USER MOD reduce.3.24.130724 H: found=0, std=0, add=790, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 788 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+ -125:sc= 0.0598 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 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 55:sc= 0.985 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00464) USER MOD Single : A 16 ASN : amide:sc= -1.21 K(o=-1.2,f=-2.4!) USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 SER OG : rot 180:sc= 0.00889 USER MOD Single : A 25 TYR OH : rot 180:sc= -0.121 USER MOD Single : A 32 THR OG1 : rot -148:sc= -1.18! USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=-0.0028) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= 0.00642 X(o=0.0064,f=0) USER MOD Single : A 40 ASN : amide:sc= -0.0791 X(o=-0.079,f=-0.24) USER MOD Single : A 42 ASN : amide:sc= -0.302 X(o=-0.3,f=-0.014) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot -68:sc= 0.99 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl 163:sc= -1.11 (180deg=-1.61) USER MOD Single : A 63 GLN : amide:sc= -0.154 K(o=-0.15,f=-1.4) USER MOD Single : A 64 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.351) USER MOD Single : A 65 GLN : amide:sc= -0.707 K(o=-0.71,f=-2!) USER MOD Single : A 67 TYR OH : rot 165:sc= -0.157 USER MOD Single : A 68 LYS NZ :NH3+ -148:sc=-0.00135 (180deg=-0.337) USER MOD Single : A 69 LYS NZ :NH3+ 147:sc= 0.0563 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 77:sc= 0.796 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0457) USER MOD Single : A 78 TYR OH : rot 14:sc= 0.285 USER MOD Single : A 80 LYS NZ :NH3+ -175:sc= 0.719 (180deg=0.703) USER MOD Single : A 81 GLN : amide:sc= -0.124 X(o=-0.12,f=0) USER MOD Single : A 85 TYR OH : rot 180:sc= -0.526 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 24:sc= 0.496 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.196 15.480 18.476 1.00 0.00 N ATOM 2 CA GLY A 1 -2.442 15.653 19.704 1.00 0.00 C ATOM 3 C GLY A 1 -1.343 16.689 19.568 1.00 0.00 C ATOM 4 O GLY A 1 -1.358 17.501 18.643 1.00 0.00 O ATOM 0 H1 GLY A 1 -4.208 15.624 18.667 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.875 16.173 17.771 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.046 14.518 18.109 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -3.120 15.950 20.504 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -2.003 14.699 19.995 1.00 0.00 H new ATOM 8 N SER A 2 -0.389 16.661 20.492 1.00 0.00 N ATOM 9 CA SER A 2 0.720 17.608 20.474 1.00 0.00 C ATOM 10 C SER A 2 2.025 16.910 20.102 1.00 0.00 C ATOM 11 O SER A 2 2.134 15.687 20.188 1.00 0.00 O ATOM 12 CB SER A 2 0.862 18.285 21.839 1.00 0.00 C ATOM 13 OG SER A 2 0.104 19.480 21.897 1.00 0.00 O ATOM 0 H SER A 2 -0.361 15.993 21.263 1.00 0.00 H new ATOM 0 HA SER A 2 0.506 18.366 19.720 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.532 17.603 22.623 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.912 18.507 22.031 1.00 0.00 H new ATOM 0 HG SER A 2 0.210 19.892 22.780 1.00 0.00 H new ATOM 19 N SER A 3 3.012 17.697 19.687 1.00 0.00 N ATOM 20 CA SER A 3 4.309 17.156 19.297 1.00 0.00 C ATOM 21 C SER A 3 4.149 16.084 18.223 1.00 0.00 C ATOM 22 O SER A 3 4.163 14.889 18.516 1.00 0.00 O ATOM 23 CB SER A 3 5.028 16.571 20.514 1.00 0.00 C ATOM 24 OG SER A 3 5.097 17.516 21.568 1.00 0.00 O ATOM 0 H SER A 3 2.939 18.712 19.612 1.00 0.00 H new ATOM 0 HA SER A 3 4.907 17.970 18.887 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.504 15.678 20.855 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.034 16.262 20.232 1.00 0.00 H new ATOM 0 HG SER A 3 5.559 17.118 22.335 1.00 0.00 H new ATOM 30 N GLY A 4 3.997 16.522 16.977 1.00 0.00 N ATOM 31 CA GLY A 4 3.837 15.588 15.877 1.00 0.00 C ATOM 32 C GLY A 4 5.089 15.470 15.030 1.00 0.00 C ATOM 33 O GLY A 4 6.075 14.864 15.448 1.00 0.00 O ATOM 0 H GLY A 4 3.982 17.506 16.709 1.00 0.00 H new ATOM 0 HA2 GLY A 4 3.576 14.607 16.273 1.00 0.00 H new ATOM 0 HA3 GLY A 4 3.006 15.910 15.249 1.00 0.00 H new ATOM 37 N SER A 5 5.049 16.049 13.834 1.00 0.00 N ATOM 38 CA SER A 5 6.187 16.001 12.923 1.00 0.00 C ATOM 39 C SER A 5 6.617 14.560 12.666 1.00 0.00 C ATOM 40 O SER A 5 6.163 13.636 13.341 1.00 0.00 O ATOM 41 CB SER A 5 7.359 16.801 13.495 1.00 0.00 C ATOM 42 OG SER A 5 8.288 17.141 12.481 1.00 0.00 O ATOM 0 H SER A 5 4.241 16.557 13.473 1.00 0.00 H new ATOM 0 HA SER A 5 5.881 16.445 11.975 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.986 17.708 13.970 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.858 16.218 14.269 1.00 0.00 H new ATOM 0 HG SER A 5 9.026 17.653 12.872 1.00 0.00 H new ATOM 48 N SER A 6 7.494 14.377 11.685 1.00 0.00 N ATOM 49 CA SER A 6 7.984 13.049 11.335 1.00 0.00 C ATOM 50 C SER A 6 9.000 13.126 10.200 1.00 0.00 C ATOM 51 O SER A 6 10.121 12.634 10.320 1.00 0.00 O ATOM 52 CB SER A 6 6.818 12.143 10.931 1.00 0.00 C ATOM 53 OG SER A 6 6.420 11.314 12.009 1.00 0.00 O ATOM 0 H SER A 6 7.880 15.132 11.118 1.00 0.00 H new ATOM 0 HA SER A 6 8.476 12.627 12.211 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.975 12.753 10.606 1.00 0.00 H new ATOM 0 HB3 SER A 6 7.110 11.525 10.082 1.00 0.00 H new ATOM 0 HG SER A 6 6.215 11.869 12.790 1.00 0.00 H new ATOM 59 N GLY A 7 8.598 13.749 9.095 1.00 0.00 N ATOM 60 CA GLY A 7 9.484 13.879 7.954 1.00 0.00 C ATOM 61 C GLY A 7 10.746 14.651 8.284 1.00 0.00 C ATOM 62 O GLY A 7 10.764 15.456 9.216 1.00 0.00 O ATOM 0 H GLY A 7 7.675 14.165 8.971 1.00 0.00 H new ATOM 0 HA2 GLY A 7 9.753 12.887 7.592 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.956 14.381 7.143 1.00 0.00 H new ATOM 66 N LYS A 8 11.805 14.405 7.521 1.00 0.00 N ATOM 67 CA LYS A 8 13.078 15.083 7.737 1.00 0.00 C ATOM 68 C LYS A 8 13.695 14.671 9.070 1.00 0.00 C ATOM 69 O LYS A 8 13.357 15.220 10.119 1.00 0.00 O ATOM 70 CB LYS A 8 12.885 16.600 7.700 1.00 0.00 C ATOM 71 CG LYS A 8 14.107 17.357 7.210 1.00 0.00 C ATOM 72 CD LYS A 8 14.425 18.543 8.106 1.00 0.00 C ATOM 73 CE LYS A 8 15.925 18.757 8.237 1.00 0.00 C ATOM 74 NZ LYS A 8 16.483 19.501 7.074 1.00 0.00 N ATOM 0 H LYS A 8 11.807 13.741 6.747 1.00 0.00 H new ATOM 0 HA LYS A 8 13.757 14.790 6.936 1.00 0.00 H new ATOM 0 HB2 LYS A 8 12.039 16.835 7.053 1.00 0.00 H new ATOM 0 HB3 LYS A 8 12.628 16.950 8.700 1.00 0.00 H new ATOM 0 HG2 LYS A 8 14.964 16.684 7.178 1.00 0.00 H new ATOM 0 HG3 LYS A 8 13.936 17.705 6.191 1.00 0.00 H new ATOM 0 HD2 LYS A 8 13.962 19.442 7.699 1.00 0.00 H new ATOM 0 HD3 LYS A 8 13.992 18.381 9.093 1.00 0.00 H new ATOM 0 HE2 LYS A 8 16.135 19.307 9.154 1.00 0.00 H new ATOM 0 HE3 LYS A 8 16.423 17.791 8.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 17.508 19.626 7.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 16.306 18.964 6.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 16.026 20.433 7.006 1.00 0.00 H new ATOM 88 N LYS A 9 14.601 13.701 9.023 1.00 0.00 N ATOM 89 CA LYS A 9 15.268 13.216 10.226 1.00 0.00 C ATOM 90 C LYS A 9 14.279 12.511 11.149 1.00 0.00 C ATOM 91 O LYS A 9 13.077 12.482 10.883 1.00 0.00 O ATOM 92 CB LYS A 9 15.934 14.377 10.967 1.00 0.00 C ATOM 93 CG LYS A 9 17.363 14.086 11.394 1.00 0.00 C ATOM 94 CD LYS A 9 18.009 15.300 12.041 1.00 0.00 C ATOM 95 CE LYS A 9 17.702 15.368 13.529 1.00 0.00 C ATOM 96 NZ LYS A 9 18.934 15.246 14.356 1.00 0.00 N ATOM 0 H LYS A 9 14.891 13.234 8.164 1.00 0.00 H new ATOM 0 HA LYS A 9 16.032 12.499 9.925 1.00 0.00 H new ATOM 0 HB2 LYS A 9 15.928 15.258 10.325 1.00 0.00 H new ATOM 0 HB3 LYS A 9 15.342 14.621 11.849 1.00 0.00 H new ATOM 0 HG2 LYS A 9 17.372 13.251 12.095 1.00 0.00 H new ATOM 0 HG3 LYS A 9 17.948 13.780 10.527 1.00 0.00 H new ATOM 0 HD2 LYS A 9 19.088 15.262 11.892 1.00 0.00 H new ATOM 0 HD3 LYS A 9 17.652 16.207 11.553 1.00 0.00 H new ATOM 0 HE2 LYS A 9 17.205 16.312 13.754 1.00 0.00 H new ATOM 0 HE3 LYS A 9 17.007 14.571 13.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 18.682 15.297 15.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 19.395 14.334 14.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 19.587 16.021 14.123 1.00 0.00 H new ATOM 110 N LYS A 10 14.792 11.943 12.235 1.00 0.00 N ATOM 111 CA LYS A 10 13.955 11.240 13.200 1.00 0.00 C ATOM 112 C LYS A 10 13.367 9.973 12.588 1.00 0.00 C ATOM 113 O LYS A 10 12.572 10.035 11.649 1.00 0.00 O ATOM 114 CB LYS A 10 12.829 12.153 13.690 1.00 0.00 C ATOM 115 CG LYS A 10 12.817 12.350 15.195 1.00 0.00 C ATOM 116 CD LYS A 10 11.528 11.838 15.815 1.00 0.00 C ATOM 117 CE LYS A 10 11.510 12.052 17.321 1.00 0.00 C ATOM 118 NZ LYS A 10 10.928 10.884 18.040 1.00 0.00 N ATOM 0 H LYS A 10 15.785 11.956 12.469 1.00 0.00 H new ATOM 0 HA LYS A 10 14.579 10.957 14.047 1.00 0.00 H new ATOM 0 HB2 LYS A 10 12.924 13.125 13.206 1.00 0.00 H new ATOM 0 HB3 LYS A 10 11.872 11.734 13.379 1.00 0.00 H new ATOM 0 HG2 LYS A 10 13.666 11.829 15.638 1.00 0.00 H new ATOM 0 HG3 LYS A 10 12.937 13.409 15.425 1.00 0.00 H new ATOM 0 HD2 LYS A 10 10.678 12.349 15.364 1.00 0.00 H new ATOM 0 HD3 LYS A 10 11.414 10.776 15.596 1.00 0.00 H new ATOM 0 HE2 LYS A 10 12.526 12.227 17.675 1.00 0.00 H new ATOM 0 HE3 LYS A 10 10.932 12.947 17.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 10.933 11.069 19.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 9.950 10.732 17.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 11.494 10.035 17.838 1.00 0.00 H new ATOM 132 N LYS A 11 13.761 8.824 13.125 1.00 0.00 N ATOM 133 CA LYS A 11 13.271 7.541 12.635 1.00 0.00 C ATOM 134 C LYS A 11 13.530 7.396 11.138 1.00 0.00 C ATOM 135 O LYS A 11 12.647 7.649 10.318 1.00 0.00 O ATOM 136 CB LYS A 11 11.774 7.400 12.920 1.00 0.00 C ATOM 137 CG LYS A 11 11.233 6.007 12.653 1.00 0.00 C ATOM 138 CD LYS A 11 10.106 5.654 13.610 1.00 0.00 C ATOM 139 CE LYS A 11 8.768 6.179 13.112 1.00 0.00 C ATOM 140 NZ LYS A 11 7.735 6.171 14.185 1.00 0.00 N ATOM 0 H LYS A 11 14.419 8.755 13.901 1.00 0.00 H new ATOM 0 HA LYS A 11 13.810 6.751 13.158 1.00 0.00 H new ATOM 0 HB2 LYS A 11 11.585 7.661 13.961 1.00 0.00 H new ATOM 0 HB3 LYS A 11 11.227 8.117 12.307 1.00 0.00 H new ATOM 0 HG2 LYS A 11 10.872 5.946 11.626 1.00 0.00 H new ATOM 0 HG3 LYS A 11 12.037 5.278 12.752 1.00 0.00 H new ATOM 0 HD2 LYS A 11 10.053 4.572 13.728 1.00 0.00 H new ATOM 0 HD3 LYS A 11 10.319 6.072 14.594 1.00 0.00 H new ATOM 0 HE2 LYS A 11 8.893 7.194 12.736 1.00 0.00 H new ATOM 0 HE3 LYS A 11 8.427 5.569 12.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 6.838 6.536 13.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 7.597 5.198 14.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 8.048 6.773 14.973 1.00 0.00 H new ATOM 154 N LYS A 12 14.745 6.987 10.789 1.00 0.00 N ATOM 155 CA LYS A 12 15.119 6.805 9.392 1.00 0.00 C ATOM 156 C LYS A 12 16.138 5.679 9.244 1.00 0.00 C ATOM 157 O LYS A 12 17.196 5.698 9.872 1.00 0.00 O ATOM 158 CB LYS A 12 15.694 8.105 8.824 1.00 0.00 C ATOM 159 CG LYS A 12 15.371 8.321 7.355 1.00 0.00 C ATOM 160 CD LYS A 12 16.612 8.193 6.487 1.00 0.00 C ATOM 161 CE LYS A 12 16.258 7.786 5.065 1.00 0.00 C ATOM 162 NZ LYS A 12 16.160 8.963 4.159 1.00 0.00 N ATOM 0 H LYS A 12 15.488 6.775 11.455 1.00 0.00 H new ATOM 0 HA LYS A 12 14.223 6.536 8.833 1.00 0.00 H new ATOM 0 HB2 LYS A 12 15.308 8.946 9.400 1.00 0.00 H new ATOM 0 HB3 LYS A 12 16.776 8.101 8.953 1.00 0.00 H new ATOM 0 HG2 LYS A 12 14.625 7.594 7.035 1.00 0.00 H new ATOM 0 HG3 LYS A 12 14.931 9.309 7.220 1.00 0.00 H new ATOM 0 HD2 LYS A 12 17.147 9.143 6.472 1.00 0.00 H new ATOM 0 HD3 LYS A 12 17.286 7.454 6.921 1.00 0.00 H new ATOM 0 HE2 LYS A 12 17.013 7.098 4.686 1.00 0.00 H new ATOM 0 HE3 LYS A 12 15.309 7.249 5.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 15.917 8.643 3.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 15.422 9.608 4.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 17.073 9.461 4.137 1.00 0.00 H new ATOM 176 N LYS A 13 15.812 4.699 8.408 1.00 0.00 N ATOM 177 CA LYS A 13 16.699 3.566 8.174 1.00 0.00 C ATOM 178 C LYS A 13 16.241 2.757 6.964 1.00 0.00 C ATOM 179 O LYS A 13 16.139 1.532 7.028 1.00 0.00 O ATOM 180 CB LYS A 13 16.750 2.668 9.412 1.00 0.00 C ATOM 181 CG LYS A 13 15.382 2.202 9.882 1.00 0.00 C ATOM 182 CD LYS A 13 15.263 0.688 9.838 1.00 0.00 C ATOM 183 CE LYS A 13 14.026 0.205 10.579 1.00 0.00 C ATOM 184 NZ LYS A 13 14.224 0.215 12.055 1.00 0.00 N ATOM 0 H LYS A 13 14.939 4.667 7.881 1.00 0.00 H new ATOM 0 HA LYS A 13 17.698 3.954 7.973 1.00 0.00 H new ATOM 0 HB2 LYS A 13 17.366 1.796 9.193 1.00 0.00 H new ATOM 0 HB3 LYS A 13 17.239 3.208 10.223 1.00 0.00 H new ATOM 0 HG2 LYS A 13 15.207 2.552 10.899 1.00 0.00 H new ATOM 0 HG3 LYS A 13 14.610 2.647 9.255 1.00 0.00 H new ATOM 0 HD2 LYS A 13 15.220 0.355 8.801 1.00 0.00 H new ATOM 0 HD3 LYS A 13 16.152 0.239 10.281 1.00 0.00 H new ATOM 0 HE2 LYS A 13 13.178 0.840 10.322 1.00 0.00 H new ATOM 0 HE3 LYS A 13 13.779 -0.805 10.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 13.377 -0.169 12.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 15.049 -0.370 12.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 14.385 1.191 12.377 1.00 0.00 H new ATOM 198 N ASP A 14 15.967 3.450 5.864 1.00 0.00 N ATOM 199 CA ASP A 14 15.523 2.795 4.639 1.00 0.00 C ATOM 200 C ASP A 14 14.361 1.848 4.920 1.00 0.00 C ATOM 201 O ASP A 14 14.499 0.626 4.874 1.00 0.00 O ATOM 202 CB ASP A 14 16.679 2.027 3.998 1.00 0.00 C ATOM 203 CG ASP A 14 16.569 1.970 2.487 1.00 0.00 C ATOM 204 OD1 ASP A 14 15.444 1.771 1.982 1.00 0.00 O ATOM 205 OD2 ASP A 14 17.607 2.123 1.809 1.00 0.00 O ATOM 0 H ASP A 14 16.045 4.465 5.796 1.00 0.00 H new ATOM 0 HA ASP A 14 15.182 3.565 3.948 1.00 0.00 H new ATOM 0 HB2 ASP A 14 17.622 2.499 4.273 1.00 0.00 H new ATOM 0 HB3 ASP A 14 16.703 1.013 4.396 1.00 0.00 H new ATOM 210 N PRO A 15 13.187 2.424 5.221 1.00 0.00 N ATOM 211 CA PRO A 15 11.978 1.649 5.516 1.00 0.00 C ATOM 212 C PRO A 15 11.427 0.942 4.282 1.00 0.00 C ATOM 213 O PRO A 15 11.961 1.085 3.183 1.00 0.00 O ATOM 214 CB PRO A 15 10.990 2.709 6.011 1.00 0.00 C ATOM 215 CG PRO A 15 11.452 3.979 5.385 1.00 0.00 C ATOM 216 CD PRO A 15 12.950 3.875 5.294 1.00 0.00 C ATOM 0 HA PRO A 15 12.169 0.854 6.237 1.00 0.00 H new ATOM 0 HB2 PRO A 15 9.969 2.469 5.713 1.00 0.00 H new ATOM 0 HB3 PRO A 15 10.996 2.779 7.099 1.00 0.00 H new ATOM 0 HG2 PRO A 15 11.009 4.111 4.398 1.00 0.00 H new ATOM 0 HG3 PRO A 15 11.156 4.840 5.985 1.00 0.00 H new ATOM 0 HD2 PRO A 15 13.336 4.390 4.414 1.00 0.00 H new ATOM 0 HD3 PRO A 15 13.437 4.319 6.162 1.00 0.00 H new ATOM 224 N ASN A 16 10.355 0.180 4.472 1.00 0.00 N ATOM 225 CA ASN A 16 9.732 -0.550 3.374 1.00 0.00 C ATOM 226 C ASN A 16 8.277 -0.878 3.695 1.00 0.00 C ATOM 227 O ASN A 16 7.400 -0.760 2.839 1.00 0.00 O ATOM 228 CB ASN A 16 10.505 -1.839 3.087 1.00 0.00 C ATOM 229 CG ASN A 16 11.563 -1.652 2.016 1.00 0.00 C ATOM 230 OD1 ASN A 16 12.629 -1.093 2.273 1.00 0.00 O ATOM 231 ND2 ASN A 16 11.270 -2.119 0.808 1.00 0.00 N ATOM 0 H ASN A 16 9.900 0.052 5.376 1.00 0.00 H new ATOM 0 HA ASN A 16 9.756 0.085 2.489 1.00 0.00 H new ATOM 0 HB2 ASN A 16 10.979 -2.188 4.005 1.00 0.00 H new ATOM 0 HB3 ASN A 16 9.808 -2.616 2.773 1.00 0.00 H new ATOM 0 HD21 ASN A 16 11.942 -2.021 0.047 1.00 0.00 H new ATOM 0 HD22 ASN A 16 10.373 -2.576 0.641 1.00 0.00 H new ATOM 238 N GLU A 17 8.028 -1.289 4.935 1.00 0.00 N ATOM 239 CA GLU A 17 6.679 -1.633 5.368 1.00 0.00 C ATOM 240 C GLU A 17 5.661 -0.633 4.827 1.00 0.00 C ATOM 241 O GLU A 17 5.929 0.563 4.713 1.00 0.00 O ATOM 242 CB GLU A 17 6.606 -1.676 6.896 1.00 0.00 C ATOM 243 CG GLU A 17 5.909 -2.913 7.438 1.00 0.00 C ATOM 244 CD GLU A 17 6.631 -3.516 8.627 1.00 0.00 C ATOM 245 OE1 GLU A 17 6.904 -2.773 9.593 1.00 0.00 O ATOM 246 OE2 GLU A 17 6.924 -4.729 8.592 1.00 0.00 O ATOM 0 H GLU A 17 8.742 -1.392 5.656 1.00 0.00 H new ATOM 0 HA GLU A 17 6.438 -2.619 4.971 1.00 0.00 H new ATOM 0 HB2 GLU A 17 7.617 -1.632 7.301 1.00 0.00 H new ATOM 0 HB3 GLU A 17 6.082 -0.789 7.251 1.00 0.00 H new ATOM 0 HG2 GLU A 17 4.891 -2.654 7.729 1.00 0.00 H new ATOM 0 HG3 GLU A 17 5.834 -3.659 6.647 1.00 0.00 H new ATOM 253 N PRO A 18 4.465 -1.134 4.486 1.00 0.00 N ATOM 254 CA PRO A 18 3.382 -0.302 3.951 1.00 0.00 C ATOM 255 C PRO A 18 2.799 0.637 5.002 1.00 0.00 C ATOM 256 O PRO A 18 2.727 0.293 6.181 1.00 0.00 O ATOM 257 CB PRO A 18 2.334 -1.326 3.508 1.00 0.00 C ATOM 258 CG PRO A 18 2.592 -2.523 4.356 1.00 0.00 C ATOM 259 CD PRO A 18 4.076 -2.550 4.596 1.00 0.00 C ATOM 0 HA PRO A 18 3.727 0.350 3.148 1.00 0.00 H new ATOM 0 HB2 PRO A 18 1.323 -0.947 3.656 1.00 0.00 H new ATOM 0 HB3 PRO A 18 2.434 -1.562 2.449 1.00 0.00 H new ATOM 0 HG2 PRO A 18 2.046 -2.459 5.297 1.00 0.00 H new ATOM 0 HG3 PRO A 18 2.261 -3.434 3.856 1.00 0.00 H new ATOM 0 HD2 PRO A 18 4.317 -2.958 5.578 1.00 0.00 H new ATOM 0 HD3 PRO A 18 4.591 -3.167 3.859 1.00 0.00 H new ATOM 267 N GLN A 19 2.385 1.822 4.566 1.00 0.00 N ATOM 268 CA GLN A 19 1.808 2.809 5.470 1.00 0.00 C ATOM 269 C GLN A 19 0.304 2.600 5.617 1.00 0.00 C ATOM 270 O GLN A 19 -0.462 2.855 4.688 1.00 0.00 O ATOM 271 CB GLN A 19 2.091 4.224 4.962 1.00 0.00 C ATOM 272 CG GLN A 19 3.572 4.531 4.812 1.00 0.00 C ATOM 273 CD GLN A 19 3.902 5.178 3.481 1.00 0.00 C ATOM 274 OE1 GLN A 19 4.704 4.657 2.706 1.00 0.00 O ATOM 275 NE2 GLN A 19 3.283 6.321 3.209 1.00 0.00 N ATOM 0 H GLN A 19 2.438 2.122 3.592 1.00 0.00 H new ATOM 0 HA GLN A 19 2.271 2.682 6.449 1.00 0.00 H new ATOM 0 HB2 GLN A 19 1.601 4.360 3.998 1.00 0.00 H new ATOM 0 HB3 GLN A 19 1.647 4.944 5.650 1.00 0.00 H new ATOM 0 HG2 GLN A 19 3.886 5.191 5.620 1.00 0.00 H new ATOM 0 HG3 GLN A 19 4.143 3.608 4.914 1.00 0.00 H new ATOM 0 HE21 GLN A 19 2.625 6.717 3.881 1.00 0.00 H new ATOM 0 HE22 GLN A 19 3.465 6.803 2.328 1.00 0.00 H new ATOM 284 N LYS A 20 -0.111 2.135 6.790 1.00 0.00 N ATOM 285 CA LYS A 20 -1.523 1.892 7.060 1.00 0.00 C ATOM 286 C LYS A 20 -2.372 3.085 6.632 1.00 0.00 C ATOM 287 O LYS A 20 -1.997 4.243 6.816 1.00 0.00 O ATOM 288 CB LYS A 20 -1.737 1.609 8.549 1.00 0.00 C ATOM 289 CG LYS A 20 -3.176 1.276 8.904 1.00 0.00 C ATOM 290 CD LYS A 20 -3.439 1.452 10.391 1.00 0.00 C ATOM 291 CE LYS A 20 -4.647 0.646 10.842 1.00 0.00 C ATOM 292 NZ LYS A 20 -5.498 1.411 11.796 1.00 0.00 N ATOM 0 H LYS A 20 0.511 1.919 7.569 1.00 0.00 H new ATOM 0 HA LYS A 20 -1.833 1.021 6.482 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -1.096 0.779 8.848 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -1.422 2.479 9.125 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -3.850 1.918 8.336 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -3.395 0.248 8.614 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -2.561 1.141 10.956 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -3.602 2.507 10.611 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.240 0.363 9.972 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -4.312 -0.278 11.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -6.311 0.828 12.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -4.939 1.660 12.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -5.839 2.280 11.337 1.00 0.00 H new ATOM 306 N PRO A 21 -3.545 2.798 6.048 1.00 0.00 N ATOM 307 CA PRO A 21 -4.472 3.834 5.583 1.00 0.00 C ATOM 308 C PRO A 21 -5.120 4.592 6.737 1.00 0.00 C ATOM 309 O PRO A 21 -5.343 4.034 7.812 1.00 0.00 O ATOM 310 CB PRO A 21 -5.526 3.044 4.804 1.00 0.00 C ATOM 311 CG PRO A 21 -5.486 1.676 5.393 1.00 0.00 C ATOM 312 CD PRO A 21 -4.057 1.440 5.797 1.00 0.00 C ATOM 0 HA PRO A 21 -3.967 4.596 4.990 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -6.514 3.492 4.909 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -5.298 3.023 3.738 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -6.152 1.602 6.253 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -5.815 0.930 4.670 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -3.989 0.814 6.687 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -3.495 0.938 5.010 1.00 0.00 H new ATOM 320 N VAL A 22 -5.422 5.866 6.508 1.00 0.00 N ATOM 321 CA VAL A 22 -6.046 6.700 7.528 1.00 0.00 C ATOM 322 C VAL A 22 -7.565 6.573 7.487 1.00 0.00 C ATOM 323 O VAL A 22 -8.128 6.045 6.529 1.00 0.00 O ATOM 324 CB VAL A 22 -5.660 8.181 7.355 1.00 0.00 C ATOM 325 CG1 VAL A 22 -4.150 8.332 7.260 1.00 0.00 C ATOM 326 CG2 VAL A 22 -6.341 8.769 6.128 1.00 0.00 C ATOM 0 H VAL A 22 -5.244 6.343 5.624 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.681 6.348 8.493 1.00 0.00 H new ATOM 0 HB VAL A 22 -6.002 8.732 8.231 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -3.897 9.385 7.138 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -3.688 7.951 8.171 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -3.781 7.769 6.403 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -6.057 9.816 6.021 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -6.032 8.217 5.241 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -7.423 8.696 6.242 1.00 0.00 H new ATOM 336 N SER A 23 -8.222 7.063 8.534 1.00 0.00 N ATOM 337 CA SER A 23 -9.676 7.002 8.620 1.00 0.00 C ATOM 338 C SER A 23 -10.321 7.686 7.418 1.00 0.00 C ATOM 339 O SER A 23 -9.636 8.090 6.479 1.00 0.00 O ATOM 340 CB SER A 23 -10.160 7.658 9.914 1.00 0.00 C ATOM 341 OG SER A 23 -11.362 7.062 10.370 1.00 0.00 O ATOM 0 H SER A 23 -7.770 7.506 9.334 1.00 0.00 H new ATOM 0 HA SER A 23 -9.971 5.953 8.621 1.00 0.00 H new ATOM 0 HB2 SER A 23 -9.391 7.566 10.681 1.00 0.00 H new ATOM 0 HB3 SER A 23 -10.319 8.723 9.748 1.00 0.00 H new ATOM 0 HG SER A 23 -11.649 7.498 11.199 1.00 0.00 H new ATOM 347 N ALA A 24 -11.643 7.813 7.456 1.00 0.00 N ATOM 348 CA ALA A 24 -12.381 8.450 6.372 1.00 0.00 C ATOM 349 C ALA A 24 -12.086 9.944 6.311 1.00 0.00 C ATOM 350 O ALA A 24 -11.646 10.459 5.282 1.00 0.00 O ATOM 351 CB ALA A 24 -13.874 8.211 6.539 1.00 0.00 C ATOM 0 H ALA A 24 -12.225 7.483 8.226 1.00 0.00 H new ATOM 0 HA ALA A 24 -12.056 8.004 5.432 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -14.413 8.692 5.723 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -14.075 7.140 6.525 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -14.205 8.630 7.489 1.00 0.00 H new ATOM 357 N TYR A 25 -12.331 10.637 7.418 1.00 0.00 N ATOM 358 CA TYR A 25 -12.094 12.074 7.488 1.00 0.00 C ATOM 359 C TYR A 25 -10.616 12.393 7.285 1.00 0.00 C ATOM 360 O TYR A 25 -10.255 13.516 6.934 1.00 0.00 O ATOM 361 CB TYR A 25 -12.565 12.624 8.836 1.00 0.00 C ATOM 362 CG TYR A 25 -11.974 13.972 9.180 1.00 0.00 C ATOM 363 CD1 TYR A 25 -12.011 15.021 8.270 1.00 0.00 C ATOM 364 CD2 TYR A 25 -11.379 14.197 10.415 1.00 0.00 C ATOM 365 CE1 TYR A 25 -11.472 16.255 8.580 1.00 0.00 C ATOM 366 CE2 TYR A 25 -10.838 15.428 10.734 1.00 0.00 C ATOM 367 CZ TYR A 25 -10.886 16.453 9.813 1.00 0.00 C ATOM 368 OH TYR A 25 -10.349 17.681 10.125 1.00 0.00 O ATOM 0 H TYR A 25 -12.693 10.227 8.279 1.00 0.00 H new ATOM 0 HA TYR A 25 -12.663 12.550 6.689 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -13.652 12.705 8.826 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -12.306 11.912 9.620 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -12.469 14.869 7.304 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -11.339 13.396 11.138 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -11.509 17.060 7.861 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -10.380 15.586 11.699 1.00 0.00 H new ATOM 0 HH TYR A 25 -9.977 17.654 11.031 1.00 0.00 H new ATOM 378 N ALA A 26 -9.766 11.396 7.507 1.00 0.00 N ATOM 379 CA ALA A 26 -8.328 11.568 7.345 1.00 0.00 C ATOM 380 C ALA A 26 -7.924 11.470 5.878 1.00 0.00 C ATOM 381 O ALA A 26 -7.083 12.233 5.402 1.00 0.00 O ATOM 382 CB ALA A 26 -7.577 10.535 8.172 1.00 0.00 C ATOM 0 H ALA A 26 -10.049 10.461 7.800 1.00 0.00 H new ATOM 0 HA ALA A 26 -8.064 12.564 7.701 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -6.504 10.675 8.042 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -7.833 10.655 9.225 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -7.855 9.534 7.843 1.00 0.00 H new ATOM 388 N LEU A 27 -8.529 10.525 5.166 1.00 0.00 N ATOM 389 CA LEU A 27 -8.232 10.326 3.751 1.00 0.00 C ATOM 390 C LEU A 27 -8.412 11.623 2.969 1.00 0.00 C ATOM 391 O LEU A 27 -7.781 11.828 1.932 1.00 0.00 O ATOM 392 CB LEU A 27 -9.134 9.236 3.169 1.00 0.00 C ATOM 393 CG LEU A 27 -8.517 7.841 3.063 1.00 0.00 C ATOM 394 CD1 LEU A 27 -9.591 6.772 3.190 1.00 0.00 C ATOM 395 CD2 LEU A 27 -7.764 7.689 1.749 1.00 0.00 C ATOM 0 H LEU A 27 -9.227 9.885 5.545 1.00 0.00 H new ATOM 0 HA LEU A 27 -7.192 10.013 3.664 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -10.032 9.169 3.783 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.451 9.548 2.174 1.00 0.00 H new ATOM 0 HG LEU A 27 -7.808 7.715 3.882 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.134 5.786 3.112 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.086 6.867 4.156 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -10.324 6.896 2.393 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -7.332 6.690 1.691 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -8.452 7.836 0.916 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -6.968 8.432 1.697 1.00 0.00 H new ATOM 407 N PHE A 28 -9.278 12.496 3.474 1.00 0.00 N ATOM 408 CA PHE A 28 -9.541 13.775 2.823 1.00 0.00 C ATOM 409 C PHE A 28 -8.576 14.847 3.321 1.00 0.00 C ATOM 410 O PHE A 28 -8.394 15.881 2.678 1.00 0.00 O ATOM 411 CB PHE A 28 -10.984 14.213 3.078 1.00 0.00 C ATOM 412 CG PHE A 28 -11.239 15.657 2.752 1.00 0.00 C ATOM 413 CD1 PHE A 28 -11.270 16.089 1.435 1.00 0.00 C ATOM 414 CD2 PHE A 28 -11.447 16.583 3.761 1.00 0.00 C ATOM 415 CE1 PHE A 28 -11.503 17.417 1.133 1.00 0.00 C ATOM 416 CE2 PHE A 28 -11.681 17.912 3.465 1.00 0.00 C ATOM 417 CZ PHE A 28 -11.710 18.330 2.149 1.00 0.00 C ATOM 0 H PHE A 28 -9.809 12.342 4.331 1.00 0.00 H new ATOM 0 HA PHE A 28 -9.392 13.647 1.751 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -11.654 13.591 2.485 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -11.229 14.037 4.125 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -11.110 15.380 0.636 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -11.426 16.262 4.792 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -11.523 17.741 0.103 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -11.841 18.623 4.262 1.00 0.00 H new ATOM 0 HZ PHE A 28 -11.894 19.368 1.915 1.00 0.00 H new ATOM 427 N PHE A 29 -7.962 14.593 4.472 1.00 0.00 N ATOM 428 CA PHE A 29 -7.017 15.537 5.058 1.00 0.00 C ATOM 429 C PHE A 29 -5.681 15.497 4.323 1.00 0.00 C ATOM 430 O PHE A 29 -5.044 16.529 4.113 1.00 0.00 O ATOM 431 CB PHE A 29 -6.805 15.224 6.541 1.00 0.00 C ATOM 432 CG PHE A 29 -5.800 16.121 7.205 1.00 0.00 C ATOM 433 CD1 PHE A 29 -4.442 15.875 7.076 1.00 0.00 C ATOM 434 CD2 PHE A 29 -6.212 17.208 7.958 1.00 0.00 C ATOM 435 CE1 PHE A 29 -3.514 16.699 7.686 1.00 0.00 C ATOM 436 CE2 PHE A 29 -5.288 18.035 8.570 1.00 0.00 C ATOM 437 CZ PHE A 29 -3.938 17.779 8.434 1.00 0.00 C ATOM 0 H PHE A 29 -8.102 13.742 5.017 1.00 0.00 H new ATOM 0 HA PHE A 29 -7.435 16.539 4.961 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -7.758 15.311 7.062 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -6.479 14.189 6.643 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -4.105 15.031 6.493 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -7.267 17.412 8.068 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -2.458 16.498 7.577 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -5.622 18.880 9.154 1.00 0.00 H new ATOM 0 HZ PHE A 29 -3.215 18.423 8.912 1.00 0.00 H new ATOM 447 N ARG A 30 -5.262 14.297 3.934 1.00 0.00 N ATOM 448 CA ARG A 30 -4.001 14.120 3.224 1.00 0.00 C ATOM 449 C ARG A 30 -4.160 14.452 1.743 1.00 0.00 C ATOM 450 O ARG A 30 -3.179 14.707 1.044 1.00 0.00 O ATOM 451 CB ARG A 30 -3.497 12.685 3.384 1.00 0.00 C ATOM 452 CG ARG A 30 -4.466 11.637 2.863 1.00 0.00 C ATOM 453 CD ARG A 30 -3.963 10.228 3.137 1.00 0.00 C ATOM 454 NE ARG A 30 -2.963 9.805 2.160 1.00 0.00 N ATOM 455 CZ ARG A 30 -1.668 10.080 2.268 1.00 0.00 C ATOM 456 NH1 ARG A 30 -1.219 10.775 3.305 1.00 0.00 N ATOM 457 NH2 ARG A 30 -0.819 9.661 1.339 1.00 0.00 N ATOM 0 H ARG A 30 -5.778 13.433 4.099 1.00 0.00 H new ATOM 0 HA ARG A 30 -3.271 14.804 3.656 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -2.547 12.582 2.859 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -3.301 12.493 4.439 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -5.440 11.775 3.333 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -4.608 11.772 1.791 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -3.533 10.185 4.138 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -4.803 9.533 3.120 1.00 0.00 H new ATOM 0 HE ARG A 30 -3.276 9.269 1.351 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -1.869 11.099 4.021 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -0.224 10.985 3.386 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -1.160 9.127 0.540 1.00 0.00 H new ATOM 0 HH22 ARG A 30 0.175 9.873 1.424 1.00 0.00 H new ATOM 471 N ASP A 31 -5.402 14.447 1.271 1.00 0.00 N ATOM 472 CA ASP A 31 -5.690 14.748 -0.126 1.00 0.00 C ATOM 473 C ASP A 31 -5.876 16.248 -0.332 1.00 0.00 C ATOM 474 O ASP A 31 -5.559 16.784 -1.394 1.00 0.00 O ATOM 475 CB ASP A 31 -6.942 13.998 -0.584 1.00 0.00 C ATOM 476 CG ASP A 31 -6.649 13.000 -1.687 1.00 0.00 C ATOM 477 OD1 ASP A 31 -6.088 11.926 -1.382 1.00 0.00 O ATOM 478 OD2 ASP A 31 -6.982 13.291 -2.854 1.00 0.00 O ATOM 0 H ASP A 31 -6.225 14.238 1.836 1.00 0.00 H new ATOM 0 HA ASP A 31 -4.840 14.420 -0.725 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -7.381 13.476 0.267 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -7.684 14.716 -0.935 1.00 0.00 H new ATOM 483 N THR A 32 -6.395 16.920 0.691 1.00 0.00 N ATOM 484 CA THR A 32 -6.626 18.358 0.621 1.00 0.00 C ATOM 485 C THR A 32 -5.433 19.133 1.167 1.00 0.00 C ATOM 486 O THR A 32 -4.937 20.058 0.525 1.00 0.00 O ATOM 487 CB THR A 32 -7.889 18.762 1.406 1.00 0.00 C ATOM 488 OG1 THR A 32 -8.916 17.781 1.220 1.00 0.00 O ATOM 489 CG2 THR A 32 -8.393 20.124 0.954 1.00 0.00 C ATOM 0 H THR A 32 -6.663 16.492 1.577 1.00 0.00 H new ATOM 0 HA THR A 32 -6.766 18.606 -0.431 1.00 0.00 H new ATOM 0 HB THR A 32 -7.631 18.820 2.463 1.00 0.00 H new ATOM 0 HG1 THR A 32 -9.793 18.217 1.244 1.00 0.00 H new ATOM 0 HG21 THR A 32 -9.285 20.389 1.522 1.00 0.00 H new ATOM 0 HG22 THR A 32 -7.619 20.873 1.124 1.00 0.00 H new ATOM 0 HG23 THR A 32 -8.636 20.088 -0.108 1.00 0.00 H new ATOM 497 N GLN A 33 -4.976 18.749 2.355 1.00 0.00 N ATOM 498 CA GLN A 33 -3.840 19.410 2.986 1.00 0.00 C ATOM 499 C GLN A 33 -2.825 19.863 1.942 1.00 0.00 C ATOM 500 O GLN A 33 -2.519 21.050 1.834 1.00 0.00 O ATOM 501 CB GLN A 33 -3.171 18.471 3.992 1.00 0.00 C ATOM 502 CG GLN A 33 -1.869 19.014 4.557 1.00 0.00 C ATOM 503 CD GLN A 33 -0.778 17.963 4.621 1.00 0.00 C ATOM 504 OE1 GLN A 33 -0.581 17.317 5.651 1.00 0.00 O ATOM 505 NE2 GLN A 33 -0.060 17.786 3.518 1.00 0.00 N ATOM 0 H GLN A 33 -5.375 17.984 2.899 1.00 0.00 H new ATOM 0 HA GLN A 33 -4.210 20.290 3.512 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -3.862 18.280 4.813 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -2.977 17.513 3.509 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -1.530 19.847 3.942 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -2.048 19.408 5.557 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -0.257 18.343 2.686 1.00 0.00 H new ATOM 0 HE22 GLN A 33 0.688 17.093 3.502 1.00 0.00 H new ATOM 514 N ALA A 34 -2.306 18.909 1.176 1.00 0.00 N ATOM 515 CA ALA A 34 -1.326 19.211 0.140 1.00 0.00 C ATOM 516 C ALA A 34 -1.708 20.473 -0.626 1.00 0.00 C ATOM 517 O ALA A 34 -0.903 21.394 -0.764 1.00 0.00 O ATOM 518 CB ALA A 34 -1.188 18.034 -0.815 1.00 0.00 C ATOM 0 H ALA A 34 -2.548 17.921 1.253 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.365 19.388 0.624 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -0.453 18.273 -1.584 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.861 17.153 -0.262 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.151 17.831 -1.284 1.00 0.00 H new ATOM 524 N ALA A 35 -2.940 20.509 -1.123 1.00 0.00 N ATOM 525 CA ALA A 35 -3.428 21.659 -1.873 1.00 0.00 C ATOM 526 C ALA A 35 -3.434 22.916 -1.010 1.00 0.00 C ATOM 527 O ALA A 35 -3.207 24.020 -1.504 1.00 0.00 O ATOM 528 CB ALA A 35 -4.822 21.382 -2.416 1.00 0.00 C ATOM 0 H ALA A 35 -3.618 19.754 -1.019 1.00 0.00 H new ATOM 0 HA ALA A 35 -2.751 21.829 -2.710 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -5.174 22.250 -2.974 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -4.790 20.515 -3.076 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.502 21.183 -1.588 1.00 0.00 H new ATOM 534 N ILE A 36 -3.696 22.740 0.281 1.00 0.00 N ATOM 535 CA ILE A 36 -3.732 23.860 1.212 1.00 0.00 C ATOM 536 C ILE A 36 -2.328 24.385 1.495 1.00 0.00 C ATOM 537 O ILE A 36 -2.001 25.525 1.166 1.00 0.00 O ATOM 538 CB ILE A 36 -4.397 23.465 2.544 1.00 0.00 C ATOM 539 CG1 ILE A 36 -5.702 22.710 2.282 1.00 0.00 C ATOM 540 CG2 ILE A 36 -4.654 24.699 3.395 1.00 0.00 C ATOM 541 CD1 ILE A 36 -6.793 23.577 1.693 1.00 0.00 C ATOM 0 H ILE A 36 -3.886 21.832 0.705 1.00 0.00 H new ATOM 0 HA ILE A 36 -4.323 24.644 0.739 1.00 0.00 H new ATOM 0 HB ILE A 36 -3.721 22.807 3.090 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -5.503 21.880 1.604 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -6.057 22.279 3.218 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -5.124 24.403 4.333 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -3.709 25.199 3.605 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -5.314 25.381 2.858 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -7.689 22.977 1.533 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.020 24.392 2.380 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -6.457 23.988 0.741 1.00 0.00 H new ATOM 553 N LYS A 37 -1.500 23.544 2.105 1.00 0.00 N ATOM 554 CA LYS A 37 -0.129 23.920 2.430 1.00 0.00 C ATOM 555 C LYS A 37 0.588 24.475 1.203 1.00 0.00 C ATOM 556 O LYS A 37 1.391 25.401 1.308 1.00 0.00 O ATOM 557 CB LYS A 37 0.636 22.713 2.978 1.00 0.00 C ATOM 558 CG LYS A 37 1.413 23.011 4.249 1.00 0.00 C ATOM 559 CD LYS A 37 2.746 23.674 3.946 1.00 0.00 C ATOM 560 CE LYS A 37 3.906 22.888 4.536 1.00 0.00 C ATOM 561 NZ LYS A 37 5.139 23.717 4.645 1.00 0.00 N ATOM 0 H LYS A 37 -1.755 22.597 2.385 1.00 0.00 H new ATOM 0 HA LYS A 37 -0.163 24.698 3.193 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -0.069 21.905 3.174 1.00 0.00 H new ATOM 0 HB3 LYS A 37 1.327 22.355 2.215 1.00 0.00 H new ATOM 0 HG2 LYS A 37 0.821 23.660 4.894 1.00 0.00 H new ATOM 0 HG3 LYS A 37 1.583 22.085 4.798 1.00 0.00 H new ATOM 0 HD2 LYS A 37 2.874 23.759 2.867 1.00 0.00 H new ATOM 0 HD3 LYS A 37 2.750 24.687 4.348 1.00 0.00 H new ATOM 0 HE2 LYS A 37 3.629 22.517 5.523 1.00 0.00 H new ATOM 0 HE3 LYS A 37 4.108 22.016 3.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 5.907 23.145 5.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 5.418 24.050 3.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 4.954 24.535 5.260 1.00 0.00 H new ATOM 575 N GLY A 38 0.290 23.904 0.040 1.00 0.00 N ATOM 576 CA GLY A 38 0.914 24.356 -1.190 1.00 0.00 C ATOM 577 C GLY A 38 0.675 25.830 -1.453 1.00 0.00 C ATOM 578 O GLY A 38 1.579 26.542 -1.889 1.00 0.00 O ATOM 0 H GLY A 38 -0.372 23.137 -0.072 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.987 24.168 -1.140 1.00 0.00 H new ATOM 0 HA3 GLY A 38 0.527 23.773 -2.026 1.00 0.00 H new ATOM 582 N GLN A 39 -0.545 26.286 -1.190 1.00 0.00 N ATOM 583 CA GLN A 39 -0.899 27.684 -1.403 1.00 0.00 C ATOM 584 C GLN A 39 -0.453 28.545 -0.226 1.00 0.00 C ATOM 585 O GLN A 39 -0.235 29.747 -0.372 1.00 0.00 O ATOM 586 CB GLN A 39 -2.409 27.824 -1.609 1.00 0.00 C ATOM 587 CG GLN A 39 -2.853 27.573 -3.041 1.00 0.00 C ATOM 588 CD GLN A 39 -4.361 27.591 -3.196 1.00 0.00 C ATOM 589 OE1 GLN A 39 -4.950 28.617 -3.536 1.00 0.00 O ATOM 590 NE2 GLN A 39 -4.995 26.451 -2.946 1.00 0.00 N ATOM 0 H GLN A 39 -1.304 25.708 -0.829 1.00 0.00 H new ATOM 0 HA GLN A 39 -0.383 28.030 -2.298 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -2.924 27.125 -0.950 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -2.716 28.827 -1.312 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -2.416 28.331 -3.691 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -2.469 26.608 -3.373 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -4.467 25.624 -2.667 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -6.010 26.402 -3.033 1.00 0.00 H new ATOM 599 N ASN A 40 -0.319 27.921 0.940 1.00 0.00 N ATOM 600 CA ASN A 40 0.100 28.631 2.143 1.00 0.00 C ATOM 601 C ASN A 40 1.180 27.851 2.886 1.00 0.00 C ATOM 602 O ASN A 40 0.913 27.143 3.857 1.00 0.00 O ATOM 603 CB ASN A 40 -1.098 28.869 3.064 1.00 0.00 C ATOM 604 CG ASN A 40 -2.392 29.048 2.294 1.00 0.00 C ATOM 605 OD1 ASN A 40 -2.556 30.015 1.550 1.00 0.00 O ATOM 606 ND2 ASN A 40 -3.319 28.113 2.470 1.00 0.00 N ATOM 0 H ASN A 40 -0.494 26.926 1.077 1.00 0.00 H new ATOM 0 HA ASN A 40 0.514 29.593 1.841 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -1.199 28.027 3.749 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -0.915 29.755 3.672 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -4.210 28.179 1.978 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -3.140 27.329 3.097 1.00 0.00 H new ATOM 613 N PRO A 41 2.431 27.982 2.420 1.00 0.00 N ATOM 614 CA PRO A 41 3.577 27.298 3.027 1.00 0.00 C ATOM 615 C PRO A 41 3.926 27.858 4.401 1.00 0.00 C ATOM 616 O PRO A 41 4.790 27.326 5.097 1.00 0.00 O ATOM 617 CB PRO A 41 4.714 27.565 2.037 1.00 0.00 C ATOM 618 CG PRO A 41 4.325 28.825 1.344 1.00 0.00 C ATOM 619 CD PRO A 41 2.824 28.809 1.266 1.00 0.00 C ATOM 0 HA PRO A 41 3.378 26.240 3.194 1.00 0.00 H new ATOM 0 HB2 PRO A 41 5.669 27.675 2.551 1.00 0.00 H new ATOM 0 HB3 PRO A 41 4.825 26.743 1.330 1.00 0.00 H new ATOM 0 HG2 PRO A 41 4.678 29.698 1.894 1.00 0.00 H new ATOM 0 HG3 PRO A 41 4.767 28.875 0.349 1.00 0.00 H new ATOM 0 HD2 PRO A 41 2.408 29.814 1.332 1.00 0.00 H new ATOM 0 HD3 PRO A 41 2.475 28.380 0.327 1.00 0.00 H new ATOM 627 N ASN A 42 3.247 28.933 4.787 1.00 0.00 N ATOM 628 CA ASN A 42 3.485 29.565 6.079 1.00 0.00 C ATOM 629 C ASN A 42 2.763 28.814 7.194 1.00 0.00 C ATOM 630 O ASN A 42 3.175 28.855 8.352 1.00 0.00 O ATOM 631 CB ASN A 42 3.023 31.024 6.050 1.00 0.00 C ATOM 632 CG ASN A 42 3.262 31.732 7.370 1.00 0.00 C ATOM 633 OD1 ASN A 42 4.300 32.363 7.569 1.00 0.00 O ATOM 634 ND2 ASN A 42 2.299 31.630 8.279 1.00 0.00 N ATOM 0 H ASN A 42 2.527 29.385 4.223 1.00 0.00 H new ATOM 0 HA ASN A 42 4.556 29.534 6.278 1.00 0.00 H new ATOM 0 HB2 ASN A 42 3.550 31.553 5.256 1.00 0.00 H new ATOM 0 HB3 ASN A 42 1.961 31.061 5.808 1.00 0.00 H new ATOM 0 HD21 ASN A 42 2.403 32.085 9.186 1.00 0.00 H new ATOM 0 HD22 ASN A 42 1.455 31.096 8.070 1.00 0.00 H new ATOM 641 N ALA A 43 1.684 28.127 6.834 1.00 0.00 N ATOM 642 CA ALA A 43 0.906 27.364 7.802 1.00 0.00 C ATOM 643 C ALA A 43 1.765 26.302 8.481 1.00 0.00 C ATOM 644 O ALA A 43 2.596 25.657 7.841 1.00 0.00 O ATOM 645 CB ALA A 43 -0.295 26.720 7.125 1.00 0.00 C ATOM 0 H ALA A 43 1.329 28.083 5.879 1.00 0.00 H new ATOM 0 HA ALA A 43 0.551 28.052 8.569 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -0.867 26.153 7.860 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -0.928 27.495 6.692 1.00 0.00 H new ATOM 0 HB3 ALA A 43 0.048 26.050 6.337 1.00 0.00 H new ATOM 651 N THR A 44 1.559 26.124 9.782 1.00 0.00 N ATOM 652 CA THR A 44 2.315 25.141 10.548 1.00 0.00 C ATOM 653 C THR A 44 1.406 24.037 11.075 1.00 0.00 C ATOM 654 O THR A 44 1.247 23.874 12.285 1.00 0.00 O ATOM 655 CB THR A 44 3.047 25.797 11.734 1.00 0.00 C ATOM 656 OG1 THR A 44 2.174 26.714 12.403 1.00 0.00 O ATOM 657 CG2 THR A 44 4.295 26.528 11.262 1.00 0.00 C ATOM 0 H THR A 44 0.875 26.648 10.327 1.00 0.00 H new ATOM 0 HA THR A 44 3.051 24.709 9.870 1.00 0.00 H new ATOM 0 HB THR A 44 3.346 25.011 12.427 1.00 0.00 H new ATOM 0 HG1 THR A 44 2.647 27.125 13.157 1.00 0.00 H new ATOM 0 HG21 THR A 44 4.795 26.983 12.117 1.00 0.00 H new ATOM 0 HG22 THR A 44 4.971 25.821 10.780 1.00 0.00 H new ATOM 0 HG23 THR A 44 4.015 27.304 10.550 1.00 0.00 H new ATOM 665 N PHE A 45 0.811 23.280 10.159 1.00 0.00 N ATOM 666 CA PHE A 45 -0.084 22.190 10.532 1.00 0.00 C ATOM 667 C PHE A 45 -1.360 22.728 11.172 1.00 0.00 C ATOM 668 O PHE A 45 -2.431 22.698 10.568 1.00 0.00 O ATOM 669 CB PHE A 45 0.619 21.232 11.497 1.00 0.00 C ATOM 670 CG PHE A 45 -0.149 19.967 11.752 1.00 0.00 C ATOM 671 CD1 PHE A 45 -0.389 19.068 10.725 1.00 0.00 C ATOM 672 CD2 PHE A 45 -0.630 19.677 13.018 1.00 0.00 C ATOM 673 CE1 PHE A 45 -1.097 17.904 10.957 1.00 0.00 C ATOM 674 CE2 PHE A 45 -1.338 18.514 13.256 1.00 0.00 C ATOM 675 CZ PHE A 45 -1.571 17.625 12.225 1.00 0.00 C ATOM 0 H PHE A 45 0.932 23.401 9.153 1.00 0.00 H new ATOM 0 HA PHE A 45 -0.354 21.649 9.625 1.00 0.00 H new ATOM 0 HB2 PHE A 45 1.599 20.977 11.094 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.787 21.743 12.445 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.019 19.279 9.733 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -0.450 20.368 13.829 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.280 17.213 10.148 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.709 18.301 14.248 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.122 16.715 12.409 1.00 0.00 H new ATOM 685 N GLY A 46 -1.237 23.220 12.401 1.00 0.00 N ATOM 686 CA GLY A 46 -2.387 23.757 13.104 1.00 0.00 C ATOM 687 C GLY A 46 -3.289 24.574 12.200 1.00 0.00 C ATOM 688 O GLY A 46 -4.502 24.620 12.403 1.00 0.00 O ATOM 0 H GLY A 46 -0.361 23.256 12.922 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -2.959 22.937 13.538 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -2.045 24.380 13.931 1.00 0.00 H new ATOM 692 N GLU A 47 -2.696 25.219 11.201 1.00 0.00 N ATOM 693 CA GLU A 47 -3.456 26.040 10.265 1.00 0.00 C ATOM 694 C GLU A 47 -4.052 25.184 9.151 1.00 0.00 C ATOM 695 O GLU A 47 -5.272 25.096 9.006 1.00 0.00 O ATOM 696 CB GLU A 47 -2.562 27.127 9.664 1.00 0.00 C ATOM 697 CG GLU A 47 -2.834 28.514 10.220 1.00 0.00 C ATOM 698 CD GLU A 47 -3.696 29.354 9.297 1.00 0.00 C ATOM 699 OE1 GLU A 47 -3.248 29.640 8.167 1.00 0.00 O ATOM 700 OE2 GLU A 47 -4.816 29.726 9.705 1.00 0.00 O ATOM 0 H GLU A 47 -1.693 25.189 11.019 1.00 0.00 H new ATOM 0 HA GLU A 47 -4.271 26.512 10.814 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -1.519 26.870 9.847 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.702 27.144 8.583 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -3.327 28.423 11.188 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -1.887 29.025 10.391 1.00 0.00 H new ATOM 707 N VAL A 48 -3.183 24.554 8.367 1.00 0.00 N ATOM 708 CA VAL A 48 -3.623 23.705 7.266 1.00 0.00 C ATOM 709 C VAL A 48 -4.768 22.795 7.698 1.00 0.00 C ATOM 710 O VAL A 48 -5.615 22.419 6.888 1.00 0.00 O ATOM 711 CB VAL A 48 -2.468 22.839 6.729 1.00 0.00 C ATOM 712 CG1 VAL A 48 -3.006 21.693 5.887 1.00 0.00 C ATOM 713 CG2 VAL A 48 -1.494 23.689 5.928 1.00 0.00 C ATOM 0 H VAL A 48 -2.170 24.615 8.474 1.00 0.00 H new ATOM 0 HA VAL A 48 -3.969 24.368 6.473 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.931 22.413 7.577 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.175 21.092 5.516 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.661 21.070 6.496 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -3.568 22.094 5.044 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.684 23.061 5.556 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.016 24.145 5.086 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -1.083 24.471 6.567 1.00 0.00 H new ATOM 723 N SER A 49 -4.786 22.444 8.980 1.00 0.00 N ATOM 724 CA SER A 49 -5.825 21.575 9.520 1.00 0.00 C ATOM 725 C SER A 49 -7.093 22.367 9.822 1.00 0.00 C ATOM 726 O SER A 49 -8.180 22.024 9.356 1.00 0.00 O ATOM 727 CB SER A 49 -5.329 20.880 10.790 1.00 0.00 C ATOM 728 OG SER A 49 -4.089 20.232 10.566 1.00 0.00 O ATOM 0 H SER A 49 -4.093 22.748 9.664 1.00 0.00 H new ATOM 0 HA SER A 49 -6.059 20.820 8.769 1.00 0.00 H new ATOM 0 HB2 SER A 49 -5.221 21.612 11.590 1.00 0.00 H new ATOM 0 HB3 SER A 49 -6.069 20.152 11.122 1.00 0.00 H new ATOM 0 HG SER A 49 -4.219 19.479 9.952 1.00 0.00 H new ATOM 734 N LYS A 50 -6.947 23.430 10.606 1.00 0.00 N ATOM 735 CA LYS A 50 -8.078 24.274 10.971 1.00 0.00 C ATOM 736 C LYS A 50 -8.970 24.540 9.763 1.00 0.00 C ATOM 737 O LYS A 50 -10.184 24.695 9.899 1.00 0.00 O ATOM 738 CB LYS A 50 -7.585 25.599 11.556 1.00 0.00 C ATOM 739 CG LYS A 50 -8.092 25.869 12.962 1.00 0.00 C ATOM 740 CD LYS A 50 -9.443 26.564 12.943 1.00 0.00 C ATOM 741 CE LYS A 50 -10.045 26.650 14.338 1.00 0.00 C ATOM 742 NZ LYS A 50 -10.787 27.925 14.544 1.00 0.00 N ATOM 0 H LYS A 50 -6.055 23.727 11.001 1.00 0.00 H new ATOM 0 HA LYS A 50 -8.664 23.747 11.724 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -6.495 25.599 11.566 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -7.898 26.414 10.903 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -8.173 24.929 13.507 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -7.371 26.487 13.497 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -9.332 27.567 12.531 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -10.123 26.023 12.285 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -10.719 25.808 14.495 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -9.252 26.567 15.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -11.182 27.945 15.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -10.138 28.728 14.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -11.560 27.993 13.851 1.00 0.00 H new ATOM 756 N ILE A 51 -8.362 24.590 8.583 1.00 0.00 N ATOM 757 CA ILE A 51 -9.102 24.835 7.352 1.00 0.00 C ATOM 758 C ILE A 51 -9.779 23.562 6.855 1.00 0.00 C ATOM 759 O ILE A 51 -10.985 23.543 6.609 1.00 0.00 O ATOM 760 CB ILE A 51 -8.184 25.381 6.242 1.00 0.00 C ATOM 761 CG1 ILE A 51 -7.430 26.617 6.737 1.00 0.00 C ATOM 762 CG2 ILE A 51 -8.996 25.712 4.998 1.00 0.00 C ATOM 763 CD1 ILE A 51 -5.996 26.682 6.258 1.00 0.00 C ATOM 0 H ILE A 51 -7.358 24.464 8.454 1.00 0.00 H new ATOM 0 HA ILE A 51 -9.862 25.581 7.584 1.00 0.00 H new ATOM 0 HB ILE A 51 -7.455 24.613 5.982 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -7.957 27.511 6.404 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -7.441 26.627 7.827 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -8.333 26.097 4.223 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -9.492 24.811 4.637 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -9.745 26.466 5.242 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -5.523 27.584 6.647 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -5.454 25.806 6.613 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -5.977 26.704 5.168 1.00 0.00 H new ATOM 775 N VAL A 52 -8.995 22.499 6.711 1.00 0.00 N ATOM 776 CA VAL A 52 -9.518 21.220 6.246 1.00 0.00 C ATOM 777 C VAL A 52 -10.746 20.804 7.049 1.00 0.00 C ATOM 778 O VAL A 52 -11.774 20.434 6.483 1.00 0.00 O ATOM 779 CB VAL A 52 -8.455 20.109 6.343 1.00 0.00 C ATOM 780 CG1 VAL A 52 -9.103 18.738 6.223 1.00 0.00 C ATOM 781 CG2 VAL A 52 -7.388 20.299 5.276 1.00 0.00 C ATOM 0 H VAL A 52 -7.995 22.498 6.910 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.798 21.354 5.201 1.00 0.00 H new ATOM 0 HB VAL A 52 -7.975 20.173 7.320 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -8.337 17.966 6.294 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -9.827 18.606 7.027 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -9.611 18.658 5.262 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -6.645 19.506 5.359 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -7.850 20.262 4.289 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -6.903 21.266 5.414 1.00 0.00 H new ATOM 791 N ALA A 53 -10.631 20.869 8.371 1.00 0.00 N ATOM 792 CA ALA A 53 -11.733 20.502 9.253 1.00 0.00 C ATOM 793 C ALA A 53 -13.045 21.114 8.775 1.00 0.00 C ATOM 794 O ALA A 53 -14.085 20.455 8.776 1.00 0.00 O ATOM 795 CB ALA A 53 -11.434 20.937 10.680 1.00 0.00 C ATOM 0 H ALA A 53 -9.786 21.172 8.855 1.00 0.00 H new ATOM 0 HA ALA A 53 -11.839 19.417 9.230 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -12.265 20.657 11.327 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -10.523 20.448 11.026 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -11.299 22.018 10.710 1.00 0.00 H new ATOM 801 N SER A 54 -12.990 22.378 8.367 1.00 0.00 N ATOM 802 CA SER A 54 -14.176 23.080 7.891 1.00 0.00 C ATOM 803 C SER A 54 -14.616 22.542 6.532 1.00 0.00 C ATOM 804 O SER A 54 -15.809 22.468 6.239 1.00 0.00 O ATOM 805 CB SER A 54 -13.901 24.581 7.793 1.00 0.00 C ATOM 806 OG SER A 54 -14.284 25.249 8.983 1.00 0.00 O ATOM 0 H SER A 54 -12.137 22.937 8.357 1.00 0.00 H new ATOM 0 HA SER A 54 -14.980 22.912 8.607 1.00 0.00 H new ATOM 0 HB2 SER A 54 -12.841 24.748 7.604 1.00 0.00 H new ATOM 0 HB3 SER A 54 -14.445 24.999 6.946 1.00 0.00 H new ATOM 0 HG SER A 54 -14.096 26.207 8.895 1.00 0.00 H new ATOM 812 N MET A 55 -13.644 22.170 5.707 1.00 0.00 N ATOM 813 CA MET A 55 -13.930 21.638 4.379 1.00 0.00 C ATOM 814 C MET A 55 -14.708 20.330 4.474 1.00 0.00 C ATOM 815 O MET A 55 -15.780 20.191 3.885 1.00 0.00 O ATOM 816 CB MET A 55 -12.630 21.417 3.604 1.00 0.00 C ATOM 817 CG MET A 55 -11.745 22.651 3.536 1.00 0.00 C ATOM 818 SD MET A 55 -10.146 22.318 2.772 1.00 0.00 S ATOM 819 CE MET A 55 -10.556 22.493 1.038 1.00 0.00 C ATOM 0 H MET A 55 -12.651 22.227 5.934 1.00 0.00 H new ATOM 0 HA MET A 55 -14.542 22.366 3.847 1.00 0.00 H new ATOM 0 HB2 MET A 55 -12.072 20.605 4.071 1.00 0.00 H new ATOM 0 HB3 MET A 55 -12.871 21.097 2.590 1.00 0.00 H new ATOM 0 HG2 MET A 55 -12.258 23.430 2.972 1.00 0.00 H new ATOM 0 HG3 MET A 55 -11.589 23.037 4.543 1.00 0.00 H new ATOM 0 HE1 MET A 55 -9.641 22.618 0.459 1.00 0.00 H new ATOM 0 HE2 MET A 55 -11.083 21.602 0.697 1.00 0.00 H new ATOM 0 HE3 MET A 55 -11.194 23.366 0.901 1.00 0.00 H new ATOM 829 N TRP A 56 -14.162 19.375 5.218 1.00 0.00 N ATOM 830 CA TRP A 56 -14.807 18.077 5.389 1.00 0.00 C ATOM 831 C TRP A 56 -16.219 18.239 5.939 1.00 0.00 C ATOM 832 O TRP A 56 -17.171 17.665 5.410 1.00 0.00 O ATOM 833 CB TRP A 56 -13.979 17.193 6.324 1.00 0.00 C ATOM 834 CG TRP A 56 -14.718 15.981 6.803 1.00 0.00 C ATOM 835 CD1 TRP A 56 -15.502 15.885 7.917 1.00 0.00 C ATOM 836 CD2 TRP A 56 -14.741 14.690 6.183 1.00 0.00 C ATOM 837 NE1 TRP A 56 -16.010 14.613 8.027 1.00 0.00 N ATOM 838 CE2 TRP A 56 -15.559 13.861 6.975 1.00 0.00 C ATOM 839 CE3 TRP A 56 -14.151 14.155 5.034 1.00 0.00 C ATOM 840 CZ2 TRP A 56 -15.799 12.528 6.655 1.00 0.00 C ATOM 841 CZ3 TRP A 56 -14.391 12.831 4.718 1.00 0.00 C ATOM 842 CH2 TRP A 56 -15.209 12.030 5.525 1.00 0.00 C ATOM 0 H TRP A 56 -13.275 19.474 5.712 1.00 0.00 H new ATOM 0 HA TRP A 56 -14.872 17.599 4.411 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -13.074 16.877 5.806 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -13.664 17.782 7.185 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -15.695 16.691 8.610 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -16.624 14.282 8.772 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -13.519 14.765 4.405 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -16.429 11.908 7.276 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -13.940 12.407 3.833 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -15.377 10.999 5.250 1.00 0.00 H new ATOM 853 N ASP A 57 -16.348 19.023 7.004 1.00 0.00 N ATOM 854 CA ASP A 57 -17.646 19.261 7.625 1.00 0.00 C ATOM 855 C ASP A 57 -18.638 19.826 6.613 1.00 0.00 C ATOM 856 O ASP A 57 -19.844 19.840 6.853 1.00 0.00 O ATOM 857 CB ASP A 57 -17.501 20.222 8.806 1.00 0.00 C ATOM 858 CG ASP A 57 -17.559 19.509 10.143 1.00 0.00 C ATOM 859 OD1 ASP A 57 -16.738 18.594 10.363 1.00 0.00 O ATOM 860 OD2 ASP A 57 -18.425 19.865 10.969 1.00 0.00 O ATOM 0 H ASP A 57 -15.570 19.504 7.455 1.00 0.00 H new ATOM 0 HA ASP A 57 -18.028 18.307 7.987 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -16.554 20.755 8.723 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -18.293 20.970 8.762 1.00 0.00 H new ATOM 865 N GLY A 58 -18.119 20.292 5.481 1.00 0.00 N ATOM 866 CA GLY A 58 -18.973 20.852 4.450 1.00 0.00 C ATOM 867 C GLY A 58 -19.025 19.987 3.206 1.00 0.00 C ATOM 868 O GLY A 58 -19.798 20.256 2.285 1.00 0.00 O ATOM 0 H GLY A 58 -17.123 20.292 5.260 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -19.981 20.975 4.845 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -18.612 21.845 4.183 1.00 0.00 H new ATOM 872 N LEU A 59 -18.201 18.945 3.177 1.00 0.00 N ATOM 873 CA LEU A 59 -18.155 18.038 2.036 1.00 0.00 C ATOM 874 C LEU A 59 -19.526 17.425 1.772 1.00 0.00 C ATOM 875 O LEU A 59 -20.344 17.293 2.681 1.00 0.00 O ATOM 876 CB LEU A 59 -17.128 16.931 2.281 1.00 0.00 C ATOM 877 CG LEU A 59 -15.988 16.836 1.266 1.00 0.00 C ATOM 878 CD1 LEU A 59 -14.820 17.711 1.691 1.00 0.00 C ATOM 879 CD2 LEU A 59 -15.541 15.391 1.099 1.00 0.00 C ATOM 0 H LEU A 59 -17.556 18.708 3.931 1.00 0.00 H new ATOM 0 HA LEU A 59 -17.859 18.613 1.158 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -16.695 17.077 3.271 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -17.651 15.975 2.300 1.00 0.00 H new ATOM 0 HG LEU A 59 -16.353 17.196 0.304 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -14.019 17.630 0.956 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -15.148 18.748 1.758 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -14.455 17.383 2.664 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -14.729 15.343 0.373 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -15.194 15.004 2.057 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -16.379 14.789 0.747 1.00 0.00 H new ATOM 891 N GLY A 60 -19.770 17.049 0.520 1.00 0.00 N ATOM 892 CA GLY A 60 -21.043 16.452 0.159 1.00 0.00 C ATOM 893 C GLY A 60 -21.181 15.030 0.666 1.00 0.00 C ATOM 894 O GLY A 60 -20.202 14.287 0.722 1.00 0.00 O ATOM 0 H GLY A 60 -19.109 17.147 -0.251 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -21.853 17.059 0.563 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -21.150 16.460 -0.926 1.00 0.00 H new ATOM 898 N GLU A 61 -22.400 14.652 1.037 1.00 0.00 N ATOM 899 CA GLU A 61 -22.661 13.310 1.545 1.00 0.00 C ATOM 900 C GLU A 61 -22.006 12.256 0.657 1.00 0.00 C ATOM 901 O GLU A 61 -21.434 11.284 1.150 1.00 0.00 O ATOM 902 CB GLU A 61 -24.168 13.057 1.630 1.00 0.00 C ATOM 903 CG GLU A 61 -24.720 13.139 3.043 1.00 0.00 C ATOM 904 CD GLU A 61 -24.377 14.448 3.728 1.00 0.00 C ATOM 905 OE1 GLU A 61 -23.212 14.613 4.143 1.00 0.00 O ATOM 906 OE2 GLU A 61 -25.276 15.307 3.849 1.00 0.00 O ATOM 0 H GLU A 61 -23.222 15.255 0.996 1.00 0.00 H new ATOM 0 HA GLU A 61 -22.231 13.237 2.544 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -24.686 13.784 1.004 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -24.386 12.071 1.220 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -25.803 13.022 3.013 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -24.326 12.311 3.632 1.00 0.00 H new ATOM 913 N GLU A 62 -22.097 12.456 -0.654 1.00 0.00 N ATOM 914 CA GLU A 62 -21.514 11.521 -1.610 1.00 0.00 C ATOM 915 C GLU A 62 -19.994 11.488 -1.481 1.00 0.00 C ATOM 916 O GLU A 62 -19.361 10.470 -1.760 1.00 0.00 O ATOM 917 CB GLU A 62 -21.908 11.907 -3.038 1.00 0.00 C ATOM 918 CG GLU A 62 -21.935 10.731 -4.000 1.00 0.00 C ATOM 919 CD GLU A 62 -23.319 10.467 -4.560 1.00 0.00 C ATOM 920 OE1 GLU A 62 -24.294 10.528 -3.782 1.00 0.00 O ATOM 921 OE2 GLU A 62 -23.427 10.200 -5.775 1.00 0.00 O ATOM 0 H GLU A 62 -22.568 13.255 -1.078 1.00 0.00 H new ATOM 0 HA GLU A 62 -21.901 10.526 -1.390 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -22.893 12.374 -3.021 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -21.207 12.654 -3.410 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -21.245 10.923 -4.822 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -21.579 9.838 -3.486 1.00 0.00 H new ATOM 928 N GLN A 63 -19.417 12.608 -1.058 1.00 0.00 N ATOM 929 CA GLN A 63 -17.972 12.707 -0.894 1.00 0.00 C ATOM 930 C GLN A 63 -17.545 12.203 0.481 1.00 0.00 C ATOM 931 O GLN A 63 -16.434 11.701 0.652 1.00 0.00 O ATOM 932 CB GLN A 63 -17.514 14.154 -1.085 1.00 0.00 C ATOM 933 CG GLN A 63 -17.898 14.740 -2.434 1.00 0.00 C ATOM 934 CD GLN A 63 -17.108 15.989 -2.774 1.00 0.00 C ATOM 935 OE1 GLN A 63 -17.093 16.955 -2.011 1.00 0.00 O ATOM 936 NE2 GLN A 63 -16.446 15.975 -3.925 1.00 0.00 N ATOM 0 H GLN A 63 -19.928 13.459 -0.823 1.00 0.00 H new ATOM 0 HA GLN A 63 -17.501 12.081 -1.652 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -17.944 14.770 -0.295 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -16.431 14.201 -0.972 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -17.738 13.991 -3.210 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -18.962 14.977 -2.434 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -16.487 15.152 -4.527 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -15.897 16.787 -4.207 1.00 0.00 H new ATOM 945 N LYS A 64 -18.433 12.342 1.459 1.00 0.00 N ATOM 946 CA LYS A 64 -18.150 11.900 2.819 1.00 0.00 C ATOM 947 C LYS A 64 -18.190 10.379 2.917 1.00 0.00 C ATOM 948 O LYS A 64 -17.298 9.762 3.498 1.00 0.00 O ATOM 949 CB LYS A 64 -19.157 12.512 3.796 1.00 0.00 C ATOM 950 CG LYS A 64 -18.756 13.887 4.301 1.00 0.00 C ATOM 951 CD LYS A 64 -19.419 14.207 5.631 1.00 0.00 C ATOM 952 CE LYS A 64 -18.918 15.526 6.200 1.00 0.00 C ATOM 953 NZ LYS A 64 -19.654 15.912 7.436 1.00 0.00 N ATOM 0 H LYS A 64 -19.356 12.758 1.335 1.00 0.00 H new ATOM 0 HA LYS A 64 -17.147 12.236 3.082 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -20.128 12.583 3.306 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -19.277 11.842 4.648 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -17.673 13.933 4.413 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -19.033 14.641 3.564 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -20.500 14.254 5.498 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -19.220 13.404 6.341 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -17.854 15.445 6.421 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -19.029 16.310 5.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -19.656 16.948 7.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -20.634 15.568 7.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -19.187 15.490 8.264 1.00 0.00 H new ATOM 967 N GLN A 65 -19.230 9.781 2.345 1.00 0.00 N ATOM 968 CA GLN A 65 -19.385 8.331 2.367 1.00 0.00 C ATOM 969 C GLN A 65 -18.247 7.650 1.614 1.00 0.00 C ATOM 970 O GLN A 65 -17.575 6.767 2.149 1.00 0.00 O ATOM 971 CB GLN A 65 -20.728 7.931 1.756 1.00 0.00 C ATOM 972 CG GLN A 65 -20.810 8.168 0.257 1.00 0.00 C ATOM 973 CD GLN A 65 -22.202 7.937 -0.296 1.00 0.00 C ATOM 974 OE1 GLN A 65 -23.030 8.848 -0.325 1.00 0.00 O ATOM 975 NE2 GLN A 65 -22.468 6.714 -0.739 1.00 0.00 N ATOM 0 H GLN A 65 -19.978 10.278 1.861 1.00 0.00 H new ATOM 0 HA GLN A 65 -19.355 8.004 3.406 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -20.910 6.876 1.959 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -21.523 8.492 2.248 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -20.501 9.190 0.037 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -20.108 7.507 -0.250 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -21.752 5.989 -0.696 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -23.389 6.499 -1.122 1.00 0.00 H new ATOM 984 N VAL A 66 -18.036 8.066 0.369 1.00 0.00 N ATOM 985 CA VAL A 66 -16.978 7.496 -0.458 1.00 0.00 C ATOM 986 C VAL A 66 -15.698 7.299 0.346 1.00 0.00 C ATOM 987 O VAL A 66 -15.083 6.233 0.301 1.00 0.00 O ATOM 988 CB VAL A 66 -16.674 8.391 -1.674 1.00 0.00 C ATOM 989 CG1 VAL A 66 -16.473 9.834 -1.239 1.00 0.00 C ATOM 990 CG2 VAL A 66 -15.454 7.876 -2.422 1.00 0.00 C ATOM 0 H VAL A 66 -18.583 8.795 -0.089 1.00 0.00 H new ATOM 0 HA VAL A 66 -17.336 6.528 -0.808 1.00 0.00 H new ATOM 0 HB VAL A 66 -17.528 8.357 -2.351 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -16.259 10.451 -2.112 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -17.378 10.196 -0.751 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -15.637 9.891 -0.541 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -15.253 8.520 -3.278 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -14.591 7.878 -1.756 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -15.642 6.860 -2.769 1.00 0.00 H new ATOM 1000 N TYR A 67 -15.302 8.332 1.082 1.00 0.00 N ATOM 1001 CA TYR A 67 -14.094 8.273 1.895 1.00 0.00 C ATOM 1002 C TYR A 67 -14.179 7.142 2.916 1.00 0.00 C ATOM 1003 O TYR A 67 -13.191 6.461 3.191 1.00 0.00 O ATOM 1004 CB TYR A 67 -13.870 9.606 2.611 1.00 0.00 C ATOM 1005 CG TYR A 67 -13.166 10.639 1.760 1.00 0.00 C ATOM 1006 CD1 TYR A 67 -11.933 10.366 1.179 1.00 0.00 C ATOM 1007 CD2 TYR A 67 -13.732 11.888 1.539 1.00 0.00 C ATOM 1008 CE1 TYR A 67 -11.286 11.307 0.402 1.00 0.00 C ATOM 1009 CE2 TYR A 67 -13.093 12.834 0.762 1.00 0.00 C ATOM 1010 CZ TYR A 67 -11.870 12.539 0.196 1.00 0.00 C ATOM 1011 OH TYR A 67 -11.229 13.480 -0.578 1.00 0.00 O ATOM 0 H TYR A 67 -15.801 9.220 1.132 1.00 0.00 H new ATOM 0 HA TYR A 67 -13.250 8.078 1.233 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -14.833 10.005 2.929 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -13.284 9.430 3.513 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -11.473 9.402 1.338 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -14.688 12.123 1.982 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -10.328 11.079 -0.042 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -13.548 13.800 0.598 1.00 0.00 H new ATOM 0 HH TYR A 67 -11.861 14.188 -0.823 1.00 0.00 H new ATOM 1021 N LYS A 68 -15.369 6.948 3.475 1.00 0.00 N ATOM 1022 CA LYS A 68 -15.587 5.899 4.465 1.00 0.00 C ATOM 1023 C LYS A 68 -15.463 4.518 3.831 1.00 0.00 C ATOM 1024 O LYS A 68 -14.917 3.593 4.433 1.00 0.00 O ATOM 1025 CB LYS A 68 -16.967 6.055 5.107 1.00 0.00 C ATOM 1026 CG LYS A 68 -17.190 7.415 5.747 1.00 0.00 C ATOM 1027 CD LYS A 68 -17.371 7.300 7.251 1.00 0.00 C ATOM 1028 CE LYS A 68 -17.569 8.664 7.895 1.00 0.00 C ATOM 1029 NZ LYS A 68 -16.676 8.858 9.070 1.00 0.00 N ATOM 0 H LYS A 68 -16.197 7.503 3.260 1.00 0.00 H new ATOM 0 HA LYS A 68 -14.821 5.996 5.235 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -17.732 5.890 4.348 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -17.096 5.281 5.864 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -16.341 8.064 5.530 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -18.070 7.885 5.308 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -18.231 6.666 7.468 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -16.499 6.814 7.687 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -17.375 9.444 7.159 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -18.608 8.771 8.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -17.150 9.463 9.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -16.461 7.935 9.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -15.792 9.311 8.763 1.00 0.00 H new ATOM 1043 N LYS A 69 -15.971 4.384 2.611 1.00 0.00 N ATOM 1044 CA LYS A 69 -15.915 3.116 1.892 1.00 0.00 C ATOM 1045 C LYS A 69 -14.473 2.733 1.577 1.00 0.00 C ATOM 1046 O LYS A 69 -14.087 1.571 1.704 1.00 0.00 O ATOM 1047 CB LYS A 69 -16.726 3.204 0.597 1.00 0.00 C ATOM 1048 CG LYS A 69 -18.007 4.008 0.735 1.00 0.00 C ATOM 1049 CD LYS A 69 -18.766 3.636 1.997 1.00 0.00 C ATOM 1050 CE LYS A 69 -19.441 2.279 1.862 1.00 0.00 C ATOM 1051 NZ LYS A 69 -19.165 1.403 3.034 1.00 0.00 N ATOM 0 H LYS A 69 -16.427 5.139 2.098 1.00 0.00 H new ATOM 0 HA LYS A 69 -16.346 2.345 2.531 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -16.107 3.653 -0.180 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -16.974 2.196 0.264 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -17.770 5.072 0.752 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -18.640 3.837 -0.135 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -18.080 3.620 2.844 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -19.517 4.397 2.209 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -20.517 2.418 1.758 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -19.093 1.789 0.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -19.989 0.794 3.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -18.333 0.811 2.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -18.980 1.991 3.871 1.00 0.00 H new ATOM 1065 N LYS A 70 -13.680 3.717 1.167 1.00 0.00 N ATOM 1066 CA LYS A 70 -12.279 3.484 0.836 1.00 0.00 C ATOM 1067 C LYS A 70 -11.483 3.103 2.080 1.00 0.00 C ATOM 1068 O LYS A 70 -10.549 2.303 2.012 1.00 0.00 O ATOM 1069 CB LYS A 70 -11.672 4.732 0.191 1.00 0.00 C ATOM 1070 CG LYS A 70 -12.337 5.125 -1.117 1.00 0.00 C ATOM 1071 CD LYS A 70 -11.364 5.830 -2.047 1.00 0.00 C ATOM 1072 CE LYS A 70 -12.087 6.763 -3.007 1.00 0.00 C ATOM 1073 NZ LYS A 70 -11.375 6.877 -4.310 1.00 0.00 N ATOM 0 H LYS A 70 -13.984 4.684 1.056 1.00 0.00 H new ATOM 0 HA LYS A 70 -12.231 2.657 0.128 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -11.745 5.565 0.891 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -10.611 4.559 0.012 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -12.731 4.235 -1.608 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -13.185 5.778 -0.913 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -10.644 6.398 -1.459 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -10.799 5.090 -2.614 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -13.099 6.396 -3.177 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -12.178 7.751 -2.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -11.899 7.521 -4.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -10.418 7.251 -4.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -11.311 5.939 -4.754 1.00 0.00 H new ATOM 1087 N THR A 71 -11.858 3.680 3.217 1.00 0.00 N ATOM 1088 CA THR A 71 -11.179 3.401 4.476 1.00 0.00 C ATOM 1089 C THR A 71 -11.271 1.922 4.834 1.00 0.00 C ATOM 1090 O THR A 71 -10.304 1.329 5.311 1.00 0.00 O ATOM 1091 CB THR A 71 -11.769 4.234 5.630 1.00 0.00 C ATOM 1092 OG1 THR A 71 -11.843 5.613 5.250 1.00 0.00 O ATOM 1093 CG2 THR A 71 -10.923 4.094 6.886 1.00 0.00 C ATOM 0 H THR A 71 -12.629 4.344 3.292 1.00 0.00 H new ATOM 0 HA THR A 71 -10.133 3.675 4.338 1.00 0.00 H new ATOM 0 HB THR A 71 -12.771 3.861 5.843 1.00 0.00 H new ATOM 0 HG1 THR A 71 -12.605 5.746 4.648 1.00 0.00 H new ATOM 0 HG21 THR A 71 -11.359 4.691 7.687 1.00 0.00 H new ATOM 0 HG22 THR A 71 -10.892 3.047 7.189 1.00 0.00 H new ATOM 0 HG23 THR A 71 -9.910 4.443 6.683 1.00 0.00 H new ATOM 1101 N GLU A 72 -12.439 1.332 4.601 1.00 0.00 N ATOM 1102 CA GLU A 72 -12.656 -0.078 4.899 1.00 0.00 C ATOM 1103 C GLU A 72 -12.017 -0.964 3.833 1.00 0.00 C ATOM 1104 O GLU A 72 -11.565 -2.072 4.121 1.00 0.00 O ATOM 1105 CB GLU A 72 -14.153 -0.378 4.997 1.00 0.00 C ATOM 1106 CG GLU A 72 -14.904 -0.158 3.695 1.00 0.00 C ATOM 1107 CD GLU A 72 -16.065 -1.119 3.521 1.00 0.00 C ATOM 1108 OE1 GLU A 72 -17.181 -0.789 3.973 1.00 0.00 O ATOM 1109 OE2 GLU A 72 -15.856 -2.200 2.933 1.00 0.00 O ATOM 0 H GLU A 72 -13.250 1.809 4.207 1.00 0.00 H new ATOM 0 HA GLU A 72 -12.186 -0.296 5.858 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -14.288 -1.412 5.314 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -14.591 0.252 5.771 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -15.277 0.866 3.664 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -14.214 -0.272 2.859 1.00 0.00 H new ATOM 1116 N ALA A 73 -11.986 -0.468 2.601 1.00 0.00 N ATOM 1117 CA ALA A 73 -11.402 -1.213 1.492 1.00 0.00 C ATOM 1118 C ALA A 73 -9.882 -1.095 1.492 1.00 0.00 C ATOM 1119 O ALA A 73 -9.183 -1.956 0.957 1.00 0.00 O ATOM 1120 CB ALA A 73 -11.972 -0.722 0.169 1.00 0.00 C ATOM 0 H ALA A 73 -12.358 0.447 2.345 1.00 0.00 H new ATOM 0 HA ALA A 73 -11.658 -2.265 1.618 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -11.527 -1.287 -0.651 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.053 -0.864 0.163 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -11.745 0.337 0.045 1.00 0.00 H new ATOM 1126 N ALA A 74 -9.375 -0.024 2.094 1.00 0.00 N ATOM 1127 CA ALA A 74 -7.938 0.205 2.163 1.00 0.00 C ATOM 1128 C ALA A 74 -7.348 -0.393 3.436 1.00 0.00 C ATOM 1129 O ALA A 74 -6.204 -0.849 3.448 1.00 0.00 O ATOM 1130 CB ALA A 74 -7.636 1.695 2.089 1.00 0.00 C ATOM 0 H ALA A 74 -9.939 0.699 2.541 1.00 0.00 H new ATOM 0 HA ALA A 74 -7.475 -0.291 1.310 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -6.558 1.851 2.142 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -8.015 2.097 1.149 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.118 2.206 2.923 1.00 0.00 H new ATOM 1136 N LYS A 75 -8.134 -0.387 4.507 1.00 0.00 N ATOM 1137 CA LYS A 75 -7.691 -0.930 5.785 1.00 0.00 C ATOM 1138 C LYS A 75 -7.593 -2.451 5.727 1.00 0.00 C ATOM 1139 O LYS A 75 -6.537 -3.026 5.991 1.00 0.00 O ATOM 1140 CB LYS A 75 -8.652 -0.513 6.901 1.00 0.00 C ATOM 1141 CG LYS A 75 -8.646 -1.454 8.093 1.00 0.00 C ATOM 1142 CD LYS A 75 -8.585 -0.691 9.405 1.00 0.00 C ATOM 1143 CE LYS A 75 -9.792 0.218 9.578 1.00 0.00 C ATOM 1144 NZ LYS A 75 -9.396 1.648 9.704 1.00 0.00 N ATOM 0 H LYS A 75 -9.082 -0.011 4.515 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.700 -0.528 5.997 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.390 0.489 7.239 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.663 -0.459 6.497 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -9.542 -2.074 8.073 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.791 -2.127 8.022 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -8.537 -1.396 10.235 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -7.672 -0.096 9.439 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -10.461 0.100 8.725 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -10.350 -0.084 10.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -10.247 2.235 9.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -8.778 1.766 10.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -8.886 1.944 8.847 1.00 0.00 H new ATOM 1158 N LYS A 76 -8.700 -3.097 5.376 1.00 0.00 N ATOM 1159 CA LYS A 76 -8.739 -4.552 5.280 1.00 0.00 C ATOM 1160 C LYS A 76 -7.612 -5.068 4.391 1.00 0.00 C ATOM 1161 O LYS A 76 -6.894 -5.996 4.762 1.00 0.00 O ATOM 1162 CB LYS A 76 -10.090 -5.010 4.726 1.00 0.00 C ATOM 1163 CG LYS A 76 -10.696 -6.175 5.490 1.00 0.00 C ATOM 1164 CD LYS A 76 -11.564 -7.040 4.591 1.00 0.00 C ATOM 1165 CE LYS A 76 -13.008 -7.064 5.066 1.00 0.00 C ATOM 1166 NZ LYS A 76 -13.149 -7.755 6.377 1.00 0.00 N ATOM 0 H LYS A 76 -9.582 -2.636 5.153 1.00 0.00 H new ATOM 0 HA LYS A 76 -8.605 -4.962 6.281 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -10.786 -4.171 4.747 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -9.967 -5.296 3.681 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -9.900 -6.782 5.922 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -11.294 -5.796 6.319 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -11.522 -6.662 3.570 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -11.170 -8.056 4.571 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -13.379 -6.043 5.152 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -13.627 -7.566 4.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -14.156 -7.931 6.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -12.638 -8.661 6.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -12.752 -7.157 7.129 1.00 0.00 H new ATOM 1180 N GLU A 77 -7.463 -4.461 3.218 1.00 0.00 N ATOM 1181 CA GLU A 77 -6.422 -4.860 2.278 1.00 0.00 C ATOM 1182 C GLU A 77 -5.035 -4.623 2.869 1.00 0.00 C ATOM 1183 O GLU A 77 -4.172 -5.499 2.824 1.00 0.00 O ATOM 1184 CB GLU A 77 -6.567 -4.090 0.964 1.00 0.00 C ATOM 1185 CG GLU A 77 -5.718 -2.832 0.900 1.00 0.00 C ATOM 1186 CD GLU A 77 -5.844 -2.110 -0.428 1.00 0.00 C ATOM 1187 OE1 GLU A 77 -6.848 -2.338 -1.135 1.00 0.00 O ATOM 1188 OE2 GLU A 77 -4.939 -1.317 -0.760 1.00 0.00 O ATOM 0 H GLU A 77 -8.050 -3.691 2.896 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.537 -5.926 2.080 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -6.294 -4.745 0.137 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -7.614 -3.820 0.825 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -6.012 -2.158 1.705 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -4.674 -3.094 1.069 1.00 0.00 H new ATOM 1195 N TYR A 78 -4.830 -3.433 3.422 1.00 0.00 N ATOM 1196 CA TYR A 78 -3.548 -3.078 4.019 1.00 0.00 C ATOM 1197 C TYR A 78 -2.957 -4.260 4.782 1.00 0.00 C ATOM 1198 O TYR A 78 -1.743 -4.468 4.784 1.00 0.00 O ATOM 1199 CB TYR A 78 -3.712 -1.881 4.957 1.00 0.00 C ATOM 1200 CG TYR A 78 -2.506 -1.628 5.832 1.00 0.00 C ATOM 1201 CD1 TYR A 78 -1.266 -1.343 5.274 1.00 0.00 C ATOM 1202 CD2 TYR A 78 -2.606 -1.671 7.217 1.00 0.00 C ATOM 1203 CE1 TYR A 78 -0.160 -1.112 6.069 1.00 0.00 C ATOM 1204 CE2 TYR A 78 -1.506 -1.440 8.021 1.00 0.00 C ATOM 1205 CZ TYR A 78 -0.285 -1.161 7.442 1.00 0.00 C ATOM 1206 OH TYR A 78 0.813 -0.929 8.238 1.00 0.00 O ATOM 0 H TYR A 78 -5.535 -2.698 3.469 1.00 0.00 H new ATOM 0 HA TYR A 78 -2.863 -2.809 3.215 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.913 -0.989 4.363 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -4.583 -2.044 5.592 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -1.165 -1.301 4.200 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -3.560 -1.889 7.673 1.00 0.00 H new ATOM 0 HE1 TYR A 78 0.797 -0.894 5.618 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -1.601 -1.478 9.096 1.00 0.00 H new ATOM 0 HH TYR A 78 1.530 -0.533 7.699 1.00 0.00 H new ATOM 1216 N LEU A 79 -3.824 -5.031 5.429 1.00 0.00 N ATOM 1217 CA LEU A 79 -3.390 -6.193 6.197 1.00 0.00 C ATOM 1218 C LEU A 79 -2.924 -7.313 5.272 1.00 0.00 C ATOM 1219 O LEU A 79 -1.880 -7.925 5.497 1.00 0.00 O ATOM 1220 CB LEU A 79 -4.528 -6.693 7.089 1.00 0.00 C ATOM 1221 CG LEU A 79 -5.205 -5.639 7.966 1.00 0.00 C ATOM 1222 CD1 LEU A 79 -6.567 -6.130 8.433 1.00 0.00 C ATOM 1223 CD2 LEU A 79 -4.325 -5.290 9.157 1.00 0.00 C ATOM 0 H LEU A 79 -4.832 -4.873 5.437 1.00 0.00 H new ATOM 0 HA LEU A 79 -2.551 -5.891 6.824 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -5.287 -7.150 6.454 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.138 -7.479 7.736 1.00 0.00 H new ATOM 0 HG LEU A 79 -5.350 -4.737 7.371 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -7.035 -5.368 9.056 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -7.199 -6.329 7.567 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -6.445 -7.046 9.011 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -4.823 -4.539 9.770 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -4.148 -6.185 9.753 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -3.373 -4.896 8.803 1.00 0.00 H new ATOM 1235 N LYS A 80 -3.704 -7.575 4.229 1.00 0.00 N ATOM 1236 CA LYS A 80 -3.371 -8.618 3.266 1.00 0.00 C ATOM 1237 C LYS A 80 -2.058 -8.304 2.556 1.00 0.00 C ATOM 1238 O LYS A 80 -1.143 -9.126 2.535 1.00 0.00 O ATOM 1239 CB LYS A 80 -4.495 -8.771 2.239 1.00 0.00 C ATOM 1240 CG LYS A 80 -5.612 -9.696 2.692 1.00 0.00 C ATOM 1241 CD LYS A 80 -6.750 -8.922 3.336 1.00 0.00 C ATOM 1242 CE LYS A 80 -6.945 -9.325 4.790 1.00 0.00 C ATOM 1243 NZ LYS A 80 -8.039 -8.549 5.438 1.00 0.00 N ATOM 0 H LYS A 80 -4.572 -7.079 4.029 1.00 0.00 H new ATOM 0 HA LYS A 80 -3.254 -9.556 3.810 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -4.914 -7.788 2.022 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.075 -9.151 1.308 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -5.990 -10.257 1.837 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -5.218 -10.423 3.402 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -6.543 -7.853 3.278 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -7.672 -9.099 2.781 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -7.173 -10.389 4.845 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -6.016 -9.170 5.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -8.085 -8.791 6.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -7.851 -7.531 5.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -8.946 -8.782 4.985 1.00 0.00 H new ATOM 1257 N GLN A 81 -1.975 -7.111 1.977 1.00 0.00 N ATOM 1258 CA GLN A 81 -0.773 -6.690 1.267 1.00 0.00 C ATOM 1259 C GLN A 81 0.452 -6.773 2.172 1.00 0.00 C ATOM 1260 O GLN A 81 1.488 -7.313 1.783 1.00 0.00 O ATOM 1261 CB GLN A 81 -0.939 -5.262 0.744 1.00 0.00 C ATOM 1262 CG GLN A 81 -1.516 -5.192 -0.661 1.00 0.00 C ATOM 1263 CD GLN A 81 -1.436 -3.800 -1.256 1.00 0.00 C ATOM 1264 OE1 GLN A 81 -0.530 -3.497 -2.034 1.00 0.00 O ATOM 1265 NE2 GLN A 81 -2.384 -2.945 -0.894 1.00 0.00 N ATOM 0 H GLN A 81 -2.725 -6.419 1.985 1.00 0.00 H new ATOM 0 HA GLN A 81 -0.625 -7.364 0.424 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -1.588 -4.709 1.422 1.00 0.00 H new ATOM 0 HB3 GLN A 81 0.031 -4.765 0.755 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -0.980 -5.890 -1.305 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -2.557 -5.514 -0.639 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -3.116 -3.239 -0.247 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -2.381 -1.994 -1.263 1.00 0.00 H new ATOM 1274 N LEU A 82 0.326 -6.236 3.380 1.00 0.00 N ATOM 1275 CA LEU A 82 1.423 -6.249 4.341 1.00 0.00 C ATOM 1276 C LEU A 82 1.901 -7.674 4.602 1.00 0.00 C ATOM 1277 O LEU A 82 3.102 -7.931 4.683 1.00 0.00 O ATOM 1278 CB LEU A 82 0.985 -5.598 5.654 1.00 0.00 C ATOM 1279 CG LEU A 82 1.974 -5.697 6.816 1.00 0.00 C ATOM 1280 CD1 LEU A 82 3.275 -4.988 6.471 1.00 0.00 C ATOM 1281 CD2 LEU A 82 1.368 -5.116 8.085 1.00 0.00 C ATOM 0 H LEU A 82 -0.525 -5.786 3.718 1.00 0.00 H new ATOM 0 HA LEU A 82 2.250 -5.679 3.918 1.00 0.00 H new ATOM 0 HB2 LEU A 82 0.783 -4.544 5.464 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.044 -6.052 5.965 1.00 0.00 H new ATOM 0 HG LEU A 82 2.193 -6.750 6.992 1.00 0.00 H new ATOM 0 HD11 LEU A 82 3.967 -5.069 7.309 1.00 0.00 H new ATOM 0 HD12 LEU A 82 3.718 -5.450 5.589 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.073 -3.936 6.267 1.00 0.00 H new ATOM 0 HD21 LEU A 82 2.087 -5.195 8.901 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.118 -4.068 7.922 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.464 -5.668 8.343 1.00 0.00 H new ATOM 1293 N ALA A 83 0.953 -8.596 4.731 1.00 0.00 N ATOM 1294 CA ALA A 83 1.278 -9.996 4.978 1.00 0.00 C ATOM 1295 C ALA A 83 2.208 -10.542 3.900 1.00 0.00 C ATOM 1296 O ALA A 83 2.888 -11.547 4.105 1.00 0.00 O ATOM 1297 CB ALA A 83 0.006 -10.828 5.051 1.00 0.00 C ATOM 0 H ALA A 83 -0.046 -8.399 4.669 1.00 0.00 H new ATOM 0 HA ALA A 83 1.796 -10.060 5.935 1.00 0.00 H new ATOM 0 HB1 ALA A 83 0.263 -11.871 5.236 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -0.623 -10.460 5.862 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.535 -10.749 4.108 1.00 0.00 H new ATOM 1303 N ALA A 84 2.233 -9.874 2.752 1.00 0.00 N ATOM 1304 CA ALA A 84 3.081 -10.292 1.643 1.00 0.00 C ATOM 1305 C ALA A 84 4.434 -9.589 1.691 1.00 0.00 C ATOM 1306 O ALA A 84 5.470 -10.195 1.417 1.00 0.00 O ATOM 1307 CB ALA A 84 2.389 -10.018 0.316 1.00 0.00 C ATOM 0 H ALA A 84 1.675 -9.041 2.566 1.00 0.00 H new ATOM 0 HA ALA A 84 3.254 -11.364 1.735 1.00 0.00 H new ATOM 0 HB1 ALA A 84 3.034 -10.335 -0.503 1.00 0.00 H new ATOM 0 HB2 ALA A 84 1.451 -10.571 0.274 1.00 0.00 H new ATOM 0 HB3 ALA A 84 2.186 -8.951 0.225 1.00 0.00 H new ATOM 1313 N TYR A 85 4.417 -8.307 2.038 1.00 0.00 N ATOM 1314 CA TYR A 85 5.642 -7.520 2.119 1.00 0.00 C ATOM 1315 C TYR A 85 6.764 -8.324 2.769 1.00 0.00 C ATOM 1316 O TYR A 85 7.898 -8.326 2.291 1.00 0.00 O ATOM 1317 CB TYR A 85 5.396 -6.234 2.910 1.00 0.00 C ATOM 1318 CG TYR A 85 6.647 -5.662 3.538 1.00 0.00 C ATOM 1319 CD1 TYR A 85 7.834 -5.582 2.821 1.00 0.00 C ATOM 1320 CD2 TYR A 85 6.640 -5.200 4.848 1.00 0.00 C ATOM 1321 CE1 TYR A 85 8.979 -5.060 3.392 1.00 0.00 C ATOM 1322 CE2 TYR A 85 7.780 -4.675 5.426 1.00 0.00 C ATOM 1323 CZ TYR A 85 8.947 -4.608 4.694 1.00 0.00 C ATOM 1324 OH TYR A 85 10.085 -4.086 5.266 1.00 0.00 O ATOM 0 H TYR A 85 3.568 -7.790 2.268 1.00 0.00 H new ATOM 0 HA TYR A 85 5.945 -7.262 1.104 1.00 0.00 H new ATOM 0 HB2 TYR A 85 4.958 -5.488 2.247 1.00 0.00 H new ATOM 0 HB3 TYR A 85 4.665 -6.433 3.693 1.00 0.00 H new ATOM 0 HD1 TYR A 85 7.863 -5.934 1.800 1.00 0.00 H new ATOM 0 HD2 TYR A 85 5.728 -5.252 5.424 1.00 0.00 H new ATOM 0 HE1 TYR A 85 9.894 -5.006 2.821 1.00 0.00 H new ATOM 0 HE2 TYR A 85 7.757 -4.319 6.445 1.00 0.00 H new ATOM 0 HH TYR A 85 9.892 -3.813 6.187 1.00 0.00 H new ATOM 1334 N ARG A 86 6.437 -9.007 3.861 1.00 0.00 N ATOM 1335 CA ARG A 86 7.416 -9.815 4.579 1.00 0.00 C ATOM 1336 C ARG A 86 7.945 -10.940 3.694 1.00 0.00 C ATOM 1337 O ARG A 86 9.119 -11.301 3.768 1.00 0.00 O ATOM 1338 CB ARG A 86 6.794 -10.399 5.848 1.00 0.00 C ATOM 1339 CG ARG A 86 5.998 -9.389 6.657 1.00 0.00 C ATOM 1340 CD ARG A 86 4.560 -9.844 6.857 1.00 0.00 C ATOM 1341 NE ARG A 86 4.485 -11.145 7.517 1.00 0.00 N ATOM 1342 CZ ARG A 86 4.729 -11.328 8.810 1.00 0.00 C ATOM 1343 NH1 ARG A 86 5.061 -10.300 9.578 1.00 0.00 N ATOM 1344 NH2 ARG A 86 4.639 -12.543 9.337 1.00 0.00 N ATOM 0 H ARG A 86 5.502 -9.017 4.268 1.00 0.00 H new ATOM 0 HA ARG A 86 8.250 -9.170 4.856 1.00 0.00 H new ATOM 0 HB2 ARG A 86 6.141 -11.228 5.574 1.00 0.00 H new ATOM 0 HB3 ARG A 86 7.586 -10.810 6.474 1.00 0.00 H new ATOM 0 HG2 ARG A 86 6.473 -9.243 7.627 1.00 0.00 H new ATOM 0 HG3 ARG A 86 6.008 -8.425 6.149 1.00 0.00 H new ATOM 0 HD2 ARG A 86 4.025 -9.104 7.452 1.00 0.00 H new ATOM 0 HD3 ARG A 86 4.059 -9.898 5.890 1.00 0.00 H new ATOM 0 HE ARG A 86 4.231 -11.957 6.954 1.00 0.00 H new ATOM 0 HH11 ARG A 86 5.130 -9.365 9.177 1.00 0.00 H new ATOM 0 HH12 ARG A 86 5.248 -10.444 10.570 1.00 0.00 H new ATOM 0 HH21 ARG A 86 4.383 -13.336 8.749 1.00 0.00 H new ATOM 0 HH22 ARG A 86 4.826 -12.683 10.330 1.00 0.00 H new ATOM 1358 N ALA A 87 7.071 -11.490 2.858 1.00 0.00 N ATOM 1359 CA ALA A 87 7.450 -12.572 1.959 1.00 0.00 C ATOM 1360 C ALA A 87 8.724 -12.229 1.194 1.00 0.00 C ATOM 1361 O ALA A 87 9.532 -13.107 0.891 1.00 0.00 O ATOM 1362 CB ALA A 87 6.316 -12.875 0.990 1.00 0.00 C ATOM 0 H ALA A 87 6.095 -11.204 2.785 1.00 0.00 H new ATOM 0 HA ALA A 87 7.646 -13.459 2.561 1.00 0.00 H new ATOM 0 HB1 ALA A 87 6.613 -13.685 0.324 1.00 0.00 H new ATOM 0 HB2 ALA A 87 5.429 -13.172 1.549 1.00 0.00 H new ATOM 0 HB3 ALA A 87 6.093 -11.985 0.401 1.00 0.00 H new ATOM 1368 N SER A 88 8.897 -10.948 0.885 1.00 0.00 N ATOM 1369 CA SER A 88 10.071 -10.491 0.152 1.00 0.00 C ATOM 1370 C SER A 88 11.261 -10.308 1.090 1.00 0.00 C ATOM 1371 O SER A 88 12.414 -10.314 0.658 1.00 0.00 O ATOM 1372 CB SER A 88 9.768 -9.175 -0.568 1.00 0.00 C ATOM 1373 OG SER A 88 10.657 -8.971 -1.652 1.00 0.00 O ATOM 0 H SER A 88 8.239 -10.208 1.131 1.00 0.00 H new ATOM 0 HA SER A 88 10.326 -11.251 -0.586 1.00 0.00 H new ATOM 0 HB2 SER A 88 8.741 -9.184 -0.933 1.00 0.00 H new ATOM 0 HB3 SER A 88 9.849 -8.345 0.134 1.00 0.00 H new ATOM 0 HG SER A 88 10.442 -8.125 -2.097 1.00 0.00 H new ATOM 1379 N LEU A 89 10.972 -10.145 2.376 1.00 0.00 N ATOM 1380 CA LEU A 89 12.016 -9.961 3.378 1.00 0.00 C ATOM 1381 C LEU A 89 12.681 -11.290 3.723 1.00 0.00 C ATOM 1382 O LEU A 89 13.907 -11.395 3.747 1.00 0.00 O ATOM 1383 CB LEU A 89 11.433 -9.326 4.641 1.00 0.00 C ATOM 1384 CG LEU A 89 11.125 -7.830 4.561 1.00 0.00 C ATOM 1385 CD1 LEU A 89 10.514 -7.340 5.864 1.00 0.00 C ATOM 1386 CD2 LEU A 89 12.386 -7.044 4.231 1.00 0.00 C ATOM 0 H LEU A 89 10.023 -10.136 2.750 1.00 0.00 H new ATOM 0 HA LEU A 89 12.772 -9.296 2.961 1.00 0.00 H new ATOM 0 HB2 LEU A 89 10.513 -9.852 4.897 1.00 0.00 H new ATOM 0 HB3 LEU A 89 12.132 -9.489 5.461 1.00 0.00 H new ATOM 0 HG LEU A 89 10.401 -7.669 3.762 1.00 0.00 H new ATOM 0 HD11 LEU A 89 10.302 -6.274 5.788 1.00 0.00 H new ATOM 0 HD12 LEU A 89 9.588 -7.881 6.058 1.00 0.00 H new ATOM 0 HD13 LEU A 89 11.214 -7.513 6.682 1.00 0.00 H new ATOM 0 HD21 LEU A 89 12.149 -5.981 4.178 1.00 0.00 H new ATOM 0 HD22 LEU A 89 13.132 -7.211 5.008 1.00 0.00 H new ATOM 0 HD23 LEU A 89 12.781 -7.376 3.271 1.00 0.00 H new ATOM 1398 N VAL A 90 11.863 -12.304 3.988 1.00 0.00 N ATOM 1399 CA VAL A 90 12.370 -13.627 4.328 1.00 0.00 C ATOM 1400 C VAL A 90 13.183 -14.216 3.180 1.00 0.00 C ATOM 1401 O VAL A 90 13.151 -13.709 2.059 1.00 0.00 O ATOM 1402 CB VAL A 90 11.225 -14.594 4.681 1.00 0.00 C ATOM 1403 CG1 VAL A 90 10.765 -14.377 6.114 1.00 0.00 C ATOM 1404 CG2 VAL A 90 10.067 -14.424 3.709 1.00 0.00 C ATOM 0 H VAL A 90 10.846 -12.234 3.974 1.00 0.00 H new ATOM 0 HA VAL A 90 13.013 -13.505 5.200 1.00 0.00 H new ATOM 0 HB VAL A 90 11.595 -15.616 4.595 1.00 0.00 H new ATOM 0 HG11 VAL A 90 9.955 -15.069 6.345 1.00 0.00 H new ATOM 0 HG12 VAL A 90 11.598 -14.553 6.794 1.00 0.00 H new ATOM 0 HG13 VAL A 90 10.411 -13.353 6.231 1.00 0.00 H new ATOM 0 HG21 VAL A 90 9.266 -15.115 3.973 1.00 0.00 H new ATOM 0 HG22 VAL A 90 9.695 -13.401 3.761 1.00 0.00 H new ATOM 0 HG23 VAL A 90 10.409 -14.635 2.696 1.00 0.00 H new ATOM 1414 N SER A 91 13.911 -15.290 3.468 1.00 0.00 N ATOM 1415 CA SER A 91 14.735 -15.947 2.460 1.00 0.00 C ATOM 1416 C SER A 91 13.867 -16.679 1.441 1.00 0.00 C ATOM 1417 O SER A 91 13.716 -16.233 0.303 1.00 0.00 O ATOM 1418 CB SER A 91 15.701 -16.931 3.123 1.00 0.00 C ATOM 1419 OG SER A 91 16.814 -16.254 3.682 1.00 0.00 O ATOM 0 H SER A 91 13.947 -15.724 4.391 1.00 0.00 H new ATOM 0 HA SER A 91 15.308 -15.180 1.939 1.00 0.00 H new ATOM 0 HB2 SER A 91 15.180 -17.487 3.903 1.00 0.00 H new ATOM 0 HB3 SER A 91 16.045 -17.659 2.388 1.00 0.00 H new ATOM 0 HG SER A 91 17.416 -16.904 4.101 1.00 0.00 H new ATOM 1425 N LYS A 92 13.298 -17.805 1.857 1.00 0.00 N ATOM 1426 CA LYS A 92 12.443 -18.600 0.984 1.00 0.00 C ATOM 1427 C LYS A 92 13.247 -19.198 -0.166 1.00 0.00 C ATOM 1428 O LYS A 92 13.481 -18.541 -1.181 1.00 0.00 O ATOM 1429 CB LYS A 92 11.304 -17.740 0.430 1.00 0.00 C ATOM 1430 CG LYS A 92 10.158 -18.550 -0.150 1.00 0.00 C ATOM 1431 CD LYS A 92 8.848 -18.250 0.560 1.00 0.00 C ATOM 1432 CE LYS A 92 8.767 -18.963 1.902 1.00 0.00 C ATOM 1433 NZ LYS A 92 7.723 -18.368 2.783 1.00 0.00 N ATOM 0 H LYS A 92 13.414 -18.188 2.795 1.00 0.00 H new ATOM 0 HA LYS A 92 12.022 -19.415 1.573 1.00 0.00 H new ATOM 0 HB2 LYS A 92 10.921 -17.102 1.227 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.700 -17.081 -0.343 1.00 0.00 H new ATOM 0 HG2 LYS A 92 10.056 -18.329 -1.212 1.00 0.00 H new ATOM 0 HG3 LYS A 92 10.383 -19.613 -0.066 1.00 0.00 H new ATOM 0 HD2 LYS A 92 8.753 -17.175 0.711 1.00 0.00 H new ATOM 0 HD3 LYS A 92 8.013 -18.559 -0.069 1.00 0.00 H new ATOM 0 HE2 LYS A 92 8.548 -20.018 1.740 1.00 0.00 H new ATOM 0 HE3 LYS A 92 9.735 -18.911 2.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 7.699 -18.881 3.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 7.946 -17.367 2.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 6.795 -18.440 2.319 1.00 0.00 H new ATOM 1447 N SER A 93 13.667 -20.448 -0.001 1.00 0.00 N ATOM 1448 CA SER A 93 14.447 -21.134 -1.025 1.00 0.00 C ATOM 1449 C SER A 93 13.547 -21.628 -2.154 1.00 0.00 C ATOM 1450 O SER A 93 12.944 -22.697 -2.059 1.00 0.00 O ATOM 1451 CB SER A 93 15.209 -22.311 -0.413 1.00 0.00 C ATOM 1452 OG SER A 93 16.573 -22.289 -0.794 1.00 0.00 O ATOM 0 H SER A 93 13.480 -21.007 0.832 1.00 0.00 H new ATOM 0 HA SER A 93 15.162 -20.423 -1.439 1.00 0.00 H new ATOM 0 HB2 SER A 93 15.131 -22.273 0.674 1.00 0.00 H new ATOM 0 HB3 SER A 93 14.754 -23.248 -0.733 1.00 0.00 H new ATOM 0 HG SER A 93 17.038 -23.050 -0.389 1.00 0.00 H new ATOM 1458 N TYR A 94 13.462 -20.842 -3.221 1.00 0.00 N ATOM 1459 CA TYR A 94 12.634 -21.197 -4.368 1.00 0.00 C ATOM 1460 C TYR A 94 13.132 -20.506 -5.633 1.00 0.00 C ATOM 1461 O TYR A 94 13.378 -21.152 -6.653 1.00 0.00 O ATOM 1462 CB TYR A 94 11.175 -20.818 -4.107 1.00 0.00 C ATOM 1463 CG TYR A 94 10.208 -21.963 -4.304 1.00 0.00 C ATOM 1464 CD1 TYR A 94 9.968 -22.878 -3.287 1.00 0.00 C ATOM 1465 CD2 TYR A 94 9.534 -22.130 -5.508 1.00 0.00 C ATOM 1466 CE1 TYR A 94 9.085 -23.926 -3.462 1.00 0.00 C ATOM 1467 CE2 TYR A 94 8.649 -23.174 -5.692 1.00 0.00 C ATOM 1468 CZ TYR A 94 8.428 -24.070 -4.666 1.00 0.00 C ATOM 1469 OH TYR A 94 7.548 -25.112 -4.846 1.00 0.00 O ATOM 0 H TYR A 94 13.956 -19.955 -3.316 1.00 0.00 H new ATOM 0 HA TYR A 94 12.702 -22.275 -4.514 1.00 0.00 H new ATOM 0 HB2 TYR A 94 11.082 -20.446 -3.087 1.00 0.00 H new ATOM 0 HB3 TYR A 94 10.896 -20.000 -4.771 1.00 0.00 H new ATOM 0 HD1 TYR A 94 10.481 -22.768 -2.343 1.00 0.00 H new ATOM 0 HD2 TYR A 94 9.705 -21.431 -6.313 1.00 0.00 H new ATOM 0 HE1 TYR A 94 8.910 -24.628 -2.661 1.00 0.00 H new ATOM 0 HE2 TYR A 94 8.133 -23.289 -6.634 1.00 0.00 H new ATOM 0 HH TYR A 94 7.170 -25.069 -5.749 1.00 0.00 H new ATOM 1479 N THR A 95 13.280 -19.187 -5.561 1.00 0.00 N ATOM 1480 CA THR A 95 13.748 -18.406 -6.699 1.00 0.00 C ATOM 1481 C THR A 95 14.785 -17.375 -6.270 1.00 0.00 C ATOM 1482 O THR A 95 15.054 -17.209 -5.080 1.00 0.00 O ATOM 1483 CB THR A 95 12.583 -17.684 -7.403 1.00 0.00 C ATOM 1484 OG1 THR A 95 11.821 -16.937 -6.447 1.00 0.00 O ATOM 1485 CG2 THR A 95 11.678 -18.680 -8.112 1.00 0.00 C ATOM 0 H THR A 95 13.082 -18.637 -4.725 1.00 0.00 H new ATOM 0 HA THR A 95 14.205 -19.108 -7.397 1.00 0.00 H new ATOM 0 HB THR A 95 13.001 -17.005 -8.146 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.083 -16.480 -6.902 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.863 -18.147 -8.601 1.00 0.00 H new ATOM 0 HG22 THR A 95 12.254 -19.227 -8.858 1.00 0.00 H new ATOM 0 HG23 THR A 95 11.268 -19.381 -7.385 1.00 0.00 H new ATOM 1493 N ASP A 96 15.363 -16.683 -7.245 1.00 0.00 N ATOM 1494 CA ASP A 96 16.370 -15.665 -6.968 1.00 0.00 C ATOM 1495 C ASP A 96 15.885 -14.287 -7.405 1.00 0.00 C ATOM 1496 O ASP A 96 15.861 -13.346 -6.612 1.00 0.00 O ATOM 1497 CB ASP A 96 17.681 -16.007 -7.678 1.00 0.00 C ATOM 1498 CG ASP A 96 18.893 -15.452 -6.956 1.00 0.00 C ATOM 1499 OD1 ASP A 96 19.215 -15.959 -5.862 1.00 0.00 O ATOM 1500 OD2 ASP A 96 19.518 -14.508 -7.485 1.00 0.00 O ATOM 0 H ASP A 96 15.152 -16.808 -8.235 1.00 0.00 H new ATOM 0 HA ASP A 96 16.543 -15.645 -5.892 1.00 0.00 H new ATOM 0 HB2 ASP A 96 17.775 -17.090 -7.759 1.00 0.00 H new ATOM 0 HB3 ASP A 96 17.654 -15.612 -8.694 1.00 0.00 H new ATOM 1505 N SER A 97 15.500 -14.176 -8.673 1.00 0.00 N ATOM 1506 CA SER A 97 15.020 -12.911 -9.217 1.00 0.00 C ATOM 1507 C SER A 97 16.179 -11.948 -9.457 1.00 0.00 C ATOM 1508 O SER A 97 16.934 -11.627 -8.541 1.00 0.00 O ATOM 1509 CB SER A 97 14.003 -12.276 -8.268 1.00 0.00 C ATOM 1510 OG SER A 97 13.174 -11.351 -8.951 1.00 0.00 O ATOM 0 H SER A 97 15.511 -14.946 -9.342 1.00 0.00 H new ATOM 0 HA SER A 97 14.536 -13.115 -10.172 1.00 0.00 H new ATOM 0 HB2 SER A 97 13.388 -13.054 -7.815 1.00 0.00 H new ATOM 0 HB3 SER A 97 14.525 -11.770 -7.456 1.00 0.00 H new ATOM 0 HG SER A 97 12.532 -10.961 -8.322 1.00 0.00 H new ATOM 1516 N GLY A 98 16.312 -11.490 -10.698 1.00 0.00 N ATOM 1517 CA GLY A 98 17.380 -10.568 -11.038 1.00 0.00 C ATOM 1518 C GLY A 98 17.062 -9.738 -12.266 1.00 0.00 C ATOM 1519 O GLY A 98 17.343 -10.131 -13.398 1.00 0.00 O ATOM 0 H GLY A 98 15.699 -11.741 -11.474 1.00 0.00 H new ATOM 0 HA2 GLY A 98 17.565 -9.905 -10.193 1.00 0.00 H new ATOM 0 HA3 GLY A 98 18.299 -11.129 -11.211 1.00 0.00 H new ATOM 1523 N PRO A 99 16.458 -8.560 -12.048 1.00 0.00 N ATOM 1524 CA PRO A 99 16.086 -7.649 -13.134 1.00 0.00 C ATOM 1525 C PRO A 99 17.302 -7.013 -13.799 1.00 0.00 C ATOM 1526 O PRO A 99 18.242 -6.592 -13.125 1.00 0.00 O ATOM 1527 CB PRO A 99 15.244 -6.582 -12.429 1.00 0.00 C ATOM 1528 CG PRO A 99 15.714 -6.602 -11.015 1.00 0.00 C ATOM 1529 CD PRO A 99 16.092 -8.028 -10.725 1.00 0.00 C ATOM 0 HA PRO A 99 15.560 -8.165 -13.937 1.00 0.00 H new ATOM 0 HB2 PRO A 99 15.389 -5.601 -12.881 1.00 0.00 H new ATOM 0 HB3 PRO A 99 14.180 -6.809 -12.496 1.00 0.00 H new ATOM 0 HG2 PRO A 99 16.566 -5.937 -10.878 1.00 0.00 H new ATOM 0 HG3 PRO A 99 14.931 -6.261 -10.338 1.00 0.00 H new ATOM 0 HD2 PRO A 99 16.924 -8.088 -10.023 1.00 0.00 H new ATOM 0 HD3 PRO A 99 15.263 -8.582 -10.285 1.00 0.00 H new ATOM 1537 N SER A 100 17.277 -6.947 -15.127 1.00 0.00 N ATOM 1538 CA SER A 100 18.380 -6.366 -15.884 1.00 0.00 C ATOM 1539 C SER A 100 17.858 -5.475 -17.007 1.00 0.00 C ATOM 1540 O SER A 100 17.086 -5.918 -17.858 1.00 0.00 O ATOM 1541 CB SER A 100 19.267 -7.470 -16.463 1.00 0.00 C ATOM 1542 OG SER A 100 18.563 -8.237 -17.424 1.00 0.00 O ATOM 0 H SER A 100 16.506 -7.288 -15.700 1.00 0.00 H new ATOM 0 HA SER A 100 18.972 -5.754 -15.204 1.00 0.00 H new ATOM 0 HB2 SER A 100 20.151 -7.027 -16.923 1.00 0.00 H new ATOM 0 HB3 SER A 100 19.616 -8.119 -15.660 1.00 0.00 H new ATOM 0 HG SER A 100 17.829 -7.703 -17.795 1.00 0.00 H new ATOM 1548 N SER A 101 18.284 -4.216 -17.002 1.00 0.00 N ATOM 1549 CA SER A 101 17.858 -3.261 -18.018 1.00 0.00 C ATOM 1550 C SER A 101 18.964 -2.253 -18.315 1.00 0.00 C ATOM 1551 O SER A 101 19.846 -2.021 -17.489 1.00 0.00 O ATOM 1552 CB SER A 101 16.595 -2.529 -17.561 1.00 0.00 C ATOM 1553 OG SER A 101 16.004 -1.813 -18.632 1.00 0.00 O ATOM 0 H SER A 101 18.924 -3.834 -16.306 1.00 0.00 H new ATOM 0 HA SER A 101 17.640 -3.814 -18.932 1.00 0.00 H new ATOM 0 HB2 SER A 101 15.879 -3.247 -17.161 1.00 0.00 H new ATOM 0 HB3 SER A 101 16.842 -1.841 -16.752 1.00 0.00 H new ATOM 0 HG SER A 101 15.198 -1.355 -18.314 1.00 0.00 H new ATOM 1559 N GLY A 102 18.910 -1.657 -19.502 1.00 0.00 N ATOM 1560 CA GLY A 102 19.913 -0.682 -19.889 1.00 0.00 C ATOM 1561 C GLY A 102 19.556 0.039 -21.174 1.00 0.00 C ATOM 1562 O GLY A 102 20.221 -0.132 -22.195 1.00 0.00 O ATOM 0 H GLY A 102 18.190 -1.832 -20.203 1.00 0.00 H new ATOM 0 HA2 GLY A 102 20.034 0.048 -19.088 1.00 0.00 H new ATOM 0 HA3 GLY A 102 20.873 -1.183 -20.012 1.00 0.00 H new TER 1566 GLY A 102