USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 694 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 45 LYS NZ :NH3+ 178:sc= 1.21 (180deg=1.17) USER MOD Set 1.2: A 59 MET CE :methyl 162:sc= 0 (180deg=-0.402) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -158:sc= -1.53! (180deg=-2.52!) USER MOD Single : A 25 LYS NZ :NH3+ -151:sc= 1.24 (180deg=1.17) USER MOD Single : A 29 GLN : amide:sc= 0.284 X(o=0.28,f=-0.16) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -80:sc= 1.08 USER MOD Single : A 35 HIS : no HD1:sc= -1.46! C(o=-1.5!,f=-3.6!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 179:sc= 0 (180deg=-0.0017) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.304 USER MOD Single : A 43 HIS : no HD1:sc= -0.141 X(o=-0.14,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 157:sc= -0.117 (180deg=-0.672) USER MOD Single : A 48 LYS NZ :NH3+ 175:sc= 2.42 (180deg=2.24) USER MOD Single : A 50 SER OG : rot 80:sc= 0.458 USER MOD Single : A 51 TYR OH : rot -130:sc= -0.146 USER MOD Single : A 52 CYS SG : rot 64:sc= -1.17! USER MOD Single : A 53 GLN : amide:sc= -0.094 K(o=-0.094,f=-1.4) USER MOD Single : A 55 GLN : amide:sc= -0.185 X(o=-0.18,f=-0.42) USER MOD Single : A 60 ASN : amide:sc= -0.502 K(o=-0.5,f=0) USER MOD Single : A 61 SER OG : rot -120:sc= 1.25 USER MOD Single : A 69 GLN : amide:sc= -0.0739 K(o=-0.074,f=-1.3!) USER MOD Single : A 74 ASN : amide:sc= -0.156 K(o=-0.16,f=-0.7) USER MOD Single : A 75 HIS : no HD1:sc= 0.56 K(o=0.56,f=-4.4!) USER MOD Single : A 76 THR OG1 : rot -60:sc= 1.11 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot -169:sc= 1.21 USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 GLN : amide:sc= 0 K(o=0,f=-0.92) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0375 USER MOD Single : B 357 ASN : amide:sc= -0.133 K(o=-0.13,f=-1.3) USER MOD Single : B 358 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 1.860 6.141 9.835 1.00 10.00 N ATOM 2 CA TYR A 21 2.204 5.322 8.652 1.00 10.00 C ATOM 3 C TYR A 21 0.943 4.781 8.003 1.00 10.00 C ATOM 4 O TYR A 21 -0.113 4.733 8.630 1.00 10.00 O ATOM 5 CB TYR A 21 3.118 4.156 9.046 1.00 10.00 C ATOM 6 CG TYR A 21 4.530 4.570 9.400 1.00 10.00 C ATOM 7 CD1 TYR A 21 5.505 4.702 8.417 1.00 10.00 C ATOM 8 CD2 TYR A 21 4.887 4.827 10.716 1.00 10.00 C ATOM 9 CE1 TYR A 21 6.796 5.077 8.739 1.00 10.00 C ATOM 10 CE2 TYR A 21 6.175 5.203 11.045 1.00 10.00 C ATOM 11 CZ TYR A 21 7.124 5.326 10.055 1.00 10.00 C ATOM 12 OH TYR A 21 8.408 5.704 10.379 1.00 10.00 O ATOM 0 HA TYR A 21 2.732 5.958 7.941 1.00 10.00 H new ATOM 0 HB2 TYR A 21 2.679 3.636 9.897 1.00 10.00 H new ATOM 0 HB3 TYR A 21 3.156 3.443 8.222 1.00 10.00 H new ATOM 0 HD1 TYR A 21 5.249 4.508 7.386 1.00 10.00 H new ATOM 0 HD2 TYR A 21 4.146 4.732 11.496 1.00 10.00 H new ATOM 0 HE1 TYR A 21 7.543 5.174 7.965 1.00 10.00 H new ATOM 0 HE2 TYR A 21 6.436 5.400 12.074 1.00 10.00 H new ATOM 0 HH TYR A 21 8.474 5.842 11.347 1.00 10.00 H new ATOM 22 N ILE A 22 1.057 4.382 6.749 1.00 10.00 N ATOM 23 CA ILE A 22 -0.072 3.837 6.012 1.00 10.00 C ATOM 24 C ILE A 22 0.234 2.403 5.600 1.00 10.00 C ATOM 25 O ILE A 22 1.186 2.153 4.860 1.00 10.00 O ATOM 26 CB ILE A 22 -0.386 4.679 4.751 1.00 10.00 C ATOM 27 CG1 ILE A 22 -0.647 6.145 5.123 1.00 10.00 C ATOM 28 CG2 ILE A 22 -1.576 4.098 3.996 1.00 10.00 C ATOM 29 CD1 ILE A 22 -1.849 6.348 6.021 1.00 10.00 C ATOM 0 H ILE A 22 1.925 4.425 6.216 1.00 10.00 H new ATOM 0 HA ILE A 22 -0.945 3.863 6.664 1.00 10.00 H new ATOM 0 HB ILE A 22 0.485 4.644 4.097 1.00 10.00 H new ATOM 0 HG12 ILE A 22 0.237 6.546 5.620 1.00 10.00 H new ATOM 0 HG13 ILE A 22 -0.788 6.722 4.209 1.00 10.00 H new ATOM 0 HG21 ILE A 22 -1.779 4.705 3.114 1.00 10.00 H new ATOM 0 HG22 ILE A 22 -1.349 3.077 3.689 1.00 10.00 H new ATOM 0 HG23 ILE A 22 -2.452 4.096 4.644 1.00 10.00 H new ATOM 0 HD11 ILE A 22 -1.966 7.410 6.238 1.00 10.00 H new ATOM 0 HD12 ILE A 22 -2.744 5.979 5.520 1.00 10.00 H new ATOM 0 HD13 ILE A 22 -1.704 5.801 6.953 1.00 10.00 H new ATOM 41 N LYS A 23 -0.551 1.463 6.096 1.00 10.00 N ATOM 42 CA LYS A 23 -0.347 0.059 5.772 1.00 10.00 C ATOM 43 C LYS A 23 -1.283 -0.381 4.654 1.00 10.00 C ATOM 44 O LYS A 23 -2.492 -0.495 4.850 1.00 10.00 O ATOM 45 CB LYS A 23 -0.555 -0.820 7.007 1.00 10.00 C ATOM 46 CG LYS A 23 0.608 -0.781 7.983 1.00 10.00 C ATOM 47 CD LYS A 23 0.235 -0.075 9.278 1.00 10.00 C ATOM 48 CE LYS A 23 -0.705 -0.918 10.129 1.00 10.00 C ATOM 49 NZ LYS A 23 -2.133 -0.631 9.842 1.00 10.00 N ATOM 0 H LYS A 23 -1.334 1.644 6.724 1.00 10.00 H new ATOM 0 HA LYS A 23 0.681 -0.058 5.431 1.00 10.00 H new ATOM 0 HB2 LYS A 23 -1.461 -0.501 7.522 1.00 10.00 H new ATOM 0 HB3 LYS A 23 -0.716 -1.850 6.687 1.00 10.00 H new ATOM 0 HG2 LYS A 23 0.932 -1.798 8.204 1.00 10.00 H new ATOM 0 HG3 LYS A 23 1.453 -0.271 7.521 1.00 10.00 H new ATOM 0 HD2 LYS A 23 1.139 0.146 9.845 1.00 10.00 H new ATOM 0 HD3 LYS A 23 -0.239 0.879 9.049 1.00 10.00 H new ATOM 0 HE2 LYS A 23 -0.506 -1.974 9.949 1.00 10.00 H new ATOM 0 HE3 LYS A 23 -0.504 -0.731 11.184 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 -2.715 -0.919 10.654 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 -2.255 0.388 9.672 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 -2.431 -1.161 8.998 1.00 10.00 H new ATOM 63 N LEU A 24 -0.716 -0.612 3.481 1.00 10.00 N ATOM 64 CA LEU A 24 -1.489 -1.044 2.328 1.00 10.00 C ATOM 65 C LEU A 24 -1.466 -2.563 2.228 1.00 10.00 C ATOM 66 O LEU A 24 -0.395 -3.175 2.235 1.00 10.00 O ATOM 67 CB LEU A 24 -0.926 -0.427 1.047 1.00 10.00 C ATOM 68 CG LEU A 24 -0.864 1.101 1.032 1.00 10.00 C ATOM 69 CD1 LEU A 24 -0.118 1.587 -0.199 1.00 10.00 C ATOM 70 CD2 LEU A 24 -2.265 1.697 1.075 1.00 10.00 C ATOM 0 H LEU A 24 0.283 -0.507 3.302 1.00 10.00 H new ATOM 0 HA LEU A 24 -2.519 -0.710 2.452 1.00 10.00 H new ATOM 0 HB2 LEU A 24 0.079 -0.817 0.886 1.00 10.00 H new ATOM 0 HB3 LEU A 24 -1.535 -0.758 0.205 1.00 10.00 H new ATOM 0 HG LEU A 24 -0.325 1.432 1.920 1.00 10.00 H new ATOM 0 HD11 LEU A 24 -0.082 2.676 -0.196 1.00 10.00 H new ATOM 0 HD12 LEU A 24 0.897 1.190 -0.189 1.00 10.00 H new ATOM 0 HD13 LEU A 24 -0.633 1.244 -1.096 1.00 10.00 H new ATOM 0 HD21 LEU A 24 -2.198 2.785 1.064 1.00 10.00 H new ATOM 0 HD22 LEU A 24 -2.831 1.359 0.207 1.00 10.00 H new ATOM 0 HD23 LEU A 24 -2.770 1.374 1.985 1.00 10.00 H new ATOM 82 N LYS A 25 -2.643 -3.169 2.146 1.00 10.00 N ATOM 83 CA LYS A 25 -2.747 -4.614 2.047 1.00 10.00 C ATOM 84 C LYS A 25 -2.904 -5.044 0.597 1.00 10.00 C ATOM 85 O LYS A 25 -3.940 -4.805 -0.028 1.00 10.00 O ATOM 86 CB LYS A 25 -3.918 -5.142 2.880 1.00 10.00 C ATOM 87 CG LYS A 25 -3.549 -5.417 4.329 1.00 10.00 C ATOM 88 CD LYS A 25 -4.647 -6.175 5.058 1.00 10.00 C ATOM 89 CE LYS A 25 -4.641 -7.658 4.713 1.00 10.00 C ATOM 90 NZ LYS A 25 -5.710 -8.402 5.433 1.00 10.00 N ATOM 0 H LYS A 25 -3.538 -2.680 2.146 1.00 10.00 H new ATOM 0 HA LYS A 25 -1.825 -5.040 2.442 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -4.732 -4.417 2.851 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -4.292 -6.060 2.427 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -2.624 -5.993 4.365 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -3.357 -4.474 4.840 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -4.520 -6.052 6.134 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -5.616 -5.747 4.801 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -4.775 -7.781 3.638 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -3.670 -8.085 4.964 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -5.407 -9.386 5.584 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -5.889 -7.950 6.352 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -6.582 -8.391 4.867 1.00 10.00 H new ATOM 104 N VAL A 26 -1.864 -5.663 0.069 1.00 10.00 N ATOM 105 CA VAL A 26 -1.862 -6.145 -1.300 1.00 10.00 C ATOM 106 C VAL A 26 -2.339 -7.589 -1.335 1.00 10.00 C ATOM 107 O VAL A 26 -1.785 -8.446 -0.646 1.00 10.00 O ATOM 108 CB VAL A 26 -0.456 -6.059 -1.932 1.00 10.00 C ATOM 109 CG1 VAL A 26 -0.552 -6.056 -3.447 1.00 10.00 C ATOM 110 CG2 VAL A 26 0.288 -4.826 -1.438 1.00 10.00 C ATOM 0 H VAL A 26 -0.998 -5.846 0.576 1.00 10.00 H new ATOM 0 HA VAL A 26 -2.535 -5.511 -1.877 1.00 10.00 H new ATOM 0 HB VAL A 26 0.109 -6.939 -1.625 1.00 10.00 H new ATOM 0 HG11 VAL A 26 0.449 -5.995 -3.875 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -1.035 -6.974 -3.783 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -1.139 -5.197 -3.773 1.00 10.00 H new ATOM 0 HG21 VAL A 26 1.276 -4.788 -1.898 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -0.272 -3.931 -1.708 1.00 10.00 H new ATOM 0 HG23 VAL A 26 0.394 -4.875 -0.354 1.00 10.00 H new ATOM 120 N ILE A 27 -3.378 -7.851 -2.111 1.00 10.00 N ATOM 121 CA ILE A 27 -3.926 -9.195 -2.214 1.00 10.00 C ATOM 122 C ILE A 27 -3.321 -9.939 -3.402 1.00 10.00 C ATOM 123 O ILE A 27 -3.538 -9.570 -4.561 1.00 10.00 O ATOM 124 CB ILE A 27 -5.468 -9.174 -2.343 1.00 10.00 C ATOM 125 CG1 ILE A 27 -6.101 -8.459 -1.142 1.00 10.00 C ATOM 126 CG2 ILE A 27 -6.014 -10.588 -2.468 1.00 10.00 C ATOM 127 CD1 ILE A 27 -5.799 -9.103 0.196 1.00 10.00 C ATOM 0 H ILE A 27 -3.859 -7.153 -2.678 1.00 10.00 H new ATOM 0 HA ILE A 27 -3.666 -9.718 -1.294 1.00 10.00 H new ATOM 0 HB ILE A 27 -5.727 -8.623 -3.247 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -5.751 -7.427 -1.123 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -7.182 -8.427 -1.281 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -7.100 -10.552 -2.558 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -5.592 -11.064 -3.353 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -5.742 -11.163 -1.583 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -6.284 -8.536 0.991 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -6.174 -10.126 0.200 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -4.722 -9.111 0.361 1.00 10.00 H new ATOM 139 N GLY A 28 -2.549 -10.976 -3.102 1.00 10.00 N ATOM 140 CA GLY A 28 -1.922 -11.766 -4.141 1.00 10.00 C ATOM 141 C GLY A 28 -2.855 -12.825 -4.693 1.00 10.00 C ATOM 142 O GLY A 28 -3.785 -13.258 -4.011 1.00 10.00 O ATOM 0 H GLY A 28 -2.346 -11.284 -2.151 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -1.600 -11.110 -4.950 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -1.027 -12.244 -3.742 1.00 10.00 H new ATOM 146 N GLN A 29 -2.594 -13.261 -5.920 1.00 10.00 N ATOM 147 CA GLN A 29 -3.423 -14.268 -6.579 1.00 10.00 C ATOM 148 C GLN A 29 -3.251 -15.640 -5.932 1.00 10.00 C ATOM 149 O GLN A 29 -4.022 -16.562 -6.193 1.00 10.00 O ATOM 150 CB GLN A 29 -3.086 -14.354 -8.068 1.00 10.00 C ATOM 151 CG GLN A 29 -3.613 -13.186 -8.892 1.00 10.00 C ATOM 152 CD GLN A 29 -2.774 -11.932 -8.749 1.00 10.00 C ATOM 153 OE1 GLN A 29 -1.790 -11.747 -9.458 1.00 10.00 O ATOM 154 NE2 GLN A 29 -3.161 -11.054 -7.838 1.00 10.00 N ATOM 0 H GLN A 29 -1.810 -12.931 -6.483 1.00 10.00 H new ATOM 0 HA GLN A 29 -4.463 -13.961 -6.465 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -2.003 -14.406 -8.182 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -3.494 -15.282 -8.469 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -3.647 -13.476 -9.942 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -4.637 -12.968 -8.589 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -3.985 -11.242 -7.266 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -2.636 -10.189 -7.707 1.00 10.00 H new ATOM 163 N ASP A 30 -2.239 -15.770 -5.092 1.00 10.00 N ATOM 164 CA ASP A 30 -1.979 -17.023 -4.402 1.00 10.00 C ATOM 165 C ASP A 30 -2.504 -16.951 -2.971 1.00 10.00 C ATOM 166 O ASP A 30 -2.069 -17.694 -2.091 1.00 10.00 O ATOM 167 CB ASP A 30 -0.483 -17.358 -4.430 1.00 10.00 C ATOM 168 CG ASP A 30 0.363 -16.401 -3.614 1.00 10.00 C ATOM 169 OD1 ASP A 30 0.161 -15.173 -3.731 1.00 10.00 O ATOM 170 OD2 ASP A 30 1.250 -16.873 -2.871 1.00 10.00 O ATOM 0 H ASP A 30 -1.582 -15.022 -4.870 1.00 10.00 H new ATOM 0 HA ASP A 30 -2.505 -17.825 -4.919 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -0.338 -18.371 -4.054 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -0.135 -17.349 -5.463 1.00 10.00 H new ATOM 175 N SER A 31 -3.459 -16.041 -2.770 1.00 10.00 N ATOM 176 CA SER A 31 -4.104 -15.830 -1.475 1.00 10.00 C ATOM 177 C SER A 31 -3.113 -15.338 -0.420 1.00 10.00 C ATOM 178 O SER A 31 -3.105 -15.815 0.714 1.00 10.00 O ATOM 179 CB SER A 31 -4.796 -17.115 -1.011 1.00 10.00 C ATOM 180 OG SER A 31 -5.694 -17.593 -2.000 1.00 10.00 O ATOM 0 H SER A 31 -3.808 -15.427 -3.506 1.00 10.00 H new ATOM 0 HA SER A 31 -4.855 -15.050 -1.601 1.00 10.00 H new ATOM 0 HB2 SER A 31 -4.048 -17.878 -0.795 1.00 10.00 H new ATOM 0 HB3 SER A 31 -5.337 -16.927 -0.084 1.00 10.00 H new ATOM 0 HG SER A 31 -6.123 -18.415 -1.683 1.00 10.00 H new ATOM 186 N SER A 32 -2.292 -14.374 -0.800 1.00 10.00 N ATOM 187 CA SER A 32 -1.310 -13.809 0.111 1.00 10.00 C ATOM 188 C SER A 32 -1.676 -12.371 0.453 1.00 10.00 C ATOM 189 O SER A 32 -2.112 -11.612 -0.416 1.00 10.00 O ATOM 190 CB SER A 32 0.078 -13.859 -0.525 1.00 10.00 C ATOM 191 OG SER A 32 0.030 -13.408 -1.869 1.00 10.00 O ATOM 0 H SER A 32 -2.286 -13.965 -1.735 1.00 10.00 H new ATOM 0 HA SER A 32 -1.302 -14.396 1.029 1.00 10.00 H new ATOM 0 HB2 SER A 32 0.768 -13.239 0.047 1.00 10.00 H new ATOM 0 HB3 SER A 32 0.462 -14.878 -0.492 1.00 10.00 H new ATOM 0 HG SER A 32 -0.291 -14.132 -2.446 1.00 10.00 H new ATOM 197 N GLU A 33 -1.527 -12.005 1.716 1.00 10.00 N ATOM 198 CA GLU A 33 -1.835 -10.654 2.147 1.00 10.00 C ATOM 199 C GLU A 33 -0.550 -9.908 2.474 1.00 10.00 C ATOM 200 O GLU A 33 0.074 -10.137 3.513 1.00 10.00 O ATOM 201 CB GLU A 33 -2.766 -10.671 3.360 1.00 10.00 C ATOM 202 CG GLU A 33 -4.031 -11.483 3.138 1.00 10.00 C ATOM 203 CD GLU A 33 -4.672 -11.924 4.433 1.00 10.00 C ATOM 204 OE1 GLU A 33 -4.549 -13.117 4.785 1.00 10.00 O ATOM 205 OE2 GLU A 33 -5.304 -11.079 5.106 1.00 10.00 O ATOM 0 H GLU A 33 -1.196 -12.623 2.457 1.00 10.00 H new ATOM 0 HA GLU A 33 -2.347 -10.138 1.335 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -2.228 -11.077 4.216 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -3.040 -9.647 3.613 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -4.745 -10.889 2.567 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -3.794 -12.361 2.537 1.00 10.00 H new ATOM 212 N ILE A 34 -0.151 -9.031 1.574 1.00 10.00 N ATOM 213 CA ILE A 34 1.067 -8.261 1.758 1.00 10.00 C ATOM 214 C ILE A 34 0.763 -6.944 2.464 1.00 10.00 C ATOM 215 O ILE A 34 -0.146 -6.220 2.072 1.00 10.00 O ATOM 216 CB ILE A 34 1.765 -7.969 0.412 1.00 10.00 C ATOM 217 CG1 ILE A 34 1.575 -9.133 -0.576 1.00 10.00 C ATOM 218 CG2 ILE A 34 3.247 -7.703 0.636 1.00 10.00 C ATOM 219 CD1 ILE A 34 2.218 -10.438 -0.141 1.00 10.00 C ATOM 0 H ILE A 34 -0.651 -8.833 0.707 1.00 10.00 H new ATOM 0 HA ILE A 34 1.739 -8.861 2.372 1.00 10.00 H new ATOM 0 HB ILE A 34 1.306 -7.081 -0.022 1.00 10.00 H new ATOM 0 HG12 ILE A 34 0.508 -9.299 -0.722 1.00 10.00 H new ATOM 0 HG13 ILE A 34 1.987 -8.844 -1.543 1.00 10.00 H new ATOM 0 HG21 ILE A 34 3.729 -7.498 -0.320 1.00 10.00 H new ATOM 0 HG22 ILE A 34 3.367 -6.842 1.294 1.00 10.00 H new ATOM 0 HG23 ILE A 34 3.708 -8.578 1.095 1.00 10.00 H new ATOM 0 HD11 ILE A 34 2.035 -11.203 -0.895 1.00 10.00 H new ATOM 0 HD12 ILE A 34 3.292 -10.293 -0.024 1.00 10.00 H new ATOM 0 HD13 ILE A 34 1.789 -10.756 0.809 1.00 10.00 H new ATOM 231 N HIS A 35 1.514 -6.651 3.513 1.00 10.00 N ATOM 232 CA HIS A 35 1.329 -5.430 4.284 1.00 10.00 C ATOM 233 C HIS A 35 2.494 -4.477 4.042 1.00 10.00 C ATOM 234 O HIS A 35 3.579 -4.654 4.599 1.00 10.00 O ATOM 235 CB HIS A 35 1.241 -5.765 5.776 1.00 10.00 C ATOM 236 CG HIS A 35 0.027 -5.213 6.468 1.00 10.00 C ATOM 237 ND1 HIS A 35 -0.372 -5.699 7.691 1.00 10.00 N ATOM 238 CD2 HIS A 35 -0.830 -4.234 6.082 1.00 10.00 C ATOM 239 CE1 HIS A 35 -1.453 -5.015 8.020 1.00 10.00 C ATOM 240 NE2 HIS A 35 -1.770 -4.119 7.079 1.00 10.00 N ATOM 0 H HIS A 35 2.266 -7.249 3.854 1.00 10.00 H new ATOM 0 HA HIS A 35 0.403 -4.950 3.967 1.00 10.00 H new ATOM 0 HB2 HIS A 35 1.249 -6.849 5.893 1.00 10.00 H new ATOM 0 HB3 HIS A 35 2.132 -5.384 6.274 1.00 10.00 H new ATOM 0 HD2 HIS A 35 -0.783 -3.658 5.170 1.00 10.00 H new ATOM 0 HE1 HIS A 35 -2.010 -5.161 8.933 1.00 10.00 H new ATOM 0 HE2 HIS A 35 -2.559 -3.473 7.097 1.00 10.00 H new ATOM 248 N PHE A 36 2.278 -3.480 3.204 1.00 10.00 N ATOM 249 CA PHE A 36 3.320 -2.513 2.903 1.00 10.00 C ATOM 250 C PHE A 36 3.159 -1.278 3.777 1.00 10.00 C ATOM 251 O PHE A 36 2.163 -0.563 3.676 1.00 10.00 O ATOM 252 CB PHE A 36 3.291 -2.121 1.423 1.00 10.00 C ATOM 253 CG PHE A 36 4.659 -2.035 0.802 1.00 10.00 C ATOM 254 CD1 PHE A 36 5.736 -1.545 1.526 1.00 10.00 C ATOM 255 CD2 PHE A 36 4.870 -2.448 -0.504 1.00 10.00 C ATOM 256 CE1 PHE A 36 6.994 -1.468 0.960 1.00 10.00 C ATOM 257 CE2 PHE A 36 6.126 -2.373 -1.077 1.00 10.00 C ATOM 258 CZ PHE A 36 7.190 -1.883 -0.344 1.00 10.00 C ATOM 0 H PHE A 36 1.394 -3.318 2.721 1.00 10.00 H new ATOM 0 HA PHE A 36 4.285 -2.974 3.115 1.00 10.00 H new ATOM 0 HB2 PHE A 36 2.695 -2.850 0.873 1.00 10.00 H new ATOM 0 HB3 PHE A 36 2.792 -1.158 1.319 1.00 10.00 H new ATOM 0 HD1 PHE A 36 5.589 -1.219 2.545 1.00 10.00 H new ATOM 0 HD2 PHE A 36 4.043 -2.833 -1.082 1.00 10.00 H new ATOM 0 HE1 PHE A 36 7.823 -1.084 1.536 1.00 10.00 H new ATOM 0 HE2 PHE A 36 6.275 -2.697 -2.096 1.00 10.00 H new ATOM 0 HZ PHE A 36 8.172 -1.824 -0.789 1.00 10.00 H new ATOM 268 N LYS A 37 4.134 -1.039 4.640 1.00 10.00 N ATOM 269 CA LYS A 37 4.106 0.106 5.538 1.00 10.00 C ATOM 270 C LYS A 37 4.732 1.317 4.854 1.00 10.00 C ATOM 271 O LYS A 37 5.956 1.434 4.785 1.00 10.00 O ATOM 272 CB LYS A 37 4.862 -0.232 6.827 1.00 10.00 C ATOM 273 CG LYS A 37 4.610 0.736 7.972 1.00 10.00 C ATOM 274 CD LYS A 37 5.464 0.396 9.186 1.00 10.00 C ATOM 275 CE LYS A 37 5.151 -0.993 9.727 1.00 10.00 C ATOM 276 NZ LYS A 37 5.973 -1.329 10.916 1.00 10.00 N ATOM 0 H LYS A 37 4.961 -1.628 4.738 1.00 10.00 H new ATOM 0 HA LYS A 37 3.073 0.345 5.789 1.00 10.00 H new ATOM 0 HB2 LYS A 37 4.581 -1.236 7.147 1.00 10.00 H new ATOM 0 HB3 LYS A 37 5.931 -0.253 6.613 1.00 10.00 H new ATOM 0 HG2 LYS A 37 4.828 1.753 7.645 1.00 10.00 H new ATOM 0 HG3 LYS A 37 3.556 0.709 8.248 1.00 10.00 H new ATOM 0 HD2 LYS A 37 6.518 0.452 8.916 1.00 10.00 H new ATOM 0 HD3 LYS A 37 5.296 1.137 9.968 1.00 10.00 H new ATOM 0 HE2 LYS A 37 4.095 -1.049 9.990 1.00 10.00 H new ATOM 0 HE3 LYS A 37 5.325 -1.733 8.946 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 5.727 -2.283 11.250 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 6.981 -1.301 10.660 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 5.789 -0.639 11.672 1.00 10.00 H new ATOM 290 N VAL A 38 3.891 2.206 4.339 1.00 10.00 N ATOM 291 CA VAL A 38 4.368 3.393 3.640 1.00 10.00 C ATOM 292 C VAL A 38 4.157 4.658 4.473 1.00 10.00 C ATOM 293 O VAL A 38 3.545 4.619 5.544 1.00 10.00 O ATOM 294 CB VAL A 38 3.676 3.553 2.262 1.00 10.00 C ATOM 295 CG1 VAL A 38 3.624 2.223 1.531 1.00 10.00 C ATOM 296 CG2 VAL A 38 2.276 4.133 2.405 1.00 10.00 C ATOM 0 H VAL A 38 2.875 2.127 4.392 1.00 10.00 H new ATOM 0 HA VAL A 38 5.438 3.257 3.481 1.00 10.00 H new ATOM 0 HB VAL A 38 4.270 4.253 1.675 1.00 10.00 H new ATOM 0 HG11 VAL A 38 3.135 2.357 0.566 1.00 10.00 H new ATOM 0 HG12 VAL A 38 4.638 1.853 1.376 1.00 10.00 H new ATOM 0 HG13 VAL A 38 3.062 1.503 2.126 1.00 10.00 H new ATOM 0 HG21 VAL A 38 1.821 4.231 1.420 1.00 10.00 H new ATOM 0 HG22 VAL A 38 1.669 3.470 3.021 1.00 10.00 H new ATOM 0 HG23 VAL A 38 2.335 5.114 2.877 1.00 10.00 H new ATOM 306 N LYS A 39 4.672 5.773 3.971 1.00 10.00 N ATOM 307 CA LYS A 39 4.556 7.057 4.646 1.00 10.00 C ATOM 308 C LYS A 39 3.885 8.066 3.712 1.00 10.00 C ATOM 309 O LYS A 39 4.065 8.006 2.493 1.00 10.00 O ATOM 310 CB LYS A 39 5.947 7.544 5.067 1.00 10.00 C ATOM 311 CG LYS A 39 5.942 8.811 5.905 1.00 10.00 C ATOM 312 CD LYS A 39 7.359 9.247 6.242 1.00 10.00 C ATOM 313 CE LYS A 39 7.419 10.707 6.658 1.00 10.00 C ATOM 314 NZ LYS A 39 8.785 11.265 6.489 1.00 10.00 N ATOM 0 H LYS A 39 5.180 5.812 3.087 1.00 10.00 H new ATOM 0 HA LYS A 39 3.942 6.951 5.541 1.00 10.00 H new ATOM 0 HB2 LYS A 39 6.440 6.752 5.631 1.00 10.00 H new ATOM 0 HB3 LYS A 39 6.544 7.718 4.172 1.00 10.00 H new ATOM 0 HG2 LYS A 39 5.432 9.607 5.363 1.00 10.00 H new ATOM 0 HG3 LYS A 39 5.382 8.641 6.824 1.00 10.00 H new ATOM 0 HD2 LYS A 39 7.749 8.624 7.047 1.00 10.00 H new ATOM 0 HD3 LYS A 39 8.003 9.089 5.377 1.00 10.00 H new ATOM 0 HE2 LYS A 39 6.712 11.285 6.063 1.00 10.00 H new ATOM 0 HE3 LYS A 39 7.112 10.803 7.699 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 8.791 12.263 6.782 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 9.455 10.728 7.076 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 9.067 11.196 5.490 1.00 10.00 H new ATOM 328 N MET A 40 3.108 8.985 4.277 1.00 10.00 N ATOM 329 CA MET A 40 2.403 9.986 3.480 1.00 10.00 C ATOM 330 C MET A 40 3.341 11.108 3.028 1.00 10.00 C ATOM 331 O MET A 40 3.327 12.213 3.581 1.00 10.00 O ATOM 332 CB MET A 40 1.221 10.561 4.267 1.00 10.00 C ATOM 333 CG MET A 40 0.327 11.477 3.444 1.00 10.00 C ATOM 334 SD MET A 40 -0.215 10.726 1.897 1.00 10.00 S ATOM 335 CE MET A 40 -1.419 9.539 2.493 1.00 10.00 C ATOM 0 H MET A 40 2.950 9.058 5.282 1.00 10.00 H new ATOM 0 HA MET A 40 2.024 9.491 2.586 1.00 10.00 H new ATOM 0 HB2 MET A 40 0.622 9.739 4.658 1.00 10.00 H new ATOM 0 HB3 MET A 40 1.602 11.115 5.125 1.00 10.00 H new ATOM 0 HG2 MET A 40 -0.547 11.750 4.035 1.00 10.00 H new ATOM 0 HG3 MET A 40 0.864 12.400 3.225 1.00 10.00 H new ATOM 0 HE1 MET A 40 -1.856 9.008 1.647 1.00 10.00 H new ATOM 0 HE2 MET A 40 -0.929 8.826 3.156 1.00 10.00 H new ATOM 0 HE3 MET A 40 -2.205 10.061 3.039 1.00 10.00 H new ATOM 345 N THR A 41 4.160 10.800 2.026 1.00 10.00 N ATOM 346 CA THR A 41 5.109 11.751 1.447 1.00 10.00 C ATOM 347 C THR A 41 6.058 11.028 0.497 1.00 10.00 C ATOM 348 O THR A 41 6.602 11.628 -0.430 1.00 10.00 O ATOM 349 CB THR A 41 5.925 12.517 2.520 1.00 10.00 C ATOM 350 OG1 THR A 41 6.707 13.549 1.905 1.00 10.00 O ATOM 351 CG2 THR A 41 6.836 11.585 3.300 1.00 10.00 C ATOM 0 H THR A 41 4.185 9.879 1.589 1.00 10.00 H new ATOM 0 HA THR A 41 4.522 12.490 0.902 1.00 10.00 H new ATOM 0 HB THR A 41 5.215 12.962 3.217 1.00 10.00 H new ATOM 0 HG1 THR A 41 7.217 14.027 2.592 1.00 10.00 H new ATOM 0 HG21 THR A 41 7.392 12.157 4.043 1.00 10.00 H new ATOM 0 HG22 THR A 41 6.236 10.825 3.801 1.00 10.00 H new ATOM 0 HG23 THR A 41 7.535 11.103 2.616 1.00 10.00 H new ATOM 359 N THR A 42 6.250 9.739 0.736 1.00 10.00 N ATOM 360 CA THR A 42 7.117 8.933 -0.101 1.00 10.00 C ATOM 361 C THR A 42 6.437 8.636 -1.433 1.00 10.00 C ATOM 362 O THR A 42 5.257 8.272 -1.474 1.00 10.00 O ATOM 363 CB THR A 42 7.481 7.618 0.606 1.00 10.00 C ATOM 364 OG1 THR A 42 7.536 7.848 2.015 1.00 10.00 O ATOM 365 CG2 THR A 42 8.818 7.080 0.119 1.00 10.00 C ATOM 0 H THR A 42 5.814 9.231 1.506 1.00 10.00 H new ATOM 0 HA THR A 42 8.033 9.494 -0.287 1.00 10.00 H new ATOM 0 HB THR A 42 6.718 6.875 0.375 1.00 10.00 H new ATOM 0 HG1 THR A 42 7.766 7.013 2.474 1.00 10.00 H new ATOM 0 HG21 THR A 42 9.047 6.149 0.638 1.00 10.00 H new ATOM 0 HG22 THR A 42 8.766 6.894 -0.954 1.00 10.00 H new ATOM 0 HG23 THR A 42 9.600 7.811 0.323 1.00 10.00 H new ATOM 373 N HIS A 43 7.179 8.803 -2.514 1.00 10.00 N ATOM 374 CA HIS A 43 6.648 8.572 -3.847 1.00 10.00 C ATOM 375 C HIS A 43 6.411 7.088 -4.078 1.00 10.00 C ATOM 376 O HIS A 43 7.186 6.247 -3.618 1.00 10.00 O ATOM 377 CB HIS A 43 7.605 9.125 -4.904 1.00 10.00 C ATOM 378 CG HIS A 43 7.852 10.596 -4.769 1.00 10.00 C ATOM 379 ND1 HIS A 43 9.046 11.157 -5.139 1.00 10.00 N ATOM 380 CD2 HIS A 43 7.034 11.569 -4.296 1.00 10.00 C ATOM 381 CE1 HIS A 43 8.936 12.448 -4.881 1.00 10.00 C ATOM 382 NE2 HIS A 43 7.732 12.744 -4.371 1.00 10.00 N ATOM 0 H HIS A 43 8.155 9.099 -2.495 1.00 10.00 H new ATOM 0 HA HIS A 43 5.694 9.092 -3.932 1.00 10.00 H new ATOM 0 HB2 HIS A 43 8.556 8.596 -4.835 1.00 10.00 H new ATOM 0 HB3 HIS A 43 7.198 8.921 -5.894 1.00 10.00 H new ATOM 0 HD2 HIS A 43 6.026 11.441 -3.930 1.00 10.00 H new ATOM 0 HE1 HIS A 43 9.717 13.173 -5.058 1.00 10.00 H new ATOM 0 HE2 HIS A 43 7.400 13.667 -4.092 1.00 10.00 H new ATOM 390 N LEU A 44 5.345 6.770 -4.805 1.00 10.00 N ATOM 391 CA LEU A 44 4.999 5.383 -5.093 1.00 10.00 C ATOM 392 C LEU A 44 6.008 4.754 -6.045 1.00 10.00 C ATOM 393 O LEU A 44 5.981 3.546 -6.280 1.00 10.00 O ATOM 394 CB LEU A 44 3.581 5.293 -5.662 1.00 10.00 C ATOM 395 CG LEU A 44 2.465 5.526 -4.637 1.00 10.00 C ATOM 396 CD1 LEU A 44 1.112 5.613 -5.322 1.00 10.00 C ATOM 397 CD2 LEU A 44 2.457 4.419 -3.587 1.00 10.00 C ATOM 0 H LEU A 44 4.705 7.455 -5.206 1.00 10.00 H new ATOM 0 HA LEU A 44 5.030 4.823 -4.159 1.00 10.00 H new ATOM 0 HB2 LEU A 44 3.478 6.024 -6.464 1.00 10.00 H new ATOM 0 HB3 LEU A 44 3.445 4.308 -6.110 1.00 10.00 H new ATOM 0 HG LEU A 44 2.659 6.475 -4.138 1.00 10.00 H new ATOM 0 HD11 LEU A 44 0.336 5.778 -4.575 1.00 10.00 H new ATOM 0 HD12 LEU A 44 1.116 6.441 -6.031 1.00 10.00 H new ATOM 0 HD13 LEU A 44 0.912 4.682 -5.853 1.00 10.00 H new ATOM 0 HD21 LEU A 44 1.658 4.604 -2.870 1.00 10.00 H new ATOM 0 HD22 LEU A 44 2.293 3.457 -4.073 1.00 10.00 H new ATOM 0 HD23 LEU A 44 3.415 4.404 -3.067 1.00 10.00 H new ATOM 409 N LYS A 45 6.897 5.584 -6.582 1.00 10.00 N ATOM 410 CA LYS A 45 7.945 5.121 -7.478 1.00 10.00 C ATOM 411 C LYS A 45 8.797 4.074 -6.768 1.00 10.00 C ATOM 412 O LYS A 45 8.957 2.955 -7.252 1.00 10.00 O ATOM 413 CB LYS A 45 8.819 6.303 -7.920 1.00 10.00 C ATOM 414 CG LYS A 45 10.094 5.894 -8.644 1.00 10.00 C ATOM 415 CD LYS A 45 9.804 5.449 -10.064 1.00 10.00 C ATOM 416 CE LYS A 45 10.989 4.724 -10.674 1.00 10.00 C ATOM 417 NZ LYS A 45 10.789 4.463 -12.123 1.00 10.00 N ATOM 0 H LYS A 45 6.910 6.589 -6.408 1.00 10.00 H new ATOM 0 HA LYS A 45 7.491 4.673 -8.362 1.00 10.00 H new ATOM 0 HB2 LYS A 45 8.234 6.950 -8.574 1.00 10.00 H new ATOM 0 HB3 LYS A 45 9.085 6.893 -7.043 1.00 10.00 H new ATOM 0 HG2 LYS A 45 10.791 6.732 -8.659 1.00 10.00 H new ATOM 0 HG3 LYS A 45 10.580 5.085 -8.099 1.00 10.00 H new ATOM 0 HD2 LYS A 45 8.933 4.794 -10.070 1.00 10.00 H new ATOM 0 HD3 LYS A 45 9.554 6.317 -10.674 1.00 10.00 H new ATOM 0 HE2 LYS A 45 11.891 5.319 -10.533 1.00 10.00 H new ATOM 0 HE3 LYS A 45 11.145 3.780 -10.153 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 11.633 3.997 -12.512 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 9.962 3.846 -12.254 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 10.631 5.363 -12.619 1.00 10.00 H new ATOM 431 N LYS A 46 9.306 4.448 -5.596 1.00 10.00 N ATOM 432 CA LYS A 46 10.136 3.566 -4.787 1.00 10.00 C ATOM 433 C LYS A 46 9.355 2.316 -4.384 1.00 10.00 C ATOM 434 O LYS A 46 9.873 1.202 -4.435 1.00 10.00 O ATOM 435 CB LYS A 46 10.616 4.319 -3.537 1.00 10.00 C ATOM 436 CG LYS A 46 11.198 3.423 -2.451 1.00 10.00 C ATOM 437 CD LYS A 46 12.684 3.166 -2.658 1.00 10.00 C ATOM 438 CE LYS A 46 13.525 4.368 -2.253 1.00 10.00 C ATOM 439 NZ LYS A 46 13.352 4.714 -0.815 1.00 10.00 N ATOM 0 H LYS A 46 9.154 5.368 -5.184 1.00 10.00 H new ATOM 0 HA LYS A 46 11.000 3.254 -5.374 1.00 10.00 H new ATOM 0 HB2 LYS A 46 11.370 5.048 -3.833 1.00 10.00 H new ATOM 0 HB3 LYS A 46 9.779 4.879 -3.120 1.00 10.00 H new ATOM 0 HG2 LYS A 46 11.043 3.887 -1.477 1.00 10.00 H new ATOM 0 HG3 LYS A 46 10.664 2.473 -2.440 1.00 10.00 H new ATOM 0 HD2 LYS A 46 12.988 2.296 -2.075 1.00 10.00 H new ATOM 0 HD3 LYS A 46 12.870 2.928 -3.705 1.00 10.00 H new ATOM 0 HE2 LYS A 46 14.576 4.158 -2.451 1.00 10.00 H new ATOM 0 HE3 LYS A 46 13.250 5.226 -2.867 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 14.182 5.245 -0.483 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 12.499 5.297 -0.698 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 13.254 3.842 -0.257 1.00 10.00 H new ATOM 453 N LEU A 47 8.095 2.515 -4.013 1.00 10.00 N ATOM 454 CA LEU A 47 7.228 1.419 -3.589 1.00 10.00 C ATOM 455 C LEU A 47 7.097 0.353 -4.675 1.00 10.00 C ATOM 456 O LEU A 47 7.137 -0.845 -4.387 1.00 10.00 O ATOM 457 CB LEU A 47 5.836 1.951 -3.215 1.00 10.00 C ATOM 458 CG LEU A 47 5.694 2.511 -1.792 1.00 10.00 C ATOM 459 CD1 LEU A 47 6.225 1.523 -0.770 1.00 10.00 C ATOM 460 CD2 LEU A 47 6.406 3.848 -1.657 1.00 10.00 C ATOM 0 H LEU A 47 7.648 3.432 -3.997 1.00 10.00 H new ATOM 0 HA LEU A 47 7.687 0.959 -2.714 1.00 10.00 H new ATOM 0 HB2 LEU A 47 5.565 2.735 -3.922 1.00 10.00 H new ATOM 0 HB3 LEU A 47 5.114 1.145 -3.341 1.00 10.00 H new ATOM 0 HG LEU A 47 4.633 2.670 -1.601 1.00 10.00 H new ATOM 0 HD11 LEU A 47 6.115 1.940 0.231 1.00 10.00 H new ATOM 0 HD12 LEU A 47 5.664 0.591 -0.839 1.00 10.00 H new ATOM 0 HD13 LEU A 47 7.279 1.327 -0.967 1.00 10.00 H new ATOM 0 HD21 LEU A 47 6.289 4.221 -0.640 1.00 10.00 H new ATOM 0 HD22 LEU A 47 7.466 3.720 -1.877 1.00 10.00 H new ATOM 0 HD23 LEU A 47 5.974 4.563 -2.358 1.00 10.00 H new ATOM 472 N LYS A 48 6.955 0.792 -5.918 1.00 10.00 N ATOM 473 CA LYS A 48 6.818 -0.127 -7.042 1.00 10.00 C ATOM 474 C LYS A 48 8.117 -0.887 -7.299 1.00 10.00 C ATOM 475 O LYS A 48 8.093 -2.043 -7.723 1.00 10.00 O ATOM 476 CB LYS A 48 6.396 0.629 -8.307 1.00 10.00 C ATOM 477 CG LYS A 48 4.995 1.216 -8.229 1.00 10.00 C ATOM 478 CD LYS A 48 4.646 2.021 -9.475 1.00 10.00 C ATOM 479 CE LYS A 48 4.505 1.131 -10.702 1.00 10.00 C ATOM 480 NZ LYS A 48 4.099 1.902 -11.907 1.00 10.00 N ATOM 0 H LYS A 48 6.932 1.779 -6.175 1.00 10.00 H new ATOM 0 HA LYS A 48 6.044 -0.850 -6.784 1.00 10.00 H new ATOM 0 HB2 LYS A 48 7.108 1.433 -8.493 1.00 10.00 H new ATOM 0 HB3 LYS A 48 6.450 -0.048 -9.159 1.00 10.00 H new ATOM 0 HG2 LYS A 48 4.271 0.411 -8.102 1.00 10.00 H new ATOM 0 HG3 LYS A 48 4.918 1.856 -7.350 1.00 10.00 H new ATOM 0 HD2 LYS A 48 3.714 2.562 -9.309 1.00 10.00 H new ATOM 0 HD3 LYS A 48 5.420 2.767 -9.654 1.00 10.00 H new ATOM 0 HE2 LYS A 48 5.453 0.628 -10.896 1.00 10.00 H new ATOM 0 HE3 LYS A 48 3.767 0.354 -10.503 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 4.097 1.274 -12.736 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 3.145 2.291 -11.765 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 4.771 2.680 -12.064 1.00 10.00 H new ATOM 494 N GLU A 49 9.243 -0.245 -7.026 1.00 10.00 N ATOM 495 CA GLU A 49 10.546 -0.859 -7.244 1.00 10.00 C ATOM 496 C GLU A 49 10.858 -1.896 -6.167 1.00 10.00 C ATOM 497 O GLU A 49 11.188 -3.045 -6.474 1.00 10.00 O ATOM 498 CB GLU A 49 11.636 0.215 -7.275 1.00 10.00 C ATOM 499 CG GLU A 49 11.383 1.299 -8.312 1.00 10.00 C ATOM 500 CD GLU A 49 12.521 2.291 -8.431 1.00 10.00 C ATOM 501 OE1 GLU A 49 12.628 3.190 -7.573 1.00 10.00 O ATOM 502 OE2 GLU A 49 13.303 2.184 -9.401 1.00 10.00 O ATOM 0 H GLU A 49 9.281 0.703 -6.652 1.00 10.00 H new ATOM 0 HA GLU A 49 10.521 -1.371 -8.206 1.00 10.00 H new ATOM 0 HB2 GLU A 49 11.711 0.675 -6.290 1.00 10.00 H new ATOM 0 HB3 GLU A 49 12.596 -0.258 -7.480 1.00 10.00 H new ATOM 0 HG2 GLU A 49 11.214 0.832 -9.282 1.00 10.00 H new ATOM 0 HG3 GLU A 49 10.469 1.834 -8.053 1.00 10.00 H new ATOM 509 N SER A 50 10.730 -1.493 -4.908 1.00 10.00 N ATOM 510 CA SER A 50 11.013 -2.374 -3.779 1.00 10.00 C ATOM 511 C SER A 50 10.101 -3.605 -3.760 1.00 10.00 C ATOM 512 O SER A 50 10.523 -4.690 -3.352 1.00 10.00 O ATOM 513 CB SER A 50 10.873 -1.595 -2.473 1.00 10.00 C ATOM 514 OG SER A 50 11.536 -0.347 -2.565 1.00 10.00 O ATOM 0 H SER A 50 10.430 -0.555 -4.641 1.00 10.00 H new ATOM 0 HA SER A 50 12.036 -2.734 -3.888 1.00 10.00 H new ATOM 0 HB2 SER A 50 9.818 -1.437 -2.248 1.00 10.00 H new ATOM 0 HB3 SER A 50 11.291 -2.175 -1.650 1.00 10.00 H new ATOM 0 HG SER A 50 10.968 0.291 -3.046 1.00 10.00 H new ATOM 520 N TYR A 51 8.859 -3.442 -4.204 1.00 10.00 N ATOM 521 CA TYR A 51 7.914 -4.553 -4.224 1.00 10.00 C ATOM 522 C TYR A 51 8.395 -5.655 -5.160 1.00 10.00 C ATOM 523 O TYR A 51 8.379 -6.834 -4.804 1.00 10.00 O ATOM 524 CB TYR A 51 6.526 -4.081 -4.651 1.00 10.00 C ATOM 525 CG TYR A 51 5.439 -5.112 -4.420 1.00 10.00 C ATOM 526 CD1 TYR A 51 4.818 -5.227 -3.182 1.00 10.00 C ATOM 527 CD2 TYR A 51 5.035 -5.970 -5.437 1.00 10.00 C ATOM 528 CE1 TYR A 51 3.829 -6.168 -2.964 1.00 10.00 C ATOM 529 CE2 TYR A 51 4.046 -6.911 -5.226 1.00 10.00 C ATOM 530 CZ TYR A 51 3.447 -7.005 -3.989 1.00 10.00 C ATOM 531 OH TYR A 51 2.466 -7.944 -3.776 1.00 10.00 O ATOM 0 H TYR A 51 8.485 -2.559 -4.552 1.00 10.00 H new ATOM 0 HA TYR A 51 7.851 -4.953 -3.212 1.00 10.00 H new ATOM 0 HB2 TYR A 51 6.276 -3.172 -4.104 1.00 10.00 H new ATOM 0 HB3 TYR A 51 6.549 -3.820 -5.709 1.00 10.00 H new ATOM 0 HD1 TYR A 51 5.113 -4.570 -2.377 1.00 10.00 H new ATOM 0 HD2 TYR A 51 5.502 -5.899 -6.408 1.00 10.00 H new ATOM 0 HE1 TYR A 51 3.358 -6.246 -1.995 1.00 10.00 H new ATOM 0 HE2 TYR A 51 3.744 -7.570 -6.027 1.00 10.00 H new ATOM 0 HH TYR A 51 2.777 -8.819 -4.089 1.00 10.00 H new ATOM 541 N CYS A 52 8.832 -5.263 -6.352 1.00 10.00 N ATOM 542 CA CYS A 52 9.322 -6.218 -7.338 1.00 10.00 C ATOM 543 C CYS A 52 10.548 -6.952 -6.799 1.00 10.00 C ATOM 544 O CYS A 52 10.717 -8.154 -7.016 1.00 10.00 O ATOM 545 CB CYS A 52 9.658 -5.503 -8.651 1.00 10.00 C ATOM 546 SG CYS A 52 8.292 -4.533 -9.335 1.00 10.00 S ATOM 0 H CYS A 52 8.857 -4.290 -6.658 1.00 10.00 H new ATOM 0 HA CYS A 52 8.539 -6.950 -7.535 1.00 10.00 H new ATOM 0 HB2 CYS A 52 10.510 -4.844 -8.485 1.00 10.00 H new ATOM 0 HB3 CYS A 52 9.967 -6.245 -9.387 1.00 10.00 H new ATOM 0 HG CYS A 52 7.996 -3.565 -8.519 1.00 10.00 H new ATOM 552 N GLN A 53 11.381 -6.220 -6.065 1.00 10.00 N ATOM 553 CA GLN A 53 12.589 -6.783 -5.476 1.00 10.00 C ATOM 554 C GLN A 53 12.243 -7.896 -4.493 1.00 10.00 C ATOM 555 O GLN A 53 12.881 -8.951 -4.479 1.00 10.00 O ATOM 556 CB GLN A 53 13.386 -5.692 -4.764 1.00 10.00 C ATOM 557 CG GLN A 53 13.965 -4.650 -5.704 1.00 10.00 C ATOM 558 CD GLN A 53 14.747 -3.578 -4.972 1.00 10.00 C ATOM 559 OE1 GLN A 53 14.449 -3.251 -3.824 1.00 10.00 O ATOM 560 NE2 GLN A 53 15.761 -3.032 -5.623 1.00 10.00 N ATOM 0 H GLN A 53 11.239 -5.230 -5.864 1.00 10.00 H new ATOM 0 HA GLN A 53 13.195 -7.204 -6.278 1.00 10.00 H new ATOM 0 HB2 GLN A 53 12.740 -5.196 -4.039 1.00 10.00 H new ATOM 0 HB3 GLN A 53 14.198 -6.155 -4.203 1.00 10.00 H new ATOM 0 HG2 GLN A 53 14.616 -5.140 -6.427 1.00 10.00 H new ATOM 0 HG3 GLN A 53 13.156 -4.184 -6.267 1.00 10.00 H new ATOM 0 HE21 GLN A 53 15.976 -3.330 -6.574 1.00 10.00 H new ATOM 0 HE22 GLN A 53 16.328 -2.313 -5.174 1.00 10.00 H new ATOM 569 N ARG A 54 11.219 -7.658 -3.680 1.00 10.00 N ATOM 570 CA ARG A 54 10.777 -8.639 -2.695 1.00 10.00 C ATOM 571 C ARG A 54 10.144 -9.840 -3.389 1.00 10.00 C ATOM 572 O ARG A 54 10.261 -10.971 -2.926 1.00 10.00 O ATOM 573 CB ARG A 54 9.782 -8.007 -1.721 1.00 10.00 C ATOM 574 CG ARG A 54 9.520 -8.848 -0.480 1.00 10.00 C ATOM 575 CD ARG A 54 8.706 -8.074 0.545 1.00 10.00 C ATOM 576 NE ARG A 54 8.475 -8.838 1.772 1.00 10.00 N ATOM 577 CZ ARG A 54 9.325 -8.885 2.796 1.00 10.00 C ATOM 578 NH1 ARG A 54 10.464 -8.204 2.752 1.00 10.00 N ATOM 579 NH2 ARG A 54 9.026 -9.602 3.875 1.00 10.00 N ATOM 0 H ARG A 54 10.679 -6.793 -3.684 1.00 10.00 H new ATOM 0 HA ARG A 54 11.647 -8.979 -2.133 1.00 10.00 H new ATOM 0 HB2 ARG A 54 10.158 -7.031 -1.414 1.00 10.00 H new ATOM 0 HB3 ARG A 54 8.838 -7.837 -2.239 1.00 10.00 H new ATOM 0 HG2 ARG A 54 8.988 -9.758 -0.759 1.00 10.00 H new ATOM 0 HG3 ARG A 54 10.468 -9.156 -0.039 1.00 10.00 H new ATOM 0 HD2 ARG A 54 9.224 -7.147 0.790 1.00 10.00 H new ATOM 0 HD3 ARG A 54 7.747 -7.797 0.108 1.00 10.00 H new ATOM 0 HE ARG A 54 7.607 -9.369 1.848 1.00 10.00 H new ATOM 0 HH11 ARG A 54 10.691 -7.642 1.932 1.00 10.00 H new ATOM 0 HH12 ARG A 54 11.112 -8.243 3.539 1.00 10.00 H new ATOM 0 HH21 ARG A 54 8.146 -10.116 3.918 1.00 10.00 H new ATOM 0 HH22 ARG A 54 9.677 -9.638 4.660 1.00 10.00 H new ATOM 593 N GLN A 55 9.482 -9.584 -4.513 1.00 10.00 N ATOM 594 CA GLN A 55 8.839 -10.644 -5.281 1.00 10.00 C ATOM 595 C GLN A 55 9.876 -11.467 -6.037 1.00 10.00 C ATOM 596 O GLN A 55 9.592 -12.572 -6.500 1.00 10.00 O ATOM 597 CB GLN A 55 7.824 -10.056 -6.262 1.00 10.00 C ATOM 598 CG GLN A 55 6.586 -9.485 -5.592 1.00 10.00 C ATOM 599 CD GLN A 55 5.792 -10.535 -4.838 1.00 10.00 C ATOM 600 OE1 GLN A 55 6.019 -10.769 -3.652 1.00 10.00 O ATOM 601 NE2 GLN A 55 4.859 -11.180 -5.522 1.00 10.00 N ATOM 0 H GLN A 55 9.377 -8.651 -4.912 1.00 10.00 H new ATOM 0 HA GLN A 55 8.316 -11.297 -4.583 1.00 10.00 H new ATOM 0 HB2 GLN A 55 8.307 -9.270 -6.843 1.00 10.00 H new ATOM 0 HB3 GLN A 55 7.521 -10.832 -6.965 1.00 10.00 H new ATOM 0 HG2 GLN A 55 6.883 -8.695 -4.902 1.00 10.00 H new ATOM 0 HG3 GLN A 55 5.948 -9.026 -6.347 1.00 10.00 H new ATOM 0 HE21 GLN A 55 4.701 -10.957 -6.505 1.00 10.00 H new ATOM 0 HE22 GLN A 55 4.298 -11.900 -5.066 1.00 10.00 H new ATOM 610 N GLY A 56 11.079 -10.919 -6.161 1.00 10.00 N ATOM 611 CA GLY A 56 12.147 -11.616 -6.848 1.00 10.00 C ATOM 612 C GLY A 56 12.031 -11.530 -8.353 1.00 10.00 C ATOM 613 O GLY A 56 12.442 -12.449 -9.066 1.00 10.00 O ATOM 0 H GLY A 56 11.333 -10.001 -5.796 1.00 10.00 H new ATOM 0 HA2 GLY A 56 13.105 -11.199 -6.538 1.00 10.00 H new ATOM 0 HA3 GLY A 56 12.143 -12.664 -6.547 1.00 10.00 H new ATOM 617 N VAL A 57 11.473 -10.430 -8.835 1.00 10.00 N ATOM 618 CA VAL A 57 11.300 -10.218 -10.263 1.00 10.00 C ATOM 619 C VAL A 57 11.661 -8.782 -10.630 1.00 10.00 C ATOM 620 O VAL A 57 11.600 -7.894 -9.783 1.00 10.00 O ATOM 621 CB VAL A 57 9.848 -10.509 -10.717 1.00 10.00 C ATOM 622 CG1 VAL A 57 9.587 -12.008 -10.774 1.00 10.00 C ATOM 623 CG2 VAL A 57 8.846 -9.825 -9.797 1.00 10.00 C ATOM 0 H VAL A 57 11.130 -9.666 -8.253 1.00 10.00 H new ATOM 0 HA VAL A 57 11.965 -10.913 -10.776 1.00 10.00 H new ATOM 0 HB VAL A 57 9.722 -10.103 -11.721 1.00 10.00 H new ATOM 0 HG11 VAL A 57 8.561 -12.187 -11.095 1.00 10.00 H new ATOM 0 HG12 VAL A 57 10.275 -12.470 -11.482 1.00 10.00 H new ATOM 0 HG13 VAL A 57 9.738 -12.442 -9.785 1.00 10.00 H new ATOM 0 HG21 VAL A 57 7.833 -10.044 -10.135 1.00 10.00 H new ATOM 0 HG22 VAL A 57 8.976 -10.193 -8.779 1.00 10.00 H new ATOM 0 HG23 VAL A 57 9.011 -8.748 -9.817 1.00 10.00 H new ATOM 633 N PRO A 58 12.064 -8.540 -11.888 1.00 10.00 N ATOM 634 CA PRO A 58 12.422 -7.196 -12.355 1.00 10.00 C ATOM 635 C PRO A 58 11.244 -6.231 -12.263 1.00 10.00 C ATOM 636 O PRO A 58 10.087 -6.646 -12.291 1.00 10.00 O ATOM 637 CB PRO A 58 12.822 -7.411 -13.823 1.00 10.00 C ATOM 638 CG PRO A 58 12.232 -8.724 -14.203 1.00 10.00 C ATOM 639 CD PRO A 58 12.217 -9.550 -12.949 1.00 10.00 C ATOM 0 HA PRO A 58 13.214 -6.753 -11.751 1.00 10.00 H new ATOM 0 HB2 PRO A 58 12.440 -6.610 -14.456 1.00 10.00 H new ATOM 0 HB3 PRO A 58 13.906 -7.419 -13.938 1.00 10.00 H new ATOM 0 HG2 PRO A 58 11.225 -8.599 -14.600 1.00 10.00 H new ATOM 0 HG3 PRO A 58 12.823 -9.207 -14.981 1.00 10.00 H new ATOM 0 HD2 PRO A 58 11.394 -10.265 -12.947 1.00 10.00 H new ATOM 0 HD3 PRO A 58 13.137 -10.122 -12.832 1.00 10.00 H new ATOM 647 N MET A 59 11.536 -4.943 -12.149 1.00 10.00 N ATOM 648 CA MET A 59 10.487 -3.937 -12.045 1.00 10.00 C ATOM 649 C MET A 59 9.683 -3.848 -13.343 1.00 10.00 C ATOM 650 O MET A 59 10.162 -4.254 -14.401 1.00 10.00 O ATOM 651 CB MET A 59 11.088 -2.566 -11.711 1.00 10.00 C ATOM 652 CG MET A 59 10.056 -1.542 -11.258 1.00 10.00 C ATOM 653 SD MET A 59 10.506 0.148 -11.688 1.00 10.00 S ATOM 654 CE MET A 59 9.034 1.025 -11.162 1.00 10.00 C ATOM 0 H MET A 59 12.485 -4.571 -12.126 1.00 10.00 H new ATOM 0 HA MET A 59 9.816 -4.237 -11.240 1.00 10.00 H new ATOM 0 HB2 MET A 59 11.835 -2.688 -10.927 1.00 10.00 H new ATOM 0 HB3 MET A 59 11.607 -2.182 -12.589 1.00 10.00 H new ATOM 0 HG2 MET A 59 9.093 -1.781 -11.708 1.00 10.00 H new ATOM 0 HG3 MET A 59 9.930 -1.615 -10.178 1.00 10.00 H new ATOM 0 HE1 MET A 59 9.260 2.086 -11.058 1.00 10.00 H new ATOM 0 HE2 MET A 59 8.247 0.893 -11.905 1.00 10.00 H new ATOM 0 HE3 MET A 59 8.698 0.630 -10.203 1.00 10.00 H new ATOM 664 N ASN A 60 8.449 -3.341 -13.229 1.00 10.00 N ATOM 665 CA ASN A 60 7.535 -3.158 -14.367 1.00 10.00 C ATOM 666 C ASN A 60 6.884 -4.476 -14.782 1.00 10.00 C ATOM 667 O ASN A 60 6.142 -4.530 -15.759 1.00 10.00 O ATOM 668 CB ASN A 60 8.249 -2.509 -15.566 1.00 10.00 C ATOM 669 CG ASN A 60 7.306 -1.718 -16.457 1.00 10.00 C ATOM 670 OD1 ASN A 60 6.982 -0.566 -16.167 1.00 10.00 O ATOM 671 ND2 ASN A 60 6.873 -2.322 -17.555 1.00 10.00 N ATOM 0 H ASN A 60 8.052 -3.043 -12.338 1.00 10.00 H new ATOM 0 HA ASN A 60 6.747 -2.482 -14.036 1.00 10.00 H new ATOM 0 HB2 ASN A 60 9.035 -1.849 -15.200 1.00 10.00 H new ATOM 0 HB3 ASN A 60 8.734 -3.285 -16.157 1.00 10.00 H new ATOM 0 HD21 ASN A 60 6.248 -1.831 -18.195 1.00 10.00 H new ATOM 0 HD22 ASN A 60 7.164 -3.278 -17.760 1.00 10.00 H new ATOM 678 N SER A 61 7.152 -5.539 -14.037 1.00 10.00 N ATOM 679 CA SER A 61 6.567 -6.838 -14.338 1.00 10.00 C ATOM 680 C SER A 61 5.216 -6.973 -13.646 1.00 10.00 C ATOM 681 O SER A 61 4.385 -7.793 -14.031 1.00 10.00 O ATOM 682 CB SER A 61 7.500 -7.960 -13.883 1.00 10.00 C ATOM 683 OG SER A 61 7.805 -7.834 -12.506 1.00 10.00 O ATOM 0 H SER A 61 7.768 -5.528 -13.224 1.00 10.00 H new ATOM 0 HA SER A 61 6.426 -6.916 -15.416 1.00 10.00 H new ATOM 0 HB2 SER A 61 7.032 -8.926 -14.069 1.00 10.00 H new ATOM 0 HB3 SER A 61 8.420 -7.934 -14.468 1.00 10.00 H new ATOM 0 HG SER A 61 8.774 -7.739 -12.393 1.00 10.00 H new ATOM 689 N LEU A 62 5.006 -6.155 -12.625 1.00 10.00 N ATOM 690 CA LEU A 62 3.770 -6.176 -11.865 1.00 10.00 C ATOM 691 C LEU A 62 3.143 -4.787 -11.819 1.00 10.00 C ATOM 692 O LEU A 62 3.834 -3.792 -11.595 1.00 10.00 O ATOM 693 CB LEU A 62 4.039 -6.668 -10.439 1.00 10.00 C ATOM 694 CG LEU A 62 4.683 -8.051 -10.332 1.00 10.00 C ATOM 695 CD1 LEU A 62 5.457 -8.171 -9.029 1.00 10.00 C ATOM 696 CD2 LEU A 62 3.626 -9.142 -10.422 1.00 10.00 C ATOM 0 H LEU A 62 5.684 -5.464 -12.304 1.00 10.00 H new ATOM 0 HA LEU A 62 3.076 -6.857 -12.357 1.00 10.00 H new ATOM 0 HB2 LEU A 62 4.685 -5.946 -9.940 1.00 10.00 H new ATOM 0 HB3 LEU A 62 3.095 -6.682 -9.894 1.00 10.00 H new ATOM 0 HG LEU A 62 5.376 -8.175 -11.164 1.00 10.00 H new ATOM 0 HD11 LEU A 62 5.911 -9.160 -8.965 1.00 10.00 H new ATOM 0 HD12 LEU A 62 6.238 -7.411 -8.998 1.00 10.00 H new ATOM 0 HD13 LEU A 62 4.778 -8.028 -8.188 1.00 10.00 H new ATOM 0 HD21 LEU A 62 4.104 -10.119 -10.344 1.00 10.00 H new ATOM 0 HD22 LEU A 62 2.910 -9.022 -9.609 1.00 10.00 H new ATOM 0 HD23 LEU A 62 3.107 -9.067 -11.377 1.00 10.00 H new ATOM 708 N ARG A 63 1.840 -4.726 -12.038 1.00 10.00 N ATOM 709 CA ARG A 63 1.118 -3.464 -12.005 1.00 10.00 C ATOM 710 C ARG A 63 0.175 -3.437 -10.806 1.00 10.00 C ATOM 711 O ARG A 63 -0.456 -4.443 -10.476 1.00 10.00 O ATOM 712 CB ARG A 63 0.337 -3.232 -13.308 1.00 10.00 C ATOM 713 CG ARG A 63 -0.859 -4.154 -13.498 1.00 10.00 C ATOM 714 CD ARG A 63 -1.683 -3.749 -14.711 1.00 10.00 C ATOM 715 NE ARG A 63 -2.896 -4.557 -14.850 1.00 10.00 N ATOM 716 CZ ARG A 63 -2.966 -5.691 -15.552 1.00 10.00 C ATOM 717 NH1 ARG A 63 -1.904 -6.148 -16.211 1.00 10.00 N ATOM 718 NH2 ARG A 63 -4.113 -6.358 -15.611 1.00 10.00 N ATOM 0 H ARG A 63 1.258 -5.539 -12.241 1.00 10.00 H new ATOM 0 HA ARG A 63 1.845 -2.657 -11.907 1.00 10.00 H new ATOM 0 HB2 ARG A 63 -0.009 -2.199 -13.330 1.00 10.00 H new ATOM 0 HB3 ARG A 63 1.016 -3.359 -14.151 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -0.514 -5.181 -13.617 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -1.485 -4.129 -12.606 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -1.957 -2.697 -14.628 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -1.076 -3.850 -15.611 1.00 10.00 H new ATOM 0 HE ARG A 63 -3.742 -4.233 -14.381 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -1.025 -5.631 -16.183 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -1.969 -7.015 -16.744 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -4.935 -6.004 -15.122 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -4.172 -7.225 -16.146 1.00 10.00 H new ATOM 732 N PHE A 64 0.107 -2.294 -10.143 1.00 10.00 N ATOM 733 CA PHE A 64 -0.757 -2.135 -8.986 1.00 10.00 C ATOM 734 C PHE A 64 -2.075 -1.503 -9.407 1.00 10.00 C ATOM 735 O PHE A 64 -2.088 -0.509 -10.133 1.00 10.00 O ATOM 736 CB PHE A 64 -0.078 -1.269 -7.925 1.00 10.00 C ATOM 737 CG PHE A 64 1.183 -1.866 -7.372 1.00 10.00 C ATOM 738 CD1 PHE A 64 2.399 -1.668 -8.010 1.00 10.00 C ATOM 739 CD2 PHE A 64 1.153 -2.625 -6.214 1.00 10.00 C ATOM 740 CE1 PHE A 64 3.559 -2.215 -7.501 1.00 10.00 C ATOM 741 CE2 PHE A 64 2.311 -3.174 -5.701 1.00 10.00 C ATOM 742 CZ PHE A 64 3.515 -2.970 -6.345 1.00 10.00 C ATOM 0 H PHE A 64 0.642 -1.461 -10.388 1.00 10.00 H new ATOM 0 HA PHE A 64 -0.951 -3.119 -8.559 1.00 10.00 H new ATOM 0 HB2 PHE A 64 0.151 -0.295 -8.357 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -0.777 -1.098 -7.107 1.00 10.00 H new ATOM 0 HD1 PHE A 64 2.438 -1.079 -8.915 1.00 10.00 H new ATOM 0 HD2 PHE A 64 0.214 -2.789 -5.707 1.00 10.00 H new ATOM 0 HE1 PHE A 64 4.500 -2.053 -8.006 1.00 10.00 H new ATOM 0 HE2 PHE A 64 2.275 -3.763 -4.796 1.00 10.00 H new ATOM 0 HZ PHE A 64 4.421 -3.400 -5.945 1.00 10.00 H new ATOM 752 N LEU A 65 -3.174 -2.087 -8.960 1.00 10.00 N ATOM 753 CA LEU A 65 -4.496 -1.587 -9.297 1.00 10.00 C ATOM 754 C LEU A 65 -5.229 -1.099 -8.059 1.00 10.00 C ATOM 755 O LEU A 65 -5.534 -1.878 -7.153 1.00 10.00 O ATOM 756 CB LEU A 65 -5.316 -2.674 -9.990 1.00 10.00 C ATOM 757 CG LEU A 65 -4.862 -3.027 -11.406 1.00 10.00 C ATOM 758 CD1 LEU A 65 -5.636 -4.225 -11.926 1.00 10.00 C ATOM 759 CD2 LEU A 65 -5.041 -1.834 -12.336 1.00 10.00 C ATOM 0 H LEU A 65 -3.176 -2.912 -8.360 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.371 -0.745 -9.977 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -5.283 -3.576 -9.379 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -6.357 -2.353 -10.029 1.00 10.00 H new ATOM 0 HG LEU A 65 -3.803 -3.285 -11.376 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -5.301 -4.464 -12.935 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -5.463 -5.081 -11.274 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -6.700 -3.991 -11.943 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -4.713 -2.103 -13.340 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -6.092 -1.548 -12.362 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -4.446 -0.996 -11.972 1.00 10.00 H new ATOM 771 N PHE A 66 -5.503 0.193 -8.031 1.00 10.00 N ATOM 772 CA PHE A 66 -6.209 0.808 -6.921 1.00 10.00 C ATOM 773 C PHE A 66 -7.387 1.611 -7.455 1.00 10.00 C ATOM 774 O PHE A 66 -7.200 2.543 -8.239 1.00 10.00 O ATOM 775 CB PHE A 66 -5.259 1.708 -6.126 1.00 10.00 C ATOM 776 CG PHE A 66 -5.827 2.201 -4.826 1.00 10.00 C ATOM 777 CD1 PHE A 66 -5.995 1.335 -3.759 1.00 10.00 C ATOM 778 CD2 PHE A 66 -6.187 3.529 -4.672 1.00 10.00 C ATOM 779 CE1 PHE A 66 -6.512 1.786 -2.559 1.00 10.00 C ATOM 780 CE2 PHE A 66 -6.706 3.986 -3.477 1.00 10.00 C ATOM 781 CZ PHE A 66 -6.868 3.113 -2.418 1.00 10.00 C ATOM 0 H PHE A 66 -5.244 0.843 -8.773 1.00 10.00 H new ATOM 0 HA PHE A 66 -6.582 0.032 -6.253 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -4.339 1.159 -5.924 1.00 10.00 H new ATOM 0 HB3 PHE A 66 -4.989 2.566 -6.741 1.00 10.00 H new ATOM 0 HD1 PHE A 66 -5.719 0.296 -3.865 1.00 10.00 H new ATOM 0 HD2 PHE A 66 -6.060 4.215 -5.496 1.00 10.00 H new ATOM 0 HE1 PHE A 66 -6.637 1.102 -1.733 1.00 10.00 H new ATOM 0 HE2 PHE A 66 -6.985 5.024 -3.370 1.00 10.00 H new ATOM 0 HZ PHE A 66 -7.272 3.468 -1.482 1.00 10.00 H new ATOM 791 N GLU A 67 -8.596 1.225 -7.049 1.00 10.00 N ATOM 792 CA GLU A 67 -9.821 1.895 -7.486 1.00 10.00 C ATOM 793 C GLU A 67 -9.985 1.789 -9.002 1.00 10.00 C ATOM 794 O GLU A 67 -10.563 2.670 -9.643 1.00 10.00 O ATOM 795 CB GLU A 67 -9.828 3.365 -7.049 1.00 10.00 C ATOM 796 CG GLU A 67 -9.849 3.549 -5.541 1.00 10.00 C ATOM 797 CD GLU A 67 -10.992 2.806 -4.888 1.00 10.00 C ATOM 798 OE1 GLU A 67 -10.727 1.919 -4.050 1.00 10.00 O ATOM 799 OE2 GLU A 67 -12.162 3.101 -5.216 1.00 10.00 O ATOM 0 H GLU A 67 -8.754 0.444 -6.412 1.00 10.00 H new ATOM 0 HA GLU A 67 -10.664 1.394 -7.011 1.00 10.00 H new ATOM 0 HB2 GLU A 67 -8.946 3.861 -7.455 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -10.699 3.860 -7.480 1.00 10.00 H new ATOM 0 HG2 GLU A 67 -8.905 3.200 -5.122 1.00 10.00 H new ATOM 0 HG3 GLU A 67 -9.929 4.611 -5.308 1.00 10.00 H new ATOM 806 N GLY A 68 -9.465 0.704 -9.567 1.00 10.00 N ATOM 807 CA GLY A 68 -9.558 0.487 -10.998 1.00 10.00 C ATOM 808 C GLY A 68 -8.494 1.238 -11.771 1.00 10.00 C ATOM 809 O GLY A 68 -8.381 1.091 -12.989 1.00 10.00 O ATOM 0 H GLY A 68 -8.978 -0.032 -9.055 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -9.469 -0.579 -11.207 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -10.543 0.799 -11.346 1.00 10.00 H new ATOM 813 N GLN A 69 -7.707 2.035 -11.066 1.00 10.00 N ATOM 814 CA GLN A 69 -6.654 2.819 -11.687 1.00 10.00 C ATOM 815 C GLN A 69 -5.295 2.174 -11.456 1.00 10.00 C ATOM 816 O GLN A 69 -5.004 1.703 -10.356 1.00 10.00 O ATOM 817 CB GLN A 69 -6.654 4.238 -11.118 1.00 10.00 C ATOM 818 CG GLN A 69 -7.834 5.077 -11.580 1.00 10.00 C ATOM 819 CD GLN A 69 -7.587 5.733 -12.923 1.00 10.00 C ATOM 820 OE1 GLN A 69 -6.455 6.091 -13.258 1.00 10.00 O ATOM 821 NE2 GLN A 69 -8.643 5.898 -13.702 1.00 10.00 N ATOM 0 H GLN A 69 -7.780 2.156 -10.056 1.00 10.00 H new ATOM 0 HA GLN A 69 -6.843 2.859 -12.760 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -6.661 4.184 -10.029 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -5.729 4.737 -11.407 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -8.721 4.447 -11.644 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -8.043 5.846 -10.836 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -9.562 5.588 -13.387 1.00 10.00 H new ATOM 0 HE22 GLN A 69 -8.538 6.335 -14.617 1.00 10.00 H new ATOM 830 N ARG A 70 -4.474 2.133 -12.495 1.00 10.00 N ATOM 831 CA ARG A 70 -3.146 1.559 -12.376 1.00 10.00 C ATOM 832 C ARG A 70 -2.194 2.591 -11.790 1.00 10.00 C ATOM 833 O ARG A 70 -2.128 3.731 -12.258 1.00 10.00 O ATOM 834 CB ARG A 70 -2.631 1.047 -13.730 1.00 10.00 C ATOM 835 CG ARG A 70 -2.527 2.114 -14.812 1.00 10.00 C ATOM 836 CD ARG A 70 -1.913 1.556 -16.088 1.00 10.00 C ATOM 837 NE ARG A 70 -0.530 1.109 -15.882 1.00 10.00 N ATOM 838 CZ ARG A 70 -0.065 -0.089 -16.251 1.00 10.00 C ATOM 839 NH1 ARG A 70 -0.858 -0.956 -16.864 1.00 10.00 N ATOM 840 NH2 ARG A 70 1.201 -0.418 -16.017 1.00 10.00 N ATOM 0 H ARG A 70 -4.704 2.488 -13.423 1.00 10.00 H new ATOM 0 HA ARG A 70 -3.199 0.701 -11.706 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -1.648 0.599 -13.584 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -3.294 0.256 -14.081 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -3.518 2.513 -15.028 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -1.922 2.944 -14.449 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -2.515 0.720 -16.445 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -1.935 2.320 -16.865 1.00 10.00 H new ATOM 0 HE ARG A 70 0.118 1.753 -15.428 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -1.829 -0.711 -17.057 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -0.497 -1.868 -17.143 1.00 10.00 H new ATOM 0 HH21 ARG A 70 1.823 0.245 -15.554 1.00 10.00 H new ATOM 0 HH22 ARG A 70 1.551 -1.333 -16.300 1.00 10.00 H new ATOM 854 N ILE A 71 -1.482 2.196 -10.752 1.00 10.00 N ATOM 855 CA ILE A 71 -0.541 3.082 -10.086 1.00 10.00 C ATOM 856 C ILE A 71 0.672 3.361 -10.966 1.00 10.00 C ATOM 857 O ILE A 71 1.411 2.444 -11.341 1.00 10.00 O ATOM 858 CB ILE A 71 -0.074 2.491 -8.738 1.00 10.00 C ATOM 859 CG1 ILE A 71 -1.273 2.235 -7.818 1.00 10.00 C ATOM 860 CG2 ILE A 71 0.929 3.414 -8.067 1.00 10.00 C ATOM 861 CD1 ILE A 71 -2.133 3.456 -7.568 1.00 10.00 C ATOM 0 H ILE A 71 -1.537 1.261 -10.348 1.00 10.00 H new ATOM 0 HA ILE A 71 -1.064 4.020 -9.898 1.00 10.00 H new ATOM 0 HB ILE A 71 0.417 1.538 -8.934 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -1.892 1.451 -8.255 1.00 10.00 H new ATOM 0 HG13 ILE A 71 -0.910 1.858 -6.862 1.00 10.00 H new ATOM 0 HG21 ILE A 71 1.246 2.980 -7.119 1.00 10.00 H new ATOM 0 HG22 ILE A 71 1.796 3.542 -8.715 1.00 10.00 H new ATOM 0 HG23 ILE A 71 0.466 4.384 -7.885 1.00 10.00 H new ATOM 0 HD11 ILE A 71 -2.959 3.190 -6.908 1.00 10.00 H new ATOM 0 HD12 ILE A 71 -1.531 4.235 -7.100 1.00 10.00 H new ATOM 0 HD13 ILE A 71 -2.529 3.822 -8.515 1.00 10.00 H new ATOM 873 N ALA A 72 0.866 4.628 -11.299 1.00 10.00 N ATOM 874 CA ALA A 72 1.986 5.038 -12.125 1.00 10.00 C ATOM 875 C ALA A 72 3.189 5.376 -11.254 1.00 10.00 C ATOM 876 O ALA A 72 3.073 5.487 -10.035 1.00 10.00 O ATOM 877 CB ALA A 72 1.603 6.230 -12.989 1.00 10.00 C ATOM 0 H ALA A 72 0.257 5.392 -11.007 1.00 10.00 H new ATOM 0 HA ALA A 72 2.254 4.210 -12.781 1.00 10.00 H new ATOM 0 HB1 ALA A 72 2.455 6.524 -13.602 1.00 10.00 H new ATOM 0 HB2 ALA A 72 0.768 5.958 -13.635 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.311 7.063 -12.350 1.00 10.00 H new ATOM 883 N ASP A 73 4.338 5.541 -11.888 1.00 10.00 N ATOM 884 CA ASP A 73 5.574 5.863 -11.177 1.00 10.00 C ATOM 885 C ASP A 73 5.531 7.291 -10.648 1.00 10.00 C ATOM 886 O ASP A 73 6.189 7.626 -9.667 1.00 10.00 O ATOM 887 CB ASP A 73 6.781 5.697 -12.104 1.00 10.00 C ATOM 888 CG ASP A 73 7.060 4.249 -12.469 1.00 10.00 C ATOM 889 OD1 ASP A 73 6.094 3.475 -12.649 1.00 10.00 O ATOM 890 OD2 ASP A 73 8.247 3.883 -12.601 1.00 10.00 O ATOM 0 H ASP A 73 4.445 5.458 -12.899 1.00 10.00 H new ATOM 0 HA ASP A 73 5.670 5.176 -10.336 1.00 10.00 H new ATOM 0 HB2 ASP A 73 6.612 6.269 -13.016 1.00 10.00 H new ATOM 0 HB3 ASP A 73 7.662 6.120 -11.622 1.00 10.00 H new ATOM 895 N ASN A 74 4.726 8.116 -11.302 1.00 10.00 N ATOM 896 CA ASN A 74 4.582 9.524 -10.939 1.00 10.00 C ATOM 897 C ASN A 74 3.376 9.749 -10.027 1.00 10.00 C ATOM 898 O ASN A 74 2.822 10.848 -9.979 1.00 10.00 O ATOM 899 CB ASN A 74 4.434 10.371 -12.208 1.00 10.00 C ATOM 900 CG ASN A 74 3.333 9.858 -13.117 1.00 10.00 C ATOM 901 OD1 ASN A 74 3.559 8.978 -13.952 1.00 10.00 O ATOM 902 ND2 ASN A 74 2.133 10.392 -12.966 1.00 10.00 N ATOM 0 H ASN A 74 4.154 7.832 -12.098 1.00 10.00 H new ATOM 0 HA ASN A 74 5.477 9.824 -10.394 1.00 10.00 H new ATOM 0 HB2 ASN A 74 4.221 11.403 -11.930 1.00 10.00 H new ATOM 0 HB3 ASN A 74 5.379 10.375 -12.752 1.00 10.00 H new ATOM 0 HD21 ASN A 74 1.358 10.078 -13.550 1.00 10.00 H new ATOM 0 HD22 ASN A 74 1.982 11.118 -12.265 1.00 10.00 H new ATOM 909 N HIS A 75 2.969 8.716 -9.301 1.00 10.00 N ATOM 910 CA HIS A 75 1.825 8.826 -8.401 1.00 10.00 C ATOM 911 C HIS A 75 2.276 8.793 -6.943 1.00 10.00 C ATOM 912 O HIS A 75 3.365 8.302 -6.629 1.00 10.00 O ATOM 913 CB HIS A 75 0.822 7.694 -8.655 1.00 10.00 C ATOM 914 CG HIS A 75 0.026 7.844 -9.920 1.00 10.00 C ATOM 915 ND1 HIS A 75 -0.856 6.872 -10.329 1.00 10.00 N ATOM 916 CD2 HIS A 75 0.018 8.854 -10.825 1.00 10.00 C ATOM 917 CE1 HIS A 75 -1.384 7.311 -11.458 1.00 10.00 C ATOM 918 NE2 HIS A 75 -0.883 8.505 -11.803 1.00 10.00 N ATOM 0 H HIS A 75 3.410 7.796 -9.316 1.00 10.00 H new ATOM 0 HA HIS A 75 1.339 9.781 -8.599 1.00 10.00 H new ATOM 0 HB2 HIS A 75 1.362 6.748 -8.689 1.00 10.00 H new ATOM 0 HB3 HIS A 75 0.134 7.638 -7.811 1.00 10.00 H new ATOM 0 HD2 HIS A 75 0.606 9.759 -10.785 1.00 10.00 H new ATOM 0 HE1 HIS A 75 -2.126 6.775 -12.031 1.00 10.00 H new ATOM 0 HE2 HIS A 75 -1.124 9.050 -12.631 1.00 10.00 H new ATOM 926 N THR A 76 1.445 9.332 -6.062 1.00 10.00 N ATOM 927 CA THR A 76 1.734 9.355 -4.635 1.00 10.00 C ATOM 928 C THR A 76 0.499 8.928 -3.843 1.00 10.00 C ATOM 929 O THR A 76 -0.612 8.974 -4.365 1.00 10.00 O ATOM 930 CB THR A 76 2.176 10.761 -4.172 1.00 10.00 C ATOM 931 OG1 THR A 76 1.241 11.750 -4.618 1.00 10.00 O ATOM 932 CG2 THR A 76 3.564 11.097 -4.691 1.00 10.00 C ATOM 0 H THR A 76 0.556 9.764 -6.314 1.00 10.00 H new ATOM 0 HA THR A 76 2.551 8.658 -4.451 1.00 10.00 H new ATOM 0 HB THR A 76 2.205 10.759 -3.082 1.00 10.00 H new ATOM 0 HG1 THR A 76 1.194 11.738 -5.597 1.00 10.00 H new ATOM 0 HG21 THR A 76 3.849 12.092 -4.350 1.00 10.00 H new ATOM 0 HG22 THR A 76 4.280 10.366 -4.315 1.00 10.00 H new ATOM 0 HG23 THR A 76 3.560 11.074 -5.781 1.00 10.00 H new ATOM 940 N PRO A 77 0.664 8.502 -2.579 1.00 10.00 N ATOM 941 CA PRO A 77 -0.465 8.080 -1.737 1.00 10.00 C ATOM 942 C PRO A 77 -1.368 9.254 -1.359 1.00 10.00 C ATOM 943 O PRO A 77 -2.490 9.063 -0.887 1.00 10.00 O ATOM 944 CB PRO A 77 0.206 7.499 -0.482 1.00 10.00 C ATOM 945 CG PRO A 77 1.645 7.328 -0.836 1.00 10.00 C ATOM 946 CD PRO A 77 1.946 8.369 -1.871 1.00 10.00 C ATOM 0 HA PRO A 77 -1.110 7.369 -2.253 1.00 10.00 H new ATOM 0 HB2 PRO A 77 0.089 8.169 0.370 1.00 10.00 H new ATOM 0 HB3 PRO A 77 -0.244 6.546 -0.203 1.00 10.00 H new ATOM 0 HG2 PRO A 77 2.280 7.456 0.041 1.00 10.00 H new ATOM 0 HG3 PRO A 77 1.835 6.327 -1.224 1.00 10.00 H new ATOM 0 HD2 PRO A 77 2.259 9.310 -1.419 1.00 10.00 H new ATOM 0 HD3 PRO A 77 2.747 8.055 -2.540 1.00 10.00 H new ATOM 954 N LYS A 78 -0.866 10.466 -1.575 1.00 10.00 N ATOM 955 CA LYS A 78 -1.610 11.678 -1.263 1.00 10.00 C ATOM 956 C LYS A 78 -2.791 11.853 -2.217 1.00 10.00 C ATOM 957 O LYS A 78 -3.849 12.353 -1.830 1.00 10.00 O ATOM 958 CB LYS A 78 -0.680 12.895 -1.338 1.00 10.00 C ATOM 959 CG LYS A 78 -1.356 14.219 -1.016 1.00 10.00 C ATOM 960 CD LYS A 78 -1.536 14.421 0.484 1.00 10.00 C ATOM 961 CE LYS A 78 -0.241 14.852 1.157 1.00 10.00 C ATOM 962 NZ LYS A 78 -0.496 15.596 2.419 1.00 10.00 N ATOM 0 H LYS A 78 0.060 10.633 -1.968 1.00 10.00 H new ATOM 0 HA LYS A 78 -2.003 11.592 -0.250 1.00 10.00 H new ATOM 0 HB2 LYS A 78 0.150 12.747 -0.647 1.00 10.00 H new ATOM 0 HB3 LYS A 78 -0.255 12.952 -2.340 1.00 10.00 H new ATOM 0 HG2 LYS A 78 -0.762 15.037 -1.423 1.00 10.00 H new ATOM 0 HG3 LYS A 78 -2.329 14.257 -1.506 1.00 10.00 H new ATOM 0 HD2 LYS A 78 -2.305 15.174 0.659 1.00 10.00 H new ATOM 0 HD3 LYS A 78 -1.889 13.494 0.936 1.00 10.00 H new ATOM 0 HE2 LYS A 78 0.368 13.973 1.370 1.00 10.00 H new ATOM 0 HE3 LYS A 78 0.332 15.480 0.474 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 0.410 15.873 2.848 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 -1.056 16.448 2.213 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 -1.021 14.989 3.080 1.00 10.00 H new ATOM 976 N GLU A 79 -2.610 11.432 -3.463 1.00 10.00 N ATOM 977 CA GLU A 79 -3.661 11.543 -4.463 1.00 10.00 C ATOM 978 C GLU A 79 -4.507 10.274 -4.476 1.00 10.00 C ATOM 979 O GLU A 79 -4.142 9.281 -3.841 1.00 10.00 O ATOM 980 CB GLU A 79 -3.059 11.806 -5.846 1.00 10.00 C ATOM 981 CG GLU A 79 -2.114 10.713 -6.320 1.00 10.00 C ATOM 982 CD GLU A 79 -1.108 11.210 -7.333 1.00 10.00 C ATOM 983 OE1 GLU A 79 -1.391 11.134 -8.542 1.00 10.00 O ATOM 984 OE2 GLU A 79 -0.023 11.674 -6.917 1.00 10.00 O ATOM 0 H GLU A 79 -1.745 11.011 -3.803 1.00 10.00 H new ATOM 0 HA GLU A 79 -4.303 12.386 -4.206 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -3.867 11.914 -6.569 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -2.522 12.754 -5.824 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -1.585 10.299 -5.462 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -2.695 9.902 -6.759 1.00 10.00 H new ATOM 991 N LEU A 80 -5.644 10.328 -5.179 1.00 10.00 N ATOM 992 CA LEU A 80 -6.580 9.197 -5.295 1.00 10.00 C ATOM 993 C LEU A 80 -7.348 8.973 -3.995 1.00 10.00 C ATOM 994 O LEU A 80 -8.570 8.843 -4.002 1.00 10.00 O ATOM 995 CB LEU A 80 -5.863 7.907 -5.717 1.00 10.00 C ATOM 996 CG LEU A 80 -5.667 7.732 -7.226 1.00 10.00 C ATOM 997 CD1 LEU A 80 -4.762 6.543 -7.513 1.00 10.00 C ATOM 998 CD2 LEU A 80 -7.008 7.550 -7.924 1.00 10.00 C ATOM 0 H LEU A 80 -5.945 11.160 -5.687 1.00 10.00 H new ATOM 0 HA LEU A 80 -7.294 9.458 -6.076 1.00 10.00 H new ATOM 0 HB2 LEU A 80 -4.886 7.879 -5.235 1.00 10.00 H new ATOM 0 HB3 LEU A 80 -6.429 7.056 -5.339 1.00 10.00 H new ATOM 0 HG LEU A 80 -5.193 8.634 -7.614 1.00 10.00 H new ATOM 0 HD11 LEU A 80 -4.634 6.434 -8.590 1.00 10.00 H new ATOM 0 HD12 LEU A 80 -3.790 6.705 -7.047 1.00 10.00 H new ATOM 0 HD13 LEU A 80 -5.212 5.637 -7.108 1.00 10.00 H new ATOM 0 HD21 LEU A 80 -6.847 7.427 -8.995 1.00 10.00 H new ATOM 0 HD22 LEU A 80 -7.507 6.665 -7.528 1.00 10.00 H new ATOM 0 HD23 LEU A 80 -7.631 8.427 -7.749 1.00 10.00 H new ATOM 1010 N GLY A 81 -6.635 8.928 -2.883 1.00 10.00 N ATOM 1011 CA GLY A 81 -7.277 8.732 -1.604 1.00 10.00 C ATOM 1012 C GLY A 81 -6.865 7.439 -0.941 1.00 10.00 C ATOM 1013 O GLY A 81 -7.706 6.582 -0.658 1.00 10.00 O ATOM 0 H GLY A 81 -5.620 9.024 -2.844 1.00 10.00 H new ATOM 0 HA2 GLY A 81 -7.033 9.567 -0.947 1.00 10.00 H new ATOM 0 HA3 GLY A 81 -8.359 8.738 -1.739 1.00 10.00 H new ATOM 1017 N MET A 82 -5.568 7.290 -0.700 1.00 10.00 N ATOM 1018 CA MET A 82 -5.048 6.096 -0.050 1.00 10.00 C ATOM 1019 C MET A 82 -5.116 6.266 1.459 1.00 10.00 C ATOM 1020 O MET A 82 -4.526 7.194 2.016 1.00 10.00 O ATOM 1021 CB MET A 82 -3.609 5.817 -0.493 1.00 10.00 C ATOM 1022 CG MET A 82 -3.518 5.082 -1.819 1.00 10.00 C ATOM 1023 SD MET A 82 -1.818 4.758 -2.329 1.00 10.00 S ATOM 1024 CE MET A 82 -2.089 3.745 -3.780 1.00 10.00 C ATOM 0 H MET A 82 -4.859 7.981 -0.945 1.00 10.00 H new ATOM 0 HA MET A 82 -5.660 5.243 -0.342 1.00 10.00 H new ATOM 0 HB2 MET A 82 -3.071 6.762 -0.572 1.00 10.00 H new ATOM 0 HB3 MET A 82 -3.108 5.228 0.275 1.00 10.00 H new ATOM 0 HG2 MET A 82 -4.055 4.137 -1.742 1.00 10.00 H new ATOM 0 HG3 MET A 82 -4.017 5.670 -2.589 1.00 10.00 H new ATOM 0 HE1 MET A 82 -1.129 3.463 -4.211 1.00 10.00 H new ATOM 0 HE2 MET A 82 -2.639 2.847 -3.499 1.00 10.00 H new ATOM 0 HE3 MET A 82 -2.665 4.308 -4.514 1.00 10.00 H new ATOM 1034 N GLU A 83 -5.845 5.383 2.117 1.00 10.00 N ATOM 1035 CA GLU A 83 -6.002 5.458 3.556 1.00 10.00 C ATOM 1036 C GLU A 83 -5.336 4.282 4.252 1.00 10.00 C ATOM 1037 O GLU A 83 -4.782 3.393 3.610 1.00 10.00 O ATOM 1038 CB GLU A 83 -7.485 5.504 3.916 1.00 10.00 C ATOM 1039 CG GLU A 83 -7.948 6.875 4.377 1.00 10.00 C ATOM 1040 CD GLU A 83 -7.081 7.430 5.487 1.00 10.00 C ATOM 1041 OE1 GLU A 83 -6.728 6.668 6.410 1.00 10.00 O ATOM 1042 OE2 GLU A 83 -6.748 8.632 5.442 1.00 10.00 O ATOM 0 H GLU A 83 -6.337 4.606 1.677 1.00 10.00 H new ATOM 0 HA GLU A 83 -5.514 6.370 3.899 1.00 10.00 H new ATOM 0 HB2 GLU A 83 -8.072 5.202 3.049 1.00 10.00 H new ATOM 0 HB3 GLU A 83 -7.684 4.777 4.704 1.00 10.00 H new ATOM 0 HG2 GLU A 83 -7.937 7.563 3.532 1.00 10.00 H new ATOM 0 HG3 GLU A 83 -8.980 6.811 4.722 1.00 10.00 H new ATOM 1049 N GLU A 84 -5.400 4.294 5.576 1.00 10.00 N ATOM 1050 CA GLU A 84 -4.818 3.243 6.395 1.00 10.00 C ATOM 1051 C GLU A 84 -5.592 1.934 6.228 1.00 10.00 C ATOM 1052 O GLU A 84 -6.823 1.938 6.128 1.00 10.00 O ATOM 1053 CB GLU A 84 -4.806 3.691 7.866 1.00 10.00 C ATOM 1054 CG GLU A 84 -4.562 2.571 8.863 1.00 10.00 C ATOM 1055 CD GLU A 84 -3.140 2.052 8.833 1.00 10.00 C ATOM 1056 OE1 GLU A 84 -2.671 1.637 7.756 1.00 10.00 O ATOM 1057 OE2 GLU A 84 -2.496 2.014 9.900 1.00 10.00 O ATOM 0 H GLU A 84 -5.857 5.032 6.111 1.00 10.00 H new ATOM 0 HA GLU A 84 -3.793 3.062 6.071 1.00 10.00 H new ATOM 0 HB2 GLU A 84 -4.035 4.450 7.995 1.00 10.00 H new ATOM 0 HB3 GLU A 84 -5.761 4.164 8.096 1.00 10.00 H new ATOM 0 HG2 GLU A 84 -4.791 2.929 9.867 1.00 10.00 H new ATOM 0 HG3 GLU A 84 -5.247 1.750 8.653 1.00 10.00 H new ATOM 1064 N GLU A 85 -4.852 0.823 6.183 1.00 10.00 N ATOM 1065 CA GLU A 85 -5.429 -0.512 6.031 1.00 10.00 C ATOM 1066 C GLU A 85 -6.208 -0.642 4.723 1.00 10.00 C ATOM 1067 O GLU A 85 -7.199 -1.375 4.648 1.00 10.00 O ATOM 1068 CB GLU A 85 -6.333 -0.847 7.222 1.00 10.00 C ATOM 1069 CG GLU A 85 -5.573 -1.270 8.466 1.00 10.00 C ATOM 1070 CD GLU A 85 -4.749 -2.518 8.242 1.00 10.00 C ATOM 1071 OE1 GLU A 85 -3.524 -2.477 8.487 1.00 10.00 O ATOM 1072 OE2 GLU A 85 -5.323 -3.550 7.836 1.00 10.00 O ATOM 0 H GLU A 85 -3.834 0.826 6.251 1.00 10.00 H new ATOM 0 HA GLU A 85 -4.604 -1.224 6.002 1.00 10.00 H new ATOM 0 HB2 GLU A 85 -6.944 0.024 7.459 1.00 10.00 H new ATOM 0 HB3 GLU A 85 -7.016 -1.647 6.935 1.00 10.00 H new ATOM 0 HG2 GLU A 85 -4.919 -0.458 8.782 1.00 10.00 H new ATOM 0 HG3 GLU A 85 -6.279 -1.445 9.278 1.00 10.00 H new ATOM 1079 N ASP A 86 -5.749 0.057 3.697 1.00 10.00 N ATOM 1080 CA ASP A 86 -6.407 0.023 2.397 1.00 10.00 C ATOM 1081 C ASP A 86 -6.003 -1.221 1.624 1.00 10.00 C ATOM 1082 O ASP A 86 -4.875 -1.699 1.740 1.00 10.00 O ATOM 1083 CB ASP A 86 -6.074 1.275 1.582 1.00 10.00 C ATOM 1084 CG ASP A 86 -7.271 2.193 1.432 1.00 10.00 C ATOM 1085 OD1 ASP A 86 -8.390 1.793 1.823 1.00 10.00 O ATOM 1086 OD2 ASP A 86 -7.102 3.319 0.926 1.00 10.00 O ATOM 0 H ASP A 86 -4.924 0.655 3.737 1.00 10.00 H new ATOM 0 HA ASP A 86 -7.483 -0.003 2.569 1.00 10.00 H new ATOM 0 HB2 ASP A 86 -5.261 1.816 2.066 1.00 10.00 H new ATOM 0 HB3 ASP A 86 -5.718 0.980 0.595 1.00 10.00 H new ATOM 1091 N VAL A 87 -6.931 -1.742 0.839 1.00 10.00 N ATOM 1092 CA VAL A 87 -6.686 -2.939 0.048 1.00 10.00 C ATOM 1093 C VAL A 87 -6.326 -2.573 -1.391 1.00 10.00 C ATOM 1094 O VAL A 87 -6.998 -1.753 -2.016 1.00 10.00 O ATOM 1095 CB VAL A 87 -7.922 -3.869 0.044 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -7.592 -5.209 -0.599 1.00 10.00 C ATOM 1097 CG2 VAL A 87 -8.446 -4.071 1.460 1.00 10.00 C ATOM 0 H VAL A 87 -7.868 -1.352 0.731 1.00 10.00 H new ATOM 0 HA VAL A 87 -5.849 -3.466 0.507 1.00 10.00 H new ATOM 0 HB VAL A 87 -8.702 -3.391 -0.548 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -8.477 -5.845 -0.590 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -7.271 -5.049 -1.628 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -6.791 -5.693 -0.040 1.00 10.00 H new ATOM 0 HG21 VAL A 87 -9.315 -4.728 1.436 1.00 10.00 H new ATOM 0 HG22 VAL A 87 -7.667 -4.522 2.075 1.00 10.00 H new ATOM 0 HG23 VAL A 87 -8.731 -3.108 1.883 1.00 10.00 H new ATOM 1107 N ILE A 88 -5.262 -3.176 -1.904 1.00 10.00 N ATOM 1108 CA ILE A 88 -4.818 -2.921 -3.268 1.00 10.00 C ATOM 1109 C ILE A 88 -4.471 -4.240 -3.961 1.00 10.00 C ATOM 1110 O ILE A 88 -4.061 -5.202 -3.309 1.00 10.00 O ATOM 1111 CB ILE A 88 -3.602 -1.953 -3.290 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -3.227 -1.575 -4.726 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -2.410 -2.566 -2.569 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -2.231 -0.439 -4.817 1.00 10.00 C ATOM 0 H ILE A 88 -4.688 -3.848 -1.394 1.00 10.00 H new ATOM 0 HA ILE A 88 -5.633 -2.442 -3.811 1.00 10.00 H new ATOM 0 HB ILE A 88 -3.889 -1.043 -2.764 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.813 -2.450 -5.226 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -4.132 -1.297 -5.267 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -1.571 -1.871 -2.597 1.00 10.00 H new ATOM 0 HG22 ILE A 88 -2.678 -2.770 -1.532 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -2.127 -3.497 -3.061 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -2.014 -0.228 -5.864 1.00 10.00 H new ATOM 0 HD12 ILE A 88 -2.650 0.451 -4.347 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -1.311 -0.720 -4.305 1.00 10.00 H new ATOM 1126 N GLU A 89 -4.659 -4.293 -5.272 1.00 10.00 N ATOM 1127 CA GLU A 89 -4.374 -5.504 -6.032 1.00 10.00 C ATOM 1128 C GLU A 89 -3.137 -5.333 -6.907 1.00 10.00 C ATOM 1129 O GLU A 89 -2.805 -4.224 -7.325 1.00 10.00 O ATOM 1130 CB GLU A 89 -5.571 -5.879 -6.910 1.00 10.00 C ATOM 1131 CG GLU A 89 -6.832 -6.196 -6.124 1.00 10.00 C ATOM 1132 CD GLU A 89 -7.967 -6.695 -6.999 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -7.883 -6.559 -8.240 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -8.953 -7.227 -6.444 1.00 10.00 O ATOM 0 H GLU A 89 -5.007 -3.514 -5.831 1.00 10.00 H new ATOM 0 HA GLU A 89 -4.184 -6.303 -5.315 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -5.778 -5.058 -7.596 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -5.307 -6.744 -7.519 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -6.604 -6.949 -5.370 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -7.157 -5.301 -5.593 1.00 10.00 H new ATOM 1141 N VAL A 90 -2.463 -6.443 -7.183 1.00 10.00 N ATOM 1142 CA VAL A 90 -1.273 -6.439 -8.021 1.00 10.00 C ATOM 1143 C VAL A 90 -1.347 -7.596 -9.016 1.00 10.00 C ATOM 1144 O VAL A 90 -1.743 -8.706 -8.653 1.00 10.00 O ATOM 1145 CB VAL A 90 0.025 -6.535 -7.178 1.00 10.00 C ATOM 1146 CG1 VAL A 90 0.099 -7.857 -6.429 1.00 10.00 C ATOM 1147 CG2 VAL A 90 1.254 -6.345 -8.055 1.00 10.00 C ATOM 0 H VAL A 90 -2.725 -7.365 -6.834 1.00 10.00 H new ATOM 0 HA VAL A 90 -1.240 -5.492 -8.560 1.00 10.00 H new ATOM 0 HB VAL A 90 0.002 -5.733 -6.440 1.00 10.00 H new ATOM 0 HG11 VAL A 90 1.020 -7.894 -5.847 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -0.757 -7.944 -5.760 1.00 10.00 H new ATOM 0 HG13 VAL A 90 0.087 -8.681 -7.143 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.153 -6.416 -7.442 1.00 10.00 H new ATOM 0 HG22 VAL A 90 1.276 -7.118 -8.823 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.215 -5.364 -8.529 1.00 10.00 H new ATOM 1157 N TYR A 91 -1.007 -7.327 -10.270 1.00 10.00 N ATOM 1158 CA TYR A 91 -1.052 -8.352 -11.310 1.00 10.00 C ATOM 1159 C TYR A 91 0.177 -8.271 -12.201 1.00 10.00 C ATOM 1160 O TYR A 91 0.818 -7.225 -12.288 1.00 10.00 O ATOM 1161 CB TYR A 91 -2.316 -8.200 -12.162 1.00 10.00 C ATOM 1162 CG TYR A 91 -3.591 -8.413 -11.384 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -4.121 -9.685 -11.213 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -4.256 -7.341 -10.806 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -5.279 -9.882 -10.488 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -5.414 -7.529 -10.082 1.00 10.00 C ATOM 1167 CZ TYR A 91 -5.922 -8.799 -9.926 1.00 10.00 C ATOM 1168 OH TYR A 91 -7.075 -8.988 -9.198 1.00 10.00 O ATOM 0 H TYR A 91 -0.697 -6.410 -10.593 1.00 10.00 H new ATOM 0 HA TYR A 91 -1.068 -9.325 -10.820 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -2.330 -7.203 -12.603 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -2.278 -8.913 -12.986 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -3.619 -10.534 -11.654 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -3.860 -6.343 -10.925 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -5.679 -10.877 -10.362 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -5.920 -6.684 -9.639 1.00 10.00 H new ATOM 0 HH TYR A 91 -7.495 -8.121 -9.020 1.00 10.00 H new ATOM 1178 N GLN A 92 0.499 -9.378 -12.857 1.00 10.00 N ATOM 1179 CA GLN A 92 1.651 -9.435 -13.747 1.00 10.00 C ATOM 1180 C GLN A 92 1.310 -8.831 -15.104 1.00 10.00 C ATOM 1181 O GLN A 92 0.279 -9.156 -15.700 1.00 10.00 O ATOM 1182 CB GLN A 92 2.115 -10.884 -13.917 1.00 10.00 C ATOM 1183 CG GLN A 92 3.533 -11.014 -14.450 1.00 10.00 C ATOM 1184 CD GLN A 92 3.947 -12.460 -14.643 1.00 10.00 C ATOM 1185 OE1 GLN A 92 4.464 -13.100 -13.728 1.00 10.00 O ATOM 1186 NE2 GLN A 92 3.721 -12.983 -15.836 1.00 10.00 N ATOM 0 H GLN A 92 -0.023 -10.251 -12.789 1.00 10.00 H new ATOM 0 HA GLN A 92 2.460 -8.854 -13.303 1.00 10.00 H new ATOM 0 HB2 GLN A 92 2.050 -11.392 -12.955 1.00 10.00 H new ATOM 0 HB3 GLN A 92 1.433 -11.397 -14.595 1.00 10.00 H new ATOM 0 HG2 GLN A 92 3.611 -10.487 -15.401 1.00 10.00 H new ATOM 0 HG3 GLN A 92 4.224 -10.530 -13.759 1.00 10.00 H new ATOM 0 HE21 GLN A 92 3.290 -12.418 -16.567 1.00 10.00 H new ATOM 0 HE22 GLN A 92 3.978 -13.952 -16.025 1.00 10.00 H new ATOM 1195 N GLU A 93 2.177 -7.948 -15.579 1.00 10.00 N ATOM 1196 CA GLU A 93 1.983 -7.288 -16.860 1.00 10.00 C ATOM 1197 C GLU A 93 2.151 -8.274 -18.010 1.00 10.00 C ATOM 1198 O GLU A 93 2.980 -9.182 -17.946 1.00 10.00 O ATOM 1199 CB GLU A 93 2.971 -6.129 -17.014 1.00 10.00 C ATOM 1200 CG GLU A 93 2.668 -4.945 -16.107 1.00 10.00 C ATOM 1201 CD GLU A 93 1.446 -4.165 -16.554 1.00 10.00 C ATOM 1202 OE1 GLU A 93 0.367 -4.777 -16.714 1.00 10.00 O ATOM 1203 OE2 GLU A 93 1.555 -2.936 -16.744 1.00 10.00 O ATOM 0 H GLU A 93 3.029 -7.671 -15.091 1.00 10.00 H new ATOM 0 HA GLU A 93 0.967 -6.895 -16.890 1.00 10.00 H new ATOM 0 HB2 GLU A 93 3.977 -6.490 -16.802 1.00 10.00 H new ATOM 0 HB3 GLU A 93 2.965 -5.793 -18.051 1.00 10.00 H new ATOM 0 HG2 GLU A 93 2.514 -5.302 -15.089 1.00 10.00 H new ATOM 0 HG3 GLU A 93 3.531 -4.279 -16.084 1.00 10.00 H new ATOM 1210 N GLN A 94 1.370 -8.077 -19.067 1.00 10.00 N ATOM 1211 CA GLN A 94 1.411 -8.951 -20.235 1.00 10.00 C ATOM 1212 C GLN A 94 2.776 -8.900 -20.924 1.00 10.00 C ATOM 1213 O GLN A 94 3.161 -9.839 -21.624 1.00 10.00 O ATOM 1214 CB GLN A 94 0.306 -8.559 -21.220 1.00 10.00 C ATOM 1215 CG GLN A 94 0.033 -9.612 -22.284 1.00 10.00 C ATOM 1216 CD GLN A 94 -0.944 -9.137 -23.343 1.00 10.00 C ATOM 1217 OE1 GLN A 94 -1.021 -7.948 -23.643 1.00 10.00 O ATOM 1218 NE2 GLN A 94 -1.698 -10.059 -23.920 1.00 10.00 N ATOM 0 H GLN A 94 0.696 -7.314 -19.139 1.00 10.00 H new ATOM 0 HA GLN A 94 1.247 -9.974 -19.897 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -0.613 -8.369 -20.665 1.00 10.00 H new ATOM 0 HB3 GLN A 94 0.582 -7.625 -21.709 1.00 10.00 H new ATOM 0 HG2 GLN A 94 0.972 -9.892 -22.762 1.00 10.00 H new ATOM 0 HG3 GLN A 94 -0.362 -10.509 -21.808 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -1.607 -11.037 -23.646 1.00 10.00 H new ATOM 0 HE22 GLN A 94 -2.370 -9.791 -24.639 1.00 10.00 H new ATOM 1227 N THR A 95 3.507 -7.812 -20.714 1.00 10.00 N ATOM 1228 CA THR A 95 4.824 -7.647 -21.311 1.00 10.00 C ATOM 1229 C THR A 95 5.872 -8.477 -20.575 1.00 10.00 C ATOM 1230 O THR A 95 6.941 -8.769 -21.114 1.00 10.00 O ATOM 1231 CB THR A 95 5.259 -6.170 -21.283 1.00 10.00 C ATOM 1232 OG1 THR A 95 4.953 -5.603 -20.002 1.00 10.00 O ATOM 1233 CG2 THR A 95 4.563 -5.374 -22.377 1.00 10.00 C ATOM 0 H THR A 95 3.208 -7.029 -20.133 1.00 10.00 H new ATOM 0 HA THR A 95 4.751 -7.989 -22.343 1.00 10.00 H new ATOM 0 HB THR A 95 6.334 -6.124 -21.459 1.00 10.00 H new ATOM 0 HG1 THR A 95 5.232 -4.664 -19.985 1.00 10.00 H new ATOM 0 HG21 THR A 95 4.889 -4.335 -22.334 1.00 10.00 H new ATOM 0 HG22 THR A 95 4.817 -5.794 -23.350 1.00 10.00 H new ATOM 0 HG23 THR A 95 3.484 -5.422 -22.232 1.00 10.00 H new ATOM 1241 N GLY A 96 5.560 -8.847 -19.336 1.00 10.00 N ATOM 1242 CA GLY A 96 6.486 -9.623 -18.532 1.00 10.00 C ATOM 1243 C GLY A 96 7.481 -8.740 -17.802 1.00 10.00 C ATOM 1244 O GLY A 96 8.199 -9.196 -16.913 1.00 10.00 O ATOM 0 H GLY A 96 4.679 -8.622 -18.874 1.00 10.00 H new ATOM 0 HA2 GLY A 96 5.928 -10.217 -17.808 1.00 10.00 H new ATOM 0 HA3 GLY A 96 7.023 -10.323 -19.172 1.00 10.00 H new ATOM 1248 N GLY A 97 7.511 -7.468 -18.174 1.00 10.00 N ATOM 1249 CA GLY A 97 8.415 -6.526 -17.561 1.00 10.00 C ATOM 1250 C GLY A 97 8.509 -5.253 -18.367 1.00 10.00 C ATOM 1251 O GLY A 97 9.561 -4.581 -18.310 1.00 10.00 O ATOM 0 H GLY A 97 6.915 -7.071 -18.900 1.00 10.00 H new ATOM 0 HA2 GLY A 97 8.074 -6.296 -16.552 1.00 10.00 H new ATOM 0 HA3 GLY A 97 9.404 -6.975 -17.469 1.00 10.00 H new ATOM 1256 N ASN B 357 -5.114 -15.586 5.316 1.00 10.00 N ATOM 1257 CA ASN B 357 -4.561 -15.847 6.664 1.00 10.00 C ATOM 1258 C ASN B 357 -3.038 -15.742 6.654 1.00 10.00 C ATOM 1259 O ASN B 357 -2.372 -16.195 7.578 1.00 10.00 O ATOM 1260 CB ASN B 357 -4.985 -17.238 7.154 1.00 10.00 C ATOM 1261 CG ASN B 357 -4.893 -17.382 8.663 1.00 10.00 C ATOM 1262 OD1 ASN B 357 -5.115 -16.425 9.405 1.00 10.00 O ATOM 1263 ND2 ASN B 357 -4.579 -18.579 9.128 1.00 10.00 N ATOM 0 HA ASN B 357 -4.957 -15.094 7.345 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -6.009 -17.434 6.836 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -4.355 -17.992 6.682 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -4.514 -18.734 10.134 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -4.402 -19.347 8.481 1.00 10.00 H new ATOM 1270 N ASN B 358 -2.484 -15.141 5.604 1.00 10.00 N ATOM 1271 CA ASN B 358 -1.037 -14.989 5.506 1.00 10.00 C ATOM 1272 C ASN B 358 -0.692 -13.520 5.422 1.00 10.00 C ATOM 1273 O ASN B 358 -1.174 -12.821 4.541 1.00 10.00 O ATOM 1274 CB ASN B 358 -0.518 -15.713 4.259 1.00 10.00 C ATOM 1275 CG ASN B 358 0.993 -15.813 4.215 1.00 10.00 C ATOM 1276 OD1 ASN B 358 1.666 -15.740 5.244 1.00 10.00 O ATOM 1277 ND2 ASN B 358 1.539 -16.001 3.022 1.00 10.00 N ATOM 0 H ASN B 358 -3.008 -14.756 4.818 1.00 10.00 H new ATOM 0 HA ASN B 358 -0.569 -15.424 6.389 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -0.944 -16.716 4.225 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -0.867 -15.188 3.370 1.00 10.00 H new ATOM 0 HD21 ASN B 358 2.551 -16.091 2.933 1.00 10.00 H new ATOM 0 HD22 ASN B 358 0.947 -16.056 2.193 1.00 10.00 H new ATOM 1284 N ARG B 359 0.153 -13.052 6.325 1.00 10.00 N ATOM 1285 CA ARG B 359 0.546 -11.653 6.314 1.00 10.00 C ATOM 1286 C ARG B 359 2.056 -11.504 6.238 1.00 10.00 C ATOM 1287 O ARG B 359 2.801 -12.107 7.013 1.00 10.00 O ATOM 1288 CB ARG B 359 -0.004 -10.909 7.542 1.00 10.00 C ATOM 1289 CG ARG B 359 0.381 -11.529 8.881 1.00 10.00 C ATOM 1290 CD ARG B 359 0.085 -10.587 10.044 1.00 10.00 C ATOM 1291 NE ARG B 359 0.622 -11.084 11.316 1.00 10.00 N ATOM 1292 CZ ARG B 359 0.807 -10.324 12.398 1.00 10.00 C ATOM 1293 NH1 ARG B 359 0.469 -9.039 12.376 1.00 10.00 N ATOM 1294 NH2 ARG B 359 1.327 -10.850 13.503 1.00 10.00 N ATOM 0 H ARG B 359 0.575 -13.611 7.066 1.00 10.00 H new ATOM 0 HA ARG B 359 0.114 -11.203 5.420 1.00 10.00 H new ATOM 0 HB2 ARG B 359 0.352 -9.879 7.517 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -1.091 -10.872 7.472 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -0.165 -12.462 9.020 1.00 10.00 H new ATOM 0 HG3 ARG B 359 1.442 -11.778 8.875 1.00 10.00 H new ATOM 0 HD2 ARG B 359 0.511 -9.606 9.831 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -0.993 -10.454 10.135 1.00 10.00 H new ATOM 0 HE ARG B 359 0.869 -12.072 11.377 1.00 10.00 H new ATOM 0 HH11 ARG B 359 0.067 -8.632 11.531 1.00 10.00 H new ATOM 0 HH12 ARG B 359 0.611 -8.460 13.204 1.00 10.00 H new ATOM 0 HH21 ARG B 359 1.586 -11.836 13.525 1.00 10.00 H new ATOM 0 HH22 ARG B 359 1.467 -10.267 14.328 1.00 10.00 H new ATOM 1308 N ASP B 360 2.497 -10.709 5.284 1.00 10.00 N ATOM 1309 CA ASP B 360 3.911 -10.420 5.112 1.00 10.00 C ATOM 1310 C ASP B 360 4.092 -8.915 5.247 1.00 10.00 C ATOM 1311 O ASP B 360 3.382 -8.157 4.595 1.00 10.00 O ATOM 1312 CB ASP B 360 4.412 -10.923 3.749 1.00 10.00 C ATOM 1313 CG ASP B 360 5.883 -10.624 3.524 1.00 10.00 C ATOM 1314 OD1 ASP B 360 6.217 -9.986 2.507 1.00 10.00 O ATOM 1315 OD2 ASP B 360 6.716 -11.032 4.366 1.00 10.00 O ATOM 0 H ASP B 360 1.890 -10.246 4.608 1.00 10.00 H new ATOM 0 HA ASP B 360 4.500 -10.936 5.870 1.00 10.00 H new ATOM 0 HB2 ASP B 360 4.248 -11.998 3.680 1.00 10.00 H new ATOM 0 HB3 ASP B 360 3.825 -10.460 2.956 1.00 10.00 H new ATOM 1320 N PRO B 361 5.039 -8.442 6.067 1.00 10.00 N ATOM 1321 CA PRO B 361 5.238 -7.023 6.269 1.00 10.00 C ATOM 1322 C PRO B 361 6.519 -6.493 5.633 1.00 10.00 C ATOM 1323 O PRO B 361 7.607 -7.044 5.788 1.00 10.00 O ATOM 1324 CB PRO B 361 5.355 -6.961 7.796 1.00 10.00 C ATOM 1325 CG PRO B 361 5.929 -8.294 8.203 1.00 10.00 C ATOM 1326 CD PRO B 361 5.870 -9.205 6.993 1.00 10.00 C ATOM 0 HA PRO B 361 4.447 -6.421 5.822 1.00 10.00 H new ATOM 0 HB2 PRO B 361 6.002 -6.142 8.108 1.00 10.00 H new ATOM 0 HB3 PRO B 361 4.383 -6.793 8.259 1.00 10.00 H new ATOM 0 HG2 PRO B 361 6.957 -8.180 8.547 1.00 10.00 H new ATOM 0 HG3 PRO B 361 5.361 -8.719 9.031 1.00 10.00 H new ATOM 0 HD2 PRO B 361 6.861 -9.401 6.583 1.00 10.00 H new ATOM 0 HD3 PRO B 361 5.428 -10.172 7.233 1.00 10.00 H new ATOM 1334 N ILE B 362 6.344 -5.410 4.895 1.00 10.00 N ATOM 1335 CA ILE B 362 7.430 -4.746 4.202 1.00 10.00 C ATOM 1336 C ILE B 362 7.592 -3.337 4.737 1.00 10.00 C ATOM 1337 O ILE B 362 6.607 -2.628 4.951 1.00 10.00 O ATOM 1338 CB ILE B 362 7.194 -4.651 2.685 1.00 10.00 C ATOM 1339 CG1 ILE B 362 6.416 -5.867 2.171 1.00 10.00 C ATOM 1340 CG2 ILE B 362 8.522 -4.507 1.951 1.00 10.00 C ATOM 1341 CD1 ILE B 362 6.061 -5.767 0.707 1.00 10.00 C ATOM 0 H ILE B 362 5.436 -4.965 4.760 1.00 10.00 H new ATOM 0 HA ILE B 362 8.324 -5.345 4.376 1.00 10.00 H new ATOM 0 HB ILE B 362 6.591 -3.764 2.488 1.00 10.00 H new ATOM 0 HG12 ILE B 362 7.010 -6.766 2.334 1.00 10.00 H new ATOM 0 HG13 ILE B 362 5.502 -5.979 2.754 1.00 10.00 H new ATOM 0 HG21 ILE B 362 8.340 -4.441 0.878 1.00 10.00 H new ATOM 0 HG22 ILE B 362 9.029 -3.603 2.289 1.00 10.00 H new ATOM 0 HG23 ILE B 362 9.149 -5.374 2.160 1.00 10.00 H new ATOM 0 HD11 ILE B 362 5.511 -6.658 0.404 1.00 10.00 H new ATOM 0 HD12 ILE B 362 5.442 -4.885 0.542 1.00 10.00 H new ATOM 0 HD13 ILE B 362 6.973 -5.685 0.116 1.00 10.00 H new ATOM 1353 N VAL B 363 8.826 -2.941 4.958 1.00 10.00 N ATOM 1354 CA VAL B 363 9.115 -1.627 5.483 1.00 10.00 C ATOM 1355 C VAL B 363 9.841 -0.815 4.421 1.00 10.00 C ATOM 1356 O VAL B 363 10.784 -1.286 3.787 1.00 10.00 O ATOM 1357 CB VAL B 363 9.957 -1.695 6.770 1.00 10.00 C ATOM 1358 CG1 VAL B 363 10.222 -0.300 7.314 1.00 10.00 C ATOM 1359 CG2 VAL B 363 9.248 -2.547 7.808 1.00 10.00 C ATOM 0 H VAL B 363 9.650 -3.516 4.780 1.00 10.00 H new ATOM 0 HA VAL B 363 8.172 -1.146 5.741 1.00 10.00 H new ATOM 0 HB VAL B 363 10.918 -2.153 6.535 1.00 10.00 H new ATOM 0 HG11 VAL B 363 10.818 -0.371 8.224 1.00 10.00 H new ATOM 0 HG12 VAL B 363 10.764 0.284 6.570 1.00 10.00 H new ATOM 0 HG13 VAL B 363 9.274 0.189 7.539 1.00 10.00 H new ATOM 0 HG21 VAL B 363 9.850 -2.590 8.716 1.00 10.00 H new ATOM 0 HG22 VAL B 363 8.277 -2.108 8.037 1.00 10.00 H new ATOM 0 HG23 VAL B 363 9.108 -3.555 7.417 1.00 10.00 H new ATOM 1369 N ILE B 364 9.372 0.405 4.246 1.00 10.00 N ATOM 1370 CA ILE B 364 9.883 1.311 3.241 1.00 10.00 C ATOM 1371 C ILE B 364 10.541 2.518 3.883 1.00 10.00 C ATOM 1372 O ILE B 364 10.119 2.991 4.943 1.00 10.00 O ATOM 1373 CB ILE B 364 8.782 1.764 2.242 1.00 10.00 C ATOM 1374 CG1 ILE B 364 9.427 2.174 0.916 1.00 10.00 C ATOM 1375 CG2 ILE B 364 7.936 2.907 2.798 1.00 10.00 C ATOM 1376 CD1 ILE B 364 9.941 1.004 0.106 1.00 10.00 C ATOM 0 H ILE B 364 8.616 0.798 4.806 1.00 10.00 H new ATOM 0 HA ILE B 364 10.633 0.761 2.673 1.00 10.00 H new ATOM 0 HB ILE B 364 8.112 0.920 2.078 1.00 10.00 H new ATOM 0 HG12 ILE B 364 8.698 2.724 0.322 1.00 10.00 H new ATOM 0 HG13 ILE B 364 10.253 2.856 1.119 1.00 10.00 H new ATOM 0 HG21 ILE B 364 7.180 3.190 2.065 1.00 10.00 H new ATOM 0 HG22 ILE B 364 7.447 2.584 3.717 1.00 10.00 H new ATOM 0 HG23 ILE B 364 8.576 3.764 3.009 1.00 10.00 H new ATOM 0 HD11 ILE B 364 10.385 1.370 -0.820 1.00 10.00 H new ATOM 0 HD12 ILE B 364 10.694 0.466 0.682 1.00 10.00 H new ATOM 0 HD13 ILE B 364 9.115 0.332 -0.128 1.00 10.00 H new