.00 0.00 H new ATOM 0 HA VAL A 100 14.747 -0.173 -2.029 1.00 0.00 H new ATOM 0 HB VAL A 100 14.237 2.791 -1.744 1.00 0.00 H new ATOM 0 HG11 VAL A 100 15.949 2.685 0.086 1.00 0.00 H new ATOM 0 HG12 VAL A 100 14.520 1.689 0.453 1.00 0.00 H new ATOM 0 HG13 VAL A 100 16.022 0.918 -0.111 1.00 0.00 H new ATOM 0 HG21 VAL A 100 16.693 3.043 -2.180 1.00 0.00 H new ATOM 0 HG22 VAL A 100 16.800 1.291 -2.477 1.00 0.00 H new ATOM 0 HG23 VAL A 100 15.841 2.321 -3.566 1.00 0.00 H new ATOM 1551 N ASP A 101 11.746 1.084 -1.521 1.00 0.00 N ATOM 1552 CA ASP A 101 10.484 0.739 -0.845 1.00 0.00 C ATOM 1553 C ASP A 101 10.093 -0.736 -0.987 1.00 0.00 C ATOM 1554 O ASP A 101 9.634 -1.364 -0.033 1.00 0.00 O ATOM 1555 CB ASP A 101 9.372 1.564 -1.503 1.00 0.00 C ATOM 1556 CG ASP A 101 8.817 2.674 -0.619 1.00 0.00 C ATOM 1557 OD1 ASP A 101 8.277 2.370 0.466 1.00 0.00 O ATOM 1558 OD2 ASP A 101 8.920 3.858 -1.005 1.00 0.00 O ATOM 0 H ASP A 101 11.669 1.819 -2.224 1.00 0.00 H new ATOM 0 HA ASP A 101 10.618 0.945 0.217 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.757 2.004 -2.423 1.00 0.00 H new ATOM 0 HB3 ASP A 101 8.557 0.897 -1.785 1.00 0.00 H new ATOM 1563 N ALA A 102 10.247 -1.283 -2.191 1.00 0.00 N ATOM 1564 CA ALA A 102 9.933 -2.686 -2.433 1.00 0.00 C ATOM 1565 C ALA A 102 10.845 -3.606 -1.615 1.00 0.00 C ATOM 1566 O ALA A 102 10.389 -4.560 -0.991 1.00 0.00 O ATOM 1567 CB ALA A 102 10.180 -2.919 -3.916 1.00 0.00 C ATOM 0 H ALA A 102 10.586 -0.777 -3.010 1.00 0.00 H new ATOM 0 HA ALA A 102 8.906 -2.906 -2.143 1.00 0.00 H new ATOM 0 HB1 ALA A 102 9.961 -3.958 -4.162 1.00 0.00 H new ATOM 0 HB2 ALA A 102 9.533 -2.264 -4.500 1.00 0.00 H new ATOM 0 HB3 ALA A 102 11.222 -2.702 -4.150 1.00 0.00 H new ATOM 1573 N LEU A 103 12.138 -3.284 -1.606 1.00 0.00 N ATOM 1574 CA LEU A 103 13.115 -4.055 -0.822 1.00 0.00 C ATOM 1575 C LEU A 103 12.739 -4.164 0.662 1.00 0.00 C ATOM 1576 O LEU A 103 12.803 -5.236 1.264 1.00 0.00 O ATOM 1577 CB LEU A 103 14.482 -3.351 -0.922 1.00 0.00 C ATOM 1578 CG LEU A 103 15.680 -4.288 -0.713 1.00 0.00 C ATOM 1579 CD1 LEU A 103 15.833 -5.280 -1.870 1.00 0.00 C ATOM 1580 CD2 LEU A 103 16.963 -3.462 -0.584 1.00 0.00 C ATOM 0 H LEU A 103 12.536 -2.502 -2.126 1.00 0.00 H new ATOM 0 HA LEU A 103 13.139 -5.065 -1.232 1.00 0.00 H new ATOM 0 HB2 LEU A 103 14.567 -2.881 -1.902 1.00 0.00 H new ATOM 0 HB3 LEU A 103 14.524 -2.553 -0.181 1.00 0.00 H new ATOM 0 HG LEU A 103 15.502 -4.856 0.200 1.00 0.00 H new ATOM 0 HD11 LEU A 103 16.692 -5.925 -1.685 1.00 0.00 H new ATOM 0 HD12 LEU A 103 14.932 -5.888 -1.949 1.00 0.00 H new ATOM 0 HD13 LEU A 103 15.984 -4.733 -2.801 1.00 0.00 H new ATOM 0 HD21 LEU A 103 17.812 -4.129 -0.436 1.00 0.00 H new ATOM 0 HD22 LEU A 103 17.114 -2.880 -1.493 1.00 0.00 H new ATOM 0 HD23 LEU A 103 16.878 -2.788 0.269 1.00 0.00 H new ATOM 1592 N ILE A 104 12.391 -3.024 1.248 1.00 0.00 N ATOM 1593 CA ILE A 104 12.226 -2.942 2.704 1.00 0.00 C ATOM 1594 C ILE A 104 10.874 -3.481 3.187 1.00 0.00 C ATOM 1595 O ILE A 104 10.785 -4.128 4.231 1.00 0.00 O ATOM 1596 CB ILE A 104 12.528 -1.476 3.055 1.00 0.00 C ATOM 1597 CG1 ILE A 104 13.132 -1.376 4.467 1.00 0.00 C ATOM 1598 CG2 ILE A 104 11.322 -0.537 2.899 1.00 0.00 C ATOM 1599 CD1 ILE A 104 13.716 0.007 4.766 1.00 0.00 C ATOM 0 H ILE A 104 12.218 -2.151 0.749 1.00 0.00 H new ATOM 0 HA ILE A 104 12.912 -3.596 3.242 1.00 0.00 H new ATOM 0 HB ILE A 104 13.260 -1.131 2.325 1.00 0.00 H new ATOM 0 HG12 ILE A 104 12.363 -1.607 5.204 1.00 0.00 H new ATOM 0 HG13 ILE A 104 13.914 -2.127 4.577 1.00 0.00 H new ATOM 0 HG21 ILE A 104 11.615 0.479 3.165 1.00 0.00 H new ATOM 0 HG22 ILE A 104 10.977 -0.556 1.865 1.00 0.00 H new ATOM 0 HG23 ILE A 104 10.517 -0.866 3.556 1.00 0.00 H new ATOM 0 HD11 ILE A 104 14.127 0.018 5.775 1.00 0.00 H new ATOM 0 HD12 ILE A 104 14.506 0.231 4.050 1.00 0.00 H new ATOM 0 HD13 ILE A 104 12.931 0.759 4.686 1.00 0.00 H new ATOM 1611 N ASN A 105 9.833 -3.265 2.388 1.00 0.00 N ATOM 1612 CA ASN A 105 8.515 -3.833 2.693 1.00 0.00 C ATOM 1613 C ASN A 105 8.445 -5.354 2.484 1.00 0.00 C ATOM 1614 O ASN A 105 7.538 -5.997 3.015 1.00 0.00 O ATOM 1615 CB ASN A 105 7.462 -3.139 1.812 1.00 0.00 C ATOM 1616 CG ASN A 105 6.060 -3.243 2.412 1.00 0.00 C ATOM 1617 OD1 ASN A 105 5.276 -4.126 2.071 1.00 0.00 O ATOM 1618 ND2 ASN A 105 5.729 -2.339 3.318 1.00 0.00 N ATOM 0 H ASN A 105 9.870 -2.709 1.534 1.00 0.00 H new ATOM 0 HA ASN A 105 8.321 -3.658 3.751 1.00 0.00 H new ATOM 0 HB2 ASN A 105 7.727 -2.089 1.688 1.00 0.00 H new ATOM 0 HB3 ASN A 105 7.466 -3.588 0.819 1.00 0.00 H new ATOM 0 HD21 ASN A 105 4.806 -2.365 3.750 1.00 0.00 H new ATOM 0 HD22 ASN A 105 6.397 -1.616 3.585 1.00 0.00 H new ATOM 1625 N GLY A 106 9.369 -5.943 1.726 1.00 0.00 N ATOM 1626 CA GLY A 106 9.311 -7.397 1.512 1.00 0.00 C ATOM 1627 C GLY A 106 8.783 -7.777 0.127 1.00 0.00 C ATOM 1628 O GLY A 106 8.204 -8.849 -0.048 1.00 0.00 O ATOM 0 H GLY A 106 10.141 -5.463 1.263 1.00 0.00 H new ATOM 0 HA2 GLY A 106 10.308 -7.818 1.643 1.00 0.00 H new ATOM 0 HA3 GLY A 106 8.673 -7.846 2.274 1.00 0.00 H new ATOM 1632 N PHE A 107 9.058 -6.941 -0.867 1.00 0.00 N ATOM 1633 CA PHE A 107 8.872 -7.348 -2.263 1.00 0.00 C ATOM 1634 C PHE A 107 10.266 -7.571 -2.854 1.00 0.00 C ATOM 1635 O PHE A 107 11.259 -7.002 -2.393 1.00 0.00 O ATOM 1636 CB PHE A 107 8.158 -6.304 -3.135 1.00 0.00 C ATOM 1637 CG PHE A 107 6.764 -5.881 -2.679 1.00 0.00 C ATOM 1638 CD1 PHE A 107 6.619 -4.871 -1.776 1.00 0.00 C ATOM 1639 CD2 PHE A 107 5.655 -6.444 -3.234 1.00 0.00 C ATOM 1640 CE1 PHE A 107 5.381 -4.462 -1.396 1.00 0.00 C ATOM 1641 CE2 PHE A 107 4.416 -6.035 -2.852 1.00 0.00 C ATOM 1642 CZ PHE A 107 4.280 -5.050 -1.928 1.00 0.00 C ATOM 0 H PHE A 107 9.406 -5.990 -0.741 1.00 0.00 H new ATOM 0 HA PHE A 107 8.243 -8.238 -2.261 1.00 0.00 H new ATOM 0 HB2 PHE A 107 8.786 -5.414 -3.186 1.00 0.00 H new ATOM 0 HB3 PHE A 107 8.081 -6.699 -4.148 1.00 0.00 H new ATOM 0 HD1 PHE A 107 7.494 -4.393 -1.360 1.00 0.00 H new ATOM 0 HD2 PHE A 107 5.760 -7.218 -3.980 1.00 0.00 H new ATOM 0 HE1 PHE A 107 5.273 -3.669 -0.671 1.00 0.00 H new ATOM 0 HE2 PHE A 107 3.539 -6.494 -3.284 1.00 0.00 H new ATOM 0 HZ PHE A 107 3.295 -4.734 -1.616 1.00 0.00 H new ATOM 1652 N GLU A 108 10.332 -8.326 -3.943 1.00 0.00 N ATOM 1653 CA GLU A 108 11.501 -8.202 -4.822 1.00 0.00 C ATOM 1654 C GLU A 108 11.006 -7.783 -6.208 1.00 0.00 C ATOM 1655 O GLU A 108 9.876 -8.050 -6.616 1.00 0.00 O ATOM 1656 CB GLU A 108 12.353 -9.484 -4.830 1.00 0.00 C ATOM 1657 CG GLU A 108 11.659 -10.739 -5.376 1.00 0.00 C ATOM 1658 CD GLU A 108 12.588 -11.944 -5.314 1.00 0.00 C ATOM 1659 OE1 GLU A 108 12.604 -12.639 -4.275 1.00 0.00 O ATOM 1660 OE2 GLU A 108 13.307 -12.204 -6.304 1.00 0.00 O ATOM 0 H GLU A 108 9.628 -9.003 -4.236 1.00 0.00 H new ATOM 0 HA GLU A 108 12.178 -7.433 -4.449 1.00 0.00 H new ATOM 0 HB2 GLU A 108 13.249 -9.299 -5.423 1.00 0.00 H new ATOM 0 HB3 GLU A 108 12.681 -9.687 -3.811 1.00 0.00 H new ATOM 0 HG2 GLU A 108 10.756 -10.940 -4.799 1.00 0.00 H new ATOM 0 HG3 GLU A 108 11.347 -10.568 -6.406 1.00 0.00 H new ATOM 1667 N ILE A 109 11.895 -7.131 -6.935 1.00 0.00 N ATOM 1668 CA ILE A 109 11.486 -6.368 -8.116 1.00 0.00 C ATOM 1669 C ILE A 109 11.921 -7.081 -9.400 1.00 0.00 C ATOM 1670 O ILE A 109 12.911 -7.814 -9.443 1.00 0.00 O ATOM 1671 CB ILE A 109 12.088 -4.969 -7.878 1.00 0.00 C ATOM 1672 CG1 ILE A 109 11.680 -3.848 -8.833 1.00 0.00 C ATOM 1673 CG2 ILE A 109 13.597 -5.015 -7.916 1.00 0.00 C ATOM 1674 CD1 ILE A 109 12.220 -2.503 -8.354 1.00 0.00 C ATOM 0 H ILE A 109 12.895 -7.110 -6.738 1.00 0.00 H new ATOM 0 HA ILE A 109 10.409 -6.279 -8.255 1.00 0.00 H new ATOM 0 HB ILE A 109 11.673 -4.721 -6.901 1.00 0.00 H new ATOM 0 HG12 ILE A 109 12.058 -4.061 -9.833 1.00 0.00 H new ATOM 0 HG13 ILE A 109 10.593 -3.804 -8.905 1.00 0.00 H new ATOM 0 HG21 ILE A 109 13.996 -4.015 -7.745 1.00 0.00 H new ATOM 0 HG22 ILE A 109 13.960 -5.688 -7.139 1.00 0.00 H new ATOM 0 HG23 ILE A 109 13.926 -5.375 -8.891 1.00 0.00 H new ATOM 0 HD11 ILE A 109 11.917 -1.721 -9.050 1.00 0.00 H new ATOM 0 HD12 ILE A 109 11.821 -2.283 -7.364 1.00 0.00 H new ATOM 0 HD13 ILE A 109 13.308 -2.544 -8.306 1.00 0.00 H new ATOM 1686 N ILE A 110 11.125 -6.887 -10.444 1.00 0.00 N ATOM 1687 CA ILE A 110 11.328 -7.623 -11.700 1.00 0.00 C ATOM 1688 C ILE A 110 10.877 -6.725 -12.850 1.00 0.00 C ATOM 1689 O ILE A 110 9.759 -6.201 -12.885 1.00 0.00 O ATOM 1690 CB ILE A 110 10.620 -8.995 -11.679 1.00 0.00 C ATOM 1691 CG1 ILE A 110 10.774 -9.749 -13.012 1.00 0.00 C ATOM 1692 CG2 ILE A 110 9.136 -8.894 -11.291 1.00 0.00 C ATOM 1693 CD1 ILE A 110 10.398 -11.230 -12.901 1.00 0.00 C ATOM 0 H ILE A 110 10.340 -6.236 -10.454 1.00 0.00 H new ATOM 0 HA ILE A 110 12.383 -7.860 -11.836 1.00 0.00 H new ATOM 0 HB ILE A 110 11.124 -9.570 -10.902 1.00 0.00 H new ATOM 0 HG12 ILE A 110 10.147 -9.275 -13.767 1.00 0.00 H new ATOM 0 HG13 ILE A 110 11.805 -9.665 -13.355 1.00 0.00 H new ATOM 0 HG21 ILE A 110 8.691 -9.889 -11.293 1.00 0.00 H new ATOM 0 HG22 ILE A 110 9.049 -8.460 -10.295 1.00 0.00 H new ATOM 0 HG23 ILE A 110 8.614 -8.262 -12.009 1.00 0.00 H new ATOM 0 HD11 ILE A 110 10.526 -11.711 -13.871 1.00 0.00 H new ATOM 0 HD12 ILE A 110 11.042 -11.715 -12.167 1.00 0.00 H new ATOM 0 HD13 ILE A 110 9.358 -11.319 -12.586 1.00 0.00 H new ATOM 1705 N ASN A 111 11.799 -6.558 -13.790 1.00 0.00 N ATOM 1706 CA ASN A 111 11.549 -5.687 -14.939 1.00 0.00 C ATOM 1707 C ASN A 111 11.303 -6.534 -16.188 1.00 0.00 C ATOM 1708 O ASN A 111 12.205 -7.038 -16.858 1.00 0.00 O ATOM 1709 CB ASN A 111 12.700 -4.715 -15.153 1.00 0.00 C ATOM 1710 CG ASN A 111 12.393 -3.645 -16.201 1.00 0.00 C ATOM 1711 OD1 ASN A 111 11.527 -2.791 -16.018 1.00 0.00 O ATOM 1712 ND2 ASN A 111 13.105 -3.673 -17.315 1.00 0.00 N ATOM 0 H ASN A 111 12.715 -7.006 -13.784 1.00 0.00 H new ATOM 0 HA ASN A 111 10.657 -5.093 -14.739 1.00 0.00 H new ATOM 0 HB2 ASN A 111 12.939 -4.230 -14.207 1.00 0.00 H new ATOM 0 HB3 ASN A 111 13.586 -5.272 -15.459 1.00 0.00 H new ATOM 0 HD21 ASN A 111 12.941 -2.978 -18.043 1.00 0.00 H new ATOM 0 HD22 ASN A 111 13.818 -4.390 -17.446 1.00 0.00 H new ATOM 1719 N GLU A 112 10.022 -6.643 -16.463 1.00 0.00 N ATOM 1720 CA GLU A 112 9.539 -7.224 -17.726 1.00 0.00 C ATOM 1721 C GLU A 112 8.548 -6.218 -18.349 1.00 0.00 C ATOM 1722 O GLU A 112 8.266 -5.185 -17.734 1.00 0.00 O ATOM 1723 CB GLU A 112 8.850 -8.565 -17.407 1.00 0.00 C ATOM 1724 CG GLU A 112 9.823 -9.670 -16.976 1.00 0.00 C ATOM 1725 CD GLU A 112 10.764 -10.088 -18.100 1.00 0.00 C ATOM 1726 OE1 GLU A 112 10.304 -10.745 -19.059 1.00 0.00 O ATOM 1727 OE2 GLU A 112 11.969 -9.764 -18.030 1.00 0.00 O ATOM 0 H GLU A 112 9.280 -6.338 -15.833 1.00 0.00 H new ATOM 0 HA GLU A 112 10.349 -7.412 -18.430 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.118 -8.408 -16.615 1.00 0.00 H new ATOM 0 HB3 GLU A 112 8.301 -8.900 -18.287 1.00 0.00 H new ATOM 0 HG2 GLU A 112 10.409 -9.322 -16.126 1.00 0.00 H new ATOM 0 HG3 GLU A 112 9.256 -10.538 -16.639 1.00 0.00 H new ATOM 1734 N PRO A 113 7.977 -6.457 -19.540 1.00 0.00 N ATOM 1735 CA PRO A 113 7.070 -5.472 -20.163 1.00 0.00 C ATOM 1736 C PRO A 113 5.848 -4.969 -19.373 1.00 0.00 C ATOM 1737 O PRO A 113 5.247 -3.954 -19.726 1.00 0.00 O ATOM 1738 CB PRO A 113 6.705 -6.156 -21.477 1.00 0.00 C ATOM 1739 CG PRO A 113 7.969 -6.940 -21.838 1.00 0.00 C ATOM 1740 CD PRO A 113 8.521 -7.434 -20.500 1.00 0.00 C ATOM 0 HA PRO A 113 7.580 -4.513 -20.253 1.00 0.00 H new ATOM 0 HB2 PRO A 113 5.844 -6.815 -21.361 1.00 0.00 H new ATOM 0 HB3 PRO A 113 6.449 -5.430 -22.249 1.00 0.00 H new ATOM 0 HG2 PRO A 113 7.741 -7.773 -22.503 1.00 0.00 H new ATOM 0 HG3 PRO A 113 8.692 -6.308 -22.355 1.00 0.00 H new ATOM 0 HD2 PRO A 113 8.190 -8.448 -20.276 1.00 0.00 H new ATOM 0 HD3 PRO A 113 9.611 -7.445 -20.492 1.00 0.00 H new ATOM 1748 N ASP A 114 5.538 -5.624 -18.266 1.00 0.00 N ATOM 1749 CA ASP A 114 4.753 -4.992 -17.200 1.00 0.00 C ATOM 1750 C ASP A 114 5.682 -4.925 -15.983 1.00 0.00 C ATOM 1751 O ASP A 114 6.026 -5.954 -15.394 1.00 0.00 O ATOM 1752 CB ASP A 114 3.511 -5.833 -16.891 1.00 0.00 C ATOM 1753 CG ASP A 114 2.457 -5.750 -17.989 1.00 0.00 C ATOM 1754 OD1 ASP A 114 1.619 -4.822 -17.951 1.00 0.00 O ATOM 1755 OD2 ASP A 114 2.460 -6.612 -18.895 1.00 0.00 O ATOM 0 H ASP A 114 5.813 -6.588 -18.076 1.00 0.00 H new ATOM 0 HA ASP A 114 4.403 -4.000 -17.485 1.00 0.00 H new ATOM 0 HB2 ASP A 114 3.806 -6.873 -16.754 1.00 0.00 H new ATOM 0 HB3 ASP A 114 3.076 -5.499 -15.949 1.00 0.00 H new ATOM 1760 N TYR A 115 6.148 -3.727 -15.634 1.00 0.00 N ATOM 1761 CA TYR A 115 7.208 -3.609 -14.621 1.00 0.00 C ATOM 1762 C TYR A 115 6.585 -3.561 -13.229 1.00 0.00 C ATOM 1763 O TYR A 115 5.788 -2.660 -12.954 1.00 0.00 O ATOM 1764 CB TYR A 115 8.013 -2.337 -14.908 1.00 0.00 C ATOM 1765 CG TYR A 115 8.860 -1.860 -13.735 1.00 0.00 C ATOM 1766 CD1 TYR A 115 9.780 -2.671 -13.143 1.00 0.00 C ATOM 1767 CD2 TYR A 115 8.632 -0.621 -13.227 1.00 0.00 C ATOM 1768 CE1 TYR A 115 10.544 -2.202 -12.122 1.00 0.00 C ATOM 1769 CE2 TYR A 115 9.397 -0.149 -12.211 1.00 0.00 C ATOM 1770 CZ TYR A 115 10.375 -0.928 -11.679 1.00 0.00 C ATOM 1771 OH TYR A 115 11.149 -0.436 -10.662 1.00 0.00 O ATOM 0 H TYR A 115 5.822 -2.842 -16.023 1.00 0.00 H new ATOM 0 HA TYR A 115 7.874 -4.471 -14.661 1.00 0.00 H new ATOM 0 HB2 TYR A 115 8.664 -2.517 -15.763 1.00 0.00 H new ATOM 0 HB3 TYR A 115 7.325 -1.541 -15.193 1.00 0.00 H new ATOM 0 HD1 TYR A 115 9.902 -3.688 -13.485 1.00 0.00 H new ATOM 0 HD2 TYR A 115 7.839 -0.010 -13.633 1.00 0.00 H new ATOM 0 HE1 TYR A 115 11.284 -2.840 -11.663 1.00 0.00 H new ATOM 0 HE2 TYR A 115 9.229 0.846 -11.825 1.00 0.00 H new ATOM 0 HH TYR A 115 10.893 0.491 -10.475 1.00 0.00 H new ATOM 1781 N CYS A 116 6.823 -4.601 -12.422 1.00 0.00 N ATOM 1782 CA CYS A 116 6.405 -4.568 -11.007 1.00 0.00 C ATOM 1783 C CYS A 116 7.358 -5.348 -10.104 1.00 0.00 C ATOM 1784 O CYS A 116 8.540 -5.549 -10.388 1.00 0.00 O ATOM 1785 CB CYS A 116 4.985 -5.153 -10.873 1.00 0.00 C ATOM 1786 SG CYS A 116 4.963 -6.838 -11.535 1.00 0.00 S ATOM 0 H CYS A 116 7.292 -5.460 -12.711 1.00 0.00 H new ATOM 0 HA CYS A 116 6.421 -3.526 -10.687 1.00 0.00 H new ATOM 0 HB2 CYS A 116 4.679 -5.158 -9.827 1.00 0.00 H new ATOM 0 HB3 CYS A 116 4.271 -4.530 -11.411 1.00 0.00 H new ATOM 0 HG CYS A 116 5.137 -6.801 -12.823 1.00 0.00 H new ATOM 1792 N TRP A 117 6.762 -5.800 -8.997 1.00 0.00 N ATOM 1793 CA TRP A 117 7.476 -6.448 -7.892 1.00 0.00 C ATOM 1794 C TRP A 117 6.620 -7.675 -7.544 1.00 0.00 C ATOM 1795 O TRP A 117 5.394 -7.617 -7.636 1.00 0.00 O ATOM 1796 CB TRP A 117 7.510 -5.541 -6.644 1.00 0.00 C ATOM 1797 CG TRP A 117 7.854 -4.092 -6.878 1.00 0.00 C ATOM 1798 CD1 TRP A 117 8.531 -3.557 -7.955 1.00 0.00 C ATOM 1799 CD2 TRP A 117 7.544 -3.033 -6.084 1.00 0.00 C ATOM 1800 NE1 TRP A 117 8.676 -2.182 -7.856 1.00 0.00 N ATOM 1801 CE2 TRP A 117 8.055 -1.889 -6.649 1.00 0.00 C ATOM 1802 CE3 TRP A 117 6.890 -3.008 -4.902 1.00 0.00 C ATOM 1803 CZ2 TRP A 117 8.045 -0.722 -5.950 1.00 0.00 C ATOM 1804 CZ3 TRP A 117 6.802 -1.828 -4.246 1.00 0.00 C ATOM 1805 CH2 TRP A 117 7.446 -0.720 -4.719 1.00 0.00 C ATOM 0 H TRP A 117 5.757 -5.725 -8.841 1.00 0.00 H new ATOM 0 HA TRP A 117 8.503 -6.680 -8.175 1.00 0.00 H new ATOM 0 HB2 TRP A 117 6.534 -5.587 -6.162 1.00 0.00 H new ATOM 0 HB3 TRP A 117 8.233 -5.955 -5.941 1.00 0.00 H new ATOM 0 HD1 TRP A 117 8.905 -4.143 -8.781 1.00 0.00 H new ATOM 0 HE1 TRP A 117 9.128 -1.542 -8.509 1.00 0.00 H new ATOM 0 HE3 TRP A 117 6.450 -3.905 -4.492 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 8.495 0.173 -6.353 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 6.217 -1.761 -3.340 1.00 0.00 H new ATOM 0 HH2 TRP A 117 7.483 0.172 -4.112 1.00 0.00 H new ATOM 1816 N ILE A 118 7.214 -8.756 -7.062 1.00 0.00 N ATOM 1817 CA ILE A 118 6.413 -9.827 -6.455 1.00 0.00 C ATOM 1818 C ILE A 118 6.920 -10.032 -5.019 1.00 0.00 C ATOM 1819 O ILE A 118 8.115 -9.993 -4.724 1.00 0.00 O ATOM 1820 CB ILE A 118 6.376 -11.081 -7.355 1.00 0.00 C ATOM 1821 CG1 ILE A 118 6.145 -12.407 -6.613 1.00 0.00 C ATOM 1822 CG2 ILE A 118 7.598 -11.283 -8.241 1.00 0.00 C ATOM 1823 CD1 ILE A 118 5.254 -13.295 -7.471 1.00 0.00 C ATOM 0 H ILE A 118 8.221 -8.921 -7.074 1.00 0.00 H new ATOM 0 HA ILE A 118 5.359 -9.559 -6.379 1.00 0.00 H new ATOM 0 HB ILE A 118 5.510 -10.846 -7.975 1.00 0.00 H new ATOM 0 HG12 ILE A 118 7.096 -12.902 -6.417 1.00 0.00 H new ATOM 0 HG13 ILE A 118 5.677 -12.223 -5.646 1.00 0.00 H new ATOM 0 HG21 ILE A 118 7.473 -12.190 -8.832 1.00 0.00 H new ATOM 0 HG22 ILE A 118 7.710 -10.428 -8.907 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.488 -11.376 -7.618 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.081 -14.241 -6.958 1.00 0.00 H new ATOM 0 HD12 ILE A 118 4.301 -12.796 -7.644 1.00 0.00 H new ATOM 0 HD13 ILE A 118 5.742 -13.485 -8.427 1.00 0.00 H new ATOM 1835 N LYS A 119 5.970 -10.332 -4.142 1.00 0.00 N ATOM 1836 CA LYS A 119 6.275 -10.540 -2.719 1.00 0.00 C ATOM 1837 C LYS A 119 6.759 -11.975 -2.471 1.00 0.00 C ATOM 1838 O LYS A 119 6.197 -12.941 -2.990 1.00 0.00 O ATOM 1839 CB LYS A 119 4.986 -10.243 -1.934 1.00 0.00 C ATOM 1840 CG LYS A 119 5.163 -10.332 -0.415 1.00 0.00 C ATOM 1841 CD LYS A 119 3.862 -9.975 0.312 1.00 0.00 C ATOM 1842 CE LYS A 119 3.998 -10.078 1.834 1.00 0.00 C ATOM 1843 NZ LYS A 119 4.940 -9.074 2.361 1.00 0.00 N ATOM 0 H LYS A 119 4.984 -10.438 -4.383 1.00 0.00 H new ATOM 0 HA LYS A 119 7.078 -9.879 -2.393 1.00 0.00 H new ATOM 0 HB2 LYS A 119 4.634 -9.245 -2.193 1.00 0.00 H new ATOM 0 HB3 LYS A 119 4.211 -10.945 -2.244 1.00 0.00 H new ATOM 0 HG2 LYS A 119 5.472 -11.340 -0.140 1.00 0.00 H new ATOM 0 HG3 LYS A 119 5.958 -9.657 -0.098 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.565 -8.961 0.044 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.066 -10.639 -0.025 1.00 0.00 H new ATOM 0 HE2 LYS A 119 3.021 -9.941 2.298 1.00 0.00 H new ATOM 0 HE3 LYS A 119 4.341 -11.077 2.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 4.871 -9.044 3.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 5.910 -9.330 2.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 4.705 -8.139 1.971 1.00 0.00 H new ATOM 1857 N MET A 120 7.829 -12.097 -1.691 1.00 0.00 N ATOM 1858 CA MET A 120 8.516 -13.391 -1.548 1.00 0.00 C ATOM 1859 C MET A 120 8.399 -13.909 -0.107 1.00 0.00 C ATOM 1860 O MET A 120 8.204 -13.148 0.843 1.00 0.00 O ATOM 1861 CB MET A 120 9.981 -13.292 -2.011 1.00 0.00 C ATOM 1862 CG MET A 120 10.887 -12.407 -1.147 1.00 0.00 C ATOM 1863 SD MET A 120 10.407 -10.677 -1.291 1.00 0.00 S ATOM 1864 CE MET A 120 11.730 -9.929 -0.326 1.00 0.00 C ATOM 0 H MET A 120 8.239 -11.333 -1.153 1.00 0.00 H new ATOM 0 HA MET A 120 8.026 -14.118 -2.196 1.00 0.00 H new ATOM 0 HB2 MET A 120 10.404 -14.296 -2.040 1.00 0.00 H new ATOM 0 HB3 MET A 120 9.996 -12.911 -3.032 1.00 0.00 H new ATOM 0 HG2 MET A 120 10.825 -12.722 -0.105 1.00 0.00 H new ATOM 0 HG3 MET A 120 11.925 -12.529 -1.456 1.00 0.00 H new ATOM 0 HE1 MET A 120 11.597 -8.847 -0.304 1.00 0.00 H new ATOM 0 HE2 MET A 120 11.703 -10.319 0.692 1.00 0.00 H new ATOM 0 HE3 MET A 120 12.692 -10.167 -0.781 1.00 0.00 H new TER 1874 MET A 120