USER MOD reduce.3.24.130724 H: found=0, std=0, add=884, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 882 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 67:sc= 0.453 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.0814 K(o=-0.081,f=-2.1!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000626) USER MOD Single : A 27 GLN : amide:sc=-0.00826 X(o=-0.0083,f=-0.0083) USER MOD Single : A 29 ASN : amide:sc= -0.861 K(o=-0.86,f=-0.016) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 CYS SG : rot 37:sc= 0.511 USER MOD Single : A 42 TYR OH : rot 150:sc= -0.669 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -159:sc= -0.128 (180deg=-0.523) USER MOD Single : A 47 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.109) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc=-0.00414 USER MOD Single : A 59 SER OG : rot -59:sc= 0.00238 USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=-0.051) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 HIS : no HD1:sc= -2.27 K(o=-2.3,f=-2.9) USER MOD Single : A 76 THR OG1 : rot 106:sc= 0.716 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 HIS : no HD1:sc= -6.57! C(o=-6.6!,f=-6.5!) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= -1.51 K(o=-1.5,f=-3.4!) USER MOD Single : A 102 GLN : amide:sc= -0.137 X(o=-0.14,f=-0.0086) USER MOD Single : A 104 MET CE :methyl -179:sc= -0.395 (180deg=-0.396) USER MOD Single : A 111 GLN : amide:sc= -7.89! C(o=-7.9!,f=-10!) USER MOD Single : A 112 SER OG : rot 67:sc= 1.15 USER MOD Single : A 115 SER OG : rot 46:sc= 0.645 USER MOD Single : A 116 SER OG : rot -57:sc= 0.0271 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 0.972 20.286 8.577 1.00 0.00 N ATOM 2 CA GLY A 1 0.501 19.182 9.394 1.00 0.00 C ATOM 3 C GLY A 1 1.171 17.870 9.036 1.00 0.00 C ATOM 4 O GLY A 1 1.960 17.336 9.815 1.00 0.00 O ATOM 0 H1 GLY A 1 0.484 21.160 8.860 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.997 20.403 8.709 1.00 0.00 H new ATOM 0 H3 GLY A 1 0.772 20.087 7.576 1.00 0.00 H new ATOM 0 HA2 GLY A 1 0.686 19.406 10.444 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -0.578 19.080 9.275 1.00 0.00 H new ATOM 8 N SER A 2 0.854 17.348 7.855 1.00 0.00 N ATOM 9 CA SER A 2 1.426 16.087 7.399 1.00 0.00 C ATOM 10 C SER A 2 2.797 16.310 6.767 1.00 0.00 C ATOM 11 O SER A 2 3.104 15.755 5.712 1.00 0.00 O ATOM 12 CB SER A 2 0.491 15.413 6.392 1.00 0.00 C ATOM 13 OG SER A 2 0.492 16.103 5.154 1.00 0.00 O ATOM 0 H SER A 2 0.204 17.779 7.197 1.00 0.00 H new ATOM 0 HA SER A 2 1.546 15.436 8.265 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.803 14.380 6.236 1.00 0.00 H new ATOM 0 HB3 SER A 2 -0.522 15.383 6.795 1.00 0.00 H new ATOM 0 HG SER A 2 1.373 16.018 4.733 1.00 0.00 H new ATOM 19 N SER A 3 3.617 17.126 7.421 1.00 0.00 N ATOM 20 CA SER A 3 4.954 17.426 6.923 1.00 0.00 C ATOM 21 C SER A 3 5.954 17.519 8.072 1.00 0.00 C ATOM 22 O SER A 3 5.675 18.128 9.104 1.00 0.00 O ATOM 23 CB SER A 3 4.945 18.736 6.132 1.00 0.00 C ATOM 24 OG SER A 3 4.041 18.667 5.043 1.00 0.00 O ATOM 0 H SER A 3 3.379 17.591 8.297 1.00 0.00 H new ATOM 0 HA SER A 3 5.260 16.614 6.263 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.666 19.560 6.789 1.00 0.00 H new ATOM 0 HB3 SER A 3 5.948 18.949 5.763 1.00 0.00 H new ATOM 0 HG SER A 3 4.052 19.516 4.554 1.00 0.00 H new ATOM 30 N GLY A 4 7.121 16.910 7.883 1.00 0.00 N ATOM 31 CA GLY A 4 8.145 16.936 8.911 1.00 0.00 C ATOM 32 C GLY A 4 7.992 15.806 9.910 1.00 0.00 C ATOM 33 O GLY A 4 8.123 14.634 9.557 1.00 0.00 O ATOM 0 H GLY A 4 7.375 16.400 7.037 1.00 0.00 H new ATOM 0 HA2 GLY A 4 9.127 16.872 8.443 1.00 0.00 H new ATOM 0 HA3 GLY A 4 8.104 17.890 9.437 1.00 0.00 H new ATOM 37 N SER A 5 7.716 16.158 11.162 1.00 0.00 N ATOM 38 CA SER A 5 7.551 15.164 12.216 1.00 0.00 C ATOM 39 C SER A 5 6.652 14.022 11.751 1.00 0.00 C ATOM 40 O SER A 5 5.760 14.217 10.925 1.00 0.00 O ATOM 41 CB SER A 5 6.962 15.814 13.470 1.00 0.00 C ATOM 42 OG SER A 5 7.299 15.077 14.632 1.00 0.00 O ATOM 0 H SER A 5 7.602 17.123 11.471 1.00 0.00 H new ATOM 0 HA SER A 5 8.533 14.755 12.453 1.00 0.00 H new ATOM 0 HB2 SER A 5 7.333 16.835 13.563 1.00 0.00 H new ATOM 0 HB3 SER A 5 5.878 15.876 13.376 1.00 0.00 H new ATOM 0 HG SER A 5 6.913 15.513 15.420 1.00 0.00 H new ATOM 48 N SER A 6 6.895 12.831 12.287 1.00 0.00 N ATOM 49 CA SER A 6 6.111 11.656 11.925 1.00 0.00 C ATOM 50 C SER A 6 5.463 11.034 13.159 1.00 0.00 C ATOM 51 O SER A 6 6.005 11.103 14.260 1.00 0.00 O ATOM 52 CB SER A 6 6.995 10.623 11.224 1.00 0.00 C ATOM 53 OG SER A 6 7.676 11.198 10.123 1.00 0.00 O ATOM 0 H SER A 6 7.628 12.654 12.973 1.00 0.00 H new ATOM 0 HA SER A 6 5.322 11.972 11.242 1.00 0.00 H new ATOM 0 HB2 SER A 6 7.718 10.218 11.932 1.00 0.00 H new ATOM 0 HB3 SER A 6 6.383 9.789 10.882 1.00 0.00 H new ATOM 0 HG SER A 6 8.235 10.518 9.693 1.00 0.00 H new ATOM 59 N GLY A 7 4.297 10.425 12.963 1.00 0.00 N ATOM 60 CA GLY A 7 3.592 9.800 14.067 1.00 0.00 C ATOM 61 C GLY A 7 3.414 8.308 13.871 1.00 0.00 C ATOM 62 O GLY A 7 2.915 7.867 12.836 1.00 0.00 O ATOM 0 H GLY A 7 3.828 10.353 12.060 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.140 9.979 14.992 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.614 10.268 14.181 1.00 0.00 H new ATOM 66 N ASN A 8 3.825 7.528 14.865 1.00 0.00 N ATOM 67 CA ASN A 8 3.710 6.075 14.796 1.00 0.00 C ATOM 68 C ASN A 8 2.247 5.643 14.834 1.00 0.00 C ATOM 69 O ASN A 8 1.465 6.136 15.647 1.00 0.00 O ATOM 70 CB ASN A 8 4.476 5.426 15.950 1.00 0.00 C ATOM 71 CG ASN A 8 5.964 5.715 15.891 1.00 0.00 C ATOM 72 OD1 ASN A 8 6.383 6.873 15.899 1.00 0.00 O ATOM 73 ND2 ASN A 8 6.769 4.661 15.832 1.00 0.00 N ATOM 0 H ASN A 8 4.241 7.877 15.728 1.00 0.00 H new ATOM 0 HA ASN A 8 4.143 5.746 13.852 1.00 0.00 H new ATOM 0 HB2 ASN A 8 4.076 5.788 16.897 1.00 0.00 H new ATOM 0 HB3 ASN A 8 4.317 4.348 15.927 1.00 0.00 H new ATOM 0 HD21 ASN A 8 7.780 4.793 15.791 1.00 0.00 H new ATOM 0 HD22 ASN A 8 6.377 3.719 15.828 1.00 0.00 H new ATOM 80 N ALA A 9 1.886 4.718 13.951 1.00 0.00 N ATOM 81 CA ALA A 9 0.519 4.217 13.886 1.00 0.00 C ATOM 82 C ALA A 9 0.489 2.694 13.946 1.00 0.00 C ATOM 83 O ALA A 9 1.463 2.017 13.618 1.00 0.00 O ATOM 84 CB ALA A 9 -0.165 4.711 12.619 1.00 0.00 C ATOM 0 H ALA A 9 2.521 4.300 13.271 1.00 0.00 H new ATOM 0 HA ALA A 9 -0.023 4.599 14.751 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -1.185 4.329 12.584 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -0.185 5.801 12.618 1.00 0.00 H new ATOM 0 HB3 ALA A 9 0.385 4.357 11.747 1.00 0.00 H new ATOM 90 N PRO A 10 -0.655 2.140 14.375 1.00 0.00 N ATOM 91 CA PRO A 10 -0.839 0.690 14.487 1.00 0.00 C ATOM 92 C PRO A 10 -0.904 0.006 13.126 1.00 0.00 C ATOM 93 O PRO A 10 -1.118 0.656 12.103 1.00 0.00 O ATOM 94 CB PRO A 10 -2.179 0.558 15.217 1.00 0.00 C ATOM 95 CG PRO A 10 -2.908 1.818 14.899 1.00 0.00 C ATOM 96 CD PRO A 10 -1.857 2.887 14.782 1.00 0.00 C ATOM 0 HA PRO A 10 -0.007 0.213 15.004 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -2.732 -0.317 14.875 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -2.035 0.444 16.291 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -3.470 1.720 13.970 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -3.626 2.061 15.682 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -2.131 3.641 14.044 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -1.706 3.407 15.728 1.00 0.00 H new ATOM 104 N VAL A 11 -0.718 -1.310 13.121 1.00 0.00 N ATOM 105 CA VAL A 11 -0.757 -2.083 11.885 1.00 0.00 C ATOM 106 C VAL A 11 -2.175 -2.165 11.333 1.00 0.00 C ATOM 107 O VAL A 11 -3.147 -2.202 12.089 1.00 0.00 O ATOM 108 CB VAL A 11 -0.217 -3.509 12.098 1.00 0.00 C ATOM 109 CG1 VAL A 11 -0.974 -4.206 13.218 1.00 0.00 C ATOM 110 CG2 VAL A 11 -0.303 -4.309 10.807 1.00 0.00 C ATOM 0 H VAL A 11 -0.539 -1.863 13.959 1.00 0.00 H new ATOM 0 HA VAL A 11 -0.121 -1.565 11.167 1.00 0.00 H new ATOM 0 HB VAL A 11 0.831 -3.442 12.388 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -0.578 -5.212 13.353 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -0.856 -3.642 14.143 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -2.032 -4.264 12.961 1.00 0.00 H new ATOM 0 HG21 VAL A 11 0.083 -5.314 10.976 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.342 -4.369 10.484 1.00 0.00 H new ATOM 0 HG23 VAL A 11 0.289 -3.818 10.035 1.00 0.00 H new ATOM 120 N THR A 12 -2.288 -2.195 10.009 1.00 0.00 N ATOM 121 CA THR A 12 -3.588 -2.272 9.354 1.00 0.00 C ATOM 122 C THR A 12 -3.935 -3.711 8.988 1.00 0.00 C ATOM 123 O THR A 12 -5.051 -4.172 9.228 1.00 0.00 O ATOM 124 CB THR A 12 -3.628 -1.407 8.080 1.00 0.00 C ATOM 125 OG1 THR A 12 -3.289 -0.053 8.397 1.00 0.00 O ATOM 126 CG2 THR A 12 -5.007 -1.452 7.439 1.00 0.00 C ATOM 0 H THR A 12 -1.494 -2.167 9.369 1.00 0.00 H new ATOM 0 HA THR A 12 -4.322 -1.893 10.065 1.00 0.00 H new ATOM 0 HB THR A 12 -2.902 -1.807 7.372 1.00 0.00 H new ATOM 0 HG1 THR A 12 -3.315 0.490 7.582 1.00 0.00 H new ATOM 0 HG21 THR A 12 -5.011 -0.834 6.541 1.00 0.00 H new ATOM 0 HG22 THR A 12 -5.251 -2.480 7.173 1.00 0.00 H new ATOM 0 HG23 THR A 12 -5.748 -1.074 8.143 1.00 0.00 H new ATOM 134 N LYS A 13 -2.971 -4.417 8.407 1.00 0.00 N ATOM 135 CA LYS A 13 -3.173 -5.806 8.010 1.00 0.00 C ATOM 136 C LYS A 13 -1.843 -6.550 7.940 1.00 0.00 C ATOM 137 O LYS A 13 -0.801 -5.955 7.667 1.00 0.00 O ATOM 138 CB LYS A 13 -3.879 -5.872 6.654 1.00 0.00 C ATOM 139 CG LYS A 13 -4.381 -7.260 6.297 1.00 0.00 C ATOM 140 CD LYS A 13 -5.393 -7.213 5.164 1.00 0.00 C ATOM 141 CE LYS A 13 -5.662 -8.599 4.600 1.00 0.00 C ATOM 142 NZ LYS A 13 -6.620 -9.366 5.445 1.00 0.00 N ATOM 0 H LYS A 13 -2.042 -4.050 8.200 1.00 0.00 H new ATOM 0 HA LYS A 13 -3.799 -6.286 8.762 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -4.721 -5.180 6.658 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -3.192 -5.533 5.879 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -3.539 -7.889 6.008 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -4.836 -7.720 7.174 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -6.325 -6.779 5.525 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -5.024 -6.562 4.372 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -6.061 -8.509 3.590 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -4.724 -9.149 4.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -6.777 -10.305 5.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -6.229 -9.474 6.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -7.524 -8.854 5.497 1.00 0.00 H new ATOM 156 N ALA A 14 -1.887 -7.855 8.186 1.00 0.00 N ATOM 157 CA ALA A 14 -0.686 -8.681 8.147 1.00 0.00 C ATOM 158 C ALA A 14 -1.032 -10.139 7.865 1.00 0.00 C ATOM 159 O ALA A 14 -1.960 -10.692 8.454 1.00 0.00 O ATOM 160 CB ALA A 14 0.079 -8.561 9.456 1.00 0.00 C ATOM 0 H ALA A 14 -2.741 -8.363 8.414 1.00 0.00 H new ATOM 0 HA ALA A 14 -0.053 -8.322 7.335 1.00 0.00 H new ATOM 0 HB1 ALA A 14 0.973 -9.183 9.413 1.00 0.00 H new ATOM 0 HB2 ALA A 14 0.367 -7.522 9.615 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -0.554 -8.892 10.279 1.00 0.00 H new ATOM 166 N GLY A 15 -0.279 -10.757 6.961 1.00 0.00 N ATOM 167 CA GLY A 15 -0.522 -12.146 6.617 1.00 0.00 C ATOM 168 C GLY A 15 0.561 -12.721 5.726 1.00 0.00 C ATOM 169 O GLY A 15 1.312 -11.979 5.093 1.00 0.00 O ATOM 0 H GLY A 15 0.495 -10.321 6.460 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -0.588 -12.737 7.530 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -1.485 -12.229 6.113 1.00 0.00 H new ATOM 173 N TRP A 16 0.644 -14.045 5.677 1.00 0.00 N ATOM 174 CA TRP A 16 1.645 -14.719 4.858 1.00 0.00 C ATOM 175 C TRP A 16 1.295 -14.618 3.377 1.00 0.00 C ATOM 176 O TRP A 16 0.374 -15.282 2.900 1.00 0.00 O ATOM 177 CB TRP A 16 1.764 -16.188 5.267 1.00 0.00 C ATOM 178 CG TRP A 16 2.482 -16.386 6.568 1.00 0.00 C ATOM 179 CD1 TRP A 16 1.917 -16.536 7.802 1.00 0.00 C ATOM 180 CD2 TRP A 16 3.899 -16.455 6.762 1.00 0.00 C ATOM 181 NE1 TRP A 16 2.897 -16.692 8.752 1.00 0.00 N ATOM 182 CE2 TRP A 16 4.121 -16.647 8.140 1.00 0.00 C ATOM 183 CE3 TRP A 16 5.001 -16.374 5.907 1.00 0.00 C ATOM 184 CZ2 TRP A 16 5.400 -16.759 8.679 1.00 0.00 C ATOM 185 CZ3 TRP A 16 6.270 -16.484 6.443 1.00 0.00 C ATOM 186 CH2 TRP A 16 6.461 -16.676 7.818 1.00 0.00 C ATOM 0 H TRP A 16 0.030 -14.674 6.195 1.00 0.00 H new ATOM 0 HA TRP A 16 2.603 -14.225 5.020 1.00 0.00 H new ATOM 0 HB2 TRP A 16 0.766 -16.619 5.342 1.00 0.00 H new ATOM 0 HB3 TRP A 16 2.289 -16.735 4.484 1.00 0.00 H new ATOM 0 HD1 TRP A 16 0.856 -16.533 8.002 1.00 0.00 H new ATOM 0 HE1 TRP A 16 2.738 -16.821 9.751 1.00 0.00 H new ATOM 0 HE3 TRP A 16 4.864 -16.228 4.846 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 5.550 -16.906 9.738 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 7.129 -16.421 5.791 1.00 0.00 H new ATOM 0 HH2 TRP A 16 7.465 -16.760 8.206 1.00 0.00 H new ATOM 197 N LEU A 17 2.035 -13.784 2.655 1.00 0.00 N ATOM 198 CA LEU A 17 1.802 -13.596 1.227 1.00 0.00 C ATOM 199 C LEU A 17 3.013 -14.043 0.415 1.00 0.00 C ATOM 200 O LEU A 17 4.157 -13.806 0.804 1.00 0.00 O ATOM 201 CB LEU A 17 1.488 -12.129 0.930 1.00 0.00 C ATOM 202 CG LEU A 17 0.030 -11.705 1.111 1.00 0.00 C ATOM 203 CD1 LEU A 17 -0.108 -10.196 0.980 1.00 0.00 C ATOM 204 CD2 LEU A 17 -0.861 -12.413 0.100 1.00 0.00 C ATOM 0 H LEU A 17 2.801 -13.227 3.034 1.00 0.00 H new ATOM 0 HA LEU A 17 0.948 -14.209 0.939 1.00 0.00 H new ATOM 0 HB2 LEU A 17 2.109 -11.507 1.575 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.783 -11.916 -0.098 1.00 0.00 H new ATOM 0 HG LEU A 17 -0.290 -11.993 2.112 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -1.152 -9.913 1.112 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.499 -9.708 1.742 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.230 -9.884 -0.008 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.895 -12.099 0.244 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.541 -12.156 -0.910 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -0.786 -13.491 0.241 1.00 0.00 H new ATOM 216 N PHE A 18 2.755 -14.689 -0.717 1.00 0.00 N ATOM 217 CA PHE A 18 3.824 -15.168 -1.586 1.00 0.00 C ATOM 218 C PHE A 18 4.254 -14.082 -2.567 1.00 0.00 C ATOM 219 O PHE A 18 3.464 -13.628 -3.396 1.00 0.00 O ATOM 220 CB PHE A 18 3.369 -16.412 -2.351 1.00 0.00 C ATOM 221 CG PHE A 18 3.107 -17.598 -1.467 1.00 0.00 C ATOM 222 CD1 PHE A 18 2.137 -17.540 -0.479 1.00 0.00 C ATOM 223 CD2 PHE A 18 3.829 -18.769 -1.624 1.00 0.00 C ATOM 224 CE1 PHE A 18 1.894 -18.629 0.337 1.00 0.00 C ATOM 225 CE2 PHE A 18 3.590 -19.862 -0.812 1.00 0.00 C ATOM 226 CZ PHE A 18 2.621 -19.792 0.169 1.00 0.00 C ATOM 0 H PHE A 18 1.814 -14.893 -1.054 1.00 0.00 H new ATOM 0 HA PHE A 18 4.679 -15.427 -0.961 1.00 0.00 H new ATOM 0 HB2 PHE A 18 2.461 -16.175 -2.906 1.00 0.00 H new ATOM 0 HB3 PHE A 18 4.131 -16.677 -3.084 1.00 0.00 H new ATOM 0 HD1 PHE A 18 1.565 -16.634 -0.345 1.00 0.00 H new ATOM 0 HD2 PHE A 18 4.588 -18.829 -2.390 1.00 0.00 H new ATOM 0 HE1 PHE A 18 1.137 -18.571 1.105 1.00 0.00 H new ATOM 0 HE2 PHE A 18 4.160 -20.769 -0.945 1.00 0.00 H new ATOM 0 HZ PHE A 18 2.432 -20.645 0.804 1.00 0.00 H new ATOM 236 N LYS A 19 5.513 -13.669 -2.468 1.00 0.00 N ATOM 237 CA LYS A 19 6.052 -12.637 -3.347 1.00 0.00 C ATOM 238 C LYS A 19 6.826 -13.258 -4.505 1.00 0.00 C ATOM 239 O LYS A 19 7.838 -13.927 -4.298 1.00 0.00 O ATOM 240 CB LYS A 19 6.963 -11.693 -2.559 1.00 0.00 C ATOM 241 CG LYS A 19 7.179 -10.350 -3.237 1.00 0.00 C ATOM 242 CD LYS A 19 8.343 -9.595 -2.619 1.00 0.00 C ATOM 243 CE LYS A 19 8.525 -8.228 -3.261 1.00 0.00 C ATOM 244 NZ LYS A 19 9.342 -8.303 -4.503 1.00 0.00 N ATOM 0 H LYS A 19 6.180 -14.033 -1.787 1.00 0.00 H new ATOM 0 HA LYS A 19 5.216 -12.069 -3.755 1.00 0.00 H new ATOM 0 HB2 LYS A 19 6.533 -11.527 -1.571 1.00 0.00 H new ATOM 0 HB3 LYS A 19 7.929 -12.175 -2.409 1.00 0.00 H new ATOM 0 HG2 LYS A 19 7.367 -10.504 -4.300 1.00 0.00 H new ATOM 0 HG3 LYS A 19 6.272 -9.751 -3.157 1.00 0.00 H new ATOM 0 HD2 LYS A 19 8.174 -9.476 -1.549 1.00 0.00 H new ATOM 0 HD3 LYS A 19 9.258 -10.177 -2.734 1.00 0.00 H new ATOM 0 HE2 LYS A 19 7.549 -7.803 -3.494 1.00 0.00 H new ATOM 0 HE3 LYS A 19 9.005 -7.554 -2.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 9.443 -7.351 -4.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 10.283 -8.685 -4.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 8.872 -8.926 -5.191 1.00 0.00 H new ATOM 258 N GLN A 20 6.343 -13.032 -5.722 1.00 0.00 N ATOM 259 CA GLN A 20 6.991 -13.569 -6.913 1.00 0.00 C ATOM 260 C GLN A 20 8.421 -13.051 -7.035 1.00 0.00 C ATOM 261 O GLN A 20 8.662 -11.846 -6.975 1.00 0.00 O ATOM 262 CB GLN A 20 6.193 -13.199 -8.165 1.00 0.00 C ATOM 263 CG GLN A 20 6.405 -14.157 -9.326 1.00 0.00 C ATOM 264 CD GLN A 20 5.819 -13.638 -10.624 1.00 0.00 C ATOM 265 OE1 GLN A 20 6.326 -12.680 -11.209 1.00 0.00 O ATOM 266 NE2 GLN A 20 4.744 -14.269 -11.083 1.00 0.00 N ATOM 0 H GLN A 20 5.505 -12.481 -5.910 1.00 0.00 H new ATOM 0 HA GLN A 20 7.024 -14.655 -6.820 1.00 0.00 H new ATOM 0 HB2 GLN A 20 5.132 -13.173 -7.915 1.00 0.00 H new ATOM 0 HB3 GLN A 20 6.471 -12.193 -8.479 1.00 0.00 H new ATOM 0 HG2 GLN A 20 7.473 -14.332 -9.458 1.00 0.00 H new ATOM 0 HG3 GLN A 20 5.952 -15.119 -9.086 1.00 0.00 H new ATOM 0 HE21 GLN A 20 4.357 -15.059 -10.566 1.00 0.00 H new ATOM 0 HE22 GLN A 20 4.306 -13.964 -11.952 1.00 0.00 H new ATOM 275 N ALA A 21 9.365 -13.971 -7.206 1.00 0.00 N ATOM 276 CA ALA A 21 10.770 -13.607 -7.338 1.00 0.00 C ATOM 277 C ALA A 21 10.949 -12.453 -8.319 1.00 0.00 C ATOM 278 O ALA A 21 10.041 -12.131 -9.085 1.00 0.00 O ATOM 279 CB ALA A 21 11.587 -14.811 -7.783 1.00 0.00 C ATOM 0 H ALA A 21 9.182 -14.973 -7.256 1.00 0.00 H new ATOM 0 HA ALA A 21 11.128 -13.279 -6.362 1.00 0.00 H new ATOM 0 HB1 ALA A 21 12.635 -14.525 -7.878 1.00 0.00 H new ATOM 0 HB2 ALA A 21 11.494 -15.607 -7.044 1.00 0.00 H new ATOM 0 HB3 ALA A 21 11.219 -15.165 -8.746 1.00 0.00 H new ATOM 285 N SER A 22 12.124 -11.833 -8.288 1.00 0.00 N ATOM 286 CA SER A 22 12.420 -10.711 -9.171 1.00 0.00 C ATOM 287 C SER A 22 13.407 -11.122 -10.260 1.00 0.00 C ATOM 288 O SER A 22 13.286 -10.706 -11.412 1.00 0.00 O ATOM 289 CB SER A 22 12.987 -9.539 -8.369 1.00 0.00 C ATOM 290 OG SER A 22 12.025 -9.029 -7.461 1.00 0.00 O ATOM 0 H SER A 22 12.887 -12.089 -7.661 1.00 0.00 H new ATOM 0 HA SER A 22 11.490 -10.400 -9.647 1.00 0.00 H new ATOM 0 HB2 SER A 22 13.872 -9.863 -7.822 1.00 0.00 H new ATOM 0 HB3 SER A 22 13.305 -8.749 -9.049 1.00 0.00 H new ATOM 0 HG SER A 22 12.413 -8.282 -6.959 1.00 0.00 H new ATOM 296 N SER A 23 14.384 -11.941 -9.885 1.00 0.00 N ATOM 297 CA SER A 23 15.396 -12.406 -10.827 1.00 0.00 C ATOM 298 C SER A 23 14.758 -13.210 -11.956 1.00 0.00 C ATOM 299 O SER A 23 13.545 -13.414 -11.979 1.00 0.00 O ATOM 300 CB SER A 23 16.441 -13.258 -10.106 1.00 0.00 C ATOM 301 OG SER A 23 17.305 -12.452 -9.323 1.00 0.00 O ATOM 0 H SER A 23 14.497 -12.296 -8.936 1.00 0.00 H new ATOM 0 HA SER A 23 15.885 -11.532 -11.258 1.00 0.00 H new ATOM 0 HB2 SER A 23 15.942 -13.988 -9.468 1.00 0.00 H new ATOM 0 HB3 SER A 23 17.024 -13.819 -10.836 1.00 0.00 H new ATOM 0 HG SER A 23 17.963 -13.021 -8.871 1.00 0.00 H new ATOM 307 N GLY A 24 15.586 -13.665 -12.891 1.00 0.00 N ATOM 308 CA GLY A 24 15.086 -14.441 -14.011 1.00 0.00 C ATOM 309 C GLY A 24 14.034 -15.449 -13.593 1.00 0.00 C ATOM 310 O GLY A 24 12.948 -15.500 -14.171 1.00 0.00 O ATOM 0 H GLY A 24 16.594 -13.510 -12.893 1.00 0.00 H new ATOM 0 HA2 GLY A 24 14.663 -13.767 -14.756 1.00 0.00 H new ATOM 0 HA3 GLY A 24 15.916 -14.963 -14.487 1.00 0.00 H new ATOM 314 N VAL A 25 14.355 -16.256 -12.587 1.00 0.00 N ATOM 315 CA VAL A 25 13.430 -17.268 -12.092 1.00 0.00 C ATOM 316 C VAL A 25 12.011 -16.718 -12.002 1.00 0.00 C ATOM 317 O VAL A 25 11.804 -15.505 -11.976 1.00 0.00 O ATOM 318 CB VAL A 25 13.855 -17.790 -10.707 1.00 0.00 C ATOM 319 CG1 VAL A 25 15.164 -18.559 -10.805 1.00 0.00 C ATOM 320 CG2 VAL A 25 13.977 -16.639 -9.719 1.00 0.00 C ATOM 0 H VAL A 25 15.250 -16.228 -12.098 1.00 0.00 H new ATOM 0 HA VAL A 25 13.453 -18.092 -12.805 1.00 0.00 H new ATOM 0 HB VAL A 25 13.087 -18.472 -10.343 1.00 0.00 H new ATOM 0 HG11 VAL A 25 15.449 -18.920 -9.817 1.00 0.00 H new ATOM 0 HG12 VAL A 25 15.039 -19.406 -11.479 1.00 0.00 H new ATOM 0 HG13 VAL A 25 15.944 -17.902 -11.190 1.00 0.00 H new ATOM 0 HG21 VAL A 25 14.278 -17.026 -8.745 1.00 0.00 H new ATOM 0 HG22 VAL A 25 14.725 -15.931 -10.076 1.00 0.00 H new ATOM 0 HG23 VAL A 25 13.015 -16.135 -9.627 1.00 0.00 H new ATOM 330 N LYS A 26 11.035 -17.618 -11.954 1.00 0.00 N ATOM 331 CA LYS A 26 9.634 -17.225 -11.864 1.00 0.00 C ATOM 332 C LYS A 26 8.902 -18.053 -10.813 1.00 0.00 C ATOM 333 O LYS A 26 7.768 -18.481 -11.026 1.00 0.00 O ATOM 334 CB LYS A 26 8.949 -17.388 -13.223 1.00 0.00 C ATOM 335 CG LYS A 26 9.314 -16.303 -14.222 1.00 0.00 C ATOM 336 CD LYS A 26 8.581 -15.005 -13.927 1.00 0.00 C ATOM 337 CE LYS A 26 8.995 -13.901 -14.889 1.00 0.00 C ATOM 338 NZ LYS A 26 8.431 -14.112 -16.251 1.00 0.00 N ATOM 0 H LYS A 26 11.189 -18.626 -11.976 1.00 0.00 H new ATOM 0 HA LYS A 26 9.596 -16.177 -11.567 1.00 0.00 H new ATOM 0 HB2 LYS A 26 9.215 -18.359 -13.641 1.00 0.00 H new ATOM 0 HB3 LYS A 26 7.869 -17.388 -13.078 1.00 0.00 H new ATOM 0 HG2 LYS A 26 10.390 -16.129 -14.195 1.00 0.00 H new ATOM 0 HG3 LYS A 26 9.071 -16.638 -15.230 1.00 0.00 H new ATOM 0 HD2 LYS A 26 7.506 -15.168 -14.000 1.00 0.00 H new ATOM 0 HD3 LYS A 26 8.788 -14.694 -12.903 1.00 0.00 H new ATOM 0 HE2 LYS A 26 8.661 -12.938 -14.503 1.00 0.00 H new ATOM 0 HE3 LYS A 26 10.083 -13.860 -14.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 8.722 -13.330 -16.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 8.784 -15.011 -16.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 7.393 -14.142 -16.196 1.00 0.00 H new ATOM 352 N GLN A 27 9.558 -18.273 -9.678 1.00 0.00 N ATOM 353 CA GLN A 27 8.968 -19.049 -8.593 1.00 0.00 C ATOM 354 C GLN A 27 8.499 -18.137 -7.464 1.00 0.00 C ATOM 355 O GLN A 27 9.017 -17.035 -7.287 1.00 0.00 O ATOM 356 CB GLN A 27 9.978 -20.065 -8.057 1.00 0.00 C ATOM 357 CG GLN A 27 11.054 -19.448 -7.178 1.00 0.00 C ATOM 358 CD GLN A 27 11.888 -20.490 -6.458 1.00 0.00 C ATOM 359 OE1 GLN A 27 11.445 -21.085 -5.476 1.00 0.00 O ATOM 360 NE2 GLN A 27 13.103 -20.715 -6.944 1.00 0.00 N ATOM 0 H GLN A 27 10.497 -17.925 -9.486 1.00 0.00 H new ATOM 0 HA GLN A 27 8.103 -19.581 -8.989 1.00 0.00 H new ATOM 0 HB2 GLN A 27 9.447 -20.826 -7.486 1.00 0.00 H new ATOM 0 HB3 GLN A 27 10.453 -20.571 -8.898 1.00 0.00 H new ATOM 0 HG2 GLN A 27 11.706 -18.826 -7.791 1.00 0.00 H new ATOM 0 HG3 GLN A 27 10.586 -18.792 -6.444 1.00 0.00 H new ATOM 0 HE21 GLN A 27 13.429 -20.198 -7.761 1.00 0.00 H new ATOM 0 HE22 GLN A 27 13.710 -21.405 -6.501 1.00 0.00 H new ATOM 369 N TRP A 28 7.515 -18.604 -6.704 1.00 0.00 N ATOM 370 CA TRP A 28 6.975 -17.830 -5.592 1.00 0.00 C ATOM 371 C TRP A 28 7.649 -18.219 -4.280 1.00 0.00 C ATOM 372 O TRP A 28 7.873 -19.399 -4.014 1.00 0.00 O ATOM 373 CB TRP A 28 5.464 -18.038 -5.485 1.00 0.00 C ATOM 374 CG TRP A 28 4.711 -17.552 -6.687 1.00 0.00 C ATOM 375 CD1 TRP A 28 4.761 -18.070 -7.950 1.00 0.00 C ATOM 376 CD2 TRP A 28 3.798 -16.451 -6.738 1.00 0.00 C ATOM 377 NE1 TRP A 28 3.934 -17.357 -8.783 1.00 0.00 N ATOM 378 CE2 TRP A 28 3.331 -16.359 -8.064 1.00 0.00 C ATOM 379 CE3 TRP A 28 3.327 -15.535 -5.794 1.00 0.00 C ATOM 380 CZ2 TRP A 28 2.418 -15.387 -8.466 1.00 0.00 C ATOM 381 CZ3 TRP A 28 2.422 -14.571 -6.194 1.00 0.00 C ATOM 382 CH2 TRP A 28 1.974 -14.503 -7.520 1.00 0.00 C ATOM 0 H TRP A 28 7.075 -19.514 -6.837 1.00 0.00 H new ATOM 0 HA TRP A 28 7.176 -16.776 -5.784 1.00 0.00 H new ATOM 0 HB2 TRP A 28 5.260 -19.099 -5.342 1.00 0.00 H new ATOM 0 HB3 TRP A 28 5.095 -17.520 -4.600 1.00 0.00 H new ATOM 0 HD1 TRP A 28 5.362 -18.916 -8.249 1.00 0.00 H new ATOM 0 HE1 TRP A 28 3.792 -17.541 -9.776 1.00 0.00 H new ATOM 0 HE3 TRP A 28 3.665 -15.580 -4.769 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 2.073 -15.333 -9.488 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 2.053 -13.857 -5.472 1.00 0.00 H new ATOM 0 HH2 TRP A 28 1.265 -13.738 -7.801 1.00 0.00 H new ATOM 393 N ASN A 29 7.968 -17.219 -3.465 1.00 0.00 N ATOM 394 CA ASN A 29 8.616 -17.458 -2.180 1.00 0.00 C ATOM 395 C ASN A 29 7.782 -16.890 -1.036 1.00 0.00 C ATOM 396 O ASN A 29 7.780 -15.683 -0.794 1.00 0.00 O ATOM 397 CB ASN A 29 10.013 -16.835 -2.167 1.00 0.00 C ATOM 398 CG ASN A 29 11.063 -17.754 -2.760 1.00 0.00 C ATOM 399 OD1 ASN A 29 12.020 -18.138 -2.087 1.00 0.00 O ATOM 400 ND2 ASN A 29 10.888 -18.111 -4.027 1.00 0.00 N ATOM 0 H ASN A 29 7.789 -16.236 -3.671 1.00 0.00 H new ATOM 0 HA ASN A 29 8.705 -18.535 -2.040 1.00 0.00 H new ATOM 0 HB2 ASN A 29 9.996 -15.900 -2.726 1.00 0.00 H new ATOM 0 HB3 ASN A 29 10.288 -16.588 -1.142 1.00 0.00 H new ATOM 0 HD21 ASN A 29 11.562 -18.728 -4.481 1.00 0.00 H new ATOM 0 HD22 ASN A 29 10.080 -17.768 -4.546 1.00 0.00 H new ATOM 407 N LYS A 30 7.075 -17.769 -0.334 1.00 0.00 N ATOM 408 CA LYS A 30 6.238 -17.358 0.787 1.00 0.00 C ATOM 409 C LYS A 30 6.978 -16.371 1.685 1.00 0.00 C ATOM 410 O LYS A 30 8.098 -16.634 2.121 1.00 0.00 O ATOM 411 CB LYS A 30 5.804 -18.579 1.601 1.00 0.00 C ATOM 412 CG LYS A 30 4.912 -18.236 2.782 1.00 0.00 C ATOM 413 CD LYS A 30 4.205 -19.468 3.322 1.00 0.00 C ATOM 414 CE LYS A 30 3.344 -19.132 4.530 1.00 0.00 C ATOM 415 NZ LYS A 30 3.068 -20.332 5.366 1.00 0.00 N ATOM 0 H LYS A 30 7.065 -18.772 -0.522 1.00 0.00 H new ATOM 0 HA LYS A 30 5.353 -16.864 0.386 1.00 0.00 H new ATOM 0 HB2 LYS A 30 5.276 -19.273 0.947 1.00 0.00 H new ATOM 0 HB3 LYS A 30 6.691 -19.097 1.965 1.00 0.00 H new ATOM 0 HG2 LYS A 30 5.511 -17.783 3.572 1.00 0.00 H new ATOM 0 HG3 LYS A 30 4.173 -17.495 2.478 1.00 0.00 H new ATOM 0 HD2 LYS A 30 3.583 -19.904 2.540 1.00 0.00 H new ATOM 0 HD3 LYS A 30 4.943 -20.221 3.598 1.00 0.00 H new ATOM 0 HE2 LYS A 30 3.846 -18.376 5.134 1.00 0.00 H new ATOM 0 HE3 LYS A 30 2.402 -18.698 4.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 2.479 -20.061 6.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 2.567 -21.044 4.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 3.966 -20.731 5.707 1.00 0.00 H new ATOM 429 N ARG A 31 6.343 -15.236 1.958 1.00 0.00 N ATOM 430 CA ARG A 31 6.941 -14.210 2.804 1.00 0.00 C ATOM 431 C ARG A 31 5.874 -13.496 3.629 1.00 0.00 C ATOM 432 O ARG A 31 4.736 -13.340 3.187 1.00 0.00 O ATOM 433 CB ARG A 31 7.705 -13.197 1.951 1.00 0.00 C ATOM 434 CG ARG A 31 8.794 -12.458 2.712 1.00 0.00 C ATOM 435 CD ARG A 31 10.043 -13.311 2.865 1.00 0.00 C ATOM 436 NE ARG A 31 10.805 -13.394 1.621 1.00 0.00 N ATOM 437 CZ ARG A 31 11.880 -14.159 1.468 1.00 0.00 C ATOM 438 NH1 ARG A 31 12.317 -14.904 2.474 1.00 0.00 N ATOM 439 NH2 ARG A 31 12.520 -14.180 0.305 1.00 0.00 N ATOM 0 H ARG A 31 5.414 -15.004 1.606 1.00 0.00 H new ATOM 0 HA ARG A 31 7.637 -14.697 3.486 1.00 0.00 H new ATOM 0 HB2 ARG A 31 8.153 -13.714 1.103 1.00 0.00 H new ATOM 0 HB3 ARG A 31 7.000 -12.471 1.546 1.00 0.00 H new ATOM 0 HG2 ARG A 31 9.044 -11.536 2.188 1.00 0.00 H new ATOM 0 HG3 ARG A 31 8.423 -12.174 3.697 1.00 0.00 H new ATOM 0 HD2 ARG A 31 10.674 -12.893 3.649 1.00 0.00 H new ATOM 0 HD3 ARG A 31 9.760 -14.314 3.184 1.00 0.00 H new ATOM 0 HE ARG A 31 10.495 -12.834 0.827 1.00 0.00 H new ATOM 0 HH11 ARG A 31 11.827 -14.891 3.369 1.00 0.00 H new ATOM 0 HH12 ARG A 31 13.143 -15.490 2.353 1.00 0.00 H new ATOM 0 HH21 ARG A 31 12.186 -13.609 -0.471 1.00 0.00 H new ATOM 0 HH22 ARG A 31 13.346 -14.768 0.188 1.00 0.00 H new ATOM 453 N TRP A 32 6.250 -13.066 4.827 1.00 0.00 N ATOM 454 CA TRP A 32 5.326 -12.368 5.714 1.00 0.00 C ATOM 455 C TRP A 32 5.161 -10.912 5.292 1.00 0.00 C ATOM 456 O TRP A 32 6.130 -10.154 5.251 1.00 0.00 O ATOM 457 CB TRP A 32 5.820 -12.440 7.159 1.00 0.00 C ATOM 458 CG TRP A 32 4.842 -11.886 8.150 1.00 0.00 C ATOM 459 CD1 TRP A 32 5.035 -10.822 8.985 1.00 0.00 C ATOM 460 CD2 TRP A 32 3.520 -12.368 8.411 1.00 0.00 C ATOM 461 NE1 TRP A 32 3.912 -10.614 9.749 1.00 0.00 N ATOM 462 CE2 TRP A 32 2.968 -11.549 9.415 1.00 0.00 C ATOM 463 CE3 TRP A 32 2.747 -13.411 7.893 1.00 0.00 C ATOM 464 CZ2 TRP A 32 1.681 -11.743 9.910 1.00 0.00 C ATOM 465 CZ3 TRP A 32 1.470 -13.603 8.385 1.00 0.00 C ATOM 466 CH2 TRP A 32 0.947 -12.772 9.384 1.00 0.00 C ATOM 0 H TRP A 32 7.189 -13.188 5.207 1.00 0.00 H new ATOM 0 HA TRP A 32 4.355 -12.859 5.645 1.00 0.00 H new ATOM 0 HB2 TRP A 32 6.033 -13.479 7.411 1.00 0.00 H new ATOM 0 HB3 TRP A 32 6.759 -11.893 7.242 1.00 0.00 H new ATOM 0 HD1 TRP A 32 5.938 -10.231 9.037 1.00 0.00 H new ATOM 0 HE1 TRP A 32 3.799 -9.882 10.451 1.00 0.00 H new ATOM 0 HE3 TRP A 32 3.141 -14.056 7.121 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 1.276 -11.105 10.681 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 0.865 -14.407 7.993 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -0.055 -12.947 9.747 1.00 0.00 H new ATOM 477 N PHE A 33 3.928 -10.527 4.980 1.00 0.00 N ATOM 478 CA PHE A 33 3.636 -9.161 4.561 1.00 0.00 C ATOM 479 C PHE A 33 2.834 -8.424 5.629 1.00 0.00 C ATOM 480 O PHE A 33 2.025 -9.022 6.338 1.00 0.00 O ATOM 481 CB PHE A 33 2.865 -9.164 3.239 1.00 0.00 C ATOM 482 CG PHE A 33 3.747 -9.301 2.031 1.00 0.00 C ATOM 483 CD1 PHE A 33 4.239 -10.540 1.652 1.00 0.00 C ATOM 484 CD2 PHE A 33 4.085 -8.191 1.274 1.00 0.00 C ATOM 485 CE1 PHE A 33 5.050 -10.669 0.541 1.00 0.00 C ATOM 486 CE2 PHE A 33 4.896 -8.314 0.162 1.00 0.00 C ATOM 487 CZ PHE A 33 5.380 -9.555 -0.205 1.00 0.00 C ATOM 0 H PHE A 33 3.115 -11.142 5.009 1.00 0.00 H new ATOM 0 HA PHE A 33 4.583 -8.641 4.420 1.00 0.00 H new ATOM 0 HB2 PHE A 33 2.146 -9.983 3.249 1.00 0.00 H new ATOM 0 HB3 PHE A 33 2.294 -8.239 3.159 1.00 0.00 H new ATOM 0 HD1 PHE A 33 3.985 -11.415 2.232 1.00 0.00 H new ATOM 0 HD2 PHE A 33 3.710 -7.218 1.556 1.00 0.00 H new ATOM 0 HE1 PHE A 33 5.426 -11.641 0.256 1.00 0.00 H new ATOM 0 HE2 PHE A 33 5.151 -7.441 -0.420 1.00 0.00 H new ATOM 0 HZ PHE A 33 6.015 -9.653 -1.073 1.00 0.00 H new ATOM 497 N VAL A 34 3.065 -7.119 5.739 1.00 0.00 N ATOM 498 CA VAL A 34 2.365 -6.298 6.719 1.00 0.00 C ATOM 499 C VAL A 34 2.105 -4.897 6.178 1.00 0.00 C ATOM 500 O VAL A 34 3.024 -4.084 6.064 1.00 0.00 O ATOM 501 CB VAL A 34 3.162 -6.190 8.033 1.00 0.00 C ATOM 502 CG1 VAL A 34 2.402 -5.354 9.051 1.00 0.00 C ATOM 503 CG2 VAL A 34 3.465 -7.574 8.586 1.00 0.00 C ATOM 0 H VAL A 34 3.732 -6.608 5.161 1.00 0.00 H new ATOM 0 HA VAL A 34 1.413 -6.789 6.920 1.00 0.00 H new ATOM 0 HB VAL A 34 4.109 -5.692 7.825 1.00 0.00 H new ATOM 0 HG11 VAL A 34 2.980 -5.289 9.973 1.00 0.00 H new ATOM 0 HG12 VAL A 34 2.241 -4.353 8.652 1.00 0.00 H new ATOM 0 HG13 VAL A 34 1.439 -5.821 9.259 1.00 0.00 H new ATOM 0 HG21 VAL A 34 4.028 -7.480 9.514 1.00 0.00 H new ATOM 0 HG22 VAL A 34 2.531 -8.101 8.781 1.00 0.00 H new ATOM 0 HG23 VAL A 34 4.053 -8.135 7.860 1.00 0.00 H new ATOM 513 N LEU A 35 0.849 -4.620 5.846 1.00 0.00 N ATOM 514 CA LEU A 35 0.468 -3.315 5.317 1.00 0.00 C ATOM 515 C LEU A 35 0.649 -2.226 6.370 1.00 0.00 C ATOM 516 O LEU A 35 0.231 -2.381 7.517 1.00 0.00 O ATOM 517 CB LEU A 35 -0.986 -3.342 4.840 1.00 0.00 C ATOM 518 CG LEU A 35 -1.653 -1.980 4.645 1.00 0.00 C ATOM 519 CD1 LEU A 35 -0.928 -1.178 3.576 1.00 0.00 C ATOM 520 CD2 LEU A 35 -3.121 -2.152 4.281 1.00 0.00 C ATOM 0 H LEU A 35 0.077 -5.281 5.934 1.00 0.00 H new ATOM 0 HA LEU A 35 1.118 -3.089 4.472 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -1.027 -3.883 3.895 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -1.573 -3.912 5.560 1.00 0.00 H new ATOM 0 HG LEU A 35 -1.594 -1.431 5.585 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -1.417 -0.212 3.451 1.00 0.00 H new ATOM 0 HD12 LEU A 35 0.108 -1.024 3.877 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -0.954 -1.722 2.632 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -3.580 -1.172 4.146 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -3.202 -2.721 3.355 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -3.634 -2.686 5.081 1.00 0.00 H new ATOM 532 N VAL A 36 1.274 -1.123 5.971 1.00 0.00 N ATOM 533 CA VAL A 36 1.508 -0.006 6.879 1.00 0.00 C ATOM 534 C VAL A 36 0.940 1.290 6.313 1.00 0.00 C ATOM 535 O VAL A 36 0.370 1.306 5.222 1.00 0.00 O ATOM 536 CB VAL A 36 3.011 0.184 7.159 1.00 0.00 C ATOM 537 CG1 VAL A 36 3.656 1.020 6.065 1.00 0.00 C ATOM 538 CG2 VAL A 36 3.221 0.822 8.523 1.00 0.00 C ATOM 0 H VAL A 36 1.627 -0.979 5.025 1.00 0.00 H new ATOM 0 HA VAL A 36 0.999 -0.245 7.813 1.00 0.00 H new ATOM 0 HB VAL A 36 3.489 -0.795 7.164 1.00 0.00 H new ATOM 0 HG11 VAL A 36 4.717 1.144 6.280 1.00 0.00 H new ATOM 0 HG12 VAL A 36 3.536 0.518 5.105 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.178 1.999 6.025 1.00 0.00 H new ATOM 0 HG21 VAL A 36 4.288 0.949 8.705 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.730 1.795 8.549 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.795 0.180 9.294 1.00 0.00 H new ATOM 548 N ASP A 37 1.099 2.376 7.062 1.00 0.00 N ATOM 549 CA ASP A 37 0.603 3.679 6.634 1.00 0.00 C ATOM 550 C ASP A 37 1.024 3.977 5.199 1.00 0.00 C ATOM 551 O ASP A 37 2.208 4.160 4.914 1.00 0.00 O ATOM 552 CB ASP A 37 1.118 4.776 7.568 1.00 0.00 C ATOM 553 CG ASP A 37 0.189 5.021 8.740 1.00 0.00 C ATOM 554 OD1 ASP A 37 0.236 4.235 9.710 1.00 0.00 O ATOM 555 OD2 ASP A 37 -0.585 6.000 8.689 1.00 0.00 O ATOM 0 H ASP A 37 1.567 2.380 7.968 1.00 0.00 H new ATOM 0 HA ASP A 37 -0.486 3.657 6.676 1.00 0.00 H new ATOM 0 HB2 ASP A 37 2.104 4.498 7.941 1.00 0.00 H new ATOM 0 HB3 ASP A 37 1.240 5.701 7.005 1.00 0.00 H new ATOM 560 N ARG A 38 0.048 4.021 4.298 1.00 0.00 N ATOM 561 CA ARG A 38 0.317 4.294 2.892 1.00 0.00 C ATOM 562 C ARG A 38 1.598 3.599 2.439 1.00 0.00 C ATOM 563 O ARG A 38 2.398 4.171 1.697 1.00 0.00 O ATOM 564 CB ARG A 38 0.432 5.801 2.655 1.00 0.00 C ATOM 565 CG ARG A 38 -0.817 6.575 3.043 1.00 0.00 C ATOM 566 CD ARG A 38 -0.908 7.897 2.296 1.00 0.00 C ATOM 567 NE ARG A 38 -2.268 8.430 2.291 1.00 0.00 N ATOM 568 CZ ARG A 38 -2.796 9.108 3.304 1.00 0.00 C ATOM 569 NH1 ARG A 38 -2.082 9.334 4.398 1.00 0.00 N ATOM 570 NH2 ARG A 38 -4.040 9.561 3.224 1.00 0.00 N ATOM 0 H ARG A 38 -0.937 3.871 4.517 1.00 0.00 H new ATOM 0 HA ARG A 38 -0.516 3.904 2.307 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.279 6.186 3.223 1.00 0.00 H new ATOM 0 HB3 ARG A 38 0.647 5.979 1.601 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -1.700 5.973 2.829 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -0.811 6.762 4.117 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -0.236 8.621 2.757 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -0.569 7.757 1.269 1.00 0.00 H new ATOM 0 HE ARG A 38 -2.844 8.273 1.464 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -1.125 8.987 4.463 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -2.490 9.855 5.174 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -4.592 9.389 2.384 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -4.444 10.081 4.003 1.00 0.00 H new ATOM 584 N CYS A 39 1.785 2.364 2.890 1.00 0.00 N ATOM 585 CA CYS A 39 2.969 1.590 2.533 1.00 0.00 C ATOM 586 C CYS A 39 2.772 0.113 2.857 1.00 0.00 C ATOM 587 O CYS A 39 1.754 -0.278 3.429 1.00 0.00 O ATOM 588 CB CYS A 39 4.197 2.127 3.270 1.00 0.00 C ATOM 589 SG CYS A 39 5.087 3.422 2.376 1.00 0.00 S ATOM 0 H CYS A 39 1.132 1.877 3.504 1.00 0.00 H new ATOM 0 HA CYS A 39 3.127 1.689 1.459 1.00 0.00 H new ATOM 0 HB2 CYS A 39 3.884 2.518 4.238 1.00 0.00 H new ATOM 0 HB3 CYS A 39 4.880 1.300 3.466 1.00 0.00 H new ATOM 0 HG CYS A 39 4.236 4.182 1.753 1.00 0.00 H new ATOM 595 N LEU A 40 3.751 -0.704 2.486 1.00 0.00 N ATOM 596 CA LEU A 40 3.685 -2.140 2.735 1.00 0.00 C ATOM 597 C LEU A 40 5.080 -2.721 2.948 1.00 0.00 C ATOM 598 O LEU A 40 5.980 -2.515 2.134 1.00 0.00 O ATOM 599 CB LEU A 40 2.998 -2.850 1.568 1.00 0.00 C ATOM 600 CG LEU A 40 3.086 -4.376 1.564 1.00 0.00 C ATOM 601 CD1 LEU A 40 2.480 -4.949 2.836 1.00 0.00 C ATOM 602 CD2 LEU A 40 2.393 -4.948 0.336 1.00 0.00 C ATOM 0 H LEU A 40 4.600 -0.397 2.012 1.00 0.00 H new ATOM 0 HA LEU A 40 3.102 -2.299 3.642 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.945 -2.567 1.566 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.430 -2.479 0.638 1.00 0.00 H new ATOM 0 HG LEU A 40 4.138 -4.660 1.527 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.552 -6.036 2.815 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.021 -4.566 3.701 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.432 -4.656 2.904 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.466 -6.035 0.350 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.343 -4.655 0.341 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.873 -4.564 -0.564 1.00 0.00 H new ATOM 614 N PHE A 41 5.251 -3.449 4.047 1.00 0.00 N ATOM 615 CA PHE A 41 6.535 -4.060 4.366 1.00 0.00 C ATOM 616 C PHE A 41 6.415 -5.581 4.421 1.00 0.00 C ATOM 617 O PHE A 41 5.315 -6.124 4.524 1.00 0.00 O ATOM 618 CB PHE A 41 7.058 -3.530 5.703 1.00 0.00 C ATOM 619 CG PHE A 41 7.523 -2.104 5.641 1.00 0.00 C ATOM 620 CD1 PHE A 41 8.681 -1.767 4.958 1.00 0.00 C ATOM 621 CD2 PHE A 41 6.803 -1.099 6.266 1.00 0.00 C ATOM 622 CE1 PHE A 41 9.111 -0.455 4.900 1.00 0.00 C ATOM 623 CE2 PHE A 41 7.228 0.216 6.212 1.00 0.00 C ATOM 624 CZ PHE A 41 8.383 0.538 5.527 1.00 0.00 C ATOM 0 H PHE A 41 4.516 -3.630 4.731 1.00 0.00 H new ATOM 0 HA PHE A 41 7.240 -3.797 3.578 1.00 0.00 H new ATOM 0 HB2 PHE A 41 6.270 -3.615 6.452 1.00 0.00 H new ATOM 0 HB3 PHE A 41 7.884 -4.159 6.036 1.00 0.00 H new ATOM 0 HD1 PHE A 41 9.254 -2.539 4.465 1.00 0.00 H new ATOM 0 HD2 PHE A 41 5.898 -1.345 6.802 1.00 0.00 H new ATOM 0 HE1 PHE A 41 10.015 -0.206 4.365 1.00 0.00 H new ATOM 0 HE2 PHE A 41 6.658 0.990 6.705 1.00 0.00 H new ATOM 0 HZ PHE A 41 8.717 1.564 5.481 1.00 0.00 H new ATOM 634 N TYR A 42 7.554 -6.261 4.351 1.00 0.00 N ATOM 635 CA TYR A 42 7.577 -7.718 4.389 1.00 0.00 C ATOM 636 C TYR A 42 8.817 -8.224 5.120 1.00 0.00 C ATOM 637 O TYR A 42 9.880 -7.606 5.064 1.00 0.00 O ATOM 638 CB TYR A 42 7.540 -8.287 2.970 1.00 0.00 C ATOM 639 CG TYR A 42 8.827 -8.085 2.203 1.00 0.00 C ATOM 640 CD1 TYR A 42 9.923 -8.912 2.416 1.00 0.00 C ATOM 641 CD2 TYR A 42 8.947 -7.068 1.264 1.00 0.00 C ATOM 642 CE1 TYR A 42 11.101 -8.731 1.718 1.00 0.00 C ATOM 643 CE2 TYR A 42 10.121 -6.880 0.560 1.00 0.00 C ATOM 644 CZ TYR A 42 11.195 -7.714 0.791 1.00 0.00 C ATOM 645 OH TYR A 42 12.367 -7.530 0.093 1.00 0.00 O ATOM 0 H TYR A 42 8.473 -5.827 4.268 1.00 0.00 H new ATOM 0 HA TYR A 42 6.694 -8.056 4.932 1.00 0.00 H new ATOM 0 HB2 TYR A 42 7.321 -9.354 3.021 1.00 0.00 H new ATOM 0 HB3 TYR A 42 6.723 -7.819 2.421 1.00 0.00 H new ATOM 0 HD1 TYR A 42 9.853 -9.710 3.140 1.00 0.00 H new ATOM 0 HD2 TYR A 42 8.108 -6.413 1.081 1.00 0.00 H new ATOM 0 HE1 TYR A 42 11.944 -9.382 1.897 1.00 0.00 H new ATOM 0 HE2 TYR A 42 10.197 -6.085 -0.167 1.00 0.00 H new ATOM 0 HH TYR A 42 12.167 -7.154 -0.790 1.00 0.00 H new ATOM 655 N TYR A 43 8.672 -9.353 5.805 1.00 0.00 N ATOM 656 CA TYR A 43 9.779 -9.943 6.549 1.00 0.00 C ATOM 657 C TYR A 43 9.857 -11.447 6.308 1.00 0.00 C ATOM 658 O TYR A 43 8.902 -12.063 5.835 1.00 0.00 O ATOM 659 CB TYR A 43 9.622 -9.662 8.044 1.00 0.00 C ATOM 660 CG TYR A 43 9.092 -8.279 8.349 1.00 0.00 C ATOM 661 CD1 TYR A 43 7.781 -7.934 8.045 1.00 0.00 C ATOM 662 CD2 TYR A 43 9.901 -7.318 8.941 1.00 0.00 C ATOM 663 CE1 TYR A 43 7.292 -6.672 8.321 1.00 0.00 C ATOM 664 CE2 TYR A 43 9.421 -6.054 9.222 1.00 0.00 C ATOM 665 CZ TYR A 43 8.115 -5.735 8.909 1.00 0.00 C ATOM 666 OH TYR A 43 7.632 -4.477 9.187 1.00 0.00 O ATOM 0 H TYR A 43 7.799 -9.878 5.861 1.00 0.00 H new ATOM 0 HA TYR A 43 10.705 -9.489 6.196 1.00 0.00 H new ATOM 0 HB2 TYR A 43 8.949 -10.403 8.475 1.00 0.00 H new ATOM 0 HB3 TYR A 43 10.589 -9.787 8.532 1.00 0.00 H new ATOM 0 HD1 TYR A 43 7.133 -8.665 7.585 1.00 0.00 H new ATOM 0 HD2 TYR A 43 10.924 -7.564 9.186 1.00 0.00 H new ATOM 0 HE1 TYR A 43 6.270 -6.421 8.077 1.00 0.00 H new ATOM 0 HE2 TYR A 43 10.064 -5.319 9.684 1.00 0.00 H new ATOM 0 HH TYR A 43 8.339 -3.939 9.601 1.00 0.00 H new ATOM 676 N LYS A 44 11.003 -12.034 6.637 1.00 0.00 N ATOM 677 CA LYS A 44 11.209 -13.466 6.460 1.00 0.00 C ATOM 678 C LYS A 44 10.151 -14.265 7.215 1.00 0.00 C ATOM 679 O LYS A 44 9.691 -15.306 6.743 1.00 0.00 O ATOM 680 CB LYS A 44 12.605 -13.865 6.942 1.00 0.00 C ATOM 681 CG LYS A 44 13.667 -13.791 5.858 1.00 0.00 C ATOM 682 CD LYS A 44 14.778 -14.799 6.097 1.00 0.00 C ATOM 683 CE LYS A 44 15.676 -14.377 7.250 1.00 0.00 C ATOM 684 NZ LYS A 44 16.340 -13.071 6.986 1.00 0.00 N ATOM 0 H LYS A 44 11.804 -11.539 7.028 1.00 0.00 H new ATOM 0 HA LYS A 44 11.120 -13.692 5.397 1.00 0.00 H new ATOM 0 HB2 LYS A 44 12.895 -13.215 7.768 1.00 0.00 H new ATOM 0 HB3 LYS A 44 12.568 -14.881 7.334 1.00 0.00 H new ATOM 0 HG2 LYS A 44 13.210 -13.976 4.886 1.00 0.00 H new ATOM 0 HG3 LYS A 44 14.087 -12.786 5.827 1.00 0.00 H new ATOM 0 HD2 LYS A 44 14.344 -15.776 6.311 1.00 0.00 H new ATOM 0 HD3 LYS A 44 15.374 -14.907 5.191 1.00 0.00 H new ATOM 0 HE2 LYS A 44 15.085 -14.306 8.163 1.00 0.00 H new ATOM 0 HE3 LYS A 44 16.434 -15.142 7.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 17.184 -12.983 7.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 16.621 -13.020 5.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 15.680 -12.296 7.200 1.00 0.00 H new ATOM 698 N ASP A 45 9.768 -13.772 8.387 1.00 0.00 N ATOM 699 CA ASP A 45 8.763 -14.439 9.206 1.00 0.00 C ATOM 700 C ASP A 45 8.070 -13.445 10.132 1.00 0.00 C ATOM 701 O ASP A 45 8.494 -12.296 10.254 1.00 0.00 O ATOM 702 CB ASP A 45 9.403 -15.559 10.027 1.00 0.00 C ATOM 703 CG ASP A 45 8.402 -16.274 10.912 1.00 0.00 C ATOM 704 OD1 ASP A 45 7.743 -17.215 10.421 1.00 0.00 O ATOM 705 OD2 ASP A 45 8.276 -15.893 12.095 1.00 0.00 O ATOM 0 H ASP A 45 10.138 -12.912 8.792 1.00 0.00 H new ATOM 0 HA ASP A 45 8.016 -14.870 8.540 1.00 0.00 H new ATOM 0 HB2 ASP A 45 9.867 -16.279 9.353 1.00 0.00 H new ATOM 0 HB3 ASP A 45 10.198 -15.143 10.646 1.00 0.00 H new ATOM 710 N GLU A 46 7.001 -13.895 10.782 1.00 0.00 N ATOM 711 CA GLU A 46 6.248 -13.044 11.696 1.00 0.00 C ATOM 712 C GLU A 46 7.184 -12.311 12.653 1.00 0.00 C ATOM 713 O GLU A 46 6.893 -11.201 13.097 1.00 0.00 O ATOM 714 CB GLU A 46 5.239 -13.876 12.489 1.00 0.00 C ATOM 715 CG GLU A 46 5.848 -15.099 13.155 1.00 0.00 C ATOM 716 CD GLU A 46 5.055 -15.561 14.362 1.00 0.00 C ATOM 717 OE1 GLU A 46 4.858 -14.748 15.289 1.00 0.00 O ATOM 718 OE2 GLU A 46 4.632 -16.736 14.380 1.00 0.00 O ATOM 0 H GLU A 46 6.637 -14.844 10.693 1.00 0.00 H new ATOM 0 HA GLU A 46 5.711 -12.304 11.103 1.00 0.00 H new ATOM 0 HB2 GLU A 46 4.782 -13.247 13.253 1.00 0.00 H new ATOM 0 HB3 GLU A 46 4.440 -14.197 11.820 1.00 0.00 H new ATOM 0 HG2 GLU A 46 5.906 -15.911 12.431 1.00 0.00 H new ATOM 0 HG3 GLU A 46 6.869 -14.871 13.461 1.00 0.00 H new ATOM 725 N LYS A 47 8.311 -12.942 12.967 1.00 0.00 N ATOM 726 CA LYS A 47 9.292 -12.352 13.870 1.00 0.00 C ATOM 727 C LYS A 47 9.625 -10.923 13.454 1.00 0.00 C ATOM 728 O LYS A 47 9.891 -10.068 14.298 1.00 0.00 O ATOM 729 CB LYS A 47 10.567 -13.198 13.893 1.00 0.00 C ATOM 730 CG LYS A 47 10.426 -14.491 14.679 1.00 0.00 C ATOM 731 CD LYS A 47 11.777 -15.027 15.119 1.00 0.00 C ATOM 732 CE LYS A 47 11.639 -16.002 16.278 1.00 0.00 C ATOM 733 NZ LYS A 47 11.320 -15.304 17.555 1.00 0.00 N ATOM 0 H LYS A 47 8.567 -13.862 12.609 1.00 0.00 H new ATOM 0 HA LYS A 47 8.860 -12.329 14.870 1.00 0.00 H new ATOM 0 HB2 LYS A 47 10.854 -13.435 12.869 1.00 0.00 H new ATOM 0 HB3 LYS A 47 11.377 -12.608 14.323 1.00 0.00 H new ATOM 0 HG2 LYS A 47 9.799 -14.319 15.554 1.00 0.00 H new ATOM 0 HG3 LYS A 47 9.920 -15.237 14.066 1.00 0.00 H new ATOM 0 HD2 LYS A 47 12.263 -15.524 14.280 1.00 0.00 H new ATOM 0 HD3 LYS A 47 12.420 -14.198 15.414 1.00 0.00 H new ATOM 0 HE2 LYS A 47 10.855 -16.725 16.053 1.00 0.00 H new ATOM 0 HE3 LYS A 47 12.566 -16.563 16.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 11.466 -15.955 18.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 11.942 -14.478 17.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 10.328 -14.991 17.541 1.00 0.00 H new ATOM 747 N GLU A 48 9.607 -10.672 12.149 1.00 0.00 N ATOM 748 CA GLU A 48 9.907 -9.346 11.622 1.00 0.00 C ATOM 749 C GLU A 48 11.042 -8.693 12.406 1.00 0.00 C ATOM 750 O GLU A 48 10.909 -7.570 12.891 1.00 0.00 O ATOM 751 CB GLU A 48 8.661 -8.459 11.674 1.00 0.00 C ATOM 752 CG GLU A 48 8.109 -8.266 13.076 1.00 0.00 C ATOM 753 CD GLU A 48 6.763 -7.567 13.083 1.00 0.00 C ATOM 754 OE1 GLU A 48 6.744 -6.319 13.120 1.00 0.00 O ATOM 755 OE2 GLU A 48 5.730 -8.268 13.050 1.00 0.00 O ATOM 0 H GLU A 48 9.388 -11.369 11.437 1.00 0.00 H new ATOM 0 HA GLU A 48 10.222 -9.458 10.585 1.00 0.00 H new ATOM 0 HB2 GLU A 48 8.902 -7.484 11.250 1.00 0.00 H new ATOM 0 HB3 GLU A 48 7.886 -8.898 11.045 1.00 0.00 H new ATOM 0 HG2 GLU A 48 8.012 -9.237 13.561 1.00 0.00 H new ATOM 0 HG3 GLU A 48 8.819 -7.685 13.665 1.00 0.00 H new ATOM 762 N GLU A 49 12.158 -9.406 12.525 1.00 0.00 N ATOM 763 CA GLU A 49 13.315 -8.897 13.251 1.00 0.00 C ATOM 764 C GLU A 49 13.809 -7.589 12.639 1.00 0.00 C ATOM 765 O GLU A 49 13.909 -6.571 13.323 1.00 0.00 O ATOM 766 CB GLU A 49 14.443 -9.932 13.248 1.00 0.00 C ATOM 767 CG GLU A 49 13.999 -11.316 13.691 1.00 0.00 C ATOM 768 CD GLU A 49 13.594 -12.199 12.526 1.00 0.00 C ATOM 769 OE1 GLU A 49 12.447 -12.064 12.051 1.00 0.00 O ATOM 770 OE2 GLU A 49 14.423 -13.025 12.090 1.00 0.00 O ATOM 0 H GLU A 49 12.285 -10.337 12.128 1.00 0.00 H new ATOM 0 HA GLU A 49 13.010 -8.705 14.280 1.00 0.00 H new ATOM 0 HB2 GLU A 49 14.862 -9.998 12.244 1.00 0.00 H new ATOM 0 HB3 GLU A 49 15.242 -9.588 13.905 1.00 0.00 H new ATOM 0 HG2 GLU A 49 14.809 -11.795 14.241 1.00 0.00 H new ATOM 0 HG3 GLU A 49 13.159 -11.221 14.379 1.00 0.00 H new ATOM 777 N SER A 50 14.117 -7.627 11.347 1.00 0.00 N ATOM 778 CA SER A 50 14.605 -6.447 10.643 1.00 0.00 C ATOM 779 C SER A 50 14.089 -6.419 9.207 1.00 0.00 C ATOM 780 O SER A 50 14.353 -7.331 8.423 1.00 0.00 O ATOM 781 CB SER A 50 16.135 -6.420 10.648 1.00 0.00 C ATOM 782 OG SER A 50 16.628 -5.346 9.866 1.00 0.00 O ATOM 0 H SER A 50 14.037 -8.462 10.766 1.00 0.00 H new ATOM 0 HA SER A 50 14.232 -5.564 11.162 1.00 0.00 H new ATOM 0 HB2 SER A 50 16.497 -6.325 11.672 1.00 0.00 H new ATOM 0 HB3 SER A 50 16.520 -7.363 10.260 1.00 0.00 H new ATOM 0 HG SER A 50 17.608 -5.349 9.886 1.00 0.00 H new ATOM 788 N ILE A 51 13.352 -5.365 8.871 1.00 0.00 N ATOM 789 CA ILE A 51 12.800 -5.217 7.530 1.00 0.00 C ATOM 790 C ILE A 51 13.843 -5.544 6.467 1.00 0.00 C ATOM 791 O ILE A 51 15.024 -5.235 6.624 1.00 0.00 O ATOM 792 CB ILE A 51 12.272 -3.790 7.294 1.00 0.00 C ATOM 793 CG1 ILE A 51 11.180 -3.451 8.311 1.00 0.00 C ATOM 794 CG2 ILE A 51 11.743 -3.649 5.874 1.00 0.00 C ATOM 795 CD1 ILE A 51 10.867 -1.973 8.392 1.00 0.00 C ATOM 0 H ILE A 51 13.124 -4.602 9.508 1.00 0.00 H new ATOM 0 HA ILE A 51 11.971 -5.920 7.450 1.00 0.00 H new ATOM 0 HB ILE A 51 13.095 -3.088 7.426 1.00 0.00 H new ATOM 0 HG12 ILE A 51 10.271 -3.993 8.050 1.00 0.00 H new ATOM 0 HG13 ILE A 51 11.489 -3.803 9.295 1.00 0.00 H new ATOM 0 HG21 ILE A 51 11.373 -2.635 5.722 1.00 0.00 H new ATOM 0 HG22 ILE A 51 12.545 -3.852 5.165 1.00 0.00 H new ATOM 0 HG23 ILE A 51 10.931 -4.359 5.716 1.00 0.00 H new ATOM 0 HD11 ILE A 51 10.085 -1.807 9.132 1.00 0.00 H new ATOM 0 HD12 ILE A 51 11.764 -1.427 8.683 1.00 0.00 H new ATOM 0 HD13 ILE A 51 10.527 -1.619 7.419 1.00 0.00 H new ATOM 807 N LEU A 52 13.398 -6.170 5.383 1.00 0.00 N ATOM 808 CA LEU A 52 14.292 -6.538 4.290 1.00 0.00 C ATOM 809 C LEU A 52 14.007 -5.701 3.048 1.00 0.00 C ATOM 810 O LEU A 52 14.926 -5.248 2.367 1.00 0.00 O ATOM 811 CB LEU A 52 14.144 -8.025 3.963 1.00 0.00 C ATOM 812 CG LEU A 52 14.312 -8.991 5.136 1.00 0.00 C ATOM 813 CD1 LEU A 52 13.472 -10.240 4.923 1.00 0.00 C ATOM 814 CD2 LEU A 52 15.778 -9.356 5.320 1.00 0.00 C ATOM 0 H LEU A 52 12.423 -6.433 5.237 1.00 0.00 H new ATOM 0 HA LEU A 52 15.316 -6.343 4.609 1.00 0.00 H new ATOM 0 HB2 LEU A 52 13.158 -8.184 3.526 1.00 0.00 H new ATOM 0 HB3 LEU A 52 14.877 -8.283 3.198 1.00 0.00 H new ATOM 0 HG LEU A 52 13.965 -8.496 6.043 1.00 0.00 H new ATOM 0 HD11 LEU A 52 13.604 -10.916 5.768 1.00 0.00 H new ATOM 0 HD12 LEU A 52 12.421 -9.962 4.842 1.00 0.00 H new ATOM 0 HD13 LEU A 52 13.787 -10.739 4.007 1.00 0.00 H new ATOM 0 HD21 LEU A 52 15.879 -10.044 6.159 1.00 0.00 H new ATOM 0 HD22 LEU A 52 16.151 -9.832 4.413 1.00 0.00 H new ATOM 0 HD23 LEU A 52 16.355 -8.453 5.520 1.00 0.00 H new ATOM 826 N GLY A 53 12.725 -5.497 2.759 1.00 0.00 N ATOM 827 CA GLY A 53 12.341 -4.712 1.600 1.00 0.00 C ATOM 828 C GLY A 53 11.084 -3.900 1.840 1.00 0.00 C ATOM 829 O GLY A 53 10.182 -4.335 2.555 1.00 0.00 O ATOM 0 H GLY A 53 11.946 -5.861 3.307 1.00 0.00 H new ATOM 0 HA2 GLY A 53 13.158 -4.041 1.333 1.00 0.00 H new ATOM 0 HA3 GLY A 53 12.184 -5.377 0.751 1.00 0.00 H new ATOM 833 N SER A 54 11.025 -2.714 1.242 1.00 0.00 N ATOM 834 CA SER A 54 9.871 -1.836 1.399 1.00 0.00 C ATOM 835 C SER A 54 9.124 -1.679 0.078 1.00 0.00 C ATOM 836 O SER A 54 9.728 -1.417 -0.963 1.00 0.00 O ATOM 837 CB SER A 54 10.314 -0.464 1.912 1.00 0.00 C ATOM 838 OG SER A 54 10.813 0.339 0.857 1.00 0.00 O ATOM 0 H SER A 54 11.762 -2.339 0.645 1.00 0.00 H new ATOM 0 HA SER A 54 9.197 -2.289 2.126 1.00 0.00 H new ATOM 0 HB2 SER A 54 9.472 0.038 2.389 1.00 0.00 H new ATOM 0 HB3 SER A 54 11.084 -0.588 2.674 1.00 0.00 H new ATOM 0 HG SER A 54 11.088 1.211 1.211 1.00 0.00 H new ATOM 844 N ILE A 55 7.806 -1.843 0.128 1.00 0.00 N ATOM 845 CA ILE A 55 6.976 -1.719 -1.063 1.00 0.00 C ATOM 846 C ILE A 55 6.056 -0.507 -0.969 1.00 0.00 C ATOM 847 O ILE A 55 5.056 -0.509 -0.250 1.00 0.00 O ATOM 848 CB ILE A 55 6.122 -2.981 -1.288 1.00 0.00 C ATOM 849 CG1 ILE A 55 7.021 -4.204 -1.480 1.00 0.00 C ATOM 850 CG2 ILE A 55 5.208 -2.795 -2.490 1.00 0.00 C ATOM 851 CD1 ILE A 55 6.294 -5.520 -1.312 1.00 0.00 C ATOM 0 H ILE A 55 7.291 -2.062 0.981 1.00 0.00 H new ATOM 0 HA ILE A 55 7.654 -1.593 -1.907 1.00 0.00 H new ATOM 0 HB ILE A 55 5.502 -3.144 -0.407 1.00 0.00 H new ATOM 0 HG12 ILE A 55 7.463 -4.167 -2.475 1.00 0.00 H new ATOM 0 HG13 ILE A 55 7.842 -4.158 -0.764 1.00 0.00 H new ATOM 0 HG21 ILE A 55 4.611 -3.695 -2.636 1.00 0.00 H new ATOM 0 HG22 ILE A 55 4.547 -1.946 -2.317 1.00 0.00 H new ATOM 0 HG23 ILE A 55 5.810 -2.611 -3.380 1.00 0.00 H new ATOM 0 HD11 ILE A 55 6.992 -6.343 -1.462 1.00 0.00 H new ATOM 0 HD12 ILE A 55 5.875 -5.578 -0.308 1.00 0.00 H new ATOM 0 HD13 ILE A 55 5.490 -5.588 -2.045 1.00 0.00 H new ATOM 863 N PRO A 56 6.398 0.555 -1.713 1.00 0.00 N ATOM 864 CA PRO A 56 5.614 1.794 -1.732 1.00 0.00 C ATOM 865 C PRO A 56 4.269 1.618 -2.427 1.00 0.00 C ATOM 866 O PRO A 56 4.181 0.993 -3.485 1.00 0.00 O ATOM 867 CB PRO A 56 6.500 2.762 -2.520 1.00 0.00 C ATOM 868 CG PRO A 56 7.344 1.887 -3.383 1.00 0.00 C ATOM 869 CD PRO A 56 7.576 0.629 -2.593 1.00 0.00 C ATOM 0 HA PRO A 56 5.372 2.138 -0.727 1.00 0.00 H new ATOM 0 HB2 PRO A 56 5.901 3.449 -3.118 1.00 0.00 H new ATOM 0 HB3 PRO A 56 7.112 3.370 -1.854 1.00 0.00 H new ATOM 0 HG2 PRO A 56 6.843 1.669 -4.326 1.00 0.00 H new ATOM 0 HG3 PRO A 56 8.288 2.374 -3.628 1.00 0.00 H new ATOM 0 HD2 PRO A 56 7.649 -0.244 -3.241 1.00 0.00 H new ATOM 0 HD3 PRO A 56 8.502 0.679 -2.021 1.00 0.00 H new ATOM 877 N LEU A 57 3.221 2.173 -1.827 1.00 0.00 N ATOM 878 CA LEU A 57 1.878 2.078 -2.388 1.00 0.00 C ATOM 879 C LEU A 57 1.346 3.457 -2.763 1.00 0.00 C ATOM 880 O LEU A 57 0.376 3.577 -3.513 1.00 0.00 O ATOM 881 CB LEU A 57 0.933 1.407 -1.390 1.00 0.00 C ATOM 882 CG LEU A 57 0.986 -0.120 -1.337 1.00 0.00 C ATOM 883 CD1 LEU A 57 0.258 -0.637 -0.106 1.00 0.00 C ATOM 884 CD2 LEU A 57 0.388 -0.719 -2.602 1.00 0.00 C ATOM 0 H LEU A 57 3.276 2.694 -0.952 1.00 0.00 H new ATOM 0 HA LEU A 57 1.931 1.471 -3.292 1.00 0.00 H new ATOM 0 HB2 LEU A 57 1.154 1.793 -0.395 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.087 1.707 -1.628 1.00 0.00 H new ATOM 0 HG LEU A 57 2.030 -0.426 -1.272 1.00 0.00 H new ATOM 0 HD11 LEU A 57 0.306 -1.726 -0.085 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.730 -0.236 0.791 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -0.785 -0.321 -0.140 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.434 -1.807 -2.547 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.651 -0.404 -2.697 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.952 -0.376 -3.469 1.00 0.00 H new ATOM 896 N LEU A 58 1.986 4.495 -2.237 1.00 0.00 N ATOM 897 CA LEU A 58 1.578 5.868 -2.518 1.00 0.00 C ATOM 898 C LEU A 58 1.383 6.082 -4.016 1.00 0.00 C ATOM 899 O LEU A 58 2.350 6.170 -4.772 1.00 0.00 O ATOM 900 CB LEU A 58 2.622 6.850 -1.983 1.00 0.00 C ATOM 901 CG LEU A 58 2.105 8.240 -1.608 1.00 0.00 C ATOM 902 CD1 LEU A 58 1.155 8.154 -0.423 1.00 0.00 C ATOM 903 CD2 LEU A 58 3.265 9.174 -1.298 1.00 0.00 C ATOM 0 H LEU A 58 2.789 4.413 -1.614 1.00 0.00 H new ATOM 0 HA LEU A 58 0.627 6.049 -2.017 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.090 6.408 -1.103 1.00 0.00 H new ATOM 0 HB3 LEU A 58 3.403 6.965 -2.735 1.00 0.00 H new ATOM 0 HG LEU A 58 1.556 8.645 -2.458 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.797 9.152 -0.170 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.307 7.519 -0.682 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.679 7.729 0.433 1.00 0.00 H new ATOM 0 HD21 LEU A 58 2.879 10.158 -1.033 1.00 0.00 H new ATOM 0 HD22 LEU A 58 3.841 8.774 -0.464 1.00 0.00 H new ATOM 0 HD23 LEU A 58 3.907 9.260 -2.175 1.00 0.00 H new ATOM 915 N SER A 59 0.125 6.166 -4.437 1.00 0.00 N ATOM 916 CA SER A 59 -0.198 6.369 -5.844 1.00 0.00 C ATOM 917 C SER A 59 0.029 5.089 -6.643 1.00 0.00 C ATOM 918 O SER A 59 0.714 5.095 -7.666 1.00 0.00 O ATOM 919 CB SER A 59 0.648 7.503 -6.425 1.00 0.00 C ATOM 920 OG SER A 59 0.077 8.004 -7.622 1.00 0.00 O ATOM 0 H SER A 59 -0.687 6.097 -3.824 1.00 0.00 H new ATOM 0 HA SER A 59 -1.252 6.639 -5.914 1.00 0.00 H new ATOM 0 HB2 SER A 59 0.734 8.308 -5.695 1.00 0.00 H new ATOM 0 HB3 SER A 59 1.658 7.143 -6.623 1.00 0.00 H new ATOM 0 HG SER A 59 0.007 7.280 -8.279 1.00 0.00 H new ATOM 926 N PHE A 60 -0.553 3.992 -6.169 1.00 0.00 N ATOM 927 CA PHE A 60 -0.414 2.704 -6.837 1.00 0.00 C ATOM 928 C PHE A 60 -1.772 2.181 -7.298 1.00 0.00 C ATOM 929 O PHE A 60 -2.799 2.830 -7.098 1.00 0.00 O ATOM 930 CB PHE A 60 0.246 1.688 -5.902 1.00 0.00 C ATOM 931 CG PHE A 60 1.746 1.692 -5.976 1.00 0.00 C ATOM 932 CD1 PHE A 60 2.461 2.858 -5.756 1.00 0.00 C ATOM 933 CD2 PHE A 60 2.441 0.529 -6.265 1.00 0.00 C ATOM 934 CE1 PHE A 60 3.841 2.864 -5.825 1.00 0.00 C ATOM 935 CE2 PHE A 60 3.822 0.528 -6.334 1.00 0.00 C ATOM 936 CZ PHE A 60 4.523 1.698 -6.113 1.00 0.00 C ATOM 0 H PHE A 60 -1.125 3.970 -5.325 1.00 0.00 H new ATOM 0 HA PHE A 60 0.219 2.844 -7.714 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -0.060 1.897 -4.877 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -0.119 0.691 -6.146 1.00 0.00 H new ATOM 0 HD1 PHE A 60 1.934 3.773 -5.528 1.00 0.00 H new ATOM 0 HD2 PHE A 60 1.898 -0.388 -6.439 1.00 0.00 H new ATOM 0 HE1 PHE A 60 4.386 3.780 -5.654 1.00 0.00 H new ATOM 0 HE2 PHE A 60 4.352 -0.386 -6.560 1.00 0.00 H new ATOM 0 HZ PHE A 60 5.602 1.701 -6.165 1.00 0.00 H new ATOM 946 N ARG A 61 -1.768 1.004 -7.914 1.00 0.00 N ATOM 947 CA ARG A 61 -2.998 0.394 -8.405 1.00 0.00 C ATOM 948 C ARG A 61 -3.059 -1.084 -8.030 1.00 0.00 C ATOM 949 O ARG A 61 -2.491 -1.934 -8.717 1.00 0.00 O ATOM 950 CB ARG A 61 -3.100 0.551 -9.923 1.00 0.00 C ATOM 951 CG ARG A 61 -4.362 -0.056 -10.514 1.00 0.00 C ATOM 952 CD ARG A 61 -4.320 -0.057 -12.034 1.00 0.00 C ATOM 953 NE ARG A 61 -5.524 -0.645 -12.615 1.00 0.00 N ATOM 954 CZ ARG A 61 -5.612 -1.041 -13.880 1.00 0.00 C ATOM 955 NH1 ARG A 61 -4.572 -0.914 -14.692 1.00 0.00 N ATOM 956 NH2 ARG A 61 -6.743 -1.567 -14.334 1.00 0.00 N ATOM 0 H ARG A 61 -0.927 0.453 -8.085 1.00 0.00 H new ATOM 0 HA ARG A 61 -3.839 0.905 -7.937 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -3.065 1.611 -10.173 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -2.231 0.085 -10.387 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -4.480 -1.077 -10.151 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -5.232 0.506 -10.173 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -4.206 0.965 -12.394 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -3.446 -0.613 -12.372 1.00 0.00 H new ATOM 0 HE ARG A 61 -6.342 -0.758 -12.017 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -3.701 -0.511 -14.346 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -4.643 -1.219 -15.663 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -7.545 -1.667 -13.712 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -6.810 -1.871 -15.305 1.00 0.00 H new ATOM 970 N VAL A 62 -3.750 -1.384 -6.935 1.00 0.00 N ATOM 971 CA VAL A 62 -3.886 -2.759 -6.469 1.00 0.00 C ATOM 972 C VAL A 62 -5.209 -3.365 -6.924 1.00 0.00 C ATOM 973 O VAL A 62 -6.274 -2.787 -6.711 1.00 0.00 O ATOM 974 CB VAL A 62 -3.796 -2.843 -4.934 1.00 0.00 C ATOM 975 CG1 VAL A 62 -3.861 -4.291 -4.473 1.00 0.00 C ATOM 976 CG2 VAL A 62 -2.524 -2.173 -4.438 1.00 0.00 C ATOM 0 H VAL A 62 -4.225 -0.693 -6.354 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.062 -3.324 -6.905 1.00 0.00 H new ATOM 0 HB VAL A 62 -4.648 -2.313 -4.508 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -3.796 -4.330 -3.386 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -4.803 -4.734 -4.796 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -3.031 -4.848 -4.906 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -2.477 -2.242 -3.351 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -1.657 -2.672 -4.871 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.525 -1.124 -4.736 1.00 0.00 H new ATOM 986 N ALA A 63 -5.133 -4.535 -7.551 1.00 0.00 N ATOM 987 CA ALA A 63 -6.324 -5.221 -8.034 1.00 0.00 C ATOM 988 C ALA A 63 -5.982 -6.610 -8.562 1.00 0.00 C ATOM 989 O ALA A 63 -4.883 -6.839 -9.067 1.00 0.00 O ATOM 990 CB ALA A 63 -7.007 -4.397 -9.116 1.00 0.00 C ATOM 0 H ALA A 63 -4.259 -5.027 -7.736 1.00 0.00 H new ATOM 0 HA ALA A 63 -7.010 -5.338 -7.195 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.895 -4.922 -9.467 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.296 -3.428 -8.708 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -6.320 -4.249 -9.949 1.00 0.00 H new ATOM 996 N ALA A 64 -6.929 -7.534 -8.441 1.00 0.00 N ATOM 997 CA ALA A 64 -6.727 -8.901 -8.907 1.00 0.00 C ATOM 998 C ALA A 64 -5.865 -8.930 -10.164 1.00 0.00 C ATOM 999 O ALA A 64 -5.909 -8.010 -10.981 1.00 0.00 O ATOM 1000 CB ALA A 64 -8.067 -9.573 -9.168 1.00 0.00 C ATOM 0 H ALA A 64 -7.844 -7.361 -8.024 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.203 -9.452 -8.126 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.901 -10.593 -9.515 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.649 -9.594 -8.247 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.612 -9.015 -9.929 1.00 0.00 H new ATOM 1006 N VAL A 65 -5.080 -9.992 -10.314 1.00 0.00 N ATOM 1007 CA VAL A 65 -4.207 -10.141 -11.472 1.00 0.00 C ATOM 1008 C VAL A 65 -4.994 -10.018 -12.772 1.00 0.00 C ATOM 1009 O VAL A 65 -6.221 -9.933 -12.760 1.00 0.00 O ATOM 1010 CB VAL A 65 -3.477 -11.497 -11.454 1.00 0.00 C ATOM 1011 CG1 VAL A 65 -2.403 -11.511 -10.376 1.00 0.00 C ATOM 1012 CG2 VAL A 65 -4.467 -12.633 -11.246 1.00 0.00 C ATOM 0 H VAL A 65 -5.031 -10.762 -9.647 1.00 0.00 H new ATOM 0 HA VAL A 65 -3.470 -9.339 -11.418 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.992 -11.641 -12.419 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -1.898 -12.477 -10.378 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -1.678 -10.722 -10.575 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -2.863 -11.344 -9.402 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -3.933 -13.583 -11.236 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -4.983 -12.497 -10.296 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -5.195 -12.634 -12.057 1.00 0.00 H new ATOM 1022 N GLN A 66 -4.278 -10.009 -13.892 1.00 0.00 N ATOM 1023 CA GLN A 66 -4.910 -9.896 -15.201 1.00 0.00 C ATOM 1024 C GLN A 66 -4.974 -11.253 -15.894 1.00 0.00 C ATOM 1025 O GLN A 66 -4.259 -12.192 -15.541 1.00 0.00 O ATOM 1026 CB GLN A 66 -4.146 -8.900 -16.075 1.00 0.00 C ATOM 1027 CG GLN A 66 -4.651 -7.471 -15.952 1.00 0.00 C ATOM 1028 CD GLN A 66 -4.274 -6.615 -17.145 1.00 0.00 C ATOM 1029 OE1 GLN A 66 -3.170 -6.723 -17.678 1.00 0.00 O ATOM 1030 NE2 GLN A 66 -5.194 -5.757 -17.572 1.00 0.00 N ATOM 0 H GLN A 66 -3.261 -10.079 -13.919 1.00 0.00 H new ATOM 0 HA GLN A 66 -5.928 -9.535 -15.055 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -3.090 -8.928 -15.806 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -4.218 -9.214 -17.116 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -5.736 -7.481 -15.845 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -4.245 -7.023 -15.045 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -6.097 -5.700 -17.100 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -4.998 -5.155 -18.372 1.00 0.00 H new ATOM 1039 N PRO A 67 -5.850 -11.362 -16.903 1.00 0.00 N ATOM 1040 CA PRO A 67 -6.029 -12.601 -17.667 1.00 0.00 C ATOM 1041 C PRO A 67 -4.825 -12.917 -18.548 1.00 0.00 C ATOM 1042 O PRO A 67 -4.621 -14.063 -18.949 1.00 0.00 O ATOM 1043 CB PRO A 67 -7.261 -12.312 -18.528 1.00 0.00 C ATOM 1044 CG PRO A 67 -7.289 -10.829 -18.665 1.00 0.00 C ATOM 1045 CD PRO A 67 -6.734 -10.284 -17.378 1.00 0.00 C ATOM 0 HA PRO A 67 -6.141 -13.469 -17.017 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -7.187 -12.798 -19.501 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -8.170 -12.683 -18.055 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -6.691 -10.504 -19.516 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -8.305 -10.472 -18.834 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -6.185 -9.356 -17.538 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -7.525 -10.067 -16.660 1.00 0.00 H new ATOM 1053 N SER A 68 -4.030 -11.894 -18.846 1.00 0.00 N ATOM 1054 CA SER A 68 -2.848 -12.062 -19.682 1.00 0.00 C ATOM 1055 C SER A 68 -1.728 -12.750 -18.908 1.00 0.00 C ATOM 1056 O SER A 68 -0.970 -13.545 -19.465 1.00 0.00 O ATOM 1057 CB SER A 68 -2.366 -10.706 -20.201 1.00 0.00 C ATOM 1058 OG SER A 68 -1.453 -10.865 -21.273 1.00 0.00 O ATOM 0 H SER A 68 -4.184 -10.940 -18.520 1.00 0.00 H new ATOM 0 HA SER A 68 -3.120 -12.691 -20.529 1.00 0.00 H new ATOM 0 HB2 SER A 68 -3.220 -10.115 -20.531 1.00 0.00 H new ATOM 0 HB3 SER A 68 -1.889 -10.152 -19.392 1.00 0.00 H new ATOM 0 HG SER A 68 -1.161 -9.984 -21.588 1.00 0.00 H new ATOM 1064 N ASP A 69 -1.630 -12.439 -17.620 1.00 0.00 N ATOM 1065 CA ASP A 69 -0.603 -13.027 -16.767 1.00 0.00 C ATOM 1066 C ASP A 69 -0.844 -14.521 -16.578 1.00 0.00 C ATOM 1067 O ASP A 69 0.097 -15.312 -16.543 1.00 0.00 O ATOM 1068 CB ASP A 69 -0.576 -12.326 -15.408 1.00 0.00 C ATOM 1069 CG ASP A 69 0.371 -11.143 -15.386 1.00 0.00 C ATOM 1070 OD1 ASP A 69 1.597 -11.362 -15.479 1.00 0.00 O ATOM 1071 OD2 ASP A 69 -0.113 -9.997 -15.275 1.00 0.00 O ATOM 0 H ASP A 69 -2.249 -11.783 -17.144 1.00 0.00 H new ATOM 0 HA ASP A 69 0.362 -12.892 -17.256 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -1.581 -11.988 -15.157 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -0.279 -13.040 -14.640 1.00 0.00 H new ATOM 1076 N ASN A 70 -2.113 -14.900 -16.456 1.00 0.00 N ATOM 1077 CA ASN A 70 -2.477 -16.299 -16.269 1.00 0.00 C ATOM 1078 C ASN A 70 -1.826 -16.868 -15.012 1.00 0.00 C ATOM 1079 O ASN A 70 -1.301 -17.981 -15.022 1.00 0.00 O ATOM 1080 CB ASN A 70 -2.062 -17.124 -17.489 1.00 0.00 C ATOM 1081 CG ASN A 70 -2.959 -18.327 -17.706 1.00 0.00 C ATOM 1082 OD1 ASN A 70 -3.474 -18.912 -16.753 1.00 0.00 O ATOM 1083 ND2 ASN A 70 -3.151 -18.703 -18.965 1.00 0.00 N ATOM 0 H ASN A 70 -2.905 -14.258 -16.483 1.00 0.00 H new ATOM 0 HA ASN A 70 -3.559 -16.353 -16.153 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -2.086 -16.492 -18.377 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -1.033 -17.460 -17.364 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -3.745 -19.506 -19.173 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -2.704 -18.189 -19.724 1.00 0.00 H new ATOM 1090 N ILE A 71 -1.866 -16.096 -13.931 1.00 0.00 N ATOM 1091 CA ILE A 71 -1.282 -16.523 -12.666 1.00 0.00 C ATOM 1092 C ILE A 71 -1.912 -17.824 -12.181 1.00 0.00 C ATOM 1093 O ILE A 71 -2.906 -17.812 -11.455 1.00 0.00 O ATOM 1094 CB ILE A 71 -1.449 -15.447 -11.577 1.00 0.00 C ATOM 1095 CG1 ILE A 71 -0.782 -14.141 -12.012 1.00 0.00 C ATOM 1096 CG2 ILE A 71 -0.866 -15.933 -10.258 1.00 0.00 C ATOM 1097 CD1 ILE A 71 0.712 -14.262 -12.210 1.00 0.00 C ATOM 0 H ILE A 71 -2.297 -15.172 -13.906 1.00 0.00 H new ATOM 0 HA ILE A 71 -0.219 -16.683 -12.847 1.00 0.00 H new ATOM 0 HB ILE A 71 -2.513 -15.259 -11.434 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -1.237 -13.802 -12.943 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -0.980 -13.374 -11.263 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -0.992 -15.161 -9.498 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -1.383 -16.839 -9.944 1.00 0.00 H new ATOM 0 HG23 ILE A 71 0.195 -16.147 -10.386 1.00 0.00 H new ATOM 0 HD11 ILE A 71 1.117 -13.298 -12.518 1.00 0.00 H new ATOM 0 HD12 ILE A 71 1.179 -14.570 -11.275 1.00 0.00 H new ATOM 0 HD13 ILE A 71 0.918 -15.005 -12.981 1.00 0.00 H new ATOM 1109 N SER A 72 -1.325 -18.946 -12.586 1.00 0.00 N ATOM 1110 CA SER A 72 -1.830 -20.257 -12.194 1.00 0.00 C ATOM 1111 C SER A 72 -2.405 -20.218 -10.782 1.00 0.00 C ATOM 1112 O SER A 72 -3.500 -20.722 -10.532 1.00 0.00 O ATOM 1113 CB SER A 72 -0.715 -21.301 -12.274 1.00 0.00 C ATOM 1114 OG SER A 72 -1.196 -22.589 -11.930 1.00 0.00 O ATOM 0 H SER A 72 -0.500 -18.974 -13.185 1.00 0.00 H new ATOM 0 HA SER A 72 -2.627 -20.533 -12.884 1.00 0.00 H new ATOM 0 HB2 SER A 72 -0.303 -21.321 -13.283 1.00 0.00 H new ATOM 0 HB3 SER A 72 0.098 -21.022 -11.603 1.00 0.00 H new ATOM 0 HG SER A 72 -0.464 -23.238 -11.990 1.00 0.00 H new ATOM 1120 N ARG A 73 -1.659 -19.615 -9.862 1.00 0.00 N ATOM 1121 CA ARG A 73 -2.093 -19.510 -8.474 1.00 0.00 C ATOM 1122 C ARG A 73 -3.409 -18.745 -8.373 1.00 0.00 C ATOM 1123 O ARG A 73 -3.553 -17.658 -8.933 1.00 0.00 O ATOM 1124 CB ARG A 73 -1.020 -18.816 -7.633 1.00 0.00 C ATOM 1125 CG ARG A 73 -0.012 -19.773 -7.021 1.00 0.00 C ATOM 1126 CD ARG A 73 1.349 -19.116 -6.851 1.00 0.00 C ATOM 1127 NE ARG A 73 2.156 -19.206 -8.065 1.00 0.00 N ATOM 1128 CZ ARG A 73 2.652 -20.345 -8.534 1.00 0.00 C ATOM 1129 NH1 ARG A 73 2.425 -21.484 -7.895 1.00 0.00 N ATOM 1130 NH2 ARG A 73 3.377 -20.346 -9.645 1.00 0.00 N ATOM 0 H ARG A 73 -0.751 -19.192 -10.053 1.00 0.00 H new ATOM 0 HA ARG A 73 -2.249 -20.518 -8.090 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -0.491 -18.095 -8.257 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -1.504 -18.253 -6.835 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -0.376 -20.115 -6.052 1.00 0.00 H new ATOM 0 HG3 ARG A 73 0.085 -20.655 -7.654 1.00 0.00 H new ATOM 0 HD2 ARG A 73 1.215 -18.068 -6.582 1.00 0.00 H new ATOM 0 HD3 ARG A 73 1.880 -19.591 -6.026 1.00 0.00 H new ATOM 0 HE ARG A 73 2.349 -18.347 -8.581 1.00 0.00 H new ATOM 0 HH11 ARG A 73 1.868 -21.487 -7.041 1.00 0.00 H new ATOM 0 HH12 ARG A 73 2.807 -22.357 -8.258 1.00 0.00 H new ATOM 0 HH21 ARG A 73 3.554 -19.472 -10.139 1.00 0.00 H new ATOM 0 HH22 ARG A 73 3.758 -21.221 -10.005 1.00 0.00 H new ATOM 1144 N LYS A 74 -4.368 -19.320 -7.655 1.00 0.00 N ATOM 1145 CA LYS A 74 -5.672 -18.694 -7.478 1.00 0.00 C ATOM 1146 C LYS A 74 -5.636 -17.670 -6.348 1.00 0.00 C ATOM 1147 O LYS A 74 -4.846 -17.792 -5.411 1.00 0.00 O ATOM 1148 CB LYS A 74 -6.735 -19.755 -7.184 1.00 0.00 C ATOM 1149 CG LYS A 74 -7.136 -20.568 -8.403 1.00 0.00 C ATOM 1150 CD LYS A 74 -8.535 -21.142 -8.255 1.00 0.00 C ATOM 1151 CE LYS A 74 -8.515 -22.477 -7.526 1.00 0.00 C ATOM 1152 NZ LYS A 74 -8.335 -23.619 -8.465 1.00 0.00 N ATOM 0 H LYS A 74 -4.266 -20.220 -7.186 1.00 0.00 H new ATOM 0 HA LYS A 74 -5.927 -18.179 -8.404 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -6.360 -20.430 -6.415 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -7.620 -19.267 -6.776 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -7.092 -19.938 -9.292 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -6.423 -21.379 -8.551 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -9.163 -20.438 -7.709 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -8.983 -21.271 -9.240 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -7.708 -22.479 -6.793 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -9.447 -22.604 -6.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -8.327 -24.511 -7.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -9.118 -23.633 -9.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -7.434 -23.512 -8.973 1.00 0.00 H new ATOM 1166 N HIS A 75 -6.496 -16.661 -6.441 1.00 0.00 N ATOM 1167 CA HIS A 75 -6.563 -15.617 -5.425 1.00 0.00 C ATOM 1168 C HIS A 75 -5.301 -14.760 -5.442 1.00 0.00 C ATOM 1169 O HIS A 75 -4.767 -14.400 -4.393 1.00 0.00 O ATOM 1170 CB HIS A 75 -6.755 -16.235 -4.040 1.00 0.00 C ATOM 1171 CG HIS A 75 -7.610 -17.465 -4.046 1.00 0.00 C ATOM 1172 ND1 HIS A 75 -8.832 -17.528 -4.680 1.00 0.00 N ATOM 1173 CD2 HIS A 75 -7.411 -18.684 -3.492 1.00 0.00 C ATOM 1174 CE1 HIS A 75 -9.350 -18.732 -4.514 1.00 0.00 C ATOM 1175 NE2 HIS A 75 -8.507 -19.453 -3.797 1.00 0.00 N ATOM 0 H HIS A 75 -7.156 -16.544 -7.210 1.00 0.00 H new ATOM 0 HA HIS A 75 -7.417 -14.979 -5.651 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -5.779 -16.483 -3.623 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -7.204 -15.493 -3.379 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -6.551 -18.994 -2.917 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -10.301 -19.069 -4.899 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -8.647 -20.423 -3.516 1.00 0.00 H new ATOM 1184 N THR A 76 -4.827 -14.436 -6.642 1.00 0.00 N ATOM 1185 CA THR A 76 -3.627 -13.624 -6.796 1.00 0.00 C ATOM 1186 C THR A 76 -3.970 -12.229 -7.308 1.00 0.00 C ATOM 1187 O THR A 76 -4.862 -12.064 -8.139 1.00 0.00 O ATOM 1188 CB THR A 76 -2.625 -14.281 -7.763 1.00 0.00 C ATOM 1189 OG1 THR A 76 -2.297 -15.599 -7.308 1.00 0.00 O ATOM 1190 CG2 THR A 76 -1.357 -13.448 -7.877 1.00 0.00 C ATOM 0 H THR A 76 -5.257 -14.724 -7.521 1.00 0.00 H new ATOM 0 HA THR A 76 -3.170 -13.544 -5.810 1.00 0.00 H new ATOM 0 HB THR A 76 -3.090 -14.342 -8.747 1.00 0.00 H new ATOM 0 HG1 THR A 76 -2.740 -16.262 -7.879 1.00 0.00 H new ATOM 0 HG21 THR A 76 -0.664 -13.932 -8.565 1.00 0.00 H new ATOM 0 HG22 THR A 76 -1.606 -12.455 -8.251 1.00 0.00 H new ATOM 0 HG23 THR A 76 -0.891 -13.359 -6.896 1.00 0.00 H new ATOM 1198 N PHE A 77 -3.254 -11.228 -6.806 1.00 0.00 N ATOM 1199 CA PHE A 77 -3.483 -9.846 -7.212 1.00 0.00 C ATOM 1200 C PHE A 77 -2.171 -9.169 -7.598 1.00 0.00 C ATOM 1201 O PHE A 77 -1.095 -9.585 -7.170 1.00 0.00 O ATOM 1202 CB PHE A 77 -4.160 -9.066 -6.084 1.00 0.00 C ATOM 1203 CG PHE A 77 -3.547 -9.309 -4.734 1.00 0.00 C ATOM 1204 CD1 PHE A 77 -3.704 -10.529 -4.097 1.00 0.00 C ATOM 1205 CD2 PHE A 77 -2.814 -8.317 -4.103 1.00 0.00 C ATOM 1206 CE1 PHE A 77 -3.140 -10.756 -2.855 1.00 0.00 C ATOM 1207 CE2 PHE A 77 -2.248 -8.539 -2.862 1.00 0.00 C ATOM 1208 CZ PHE A 77 -2.412 -9.759 -2.237 1.00 0.00 C ATOM 0 H PHE A 77 -2.511 -11.348 -6.118 1.00 0.00 H new ATOM 0 HA PHE A 77 -4.138 -9.853 -8.083 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.111 -8.001 -6.310 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.215 -9.336 -6.049 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -4.273 -11.312 -4.576 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -2.684 -7.360 -4.586 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -3.269 -11.712 -2.369 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -1.677 -7.758 -2.381 1.00 0.00 H new ATOM 0 HZ PHE A 77 -1.972 -9.933 -1.266 1.00 0.00 H new ATOM 1218 N LYS A 78 -2.270 -8.122 -8.410 1.00 0.00 N ATOM 1219 CA LYS A 78 -1.093 -7.385 -8.855 1.00 0.00 C ATOM 1220 C LYS A 78 -1.197 -5.912 -8.471 1.00 0.00 C ATOM 1221 O LYS A 78 -2.294 -5.375 -8.325 1.00 0.00 O ATOM 1222 CB LYS A 78 -0.925 -7.517 -10.370 1.00 0.00 C ATOM 1223 CG LYS A 78 -2.012 -6.815 -11.166 1.00 0.00 C ATOM 1224 CD LYS A 78 -1.678 -6.772 -12.648 1.00 0.00 C ATOM 1225 CE LYS A 78 -2.360 -5.601 -13.339 1.00 0.00 C ATOM 1226 NZ LYS A 78 -1.588 -5.128 -14.521 1.00 0.00 N ATOM 0 H LYS A 78 -3.153 -7.765 -8.773 1.00 0.00 H new ATOM 0 HA LYS A 78 -0.220 -7.811 -8.361 1.00 0.00 H new ATOM 0 HB2 LYS A 78 0.044 -7.109 -10.657 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -0.917 -8.574 -10.636 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -2.961 -7.331 -11.021 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -2.140 -5.799 -10.791 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -0.598 -6.693 -12.777 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -1.988 -7.705 -13.119 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -3.360 -5.898 -13.654 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -2.479 -4.781 -12.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -2.086 -4.330 -14.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -0.642 -4.821 -14.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -1.496 -5.903 -15.208 1.00 0.00 H new ATOM 1240 N ALA A 79 -0.047 -5.265 -8.310 1.00 0.00 N ATOM 1241 CA ALA A 79 -0.010 -3.853 -7.947 1.00 0.00 C ATOM 1242 C ALA A 79 0.967 -3.085 -8.831 1.00 0.00 C ATOM 1243 O ALA A 79 2.158 -3.390 -8.867 1.00 0.00 O ATOM 1244 CB ALA A 79 0.367 -3.696 -6.481 1.00 0.00 C ATOM 0 H ALA A 79 0.871 -5.696 -8.425 1.00 0.00 H new ATOM 0 HA ALA A 79 -1.005 -3.436 -8.102 1.00 0.00 H new ATOM 0 HB1 ALA A 79 0.391 -2.637 -6.223 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -0.370 -4.204 -5.859 1.00 0.00 H new ATOM 0 HB3 ALA A 79 1.350 -4.134 -6.309 1.00 0.00 H new ATOM 1250 N GLU A 80 0.453 -2.087 -9.544 1.00 0.00 N ATOM 1251 CA GLU A 80 1.280 -1.277 -10.430 1.00 0.00 C ATOM 1252 C GLU A 80 1.311 0.177 -9.966 1.00 0.00 C ATOM 1253 O GLU A 80 0.431 0.625 -9.231 1.00 0.00 O ATOM 1254 CB GLU A 80 0.758 -1.355 -11.866 1.00 0.00 C ATOM 1255 CG GLU A 80 1.622 -0.610 -12.869 1.00 0.00 C ATOM 1256 CD GLU A 80 1.052 -0.650 -14.274 1.00 0.00 C ATOM 1257 OE1 GLU A 80 0.026 0.020 -14.516 1.00 0.00 O ATOM 1258 OE2 GLU A 80 1.630 -1.351 -15.130 1.00 0.00 O ATOM 0 H GLU A 80 -0.531 -1.821 -9.525 1.00 0.00 H new ATOM 0 HA GLU A 80 2.295 -1.672 -10.399 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.692 -2.402 -12.163 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.253 -0.950 -11.899 1.00 0.00 H new ATOM 0 HG2 GLU A 80 1.726 0.428 -12.553 1.00 0.00 H new ATOM 0 HG3 GLU A 80 2.622 -1.044 -12.874 1.00 0.00 H new ATOM 1265 N HIS A 81 2.332 0.909 -10.401 1.00 0.00 N ATOM 1266 CA HIS A 81 2.479 2.312 -10.031 1.00 0.00 C ATOM 1267 C HIS A 81 2.815 3.163 -11.252 1.00 0.00 C ATOM 1268 O HIS A 81 3.839 3.845 -11.282 1.00 0.00 O ATOM 1269 CB HIS A 81 3.567 2.470 -8.969 1.00 0.00 C ATOM 1270 CG HIS A 81 3.925 3.897 -8.686 1.00 0.00 C ATOM 1271 ND1 HIS A 81 5.134 4.276 -8.142 1.00 0.00 N ATOM 1272 CD2 HIS A 81 3.225 5.040 -8.876 1.00 0.00 C ATOM 1273 CE1 HIS A 81 5.161 5.590 -8.008 1.00 0.00 C ATOM 1274 NE2 HIS A 81 4.015 6.077 -8.447 1.00 0.00 N ATOM 0 H HIS A 81 3.069 0.554 -11.010 1.00 0.00 H new ATOM 0 HA HIS A 81 1.529 2.656 -9.621 1.00 0.00 H new ATOM 0 HB2 HIS A 81 3.233 1.998 -8.045 1.00 0.00 H new ATOM 0 HB3 HIS A 81 4.461 1.937 -9.294 1.00 0.00 H new ATOM 0 HD2 HIS A 81 2.230 5.121 -9.288 1.00 0.00 H new ATOM 0 HE1 HIS A 81 5.981 6.168 -7.607 1.00 0.00 H new ATOM 0 HE2 HIS A 81 3.758 7.064 -8.464 1.00 0.00 H new ATOM 1283 N ALA A 82 1.947 3.117 -12.257 1.00 0.00 N ATOM 1284 CA ALA A 82 2.151 3.885 -13.479 1.00 0.00 C ATOM 1285 C ALA A 82 3.268 3.283 -14.325 1.00 0.00 C ATOM 1286 O ALA A 82 3.902 3.978 -15.118 1.00 0.00 O ATOM 1287 CB ALA A 82 2.463 5.336 -13.145 1.00 0.00 C ATOM 0 H ALA A 82 1.095 2.556 -12.249 1.00 0.00 H new ATOM 0 HA ALA A 82 1.230 3.848 -14.060 1.00 0.00 H new ATOM 0 HB1 ALA A 82 2.613 5.897 -14.067 1.00 0.00 H new ATOM 0 HB2 ALA A 82 1.632 5.768 -12.588 1.00 0.00 H new ATOM 0 HB3 ALA A 82 3.368 5.384 -12.540 1.00 0.00 H new ATOM 1293 N GLY A 83 3.503 1.986 -14.150 1.00 0.00 N ATOM 1294 CA GLY A 83 4.544 1.313 -14.905 1.00 0.00 C ATOM 1295 C GLY A 83 5.786 1.054 -14.075 1.00 0.00 C ATOM 1296 O GLY A 83 6.497 0.074 -14.298 1.00 0.00 O ATOM 0 H GLY A 83 2.992 1.390 -13.499 1.00 0.00 H new ATOM 0 HA2 GLY A 83 4.160 0.366 -15.284 1.00 0.00 H new ATOM 0 HA3 GLY A 83 4.809 1.919 -15.772 1.00 0.00 H new ATOM 1300 N VAL A 84 6.049 1.936 -13.115 1.00 0.00 N ATOM 1301 CA VAL A 84 7.214 1.798 -12.249 1.00 0.00 C ATOM 1302 C VAL A 84 7.556 0.331 -12.017 1.00 0.00 C ATOM 1303 O VAL A 84 8.632 -0.133 -12.395 1.00 0.00 O ATOM 1304 CB VAL A 84 6.985 2.482 -10.888 1.00 0.00 C ATOM 1305 CG1 VAL A 84 8.178 2.258 -9.971 1.00 0.00 C ATOM 1306 CG2 VAL A 84 6.718 3.968 -11.077 1.00 0.00 C ATOM 0 H VAL A 84 5.471 2.753 -12.918 1.00 0.00 H new ATOM 0 HA VAL A 84 8.046 2.286 -12.757 1.00 0.00 H new ATOM 0 HB VAL A 84 6.108 2.036 -10.419 1.00 0.00 H new ATOM 0 HG11 VAL A 84 7.999 2.748 -9.014 1.00 0.00 H new ATOM 0 HG12 VAL A 84 8.318 1.189 -9.810 1.00 0.00 H new ATOM 0 HG13 VAL A 84 9.074 2.676 -10.431 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.558 4.435 -10.105 1.00 0.00 H new ATOM 0 HG22 VAL A 84 7.574 4.432 -11.567 1.00 0.00 H new ATOM 0 HG23 VAL A 84 5.830 4.102 -11.695 1.00 0.00 H new ATOM 1316 N ARG A 85 6.634 -0.395 -11.394 1.00 0.00 N ATOM 1317 CA ARG A 85 6.838 -1.810 -11.111 1.00 0.00 C ATOM 1318 C ARG A 85 5.513 -2.501 -10.804 1.00 0.00 C ATOM 1319 O ARG A 85 4.678 -1.969 -10.071 1.00 0.00 O ATOM 1320 CB ARG A 85 7.800 -1.983 -9.933 1.00 0.00 C ATOM 1321 CG ARG A 85 8.239 -3.421 -9.712 1.00 0.00 C ATOM 1322 CD ARG A 85 9.507 -3.742 -10.488 1.00 0.00 C ATOM 1323 NE ARG A 85 9.569 -5.149 -10.877 1.00 0.00 N ATOM 1324 CZ ARG A 85 10.706 -5.808 -11.068 1.00 0.00 C ATOM 1325 NH1 ARG A 85 11.869 -5.192 -10.908 1.00 0.00 N ATOM 1326 NH2 ARG A 85 10.681 -7.087 -11.421 1.00 0.00 N ATOM 0 H ARG A 85 5.738 -0.026 -11.075 1.00 0.00 H new ATOM 0 HA ARG A 85 7.272 -2.272 -11.998 1.00 0.00 H new ATOM 0 HB2 ARG A 85 8.682 -1.365 -10.101 1.00 0.00 H new ATOM 0 HB3 ARG A 85 7.320 -1.615 -9.026 1.00 0.00 H new ATOM 0 HG2 ARG A 85 8.409 -3.591 -8.649 1.00 0.00 H new ATOM 0 HG3 ARG A 85 7.442 -4.097 -10.020 1.00 0.00 H new ATOM 0 HD2 ARG A 85 9.554 -3.117 -11.380 1.00 0.00 H new ATOM 0 HD3 ARG A 85 10.377 -3.495 -9.879 1.00 0.00 H new ATOM 0 HE ARG A 85 8.692 -5.652 -11.009 1.00 0.00 H new ATOM 0 HH11 ARG A 85 11.892 -4.209 -10.637 1.00 0.00 H new ATOM 0 HH12 ARG A 85 12.740 -5.701 -11.056 1.00 0.00 H new ATOM 0 HH21 ARG A 85 9.788 -7.564 -11.546 1.00 0.00 H new ATOM 0 HH22 ARG A 85 11.555 -7.593 -11.568 1.00 0.00 H new ATOM 1340 N THR A 86 5.325 -3.689 -11.370 1.00 0.00 N ATOM 1341 CA THR A 86 4.101 -4.451 -11.159 1.00 0.00 C ATOM 1342 C THR A 86 4.339 -5.623 -10.214 1.00 0.00 C ATOM 1343 O THR A 86 4.857 -6.664 -10.618 1.00 0.00 O ATOM 1344 CB THR A 86 3.536 -4.985 -12.489 1.00 0.00 C ATOM 1345 OG1 THR A 86 3.732 -4.020 -13.528 1.00 0.00 O ATOM 1346 CG2 THR A 86 2.054 -5.303 -12.358 1.00 0.00 C ATOM 0 H THR A 86 6.005 -4.144 -11.978 1.00 0.00 H new ATOM 0 HA THR A 86 3.377 -3.769 -10.713 1.00 0.00 H new ATOM 0 HB THR A 86 4.068 -5.902 -12.742 1.00 0.00 H new ATOM 0 HG1 THR A 86 3.372 -4.368 -14.370 1.00 0.00 H new ATOM 0 HG21 THR A 86 1.677 -5.678 -13.309 1.00 0.00 H new ATOM 0 HG22 THR A 86 1.911 -6.060 -11.587 1.00 0.00 H new ATOM 0 HG23 THR A 86 1.511 -4.399 -12.084 1.00 0.00 H new ATOM 1354 N TYR A 87 3.956 -5.447 -8.954 1.00 0.00 N ATOM 1355 CA TYR A 87 4.130 -6.490 -7.950 1.00 0.00 C ATOM 1356 C TYR A 87 3.002 -7.515 -8.028 1.00 0.00 C ATOM 1357 O TYR A 87 1.877 -7.189 -8.408 1.00 0.00 O ATOM 1358 CB TYR A 87 4.180 -5.877 -6.550 1.00 0.00 C ATOM 1359 CG TYR A 87 5.301 -4.878 -6.367 1.00 0.00 C ATOM 1360 CD1 TYR A 87 5.216 -3.602 -6.909 1.00 0.00 C ATOM 1361 CD2 TYR A 87 6.445 -5.211 -5.651 1.00 0.00 C ATOM 1362 CE1 TYR A 87 6.238 -2.686 -6.745 1.00 0.00 C ATOM 1363 CE2 TYR A 87 7.470 -4.302 -5.481 1.00 0.00 C ATOM 1364 CZ TYR A 87 7.362 -3.041 -6.029 1.00 0.00 C ATOM 1365 OH TYR A 87 8.383 -2.133 -5.863 1.00 0.00 O ATOM 0 H TYR A 87 3.523 -4.592 -8.604 1.00 0.00 H new ATOM 0 HA TYR A 87 5.073 -6.998 -8.151 1.00 0.00 H new ATOM 0 HB2 TYR A 87 3.229 -5.386 -6.343 1.00 0.00 H new ATOM 0 HB3 TYR A 87 4.292 -6.675 -5.816 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.336 -3.321 -7.468 1.00 0.00 H new ATOM 0 HD2 TYR A 87 6.533 -6.198 -5.220 1.00 0.00 H new ATOM 0 HE1 TYR A 87 6.157 -1.699 -7.175 1.00 0.00 H new ATOM 0 HE2 TYR A 87 8.352 -4.577 -4.922 1.00 0.00 H new ATOM 0 HH TYR A 87 9.100 -2.540 -5.334 1.00 0.00 H new ATOM 1375 N PHE A 88 3.312 -8.755 -7.665 1.00 0.00 N ATOM 1376 CA PHE A 88 2.326 -9.829 -7.694 1.00 0.00 C ATOM 1377 C PHE A 88 2.287 -10.567 -6.359 1.00 0.00 C ATOM 1378 O PHE A 88 3.304 -11.080 -5.890 1.00 0.00 O ATOM 1379 CB PHE A 88 2.643 -10.811 -8.823 1.00 0.00 C ATOM 1380 CG PHE A 88 2.206 -10.329 -10.177 1.00 0.00 C ATOM 1381 CD1 PHE A 88 2.968 -9.409 -10.879 1.00 0.00 C ATOM 1382 CD2 PHE A 88 1.033 -10.796 -10.748 1.00 0.00 C ATOM 1383 CE1 PHE A 88 2.568 -8.963 -12.124 1.00 0.00 C ATOM 1384 CE2 PHE A 88 0.627 -10.354 -11.993 1.00 0.00 C ATOM 1385 CZ PHE A 88 1.397 -9.437 -12.683 1.00 0.00 C ATOM 0 H PHE A 88 4.238 -9.041 -7.347 1.00 0.00 H new ATOM 0 HA PHE A 88 1.347 -9.385 -7.873 1.00 0.00 H new ATOM 0 HB2 PHE A 88 3.717 -10.997 -8.841 1.00 0.00 H new ATOM 0 HB3 PHE A 88 2.158 -11.764 -8.612 1.00 0.00 H new ATOM 0 HD1 PHE A 88 3.885 -9.036 -10.448 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.429 -11.514 -10.214 1.00 0.00 H new ATOM 0 HE1 PHE A 88 3.170 -8.244 -12.660 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -0.290 -10.725 -12.426 1.00 0.00 H new ATOM 0 HZ PHE A 88 1.084 -9.092 -13.657 1.00 0.00 H new ATOM 1395 N PHE A 89 1.106 -10.617 -5.751 1.00 0.00 N ATOM 1396 CA PHE A 89 0.934 -11.290 -4.469 1.00 0.00 C ATOM 1397 C PHE A 89 -0.125 -12.385 -4.568 1.00 0.00 C ATOM 1398 O PHE A 89 -1.234 -12.149 -5.048 1.00 0.00 O ATOM 1399 CB PHE A 89 0.542 -10.282 -3.388 1.00 0.00 C ATOM 1400 CG PHE A 89 1.437 -9.077 -3.338 1.00 0.00 C ATOM 1401 CD1 PHE A 89 2.736 -9.182 -2.866 1.00 0.00 C ATOM 1402 CD2 PHE A 89 0.981 -7.840 -3.764 1.00 0.00 C ATOM 1403 CE1 PHE A 89 3.562 -8.075 -2.819 1.00 0.00 C ATOM 1404 CE2 PHE A 89 1.803 -6.729 -3.720 1.00 0.00 C ATOM 1405 CZ PHE A 89 3.095 -6.847 -3.247 1.00 0.00 C ATOM 0 H PHE A 89 0.254 -10.199 -6.126 1.00 0.00 H new ATOM 0 HA PHE A 89 1.884 -11.751 -4.198 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.483 -9.956 -3.562 1.00 0.00 H new ATOM 0 HB3 PHE A 89 0.559 -10.778 -2.417 1.00 0.00 H new ATOM 0 HD1 PHE A 89 3.107 -10.140 -2.531 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.029 -7.742 -4.135 1.00 0.00 H new ATOM 0 HE1 PHE A 89 4.572 -8.170 -2.448 1.00 0.00 H new ATOM 0 HE2 PHE A 89 1.435 -5.770 -4.055 1.00 0.00 H new ATOM 0 HZ PHE A 89 3.739 -5.981 -3.212 1.00 0.00 H new ATOM 1415 N SER A 90 0.226 -13.582 -4.111 1.00 0.00 N ATOM 1416 CA SER A 90 -0.692 -14.715 -4.151 1.00 0.00 C ATOM 1417 C SER A 90 -1.209 -15.045 -2.754 1.00 0.00 C ATOM 1418 O SER A 90 -0.429 -15.243 -1.823 1.00 0.00 O ATOM 1419 CB SER A 90 0.001 -15.939 -4.754 1.00 0.00 C ATOM 1420 OG SER A 90 -0.757 -17.115 -4.532 1.00 0.00 O ATOM 0 H SER A 90 1.139 -13.793 -3.709 1.00 0.00 H new ATOM 0 HA SER A 90 -1.541 -14.442 -4.778 1.00 0.00 H new ATOM 0 HB2 SER A 90 0.142 -15.790 -5.825 1.00 0.00 H new ATOM 0 HB3 SER A 90 0.992 -16.053 -4.315 1.00 0.00 H new ATOM 0 HG SER A 90 -0.294 -17.882 -4.928 1.00 0.00 H new ATOM 1426 N ALA A 91 -2.529 -15.102 -2.618 1.00 0.00 N ATOM 1427 CA ALA A 91 -3.152 -15.411 -1.336 1.00 0.00 C ATOM 1428 C ALA A 91 -3.635 -16.856 -1.294 1.00 0.00 C ATOM 1429 O ALA A 91 -4.315 -17.320 -2.208 1.00 0.00 O ATOM 1430 CB ALA A 91 -4.308 -14.458 -1.068 1.00 0.00 C ATOM 0 H ALA A 91 -3.188 -14.938 -3.379 1.00 0.00 H new ATOM 0 HA ALA A 91 -2.402 -15.284 -0.556 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -4.764 -14.700 -0.108 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -3.937 -13.433 -1.046 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -5.052 -14.557 -1.858 1.00 0.00 H new ATOM 1436 N GLU A 92 -3.277 -17.564 -0.227 1.00 0.00 N ATOM 1437 CA GLU A 92 -3.674 -18.958 -0.067 1.00 0.00 C ATOM 1438 C GLU A 92 -5.185 -19.114 -0.210 1.00 0.00 C ATOM 1439 O GLU A 92 -5.665 -20.026 -0.882 1.00 0.00 O ATOM 1440 CB GLU A 92 -3.222 -19.488 1.295 1.00 0.00 C ATOM 1441 CG GLU A 92 -1.720 -19.403 1.513 1.00 0.00 C ATOM 1442 CD GLU A 92 -1.208 -20.469 2.463 1.00 0.00 C ATOM 1443 OE1 GLU A 92 -1.873 -21.517 2.593 1.00 0.00 O ATOM 1444 OE2 GLU A 92 -0.141 -20.253 3.075 1.00 0.00 O ATOM 0 H GLU A 92 -2.713 -17.195 0.539 1.00 0.00 H new ATOM 0 HA GLU A 92 -3.190 -19.538 -0.853 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -3.727 -18.926 2.080 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -3.537 -20.527 1.394 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -1.211 -19.501 0.554 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -1.469 -18.419 1.908 1.00 0.00 H new ATOM 1451 N SER A 93 -5.929 -18.216 0.428 1.00 0.00 N ATOM 1452 CA SER A 93 -7.386 -18.255 0.377 1.00 0.00 C ATOM 1453 C SER A 93 -7.935 -17.059 -0.396 1.00 0.00 C ATOM 1454 O SER A 93 -7.287 -16.021 -0.525 1.00 0.00 O ATOM 1455 CB SER A 93 -7.967 -18.273 1.792 1.00 0.00 C ATOM 1456 OG SER A 93 -7.968 -19.585 2.327 1.00 0.00 O ATOM 0 H SER A 93 -5.547 -17.453 0.986 1.00 0.00 H new ATOM 0 HA SER A 93 -7.682 -19.167 -0.141 1.00 0.00 H new ATOM 0 HB2 SER A 93 -7.384 -17.615 2.436 1.00 0.00 H new ATOM 0 HB3 SER A 93 -8.985 -17.883 1.775 1.00 0.00 H new ATOM 0 HG SER A 93 -8.343 -19.569 3.232 1.00 0.00 H new ATOM 1462 N PRO A 94 -9.159 -17.208 -0.923 1.00 0.00 N ATOM 1463 CA PRO A 94 -9.824 -16.151 -1.691 1.00 0.00 C ATOM 1464 C PRO A 94 -10.236 -14.971 -0.818 1.00 0.00 C ATOM 1465 O PRO A 94 -10.221 -13.824 -1.263 1.00 0.00 O ATOM 1466 CB PRO A 94 -11.059 -16.852 -2.262 1.00 0.00 C ATOM 1467 CG PRO A 94 -11.332 -17.970 -1.316 1.00 0.00 C ATOM 1468 CD PRO A 94 -9.989 -18.419 -0.809 1.00 0.00 C ATOM 0 HA PRO A 94 -9.169 -15.725 -2.451 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -11.907 -16.170 -2.325 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -10.873 -17.223 -3.270 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -11.969 -17.640 -0.495 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -11.853 -18.786 -1.816 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -10.046 -18.772 0.221 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -9.588 -19.239 -1.405 1.00 0.00 H new ATOM 1476 N GLU A 95 -10.603 -15.261 0.426 1.00 0.00 N ATOM 1477 CA GLU A 95 -11.019 -14.223 1.361 1.00 0.00 C ATOM 1478 C GLU A 95 -9.903 -13.205 1.577 1.00 0.00 C ATOM 1479 O GLU A 95 -10.155 -12.006 1.685 1.00 0.00 O ATOM 1480 CB GLU A 95 -11.425 -14.843 2.700 1.00 0.00 C ATOM 1481 CG GLU A 95 -10.316 -15.645 3.360 1.00 0.00 C ATOM 1482 CD GLU A 95 -10.779 -16.358 4.615 1.00 0.00 C ATOM 1483 OE1 GLU A 95 -10.910 -15.691 5.663 1.00 0.00 O ATOM 1484 OE2 GLU A 95 -11.011 -17.583 4.550 1.00 0.00 O ATOM 0 H GLU A 95 -10.621 -16.206 0.809 1.00 0.00 H new ATOM 0 HA GLU A 95 -11.879 -13.708 0.932 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -11.741 -14.050 3.377 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -12.287 -15.491 2.544 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -9.932 -16.378 2.651 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.490 -14.979 3.609 1.00 0.00 H new ATOM 1491 N GLU A 96 -8.668 -13.694 1.638 1.00 0.00 N ATOM 1492 CA GLU A 96 -7.513 -12.828 1.842 1.00 0.00 C ATOM 1493 C GLU A 96 -7.262 -11.958 0.614 1.00 0.00 C ATOM 1494 O GLU A 96 -7.242 -10.730 0.705 1.00 0.00 O ATOM 1495 CB GLU A 96 -6.269 -13.664 2.152 1.00 0.00 C ATOM 1496 CG GLU A 96 -6.066 -13.927 3.634 1.00 0.00 C ATOM 1497 CD GLU A 96 -5.276 -15.194 3.899 1.00 0.00 C ATOM 1498 OE1 GLU A 96 -5.579 -16.226 3.265 1.00 0.00 O ATOM 1499 OE2 GLU A 96 -4.353 -15.152 4.740 1.00 0.00 O ATOM 0 H GLU A 96 -8.442 -14.685 1.549 1.00 0.00 H new ATOM 0 HA GLU A 96 -7.724 -12.177 2.690 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -6.343 -14.618 1.629 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -5.391 -13.152 1.759 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -5.547 -13.079 4.082 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -7.038 -14.000 4.123 1.00 0.00 H new ATOM 1506 N GLN A 97 -7.070 -12.603 -0.532 1.00 0.00 N ATOM 1507 CA GLN A 97 -6.818 -11.888 -1.777 1.00 0.00 C ATOM 1508 C GLN A 97 -7.618 -10.590 -1.831 1.00 0.00 C ATOM 1509 O GLN A 97 -7.049 -9.500 -1.854 1.00 0.00 O ATOM 1510 CB GLN A 97 -7.172 -12.769 -2.976 1.00 0.00 C ATOM 1511 CG GLN A 97 -7.138 -12.032 -4.305 1.00 0.00 C ATOM 1512 CD GLN A 97 -8.101 -12.614 -5.321 1.00 0.00 C ATOM 1513 OE1 GLN A 97 -9.105 -13.229 -4.960 1.00 0.00 O ATOM 1514 NE2 GLN A 97 -7.801 -12.422 -6.600 1.00 0.00 N ATOM 0 H GLN A 97 -7.084 -13.619 -0.624 1.00 0.00 H new ATOM 0 HA GLN A 97 -5.757 -11.641 -1.817 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -6.477 -13.608 -3.018 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -8.168 -13.187 -2.827 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -7.381 -10.982 -4.140 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -6.126 -12.066 -4.709 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -6.959 -11.906 -6.854 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -8.413 -12.790 -7.328 1.00 0.00 H new ATOM 1523 N GLU A 98 -8.941 -10.717 -1.852 1.00 0.00 N ATOM 1524 CA GLU A 98 -9.819 -9.554 -1.905 1.00 0.00 C ATOM 1525 C GLU A 98 -9.497 -8.578 -0.777 1.00 0.00 C ATOM 1526 O GLU A 98 -9.143 -7.425 -1.021 1.00 0.00 O ATOM 1527 CB GLU A 98 -11.284 -9.987 -1.816 1.00 0.00 C ATOM 1528 CG GLU A 98 -11.766 -10.753 -3.037 1.00 0.00 C ATOM 1529 CD GLU A 98 -12.283 -9.840 -4.132 1.00 0.00 C ATOM 1530 OE1 GLU A 98 -11.494 -9.016 -4.640 1.00 0.00 O ATOM 1531 OE2 GLU A 98 -13.477 -9.950 -4.480 1.00 0.00 O ATOM 0 H GLU A 98 -9.428 -11.613 -1.833 1.00 0.00 H new ATOM 0 HA GLU A 98 -9.654 -9.050 -2.857 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -11.417 -10.609 -0.931 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -11.908 -9.103 -1.682 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -10.947 -11.357 -3.429 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -12.557 -11.442 -2.740 1.00 0.00 H new ATOM 1538 N ALA A 99 -9.623 -9.049 0.459 1.00 0.00 N ATOM 1539 CA ALA A 99 -9.345 -8.220 1.625 1.00 0.00 C ATOM 1540 C ALA A 99 -8.128 -7.332 1.389 1.00 0.00 C ATOM 1541 O ALA A 99 -8.197 -6.113 1.550 1.00 0.00 O ATOM 1542 CB ALA A 99 -9.134 -9.092 2.855 1.00 0.00 C ATOM 0 H ALA A 99 -9.916 -10.001 0.679 1.00 0.00 H new ATOM 0 HA ALA A 99 -10.206 -7.574 1.795 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -8.927 -8.459 3.718 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -10.032 -9.680 3.043 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -8.291 -9.762 2.686 1.00 0.00 H new ATOM 1548 N TRP A 100 -7.016 -7.950 1.008 1.00 0.00 N ATOM 1549 CA TRP A 100 -5.783 -7.214 0.751 1.00 0.00 C ATOM 1550 C TRP A 100 -6.000 -6.144 -0.313 1.00 0.00 C ATOM 1551 O TRP A 100 -5.803 -4.955 -0.059 1.00 0.00 O ATOM 1552 CB TRP A 100 -4.676 -8.173 0.309 1.00 0.00 C ATOM 1553 CG TRP A 100 -3.957 -8.819 1.455 1.00 0.00 C ATOM 1554 CD1 TRP A 100 -4.139 -10.088 1.925 1.00 0.00 C ATOM 1555 CD2 TRP A 100 -2.945 -8.225 2.275 1.00 0.00 C ATOM 1556 NE1 TRP A 100 -3.300 -10.319 2.989 1.00 0.00 N ATOM 1557 CE2 TRP A 100 -2.557 -9.193 3.223 1.00 0.00 C ATOM 1558 CE3 TRP A 100 -2.327 -6.972 2.301 1.00 0.00 C ATOM 1559 CZ2 TRP A 100 -1.581 -8.943 4.184 1.00 0.00 C ATOM 1560 CZ3 TRP A 100 -1.359 -6.726 3.255 1.00 0.00 C ATOM 1561 CH2 TRP A 100 -0.992 -7.708 4.186 1.00 0.00 C ATOM 0 H TRP A 100 -6.942 -8.958 0.870 1.00 0.00 H new ATOM 0 HA TRP A 100 -5.482 -6.724 1.677 1.00 0.00 H new ATOM 0 HB2 TRP A 100 -5.108 -8.949 -0.323 1.00 0.00 H new ATOM 0 HB3 TRP A 100 -3.956 -7.629 -0.302 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -4.839 -10.804 1.521 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -3.241 -11.189 3.519 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -2.602 -6.209 1.587 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -1.299 -9.698 4.903 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -0.876 -5.760 3.284 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -0.230 -7.485 4.918 1.00 0.00 H new ATOM 1572 N ILE A 101 -6.405 -6.572 -1.503 1.00 0.00 N ATOM 1573 CA ILE A 101 -6.650 -5.649 -2.605 1.00 0.00 C ATOM 1574 C ILE A 101 -7.247 -4.339 -2.101 1.00 0.00 C ATOM 1575 O ILE A 101 -6.996 -3.275 -2.666 1.00 0.00 O ATOM 1576 CB ILE A 101 -7.596 -6.262 -3.654 1.00 0.00 C ATOM 1577 CG1 ILE A 101 -6.922 -7.446 -4.350 1.00 0.00 C ATOM 1578 CG2 ILE A 101 -8.012 -5.209 -4.670 1.00 0.00 C ATOM 1579 CD1 ILE A 101 -7.863 -8.251 -5.219 1.00 0.00 C ATOM 0 H ILE A 101 -6.571 -7.553 -1.730 1.00 0.00 H new ATOM 0 HA ILE A 101 -5.685 -5.451 -3.071 1.00 0.00 H new ATOM 0 HB ILE A 101 -8.491 -6.624 -3.148 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -6.100 -7.077 -4.963 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -6.487 -8.101 -3.595 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -8.681 -5.657 -5.405 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -8.527 -4.395 -4.160 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -7.127 -4.820 -5.174 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -7.317 -9.074 -5.681 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -8.672 -8.650 -4.607 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -8.279 -7.610 -5.996 1.00 0.00 H new ATOM 1591 N GLN A 102 -8.037 -4.426 -1.036 1.00 0.00 N ATOM 1592 CA GLN A 102 -8.669 -3.247 -0.456 1.00 0.00 C ATOM 1593 C GLN A 102 -7.789 -2.636 0.629 1.00 0.00 C ATOM 1594 O GLN A 102 -7.360 -1.487 0.520 1.00 0.00 O ATOM 1595 CB GLN A 102 -10.037 -3.609 0.124 1.00 0.00 C ATOM 1596 CG GLN A 102 -11.047 -4.045 -0.925 1.00 0.00 C ATOM 1597 CD GLN A 102 -11.855 -2.886 -1.475 1.00 0.00 C ATOM 1598 OE1 GLN A 102 -11.859 -2.634 -2.680 1.00 0.00 O ATOM 1599 NE2 GLN A 102 -12.544 -2.172 -0.592 1.00 0.00 N ATOM 0 H GLN A 102 -8.255 -5.300 -0.557 1.00 0.00 H new ATOM 0 HA GLN A 102 -8.802 -2.510 -1.248 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -9.913 -4.411 0.852 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -10.433 -2.748 0.662 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -10.524 -4.539 -1.744 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -11.724 -4.780 -0.489 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -12.512 -2.416 0.398 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -13.105 -1.379 -0.904 1.00 0.00 H new ATOM 1608 N ALA A 103 -7.524 -3.411 1.676 1.00 0.00 N ATOM 1609 CA ALA A 103 -6.694 -2.946 2.780 1.00 0.00 C ATOM 1610 C ALA A 103 -5.547 -2.076 2.276 1.00 0.00 C ATOM 1611 O ALA A 103 -5.359 -0.952 2.740 1.00 0.00 O ATOM 1612 CB ALA A 103 -6.154 -4.130 3.569 1.00 0.00 C ATOM 0 H ALA A 103 -7.872 -4.364 1.782 1.00 0.00 H new ATOM 0 HA ALA A 103 -7.315 -2.338 3.438 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -5.536 -3.768 4.391 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -6.985 -4.710 3.969 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -5.553 -4.761 2.913 1.00 0.00 H new ATOM 1618 N MET A 104 -4.783 -2.604 1.326 1.00 0.00 N ATOM 1619 CA MET A 104 -3.655 -1.874 0.759 1.00 0.00 C ATOM 1620 C MET A 104 -4.112 -0.957 -0.370 1.00 0.00 C ATOM 1621 O MET A 104 -3.602 0.151 -0.528 1.00 0.00 O ATOM 1622 CB MET A 104 -2.596 -2.850 0.242 1.00 0.00 C ATOM 1623 CG MET A 104 -3.021 -3.601 -1.009 1.00 0.00 C ATOM 1624 SD MET A 104 -1.645 -4.440 -1.817 1.00 0.00 S ATOM 1625 CE MET A 104 -1.285 -5.726 -0.624 1.00 0.00 C ATOM 0 H MET A 104 -4.924 -3.534 0.932 1.00 0.00 H new ATOM 0 HA MET A 104 -3.219 -1.260 1.547 1.00 0.00 H new ATOM 0 HB2 MET A 104 -1.679 -2.300 0.032 1.00 0.00 H new ATOM 0 HB3 MET A 104 -2.363 -3.570 1.027 1.00 0.00 H new ATOM 0 HG2 MET A 104 -3.784 -4.333 -0.747 1.00 0.00 H new ATOM 0 HG3 MET A 104 -3.477 -2.902 -1.710 1.00 0.00 H new ATOM 0 HE1 MET A 104 -0.442 -6.321 -0.974 1.00 0.00 H new ATOM 0 HE2 MET A 104 -1.036 -5.273 0.336 1.00 0.00 H new ATOM 0 HE3 MET A 104 -2.158 -6.368 -0.506 1.00 0.00 H new ATOM 1635 N GLY A 105 -5.078 -1.427 -1.154 1.00 0.00 N ATOM 1636 CA GLY A 105 -5.588 -0.637 -2.259 1.00 0.00 C ATOM 1637 C GLY A 105 -5.988 0.763 -1.835 1.00 0.00 C ATOM 1638 O GLY A 105 -5.504 1.748 -2.391 1.00 0.00 O ATOM 0 H GLY A 105 -5.516 -2.341 -1.043 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -4.828 -0.574 -3.038 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -6.450 -1.142 -2.695 1.00 0.00 H new ATOM 1642 N GLU A 106 -6.875 0.849 -0.849 1.00 0.00 N ATOM 1643 CA GLU A 106 -7.341 2.139 -0.353 1.00 0.00 C ATOM 1644 C GLU A 106 -6.172 3.099 -0.149 1.00 0.00 C ATOM 1645 O GLU A 106 -6.232 4.261 -0.550 1.00 0.00 O ATOM 1646 CB GLU A 106 -8.103 1.960 0.962 1.00 0.00 C ATOM 1647 CG GLU A 106 -7.210 1.984 2.191 1.00 0.00 C ATOM 1648 CD GLU A 106 -7.994 1.869 3.484 1.00 0.00 C ATOM 1649 OE1 GLU A 106 -8.634 0.820 3.699 1.00 0.00 O ATOM 1650 OE2 GLU A 106 -7.966 2.831 4.281 1.00 0.00 O ATOM 0 H GLU A 106 -7.285 0.042 -0.378 1.00 0.00 H new ATOM 0 HA GLU A 106 -8.012 2.565 -1.099 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -8.849 2.750 1.050 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -8.642 1.013 0.934 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -6.493 1.165 2.131 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -6.635 2.910 2.200 1.00 0.00 H new ATOM 1657 N ALA A 107 -5.110 2.603 0.477 1.00 0.00 N ATOM 1658 CA ALA A 107 -3.926 3.415 0.733 1.00 0.00 C ATOM 1659 C ALA A 107 -3.415 4.061 -0.550 1.00 0.00 C ATOM 1660 O ALA A 107 -2.852 5.155 -0.524 1.00 0.00 O ATOM 1661 CB ALA A 107 -2.835 2.570 1.372 1.00 0.00 C ATOM 0 H ALA A 107 -5.045 1.643 0.816 1.00 0.00 H new ATOM 0 HA ALA A 107 -4.204 4.211 1.423 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -1.957 3.189 1.558 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -3.197 2.161 2.316 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -2.568 1.753 0.702 1.00 0.00 H new ATOM 1667 N ALA A 108 -3.615 3.376 -1.672 1.00 0.00 N ATOM 1668 CA ALA A 108 -3.176 3.884 -2.965 1.00 0.00 C ATOM 1669 C ALA A 108 -4.280 4.685 -3.645 1.00 0.00 C ATOM 1670 O ALA A 108 -4.011 5.663 -4.343 1.00 0.00 O ATOM 1671 CB ALA A 108 -2.728 2.736 -3.858 1.00 0.00 C ATOM 0 H ALA A 108 -4.078 2.468 -1.711 1.00 0.00 H new ATOM 0 HA ALA A 108 -2.331 4.551 -2.797 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -2.403 3.130 -4.821 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -1.901 2.208 -3.384 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -3.559 2.047 -4.010 1.00 0.00 H new ATOM 1677 N ARG A 109 -5.524 4.265 -3.436 1.00 0.00 N ATOM 1678 CA ARG A 109 -6.670 4.944 -4.030 1.00 0.00 C ATOM 1679 C ARG A 109 -6.672 6.426 -3.668 1.00 0.00 C ATOM 1680 O ARG A 109 -6.322 6.803 -2.550 1.00 0.00 O ATOM 1681 CB ARG A 109 -7.973 4.292 -3.565 1.00 0.00 C ATOM 1682 CG ARG A 109 -8.451 3.170 -4.472 1.00 0.00 C ATOM 1683 CD ARG A 109 -7.938 1.817 -4.004 1.00 0.00 C ATOM 1684 NE ARG A 109 -8.695 0.713 -4.587 1.00 0.00 N ATOM 1685 CZ ARG A 109 -8.484 0.244 -5.812 1.00 0.00 C ATOM 1686 NH1 ARG A 109 -7.544 0.779 -6.578 1.00 0.00 N ATOM 1687 NH2 ARG A 109 -9.214 -0.764 -6.272 1.00 0.00 N ATOM 0 H ARG A 109 -5.764 3.458 -2.860 1.00 0.00 H new ATOM 0 HA ARG A 109 -6.593 4.853 -5.113 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -7.833 3.899 -2.558 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -8.749 5.055 -3.505 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -9.541 3.159 -4.495 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -8.113 3.356 -5.491 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -6.886 1.716 -4.271 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -7.997 1.763 -2.917 1.00 0.00 H new ATOM 0 HE ARG A 109 -9.425 0.278 -4.023 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -6.980 1.553 -6.227 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -7.385 0.416 -7.518 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -9.938 -1.179 -5.685 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -9.052 -1.124 -7.213 1.00 0.00 H new ATOM 1701 N VAL A 110 -7.068 7.262 -4.622 1.00 0.00 N ATOM 1702 CA VAL A 110 -7.117 8.703 -4.404 1.00 0.00 C ATOM 1703 C VAL A 110 -6.022 9.150 -3.442 1.00 0.00 C ATOM 1704 O VAL A 110 -6.297 9.790 -2.427 1.00 0.00 O ATOM 1705 CB VAL A 110 -8.484 9.140 -3.846 1.00 0.00 C ATOM 1706 CG1 VAL A 110 -8.461 10.614 -3.468 1.00 0.00 C ATOM 1707 CG2 VAL A 110 -9.586 8.858 -4.856 1.00 0.00 C ATOM 0 H VAL A 110 -7.360 6.966 -5.554 1.00 0.00 H new ATOM 0 HA VAL A 110 -6.961 9.176 -5.374 1.00 0.00 H new ATOM 0 HB VAL A 110 -8.691 8.562 -2.945 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -9.436 10.904 -3.076 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -7.699 10.783 -2.707 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -8.232 11.212 -4.350 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -10.545 9.173 -4.445 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -9.387 9.409 -5.775 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.617 7.790 -5.072 1.00 0.00 H new ATOM 1717 N GLN A 111 -4.779 8.810 -3.770 1.00 0.00 N ATOM 1718 CA GLN A 111 -3.642 9.177 -2.934 1.00 0.00 C ATOM 1719 C GLN A 111 -3.713 10.646 -2.532 1.00 0.00 C ATOM 1720 O GLN A 111 -4.216 11.482 -3.284 1.00 0.00 O ATOM 1721 CB GLN A 111 -2.330 8.901 -3.672 1.00 0.00 C ATOM 1722 CG GLN A 111 -1.150 8.662 -2.745 1.00 0.00 C ATOM 1723 CD GLN A 111 -0.422 9.943 -2.386 1.00 0.00 C ATOM 1724 OE1 GLN A 111 -0.250 10.264 -1.210 1.00 0.00 O ATOM 1725 NE2 GLN A 111 0.012 10.682 -3.400 1.00 0.00 N ATOM 0 H GLN A 111 -4.534 8.282 -4.608 1.00 0.00 H new ATOM 0 HA GLN A 111 -3.677 8.570 -2.029 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -2.460 8.029 -4.313 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -2.105 9.745 -4.323 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -1.501 8.180 -1.833 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -0.452 7.973 -3.221 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -0.152 10.378 -4.360 1.00 0.00 H new ATOM 0 HE22 GLN A 111 0.510 11.554 -3.219 1.00 0.00 H new ATOM 1734 N SER A 112 -3.207 10.954 -1.343 1.00 0.00 N ATOM 1735 CA SER A 112 -3.217 12.323 -0.839 1.00 0.00 C ATOM 1736 C SER A 112 -4.563 12.990 -1.106 1.00 0.00 C ATOM 1737 O SER A 112 -4.626 14.081 -1.671 1.00 0.00 O ATOM 1738 CB SER A 112 -2.095 13.136 -1.486 1.00 0.00 C ATOM 1739 OG SER A 112 -2.458 13.560 -2.788 1.00 0.00 O ATOM 0 H SER A 112 -2.785 10.275 -0.710 1.00 0.00 H new ATOM 0 HA SER A 112 -3.055 12.288 0.238 1.00 0.00 H new ATOM 0 HB2 SER A 112 -1.868 14.004 -0.868 1.00 0.00 H new ATOM 0 HB3 SER A 112 -1.188 12.534 -1.536 1.00 0.00 H new ATOM 0 HG SER A 112 -3.197 14.201 -2.729 1.00 0.00 H new ATOM 1745 N GLY A 113 -5.638 12.325 -0.694 1.00 0.00 N ATOM 1746 CA GLY A 113 -6.969 12.868 -0.898 1.00 0.00 C ATOM 1747 C GLY A 113 -7.992 12.262 0.042 1.00 0.00 C ATOM 1748 O GLY A 113 -7.650 11.636 1.046 1.00 0.00 O ATOM 0 H GLY A 113 -5.611 11.421 -0.223 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -6.943 13.948 -0.755 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -7.277 12.690 -1.928 1.00 0.00 H new ATOM 1752 N PRO A 114 -9.281 12.448 -0.280 1.00 0.00 N ATOM 1753 CA PRO A 114 -10.383 11.924 0.532 1.00 0.00 C ATOM 1754 C PRO A 114 -10.483 10.404 0.461 1.00 0.00 C ATOM 1755 O PRO A 114 -11.165 9.857 -0.407 1.00 0.00 O ATOM 1756 CB PRO A 114 -11.622 12.571 -0.092 1.00 0.00 C ATOM 1757 CG PRO A 114 -11.229 12.862 -1.500 1.00 0.00 C ATOM 1758 CD PRO A 114 -9.761 13.184 -1.461 1.00 0.00 C ATOM 0 HA PRO A 114 -10.254 12.151 1.590 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -12.481 11.902 -0.051 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -11.902 13.482 0.437 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -11.424 12.005 -2.145 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -11.802 13.699 -1.900 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -9.254 12.860 -2.370 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -9.587 14.256 -1.364 1.00 0.00 H new ATOM 1766 N SER A 115 -9.801 9.727 1.379 1.00 0.00 N ATOM 1767 CA SER A 115 -9.811 8.269 1.418 1.00 0.00 C ATOM 1768 C SER A 115 -10.974 7.756 2.261 1.00 0.00 C ATOM 1769 O SER A 115 -10.806 7.431 3.436 1.00 0.00 O ATOM 1770 CB SER A 115 -8.488 7.744 1.979 1.00 0.00 C ATOM 1771 OG SER A 115 -8.242 8.263 3.275 1.00 0.00 O ATOM 0 H SER A 115 -9.235 10.164 2.106 1.00 0.00 H new ATOM 0 HA SER A 115 -9.936 7.903 0.399 1.00 0.00 H new ATOM 0 HB2 SER A 115 -8.513 6.655 2.019 1.00 0.00 H new ATOM 0 HB3 SER A 115 -7.671 8.020 1.312 1.00 0.00 H new ATOM 0 HG SER A 115 -9.058 8.199 3.813 1.00 0.00 H new ATOM 1777 N SER A 116 -12.153 7.687 1.652 1.00 0.00 N ATOM 1778 CA SER A 116 -13.346 7.218 2.347 1.00 0.00 C ATOM 1779 C SER A 116 -13.723 8.166 3.481 1.00 0.00 C ATOM 1780 O SER A 116 -14.102 7.732 4.568 1.00 0.00 O ATOM 1781 CB SER A 116 -13.119 5.809 2.899 1.00 0.00 C ATOM 1782 OG SER A 116 -14.351 5.161 3.166 1.00 0.00 O ATOM 0 H SER A 116 -12.308 7.950 0.679 1.00 0.00 H new ATOM 0 HA SER A 116 -14.167 7.193 1.631 1.00 0.00 H new ATOM 0 HB2 SER A 116 -12.544 5.223 2.182 1.00 0.00 H new ATOM 0 HB3 SER A 116 -12.528 5.864 3.813 1.00 0.00 H new ATOM 0 HG SER A 116 -14.877 5.703 3.791 1.00 0.00 H new ATOM 1788 N GLY A 117 -13.615 9.465 3.219 1.00 0.00 N ATOM 1789 CA GLY A 117 -13.947 10.456 4.226 1.00 0.00 C ATOM 1790 C GLY A 117 -14.423 11.761 3.620 1.00 0.00 C ATOM 1791 O GLY A 117 -15.356 11.777 2.818 1.00 0.00 O ATOM 0 H GLY A 117 -13.303 9.849 2.327 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -14.723 10.059 4.881 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -13.072 10.645 4.847 1.00 0.00 H new TER 1795 GLY A 117