USER MOD reduce.3.24.130724 H: found=0, std=0, add=790, rem=0, adj=24 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+ -104:sc= 0.0524 (180deg=0) USER MOD Single : A 2 SER OG : rot 76:sc= 0.442 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=-0.000942 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -0.0194 X(o=-0.019,f=0) 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 USER MOD Single : A 25 TYR OH : rot 180:sc= -0.0029 USER MOD Single : A 32 THR OG1 : rot 164:sc= -0.363! USER MOD Single : A 33 GLN : amide:sc= -0.271 X(o=-0.27,f=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= -5.14! C(o=-5.1!,f=-9.3!) USER MOD Single : A 40 ASN : amide:sc= -0.147 X(o=-0.15,f=-0.53) USER MOD Single : A 42 ASN : amide:sc= -0.137 K(o=-0.14,f=-2.4!) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.0165 USER MOD Single : A 49 SER OG : rot -62:sc= 0.558 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 166:sc= -0.154 (180deg=-0.24) USER MOD Single : A 63 GLN : amide:sc= -1.24 K(o=-1.2,f=-0.18) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 GLN : amide:sc= -0.877 K(o=-0.88,f=-2.8!) USER MOD Single : A 67 TYR OH : rot 165:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 87:sc= 1.02 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 TYR OH : rot 180:sc= -0.0928 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= -0.115 X(o=-0.12,f=0) USER MOD Single : A 85 TYR OH : rot 180:sc= -0.202 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 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 34.039 29.717 -20.304 1.00 0.00 N ATOM 2 CA GLY A 1 33.631 29.307 -18.973 1.00 0.00 C ATOM 3 C GLY A 1 33.179 27.860 -18.925 1.00 0.00 C ATOM 4 O GLY A 1 32.896 27.257 -19.960 1.00 0.00 O ATOM 0 H1 GLY A 1 35.077 29.760 -20.351 1.00 0.00 H new ATOM 0 H2 GLY A 1 33.689 29.030 -21.002 1.00 0.00 H new ATOM 0 H3 GLY A 1 33.644 30.656 -20.515 1.00 0.00 H new ATOM 0 HA2 GLY A 1 34.462 29.448 -18.282 1.00 0.00 H new ATOM 0 HA3 GLY A 1 32.820 29.949 -18.631 1.00 0.00 H new ATOM 8 N SER A 2 33.114 27.302 -17.720 1.00 0.00 N ATOM 9 CA SER A 2 32.700 25.915 -17.542 1.00 0.00 C ATOM 10 C SER A 2 33.014 25.432 -16.129 1.00 0.00 C ATOM 11 O SER A 2 33.661 26.133 -15.351 1.00 0.00 O ATOM 12 CB SER A 2 33.395 25.017 -18.567 1.00 0.00 C ATOM 13 OG SER A 2 32.487 24.586 -19.566 1.00 0.00 O ATOM 0 H SER A 2 33.343 27.789 -16.853 1.00 0.00 H new ATOM 0 HA SER A 2 31.622 25.861 -17.695 1.00 0.00 H new ATOM 0 HB2 SER A 2 34.220 25.559 -19.030 1.00 0.00 H new ATOM 0 HB3 SER A 2 33.825 24.151 -18.064 1.00 0.00 H new ATOM 0 HG SER A 2 32.314 25.321 -20.190 1.00 0.00 H new ATOM 19 N SER A 3 32.550 24.229 -15.805 1.00 0.00 N ATOM 20 CA SER A 3 32.777 23.652 -14.486 1.00 0.00 C ATOM 21 C SER A 3 32.105 24.492 -13.403 1.00 0.00 C ATOM 22 O SER A 3 32.178 25.720 -13.420 1.00 0.00 O ATOM 23 CB SER A 3 34.276 23.542 -14.205 1.00 0.00 C ATOM 24 OG SER A 3 34.516 23.039 -12.902 1.00 0.00 O ATOM 0 H SER A 3 32.015 23.635 -16.438 1.00 0.00 H new ATOM 0 HA SER A 3 32.338 22.654 -14.473 1.00 0.00 H new ATOM 0 HB2 SER A 3 34.740 22.887 -14.942 1.00 0.00 H new ATOM 0 HB3 SER A 3 34.742 24.522 -14.311 1.00 0.00 H new ATOM 0 HG SER A 3 35.482 22.977 -12.748 1.00 0.00 H new ATOM 30 N GLY A 4 31.451 23.818 -12.461 1.00 0.00 N ATOM 31 CA GLY A 4 30.776 24.517 -11.384 1.00 0.00 C ATOM 32 C GLY A 4 29.694 23.676 -10.736 1.00 0.00 C ATOM 33 O GLY A 4 29.298 22.641 -11.272 1.00 0.00 O ATOM 0 H GLY A 4 31.377 22.801 -12.425 1.00 0.00 H new ATOM 0 HA2 GLY A 4 31.507 24.808 -10.629 1.00 0.00 H new ATOM 0 HA3 GLY A 4 30.335 25.436 -11.771 1.00 0.00 H new ATOM 37 N SER A 5 29.215 24.120 -9.578 1.00 0.00 N ATOM 38 CA SER A 5 28.176 23.398 -8.853 1.00 0.00 C ATOM 39 C SER A 5 28.655 22.003 -8.464 1.00 0.00 C ATOM 40 O SER A 5 29.201 21.269 -9.288 1.00 0.00 O ATOM 41 CB SER A 5 26.909 23.295 -9.703 1.00 0.00 C ATOM 42 OG SER A 5 26.054 24.404 -9.480 1.00 0.00 O ATOM 0 H SER A 5 29.530 24.976 -9.122 1.00 0.00 H new ATOM 0 HA SER A 5 27.950 23.953 -7.943 1.00 0.00 H new ATOM 0 HB2 SER A 5 27.178 23.246 -10.758 1.00 0.00 H new ATOM 0 HB3 SER A 5 26.382 22.371 -9.465 1.00 0.00 H new ATOM 0 HG SER A 5 25.252 24.316 -10.036 1.00 0.00 H new ATOM 48 N SER A 6 28.447 21.643 -7.201 1.00 0.00 N ATOM 49 CA SER A 6 28.860 20.338 -6.700 1.00 0.00 C ATOM 50 C SER A 6 28.397 20.137 -5.260 1.00 0.00 C ATOM 51 O SER A 6 28.222 21.098 -4.513 1.00 0.00 O ATOM 52 CB SER A 6 30.381 20.194 -6.783 1.00 0.00 C ATOM 53 OG SER A 6 30.809 18.964 -6.225 1.00 0.00 O ATOM 0 H SER A 6 27.995 22.237 -6.506 1.00 0.00 H new ATOM 0 HA SER A 6 28.395 19.574 -7.323 1.00 0.00 H new ATOM 0 HB2 SER A 6 30.699 20.255 -7.824 1.00 0.00 H new ATOM 0 HB3 SER A 6 30.857 21.021 -6.256 1.00 0.00 H new ATOM 0 HG SER A 6 31.784 18.896 -6.292 1.00 0.00 H new ATOM 59 N GLY A 7 28.201 18.879 -4.878 1.00 0.00 N ATOM 60 CA GLY A 7 27.759 18.573 -3.530 1.00 0.00 C ATOM 61 C GLY A 7 27.043 17.240 -3.442 1.00 0.00 C ATOM 62 O GLY A 7 25.827 17.167 -3.620 1.00 0.00 O ATOM 0 H GLY A 7 28.340 18.066 -5.478 1.00 0.00 H new ATOM 0 HA2 GLY A 7 28.620 18.564 -2.862 1.00 0.00 H new ATOM 0 HA3 GLY A 7 27.094 19.363 -3.181 1.00 0.00 H new ATOM 66 N LYS A 8 27.798 16.181 -3.170 1.00 0.00 N ATOM 67 CA LYS A 8 27.229 14.843 -3.059 1.00 0.00 C ATOM 68 C LYS A 8 26.738 14.577 -1.640 1.00 0.00 C ATOM 69 O LYS A 8 27.257 15.139 -0.676 1.00 0.00 O ATOM 70 CB LYS A 8 28.267 13.791 -3.457 1.00 0.00 C ATOM 71 CG LYS A 8 28.711 13.892 -4.906 1.00 0.00 C ATOM 72 CD LYS A 8 27.963 12.906 -5.788 1.00 0.00 C ATOM 73 CE LYS A 8 27.365 13.591 -7.007 1.00 0.00 C ATOM 74 NZ LYS A 8 25.933 13.945 -6.797 1.00 0.00 N ATOM 0 H LYS A 8 28.806 16.224 -3.022 1.00 0.00 H new ATOM 0 HA LYS A 8 26.378 14.779 -3.737 1.00 0.00 H new ATOM 0 HB2 LYS A 8 29.139 13.891 -2.811 1.00 0.00 H new ATOM 0 HB3 LYS A 8 27.852 12.799 -3.281 1.00 0.00 H new ATOM 0 HG2 LYS A 8 28.544 14.906 -5.269 1.00 0.00 H new ATOM 0 HG3 LYS A 8 29.782 13.702 -4.973 1.00 0.00 H new ATOM 0 HD2 LYS A 8 28.642 12.116 -6.110 1.00 0.00 H new ATOM 0 HD3 LYS A 8 27.170 12.429 -5.212 1.00 0.00 H new ATOM 0 HE2 LYS A 8 27.933 14.494 -7.232 1.00 0.00 H new ATOM 0 HE3 LYS A 8 27.454 12.935 -7.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 25.562 14.410 -7.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 25.386 13.081 -6.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 25.850 14.592 -5.987 1.00 0.00 H new ATOM 88 N LYS A 9 25.734 13.714 -1.519 1.00 0.00 N ATOM 89 CA LYS A 9 25.174 13.370 -0.218 1.00 0.00 C ATOM 90 C LYS A 9 24.740 11.908 -0.181 1.00 0.00 C ATOM 91 O LYS A 9 24.393 11.326 -1.210 1.00 0.00 O ATOM 92 CB LYS A 9 23.981 14.274 0.102 1.00 0.00 C ATOM 93 CG LYS A 9 24.379 15.675 0.533 1.00 0.00 C ATOM 94 CD LYS A 9 23.889 16.722 -0.453 1.00 0.00 C ATOM 95 CE LYS A 9 24.933 17.805 -0.680 1.00 0.00 C ATOM 96 NZ LYS A 9 24.669 19.012 0.152 1.00 0.00 N ATOM 0 H LYS A 9 25.292 13.240 -2.307 1.00 0.00 H new ATOM 0 HA LYS A 9 25.949 13.520 0.534 1.00 0.00 H new ATOM 0 HB2 LYS A 9 23.341 14.341 -0.777 1.00 0.00 H new ATOM 0 HB3 LYS A 9 23.389 13.814 0.893 1.00 0.00 H new ATOM 0 HG2 LYS A 9 23.968 15.883 1.521 1.00 0.00 H new ATOM 0 HG3 LYS A 9 25.464 15.735 0.620 1.00 0.00 H new ATOM 0 HD2 LYS A 9 23.646 16.244 -1.402 1.00 0.00 H new ATOM 0 HD3 LYS A 9 22.970 17.174 -0.079 1.00 0.00 H new ATOM 0 HE2 LYS A 9 25.922 17.411 -0.445 1.00 0.00 H new ATOM 0 HE3 LYS A 9 24.943 18.085 -1.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.402 19.727 -0.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 23.736 19.403 -0.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 24.685 18.750 1.158 1.00 0.00 H new ATOM 110 N LYS A 10 24.762 11.318 1.009 1.00 0.00 N ATOM 111 CA LYS A 10 24.369 9.925 1.181 1.00 0.00 C ATOM 112 C LYS A 10 22.936 9.823 1.694 1.00 0.00 C ATOM 113 O LYS A 10 22.453 10.709 2.399 1.00 0.00 O ATOM 114 CB LYS A 10 25.320 9.221 2.151 1.00 0.00 C ATOM 115 CG LYS A 10 26.640 8.812 1.519 1.00 0.00 C ATOM 116 CD LYS A 10 27.823 9.403 2.267 1.00 0.00 C ATOM 117 CE LYS A 10 29.145 8.965 1.654 1.00 0.00 C ATOM 118 NZ LYS A 10 29.782 7.868 2.435 1.00 0.00 N ATOM 0 H LYS A 10 25.048 11.784 1.870 1.00 0.00 H new ATOM 0 HA LYS A 10 24.424 9.436 0.208 1.00 0.00 H new ATOM 0 HB2 LYS A 10 25.520 9.882 2.995 1.00 0.00 H new ATOM 0 HB3 LYS A 10 24.828 8.334 2.550 1.00 0.00 H new ATOM 0 HG2 LYS A 10 26.719 7.725 1.511 1.00 0.00 H new ATOM 0 HG3 LYS A 10 26.664 9.141 0.480 1.00 0.00 H new ATOM 0 HD2 LYS A 10 27.757 10.491 2.253 1.00 0.00 H new ATOM 0 HD3 LYS A 10 27.785 9.095 3.312 1.00 0.00 H new ATOM 0 HE2 LYS A 10 28.978 8.632 0.630 1.00 0.00 H new ATOM 0 HE3 LYS A 10 29.823 9.817 1.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 30.680 7.598 1.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 29.965 8.194 3.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 29.146 7.045 2.460 1.00 0.00 H new ATOM 132 N LYS A 11 22.261 8.736 1.337 1.00 0.00 N ATOM 133 CA LYS A 11 20.884 8.515 1.763 1.00 0.00 C ATOM 134 C LYS A 11 20.548 7.027 1.772 1.00 0.00 C ATOM 135 O LYS A 11 21.184 6.233 1.079 1.00 0.00 O ATOM 136 CB LYS A 11 19.917 9.262 0.841 1.00 0.00 C ATOM 137 CG LYS A 11 18.459 9.112 1.239 1.00 0.00 C ATOM 138 CD LYS A 11 17.564 10.045 0.440 1.00 0.00 C ATOM 139 CE LYS A 11 16.232 10.271 1.137 1.00 0.00 C ATOM 140 NZ LYS A 11 15.084 10.133 0.198 1.00 0.00 N ATOM 0 H LYS A 11 22.646 7.993 0.753 1.00 0.00 H new ATOM 0 HA LYS A 11 20.779 8.899 2.778 1.00 0.00 H new ATOM 0 HB2 LYS A 11 20.177 10.321 0.837 1.00 0.00 H new ATOM 0 HB3 LYS A 11 20.046 8.898 -0.178 1.00 0.00 H new ATOM 0 HG2 LYS A 11 18.143 8.081 1.083 1.00 0.00 H new ATOM 0 HG3 LYS A 11 18.348 9.322 2.303 1.00 0.00 H new ATOM 0 HD2 LYS A 11 18.068 11.001 0.297 1.00 0.00 H new ATOM 0 HD3 LYS A 11 17.391 9.625 -0.551 1.00 0.00 H new ATOM 0 HE2 LYS A 11 16.123 9.555 1.952 1.00 0.00 H new ATOM 0 HE3 LYS A 11 16.219 11.266 1.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 14.194 10.294 0.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 15.175 10.833 -0.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 15.081 9.175 -0.208 1.00 0.00 H new ATOM 154 N LYS A 12 19.544 6.656 2.560 1.00 0.00 N ATOM 155 CA LYS A 12 19.121 5.264 2.657 1.00 0.00 C ATOM 156 C LYS A 12 18.651 4.743 1.303 1.00 0.00 C ATOM 157 O LYS A 12 17.789 5.343 0.660 1.00 0.00 O ATOM 158 CB LYS A 12 18.000 5.121 3.688 1.00 0.00 C ATOM 159 CG LYS A 12 16.646 5.588 3.183 1.00 0.00 C ATOM 160 CD LYS A 12 15.775 6.103 4.317 1.00 0.00 C ATOM 161 CE LYS A 12 16.116 7.542 4.672 1.00 0.00 C ATOM 162 NZ LYS A 12 15.202 8.088 5.714 1.00 0.00 N ATOM 0 H LYS A 12 19.008 7.301 3.141 1.00 0.00 H new ATOM 0 HA LYS A 12 19.978 4.671 2.977 1.00 0.00 H new ATOM 0 HB2 LYS A 12 17.926 4.076 3.989 1.00 0.00 H new ATOM 0 HB3 LYS A 12 18.262 5.691 4.579 1.00 0.00 H new ATOM 0 HG2 LYS A 12 16.785 6.376 2.443 1.00 0.00 H new ATOM 0 HG3 LYS A 12 16.140 4.764 2.680 1.00 0.00 H new ATOM 0 HD2 LYS A 12 14.726 6.037 4.030 1.00 0.00 H new ATOM 0 HD3 LYS A 12 15.906 5.470 5.194 1.00 0.00 H new ATOM 0 HE2 LYS A 12 17.145 7.594 5.028 1.00 0.00 H new ATOM 0 HE3 LYS A 12 16.057 8.161 3.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 15.467 9.071 5.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 14.223 8.062 5.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 15.277 7.513 6.577 1.00 0.00 H new ATOM 176 N LYS A 13 19.221 3.622 0.875 1.00 0.00 N ATOM 177 CA LYS A 13 18.858 3.017 -0.401 1.00 0.00 C ATOM 178 C LYS A 13 17.375 3.220 -0.698 1.00 0.00 C ATOM 179 O LYS A 13 17.001 4.114 -1.456 1.00 0.00 O ATOM 180 CB LYS A 13 19.187 1.523 -0.393 1.00 0.00 C ATOM 181 CG LYS A 13 20.674 1.227 -0.493 1.00 0.00 C ATOM 182 CD LYS A 13 20.953 0.087 -1.458 1.00 0.00 C ATOM 183 CE LYS A 13 22.309 0.243 -2.128 1.00 0.00 C ATOM 184 NZ LYS A 13 22.331 -0.369 -3.485 1.00 0.00 N ATOM 0 H LYS A 13 19.937 3.113 1.394 1.00 0.00 H new ATOM 0 HA LYS A 13 19.438 3.506 -1.184 1.00 0.00 H new ATOM 0 HB2 LYS A 13 18.797 1.079 0.523 1.00 0.00 H new ATOM 0 HB3 LYS A 13 18.673 1.042 -1.225 1.00 0.00 H new ATOM 0 HG2 LYS A 13 21.202 2.121 -0.823 1.00 0.00 H new ATOM 0 HG3 LYS A 13 21.062 0.973 0.493 1.00 0.00 H new ATOM 0 HD2 LYS A 13 20.918 -0.862 -0.922 1.00 0.00 H new ATOM 0 HD3 LYS A 13 20.172 0.053 -2.218 1.00 0.00 H new ATOM 0 HE2 LYS A 13 22.557 1.302 -2.203 1.00 0.00 H new ATOM 0 HE3 LYS A 13 23.076 -0.221 -1.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 23.272 -0.241 -3.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 22.119 -1.385 -3.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 21.617 0.091 -4.085 1.00 0.00 H new ATOM 198 N ASP A 14 16.537 2.385 -0.093 1.00 0.00 N ATOM 199 CA ASP A 14 15.095 2.475 -0.291 1.00 0.00 C ATOM 200 C ASP A 14 14.346 1.850 0.883 1.00 0.00 C ATOM 201 O ASP A 14 14.741 0.817 1.423 1.00 0.00 O ATOM 202 CB ASP A 14 14.693 1.784 -1.594 1.00 0.00 C ATOM 203 CG ASP A 14 13.190 1.739 -1.787 1.00 0.00 C ATOM 204 OD1 ASP A 14 12.551 0.806 -1.258 1.00 0.00 O ATOM 205 OD2 ASP A 14 12.651 2.638 -2.467 1.00 0.00 O ATOM 0 H ASP A 14 16.831 1.639 0.538 1.00 0.00 H new ATOM 0 HA ASP A 14 14.826 3.530 -0.351 1.00 0.00 H new ATOM 0 HB2 ASP A 14 15.149 2.307 -2.435 1.00 0.00 H new ATOM 0 HB3 ASP A 14 15.087 0.768 -1.599 1.00 0.00 H new ATOM 210 N PRO A 15 13.239 2.490 1.287 1.00 0.00 N ATOM 211 CA PRO A 15 12.412 2.015 2.401 1.00 0.00 C ATOM 212 C PRO A 15 11.663 0.731 2.060 1.00 0.00 C ATOM 213 O PRO A 15 11.839 0.167 0.982 1.00 0.00 O ATOM 214 CB PRO A 15 11.427 3.165 2.627 1.00 0.00 C ATOM 215 CG PRO A 15 11.346 3.859 1.311 1.00 0.00 C ATOM 216 CD PRO A 15 12.709 3.727 0.689 1.00 0.00 C ATOM 0 HA PRO A 15 13.011 1.770 3.278 1.00 0.00 H new ATOM 0 HB2 PRO A 15 10.451 2.794 2.940 1.00 0.00 H new ATOM 0 HB3 PRO A 15 11.778 3.839 3.409 1.00 0.00 H new ATOM 0 HG2 PRO A 15 10.583 3.407 0.678 1.00 0.00 H new ATOM 0 HG3 PRO A 15 11.075 4.907 1.438 1.00 0.00 H new ATOM 0 HD2 PRO A 15 12.650 3.655 -0.397 1.00 0.00 H new ATOM 0 HD3 PRO A 15 13.340 4.586 0.917 1.00 0.00 H new ATOM 224 N ASN A 16 10.826 0.276 2.987 1.00 0.00 N ATOM 225 CA ASN A 16 10.050 -0.942 2.784 1.00 0.00 C ATOM 226 C ASN A 16 8.738 -0.886 3.559 1.00 0.00 C ATOM 227 O ASN A 16 8.324 0.177 4.022 1.00 0.00 O ATOM 228 CB ASN A 16 10.860 -2.165 3.218 1.00 0.00 C ATOM 229 CG ASN A 16 11.268 -3.035 2.045 1.00 0.00 C ATOM 230 OD1 ASN A 16 12.454 -3.188 1.754 1.00 0.00 O ATOM 231 ND2 ASN A 16 10.283 -3.609 1.364 1.00 0.00 N ATOM 0 H ASN A 16 10.668 0.732 3.886 1.00 0.00 H new ATOM 0 HA ASN A 16 9.820 -1.025 1.722 1.00 0.00 H new ATOM 0 HB2 ASN A 16 11.752 -1.836 3.750 1.00 0.00 H new ATOM 0 HB3 ASN A 16 10.271 -2.757 3.918 1.00 0.00 H new ATOM 0 HD21 ASN A 16 10.496 -4.205 0.564 1.00 0.00 H new ATOM 0 HD22 ASN A 16 9.314 -3.454 1.641 1.00 0.00 H new ATOM 238 N GLU A 17 8.088 -2.038 3.698 1.00 0.00 N ATOM 239 CA GLU A 17 6.823 -2.119 4.417 1.00 0.00 C ATOM 240 C GLU A 17 5.769 -1.226 3.767 1.00 0.00 C ATOM 241 O GLU A 17 6.057 -0.124 3.299 1.00 0.00 O ATOM 242 CB GLU A 17 7.015 -1.716 5.881 1.00 0.00 C ATOM 243 CG GLU A 17 5.717 -1.638 6.666 1.00 0.00 C ATOM 244 CD GLU A 17 5.840 -0.783 7.913 1.00 0.00 C ATOM 245 OE1 GLU A 17 6.530 0.257 7.852 1.00 0.00 O ATOM 246 OE2 GLU A 17 5.248 -1.153 8.948 1.00 0.00 O ATOM 0 H GLU A 17 8.417 -2.927 3.322 1.00 0.00 H new ATOM 0 HA GLU A 17 6.477 -3.152 4.374 1.00 0.00 H new ATOM 0 HB2 GLU A 17 7.678 -2.434 6.363 1.00 0.00 H new ATOM 0 HB3 GLU A 17 7.512 -0.747 5.920 1.00 0.00 H new ATOM 0 HG2 GLU A 17 4.934 -1.231 6.027 1.00 0.00 H new ATOM 0 HG3 GLU A 17 5.407 -2.644 6.949 1.00 0.00 H new ATOM 253 N PRO A 18 4.520 -1.712 3.737 1.00 0.00 N ATOM 254 CA PRO A 18 3.398 -0.975 3.147 1.00 0.00 C ATOM 255 C PRO A 18 3.008 0.246 3.973 1.00 0.00 C ATOM 256 O PRO A 18 3.442 0.397 5.115 1.00 0.00 O ATOM 257 CB PRO A 18 2.263 -2.002 3.142 1.00 0.00 C ATOM 258 CG PRO A 18 2.603 -2.949 4.240 1.00 0.00 C ATOM 259 CD PRO A 18 4.105 -3.018 4.277 1.00 0.00 C ATOM 0 HA PRO A 18 3.642 -0.584 2.159 1.00 0.00 H new ATOM 0 HB2 PRO A 18 1.298 -1.526 3.315 1.00 0.00 H new ATOM 0 HB3 PRO A 18 2.198 -2.515 2.183 1.00 0.00 H new ATOM 0 HG2 PRO A 18 2.205 -2.601 5.193 1.00 0.00 H new ATOM 0 HG3 PRO A 18 2.172 -3.933 4.055 1.00 0.00 H new ATOM 0 HD2 PRO A 18 4.475 -3.170 5.291 1.00 0.00 H new ATOM 0 HD3 PRO A 18 4.484 -3.842 3.672 1.00 0.00 H new ATOM 267 N GLN A 19 2.187 1.113 3.389 1.00 0.00 N ATOM 268 CA GLN A 19 1.740 2.320 4.073 1.00 0.00 C ATOM 269 C GLN A 19 0.279 2.197 4.495 1.00 0.00 C ATOM 270 O GLN A 19 -0.624 2.229 3.660 1.00 0.00 O ATOM 271 CB GLN A 19 1.920 3.540 3.168 1.00 0.00 C ATOM 272 CG GLN A 19 1.143 3.452 1.865 1.00 0.00 C ATOM 273 CD GLN A 19 2.018 3.675 0.647 1.00 0.00 C ATOM 274 OE1 GLN A 19 2.017 4.756 0.057 1.00 0.00 O ATOM 275 NE2 GLN A 19 2.771 2.651 0.263 1.00 0.00 N ATOM 0 H GLN A 19 1.818 1.002 2.444 1.00 0.00 H new ATOM 0 HA GLN A 19 2.349 2.447 4.968 1.00 0.00 H new ATOM 0 HB2 GLN A 19 1.606 4.433 3.709 1.00 0.00 H new ATOM 0 HB3 GLN A 19 2.979 3.661 2.942 1.00 0.00 H new ATOM 0 HG2 GLN A 19 0.671 2.472 1.794 1.00 0.00 H new ATOM 0 HG3 GLN A 19 0.343 4.192 1.873 1.00 0.00 H new ATOM 0 HE21 GLN A 19 2.741 1.773 0.781 1.00 0.00 H new ATOM 0 HE22 GLN A 19 3.380 2.742 -0.550 1.00 0.00 H new ATOM 284 N LYS A 20 0.055 2.057 5.797 1.00 0.00 N ATOM 285 CA LYS A 20 -1.295 1.930 6.332 1.00 0.00 C ATOM 286 C LYS A 20 -2.156 3.122 5.926 1.00 0.00 C ATOM 287 O LYS A 20 -1.709 4.270 5.927 1.00 0.00 O ATOM 288 CB LYS A 20 -1.253 1.814 7.858 1.00 0.00 C ATOM 289 CG LYS A 20 -2.589 1.442 8.477 1.00 0.00 C ATOM 290 CD LYS A 20 -2.555 1.563 9.991 1.00 0.00 C ATOM 291 CE LYS A 20 -3.537 0.606 10.649 1.00 0.00 C ATOM 292 NZ LYS A 20 -3.654 0.851 12.113 1.00 0.00 N ATOM 0 H LYS A 20 0.792 2.029 6.502 1.00 0.00 H new ATOM 0 HA LYS A 20 -1.739 1.025 5.917 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -0.512 1.065 8.137 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -0.920 2.763 8.277 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -3.369 2.089 8.077 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -2.848 0.421 8.198 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -1.547 1.356 10.351 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -2.793 2.586 10.281 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -4.517 0.714 10.183 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -3.214 -0.421 10.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -4.332 0.179 12.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -2.725 0.723 12.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -3.987 1.823 12.277 1.00 0.00 H new ATOM 306 N PRO A 21 -3.420 2.847 5.571 1.00 0.00 N ATOM 307 CA PRO A 21 -4.369 3.885 5.159 1.00 0.00 C ATOM 308 C PRO A 21 -4.786 4.783 6.318 1.00 0.00 C ATOM 309 O PRO A 21 -4.457 4.516 7.473 1.00 0.00 O ATOM 310 CB PRO A 21 -5.568 3.084 4.644 1.00 0.00 C ATOM 311 CG PRO A 21 -5.485 1.778 5.357 1.00 0.00 C ATOM 312 CD PRO A 21 -4.019 1.503 5.547 1.00 0.00 C ATOM 0 HA PRO A 21 -3.939 4.560 4.418 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -6.507 3.594 4.860 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -5.519 2.949 3.563 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -6.001 1.823 6.316 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -5.959 0.986 4.777 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -3.829 0.962 6.474 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -3.615 0.898 4.735 1.00 0.00 H new ATOM 320 N VAL A 22 -5.514 5.850 6.002 1.00 0.00 N ATOM 321 CA VAL A 22 -5.977 6.788 7.017 1.00 0.00 C ATOM 322 C VAL A 22 -7.499 6.782 7.117 1.00 0.00 C ATOM 323 O VAL A 22 -8.193 6.466 6.151 1.00 0.00 O ATOM 324 CB VAL A 22 -5.499 8.221 6.719 1.00 0.00 C ATOM 325 CG1 VAL A 22 -3.988 8.255 6.549 1.00 0.00 C ATOM 326 CG2 VAL A 22 -6.195 8.767 5.481 1.00 0.00 C ATOM 0 H VAL A 22 -5.796 6.086 5.050 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.551 6.462 7.966 1.00 0.00 H new ATOM 0 HB VAL A 22 -5.760 8.856 7.565 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -3.668 9.276 6.339 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -3.511 7.907 7.465 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -3.700 7.607 5.721 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -5.846 9.781 5.285 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -5.966 8.132 4.625 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -7.272 8.780 5.645 1.00 0.00 H new ATOM 336 N SER A 23 -8.010 7.133 8.292 1.00 0.00 N ATOM 337 CA SER A 23 -9.450 7.166 8.520 1.00 0.00 C ATOM 338 C SER A 23 -10.164 7.895 7.386 1.00 0.00 C ATOM 339 O SER A 23 -9.532 8.568 6.572 1.00 0.00 O ATOM 340 CB SER A 23 -9.762 7.846 9.855 1.00 0.00 C ATOM 341 OG SER A 23 -10.258 6.913 10.799 1.00 0.00 O ATOM 0 H SER A 23 -7.449 7.399 9.101 1.00 0.00 H new ATOM 0 HA SER A 23 -9.811 6.138 8.551 1.00 0.00 H new ATOM 0 HB2 SER A 23 -8.861 8.319 10.245 1.00 0.00 H new ATOM 0 HB3 SER A 23 -10.496 8.637 9.701 1.00 0.00 H new ATOM 0 HG SER A 23 -10.448 7.372 11.644 1.00 0.00 H new ATOM 347 N ALA A 24 -11.484 7.755 7.339 1.00 0.00 N ATOM 348 CA ALA A 24 -12.285 8.402 6.307 1.00 0.00 C ATOM 349 C ALA A 24 -12.003 9.900 6.251 1.00 0.00 C ATOM 350 O ALA A 24 -11.570 10.422 5.224 1.00 0.00 O ATOM 351 CB ALA A 24 -13.765 8.150 6.552 1.00 0.00 C ATOM 0 H ALA A 24 -12.022 7.199 8.004 1.00 0.00 H new ATOM 0 HA ALA A 24 -12.009 7.971 5.345 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -14.351 8.639 5.774 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -13.960 7.078 6.533 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -14.046 8.553 7.525 1.00 0.00 H new ATOM 357 N TYR A 25 -12.252 10.585 7.361 1.00 0.00 N ATOM 358 CA TYR A 25 -12.028 12.024 7.438 1.00 0.00 C ATOM 359 C TYR A 25 -10.562 12.361 7.185 1.00 0.00 C ATOM 360 O TYR A 25 -10.225 13.491 6.834 1.00 0.00 O ATOM 361 CB TYR A 25 -12.457 12.556 8.806 1.00 0.00 C ATOM 362 CG TYR A 25 -11.818 13.878 9.169 1.00 0.00 C ATOM 363 CD1 TYR A 25 -11.918 14.976 8.324 1.00 0.00 C ATOM 364 CD2 TYR A 25 -11.115 14.028 10.358 1.00 0.00 C ATOM 365 CE1 TYR A 25 -11.335 16.185 8.651 1.00 0.00 C ATOM 366 CE2 TYR A 25 -10.530 15.234 10.695 1.00 0.00 C ATOM 367 CZ TYR A 25 -10.643 16.309 9.838 1.00 0.00 C ATOM 368 OH TYR A 25 -10.062 17.512 10.168 1.00 0.00 O ATOM 0 H TYR A 25 -12.609 10.167 8.220 1.00 0.00 H new ATOM 0 HA TYR A 25 -12.630 12.502 6.665 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -13.541 12.670 8.818 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -12.205 11.819 9.568 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -12.461 14.883 7.395 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -11.024 13.188 11.030 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -11.420 17.028 7.981 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -9.988 15.334 11.624 1.00 0.00 H new ATOM 0 HH TYR A 25 -9.614 17.432 11.036 1.00 0.00 H new ATOM 378 N ALA A 26 -9.694 11.371 7.366 1.00 0.00 N ATOM 379 CA ALA A 26 -8.264 11.560 7.156 1.00 0.00 C ATOM 380 C ALA A 26 -7.913 11.487 5.674 1.00 0.00 C ATOM 381 O ALA A 26 -7.041 12.214 5.196 1.00 0.00 O ATOM 382 CB ALA A 26 -7.474 10.522 7.939 1.00 0.00 C ATOM 0 H ALA A 26 -9.956 10.430 7.658 1.00 0.00 H new ATOM 0 HA ALA A 26 -7.997 12.553 7.518 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -6.408 10.675 7.773 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -7.694 10.623 9.002 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -7.754 9.523 7.604 1.00 0.00 H new ATOM 388 N LEU A 27 -8.596 10.606 4.951 1.00 0.00 N ATOM 389 CA LEU A 27 -8.355 10.438 3.523 1.00 0.00 C ATOM 390 C LEU A 27 -8.522 11.762 2.783 1.00 0.00 C ATOM 391 O LEU A 27 -7.852 12.014 1.781 1.00 0.00 O ATOM 392 CB LEU A 27 -9.311 9.394 2.944 1.00 0.00 C ATOM 393 CG LEU A 27 -8.722 8.002 2.708 1.00 0.00 C ATOM 394 CD1 LEU A 27 -9.794 6.935 2.868 1.00 0.00 C ATOM 395 CD2 LEU A 27 -8.086 7.920 1.328 1.00 0.00 C ATOM 0 H LEU A 27 -9.321 9.997 5.331 1.00 0.00 H new ATOM 0 HA LEU A 27 -7.329 10.096 3.391 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -10.162 9.297 3.618 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.696 9.769 1.996 1.00 0.00 H new ATOM 0 HG LEU A 27 -7.948 7.824 3.454 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.357 5.951 2.697 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.204 6.979 3.877 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -10.591 7.109 2.145 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -7.672 6.923 1.177 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -8.841 8.119 0.567 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.289 8.659 1.250 1.00 0.00 H new ATOM 407 N PHE A 28 -9.418 12.605 3.285 1.00 0.00 N ATOM 408 CA PHE A 28 -9.672 13.904 2.672 1.00 0.00 C ATOM 409 C PHE A 28 -8.673 14.945 3.170 1.00 0.00 C ATOM 410 O PHE A 28 -8.498 15.997 2.556 1.00 0.00 O ATOM 411 CB PHE A 28 -11.099 14.365 2.976 1.00 0.00 C ATOM 412 CG PHE A 28 -11.341 15.814 2.664 1.00 0.00 C ATOM 413 CD1 PHE A 28 -11.408 16.252 1.351 1.00 0.00 C ATOM 414 CD2 PHE A 28 -11.501 16.738 3.684 1.00 0.00 C ATOM 415 CE1 PHE A 28 -11.630 17.585 1.062 1.00 0.00 C ATOM 416 CE2 PHE A 28 -11.723 18.073 3.400 1.00 0.00 C ATOM 417 CZ PHE A 28 -11.789 18.496 2.087 1.00 0.00 C ATOM 0 H PHE A 28 -9.980 12.412 4.114 1.00 0.00 H new ATOM 0 HA PHE A 28 -9.553 13.798 1.594 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -11.799 13.757 2.403 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -11.312 14.188 4.030 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -11.285 15.544 0.545 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -11.452 16.412 4.712 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -11.679 17.914 0.035 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -11.845 18.784 4.204 1.00 0.00 H new ATOM 0 HZ PHE A 28 -11.965 19.538 1.862 1.00 0.00 H new ATOM 427 N PHE A 29 -8.021 14.643 4.288 1.00 0.00 N ATOM 428 CA PHE A 29 -7.040 15.552 4.870 1.00 0.00 C ATOM 429 C PHE A 29 -5.726 15.501 4.097 1.00 0.00 C ATOM 430 O PHE A 29 -5.132 16.536 3.793 1.00 0.00 O ATOM 431 CB PHE A 29 -6.795 15.198 6.339 1.00 0.00 C ATOM 432 CG PHE A 29 -5.953 16.207 7.065 1.00 0.00 C ATOM 433 CD1 PHE A 29 -4.571 16.170 6.974 1.00 0.00 C ATOM 434 CD2 PHE A 29 -6.543 17.193 7.840 1.00 0.00 C ATOM 435 CE1 PHE A 29 -3.792 17.097 7.641 1.00 0.00 C ATOM 436 CE2 PHE A 29 -5.770 18.123 8.509 1.00 0.00 C ATOM 437 CZ PHE A 29 -4.393 18.074 8.410 1.00 0.00 C ATOM 0 H PHE A 29 -8.154 13.776 4.809 1.00 0.00 H new ATOM 0 HA PHE A 29 -7.438 16.565 4.809 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -7.755 15.104 6.847 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -6.309 14.224 6.394 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -4.096 15.407 6.374 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -7.619 17.235 7.922 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -2.716 17.057 7.561 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -6.242 18.887 9.109 1.00 0.00 H new ATOM 0 HZ PHE A 29 -3.787 18.799 8.933 1.00 0.00 H new ATOM 447 N ARG A 30 -5.277 14.291 3.782 1.00 0.00 N ATOM 448 CA ARG A 30 -4.033 14.104 3.046 1.00 0.00 C ATOM 449 C ARG A 30 -4.190 14.542 1.593 1.00 0.00 C ATOM 450 O ARG A 30 -3.203 14.765 0.891 1.00 0.00 O ATOM 451 CB ARG A 30 -3.595 12.640 3.105 1.00 0.00 C ATOM 452 CG ARG A 30 -4.645 11.669 2.591 1.00 0.00 C ATOM 453 CD ARG A 30 -4.247 10.226 2.857 1.00 0.00 C ATOM 454 NE ARG A 30 -3.333 9.714 1.840 1.00 0.00 N ATOM 455 CZ ARG A 30 -2.019 9.906 1.870 1.00 0.00 C ATOM 456 NH1 ARG A 30 -1.468 10.594 2.860 1.00 0.00 N ATOM 457 NH2 ARG A 30 -1.252 9.408 0.907 1.00 0.00 N ATOM 0 H ARG A 30 -5.757 13.424 4.025 1.00 0.00 H new ATOM 0 HA ARG A 30 -3.267 14.723 3.513 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -2.683 12.519 2.521 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -3.349 12.384 4.136 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -5.601 11.878 3.071 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -4.786 11.817 1.520 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -3.775 10.155 3.837 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -5.141 9.603 2.888 1.00 0.00 H new ATOM 0 HE ARG A 30 -3.725 9.180 1.064 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -2.053 10.978 3.602 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -0.459 10.740 2.880 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -1.672 8.878 0.144 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -0.243 9.556 0.931 1.00 0.00 H new ATOM 471 N ASP A 31 -5.436 14.661 1.148 1.00 0.00 N ATOM 472 CA ASP A 31 -5.723 15.072 -0.222 1.00 0.00 C ATOM 473 C ASP A 31 -5.916 16.582 -0.307 1.00 0.00 C ATOM 474 O ASP A 31 -5.564 17.209 -1.307 1.00 0.00 O ATOM 475 CB ASP A 31 -6.970 14.355 -0.741 1.00 0.00 C ATOM 476 CG ASP A 31 -6.640 13.289 -1.767 1.00 0.00 C ATOM 477 OD1 ASP A 31 -5.690 12.512 -1.532 1.00 0.00 O ATOM 478 OD2 ASP A 31 -7.333 13.230 -2.804 1.00 0.00 O ATOM 0 H ASP A 31 -6.264 14.479 1.716 1.00 0.00 H new ATOM 0 HA ASP A 31 -4.871 14.798 -0.844 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -7.498 13.898 0.096 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -7.647 15.085 -1.185 1.00 0.00 H new ATOM 483 N THR A 32 -6.479 17.162 0.749 1.00 0.00 N ATOM 484 CA THR A 32 -6.722 18.599 0.793 1.00 0.00 C ATOM 485 C THR A 32 -5.512 19.344 1.346 1.00 0.00 C ATOM 486 O THR A 32 -4.999 20.267 0.714 1.00 0.00 O ATOM 487 CB THR A 32 -7.955 18.934 1.653 1.00 0.00 C ATOM 488 OG1 THR A 32 -9.105 18.246 1.150 1.00 0.00 O ATOM 489 CG2 THR A 32 -8.217 20.432 1.663 1.00 0.00 C ATOM 0 H THR A 32 -6.775 16.658 1.585 1.00 0.00 H new ATOM 0 HA THR A 32 -6.906 18.921 -0.232 1.00 0.00 H new ATOM 0 HB THR A 32 -7.757 18.610 2.675 1.00 0.00 H new ATOM 0 HG1 THR A 32 -9.810 18.247 1.830 1.00 0.00 H new ATOM 0 HG21 THR A 32 -9.092 20.644 2.277 1.00 0.00 H new ATOM 0 HG22 THR A 32 -7.351 20.950 2.075 1.00 0.00 H new ATOM 0 HG23 THR A 32 -8.396 20.777 0.645 1.00 0.00 H new ATOM 497 N GLN A 33 -5.062 18.937 2.528 1.00 0.00 N ATOM 498 CA GLN A 33 -3.912 19.567 3.165 1.00 0.00 C ATOM 499 C GLN A 33 -2.888 20.010 2.125 1.00 0.00 C ATOM 500 O GLN A 33 -2.573 21.194 2.015 1.00 0.00 O ATOM 501 CB GLN A 33 -3.262 18.604 4.160 1.00 0.00 C ATOM 502 CG GLN A 33 -1.935 19.101 4.710 1.00 0.00 C ATOM 503 CD GLN A 33 -0.869 18.023 4.727 1.00 0.00 C ATOM 504 OE1 GLN A 33 -0.546 17.470 5.779 1.00 0.00 O ATOM 505 NE2 GLN A 33 -0.316 17.718 3.559 1.00 0.00 N ATOM 0 H GLN A 33 -5.476 18.174 3.064 1.00 0.00 H new ATOM 0 HA GLN A 33 -4.264 20.449 3.701 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -3.949 18.434 4.989 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -3.106 17.642 3.672 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -1.588 19.940 4.107 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -2.083 19.476 5.723 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -0.614 18.202 2.712 1.00 0.00 H new ATOM 0 HE22 GLN A 33 0.407 17.000 3.509 1.00 0.00 H new ATOM 514 N ALA A 34 -2.372 19.050 1.364 1.00 0.00 N ATOM 515 CA ALA A 34 -1.386 19.342 0.331 1.00 0.00 C ATOM 516 C ALA A 34 -1.772 20.586 -0.461 1.00 0.00 C ATOM 517 O ALA A 34 -0.954 21.483 -0.664 1.00 0.00 O ATOM 518 CB ALA A 34 -1.227 18.149 -0.599 1.00 0.00 C ATOM 0 H ALA A 34 -2.620 18.064 1.444 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.431 19.537 0.820 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -0.488 18.381 -1.366 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.896 17.283 -0.026 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.183 17.927 -1.073 1.00 0.00 H new ATOM 524 N ALA A 35 -3.022 20.633 -0.908 1.00 0.00 N ATOM 525 CA ALA A 35 -3.517 21.768 -1.678 1.00 0.00 C ATOM 526 C ALA A 35 -3.516 23.042 -0.839 1.00 0.00 C ATOM 527 O ALA A 35 -3.289 24.136 -1.357 1.00 0.00 O ATOM 528 CB ALA A 35 -4.915 21.480 -2.203 1.00 0.00 C ATOM 0 H ALA A 35 -3.711 19.898 -0.750 1.00 0.00 H new ATOM 0 HA ALA A 35 -2.848 21.921 -2.525 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -5.272 22.336 -2.776 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -4.888 20.599 -2.845 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.588 21.298 -1.365 1.00 0.00 H new ATOM 534 N ILE A 36 -3.770 22.892 0.456 1.00 0.00 N ATOM 535 CA ILE A 36 -3.798 24.031 1.365 1.00 0.00 C ATOM 536 C ILE A 36 -2.397 24.588 1.592 1.00 0.00 C ATOM 537 O ILE A 36 -2.107 25.732 1.241 1.00 0.00 O ATOM 538 CB ILE A 36 -4.413 23.651 2.725 1.00 0.00 C ATOM 539 CG1 ILE A 36 -5.733 22.903 2.521 1.00 0.00 C ATOM 540 CG2 ILE A 36 -4.629 24.894 3.575 1.00 0.00 C ATOM 541 CD1 ILE A 36 -6.831 23.762 1.935 1.00 0.00 C ATOM 0 H ILE A 36 -3.959 21.993 0.900 1.00 0.00 H new ATOM 0 HA ILE A 36 -4.418 24.794 0.895 1.00 0.00 H new ATOM 0 HB ILE A 36 -3.720 22.992 3.249 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -5.560 22.051 1.864 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -6.067 22.504 3.479 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -5.064 24.609 4.533 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -3.673 25.390 3.744 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -5.305 25.575 3.058 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -7.736 23.166 1.818 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.032 24.601 2.602 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -6.517 24.140 0.962 1.00 0.00 H new ATOM 553 N LYS A 37 -1.529 23.771 2.179 1.00 0.00 N ATOM 554 CA LYS A 37 -0.156 24.179 2.450 1.00 0.00 C ATOM 555 C LYS A 37 0.536 24.643 1.172 1.00 0.00 C ATOM 556 O LYS A 37 1.092 25.739 1.118 1.00 0.00 O ATOM 557 CB LYS A 37 0.627 23.024 3.076 1.00 0.00 C ATOM 558 CG LYS A 37 1.538 23.452 4.214 1.00 0.00 C ATOM 559 CD LYS A 37 2.762 24.191 3.700 1.00 0.00 C ATOM 560 CE LYS A 37 3.930 23.244 3.470 1.00 0.00 C ATOM 561 NZ LYS A 37 4.760 23.659 2.306 1.00 0.00 N ATOM 0 H LYS A 37 -1.753 22.821 2.476 1.00 0.00 H new ATOM 0 HA LYS A 37 -0.183 25.013 3.151 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -0.076 22.278 3.446 1.00 0.00 H new ATOM 0 HB3 LYS A 37 1.226 22.542 2.304 1.00 0.00 H new ATOM 0 HG2 LYS A 37 0.986 24.094 4.901 1.00 0.00 H new ATOM 0 HG3 LYS A 37 1.852 22.575 4.779 1.00 0.00 H new ATOM 0 HD2 LYS A 37 2.516 24.700 2.768 1.00 0.00 H new ATOM 0 HD3 LYS A 37 3.051 24.960 4.416 1.00 0.00 H new ATOM 0 HE2 LYS A 37 4.551 23.210 4.365 1.00 0.00 H new ATOM 0 HE3 LYS A 37 3.552 22.235 3.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 5.545 22.988 2.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 4.174 23.667 1.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 5.142 24.612 2.474 1.00 0.00 H new ATOM 575 N GLY A 38 0.497 23.800 0.144 1.00 0.00 N ATOM 576 CA GLY A 38 1.123 24.143 -1.120 1.00 0.00 C ATOM 577 C GLY A 38 0.773 25.544 -1.579 1.00 0.00 C ATOM 578 O GLY A 38 1.636 26.280 -2.057 1.00 0.00 O ATOM 0 H GLY A 38 0.044 22.887 0.164 1.00 0.00 H new ATOM 0 HA2 GLY A 38 2.205 24.056 -1.021 1.00 0.00 H new ATOM 0 HA3 GLY A 38 0.814 23.427 -1.881 1.00 0.00 H new ATOM 582 N GLN A 39 -0.496 25.912 -1.437 1.00 0.00 N ATOM 583 CA GLN A 39 -0.958 27.233 -1.844 1.00 0.00 C ATOM 584 C GLN A 39 -0.610 28.280 -0.791 1.00 0.00 C ATOM 585 O GLN A 39 -0.421 29.454 -1.107 1.00 0.00 O ATOM 586 CB GLN A 39 -2.469 27.217 -2.085 1.00 0.00 C ATOM 587 CG GLN A 39 -2.867 26.588 -3.410 1.00 0.00 C ATOM 588 CD GLN A 39 -2.041 25.362 -3.745 1.00 0.00 C ATOM 589 OE1 GLN A 39 -0.820 25.441 -3.884 1.00 0.00 O ATOM 590 NE2 GLN A 39 -2.704 24.219 -3.877 1.00 0.00 N ATOM 0 H GLN A 39 -1.222 25.314 -1.043 1.00 0.00 H new ATOM 0 HA GLN A 39 -0.452 27.496 -2.773 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -2.952 26.672 -1.274 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -2.845 28.240 -2.050 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -3.921 26.313 -3.375 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -2.756 27.325 -4.206 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -3.716 24.199 -3.753 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -2.201 23.361 -4.102 1.00 0.00 H new ATOM 599 N ASN A 40 -0.528 27.846 0.463 1.00 0.00 N ATOM 600 CA ASN A 40 -0.204 28.746 1.564 1.00 0.00 C ATOM 601 C ASN A 40 0.811 28.108 2.508 1.00 0.00 C ATOM 602 O ASN A 40 0.464 27.566 3.557 1.00 0.00 O ATOM 603 CB ASN A 40 -1.471 29.119 2.335 1.00 0.00 C ATOM 604 CG ASN A 40 -2.706 29.114 1.455 1.00 0.00 C ATOM 605 OD1 ASN A 40 -2.819 29.907 0.520 1.00 0.00 O ATOM 606 ND2 ASN A 40 -3.641 28.219 1.752 1.00 0.00 N ATOM 0 H ASN A 40 -0.681 26.877 0.742 1.00 0.00 H new ATOM 0 HA ASN A 40 0.236 29.650 1.144 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -1.612 28.418 3.158 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -1.347 30.108 2.776 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -4.495 28.170 1.196 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -3.505 27.581 2.536 1.00 0.00 H new ATOM 613 N PRO A 41 2.095 28.173 2.127 1.00 0.00 N ATOM 614 CA PRO A 41 3.187 27.608 2.926 1.00 0.00 C ATOM 615 C PRO A 41 3.427 28.388 4.214 1.00 0.00 C ATOM 616 O PRO A 41 4.066 27.893 5.141 1.00 0.00 O ATOM 617 CB PRO A 41 4.400 27.720 1.999 1.00 0.00 C ATOM 618 CG PRO A 41 4.072 28.847 1.081 1.00 0.00 C ATOM 619 CD PRO A 41 2.581 28.804 0.888 1.00 0.00 C ATOM 0 HA PRO A 41 2.972 26.589 3.247 1.00 0.00 H new ATOM 0 HB2 PRO A 41 5.312 27.920 2.562 1.00 0.00 H new ATOM 0 HB3 PRO A 41 4.563 26.794 1.447 1.00 0.00 H new ATOM 0 HG2 PRO A 41 4.383 29.801 1.507 1.00 0.00 H new ATOM 0 HG3 PRO A 41 4.592 28.739 0.129 1.00 0.00 H new ATOM 0 HD2 PRO A 41 2.164 29.802 0.755 1.00 0.00 H new ATOM 0 HD3 PRO A 41 2.306 28.224 0.007 1.00 0.00 H new ATOM 627 N ASN A 42 2.909 29.611 4.265 1.00 0.00 N ATOM 628 CA ASN A 42 3.068 30.460 5.440 1.00 0.00 C ATOM 629 C ASN A 42 2.256 29.921 6.614 1.00 0.00 C ATOM 630 O ASN A 42 2.615 30.122 7.774 1.00 0.00 O ATOM 631 CB ASN A 42 2.636 31.893 5.122 1.00 0.00 C ATOM 632 CG ASN A 42 3.466 32.516 4.016 1.00 0.00 C ATOM 633 OD1 ASN A 42 3.539 31.988 2.907 1.00 0.00 O ATOM 634 ND2 ASN A 42 4.099 33.644 4.316 1.00 0.00 N ATOM 0 H ASN A 42 2.376 30.036 3.507 1.00 0.00 H new ATOM 0 HA ASN A 42 4.122 30.459 5.719 1.00 0.00 H new ATOM 0 HB2 ASN A 42 1.586 31.897 4.830 1.00 0.00 H new ATOM 0 HB3 ASN A 42 2.719 32.503 6.022 1.00 0.00 H new ATOM 0 HD21 ASN A 42 4.674 34.108 3.613 1.00 0.00 H new ATOM 0 HD22 ASN A 42 4.010 34.046 5.249 1.00 0.00 H new ATOM 641 N ALA A 43 1.161 29.235 6.304 1.00 0.00 N ATOM 642 CA ALA A 43 0.300 28.664 7.332 1.00 0.00 C ATOM 643 C ALA A 43 0.948 27.442 7.974 1.00 0.00 C ATOM 644 O ALA A 43 1.448 26.555 7.281 1.00 0.00 O ATOM 645 CB ALA A 43 -1.054 28.298 6.743 1.00 0.00 C ATOM 0 H ALA A 43 0.849 29.061 5.349 1.00 0.00 H new ATOM 0 HA ALA A 43 0.155 29.415 8.108 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -1.687 27.873 7.522 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -1.528 29.192 6.338 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -0.918 27.567 5.946 1.00 0.00 H new ATOM 651 N THR A 44 0.936 27.401 9.303 1.00 0.00 N ATOM 652 CA THR A 44 1.524 26.288 10.038 1.00 0.00 C ATOM 653 C THR A 44 0.596 25.079 10.040 1.00 0.00 C ATOM 654 O THR A 44 -0.611 25.210 9.840 1.00 0.00 O ATOM 655 CB THR A 44 1.839 26.681 11.494 1.00 0.00 C ATOM 656 OG1 THR A 44 2.576 25.634 12.135 1.00 0.00 O ATOM 657 CG2 THR A 44 0.559 26.955 12.269 1.00 0.00 C ATOM 0 H THR A 44 0.526 28.126 9.892 1.00 0.00 H new ATOM 0 HA THR A 44 2.453 26.029 9.530 1.00 0.00 H new ATOM 0 HB THR A 44 2.439 27.591 11.480 1.00 0.00 H new ATOM 0 HG1 THR A 44 2.774 25.892 13.059 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.806 27.231 13.294 1.00 0.00 H new ATOM 0 HG22 THR A 44 0.014 27.772 11.795 1.00 0.00 H new ATOM 0 HG23 THR A 44 -0.062 26.059 12.274 1.00 0.00 H new ATOM 665 N PHE A 45 1.168 23.901 10.267 1.00 0.00 N ATOM 666 CA PHE A 45 0.391 22.667 10.294 1.00 0.00 C ATOM 667 C PHE A 45 -0.951 22.884 10.986 1.00 0.00 C ATOM 668 O PHE A 45 -1.972 22.339 10.570 1.00 0.00 O ATOM 669 CB PHE A 45 1.173 21.562 11.008 1.00 0.00 C ATOM 670 CG PHE A 45 0.500 20.221 10.955 1.00 0.00 C ATOM 671 CD1 PHE A 45 0.374 19.541 9.755 1.00 0.00 C ATOM 672 CD2 PHE A 45 -0.007 19.640 12.106 1.00 0.00 C ATOM 673 CE1 PHE A 45 -0.245 18.307 9.703 1.00 0.00 C ATOM 674 CE2 PHE A 45 -0.627 18.405 12.061 1.00 0.00 C ATOM 675 CZ PHE A 45 -0.746 17.738 10.858 1.00 0.00 C ATOM 0 H PHE A 45 2.166 23.775 10.435 1.00 0.00 H new ATOM 0 HA PHE A 45 0.204 22.363 9.264 1.00 0.00 H new ATOM 0 HB2 PHE A 45 2.163 21.481 10.559 1.00 0.00 H new ATOM 0 HB3 PHE A 45 1.318 21.846 12.050 1.00 0.00 H new ATOM 0 HD1 PHE A 45 0.764 19.981 8.849 1.00 0.00 H new ATOM 0 HD2 PHE A 45 0.083 20.158 13.049 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -0.337 17.788 8.761 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -1.018 17.963 12.966 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.230 16.773 10.820 1.00 0.00 H new ATOM 685 N GLY A 46 -0.940 23.685 12.048 1.00 0.00 N ATOM 686 CA GLY A 46 -2.161 23.960 12.782 1.00 0.00 C ATOM 687 C GLY A 46 -3.192 24.688 11.941 1.00 0.00 C ATOM 688 O GLY A 46 -4.379 24.370 11.992 1.00 0.00 O ATOM 0 H GLY A 46 -0.107 24.148 12.412 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -2.585 23.022 13.140 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -1.925 24.559 13.662 1.00 0.00 H new ATOM 692 N GLU A 47 -2.737 25.668 11.167 1.00 0.00 N ATOM 693 CA GLU A 47 -3.629 26.444 10.315 1.00 0.00 C ATOM 694 C GLU A 47 -4.187 25.583 9.185 1.00 0.00 C ATOM 695 O GLU A 47 -5.401 25.497 8.996 1.00 0.00 O ATOM 696 CB GLU A 47 -2.892 27.652 9.733 1.00 0.00 C ATOM 697 CG GLU A 47 -3.168 28.949 10.477 1.00 0.00 C ATOM 698 CD GLU A 47 -4.497 29.570 10.094 1.00 0.00 C ATOM 699 OE1 GLU A 47 -4.859 29.505 8.901 1.00 0.00 O ATOM 700 OE2 GLU A 47 -5.173 30.122 10.987 1.00 0.00 O ATOM 0 H GLU A 47 -1.756 25.943 11.113 1.00 0.00 H new ATOM 0 HA GLU A 47 -4.460 26.795 10.927 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -1.820 27.455 9.748 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.179 27.774 8.689 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -3.157 28.757 11.550 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -2.367 29.659 10.271 1.00 0.00 H new ATOM 707 N VAL A 48 -3.292 24.947 8.436 1.00 0.00 N ATOM 708 CA VAL A 48 -3.693 24.092 7.325 1.00 0.00 C ATOM 709 C VAL A 48 -4.761 23.094 7.758 1.00 0.00 C ATOM 710 O VAL A 48 -5.673 22.775 6.995 1.00 0.00 O ATOM 711 CB VAL A 48 -2.491 23.322 6.746 1.00 0.00 C ATOM 712 CG1 VAL A 48 -2.965 22.148 5.903 1.00 0.00 C ATOM 713 CG2 VAL A 48 -1.606 24.252 5.931 1.00 0.00 C ATOM 0 H VAL A 48 -2.284 25.008 8.578 1.00 0.00 H new ATOM 0 HA VAL A 48 -4.101 24.746 6.554 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.900 22.929 7.573 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.102 21.616 5.502 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.554 21.471 6.521 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -3.579 22.515 5.081 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.762 23.692 5.529 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.183 24.677 5.110 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -1.238 25.055 6.569 1.00 0.00 H new ATOM 723 N SER A 49 -4.642 22.604 8.988 1.00 0.00 N ATOM 724 CA SER A 49 -5.596 21.639 9.522 1.00 0.00 C ATOM 725 C SER A 49 -6.948 22.298 9.781 1.00 0.00 C ATOM 726 O SER A 49 -7.973 21.870 9.250 1.00 0.00 O ATOM 727 CB SER A 49 -5.060 21.022 10.815 1.00 0.00 C ATOM 728 OG SER A 49 -5.177 21.927 11.899 1.00 0.00 O ATOM 0 H SER A 49 -3.894 22.859 9.633 1.00 0.00 H new ATOM 0 HA SER A 49 -5.732 20.851 8.781 1.00 0.00 H new ATOM 0 HB2 SER A 49 -5.609 20.107 11.040 1.00 0.00 H new ATOM 0 HB3 SER A 49 -4.015 20.742 10.682 1.00 0.00 H new ATOM 0 HG SER A 49 -4.635 22.723 11.720 1.00 0.00 H new ATOM 734 N LYS A 50 -6.941 23.342 10.603 1.00 0.00 N ATOM 735 CA LYS A 50 -8.165 24.063 10.934 1.00 0.00 C ATOM 736 C LYS A 50 -8.972 24.371 9.677 1.00 0.00 C ATOM 737 O LYS A 50 -10.201 24.442 9.719 1.00 0.00 O ATOM 738 CB LYS A 50 -7.832 25.363 11.671 1.00 0.00 C ATOM 739 CG LYS A 50 -8.714 25.619 12.880 1.00 0.00 C ATOM 740 CD LYS A 50 -10.091 26.116 12.471 1.00 0.00 C ATOM 741 CE LYS A 50 -11.048 26.144 13.653 1.00 0.00 C ATOM 742 NZ LYS A 50 -12.120 27.161 13.475 1.00 0.00 N ATOM 0 H LYS A 50 -6.102 23.708 11.052 1.00 0.00 H new ATOM 0 HA LYS A 50 -8.767 23.428 11.584 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -6.791 25.333 11.991 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -7.928 26.199 10.978 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -8.815 24.701 13.459 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -8.239 26.355 13.529 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -10.006 27.116 12.046 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -10.494 25.471 11.690 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -11.499 25.160 13.779 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -10.492 26.359 14.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -12.751 27.149 14.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -11.692 28.104 13.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -12.667 26.942 12.618 1.00 0.00 H new ATOM 756 N ILE A 51 -8.274 24.552 8.561 1.00 0.00 N ATOM 757 CA ILE A 51 -8.927 24.850 7.292 1.00 0.00 C ATOM 758 C ILE A 51 -9.585 23.605 6.707 1.00 0.00 C ATOM 759 O ILE A 51 -10.737 23.643 6.274 1.00 0.00 O ATOM 760 CB ILE A 51 -7.931 25.421 6.266 1.00 0.00 C ATOM 761 CG1 ILE A 51 -7.390 26.770 6.744 1.00 0.00 C ATOM 762 CG2 ILE A 51 -8.595 25.562 4.905 1.00 0.00 C ATOM 763 CD1 ILE A 51 -6.092 27.171 6.079 1.00 0.00 C ATOM 0 H ILE A 51 -7.257 24.498 8.510 1.00 0.00 H new ATOM 0 HA ILE A 51 -9.691 25.599 7.499 1.00 0.00 H new ATOM 0 HB ILE A 51 -7.094 24.729 6.170 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -8.138 27.540 6.555 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -7.239 26.730 7.823 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -7.878 25.967 4.191 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -8.935 24.585 4.563 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -9.448 26.236 4.984 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -5.768 28.137 6.466 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -5.329 26.421 6.289 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -6.242 27.244 5.002 1.00 0.00 H new ATOM 775 N VAL A 52 -8.846 22.500 6.699 1.00 0.00 N ATOM 776 CA VAL A 52 -9.357 21.242 6.169 1.00 0.00 C ATOM 777 C VAL A 52 -10.525 20.729 7.004 1.00 0.00 C ATOM 778 O VAL A 52 -11.525 20.254 6.466 1.00 0.00 O ATOM 779 CB VAL A 52 -8.259 20.163 6.126 1.00 0.00 C ATOM 780 CG1 VAL A 52 -8.842 18.823 5.703 1.00 0.00 C ATOM 781 CG2 VAL A 52 -7.136 20.584 5.190 1.00 0.00 C ATOM 0 H VAL A 52 -7.891 22.451 7.054 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.699 21.442 5.154 1.00 0.00 H new ATOM 0 HB VAL A 52 -7.844 20.051 7.128 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -8.051 18.073 5.678 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -9.608 18.518 6.416 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -9.285 18.916 4.711 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -6.369 19.810 5.171 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -7.534 20.725 4.185 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -6.700 21.519 5.542 1.00 0.00 H new ATOM 791 N ALA A 53 -10.391 20.828 8.323 1.00 0.00 N ATOM 792 CA ALA A 53 -11.436 20.377 9.233 1.00 0.00 C ATOM 793 C ALA A 53 -12.772 21.036 8.906 1.00 0.00 C ATOM 794 O ALA A 53 -13.823 20.399 8.976 1.00 0.00 O ATOM 795 CB ALA A 53 -11.042 20.665 10.674 1.00 0.00 C ATOM 0 H ALA A 53 -9.569 21.217 8.785 1.00 0.00 H new ATOM 0 HA ALA A 53 -11.552 19.300 9.108 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -11.832 20.323 11.343 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -10.115 20.142 10.909 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -10.896 21.737 10.804 1.00 0.00 H new ATOM 801 N SER A 54 -12.723 22.315 8.549 1.00 0.00 N ATOM 802 CA SER A 54 -13.930 23.062 8.215 1.00 0.00 C ATOM 803 C SER A 54 -14.470 22.641 6.851 1.00 0.00 C ATOM 804 O SER A 54 -15.653 22.815 6.559 1.00 0.00 O ATOM 805 CB SER A 54 -13.644 24.565 8.221 1.00 0.00 C ATOM 806 OG SER A 54 -14.189 25.183 9.374 1.00 0.00 O ATOM 0 H SER A 54 -11.861 22.856 8.484 1.00 0.00 H new ATOM 0 HA SER A 54 -14.685 22.840 8.970 1.00 0.00 H new ATOM 0 HB2 SER A 54 -12.568 24.734 8.188 1.00 0.00 H new ATOM 0 HB3 SER A 54 -14.066 25.022 7.326 1.00 0.00 H new ATOM 0 HG SER A 54 -13.991 26.143 9.355 1.00 0.00 H new ATOM 812 N MET A 55 -13.593 22.087 6.021 1.00 0.00 N ATOM 813 CA MET A 55 -13.981 21.640 4.688 1.00 0.00 C ATOM 814 C MET A 55 -14.781 20.343 4.761 1.00 0.00 C ATOM 815 O MET A 55 -15.874 20.246 4.203 1.00 0.00 O ATOM 816 CB MET A 55 -12.742 21.439 3.813 1.00 0.00 C ATOM 817 CG MET A 55 -12.007 22.731 3.495 1.00 0.00 C ATOM 818 SD MET A 55 -12.261 23.274 1.794 1.00 0.00 S ATOM 819 CE MET A 55 -11.023 22.301 0.940 1.00 0.00 C ATOM 0 H MET A 55 -12.610 21.937 6.247 1.00 0.00 H new ATOM 0 HA MET A 55 -14.610 22.411 4.243 1.00 0.00 H new ATOM 0 HB2 MET A 55 -12.058 20.756 4.317 1.00 0.00 H new ATOM 0 HB3 MET A 55 -13.040 20.961 2.880 1.00 0.00 H new ATOM 0 HG2 MET A 55 -12.343 23.513 4.176 1.00 0.00 H new ATOM 0 HG3 MET A 55 -10.941 22.591 3.672 1.00 0.00 H new ATOM 0 HE1 MET A 55 -11.213 22.331 -0.133 1.00 0.00 H new ATOM 0 HE2 MET A 55 -10.034 22.710 1.145 1.00 0.00 H new ATOM 0 HE3 MET A 55 -11.068 21.269 1.288 1.00 0.00 H new ATOM 829 N TRP A 56 -14.230 19.351 5.451 1.00 0.00 N ATOM 830 CA TRP A 56 -14.894 18.060 5.596 1.00 0.00 C ATOM 831 C TRP A 56 -16.272 18.225 6.227 1.00 0.00 C ATOM 832 O TRP A 56 -17.251 17.640 5.763 1.00 0.00 O ATOM 833 CB TRP A 56 -14.039 17.117 6.445 1.00 0.00 C ATOM 834 CG TRP A 56 -14.799 15.937 6.968 1.00 0.00 C ATOM 835 CD1 TRP A 56 -15.580 15.895 8.088 1.00 0.00 C ATOM 836 CD2 TRP A 56 -14.849 14.626 6.393 1.00 0.00 C ATOM 837 NE1 TRP A 56 -16.112 14.638 8.244 1.00 0.00 N ATOM 838 CE2 TRP A 56 -15.680 13.841 7.217 1.00 0.00 C ATOM 839 CE3 TRP A 56 -14.275 14.040 5.262 1.00 0.00 C ATOM 840 CZ2 TRP A 56 -15.947 12.502 6.944 1.00 0.00 C ATOM 841 CZ3 TRP A 56 -14.541 12.711 4.993 1.00 0.00 C ATOM 842 CH2 TRP A 56 -15.372 11.954 5.830 1.00 0.00 C ATOM 0 H TRP A 56 -13.326 19.415 5.919 1.00 0.00 H new ATOM 0 HA TRP A 56 -15.020 17.629 4.603 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -13.198 16.763 5.848 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -13.622 17.673 7.285 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -15.754 16.728 8.753 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -16.729 14.346 9.002 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -13.635 14.615 4.610 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -16.586 11.917 7.589 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -14.101 12.247 4.122 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -15.562 10.918 5.591 1.00 0.00 H new ATOM 853 N ASP A 57 -16.341 19.023 7.286 1.00 0.00 N ATOM 854 CA ASP A 57 -17.601 19.265 7.980 1.00 0.00 C ATOM 855 C ASP A 57 -18.643 19.844 7.029 1.00 0.00 C ATOM 856 O ASP A 57 -19.835 19.864 7.334 1.00 0.00 O ATOM 857 CB ASP A 57 -17.384 20.215 9.159 1.00 0.00 C ATOM 858 CG ASP A 57 -17.616 19.540 10.497 1.00 0.00 C ATOM 859 OD1 ASP A 57 -18.524 18.686 10.582 1.00 0.00 O ATOM 860 OD2 ASP A 57 -16.889 19.866 11.459 1.00 0.00 O ATOM 0 H ASP A 57 -15.540 19.514 7.683 1.00 0.00 H new ATOM 0 HA ASP A 57 -17.970 18.310 8.356 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -16.367 20.606 9.124 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -18.057 21.067 9.064 1.00 0.00 H new ATOM 865 N GLY A 58 -18.185 20.316 5.873 1.00 0.00 N ATOM 866 CA GLY A 58 -19.090 20.890 4.895 1.00 0.00 C ATOM 867 C GLY A 58 -19.113 20.108 3.597 1.00 0.00 C ATOM 868 O GLY A 58 -19.709 20.544 2.611 1.00 0.00 O ATOM 0 H GLY A 58 -17.203 20.311 5.597 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -20.096 20.925 5.312 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -18.794 21.919 4.690 1.00 0.00 H new ATOM 872 N LEU A 59 -18.463 18.950 3.594 1.00 0.00 N ATOM 873 CA LEU A 59 -18.409 18.105 2.406 1.00 0.00 C ATOM 874 C LEU A 59 -19.769 17.474 2.125 1.00 0.00 C ATOM 875 O LEU A 59 -20.649 17.463 2.985 1.00 0.00 O ATOM 876 CB LEU A 59 -17.353 17.012 2.580 1.00 0.00 C ATOM 877 CG LEU A 59 -16.272 16.945 1.501 1.00 0.00 C ATOM 878 CD1 LEU A 59 -15.200 17.994 1.754 1.00 0.00 C ATOM 879 CD2 LEU A 59 -15.658 15.554 1.447 1.00 0.00 C ATOM 0 H LEU A 59 -17.966 18.574 4.401 1.00 0.00 H new ATOM 0 HA LEU A 59 -18.137 18.732 1.557 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -16.867 17.155 3.545 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -17.860 16.048 2.618 1.00 0.00 H new ATOM 0 HG LEU A 59 -16.735 17.153 0.536 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -14.439 17.931 0.976 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -15.651 18.986 1.741 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -14.740 17.817 2.726 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -14.891 15.525 0.673 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -15.210 15.316 2.412 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -16.433 14.823 1.217 1.00 0.00 H new ATOM 891 N GLY A 60 -19.933 16.946 0.916 1.00 0.00 N ATOM 892 CA GLY A 60 -21.187 16.318 0.544 1.00 0.00 C ATOM 893 C GLY A 60 -21.290 14.890 1.040 1.00 0.00 C ATOM 894 O GLY A 60 -20.276 14.243 1.302 1.00 0.00 O ATOM 0 H GLY A 60 -19.219 16.942 0.187 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -22.015 16.900 0.948 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -21.288 16.331 -0.541 1.00 0.00 H new ATOM 898 N GLU A 61 -22.517 14.396 1.170 1.00 0.00 N ATOM 899 CA GLU A 61 -22.747 13.036 1.640 1.00 0.00 C ATOM 900 C GLU A 61 -22.034 12.024 0.748 1.00 0.00 C ATOM 901 O GLU A 61 -21.505 11.022 1.229 1.00 0.00 O ATOM 902 CB GLU A 61 -24.246 12.731 1.677 1.00 0.00 C ATOM 903 CG GLU A 61 -24.728 12.205 3.018 1.00 0.00 C ATOM 904 CD GLU A 61 -26.240 12.189 3.130 1.00 0.00 C ATOM 905 OE1 GLU A 61 -26.890 11.535 2.288 1.00 0.00 O ATOM 906 OE2 GLU A 61 -26.774 12.831 4.059 1.00 0.00 O ATOM 0 H GLU A 61 -23.367 14.918 0.956 1.00 0.00 H new ATOM 0 HA GLU A 61 -22.342 12.955 2.649 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -24.799 13.638 1.432 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -24.478 11.998 0.904 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -24.346 11.195 3.166 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -24.315 12.822 3.816 1.00 0.00 H new ATOM 913 N GLU A 62 -22.024 12.294 -0.553 1.00 0.00 N ATOM 914 CA GLU A 62 -21.376 11.407 -1.512 1.00 0.00 C ATOM 915 C GLU A 62 -19.863 11.406 -1.317 1.00 0.00 C ATOM 916 O GLU A 62 -19.197 10.399 -1.556 1.00 0.00 O ATOM 917 CB GLU A 62 -21.717 11.830 -2.943 1.00 0.00 C ATOM 918 CG GLU A 62 -21.992 10.661 -3.874 1.00 0.00 C ATOM 919 CD GLU A 62 -23.392 10.697 -4.457 1.00 0.00 C ATOM 920 OE1 GLU A 62 -23.724 11.685 -5.144 1.00 0.00 O ATOM 921 OE2 GLU A 62 -24.154 9.735 -4.226 1.00 0.00 O ATOM 0 H GLU A 62 -22.457 13.119 -0.967 1.00 0.00 H new ATOM 0 HA GLU A 62 -21.747 10.396 -1.341 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -22.591 12.480 -2.922 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -20.892 12.418 -3.345 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -21.264 10.668 -4.685 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -21.853 9.727 -3.330 1.00 0.00 H new ATOM 928 N GLN A 63 -19.328 12.542 -0.882 1.00 0.00 N ATOM 929 CA GLN A 63 -17.893 12.673 -0.656 1.00 0.00 C ATOM 930 C GLN A 63 -17.511 12.159 0.728 1.00 0.00 C ATOM 931 O GLN A 63 -16.406 11.655 0.932 1.00 0.00 O ATOM 932 CB GLN A 63 -17.463 14.133 -0.808 1.00 0.00 C ATOM 933 CG GLN A 63 -17.699 14.695 -2.201 1.00 0.00 C ATOM 934 CD GLN A 63 -16.922 15.972 -2.454 1.00 0.00 C ATOM 935 OE1 GLN A 63 -15.958 15.984 -3.219 1.00 0.00 O ATOM 936 NE2 GLN A 63 -17.340 17.057 -1.811 1.00 0.00 N ATOM 0 H GLN A 63 -19.866 13.385 -0.679 1.00 0.00 H new ATOM 0 HA GLN A 63 -17.376 12.070 -1.403 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -18.006 14.740 -0.084 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -16.404 14.218 -0.566 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -17.415 13.948 -2.943 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -18.763 14.889 -2.335 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -18.144 17.001 -1.186 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -16.857 17.946 -1.942 1.00 0.00 H new ATOM 945 N LYS A 64 -18.431 12.290 1.677 1.00 0.00 N ATOM 946 CA LYS A 64 -18.192 11.838 3.043 1.00 0.00 C ATOM 947 C LYS A 64 -18.248 10.317 3.130 1.00 0.00 C ATOM 948 O LYS A 64 -17.389 9.691 3.750 1.00 0.00 O ATOM 949 CB LYS A 64 -19.223 12.452 3.992 1.00 0.00 C ATOM 950 CG LYS A 64 -18.798 13.792 4.568 1.00 0.00 C ATOM 951 CD LYS A 64 -19.607 14.150 5.804 1.00 0.00 C ATOM 952 CE LYS A 64 -19.129 15.453 6.424 1.00 0.00 C ATOM 953 NZ LYS A 64 -19.973 15.859 7.582 1.00 0.00 N ATOM 0 H LYS A 64 -19.350 12.706 1.526 1.00 0.00 H new ATOM 0 HA LYS A 64 -17.195 12.165 3.338 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -20.165 12.578 3.459 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -19.410 11.757 4.811 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -17.739 13.760 4.822 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -18.922 14.569 3.814 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -20.660 14.237 5.538 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -19.529 13.347 6.537 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -18.095 15.342 6.750 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -19.143 16.240 5.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -19.614 16.752 7.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -20.955 15.990 7.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -19.939 15.119 8.312 1.00 0.00 H new ATOM 967 N GLN A 65 -19.262 9.729 2.504 1.00 0.00 N ATOM 968 CA GLN A 65 -19.427 8.280 2.511 1.00 0.00 C ATOM 969 C GLN A 65 -18.311 7.601 1.725 1.00 0.00 C ATOM 970 O GLN A 65 -17.628 6.714 2.237 1.00 0.00 O ATOM 971 CB GLN A 65 -20.787 7.898 1.923 1.00 0.00 C ATOM 972 CG GLN A 65 -20.923 8.222 0.444 1.00 0.00 C ATOM 973 CD GLN A 65 -22.345 8.070 -0.059 1.00 0.00 C ATOM 974 OE1 GLN A 65 -23.102 9.040 -0.116 1.00 0.00 O ATOM 975 NE2 GLN A 65 -22.716 6.849 -0.426 1.00 0.00 N ATOM 0 H GLN A 65 -19.981 10.233 1.986 1.00 0.00 H new ATOM 0 HA GLN A 65 -19.377 7.939 3.545 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -20.950 6.830 2.069 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -21.571 8.418 2.474 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -20.587 9.244 0.267 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -20.267 7.567 -0.129 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -22.055 6.074 -0.362 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -23.662 6.686 -0.772 1.00 0.00 H new ATOM 984 N VAL A 66 -18.131 8.022 0.477 1.00 0.00 N ATOM 985 CA VAL A 66 -17.097 7.455 -0.380 1.00 0.00 C ATOM 986 C VAL A 66 -15.794 7.259 0.388 1.00 0.00 C ATOM 987 O VAL A 66 -15.172 6.199 0.314 1.00 0.00 O ATOM 988 CB VAL A 66 -16.829 8.351 -1.604 1.00 0.00 C ATOM 989 CG1 VAL A 66 -16.415 9.747 -1.164 1.00 0.00 C ATOM 990 CG2 VAL A 66 -15.767 7.728 -2.497 1.00 0.00 C ATOM 0 H VAL A 66 -18.688 8.754 0.037 1.00 0.00 H new ATOM 0 HA VAL A 66 -17.464 6.487 -0.721 1.00 0.00 H new ATOM 0 HB VAL A 66 -17.751 8.436 -2.179 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -16.230 10.365 -2.042 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -17.212 10.192 -0.568 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -15.506 9.685 -0.566 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -15.590 8.374 -3.357 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -14.841 7.611 -1.934 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -16.108 6.751 -2.841 1.00 0.00 H new ATOM 1000 N TYR A 67 -15.387 8.287 1.124 1.00 0.00 N ATOM 1001 CA TYR A 67 -14.157 8.228 1.904 1.00 0.00 C ATOM 1002 C TYR A 67 -14.224 7.115 2.945 1.00 0.00 C ATOM 1003 O TYR A 67 -13.210 6.506 3.287 1.00 0.00 O ATOM 1004 CB TYR A 67 -13.900 9.570 2.592 1.00 0.00 C ATOM 1005 CG TYR A 67 -13.265 10.603 1.688 1.00 0.00 C ATOM 1006 CD1 TYR A 67 -12.147 10.292 0.923 1.00 0.00 C ATOM 1007 CD2 TYR A 67 -13.783 11.889 1.598 1.00 0.00 C ATOM 1008 CE1 TYR A 67 -11.564 11.232 0.096 1.00 0.00 C ATOM 1009 CE2 TYR A 67 -13.207 12.835 0.773 1.00 0.00 C ATOM 1010 CZ TYR A 67 -12.097 12.502 0.024 1.00 0.00 C ATOM 1011 OH TYR A 67 -11.520 13.442 -0.798 1.00 0.00 O ATOM 0 H TYR A 67 -15.891 9.171 1.197 1.00 0.00 H new ATOM 0 HA TYR A 67 -13.335 8.013 1.222 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -14.844 9.962 2.970 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -13.254 9.408 3.455 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -11.727 9.298 0.976 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -14.651 12.153 2.183 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -10.695 10.974 -0.491 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -13.623 13.830 0.714 1.00 0.00 H new ATOM 0 HH TYR A 67 -12.138 14.193 -0.921 1.00 0.00 H new ATOM 1021 N LYS A 68 -15.427 6.854 3.446 1.00 0.00 N ATOM 1022 CA LYS A 68 -15.630 5.814 4.446 1.00 0.00 C ATOM 1023 C LYS A 68 -15.590 4.429 3.808 1.00 0.00 C ATOM 1024 O LYS A 68 -14.971 3.507 4.339 1.00 0.00 O ATOM 1025 CB LYS A 68 -16.968 6.019 5.160 1.00 0.00 C ATOM 1026 CG LYS A 68 -17.096 7.373 5.836 1.00 0.00 C ATOM 1027 CD LYS A 68 -17.045 7.248 7.350 1.00 0.00 C ATOM 1028 CE LYS A 68 -18.440 7.234 7.955 1.00 0.00 C ATOM 1029 NZ LYS A 68 -19.028 8.600 8.025 1.00 0.00 N ATOM 0 H LYS A 68 -16.276 7.349 3.175 1.00 0.00 H new ATOM 0 HA LYS A 68 -14.822 5.883 5.174 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -17.777 5.905 4.438 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -17.095 5.236 5.907 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -16.293 8.027 5.497 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -18.035 7.841 5.540 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -16.520 6.333 7.623 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -16.475 8.079 7.766 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -19.087 6.590 7.360 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -18.397 6.805 8.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -19.979 8.548 8.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -18.424 9.208 8.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -19.093 9.000 7.067 1.00 0.00 H new ATOM 1043 N LYS A 69 -16.252 4.291 2.664 1.00 0.00 N ATOM 1044 CA LYS A 69 -16.291 3.020 1.951 1.00 0.00 C ATOM 1045 C LYS A 69 -14.886 2.576 1.555 1.00 0.00 C ATOM 1046 O LYS A 69 -14.543 1.398 1.659 1.00 0.00 O ATOM 1047 CB LYS A 69 -17.170 3.137 0.704 1.00 0.00 C ATOM 1048 CG LYS A 69 -18.412 3.986 0.914 1.00 0.00 C ATOM 1049 CD LYS A 69 -19.103 3.650 2.225 1.00 0.00 C ATOM 1050 CE LYS A 69 -19.846 2.326 2.139 1.00 0.00 C ATOM 1051 NZ LYS A 69 -21.158 2.470 1.449 1.00 0.00 N ATOM 0 H LYS A 69 -16.769 5.044 2.211 1.00 0.00 H new ATOM 0 HA LYS A 69 -16.716 2.271 2.618 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -16.581 3.564 -0.107 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -17.472 2.139 0.387 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -18.138 5.041 0.906 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -19.104 3.830 0.087 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -18.364 3.603 3.025 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -19.803 4.445 2.483 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -19.233 1.600 1.606 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -20.005 1.933 3.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -21.633 1.546 1.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -21.753 3.144 1.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -21.005 2.821 0.482 1.00 0.00 H new ATOM 1065 N LYS A 70 -14.076 3.526 1.101 1.00 0.00 N ATOM 1066 CA LYS A 70 -12.707 3.235 0.692 1.00 0.00 C ATOM 1067 C LYS A 70 -11.863 2.801 1.887 1.00 0.00 C ATOM 1068 O LYS A 70 -11.220 1.751 1.858 1.00 0.00 O ATOM 1069 CB LYS A 70 -12.078 4.462 0.029 1.00 0.00 C ATOM 1070 CG LYS A 70 -12.651 4.773 -1.343 1.00 0.00 C ATOM 1071 CD LYS A 70 -11.705 5.637 -2.160 1.00 0.00 C ATOM 1072 CE LYS A 70 -12.466 6.588 -3.071 1.00 0.00 C ATOM 1073 NZ LYS A 70 -12.113 6.383 -4.504 1.00 0.00 N ATOM 0 H LYS A 70 -14.344 4.506 1.007 1.00 0.00 H new ATOM 0 HA LYS A 70 -12.736 2.417 -0.027 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -12.219 5.327 0.677 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.003 4.304 -0.063 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -12.847 3.843 -1.876 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -13.607 5.284 -1.232 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -11.063 6.209 -1.490 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -11.054 5.000 -2.759 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -13.538 6.441 -2.936 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -12.247 7.617 -2.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -12.652 7.049 -5.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -11.095 6.548 -4.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -12.345 5.408 -4.783 1.00 0.00 H new ATOM 1087 N THR A 71 -11.870 3.615 2.937 1.00 0.00 N ATOM 1088 CA THR A 71 -11.105 3.315 4.142 1.00 0.00 C ATOM 1089 C THR A 71 -11.129 1.822 4.450 1.00 0.00 C ATOM 1090 O THR A 71 -10.126 1.253 4.879 1.00 0.00 O ATOM 1091 CB THR A 71 -11.648 4.088 5.359 1.00 0.00 C ATOM 1092 OG1 THR A 71 -11.796 5.474 5.033 1.00 0.00 O ATOM 1093 CG2 THR A 71 -10.718 3.939 6.553 1.00 0.00 C ATOM 0 H THR A 71 -12.397 4.487 2.978 1.00 0.00 H new ATOM 0 HA THR A 71 -10.078 3.628 3.951 1.00 0.00 H new ATOM 0 HB THR A 71 -12.620 3.672 5.622 1.00 0.00 H new ATOM 0 HG1 THR A 71 -12.673 5.622 4.622 1.00 0.00 H new ATOM 0 HG21 THR A 71 -11.122 4.493 7.400 1.00 0.00 H new ATOM 0 HG22 THR A 71 -10.631 2.885 6.817 1.00 0.00 H new ATOM 0 HG23 THR A 71 -9.734 4.332 6.299 1.00 0.00 H new ATOM 1101 N GLU A 72 -12.279 1.195 4.228 1.00 0.00 N ATOM 1102 CA GLU A 72 -12.431 -0.233 4.483 1.00 0.00 C ATOM 1103 C GLU A 72 -11.721 -1.056 3.412 1.00 0.00 C ATOM 1104 O GLU A 72 -11.052 -2.043 3.714 1.00 0.00 O ATOM 1105 CB GLU A 72 -13.913 -0.610 4.532 1.00 0.00 C ATOM 1106 CG GLU A 72 -14.568 -0.331 5.874 1.00 0.00 C ATOM 1107 CD GLU A 72 -14.977 -1.598 6.599 1.00 0.00 C ATOM 1108 OE1 GLU A 72 -16.111 -2.070 6.375 1.00 0.00 O ATOM 1109 OE2 GLU A 72 -14.162 -2.119 7.390 1.00 0.00 O ATOM 0 H GLU A 72 -13.119 1.652 3.872 1.00 0.00 H new ATOM 0 HA GLU A 72 -11.975 -0.454 5.448 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -14.445 -0.060 3.756 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -14.017 -1.670 4.300 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -13.878 0.235 6.500 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -15.447 0.296 5.722 1.00 0.00 H new ATOM 1116 N ALA A 73 -11.873 -0.641 2.158 1.00 0.00 N ATOM 1117 CA ALA A 73 -11.246 -1.338 1.042 1.00 0.00 C ATOM 1118 C ALA A 73 -9.727 -1.211 1.099 1.00 0.00 C ATOM 1119 O ALA A 73 -9.003 -2.082 0.618 1.00 0.00 O ATOM 1120 CB ALA A 73 -11.773 -0.799 -0.280 1.00 0.00 C ATOM 0 H ALA A 73 -12.425 0.174 1.890 1.00 0.00 H new ATOM 0 HA ALA A 73 -11.499 -2.395 1.118 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -11.296 -1.329 -1.105 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.852 -0.947 -0.329 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -11.549 0.265 -0.354 1.00 0.00 H new ATOM 1126 N ALA A 74 -9.251 -0.119 1.689 1.00 0.00 N ATOM 1127 CA ALA A 74 -7.819 0.121 1.809 1.00 0.00 C ATOM 1128 C ALA A 74 -7.279 -0.424 3.128 1.00 0.00 C ATOM 1129 O ALA A 74 -6.093 -0.733 3.245 1.00 0.00 O ATOM 1130 CB ALA A 74 -7.521 1.608 1.690 1.00 0.00 C ATOM 0 H ALA A 74 -9.837 0.613 2.091 1.00 0.00 H new ATOM 0 HA ALA A 74 -7.319 -0.405 0.996 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -6.447 1.772 1.782 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -7.862 1.971 0.721 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.040 2.148 2.483 1.00 0.00 H new ATOM 1136 N LYS A 75 -8.158 -0.541 4.118 1.00 0.00 N ATOM 1137 CA LYS A 75 -7.771 -1.049 5.428 1.00 0.00 C ATOM 1138 C LYS A 75 -7.667 -2.571 5.412 1.00 0.00 C ATOM 1139 O LYS A 75 -6.601 -3.134 5.665 1.00 0.00 O ATOM 1140 CB LYS A 75 -8.783 -0.608 6.488 1.00 0.00 C ATOM 1141 CG LYS A 75 -8.772 -1.473 7.737 1.00 0.00 C ATOM 1142 CD LYS A 75 -8.663 -0.631 8.997 1.00 0.00 C ATOM 1143 CE LYS A 75 -9.884 0.258 9.181 1.00 0.00 C ATOM 1144 NZ LYS A 75 -9.512 1.694 9.308 1.00 0.00 N ATOM 0 H LYS A 75 -9.143 -0.291 4.037 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.792 -0.638 5.675 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.575 0.424 6.769 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.782 -0.625 6.053 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -9.683 -2.070 7.775 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.935 -2.170 7.691 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -8.553 -1.283 9.863 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -7.766 -0.013 8.947 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -10.557 0.131 8.333 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -10.430 -0.055 10.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -10.372 2.266 9.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -8.891 1.820 10.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -9.013 2.001 8.449 1.00 0.00 H new ATOM 1158 N LYS A 76 -8.779 -3.232 5.112 1.00 0.00 N ATOM 1159 CA LYS A 76 -8.814 -4.689 5.059 1.00 0.00 C ATOM 1160 C LYS A 76 -7.706 -5.227 4.160 1.00 0.00 C ATOM 1161 O LYS A 76 -7.095 -6.253 4.459 1.00 0.00 O ATOM 1162 CB LYS A 76 -10.175 -5.170 4.553 1.00 0.00 C ATOM 1163 CG LYS A 76 -10.959 -5.969 5.580 1.00 0.00 C ATOM 1164 CD LYS A 76 -12.406 -5.513 5.656 1.00 0.00 C ATOM 1165 CE LYS A 76 -13.305 -6.361 4.768 1.00 0.00 C ATOM 1166 NZ LYS A 76 -13.840 -5.583 3.617 1.00 0.00 N ATOM 0 H LYS A 76 -9.670 -2.782 4.901 1.00 0.00 H new ATOM 0 HA LYS A 76 -8.655 -5.068 6.069 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -10.766 -4.306 4.249 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -10.027 -5.783 3.664 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -10.923 -7.028 5.323 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -10.491 -5.863 6.559 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -12.753 -5.571 6.688 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -12.476 -4.468 5.354 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -12.744 -7.219 4.397 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -14.133 -6.753 5.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -14.447 -6.196 3.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -14.396 -4.779 3.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -13.050 -5.231 3.039 1.00 0.00 H new ATOM 1180 N GLU A 77 -7.452 -4.528 3.058 1.00 0.00 N ATOM 1181 CA GLU A 77 -6.417 -4.937 2.116 1.00 0.00 C ATOM 1182 C GLU A 77 -5.026 -4.711 2.704 1.00 0.00 C ATOM 1183 O GLU A 77 -4.164 -5.587 2.638 1.00 0.00 O ATOM 1184 CB GLU A 77 -6.558 -4.165 0.802 1.00 0.00 C ATOM 1185 CG GLU A 77 -5.699 -2.913 0.736 1.00 0.00 C ATOM 1186 CD GLU A 77 -5.858 -2.166 -0.574 1.00 0.00 C ATOM 1187 OE1 GLU A 77 -7.012 -1.944 -0.995 1.00 0.00 O ATOM 1188 OE2 GLU A 77 -4.826 -1.802 -1.177 1.00 0.00 O ATOM 0 H GLU A 77 -7.949 -3.676 2.796 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.541 -6.002 1.919 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -6.292 -4.822 -0.026 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -7.603 -3.886 0.665 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -5.963 -2.252 1.561 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -4.652 -3.187 0.869 1.00 0.00 H new ATOM 1195 N TYR A 78 -4.817 -3.532 3.277 1.00 0.00 N ATOM 1196 CA TYR A 78 -3.532 -3.189 3.874 1.00 0.00 C ATOM 1197 C TYR A 78 -2.990 -4.349 4.705 1.00 0.00 C ATOM 1198 O TYR A 78 -1.824 -4.725 4.581 1.00 0.00 O ATOM 1199 CB TYR A 78 -3.668 -1.941 4.748 1.00 0.00 C ATOM 1200 CG TYR A 78 -2.436 -1.642 5.573 1.00 0.00 C ATOM 1201 CD1 TYR A 78 -1.216 -1.378 4.964 1.00 0.00 C ATOM 1202 CD2 TYR A 78 -2.494 -1.623 6.961 1.00 0.00 C ATOM 1203 CE1 TYR A 78 -0.088 -1.105 5.713 1.00 0.00 C ATOM 1204 CE2 TYR A 78 -1.371 -1.350 7.719 1.00 0.00 C ATOM 1205 CZ TYR A 78 -0.171 -1.092 7.090 1.00 0.00 C ATOM 1206 OH TYR A 78 0.950 -0.819 7.840 1.00 0.00 O ATOM 0 H TYR A 78 -5.521 -2.797 3.341 1.00 0.00 H new ATOM 0 HA TYR A 78 -2.829 -2.984 3.067 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.885 -1.084 4.111 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -4.520 -2.066 5.416 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -1.148 -1.386 3.886 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -3.432 -1.825 7.456 1.00 0.00 H new ATOM 0 HE1 TYR A 78 0.853 -0.903 5.224 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -1.433 -1.339 8.797 1.00 0.00 H new ATOM 0 HH TYR A 78 0.721 -0.848 8.793 1.00 0.00 H new ATOM 1216 N LEU A 79 -3.846 -4.912 5.551 1.00 0.00 N ATOM 1217 CA LEU A 79 -3.456 -6.030 6.402 1.00 0.00 C ATOM 1218 C LEU A 79 -3.028 -7.230 5.564 1.00 0.00 C ATOM 1219 O LEU A 79 -1.976 -7.824 5.801 1.00 0.00 O ATOM 1220 CB LEU A 79 -4.612 -6.423 7.323 1.00 0.00 C ATOM 1221 CG LEU A 79 -4.786 -5.573 8.582 1.00 0.00 C ATOM 1222 CD1 LEU A 79 -5.325 -4.196 8.227 1.00 0.00 C ATOM 1223 CD2 LEU A 79 -5.709 -6.269 9.572 1.00 0.00 C ATOM 0 H LEU A 79 -4.814 -4.612 5.666 1.00 0.00 H new ATOM 0 HA LEU A 79 -2.608 -5.713 7.009 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -5.538 -6.380 6.749 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.472 -7.461 7.626 1.00 0.00 H new ATOM 0 HG LEU A 79 -3.810 -5.449 9.050 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -5.442 -3.606 9.136 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -4.628 -3.694 7.556 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -6.292 -4.300 7.735 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -5.821 -5.650 10.462 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -6.685 -6.424 9.112 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -5.282 -7.232 9.852 1.00 0.00 H new ATOM 1235 N LYS A 80 -3.850 -7.581 4.580 1.00 0.00 N ATOM 1236 CA LYS A 80 -3.556 -8.708 3.702 1.00 0.00 C ATOM 1237 C LYS A 80 -2.185 -8.549 3.054 1.00 0.00 C ATOM 1238 O LYS A 80 -1.369 -9.470 3.075 1.00 0.00 O ATOM 1239 CB LYS A 80 -4.632 -8.832 2.621 1.00 0.00 C ATOM 1240 CG LYS A 80 -5.796 -9.723 3.021 1.00 0.00 C ATOM 1241 CD LYS A 80 -6.933 -8.917 3.627 1.00 0.00 C ATOM 1242 CE LYS A 80 -8.249 -9.677 3.566 1.00 0.00 C ATOM 1243 NZ LYS A 80 -9.247 -8.989 2.702 1.00 0.00 N ATOM 0 H LYS A 80 -4.725 -7.101 4.371 1.00 0.00 H new ATOM 0 HA LYS A 80 -3.550 -9.616 4.306 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -5.011 -7.838 2.382 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.178 -9.227 1.712 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -6.158 -10.264 2.147 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -5.455 -10.469 3.739 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -6.698 -8.677 4.664 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -7.033 -7.971 3.096 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -8.070 -10.682 3.185 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -8.653 -9.785 4.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -10.130 -9.538 2.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -9.437 -8.039 3.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -8.872 -8.909 1.735 1.00 0.00 H new ATOM 1257 N GLN A 81 -1.939 -7.376 2.479 1.00 0.00 N ATOM 1258 CA GLN A 81 -0.666 -7.099 1.825 1.00 0.00 C ATOM 1259 C GLN A 81 0.487 -7.187 2.819 1.00 0.00 C ATOM 1260 O GLN A 81 1.399 -7.999 2.658 1.00 0.00 O ATOM 1261 CB GLN A 81 -0.692 -5.713 1.178 1.00 0.00 C ATOM 1262 CG GLN A 81 -1.312 -5.701 -0.209 1.00 0.00 C ATOM 1263 CD GLN A 81 -1.174 -4.357 -0.898 1.00 0.00 C ATOM 1264 OE1 GLN A 81 -0.264 -4.148 -1.701 1.00 0.00 O ATOM 1265 NE2 GLN A 81 -2.080 -3.437 -0.588 1.00 0.00 N ATOM 0 H GLN A 81 -2.604 -6.603 2.453 1.00 0.00 H new ATOM 0 HA GLN A 81 -0.513 -7.851 1.051 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -1.248 -5.031 1.821 1.00 0.00 H new ATOM 0 HB3 GLN A 81 0.327 -5.332 1.115 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -0.839 -6.469 -0.821 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -2.368 -5.959 -0.133 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -2.817 -3.653 0.083 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -2.039 -2.514 -1.021 1.00 0.00 H new ATOM 1274 N LEU A 82 0.441 -6.346 3.847 1.00 0.00 N ATOM 1275 CA LEU A 82 1.483 -6.329 4.869 1.00 0.00 C ATOM 1276 C LEU A 82 1.784 -7.740 5.364 1.00 0.00 C ATOM 1277 O LEU A 82 2.938 -8.166 5.392 1.00 0.00 O ATOM 1278 CB LEU A 82 1.059 -5.444 6.042 1.00 0.00 C ATOM 1279 CG LEU A 82 2.002 -5.428 7.246 1.00 0.00 C ATOM 1280 CD1 LEU A 82 3.347 -4.829 6.862 1.00 0.00 C ATOM 1281 CD2 LEU A 82 1.381 -4.655 8.400 1.00 0.00 C ATOM 0 H LEU A 82 -0.306 -5.667 3.995 1.00 0.00 H new ATOM 0 HA LEU A 82 2.389 -5.920 4.422 1.00 0.00 H new ATOM 0 HB2 LEU A 82 0.948 -4.422 5.679 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.076 -5.770 6.380 1.00 0.00 H new ATOM 0 HG LEU A 82 2.164 -6.456 7.570 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.005 -4.826 7.731 1.00 0.00 H new ATOM 0 HD12 LEU A 82 3.797 -5.425 6.068 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.203 -3.807 6.512 1.00 0.00 H new ATOM 0 HD21 LEU A 82 2.066 -4.654 9.248 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.188 -3.628 8.088 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.443 -5.128 8.692 1.00 0.00 H new ATOM 1293 N ALA A 83 0.737 -8.461 5.751 1.00 0.00 N ATOM 1294 CA ALA A 83 0.888 -9.826 6.241 1.00 0.00 C ATOM 1295 C ALA A 83 1.911 -10.596 5.413 1.00 0.00 C ATOM 1296 O ALA A 83 2.592 -11.486 5.921 1.00 0.00 O ATOM 1297 CB ALA A 83 -0.453 -10.544 6.227 1.00 0.00 C ATOM 0 H ALA A 83 -0.225 -8.123 5.735 1.00 0.00 H new ATOM 0 HA ALA A 83 1.251 -9.779 7.268 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -0.325 -11.562 6.595 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.157 -10.012 6.867 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.840 -10.573 5.208 1.00 0.00 H new ATOM 1303 N ALA A 84 2.013 -10.248 4.134 1.00 0.00 N ATOM 1304 CA ALA A 84 2.954 -10.906 3.236 1.00 0.00 C ATOM 1305 C ALA A 84 4.347 -10.299 3.359 1.00 0.00 C ATOM 1306 O ALA A 84 5.343 -11.018 3.445 1.00 0.00 O ATOM 1307 CB ALA A 84 2.462 -10.817 1.799 1.00 0.00 C ATOM 0 H ALA A 84 1.455 -9.514 3.697 1.00 0.00 H new ATOM 0 HA ALA A 84 3.018 -11.956 3.522 1.00 0.00 H new ATOM 0 HB1 ALA A 84 3.174 -11.312 1.139 1.00 0.00 H new ATOM 0 HB2 ALA A 84 1.491 -11.305 1.716 1.00 0.00 H new ATOM 0 HB3 ALA A 84 2.368 -9.770 1.511 1.00 0.00 H new ATOM 1313 N TYR A 85 4.410 -8.972 3.367 1.00 0.00 N ATOM 1314 CA TYR A 85 5.682 -8.268 3.477 1.00 0.00 C ATOM 1315 C TYR A 85 6.565 -8.902 4.548 1.00 0.00 C ATOM 1316 O TYR A 85 7.777 -9.032 4.372 1.00 0.00 O ATOM 1317 CB TYR A 85 5.446 -6.793 3.803 1.00 0.00 C ATOM 1318 CG TYR A 85 6.657 -6.100 4.387 1.00 0.00 C ATOM 1319 CD1 TYR A 85 7.872 -6.098 3.713 1.00 0.00 C ATOM 1320 CD2 TYR A 85 6.585 -5.446 5.611 1.00 0.00 C ATOM 1321 CE1 TYR A 85 8.981 -5.467 4.243 1.00 0.00 C ATOM 1322 CE2 TYR A 85 7.689 -4.812 6.147 1.00 0.00 C ATOM 1323 CZ TYR A 85 8.884 -4.825 5.460 1.00 0.00 C ATOM 1324 OH TYR A 85 9.986 -4.195 5.990 1.00 0.00 O ATOM 0 H TYR A 85 3.595 -8.362 3.299 1.00 0.00 H new ATOM 0 HA TYR A 85 6.194 -8.344 2.518 1.00 0.00 H new ATOM 0 HB2 TYR A 85 5.143 -6.273 2.894 1.00 0.00 H new ATOM 0 HB3 TYR A 85 4.618 -6.713 4.507 1.00 0.00 H new ATOM 0 HD1 TYR A 85 7.951 -6.598 2.759 1.00 0.00 H new ATOM 0 HD2 TYR A 85 5.650 -5.433 6.152 1.00 0.00 H new ATOM 0 HE1 TYR A 85 9.919 -5.476 3.707 1.00 0.00 H new ATOM 0 HE2 TYR A 85 7.616 -4.309 7.100 1.00 0.00 H new ATOM 0 HH TYR A 85 9.749 -3.791 6.851 1.00 0.00 H new ATOM 1334 N ARG A 86 5.948 -9.296 5.657 1.00 0.00 N ATOM 1335 CA ARG A 86 6.677 -9.917 6.757 1.00 0.00 C ATOM 1336 C ARG A 86 7.401 -11.176 6.288 1.00 0.00 C ATOM 1337 O ARG A 86 8.526 -11.447 6.704 1.00 0.00 O ATOM 1338 CB ARG A 86 5.720 -10.261 7.900 1.00 0.00 C ATOM 1339 CG ARG A 86 4.972 -9.058 8.451 1.00 0.00 C ATOM 1340 CD ARG A 86 3.482 -9.149 8.160 1.00 0.00 C ATOM 1341 NE ARG A 86 2.697 -9.336 9.377 1.00 0.00 N ATOM 1342 CZ ARG A 86 2.458 -10.523 9.923 1.00 0.00 C ATOM 1343 NH1 ARG A 86 2.941 -11.623 9.362 1.00 0.00 N ATOM 1344 NH2 ARG A 86 1.734 -10.612 11.032 1.00 0.00 N ATOM 0 H ARG A 86 4.946 -9.196 5.818 1.00 0.00 H new ATOM 0 HA ARG A 86 7.420 -9.205 7.116 1.00 0.00 H new ATOM 0 HB2 ARG A 86 4.998 -10.998 7.548 1.00 0.00 H new ATOM 0 HB3 ARG A 86 6.284 -10.728 8.707 1.00 0.00 H new ATOM 0 HG2 ARG A 86 5.130 -8.991 9.527 1.00 0.00 H new ATOM 0 HG3 ARG A 86 5.375 -8.145 8.012 1.00 0.00 H new ATOM 0 HD2 ARG A 86 3.155 -8.240 7.654 1.00 0.00 H new ATOM 0 HD3 ARG A 86 3.296 -9.978 7.478 1.00 0.00 H new ATOM 0 HE ARG A 86 2.311 -8.509 9.833 1.00 0.00 H new ATOM 0 HH11 ARG A 86 3.497 -11.559 8.509 1.00 0.00 H new ATOM 0 HH12 ARG A 86 2.756 -12.534 9.783 1.00 0.00 H new ATOM 0 HH21 ARG A 86 1.360 -9.768 11.466 1.00 0.00 H new ATOM 0 HH22 ARG A 86 1.551 -11.524 11.450 1.00 0.00 H new ATOM 1358 N ALA A 87 6.746 -11.940 5.420 1.00 0.00 N ATOM 1359 CA ALA A 87 7.327 -13.169 4.894 1.00 0.00 C ATOM 1360 C ALA A 87 8.821 -13.004 4.638 1.00 0.00 C ATOM 1361 O ALA A 87 9.581 -13.970 4.699 1.00 0.00 O ATOM 1362 CB ALA A 87 6.613 -13.585 3.617 1.00 0.00 C ATOM 0 H ALA A 87 5.813 -11.729 5.066 1.00 0.00 H new ATOM 0 HA ALA A 87 7.198 -13.952 5.641 1.00 0.00 H new ATOM 0 HB1 ALA A 87 7.057 -14.504 3.235 1.00 0.00 H new ATOM 0 HB2 ALA A 87 5.557 -13.753 3.829 1.00 0.00 H new ATOM 0 HB3 ALA A 87 6.713 -12.797 2.871 1.00 0.00 H new ATOM 1368 N SER A 88 9.235 -11.774 4.350 1.00 0.00 N ATOM 1369 CA SER A 88 10.638 -11.483 4.080 1.00 0.00 C ATOM 1370 C SER A 88 11.388 -11.175 5.373 1.00 0.00 C ATOM 1371 O SER A 88 12.539 -11.577 5.548 1.00 0.00 O ATOM 1372 CB SER A 88 10.759 -10.304 3.113 1.00 0.00 C ATOM 1373 OG SER A 88 10.861 -10.752 1.773 1.00 0.00 O ATOM 0 H SER A 88 8.619 -10.963 4.298 1.00 0.00 H new ATOM 0 HA SER A 88 11.085 -12.366 3.623 1.00 0.00 H new ATOM 0 HB2 SER A 88 9.891 -9.654 3.217 1.00 0.00 H new ATOM 0 HB3 SER A 88 11.636 -9.709 3.368 1.00 0.00 H new ATOM 0 HG SER A 88 10.935 -9.980 1.175 1.00 0.00 H new ATOM 1379 N LEU A 89 10.727 -10.459 6.276 1.00 0.00 N ATOM 1380 CA LEU A 89 11.329 -10.095 7.554 1.00 0.00 C ATOM 1381 C LEU A 89 11.570 -11.332 8.413 1.00 0.00 C ATOM 1382 O LEU A 89 12.640 -11.495 9.000 1.00 0.00 O ATOM 1383 CB LEU A 89 10.431 -9.108 8.301 1.00 0.00 C ATOM 1384 CG LEU A 89 10.168 -7.776 7.597 1.00 0.00 C ATOM 1385 CD1 LEU A 89 9.014 -7.041 8.261 1.00 0.00 C ATOM 1386 CD2 LEU A 89 11.423 -6.914 7.599 1.00 0.00 C ATOM 0 H LEU A 89 9.774 -10.119 6.147 1.00 0.00 H new ATOM 0 HA LEU A 89 12.290 -9.621 7.354 1.00 0.00 H new ATOM 0 HB2 LEU A 89 9.473 -9.591 8.491 1.00 0.00 H new ATOM 0 HB3 LEU A 89 10.881 -8.901 9.272 1.00 0.00 H new ATOM 0 HG LEU A 89 9.894 -7.982 6.562 1.00 0.00 H new ATOM 0 HD11 LEU A 89 8.841 -6.095 7.747 1.00 0.00 H new ATOM 0 HD12 LEU A 89 8.114 -7.653 8.207 1.00 0.00 H new ATOM 0 HD13 LEU A 89 9.259 -6.847 9.305 1.00 0.00 H new ATOM 0 HD21 LEU A 89 11.217 -5.970 7.094 1.00 0.00 H new ATOM 0 HD22 LEU A 89 11.727 -6.717 8.627 1.00 0.00 H new ATOM 0 HD23 LEU A 89 12.225 -7.437 7.078 1.00 0.00 H new ATOM 1398 N VAL A 90 10.567 -12.203 8.483 1.00 0.00 N ATOM 1399 CA VAL A 90 10.671 -13.427 9.268 1.00 0.00 C ATOM 1400 C VAL A 90 11.849 -14.277 8.807 1.00 0.00 C ATOM 1401 O VAL A 90 12.169 -14.321 7.619 1.00 0.00 O ATOM 1402 CB VAL A 90 9.381 -14.263 9.176 1.00 0.00 C ATOM 1403 CG1 VAL A 90 8.199 -13.485 9.733 1.00 0.00 C ATOM 1404 CG2 VAL A 90 9.122 -14.686 7.737 1.00 0.00 C ATOM 0 H VAL A 90 9.674 -12.083 8.005 1.00 0.00 H new ATOM 0 HA VAL A 90 10.828 -13.127 10.304 1.00 0.00 H new ATOM 0 HB VAL A 90 9.508 -15.163 9.778 1.00 0.00 H new ATOM 0 HG11 VAL A 90 7.297 -14.092 9.659 1.00 0.00 H new ATOM 0 HG12 VAL A 90 8.386 -13.238 10.778 1.00 0.00 H new ATOM 0 HG13 VAL A 90 8.066 -12.567 9.161 1.00 0.00 H new ATOM 0 HG21 VAL A 90 8.207 -15.276 7.690 1.00 0.00 H new ATOM 0 HG22 VAL A 90 9.015 -13.800 7.111 1.00 0.00 H new ATOM 0 HG23 VAL A 90 9.959 -15.285 7.378 1.00 0.00 H new ATOM 1414 N SER A 91 12.491 -14.952 9.755 1.00 0.00 N ATOM 1415 CA SER A 91 13.637 -15.800 9.448 1.00 0.00 C ATOM 1416 C SER A 91 13.227 -17.269 9.392 1.00 0.00 C ATOM 1417 O SER A 91 13.899 -18.090 8.768 1.00 0.00 O ATOM 1418 CB SER A 91 14.738 -15.605 10.492 1.00 0.00 C ATOM 1419 OG SER A 91 14.279 -15.951 11.787 1.00 0.00 O ATOM 0 H SER A 91 12.237 -14.928 10.743 1.00 0.00 H new ATOM 0 HA SER A 91 14.020 -15.510 8.469 1.00 0.00 H new ATOM 0 HB2 SER A 91 15.602 -16.217 10.233 1.00 0.00 H new ATOM 0 HB3 SER A 91 15.070 -14.567 10.486 1.00 0.00 H new ATOM 0 HG SER A 91 15.001 -15.819 12.436 1.00 0.00 H new ATOM 1425 N LYS A 92 12.119 -17.592 10.051 1.00 0.00 N ATOM 1426 CA LYS A 92 11.617 -18.961 10.078 1.00 0.00 C ATOM 1427 C LYS A 92 11.106 -19.379 8.703 1.00 0.00 C ATOM 1428 O LYS A 92 10.346 -18.651 8.064 1.00 0.00 O ATOM 1429 CB LYS A 92 10.497 -19.094 11.112 1.00 0.00 C ATOM 1430 CG LYS A 92 10.904 -19.873 12.352 1.00 0.00 C ATOM 1431 CD LYS A 92 11.086 -18.957 13.550 1.00 0.00 C ATOM 1432 CE LYS A 92 11.206 -19.749 14.843 1.00 0.00 C ATOM 1433 NZ LYS A 92 9.873 -20.063 15.428 1.00 0.00 N ATOM 0 H LYS A 92 11.552 -16.924 10.573 1.00 0.00 H new ATOM 0 HA LYS A 92 12.440 -19.619 10.356 1.00 0.00 H new ATOM 0 HB2 LYS A 92 10.169 -18.098 11.410 1.00 0.00 H new ATOM 0 HB3 LYS A 92 9.642 -19.586 10.648 1.00 0.00 H new ATOM 0 HG2 LYS A 92 10.145 -20.622 12.578 1.00 0.00 H new ATOM 0 HG3 LYS A 92 11.833 -20.409 12.158 1.00 0.00 H new ATOM 0 HD2 LYS A 92 11.979 -18.347 13.411 1.00 0.00 H new ATOM 0 HD3 LYS A 92 10.240 -18.273 13.618 1.00 0.00 H new ATOM 0 HE2 LYS A 92 11.746 -20.676 14.652 1.00 0.00 H new ATOM 0 HE3 LYS A 92 11.794 -19.181 15.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 9.999 -20.603 16.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 9.367 -19.178 15.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 9.321 -20.627 14.751 1.00 0.00 H new ATOM 1447 N SER A 93 11.526 -20.558 8.254 1.00 0.00 N ATOM 1448 CA SER A 93 11.112 -21.073 6.954 1.00 0.00 C ATOM 1449 C SER A 93 10.040 -22.146 7.111 1.00 0.00 C ATOM 1450 O SER A 93 10.341 -23.301 7.414 1.00 0.00 O ATOM 1451 CB SER A 93 12.315 -21.644 6.201 1.00 0.00 C ATOM 1452 OG SER A 93 12.797 -20.724 5.237 1.00 0.00 O ATOM 0 H SER A 93 12.153 -21.174 8.772 1.00 0.00 H new ATOM 0 HA SER A 93 10.693 -20.246 6.380 1.00 0.00 H new ATOM 0 HB2 SER A 93 13.109 -21.885 6.908 1.00 0.00 H new ATOM 0 HB3 SER A 93 12.032 -22.575 5.710 1.00 0.00 H new ATOM 0 HG SER A 93 13.567 -21.112 4.771 1.00 0.00 H new ATOM 1458 N TYR A 94 8.787 -21.757 6.903 1.00 0.00 N ATOM 1459 CA TYR A 94 7.668 -22.684 7.023 1.00 0.00 C ATOM 1460 C TYR A 94 6.994 -22.903 5.672 1.00 0.00 C ATOM 1461 O TYR A 94 7.331 -22.251 4.683 1.00 0.00 O ATOM 1462 CB TYR A 94 6.649 -22.158 8.035 1.00 0.00 C ATOM 1463 CG TYR A 94 6.663 -22.902 9.352 1.00 0.00 C ATOM 1464 CD1 TYR A 94 6.287 -24.237 9.422 1.00 0.00 C ATOM 1465 CD2 TYR A 94 7.055 -22.269 10.525 1.00 0.00 C ATOM 1466 CE1 TYR A 94 6.298 -24.920 10.623 1.00 0.00 C ATOM 1467 CE2 TYR A 94 7.071 -22.944 11.730 1.00 0.00 C ATOM 1468 CZ TYR A 94 6.691 -24.270 11.774 1.00 0.00 C ATOM 1469 OH TYR A 94 6.705 -24.947 12.972 1.00 0.00 O ATOM 0 H TYR A 94 8.521 -20.805 6.650 1.00 0.00 H new ATOM 0 HA TYR A 94 8.057 -23.640 7.373 1.00 0.00 H new ATOM 0 HB2 TYR A 94 6.847 -21.102 8.222 1.00 0.00 H new ATOM 0 HB3 TYR A 94 5.651 -22.224 7.601 1.00 0.00 H new ATOM 0 HD1 TYR A 94 5.981 -24.750 8.522 1.00 0.00 H new ATOM 0 HD2 TYR A 94 7.352 -21.231 10.494 1.00 0.00 H new ATOM 0 HE1 TYR A 94 6.000 -25.958 10.660 1.00 0.00 H new ATOM 0 HE2 TYR A 94 7.379 -22.437 12.632 1.00 0.00 H new ATOM 0 HH TYR A 94 7.008 -24.346 13.684 1.00 0.00 H new ATOM 1479 N THR A 95 6.038 -23.826 5.638 1.00 0.00 N ATOM 1480 CA THR A 95 5.315 -24.133 4.410 1.00 0.00 C ATOM 1481 C THR A 95 4.125 -25.045 4.685 1.00 0.00 C ATOM 1482 O THR A 95 3.041 -24.849 4.136 1.00 0.00 O ATOM 1483 CB THR A 95 6.233 -24.805 3.371 1.00 0.00 C ATOM 1484 OG1 THR A 95 5.499 -25.074 2.171 1.00 0.00 O ATOM 1485 CG2 THR A 95 6.812 -26.101 3.918 1.00 0.00 C ATOM 0 H THR A 95 5.746 -24.374 6.447 1.00 0.00 H new ATOM 0 HA THR A 95 4.957 -23.185 4.009 1.00 0.00 H new ATOM 0 HB THR A 95 7.054 -24.124 3.150 1.00 0.00 H new ATOM 0 HG1 THR A 95 6.089 -25.500 1.515 1.00 0.00 H new ATOM 0 HG21 THR A 95 7.457 -26.557 3.167 1.00 0.00 H new ATOM 0 HG22 THR A 95 7.394 -25.889 4.815 1.00 0.00 H new ATOM 0 HG23 THR A 95 6.001 -26.786 4.165 1.00 0.00 H new ATOM 1493 N ASP A 96 4.334 -26.041 5.539 1.00 0.00 N ATOM 1494 CA ASP A 96 3.277 -26.982 5.889 1.00 0.00 C ATOM 1495 C ASP A 96 2.945 -27.890 4.708 1.00 0.00 C ATOM 1496 O ASP A 96 2.088 -27.567 3.886 1.00 0.00 O ATOM 1497 CB ASP A 96 2.023 -26.231 6.338 1.00 0.00 C ATOM 1498 CG ASP A 96 1.573 -26.634 7.729 1.00 0.00 C ATOM 1499 OD1 ASP A 96 2.443 -26.786 8.612 1.00 0.00 O ATOM 1500 OD2 ASP A 96 0.352 -26.798 7.934 1.00 0.00 O ATOM 0 H ASP A 96 5.226 -26.217 6.002 1.00 0.00 H new ATOM 0 HA ASP A 96 3.634 -27.601 6.712 1.00 0.00 H new ATOM 0 HB2 ASP A 96 2.219 -25.159 6.319 1.00 0.00 H new ATOM 0 HB3 ASP A 96 1.217 -26.420 5.629 1.00 0.00 H new ATOM 1505 N SER A 97 3.630 -29.027 4.632 1.00 0.00 N ATOM 1506 CA SER A 97 3.412 -29.979 3.549 1.00 0.00 C ATOM 1507 C SER A 97 1.936 -30.349 3.441 1.00 0.00 C ATOM 1508 O SER A 97 1.285 -30.653 4.440 1.00 0.00 O ATOM 1509 CB SER A 97 4.250 -31.239 3.774 1.00 0.00 C ATOM 1510 OG SER A 97 5.571 -31.065 3.292 1.00 0.00 O ATOM 0 H SER A 97 4.340 -29.311 5.307 1.00 0.00 H new ATOM 0 HA SER A 97 3.720 -29.508 2.616 1.00 0.00 H new ATOM 0 HB2 SER A 97 4.276 -31.477 4.837 1.00 0.00 H new ATOM 0 HB3 SER A 97 3.784 -32.085 3.269 1.00 0.00 H new ATOM 0 HG SER A 97 6.087 -31.883 3.449 1.00 0.00 H new ATOM 1516 N GLY A 98 1.413 -30.321 2.218 1.00 0.00 N ATOM 1517 CA GLY A 98 0.018 -30.654 2.000 1.00 0.00 C ATOM 1518 C GLY A 98 -0.292 -32.099 2.336 1.00 0.00 C ATOM 1519 O GLY A 98 0.565 -32.978 2.243 1.00 0.00 O ATOM 0 H GLY A 98 1.931 -30.074 1.375 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -0.608 -30.001 2.608 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -0.239 -30.463 0.958 1.00 0.00 H new ATOM 1523 N PRO A 99 -1.544 -32.362 2.740 1.00 0.00 N ATOM 1524 CA PRO A 99 -1.994 -33.710 3.101 1.00 0.00 C ATOM 1525 C PRO A 99 -2.085 -34.633 1.892 1.00 0.00 C ATOM 1526 O PRO A 99 -1.803 -34.226 0.765 1.00 0.00 O ATOM 1527 CB PRO A 99 -3.382 -33.472 3.700 1.00 0.00 C ATOM 1528 CG PRO A 99 -3.849 -32.200 3.080 1.00 0.00 C ATOM 1529 CD PRO A 99 -2.618 -31.363 2.875 1.00 0.00 C ATOM 0 HA PRO A 99 -1.301 -34.203 3.782 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -4.058 -34.296 3.471 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -3.336 -33.390 4.786 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -4.354 -32.390 2.133 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -4.564 -31.691 3.726 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -2.700 -30.739 1.985 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -2.442 -30.695 3.718 1.00 0.00 H new ATOM 1537 N SER A 100 -2.483 -35.879 2.133 1.00 0.00 N ATOM 1538 CA SER A 100 -2.609 -36.862 1.063 1.00 0.00 C ATOM 1539 C SER A 100 -4.011 -37.462 1.040 1.00 0.00 C ATOM 1540 O SER A 100 -4.313 -38.389 1.791 1.00 0.00 O ATOM 1541 CB SER A 100 -1.569 -37.971 1.235 1.00 0.00 C ATOM 1542 OG SER A 100 -0.335 -37.610 0.639 1.00 0.00 O ATOM 0 H SER A 100 -2.724 -36.231 3.060 1.00 0.00 H new ATOM 0 HA SER A 100 -2.434 -36.355 0.114 1.00 0.00 H new ATOM 0 HB2 SER A 100 -1.419 -38.172 2.296 1.00 0.00 H new ATOM 0 HB3 SER A 100 -1.938 -38.893 0.785 1.00 0.00 H new ATOM 0 HG SER A 100 0.313 -38.334 0.764 1.00 0.00 H new ATOM 1548 N SER A 101 -4.863 -36.927 0.171 1.00 0.00 N ATOM 1549 CA SER A 101 -6.235 -37.407 0.051 1.00 0.00 C ATOM 1550 C SER A 101 -6.351 -38.450 -1.056 1.00 0.00 C ATOM 1551 O SER A 101 -6.758 -39.586 -0.814 1.00 0.00 O ATOM 1552 CB SER A 101 -7.183 -36.240 -0.231 1.00 0.00 C ATOM 1553 OG SER A 101 -7.389 -35.458 0.933 1.00 0.00 O ATOM 0 H SER A 101 -4.627 -36.161 -0.460 1.00 0.00 H new ATOM 0 HA SER A 101 -6.515 -37.873 0.996 1.00 0.00 H new ATOM 0 HB2 SER A 101 -6.771 -35.616 -1.024 1.00 0.00 H new ATOM 0 HB3 SER A 101 -8.139 -36.622 -0.590 1.00 0.00 H new ATOM 0 HG SER A 101 -7.997 -34.718 0.726 1.00 0.00 H new ATOM 1559 N GLY A 102 -5.988 -38.056 -2.273 1.00 0.00 N ATOM 1560 CA GLY A 102 -6.059 -38.967 -3.400 1.00 0.00 C ATOM 1561 C GLY A 102 -4.717 -39.593 -3.724 1.00 0.00 C ATOM 1562 O GLY A 102 -3.875 -38.971 -4.372 1.00 0.00 O ATOM 0 H GLY A 102 -5.646 -37.122 -2.498 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -6.781 -39.754 -3.182 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -6.427 -38.430 -4.275 1.00 0.00 H new TER 1566 GLY A 102