USER MOD reduce.3.24.130724 H: found=0, std=0, add=889, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 889 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 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -169:sc= 0.832 (180deg=0.679) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 GLN : amide:sc= -0.594 K(o=-0.59,f=-6.4!) USER MOD Single : A 18 MET CE :methyl 130:sc= -0.034 (180deg=-0.223) USER MOD Single : A 19 MET CE :methyl -124:sc= -0.0196 (180deg=-0.325) USER MOD Single : A 29 LYS NZ :NH3+ 177:sc= -0.238 (180deg=-0.252) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 163:sc= 0.668 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 1.14 K(o=1.1,f=-2.7!) USER MOD Single : A 64 LYS NZ :NH3+ -178:sc= -0.285 (180deg=-0.291) USER MOD Single : A 65 SER OG : rot -170:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.204 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 102 LYS NZ :NH3+ -131:sc= -0.0688 (180deg=-0.478) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0.0148 USER MOD Single : A 106 MET CE :methyl -153:sc= -1.75 (180deg=-2.87) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.615 -1.179 -2.985 1.00 0.00 N ATOM 2 CA MET A 1 3.970 -0.537 -1.824 1.00 0.00 C ATOM 3 C MET A 1 4.576 0.836 -1.554 1.00 0.00 C ATOM 4 O MET A 1 3.897 1.853 -1.701 1.00 0.00 O ATOM 5 CB MET A 1 4.062 -1.419 -0.573 1.00 0.00 C ATOM 6 CG MET A 1 3.322 -2.736 -0.785 1.00 0.00 C ATOM 7 SD MET A 1 1.563 -2.546 -1.184 1.00 0.00 S ATOM 8 CE MET A 1 1.112 -4.294 -1.306 1.00 0.00 C ATOM 0 H1 MET A 1 4.070 -2.019 -3.264 1.00 0.00 H new ATOM 0 H2 MET A 1 4.648 -0.508 -3.779 1.00 0.00 H new ATOM 0 H3 MET A 1 5.583 -1.463 -2.731 1.00 0.00 H new ATOM 0 HA MET A 1 2.915 -0.407 -2.067 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.108 -1.618 -0.338 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.638 -0.892 0.282 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.808 -3.287 -1.590 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.415 -3.341 0.117 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.053 -4.380 -1.548 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.703 -4.769 -2.089 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.308 -4.788 -0.354 1.00 0.00 H new ATOM 20 N SER A 2 5.852 0.870 -1.154 1.00 0.00 N ATOM 21 CA SER A 2 6.547 2.113 -0.839 1.00 0.00 C ATOM 22 C SER A 2 6.886 2.887 -2.114 1.00 0.00 C ATOM 23 O SER A 2 6.709 2.387 -3.224 1.00 0.00 O ATOM 24 CB SER A 2 7.818 1.795 -0.054 1.00 0.00 C ATOM 25 OG SER A 2 8.702 1.047 -0.864 1.00 0.00 O ATOM 0 H SER A 2 6.427 0.035 -1.041 1.00 0.00 H new ATOM 0 HA SER A 2 5.894 2.740 -0.233 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.298 2.719 0.269 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.570 1.233 0.846 1.00 0.00 H new ATOM 0 HG SER A 2 9.517 0.846 -0.359 1.00 0.00 H new ATOM 31 N ALA A 3 7.381 4.117 -1.945 1.00 0.00 N ATOM 32 CA ALA A 3 7.776 4.978 -3.055 1.00 0.00 C ATOM 33 C ALA A 3 9.125 4.558 -3.643 1.00 0.00 C ATOM 34 O ALA A 3 9.752 5.327 -4.371 1.00 0.00 O ATOM 35 CB ALA A 3 7.821 6.429 -2.567 1.00 0.00 C ATOM 0 H ALA A 3 7.518 4.542 -1.028 1.00 0.00 H new ATOM 0 HA ALA A 3 7.040 4.883 -3.854 1.00 0.00 H new ATOM 0 HB1 ALA A 3 8.115 7.081 -3.390 1.00 0.00 H new ATOM 0 HB2 ALA A 3 6.835 6.722 -2.207 1.00 0.00 H new ATOM 0 HB3 ALA A 3 8.545 6.518 -1.757 1.00 0.00 H new ATOM 41 N LEU A 4 9.578 3.338 -3.330 1.00 0.00 N ATOM 42 CA LEU A 4 10.845 2.815 -3.817 1.00 0.00 C ATOM 43 C LEU A 4 10.636 1.393 -4.332 1.00 0.00 C ATOM 44 O LEU A 4 10.459 0.467 -3.541 1.00 0.00 O ATOM 45 CB LEU A 4 11.869 2.873 -2.675 1.00 0.00 C ATOM 46 CG LEU A 4 13.110 2.006 -2.930 1.00 0.00 C ATOM 47 CD1 LEU A 4 13.797 2.408 -4.229 1.00 0.00 C ATOM 48 CD2 LEU A 4 14.095 2.196 -1.780 1.00 0.00 C ATOM 0 H LEU A 4 9.069 2.689 -2.729 1.00 0.00 H new ATOM 0 HA LEU A 4 11.226 3.412 -4.646 1.00 0.00 H new ATOM 0 HB2 LEU A 4 12.180 3.907 -2.527 1.00 0.00 H new ATOM 0 HB3 LEU A 4 11.391 2.549 -1.751 1.00 0.00 H new ATOM 0 HG LEU A 4 12.795 0.965 -3.003 1.00 0.00 H new ATOM 0 HD11 LEU A 4 14.673 1.779 -4.387 1.00 0.00 H new ATOM 0 HD12 LEU A 4 13.105 2.281 -5.061 1.00 0.00 H new ATOM 0 HD13 LEU A 4 14.106 3.452 -4.170 1.00 0.00 H new ATOM 0 HD21 LEU A 4 14.980 1.583 -1.954 1.00 0.00 H new ATOM 0 HD22 LEU A 4 14.386 3.245 -1.720 1.00 0.00 H new ATOM 0 HD23 LEU A 4 13.624 1.896 -0.844 1.00 0.00 H new ATOM 60 N THR A 5 10.657 1.224 -5.657 1.00 0.00 N ATOM 61 CA THR A 5 10.452 -0.077 -6.283 1.00 0.00 C ATOM 62 C THR A 5 11.352 -0.328 -7.491 1.00 0.00 C ATOM 63 O THR A 5 11.826 -1.445 -7.672 1.00 0.00 O ATOM 64 CB THR A 5 8.976 -0.285 -6.649 1.00 0.00 C ATOM 65 OG1 THR A 5 8.699 0.353 -7.875 1.00 0.00 O ATOM 66 CG2 THR A 5 8.018 0.251 -5.582 1.00 0.00 C ATOM 0 H THR A 5 10.816 1.983 -6.319 1.00 0.00 H new ATOM 0 HA THR A 5 10.741 -0.815 -5.535 1.00 0.00 H new ATOM 0 HB THR A 5 8.816 -1.361 -6.724 1.00 0.00 H new ATOM 0 HG1 THR A 5 7.757 0.218 -8.108 1.00 0.00 H new ATOM 0 HG21 THR A 5 6.989 0.076 -5.896 1.00 0.00 H new ATOM 0 HG22 THR A 5 8.202 -0.262 -4.638 1.00 0.00 H new ATOM 0 HG23 THR A 5 8.180 1.321 -5.452 1.00 0.00 H new ATOM 74 N GLN A 6 11.596 0.692 -8.319 1.00 0.00 N ATOM 75 CA GLN A 6 12.412 0.525 -9.509 1.00 0.00 C ATOM 76 C GLN A 6 13.881 0.544 -9.102 1.00 0.00 C ATOM 77 O GLN A 6 14.406 1.591 -8.730 1.00 0.00 O ATOM 78 CB GLN A 6 12.109 1.647 -10.509 1.00 0.00 C ATOM 79 CG GLN A 6 10.602 1.907 -10.671 1.00 0.00 C ATOM 80 CD GLN A 6 9.837 0.692 -11.180 1.00 0.00 C ATOM 81 OE1 GLN A 6 10.422 -0.283 -11.643 1.00 0.00 O ATOM 82 NE2 GLN A 6 8.510 0.743 -11.097 1.00 0.00 N ATOM 0 H GLN A 6 11.238 1.637 -8.181 1.00 0.00 H new ATOM 0 HA GLN A 6 12.186 -0.427 -9.990 1.00 0.00 H new ATOM 0 HB2 GLN A 6 12.598 2.564 -10.179 1.00 0.00 H new ATOM 0 HB3 GLN A 6 12.535 1.389 -11.478 1.00 0.00 H new ATOM 0 HG2 GLN A 6 10.187 2.214 -9.711 1.00 0.00 H new ATOM 0 HG3 GLN A 6 10.455 2.737 -11.362 1.00 0.00 H new ATOM 0 HE21 GLN A 6 8.055 1.568 -10.707 1.00 0.00 H new ATOM 0 HE22 GLN A 6 7.948 -0.043 -11.423 1.00 0.00 H new ATOM 91 N ILE A 7 14.546 -0.612 -9.165 1.00 0.00 N ATOM 92 CA ILE A 7 15.937 -0.728 -8.743 1.00 0.00 C ATOM 93 C ILE A 7 16.785 -1.414 -9.814 1.00 0.00 C ATOM 94 O ILE A 7 16.365 -2.417 -10.386 1.00 0.00 O ATOM 95 CB ILE A 7 16.004 -1.462 -7.393 1.00 0.00 C ATOM 96 CG1 ILE A 7 15.319 -0.593 -6.330 1.00 0.00 C ATOM 97 CG2 ILE A 7 17.464 -1.730 -7.014 1.00 0.00 C ATOM 98 CD1 ILE A 7 15.447 -1.178 -4.925 1.00 0.00 C ATOM 0 H ILE A 7 14.138 -1.482 -9.506 1.00 0.00 H new ATOM 0 HA ILE A 7 16.356 0.269 -8.611 1.00 0.00 H new ATOM 0 HB ILE A 7 15.492 -2.422 -7.462 1.00 0.00 H new ATOM 0 HG12 ILE A 7 15.755 0.406 -6.345 1.00 0.00 H new ATOM 0 HG13 ILE A 7 14.264 -0.484 -6.580 1.00 0.00 H new ATOM 0 HG21 ILE A 7 17.502 -2.250 -6.057 1.00 0.00 H new ATOM 0 HG22 ILE A 7 17.932 -2.347 -7.781 1.00 0.00 H new ATOM 0 HG23 ILE A 7 17.999 -0.784 -6.934 1.00 0.00 H new ATOM 0 HD11 ILE A 7 14.945 -0.524 -4.212 1.00 0.00 H new ATOM 0 HD12 ILE A 7 14.986 -2.165 -4.899 1.00 0.00 H new ATOM 0 HD13 ILE A 7 16.501 -1.262 -4.661 1.00 0.00 H new ATOM 110 N LEU A 8 17.979 -0.869 -10.073 1.00 0.00 N ATOM 111 CA LEU A 8 18.956 -1.490 -10.956 1.00 0.00 C ATOM 112 C LEU A 8 19.979 -2.266 -10.127 1.00 0.00 C ATOM 113 O LEU A 8 20.220 -1.926 -8.968 1.00 0.00 O ATOM 114 CB LEU A 8 19.643 -0.423 -11.814 1.00 0.00 C ATOM 115 CG LEU A 8 20.285 -1.066 -13.054 1.00 0.00 C ATOM 116 CD1 LEU A 8 19.245 -1.198 -14.164 1.00 0.00 C ATOM 117 CD2 LEU A 8 21.448 -0.227 -13.574 1.00 0.00 C ATOM 0 H LEU A 8 18.289 0.016 -9.673 1.00 0.00 H new ATOM 0 HA LEU A 8 18.450 -2.187 -11.623 1.00 0.00 H new ATOM 0 HB2 LEU A 8 18.916 0.329 -12.121 1.00 0.00 H new ATOM 0 HB3 LEU A 8 20.405 0.090 -11.227 1.00 0.00 H new ATOM 0 HG LEU A 8 20.659 -2.048 -12.763 1.00 0.00 H new ATOM 0 HD11 LEU A 8 19.705 -1.654 -15.041 1.00 0.00 H new ATOM 0 HD12 LEU A 8 18.422 -1.824 -13.819 1.00 0.00 H new ATOM 0 HD13 LEU A 8 18.865 -0.211 -14.426 1.00 0.00 H new ATOM 0 HD21 LEU A 8 21.881 -0.709 -14.451 1.00 0.00 H new ATOM 0 HD22 LEU A 8 21.088 0.765 -13.845 1.00 0.00 H new ATOM 0 HD23 LEU A 8 22.208 -0.137 -12.798 1.00 0.00 H new ATOM 129 N ILE A 9 20.585 -3.299 -10.712 1.00 0.00 N ATOM 130 CA ILE A 9 21.587 -4.106 -10.031 1.00 0.00 C ATOM 131 C ILE A 9 22.865 -4.138 -10.860 1.00 0.00 C ATOM 132 O ILE A 9 22.811 -4.212 -12.089 1.00 0.00 O ATOM 133 CB ILE A 9 21.041 -5.522 -9.779 1.00 0.00 C ATOM 134 CG1 ILE A 9 19.618 -5.486 -9.196 1.00 0.00 C ATOM 135 CG2 ILE A 9 21.982 -6.274 -8.831 1.00 0.00 C ATOM 136 CD1 ILE A 9 18.997 -6.883 -9.208 1.00 0.00 C ATOM 0 H ILE A 9 20.393 -3.596 -11.669 1.00 0.00 H new ATOM 0 HA ILE A 9 21.821 -3.664 -9.062 1.00 0.00 H new ATOM 0 HB ILE A 9 20.991 -6.042 -10.736 1.00 0.00 H new ATOM 0 HG12 ILE A 9 19.647 -5.103 -8.176 1.00 0.00 H new ATOM 0 HG13 ILE A 9 18.999 -4.802 -9.776 1.00 0.00 H new ATOM 0 HG21 ILE A 9 21.594 -7.277 -8.653 1.00 0.00 H new ATOM 0 HG22 ILE A 9 22.973 -6.342 -9.280 1.00 0.00 H new ATOM 0 HG23 ILE A 9 22.049 -5.738 -7.884 1.00 0.00 H new ATOM 0 HD11 ILE A 9 17.991 -6.837 -8.792 1.00 0.00 H new ATOM 0 HD12 ILE A 9 18.950 -7.251 -10.233 1.00 0.00 H new ATOM 0 HD13 ILE A 9 19.608 -7.558 -8.608 1.00 0.00 H new ATOM 148 N VAL A 10 24.016 -4.082 -10.183 1.00 0.00 N ATOM 149 CA VAL A 10 25.314 -4.112 -10.839 1.00 0.00 C ATOM 150 C VAL A 10 26.280 -5.004 -10.072 1.00 0.00 C ATOM 151 O VAL A 10 26.620 -4.720 -8.926 1.00 0.00 O ATOM 152 CB VAL A 10 25.875 -2.693 -10.997 1.00 0.00 C ATOM 153 CG1 VAL A 10 27.124 -2.733 -11.877 1.00 0.00 C ATOM 154 CG2 VAL A 10 24.843 -1.756 -11.619 1.00 0.00 C ATOM 0 H VAL A 10 24.067 -4.015 -9.167 1.00 0.00 H new ATOM 0 HA VAL A 10 25.188 -4.533 -11.836 1.00 0.00 H new ATOM 0 HB VAL A 10 26.128 -2.314 -10.007 1.00 0.00 H new ATOM 0 HG11 VAL A 10 27.522 -1.725 -11.989 1.00 0.00 H new ATOM 0 HG12 VAL A 10 27.876 -3.371 -11.413 1.00 0.00 H new ATOM 0 HG13 VAL A 10 26.865 -3.132 -12.858 1.00 0.00 H new ATOM 0 HG21 VAL A 10 25.270 -0.758 -11.718 1.00 0.00 H new ATOM 0 HG22 VAL A 10 24.560 -2.129 -12.603 1.00 0.00 H new ATOM 0 HG23 VAL A 10 23.961 -1.711 -10.980 1.00 0.00 H new ATOM 164 N GLU A 11 26.714 -6.085 -10.719 1.00 0.00 N ATOM 165 CA GLU A 11 27.598 -7.076 -10.119 1.00 0.00 C ATOM 166 C GLU A 11 28.383 -7.796 -11.215 1.00 0.00 C ATOM 167 O GLU A 11 28.237 -7.477 -12.393 1.00 0.00 O ATOM 168 CB GLU A 11 26.768 -8.080 -9.296 1.00 0.00 C ATOM 169 CG GLU A 11 26.080 -9.139 -10.172 1.00 0.00 C ATOM 170 CD GLU A 11 25.079 -8.547 -11.161 1.00 0.00 C ATOM 171 OE1 GLU A 11 24.394 -7.571 -10.779 1.00 0.00 O ATOM 172 OE2 GLU A 11 25.010 -9.079 -12.291 1.00 0.00 O ATOM 0 H GLU A 11 26.458 -6.297 -11.683 1.00 0.00 H new ATOM 0 HA GLU A 11 28.305 -6.581 -9.453 1.00 0.00 H new ATOM 0 HB2 GLU A 11 27.417 -8.577 -8.575 1.00 0.00 H new ATOM 0 HB3 GLU A 11 26.013 -7.539 -8.726 1.00 0.00 H new ATOM 0 HG2 GLU A 11 26.839 -9.694 -10.723 1.00 0.00 H new ATOM 0 HG3 GLU A 11 25.566 -9.854 -9.529 1.00 0.00 H new ATOM 179 N ASP A 12 29.218 -8.765 -10.832 1.00 0.00 N ATOM 180 CA ASP A 12 29.954 -9.576 -11.797 1.00 0.00 C ATOM 181 C ASP A 12 29.860 -11.064 -11.433 1.00 0.00 C ATOM 182 O ASP A 12 30.573 -11.885 -12.009 1.00 0.00 O ATOM 183 CB ASP A 12 31.413 -9.108 -11.874 1.00 0.00 C ATOM 184 CG ASP A 12 32.185 -9.296 -10.567 1.00 0.00 C ATOM 185 OD1 ASP A 12 33.382 -8.934 -10.563 1.00 0.00 O ATOM 186 OD2 ASP A 12 31.579 -9.794 -9.588 1.00 0.00 O ATOM 0 H ASP A 12 29.400 -9.005 -9.857 1.00 0.00 H new ATOM 0 HA ASP A 12 29.506 -9.449 -12.783 1.00 0.00 H new ATOM 0 HB2 ASP A 12 31.920 -9.656 -12.668 1.00 0.00 H new ATOM 0 HB3 ASP A 12 31.434 -8.054 -12.150 1.00 0.00 H new ATOM 191 N GLU A 13 28.981 -11.409 -10.480 1.00 0.00 N ATOM 192 CA GLU A 13 28.771 -12.790 -10.068 1.00 0.00 C ATOM 193 C GLU A 13 27.328 -13.196 -10.377 1.00 0.00 C ATOM 194 O GLU A 13 26.402 -12.442 -10.070 1.00 0.00 O ATOM 195 CB GLU A 13 29.073 -12.915 -8.568 1.00 0.00 C ATOM 196 CG GLU A 13 28.904 -14.352 -8.067 1.00 0.00 C ATOM 197 CD GLU A 13 30.009 -15.289 -8.565 1.00 0.00 C ATOM 198 OE1 GLU A 13 29.936 -16.487 -8.214 1.00 0.00 O ATOM 199 OE2 GLU A 13 30.908 -14.806 -9.287 1.00 0.00 O ATOM 0 H GLU A 13 28.401 -10.735 -9.980 1.00 0.00 H new ATOM 0 HA GLU A 13 29.438 -13.457 -10.614 1.00 0.00 H new ATOM 0 HB2 GLU A 13 30.092 -12.581 -8.374 1.00 0.00 H new ATOM 0 HB3 GLU A 13 28.410 -12.256 -8.008 1.00 0.00 H new ATOM 0 HG2 GLU A 13 28.897 -14.353 -6.977 1.00 0.00 H new ATOM 0 HG3 GLU A 13 27.936 -14.734 -8.392 1.00 0.00 H new ATOM 206 N PRO A 14 27.108 -14.380 -10.974 1.00 0.00 N ATOM 207 CA PRO A 14 25.780 -14.851 -11.332 1.00 0.00 C ATOM 208 C PRO A 14 24.894 -15.051 -10.107 1.00 0.00 C ATOM 209 O PRO A 14 23.702 -14.757 -10.150 1.00 0.00 O ATOM 210 CB PRO A 14 25.995 -16.192 -12.045 1.00 0.00 C ATOM 211 CG PRO A 14 27.469 -16.198 -12.446 1.00 0.00 C ATOM 212 CD PRO A 14 28.133 -15.316 -11.394 1.00 0.00 C ATOM 0 HA PRO A 14 25.272 -14.119 -11.960 1.00 0.00 H new ATOM 0 HB2 PRO A 14 25.762 -17.030 -11.388 1.00 0.00 H new ATOM 0 HB3 PRO A 14 25.349 -16.282 -12.918 1.00 0.00 H new ATOM 0 HG2 PRO A 14 27.881 -17.207 -12.441 1.00 0.00 H new ATOM 0 HG3 PRO A 14 27.612 -15.800 -13.451 1.00 0.00 H new ATOM 0 HD2 PRO A 14 28.491 -15.910 -10.553 1.00 0.00 H new ATOM 0 HD3 PRO A 14 28.996 -14.794 -11.807 1.00 0.00 H new ATOM 220 N LEU A 15 25.479 -15.551 -9.014 1.00 0.00 N ATOM 221 CA LEU A 15 24.732 -15.878 -7.811 1.00 0.00 C ATOM 222 C LEU A 15 24.172 -14.624 -7.151 1.00 0.00 C ATOM 223 O LEU A 15 23.003 -14.594 -6.778 1.00 0.00 O ATOM 224 CB LEU A 15 25.649 -16.610 -6.829 1.00 0.00 C ATOM 225 CG LEU A 15 25.607 -18.119 -7.063 1.00 0.00 C ATOM 226 CD1 LEU A 15 26.742 -18.783 -6.290 1.00 0.00 C ATOM 227 CD2 LEU A 15 24.281 -18.684 -6.553 1.00 0.00 C ATOM 0 H LEU A 15 26.480 -15.737 -8.945 1.00 0.00 H new ATOM 0 HA LEU A 15 23.894 -16.518 -8.089 1.00 0.00 H new ATOM 0 HB2 LEU A 15 26.671 -16.249 -6.942 1.00 0.00 H new ATOM 0 HB3 LEU A 15 25.344 -16.388 -5.806 1.00 0.00 H new ATOM 0 HG LEU A 15 25.710 -18.316 -8.130 1.00 0.00 H new ATOM 0 HD11 LEU A 15 26.714 -19.860 -6.456 1.00 0.00 H new ATOM 0 HD12 LEU A 15 27.697 -18.388 -6.635 1.00 0.00 H new ATOM 0 HD13 LEU A 15 26.627 -18.576 -5.226 1.00 0.00 H new ATOM 0 HD21 LEU A 15 24.255 -19.761 -6.722 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.186 -18.482 -5.486 1.00 0.00 H new ATOM 0 HD23 LEU A 15 23.456 -18.213 -7.087 1.00 0.00 H new ATOM 239 N ILE A 16 24.992 -13.583 -7.002 1.00 0.00 N ATOM 240 CA ILE A 16 24.548 -12.375 -6.319 1.00 0.00 C ATOM 241 C ILE A 16 23.501 -11.655 -7.166 1.00 0.00 C ATOM 242 O ILE A 16 22.675 -10.917 -6.637 1.00 0.00 O ATOM 243 CB ILE A 16 25.760 -11.479 -6.022 1.00 0.00 C ATOM 244 CG1 ILE A 16 26.864 -12.261 -5.293 1.00 0.00 C ATOM 245 CG2 ILE A 16 25.322 -10.277 -5.179 1.00 0.00 C ATOM 246 CD1 ILE A 16 26.375 -12.914 -3.996 1.00 0.00 C ATOM 0 H ILE A 16 25.954 -13.554 -7.341 1.00 0.00 H new ATOM 0 HA ILE A 16 24.081 -12.633 -5.369 1.00 0.00 H new ATOM 0 HB ILE A 16 26.167 -11.128 -6.970 1.00 0.00 H new ATOM 0 HG12 ILE A 16 27.255 -13.032 -5.957 1.00 0.00 H new ATOM 0 HG13 ILE A 16 27.690 -11.587 -5.066 1.00 0.00 H new ATOM 0 HG21 ILE A 16 26.185 -9.645 -4.971 1.00 0.00 H new ATOM 0 HG22 ILE A 16 24.574 -9.702 -5.726 1.00 0.00 H new ATOM 0 HG23 ILE A 16 24.894 -10.628 -4.240 1.00 0.00 H new ATOM 0 HD11 ILE A 16 27.199 -13.452 -3.526 1.00 0.00 H new ATOM 0 HD12 ILE A 16 26.010 -12.144 -3.316 1.00 0.00 H new ATOM 0 HD13 ILE A 16 25.568 -13.611 -4.221 1.00 0.00 H new ATOM 258 N ALA A 17 23.527 -11.873 -8.484 1.00 0.00 N ATOM 259 CA ALA A 17 22.565 -11.269 -9.387 1.00 0.00 C ATOM 260 C ALA A 17 21.191 -11.913 -9.207 1.00 0.00 C ATOM 261 O ALA A 17 20.204 -11.212 -8.997 1.00 0.00 O ATOM 262 CB ALA A 17 23.049 -11.438 -10.825 1.00 0.00 C ATOM 0 H ALA A 17 24.214 -12.470 -8.945 1.00 0.00 H new ATOM 0 HA ALA A 17 22.474 -10.207 -9.161 1.00 0.00 H new ATOM 0 HB1 ALA A 17 22.329 -10.986 -11.507 1.00 0.00 H new ATOM 0 HB2 ALA A 17 24.017 -10.950 -10.943 1.00 0.00 H new ATOM 0 HB3 ALA A 17 23.148 -12.499 -11.053 1.00 0.00 H new ATOM 268 N MET A 18 21.125 -13.246 -9.285 1.00 0.00 N ATOM 269 CA MET A 18 19.851 -13.953 -9.228 1.00 0.00 C ATOM 270 C MET A 18 19.251 -13.889 -7.826 1.00 0.00 C ATOM 271 O MET A 18 18.036 -13.992 -7.669 1.00 0.00 O ATOM 272 CB MET A 18 20.047 -15.408 -9.670 1.00 0.00 C ATOM 273 CG MET A 18 21.001 -16.161 -8.737 1.00 0.00 C ATOM 274 SD MET A 18 21.194 -17.920 -9.131 1.00 0.00 S ATOM 275 CE MET A 18 22.037 -17.779 -10.727 1.00 0.00 C ATOM 0 H MET A 18 21.939 -13.852 -9.387 1.00 0.00 H new ATOM 0 HA MET A 18 19.151 -13.467 -9.908 1.00 0.00 H new ATOM 0 HB2 MET A 18 19.082 -15.915 -9.690 1.00 0.00 H new ATOM 0 HB3 MET A 18 20.440 -15.430 -10.687 1.00 0.00 H new ATOM 0 HG2 MET A 18 21.980 -15.683 -8.774 1.00 0.00 H new ATOM 0 HG3 MET A 18 20.639 -16.067 -7.713 1.00 0.00 H new ATOM 0 HE1 MET A 18 22.922 -18.415 -10.728 1.00 0.00 H new ATOM 0 HE2 MET A 18 21.363 -18.094 -11.524 1.00 0.00 H new ATOM 0 HE3 MET A 18 22.334 -16.743 -10.891 1.00 0.00 H new ATOM 285 N MET A 19 20.094 -13.714 -6.802 1.00 0.00 N ATOM 286 CA MET A 19 19.621 -13.582 -5.433 1.00 0.00 C ATOM 287 C MET A 19 18.946 -12.227 -5.229 1.00 0.00 C ATOM 288 O MET A 19 17.961 -12.130 -4.499 1.00 0.00 O ATOM 289 CB MET A 19 20.805 -13.748 -4.475 1.00 0.00 C ATOM 290 CG MET A 19 21.228 -15.217 -4.396 1.00 0.00 C ATOM 291 SD MET A 19 20.041 -16.302 -3.559 1.00 0.00 S ATOM 292 CE MET A 19 20.235 -15.697 -1.862 1.00 0.00 C ATOM 0 H MET A 19 21.108 -13.661 -6.903 1.00 0.00 H new ATOM 0 HA MET A 19 18.882 -14.357 -5.228 1.00 0.00 H new ATOM 0 HB2 MET A 19 21.643 -13.140 -4.815 1.00 0.00 H new ATOM 0 HB3 MET A 19 20.531 -13.388 -3.483 1.00 0.00 H new ATOM 0 HG2 MET A 19 21.390 -15.589 -5.408 1.00 0.00 H new ATOM 0 HG3 MET A 19 22.185 -15.278 -3.877 1.00 0.00 H new ATOM 0 HE1 MET A 19 20.500 -16.528 -1.208 1.00 0.00 H new ATOM 0 HE2 MET A 19 21.024 -14.946 -1.832 1.00 0.00 H new ATOM 0 HE3 MET A 19 19.298 -15.253 -1.525 1.00 0.00 H new ATOM 302 N LEU A 20 19.471 -11.179 -5.872 1.00 0.00 N ATOM 303 CA LEU A 20 18.913 -9.841 -5.739 1.00 0.00 C ATOM 304 C LEU A 20 17.664 -9.686 -6.602 1.00 0.00 C ATOM 305 O LEU A 20 16.760 -8.936 -6.244 1.00 0.00 O ATOM 306 CB LEU A 20 19.976 -8.814 -6.126 1.00 0.00 C ATOM 307 CG LEU A 20 21.077 -8.728 -5.061 1.00 0.00 C ATOM 308 CD1 LEU A 20 22.185 -7.796 -5.549 1.00 0.00 C ATOM 309 CD2 LEU A 20 20.516 -8.173 -3.752 1.00 0.00 C ATOM 0 H LEU A 20 20.282 -11.238 -6.488 1.00 0.00 H new ATOM 0 HA LEU A 20 18.616 -9.676 -4.703 1.00 0.00 H new ATOM 0 HB2 LEU A 20 20.415 -9.085 -7.086 1.00 0.00 H new ATOM 0 HB3 LEU A 20 19.512 -7.836 -6.253 1.00 0.00 H new ATOM 0 HG LEU A 20 21.470 -9.730 -4.889 1.00 0.00 H new ATOM 0 HD11 LEU A 20 22.968 -7.734 -4.793 1.00 0.00 H new ATOM 0 HD12 LEU A 20 22.606 -8.185 -6.476 1.00 0.00 H new ATOM 0 HD13 LEU A 20 21.773 -6.803 -5.727 1.00 0.00 H new ATOM 0 HD21 LEU A 20 21.312 -8.119 -3.009 1.00 0.00 H new ATOM 0 HD22 LEU A 20 20.112 -7.175 -3.923 1.00 0.00 H new ATOM 0 HD23 LEU A 20 19.724 -8.828 -3.389 1.00 0.00 H new ATOM 321 N GLU A 21 17.606 -10.388 -7.739 1.00 0.00 N ATOM 322 CA GLU A 21 16.432 -10.348 -8.601 1.00 0.00 C ATOM 323 C GLU A 21 15.243 -11.035 -7.929 1.00 0.00 C ATOM 324 O GLU A 21 14.097 -10.649 -8.157 1.00 0.00 O ATOM 325 CB GLU A 21 16.753 -11.031 -9.929 1.00 0.00 C ATOM 326 CG GLU A 21 17.724 -10.177 -10.751 1.00 0.00 C ATOM 327 CD GLU A 21 18.197 -10.903 -12.010 1.00 0.00 C ATOM 328 OE1 GLU A 21 17.803 -12.074 -12.198 1.00 0.00 O ATOM 329 OE2 GLU A 21 18.955 -10.266 -12.777 1.00 0.00 O ATOM 0 H GLU A 21 18.359 -10.987 -8.078 1.00 0.00 H new ATOM 0 HA GLU A 21 16.164 -9.307 -8.783 1.00 0.00 H new ATOM 0 HB2 GLU A 21 17.190 -12.012 -9.744 1.00 0.00 H new ATOM 0 HB3 GLU A 21 15.834 -11.192 -10.493 1.00 0.00 H new ATOM 0 HG2 GLU A 21 17.237 -9.243 -11.032 1.00 0.00 H new ATOM 0 HG3 GLU A 21 18.586 -9.915 -10.137 1.00 0.00 H new ATOM 336 N ASP A 22 15.511 -12.048 -7.101 1.00 0.00 N ATOM 337 CA ASP A 22 14.460 -12.787 -6.418 1.00 0.00 C ATOM 338 C ASP A 22 13.874 -11.964 -5.271 1.00 0.00 C ATOM 339 O ASP A 22 12.658 -11.927 -5.088 1.00 0.00 O ATOM 340 CB ASP A 22 15.041 -14.112 -5.912 1.00 0.00 C ATOM 341 CG ASP A 22 14.017 -14.948 -5.141 1.00 0.00 C ATOM 342 OD1 ASP A 22 14.465 -15.783 -4.324 1.00 0.00 O ATOM 343 OD2 ASP A 22 12.805 -14.751 -5.379 1.00 0.00 O ATOM 0 H ASP A 22 16.455 -12.372 -6.890 1.00 0.00 H new ATOM 0 HA ASP A 22 13.645 -12.993 -7.112 1.00 0.00 H new ATOM 0 HB2 ASP A 22 15.411 -14.689 -6.759 1.00 0.00 H new ATOM 0 HB3 ASP A 22 15.896 -13.907 -5.268 1.00 0.00 H new ATOM 348 N PHE A 23 14.739 -11.301 -4.497 1.00 0.00 N ATOM 349 CA PHE A 23 14.297 -10.541 -3.341 1.00 0.00 C ATOM 350 C PHE A 23 13.533 -9.262 -3.661 1.00 0.00 C ATOM 351 O PHE A 23 12.707 -8.818 -2.865 1.00 0.00 O ATOM 352 CB PHE A 23 15.461 -10.276 -2.386 1.00 0.00 C ATOM 353 CG PHE A 23 15.871 -11.478 -1.561 1.00 0.00 C ATOM 354 CD1 PHE A 23 14.923 -12.162 -0.783 1.00 0.00 C ATOM 355 CD2 PHE A 23 17.206 -11.909 -1.573 1.00 0.00 C ATOM 356 CE1 PHE A 23 15.312 -13.278 -0.029 1.00 0.00 C ATOM 357 CE2 PHE A 23 17.592 -13.018 -0.813 1.00 0.00 C ATOM 358 CZ PHE A 23 16.646 -13.708 -0.044 1.00 0.00 C ATOM 0 H PHE A 23 15.746 -11.280 -4.656 1.00 0.00 H new ATOM 0 HA PHE A 23 13.564 -11.177 -2.845 1.00 0.00 H new ATOM 0 HB2 PHE A 23 16.320 -9.935 -2.964 1.00 0.00 H new ATOM 0 HB3 PHE A 23 15.187 -9.464 -1.713 1.00 0.00 H new ATOM 0 HD1 PHE A 23 13.896 -11.829 -0.766 1.00 0.00 H new ATOM 0 HD2 PHE A 23 17.937 -11.384 -2.170 1.00 0.00 H new ATOM 0 HE1 PHE A 23 14.582 -13.808 0.565 1.00 0.00 H new ATOM 0 HE2 PHE A 23 18.622 -13.343 -0.819 1.00 0.00 H new ATOM 0 HZ PHE A 23 16.944 -14.569 0.536 1.00 0.00 H new ATOM 368 N LEU A 24 13.798 -8.656 -4.821 1.00 0.00 N ATOM 369 CA LEU A 24 13.085 -7.449 -5.203 1.00 0.00 C ATOM 370 C LEU A 24 11.662 -7.798 -5.625 1.00 0.00 C ATOM 371 O LEU A 24 10.729 -7.082 -5.282 1.00 0.00 O ATOM 372 CB LEU A 24 13.831 -6.749 -6.339 1.00 0.00 C ATOM 373 CG LEU A 24 15.131 -6.114 -5.835 1.00 0.00 C ATOM 374 CD1 LEU A 24 15.927 -5.592 -7.026 1.00 0.00 C ATOM 375 CD2 LEU A 24 14.834 -4.944 -4.897 1.00 0.00 C ATOM 0 H LEU A 24 14.490 -8.979 -5.497 1.00 0.00 H new ATOM 0 HA LEU A 24 13.034 -6.771 -4.351 1.00 0.00 H new ATOM 0 HB2 LEU A 24 14.055 -7.467 -7.128 1.00 0.00 H new ATOM 0 HB3 LEU A 24 13.194 -5.981 -6.778 1.00 0.00 H new ATOM 0 HG LEU A 24 15.699 -6.870 -5.293 1.00 0.00 H new ATOM 0 HD11 LEU A 24 16.854 -5.139 -6.674 1.00 0.00 H new ATOM 0 HD12 LEU A 24 16.160 -6.418 -7.698 1.00 0.00 H new ATOM 0 HD13 LEU A 24 15.338 -4.846 -7.559 1.00 0.00 H new ATOM 0 HD21 LEU A 24 15.771 -4.508 -4.551 1.00 0.00 H new ATOM 0 HD22 LEU A 24 14.257 -4.188 -5.430 1.00 0.00 H new ATOM 0 HD23 LEU A 24 14.262 -5.301 -4.041 1.00 0.00 H new ATOM 387 N GLU A 25 11.491 -8.894 -6.368 1.00 0.00 N ATOM 388 CA GLU A 25 10.173 -9.265 -6.866 1.00 0.00 C ATOM 389 C GLU A 25 9.256 -9.756 -5.740 1.00 0.00 C ATOM 390 O GLU A 25 8.036 -9.670 -5.866 1.00 0.00 O ATOM 391 CB GLU A 25 10.312 -10.323 -7.961 1.00 0.00 C ATOM 392 CG GLU A 25 10.960 -9.710 -9.205 1.00 0.00 C ATOM 393 CD GLU A 25 11.042 -10.716 -10.356 1.00 0.00 C ATOM 394 OE1 GLU A 25 11.451 -10.287 -11.457 1.00 0.00 O ATOM 395 OE2 GLU A 25 10.694 -11.896 -10.127 1.00 0.00 O ATOM 0 H GLU A 25 12.242 -9.531 -6.633 1.00 0.00 H new ATOM 0 HA GLU A 25 9.706 -8.375 -7.289 1.00 0.00 H new ATOM 0 HB2 GLU A 25 10.916 -11.155 -7.599 1.00 0.00 H new ATOM 0 HB3 GLU A 25 9.332 -10.727 -8.214 1.00 0.00 H new ATOM 0 HG2 GLU A 25 10.386 -8.840 -9.523 1.00 0.00 H new ATOM 0 HG3 GLU A 25 11.961 -9.358 -8.957 1.00 0.00 H new ATOM 402 N VAL A 26 9.826 -10.268 -4.640 1.00 0.00 N ATOM 403 CA VAL A 26 9.026 -10.707 -3.501 1.00 0.00 C ATOM 404 C VAL A 26 8.666 -9.556 -2.558 1.00 0.00 C ATOM 405 O VAL A 26 7.694 -9.650 -1.810 1.00 0.00 O ATOM 406 CB VAL A 26 9.719 -11.873 -2.777 1.00 0.00 C ATOM 407 CG1 VAL A 26 10.776 -11.376 -1.796 1.00 0.00 C ATOM 408 CG2 VAL A 26 8.682 -12.690 -2.003 1.00 0.00 C ATOM 0 H VAL A 26 10.832 -10.386 -4.520 1.00 0.00 H new ATOM 0 HA VAL A 26 8.073 -11.074 -3.883 1.00 0.00 H new ATOM 0 HB VAL A 26 10.205 -12.488 -3.534 1.00 0.00 H new ATOM 0 HG11 VAL A 26 11.244 -12.228 -1.303 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.534 -10.807 -2.335 1.00 0.00 H new ATOM 0 HG13 VAL A 26 10.306 -10.737 -1.048 1.00 0.00 H new ATOM 0 HG21 VAL A 26 9.177 -13.515 -1.491 1.00 0.00 H new ATOM 0 HG22 VAL A 26 8.190 -12.052 -1.270 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.940 -13.086 -2.696 1.00 0.00 H new ATOM 418 N LEU A 27 9.448 -8.472 -2.596 1.00 0.00 N ATOM 419 CA LEU A 27 9.173 -7.269 -1.817 1.00 0.00 C ATOM 420 C LEU A 27 8.233 -6.327 -2.574 1.00 0.00 C ATOM 421 O LEU A 27 8.126 -5.155 -2.225 1.00 0.00 O ATOM 422 CB LEU A 27 10.490 -6.562 -1.482 1.00 0.00 C ATOM 423 CG LEU A 27 11.306 -7.329 -0.436 1.00 0.00 C ATOM 424 CD1 LEU A 27 12.653 -6.628 -0.262 1.00 0.00 C ATOM 425 CD2 LEU A 27 10.581 -7.337 0.906 1.00 0.00 C ATOM 0 H LEU A 27 10.289 -8.408 -3.169 1.00 0.00 H new ATOM 0 HA LEU A 27 8.676 -7.558 -0.891 1.00 0.00 H new ATOM 0 HB2 LEU A 27 11.081 -6.449 -2.391 1.00 0.00 H new ATOM 0 HB3 LEU A 27 10.279 -5.559 -1.112 1.00 0.00 H new ATOM 0 HG LEU A 27 11.442 -8.357 -0.771 1.00 0.00 H new ATOM 0 HD11 LEU A 27 13.247 -7.161 0.480 1.00 0.00 H new ATOM 0 HD12 LEU A 27 13.184 -6.619 -1.214 1.00 0.00 H new ATOM 0 HD13 LEU A 27 12.489 -5.603 0.072 1.00 0.00 H new ATOM 0 HD21 LEU A 27 11.175 -7.886 1.637 1.00 0.00 H new ATOM 0 HD22 LEU A 27 10.440 -6.312 1.249 1.00 0.00 H new ATOM 0 HD23 LEU A 27 9.610 -7.819 0.792 1.00 0.00 H new ATOM 437 N ASP A 28 7.557 -6.837 -3.608 1.00 0.00 N ATOM 438 CA ASP A 28 6.693 -6.043 -4.474 1.00 0.00 C ATOM 439 C ASP A 28 7.470 -4.900 -5.147 1.00 0.00 C ATOM 440 O ASP A 28 6.898 -3.891 -5.557 1.00 0.00 O ATOM 441 CB ASP A 28 5.451 -5.568 -3.699 1.00 0.00 C ATOM 442 CG ASP A 28 4.507 -4.737 -4.565 1.00 0.00 C ATOM 443 OD1 ASP A 28 3.973 -3.742 -4.029 1.00 0.00 O ATOM 444 OD2 ASP A 28 4.325 -5.108 -5.748 1.00 0.00 O ATOM 0 H ASP A 28 7.597 -7.823 -3.866 1.00 0.00 H new ATOM 0 HA ASP A 28 6.333 -6.671 -5.289 1.00 0.00 H new ATOM 0 HB2 ASP A 28 4.915 -6.434 -3.310 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.767 -4.976 -2.840 1.00 0.00 H new ATOM 449 N LYS A 29 8.793 -5.063 -5.259 1.00 0.00 N ATOM 450 CA LYS A 29 9.652 -4.129 -5.971 1.00 0.00 C ATOM 451 C LYS A 29 9.948 -4.677 -7.365 1.00 0.00 C ATOM 452 O LYS A 29 9.441 -5.737 -7.740 1.00 0.00 O ATOM 453 CB LYS A 29 10.935 -3.867 -5.170 1.00 0.00 C ATOM 454 CG LYS A 29 10.596 -3.203 -3.836 1.00 0.00 C ATOM 455 CD LYS A 29 11.880 -2.870 -3.072 1.00 0.00 C ATOM 456 CE LYS A 29 11.563 -2.067 -1.810 1.00 0.00 C ATOM 457 NZ LYS A 29 10.645 -2.799 -0.915 1.00 0.00 N ATOM 0 H LYS A 29 9.294 -5.853 -4.853 1.00 0.00 H new ATOM 0 HA LYS A 29 9.145 -3.171 -6.084 1.00 0.00 H new ATOM 0 HB2 LYS A 29 11.461 -4.805 -4.994 1.00 0.00 H new ATOM 0 HB3 LYS A 29 11.606 -3.227 -5.743 1.00 0.00 H new ATOM 0 HG2 LYS A 29 10.021 -2.294 -4.010 1.00 0.00 H new ATOM 0 HG3 LYS A 29 9.970 -3.867 -3.239 1.00 0.00 H new ATOM 0 HD2 LYS A 29 12.399 -3.790 -2.803 1.00 0.00 H new ATOM 0 HD3 LYS A 29 12.553 -2.300 -3.712 1.00 0.00 H new ATOM 0 HE2 LYS A 29 12.488 -1.843 -1.279 1.00 0.00 H new ATOM 0 HE3 LYS A 29 11.116 -1.112 -2.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 10.493 -2.247 -0.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 9.735 -2.946 -1.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 11.060 -3.721 -0.670 1.00 0.00 H new ATOM 471 N THR A 30 10.767 -3.963 -8.138 1.00 0.00 N ATOM 472 CA THR A 30 11.014 -4.292 -9.532 1.00 0.00 C ATOM 473 C THR A 30 12.487 -4.193 -9.923 1.00 0.00 C ATOM 474 O THR A 30 13.048 -3.097 -9.934 1.00 0.00 O ATOM 475 CB THR A 30 10.158 -3.394 -10.429 1.00 0.00 C ATOM 476 OG1 THR A 30 8.840 -3.329 -9.927 1.00 0.00 O ATOM 477 CG2 THR A 30 10.139 -3.911 -11.862 1.00 0.00 C ATOM 0 H THR A 30 11.275 -3.142 -7.810 1.00 0.00 H new ATOM 0 HA THR A 30 10.734 -5.336 -9.671 1.00 0.00 H new ATOM 0 HB THR A 30 10.597 -2.396 -10.430 1.00 0.00 H new ATOM 0 HG1 THR A 30 8.298 -2.752 -10.505 1.00 0.00 H new ATOM 0 HG21 THR A 30 9.524 -3.255 -12.477 1.00 0.00 H new ATOM 0 HG22 THR A 30 11.155 -3.930 -12.255 1.00 0.00 H new ATOM 0 HG23 THR A 30 9.724 -4.919 -11.880 1.00 0.00 H new ATOM 485 N PRO A 31 13.130 -5.327 -10.248 1.00 0.00 N ATOM 486 CA PRO A 31 14.448 -5.342 -10.849 1.00 0.00 C ATOM 487 C PRO A 31 14.326 -4.924 -12.314 1.00 0.00 C ATOM 488 O PRO A 31 14.059 -5.756 -13.183 1.00 0.00 O ATOM 489 CB PRO A 31 14.944 -6.780 -10.709 1.00 0.00 C ATOM 490 CG PRO A 31 13.672 -7.625 -10.610 1.00 0.00 C ATOM 491 CD PRO A 31 12.611 -6.670 -10.059 1.00 0.00 C ATOM 0 HA PRO A 31 15.146 -4.652 -10.375 1.00 0.00 H new ATOM 0 HB2 PRO A 31 15.549 -7.075 -11.566 1.00 0.00 H new ATOM 0 HB3 PRO A 31 15.568 -6.899 -9.823 1.00 0.00 H new ATOM 0 HG2 PRO A 31 13.382 -8.019 -11.584 1.00 0.00 H new ATOM 0 HG3 PRO A 31 13.816 -8.480 -9.950 1.00 0.00 H new ATOM 0 HD2 PRO A 31 11.664 -6.798 -10.583 1.00 0.00 H new ATOM 0 HD3 PRO A 31 12.421 -6.868 -9.004 1.00 0.00 H new ATOM 499 N VAL A 32 14.517 -3.633 -12.591 1.00 0.00 N ATOM 500 CA VAL A 32 14.305 -3.078 -13.930 1.00 0.00 C ATOM 501 C VAL A 32 15.465 -3.364 -14.877 1.00 0.00 C ATOM 502 O VAL A 32 15.432 -2.948 -16.035 1.00 0.00 O ATOM 503 CB VAL A 32 14.007 -1.579 -13.853 1.00 0.00 C ATOM 504 CG1 VAL A 32 12.923 -1.304 -12.818 1.00 0.00 C ATOM 505 CG2 VAL A 32 15.255 -0.782 -13.465 1.00 0.00 C ATOM 0 H VAL A 32 14.821 -2.947 -11.900 1.00 0.00 H new ATOM 0 HA VAL A 32 13.435 -3.583 -14.350 1.00 0.00 H new ATOM 0 HB VAL A 32 13.672 -1.267 -14.842 1.00 0.00 H new ATOM 0 HG11 VAL A 32 12.723 -0.233 -12.776 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.011 -1.833 -13.097 1.00 0.00 H new ATOM 0 HG13 VAL A 32 13.258 -1.649 -11.840 1.00 0.00 H new ATOM 0 HG21 VAL A 32 15.009 0.279 -13.419 1.00 0.00 H new ATOM 0 HG22 VAL A 32 15.611 -1.115 -12.490 1.00 0.00 H new ATOM 0 HG23 VAL A 32 16.035 -0.942 -14.209 1.00 0.00 H new ATOM 515 N GLY A 33 16.495 -4.069 -14.406 1.00 0.00 N ATOM 516 CA GLY A 33 17.600 -4.457 -15.265 1.00 0.00 C ATOM 517 C GLY A 33 18.835 -4.835 -14.464 1.00 0.00 C ATOM 518 O GLY A 33 18.925 -4.548 -13.269 1.00 0.00 O ATOM 0 H GLY A 33 16.581 -4.379 -13.438 1.00 0.00 H new ATOM 0 HA2 GLY A 33 17.298 -5.300 -15.886 1.00 0.00 H new ATOM 0 HA3 GLY A 33 17.842 -3.635 -15.939 1.00 0.00 H new ATOM 522 N THR A 34 19.785 -5.486 -15.135 1.00 0.00 N ATOM 523 CA THR A 34 21.047 -5.900 -14.543 1.00 0.00 C ATOM 524 C THR A 34 22.195 -5.758 -15.530 1.00 0.00 C ATOM 525 O THR A 34 22.059 -6.126 -16.696 1.00 0.00 O ATOM 526 CB THR A 34 20.954 -7.330 -13.997 1.00 0.00 C ATOM 527 OG1 THR A 34 19.754 -7.503 -13.279 1.00 0.00 O ATOM 528 CG2 THR A 34 22.145 -7.624 -13.093 1.00 0.00 C ATOM 0 H THR A 34 19.694 -5.742 -16.118 1.00 0.00 H new ATOM 0 HA THR A 34 21.255 -5.236 -13.704 1.00 0.00 H new ATOM 0 HB THR A 34 20.965 -8.024 -14.837 1.00 0.00 H new ATOM 0 HG1 THR A 34 19.576 -8.460 -13.166 1.00 0.00 H new ATOM 0 HG21 THR A 34 22.069 -8.642 -12.711 1.00 0.00 H new ATOM 0 HG22 THR A 34 23.069 -7.518 -13.662 1.00 0.00 H new ATOM 0 HG23 THR A 34 22.150 -6.923 -12.259 1.00 0.00 H new ATOM 536 N VAL A 35 23.323 -5.222 -15.061 1.00 0.00 N ATOM 537 CA VAL A 35 24.492 -4.993 -15.901 1.00 0.00 C ATOM 538 C VAL A 35 25.769 -5.346 -15.143 1.00 0.00 C ATOM 539 O VAL A 35 25.744 -5.503 -13.922 1.00 0.00 O ATOM 540 CB VAL A 35 24.510 -3.543 -16.411 1.00 0.00 C ATOM 541 CG1 VAL A 35 23.180 -3.160 -17.066 1.00 0.00 C ATOM 542 CG2 VAL A 35 24.756 -2.580 -15.255 1.00 0.00 C ATOM 0 H VAL A 35 23.448 -4.936 -14.090 1.00 0.00 H new ATOM 0 HA VAL A 35 24.438 -5.645 -16.772 1.00 0.00 H new ATOM 0 HB VAL A 35 25.310 -3.475 -17.148 1.00 0.00 H new ATOM 0 HG11 VAL A 35 23.230 -2.128 -17.414 1.00 0.00 H new ATOM 0 HG12 VAL A 35 22.988 -3.820 -17.912 1.00 0.00 H new ATOM 0 HG13 VAL A 35 22.374 -3.259 -16.338 1.00 0.00 H new ATOM 0 HG21 VAL A 35 24.766 -1.557 -15.630 1.00 0.00 H new ATOM 0 HG22 VAL A 35 23.962 -2.688 -14.516 1.00 0.00 H new ATOM 0 HG23 VAL A 35 25.716 -2.806 -14.791 1.00 0.00 H new ATOM 552 N ASP A 36 26.886 -5.473 -15.865 1.00 0.00 N ATOM 553 CA ASP A 36 28.156 -5.888 -15.277 1.00 0.00 C ATOM 554 C ASP A 36 29.322 -4.954 -15.602 1.00 0.00 C ATOM 555 O ASP A 36 30.459 -5.236 -15.234 1.00 0.00 O ATOM 556 CB ASP A 36 28.462 -7.351 -15.620 1.00 0.00 C ATOM 557 CG ASP A 36 28.232 -7.689 -17.096 1.00 0.00 C ATOM 558 OD1 ASP A 36 28.223 -8.904 -17.400 1.00 0.00 O ATOM 559 OD2 ASP A 36 28.067 -6.747 -17.903 1.00 0.00 O ATOM 0 H ASP A 36 26.932 -5.291 -16.868 1.00 0.00 H new ATOM 0 HA ASP A 36 28.037 -5.812 -14.196 1.00 0.00 H new ATOM 0 HB2 ASP A 36 29.499 -7.568 -15.362 1.00 0.00 H new ATOM 0 HB3 ASP A 36 27.838 -7.999 -15.005 1.00 0.00 H new ATOM 564 N THR A 37 29.038 -3.844 -16.287 1.00 0.00 N ATOM 565 CA THR A 37 30.028 -2.815 -16.578 1.00 0.00 C ATOM 566 C THR A 37 29.470 -1.418 -16.354 1.00 0.00 C ATOM 567 O THR A 37 28.261 -1.211 -16.428 1.00 0.00 O ATOM 568 CB THR A 37 30.615 -2.967 -17.983 1.00 0.00 C ATOM 569 OG1 THR A 37 29.722 -2.422 -18.928 1.00 0.00 O ATOM 570 CG2 THR A 37 30.900 -4.427 -18.337 1.00 0.00 C ATOM 0 H THR A 37 28.110 -3.637 -16.655 1.00 0.00 H new ATOM 0 HA THR A 37 30.847 -2.955 -15.872 1.00 0.00 H new ATOM 0 HB THR A 37 31.564 -2.431 -18.002 1.00 0.00 H new ATOM 0 HG1 THR A 37 30.099 -2.518 -19.828 1.00 0.00 H new ATOM 0 HG21 THR A 37 31.315 -4.483 -19.343 1.00 0.00 H new ATOM 0 HG22 THR A 37 31.615 -4.841 -17.626 1.00 0.00 H new ATOM 0 HG23 THR A 37 29.973 -4.999 -18.295 1.00 0.00 H new ATOM 578 N VAL A 38 30.351 -0.453 -16.080 1.00 0.00 N ATOM 579 CA VAL A 38 29.900 0.904 -15.801 1.00 0.00 C ATOM 580 C VAL A 38 29.329 1.598 -17.028 1.00 0.00 C ATOM 581 O VAL A 38 28.520 2.511 -16.900 1.00 0.00 O ATOM 582 CB VAL A 38 30.990 1.740 -15.114 1.00 0.00 C ATOM 583 CG1 VAL A 38 31.787 0.906 -14.114 1.00 0.00 C ATOM 584 CG2 VAL A 38 31.950 2.359 -16.131 1.00 0.00 C ATOM 0 H VAL A 38 31.362 -0.586 -16.046 1.00 0.00 H new ATOM 0 HA VAL A 38 29.075 0.815 -15.095 1.00 0.00 H new ATOM 0 HB VAL A 38 30.477 2.540 -14.581 1.00 0.00 H new ATOM 0 HG11 VAL A 38 32.550 1.529 -13.647 1.00 0.00 H new ATOM 0 HG12 VAL A 38 31.116 0.517 -13.348 1.00 0.00 H new ATOM 0 HG13 VAL A 38 32.265 0.075 -14.633 1.00 0.00 H new ATOM 0 HG21 VAL A 38 32.707 2.943 -15.608 1.00 0.00 H new ATOM 0 HG22 VAL A 38 32.434 1.567 -16.703 1.00 0.00 H new ATOM 0 HG23 VAL A 38 31.394 3.008 -16.808 1.00 0.00 H new ATOM 594 N ALA A 39 29.738 1.172 -18.223 1.00 0.00 N ATOM 595 CA ALA A 39 29.213 1.748 -19.454 1.00 0.00 C ATOM 596 C ALA A 39 27.737 1.378 -19.611 1.00 0.00 C ATOM 597 O ALA A 39 26.949 2.178 -20.114 1.00 0.00 O ATOM 598 CB ALA A 39 30.032 1.229 -20.635 1.00 0.00 C ATOM 0 H ALA A 39 30.428 0.434 -18.361 1.00 0.00 H new ATOM 0 HA ALA A 39 29.289 2.835 -19.420 1.00 0.00 H new ATOM 0 HB1 ALA A 39 29.646 1.655 -21.561 1.00 0.00 H new ATOM 0 HB2 ALA A 39 31.075 1.519 -20.510 1.00 0.00 H new ATOM 0 HB3 ALA A 39 29.960 0.142 -20.678 1.00 0.00 H new ATOM 604 N GLY A 40 27.362 0.169 -19.178 1.00 0.00 N ATOM 605 CA GLY A 40 25.980 -0.272 -19.234 1.00 0.00 C ATOM 606 C GLY A 40 25.183 0.298 -18.062 1.00 0.00 C ATOM 607 O GLY A 40 23.988 0.556 -18.192 1.00 0.00 O ATOM 0 H GLY A 40 28.006 -0.518 -18.785 1.00 0.00 H new ATOM 0 HA2 GLY A 40 25.530 0.045 -20.175 1.00 0.00 H new ATOM 0 HA3 GLY A 40 25.939 -1.361 -19.212 1.00 0.00 H new ATOM 611 N ALA A 41 25.844 0.498 -16.921 1.00 0.00 N ATOM 612 CA ALA A 41 25.180 1.017 -15.738 1.00 0.00 C ATOM 613 C ALA A 41 24.909 2.512 -15.884 1.00 0.00 C ATOM 614 O ALA A 41 23.872 2.998 -15.437 1.00 0.00 O ATOM 615 CB ALA A 41 26.057 0.734 -14.519 1.00 0.00 C ATOM 0 H ALA A 41 26.838 0.307 -16.797 1.00 0.00 H new ATOM 0 HA ALA A 41 24.216 0.524 -15.611 1.00 0.00 H new ATOM 0 HB1 ALA A 41 25.570 1.119 -13.623 1.00 0.00 H new ATOM 0 HB2 ALA A 41 26.204 -0.341 -14.418 1.00 0.00 H new ATOM 0 HB3 ALA A 41 27.023 1.222 -14.645 1.00 0.00 H new ATOM 621 N LEU A 42 25.835 3.245 -16.510 1.00 0.00 N ATOM 622 CA LEU A 42 25.652 4.667 -16.762 1.00 0.00 C ATOM 623 C LEU A 42 24.567 4.869 -17.816 1.00 0.00 C ATOM 624 O LEU A 42 23.848 5.864 -17.776 1.00 0.00 O ATOM 625 CB LEU A 42 26.971 5.277 -17.248 1.00 0.00 C ATOM 626 CG LEU A 42 27.960 5.464 -16.093 1.00 0.00 C ATOM 627 CD1 LEU A 42 29.342 5.773 -16.661 1.00 0.00 C ATOM 628 CD2 LEU A 42 27.529 6.628 -15.203 1.00 0.00 C ATOM 0 H LEU A 42 26.720 2.870 -16.850 1.00 0.00 H new ATOM 0 HA LEU A 42 25.347 5.161 -15.839 1.00 0.00 H new ATOM 0 HB2 LEU A 42 27.414 4.632 -18.007 1.00 0.00 H new ATOM 0 HB3 LEU A 42 26.776 6.239 -17.721 1.00 0.00 H new ATOM 0 HG LEU A 42 27.984 4.548 -15.502 1.00 0.00 H new ATOM 0 HD11 LEU A 42 30.050 5.907 -15.843 1.00 0.00 H new ATOM 0 HD12 LEU A 42 29.669 4.947 -17.292 1.00 0.00 H new ATOM 0 HD13 LEU A 42 29.296 6.686 -17.254 1.00 0.00 H new ATOM 0 HD21 LEU A 42 28.243 6.746 -14.388 1.00 0.00 H new ATOM 0 HD22 LEU A 42 27.496 7.544 -15.793 1.00 0.00 H new ATOM 0 HD23 LEU A 42 26.540 6.425 -14.792 1.00 0.00 H new ATOM 640 N ALA A 43 24.443 3.926 -18.755 1.00 0.00 N ATOM 641 CA ALA A 43 23.437 4.012 -19.799 1.00 0.00 C ATOM 642 C ALA A 43 22.047 3.705 -19.242 1.00 0.00 C ATOM 643 O ALA A 43 21.062 4.284 -19.694 1.00 0.00 O ATOM 644 CB ALA A 43 23.802 3.029 -20.913 1.00 0.00 C ATOM 0 H ALA A 43 25.032 3.095 -18.807 1.00 0.00 H new ATOM 0 HA ALA A 43 23.412 5.026 -20.198 1.00 0.00 H new ATOM 0 HB1 ALA A 43 23.055 3.082 -21.705 1.00 0.00 H new ATOM 0 HB2 ALA A 43 24.780 3.286 -21.319 1.00 0.00 H new ATOM 0 HB3 ALA A 43 23.832 2.017 -20.510 1.00 0.00 H new ATOM 650 N ARG A 44 21.956 2.798 -18.263 1.00 0.00 N ATOM 651 CA ARG A 44 20.673 2.392 -17.704 1.00 0.00 C ATOM 652 C ARG A 44 20.162 3.373 -16.657 1.00 0.00 C ATOM 653 O ARG A 44 18.954 3.537 -16.527 1.00 0.00 O ATOM 654 CB ARG A 44 20.783 0.975 -17.134 1.00 0.00 C ATOM 655 CG ARG A 44 20.802 -0.068 -18.259 1.00 0.00 C ATOM 656 CD ARG A 44 19.469 -0.102 -19.019 1.00 0.00 C ATOM 657 NE ARG A 44 18.368 -0.553 -18.153 1.00 0.00 N ATOM 658 CZ ARG A 44 17.210 0.101 -17.998 1.00 0.00 C ATOM 659 NH1 ARG A 44 16.980 1.252 -18.620 1.00 0.00 N ATOM 660 NH2 ARG A 44 16.266 -0.404 -17.207 1.00 0.00 N ATOM 0 H ARG A 44 22.761 2.333 -17.844 1.00 0.00 H new ATOM 0 HA ARG A 44 19.938 2.395 -18.509 1.00 0.00 H new ATOM 0 HB2 ARG A 44 21.691 0.888 -16.537 1.00 0.00 H new ATOM 0 HB3 ARG A 44 19.943 0.781 -16.467 1.00 0.00 H new ATOM 0 HG2 ARG A 44 21.612 0.159 -18.953 1.00 0.00 H new ATOM 0 HG3 ARG A 44 21.008 -1.053 -17.840 1.00 0.00 H new ATOM 0 HD2 ARG A 44 19.245 0.891 -19.408 1.00 0.00 H new ATOM 0 HD3 ARG A 44 19.555 -0.768 -19.877 1.00 0.00 H new ATOM 0 HE ARG A 44 18.496 -1.423 -17.636 1.00 0.00 H new ATOM 0 HH11 ARG A 44 17.693 1.654 -19.229 1.00 0.00 H new ATOM 0 HH12 ARG A 44 16.091 1.734 -18.488 1.00 0.00 H new ATOM 0 HH21 ARG A 44 16.426 -1.287 -16.721 1.00 0.00 H new ATOM 0 HH22 ARG A 44 15.383 0.092 -17.087 1.00 0.00 H new ATOM 674 N VAL A 45 21.058 4.026 -15.913 1.00 0.00 N ATOM 675 CA VAL A 45 20.635 5.054 -14.974 1.00 0.00 C ATOM 676 C VAL A 45 20.294 6.364 -15.687 1.00 0.00 C ATOM 677 O VAL A 45 19.541 7.180 -15.161 1.00 0.00 O ATOM 678 CB VAL A 45 21.668 5.230 -13.857 1.00 0.00 C ATOM 679 CG1 VAL A 45 22.900 6.003 -14.328 1.00 0.00 C ATOM 680 CG2 VAL A 45 21.035 5.987 -12.693 1.00 0.00 C ATOM 0 H VAL A 45 22.064 3.861 -15.945 1.00 0.00 H new ATOM 0 HA VAL A 45 19.711 4.725 -14.499 1.00 0.00 H new ATOM 0 HB VAL A 45 21.986 4.234 -13.549 1.00 0.00 H new ATOM 0 HG11 VAL A 45 23.604 6.103 -13.502 1.00 0.00 H new ATOM 0 HG12 VAL A 45 23.376 5.465 -15.148 1.00 0.00 H new ATOM 0 HG13 VAL A 45 22.599 6.993 -14.670 1.00 0.00 H new ATOM 0 HG21 VAL A 45 21.770 6.112 -11.898 1.00 0.00 H new ATOM 0 HG22 VAL A 45 20.700 6.966 -13.035 1.00 0.00 H new ATOM 0 HG23 VAL A 45 20.182 5.424 -12.313 1.00 0.00 H new ATOM 690 N GLU A 46 20.845 6.567 -16.886 1.00 0.00 N ATOM 691 CA GLU A 46 20.539 7.738 -17.694 1.00 0.00 C ATOM 692 C GLU A 46 19.136 7.619 -18.302 1.00 0.00 C ATOM 693 O GLU A 46 18.528 8.626 -18.666 1.00 0.00 O ATOM 694 CB GLU A 46 21.617 7.878 -18.777 1.00 0.00 C ATOM 695 CG GLU A 46 21.287 8.938 -19.829 1.00 0.00 C ATOM 696 CD GLU A 46 21.155 10.346 -19.242 1.00 0.00 C ATOM 697 OE1 GLU A 46 21.408 10.502 -18.026 1.00 0.00 O ATOM 698 OE2 GLU A 46 20.805 11.256 -20.024 1.00 0.00 O ATOM 0 H GLU A 46 21.511 5.926 -17.317 1.00 0.00 H new ATOM 0 HA GLU A 46 20.541 8.635 -17.074 1.00 0.00 H new ATOM 0 HB2 GLU A 46 22.566 8.129 -18.304 1.00 0.00 H new ATOM 0 HB3 GLU A 46 21.752 6.916 -19.271 1.00 0.00 H new ATOM 0 HG2 GLU A 46 22.066 8.940 -20.591 1.00 0.00 H new ATOM 0 HG3 GLU A 46 20.355 8.670 -20.327 1.00 0.00 H new ATOM 705 N ASP A 47 18.619 6.391 -18.411 1.00 0.00 N ATOM 706 CA ASP A 47 17.268 6.157 -18.912 1.00 0.00 C ATOM 707 C ASP A 47 16.197 6.674 -17.948 1.00 0.00 C ATOM 708 O ASP A 47 15.038 6.826 -18.332 1.00 0.00 O ATOM 709 CB ASP A 47 17.066 4.671 -19.219 1.00 0.00 C ATOM 710 CG ASP A 47 17.896 4.203 -20.416 1.00 0.00 C ATOM 711 OD1 ASP A 47 18.063 2.968 -20.536 1.00 0.00 O ATOM 712 OD2 ASP A 47 18.346 5.074 -21.195 1.00 0.00 O ATOM 0 H ASP A 47 19.122 5.541 -18.156 1.00 0.00 H new ATOM 0 HA ASP A 47 17.156 6.723 -19.837 1.00 0.00 H new ATOM 0 HB2 ASP A 47 17.335 4.082 -18.342 1.00 0.00 H new ATOM 0 HB3 ASP A 47 16.011 4.484 -19.417 1.00 0.00 H new ATOM 717 N GLY A 48 16.591 6.950 -16.699 1.00 0.00 N ATOM 718 CA GLY A 48 15.704 7.529 -15.703 1.00 0.00 C ATOM 719 C GLY A 48 14.615 6.551 -15.271 1.00 0.00 C ATOM 720 O GLY A 48 14.629 5.383 -15.651 1.00 0.00 O ATOM 0 H GLY A 48 17.536 6.775 -16.358 1.00 0.00 H new ATOM 0 HA2 GLY A 48 16.285 7.832 -14.832 1.00 0.00 H new ATOM 0 HA3 GLY A 48 15.243 8.430 -16.108 1.00 0.00 H new ATOM 724 N GLY A 49 13.669 7.044 -14.465 1.00 0.00 N ATOM 725 CA GLY A 49 12.546 6.253 -13.979 1.00 0.00 C ATOM 726 C GLY A 49 12.964 5.295 -12.861 1.00 0.00 C ATOM 727 O GLY A 49 12.126 4.579 -12.316 1.00 0.00 O ATOM 0 H GLY A 49 13.666 8.008 -14.133 1.00 0.00 H new ATOM 0 HA2 GLY A 49 11.764 6.919 -13.613 1.00 0.00 H new ATOM 0 HA3 GLY A 49 12.119 5.683 -14.804 1.00 0.00 H new ATOM 731 N ILE A 50 14.257 5.277 -12.523 1.00 0.00 N ATOM 732 CA ILE A 50 14.788 4.407 -11.481 1.00 0.00 C ATOM 733 C ILE A 50 14.762 5.124 -10.132 1.00 0.00 C ATOM 734 O ILE A 50 14.997 6.331 -10.065 1.00 0.00 O ATOM 735 CB ILE A 50 16.208 3.965 -11.865 1.00 0.00 C ATOM 736 CG1 ILE A 50 16.134 3.093 -13.124 1.00 0.00 C ATOM 737 CG2 ILE A 50 16.848 3.176 -10.720 1.00 0.00 C ATOM 738 CD1 ILE A 50 17.520 2.897 -13.735 1.00 0.00 C ATOM 0 H ILE A 50 14.961 5.867 -12.967 1.00 0.00 H new ATOM 0 HA ILE A 50 14.167 3.516 -11.387 1.00 0.00 H new ATOM 0 HB ILE A 50 16.821 4.845 -12.060 1.00 0.00 H new ATOM 0 HG12 ILE A 50 15.702 2.124 -12.875 1.00 0.00 H new ATOM 0 HG13 ILE A 50 15.473 3.558 -13.855 1.00 0.00 H new ATOM 0 HG21 ILE A 50 17.854 2.870 -11.007 1.00 0.00 H new ATOM 0 HG22 ILE A 50 16.900 3.803 -9.830 1.00 0.00 H new ATOM 0 HG23 ILE A 50 16.247 2.292 -10.506 1.00 0.00 H new ATOM 0 HD11 ILE A 50 17.440 2.275 -14.627 1.00 0.00 H new ATOM 0 HD12 ILE A 50 17.939 3.866 -14.005 1.00 0.00 H new ATOM 0 HD13 ILE A 50 18.172 2.410 -13.010 1.00 0.00 H new ATOM 750 N ASP A 51 14.471 4.377 -9.061 1.00 0.00 N ATOM 751 CA ASP A 51 14.351 4.936 -7.722 1.00 0.00 C ATOM 752 C ASP A 51 15.652 4.765 -6.934 1.00 0.00 C ATOM 753 O ASP A 51 15.980 5.609 -6.104 1.00 0.00 O ATOM 754 CB ASP A 51 13.208 4.229 -6.990 1.00 0.00 C ATOM 755 CG ASP A 51 11.872 4.340 -7.724 1.00 0.00 C ATOM 756 OD1 ASP A 51 11.732 5.267 -8.554 1.00 0.00 O ATOM 757 OD2 ASP A 51 11.000 3.487 -7.440 1.00 0.00 O ATOM 0 H ASP A 51 14.313 3.370 -9.104 1.00 0.00 H new ATOM 0 HA ASP A 51 14.144 6.003 -7.804 1.00 0.00 H new ATOM 0 HB2 ASP A 51 13.461 3.176 -6.863 1.00 0.00 H new ATOM 0 HB3 ASP A 51 13.105 4.654 -5.992 1.00 0.00 H new ATOM 762 N ALA A 52 16.391 3.680 -7.187 1.00 0.00 N ATOM 763 CA ALA A 52 17.644 3.390 -6.499 1.00 0.00 C ATOM 764 C ALA A 52 18.448 2.366 -7.304 1.00 0.00 C ATOM 765 O ALA A 52 17.964 1.844 -8.305 1.00 0.00 O ATOM 766 CB ALA A 52 17.338 2.843 -5.101 1.00 0.00 C ATOM 0 H ALA A 52 16.132 2.977 -7.879 1.00 0.00 H new ATOM 0 HA ALA A 52 18.233 4.303 -6.405 1.00 0.00 H new ATOM 0 HB1 ALA A 52 18.272 2.625 -4.583 1.00 0.00 H new ATOM 0 HB2 ALA A 52 16.774 3.585 -4.535 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.750 1.930 -5.188 1.00 0.00 H new ATOM 772 N ALA A 53 19.680 2.071 -6.877 1.00 0.00 N ATOM 773 CA ALA A 53 20.501 1.079 -7.561 1.00 0.00 C ATOM 774 C ALA A 53 21.428 0.354 -6.583 1.00 0.00 C ATOM 775 O ALA A 53 21.611 0.792 -5.451 1.00 0.00 O ATOM 776 CB ALA A 53 21.308 1.759 -8.667 1.00 0.00 C ATOM 0 H ALA A 53 20.124 2.504 -6.067 1.00 0.00 H new ATOM 0 HA ALA A 53 19.845 0.330 -8.004 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.922 1.017 -9.178 1.00 0.00 H new ATOM 0 HB2 ALA A 53 20.628 2.222 -9.382 1.00 0.00 H new ATOM 0 HB3 ALA A 53 21.951 2.523 -8.231 1.00 0.00 H new ATOM 782 N ILE A 54 22.013 -0.757 -7.043 1.00 0.00 N ATOM 783 CA ILE A 54 22.957 -1.551 -6.263 1.00 0.00 C ATOM 784 C ILE A 54 24.263 -1.671 -7.046 1.00 0.00 C ATOM 785 O ILE A 54 24.236 -1.779 -8.268 1.00 0.00 O ATOM 786 CB ILE A 54 22.355 -2.928 -5.953 1.00 0.00 C ATOM 787 CG1 ILE A 54 20.928 -2.764 -5.405 1.00 0.00 C ATOM 788 CG2 ILE A 54 23.248 -3.667 -4.954 1.00 0.00 C ATOM 789 CD1 ILE A 54 20.317 -4.113 -5.009 1.00 0.00 C ATOM 0 H ILE A 54 21.840 -1.130 -7.976 1.00 0.00 H new ATOM 0 HA ILE A 54 23.165 -1.064 -5.310 1.00 0.00 H new ATOM 0 HB ILE A 54 22.301 -3.518 -6.868 1.00 0.00 H new ATOM 0 HG12 ILE A 54 20.944 -2.103 -4.539 1.00 0.00 H new ATOM 0 HG13 ILE A 54 20.301 -2.287 -6.158 1.00 0.00 H new ATOM 0 HG21 ILE A 54 22.818 -4.645 -4.736 1.00 0.00 H new ATOM 0 HG22 ILE A 54 24.243 -3.795 -5.381 1.00 0.00 H new ATOM 0 HG23 ILE A 54 23.320 -3.088 -4.033 1.00 0.00 H new ATOM 0 HD11 ILE A 54 19.308 -3.957 -4.626 1.00 0.00 H new ATOM 0 HD12 ILE A 54 20.277 -4.765 -5.882 1.00 0.00 H new ATOM 0 HD13 ILE A 54 20.930 -4.578 -4.237 1.00 0.00 H new ATOM 801 N LEU A 55 25.406 -1.653 -6.352 1.00 0.00 N ATOM 802 CA LEU A 55 26.709 -1.610 -7.012 1.00 0.00 C ATOM 803 C LEU A 55 27.757 -2.426 -6.259 1.00 0.00 C ATOM 804 O LEU A 55 28.028 -2.169 -5.089 1.00 0.00 O ATOM 805 CB LEU A 55 27.155 -0.149 -7.114 1.00 0.00 C ATOM 806 CG LEU A 55 28.510 -0.016 -7.813 1.00 0.00 C ATOM 807 CD1 LEU A 55 28.417 -0.461 -9.274 1.00 0.00 C ATOM 808 CD2 LEU A 55 28.950 1.441 -7.781 1.00 0.00 C ATOM 0 H LEU A 55 25.452 -1.668 -5.333 1.00 0.00 H new ATOM 0 HA LEU A 55 26.612 -2.051 -8.004 1.00 0.00 H new ATOM 0 HB2 LEU A 55 26.406 0.422 -7.662 1.00 0.00 H new ATOM 0 HB3 LEU A 55 27.217 0.283 -6.115 1.00 0.00 H new ATOM 0 HG LEU A 55 29.228 -0.649 -7.292 1.00 0.00 H new ATOM 0 HD11 LEU A 55 29.393 -0.357 -9.749 1.00 0.00 H new ATOM 0 HD12 LEU A 55 28.102 -1.503 -9.317 1.00 0.00 H new ATOM 0 HD13 LEU A 55 27.690 0.160 -9.798 1.00 0.00 H new ATOM 0 HD21 LEU A 55 29.915 1.541 -8.278 1.00 0.00 H new ATOM 0 HD22 LEU A 55 28.212 2.055 -8.296 1.00 0.00 H new ATOM 0 HD23 LEU A 55 29.039 1.772 -6.746 1.00 0.00 H new ATOM 820 N ASP A 56 28.352 -3.408 -6.935 1.00 0.00 N ATOM 821 CA ASP A 56 29.466 -4.166 -6.383 1.00 0.00 C ATOM 822 C ASP A 56 30.714 -3.279 -6.441 1.00 0.00 C ATOM 823 O ASP A 56 30.923 -2.563 -7.418 1.00 0.00 O ATOM 824 CB ASP A 56 29.637 -5.448 -7.205 1.00 0.00 C ATOM 825 CG ASP A 56 30.638 -6.430 -6.591 1.00 0.00 C ATOM 826 OD1 ASP A 56 31.401 -6.014 -5.694 1.00 0.00 O ATOM 827 OD2 ASP A 56 30.620 -7.602 -7.034 1.00 0.00 O ATOM 0 H ASP A 56 28.076 -3.696 -7.874 1.00 0.00 H new ATOM 0 HA ASP A 56 29.291 -4.452 -5.346 1.00 0.00 H new ATOM 0 HB2 ASP A 56 28.669 -5.940 -7.304 1.00 0.00 H new ATOM 0 HB3 ASP A 56 29.966 -5.186 -8.211 1.00 0.00 H new ATOM 832 N VAL A 57 31.539 -3.327 -5.394 1.00 0.00 N ATOM 833 CA VAL A 57 32.729 -2.486 -5.296 1.00 0.00 C ATOM 834 C VAL A 57 33.666 -2.761 -6.470 1.00 0.00 C ATOM 835 O VAL A 57 34.381 -1.865 -6.908 1.00 0.00 O ATOM 836 CB VAL A 57 33.438 -2.756 -3.966 1.00 0.00 C ATOM 837 CG1 VAL A 57 34.729 -1.945 -3.862 1.00 0.00 C ATOM 838 CG2 VAL A 57 32.526 -2.372 -2.801 1.00 0.00 C ATOM 0 H VAL A 57 31.401 -3.946 -4.596 1.00 0.00 H new ATOM 0 HA VAL A 57 32.434 -1.437 -5.333 1.00 0.00 H new ATOM 0 HB VAL A 57 33.676 -3.819 -3.923 1.00 0.00 H new ATOM 0 HG11 VAL A 57 35.214 -2.154 -2.909 1.00 0.00 H new ATOM 0 HG12 VAL A 57 35.398 -2.220 -4.678 1.00 0.00 H new ATOM 0 HG13 VAL A 57 34.497 -0.882 -3.926 1.00 0.00 H new ATOM 0 HG21 VAL A 57 33.038 -2.567 -1.859 1.00 0.00 H new ATOM 0 HG22 VAL A 57 32.278 -1.313 -2.867 1.00 0.00 H new ATOM 0 HG23 VAL A 57 31.611 -2.962 -2.846 1.00 0.00 H new ATOM 848 N ASN A 58 33.657 -4.001 -6.978 1.00 0.00 N ATOM 849 CA ASN A 58 34.473 -4.390 -8.118 1.00 0.00 C ATOM 850 C ASN A 58 33.592 -5.034 -9.189 1.00 0.00 C ATOM 851 O ASN A 58 32.755 -5.879 -8.879 1.00 0.00 O ATOM 852 CB ASN A 58 35.584 -5.348 -7.677 1.00 0.00 C ATOM 853 CG ASN A 58 36.454 -4.759 -6.577 1.00 0.00 C ATOM 854 OD1 ASN A 58 36.848 -3.597 -6.637 1.00 0.00 O ATOM 855 ND2 ASN A 58 36.762 -5.561 -5.565 1.00 0.00 N ATOM 0 H ASN A 58 33.082 -4.756 -6.605 1.00 0.00 H new ATOM 0 HA ASN A 58 34.942 -3.502 -8.541 1.00 0.00 H new ATOM 0 HB2 ASN A 58 35.139 -6.279 -7.325 1.00 0.00 H new ATOM 0 HB3 ASN A 58 36.208 -5.597 -8.536 1.00 0.00 H new ATOM 0 HD21 ASN A 58 37.345 -5.218 -4.802 1.00 0.00 H new ATOM 0 HD22 ASN A 58 36.416 -6.520 -5.551 1.00 0.00 H new ATOM 862 N LEU A 59 33.794 -4.630 -10.442 1.00 0.00 N ATOM 863 CA LEU A 59 33.076 -5.171 -11.588 1.00 0.00 C ATOM 864 C LEU A 59 34.007 -6.111 -12.348 1.00 0.00 C ATOM 865 O LEU A 59 35.119 -6.385 -11.897 1.00 0.00 O ATOM 866 CB LEU A 59 32.598 -4.012 -12.469 1.00 0.00 C ATOM 867 CG LEU A 59 31.175 -3.570 -12.087 1.00 0.00 C ATOM 868 CD1 LEU A 59 31.035 -3.328 -10.588 1.00 0.00 C ATOM 869 CD2 LEU A 59 30.852 -2.271 -12.811 1.00 0.00 C ATOM 0 H LEU A 59 34.471 -3.908 -10.690 1.00 0.00 H new ATOM 0 HA LEU A 59 32.200 -5.737 -11.271 1.00 0.00 H new ATOM 0 HB2 LEU A 59 33.282 -3.170 -12.368 1.00 0.00 H new ATOM 0 HB3 LEU A 59 32.618 -4.316 -13.516 1.00 0.00 H new ATOM 0 HG LEU A 59 30.491 -4.369 -12.372 1.00 0.00 H new ATOM 0 HD11 LEU A 59 30.015 -3.018 -10.363 1.00 0.00 H new ATOM 0 HD12 LEU A 59 31.262 -4.247 -10.048 1.00 0.00 H new ATOM 0 HD13 LEU A 59 31.728 -2.546 -10.279 1.00 0.00 H new ATOM 0 HD21 LEU A 59 29.845 -1.948 -12.547 1.00 0.00 H new ATOM 0 HD22 LEU A 59 31.568 -1.503 -12.517 1.00 0.00 H new ATOM 0 HD23 LEU A 59 30.912 -2.430 -13.888 1.00 0.00 H new ATOM 881 N ARG A 60 33.559 -6.609 -13.505 1.00 0.00 N ATOM 882 CA ARG A 60 34.348 -7.547 -14.294 1.00 0.00 C ATOM 883 C ARG A 60 35.754 -7.011 -14.534 1.00 0.00 C ATOM 884 O ARG A 60 35.958 -5.810 -14.710 1.00 0.00 O ATOM 885 CB ARG A 60 33.636 -7.859 -15.611 1.00 0.00 C ATOM 886 CG ARG A 60 32.426 -8.747 -15.325 1.00 0.00 C ATOM 887 CD ARG A 60 31.806 -9.227 -16.634 1.00 0.00 C ATOM 888 NE ARG A 60 30.593 -10.020 -16.403 1.00 0.00 N ATOM 889 CZ ARG A 60 30.587 -11.259 -15.899 1.00 0.00 C ATOM 890 NH1 ARG A 60 31.726 -11.874 -15.589 1.00 0.00 N ATOM 891 NH2 ARG A 60 29.433 -11.883 -15.698 1.00 0.00 N ATOM 0 H ARG A 60 32.653 -6.375 -13.912 1.00 0.00 H new ATOM 0 HA ARG A 60 34.447 -8.476 -13.733 1.00 0.00 H new ATOM 0 HB2 ARG A 60 33.319 -6.935 -16.095 1.00 0.00 H new ATOM 0 HB3 ARG A 60 34.318 -8.361 -16.298 1.00 0.00 H new ATOM 0 HG2 ARG A 60 32.728 -9.603 -14.721 1.00 0.00 H new ATOM 0 HG3 ARG A 60 31.688 -8.193 -14.746 1.00 0.00 H new ATOM 0 HD2 ARG A 60 31.565 -8.367 -17.259 1.00 0.00 H new ATOM 0 HD3 ARG A 60 32.533 -9.826 -17.183 1.00 0.00 H new ATOM 0 HE ARG A 60 29.695 -9.599 -16.643 1.00 0.00 H new ATOM 0 HH11 ARG A 60 32.617 -11.400 -15.735 1.00 0.00 H new ATOM 0 HH12 ARG A 60 31.707 -12.819 -15.205 1.00 0.00 H new ATOM 0 HH21 ARG A 60 28.555 -11.418 -15.928 1.00 0.00 H new ATOM 0 HH22 ARG A 60 29.424 -12.828 -15.314 1.00 0.00 H new ATOM 905 N GLY A 61 36.723 -7.925 -14.539 1.00 0.00 N ATOM 906 CA GLY A 61 38.139 -7.578 -14.578 1.00 0.00 C ATOM 907 C GLY A 61 38.667 -7.286 -13.167 1.00 0.00 C ATOM 908 O GLY A 61 39.865 -7.069 -12.990 1.00 0.00 O ATOM 0 H GLY A 61 36.546 -8.929 -14.516 1.00 0.00 H new ATOM 0 HA2 GLY A 61 38.707 -8.396 -15.022 1.00 0.00 H new ATOM 0 HA3 GLY A 61 38.287 -6.706 -15.214 1.00 0.00 H new ATOM 912 N GLY A 62 37.777 -7.280 -12.170 1.00 0.00 N ATOM 913 CA GLY A 62 38.137 -7.061 -10.777 1.00 0.00 C ATOM 914 C GLY A 62 38.467 -5.600 -10.483 1.00 0.00 C ATOM 915 O GLY A 62 38.909 -5.281 -9.383 1.00 0.00 O ATOM 0 H GLY A 62 36.778 -7.429 -12.315 1.00 0.00 H new ATOM 0 HA2 GLY A 62 37.314 -7.380 -10.138 1.00 0.00 H new ATOM 0 HA3 GLY A 62 38.996 -7.682 -10.525 1.00 0.00 H new ATOM 919 N GLU A 63 38.254 -4.707 -11.455 1.00 0.00 N ATOM 920 CA GLU A 63 38.579 -3.298 -11.292 1.00 0.00 C ATOM 921 C GLU A 63 37.531 -2.602 -10.417 1.00 0.00 C ATOM 922 O GLU A 63 36.333 -2.868 -10.536 1.00 0.00 O ATOM 923 CB GLU A 63 38.681 -2.633 -12.666 1.00 0.00 C ATOM 924 CG GLU A 63 39.020 -1.143 -12.527 1.00 0.00 C ATOM 925 CD GLU A 63 39.241 -0.475 -13.885 1.00 0.00 C ATOM 926 OE1 GLU A 63 39.166 -1.191 -14.910 1.00 0.00 O ATOM 927 OE2 GLU A 63 39.483 0.754 -13.886 1.00 0.00 O ATOM 0 H GLU A 63 37.856 -4.943 -12.364 1.00 0.00 H new ATOM 0 HA GLU A 63 39.542 -3.207 -10.789 1.00 0.00 H new ATOM 0 HB2 GLU A 63 39.447 -3.131 -13.260 1.00 0.00 H new ATOM 0 HB3 GLU A 63 37.738 -2.748 -13.201 1.00 0.00 H new ATOM 0 HG2 GLU A 63 38.212 -0.635 -12.001 1.00 0.00 H new ATOM 0 HG3 GLU A 63 39.917 -1.031 -11.918 1.00 0.00 H new ATOM 934 N LYS A 64 37.992 -1.705 -9.538 1.00 0.00 N ATOM 935 CA LYS A 64 37.123 -0.945 -8.646 1.00 0.00 C ATOM 936 C LYS A 64 36.269 0.035 -9.449 1.00 0.00 C ATOM 937 O LYS A 64 36.741 0.609 -10.427 1.00 0.00 O ATOM 938 CB LYS A 64 37.995 -0.223 -7.618 1.00 0.00 C ATOM 939 CG LYS A 64 37.180 0.700 -6.711 1.00 0.00 C ATOM 940 CD LYS A 64 38.114 1.284 -5.651 1.00 0.00 C ATOM 941 CE LYS A 64 37.372 2.276 -4.756 1.00 0.00 C ATOM 942 NZ LYS A 64 36.975 3.480 -5.510 1.00 0.00 N ATOM 0 H LYS A 64 38.983 -1.488 -9.429 1.00 0.00 H new ATOM 0 HA LYS A 64 36.439 -1.613 -8.122 1.00 0.00 H new ATOM 0 HB2 LYS A 64 38.518 -0.959 -7.008 1.00 0.00 H new ATOM 0 HB3 LYS A 64 38.756 0.360 -8.136 1.00 0.00 H new ATOM 0 HG2 LYS A 64 36.723 1.499 -7.295 1.00 0.00 H new ATOM 0 HG3 LYS A 64 36.369 0.147 -6.238 1.00 0.00 H new ATOM 0 HD2 LYS A 64 38.529 0.480 -5.043 1.00 0.00 H new ATOM 0 HD3 LYS A 64 38.953 1.783 -6.135 1.00 0.00 H new ATOM 0 HE2 LYS A 64 36.487 1.799 -4.335 1.00 0.00 H new ATOM 0 HE3 LYS A 64 38.009 2.561 -3.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 36.503 4.151 -4.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 37.820 3.928 -5.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 36.321 3.212 -6.273 1.00 0.00 H new ATOM 956 N SER A 65 35.015 0.228 -9.034 1.00 0.00 N ATOM 957 CA SER A 65 34.088 1.086 -9.763 1.00 0.00 C ATOM 958 C SER A 65 33.136 1.818 -8.821 1.00 0.00 C ATOM 959 O SER A 65 32.506 1.201 -7.963 1.00 0.00 O ATOM 960 CB SER A 65 33.286 0.245 -10.754 1.00 0.00 C ATOM 961 OG SER A 65 34.127 -0.227 -11.788 1.00 0.00 O ATOM 0 H SER A 65 34.621 -0.200 -8.196 1.00 0.00 H new ATOM 0 HA SER A 65 34.672 1.836 -10.296 1.00 0.00 H new ATOM 0 HB2 SER A 65 32.825 -0.597 -10.238 1.00 0.00 H new ATOM 0 HB3 SER A 65 32.477 0.841 -11.177 1.00 0.00 H new ATOM 0 HG SER A 65 33.581 -0.628 -12.496 1.00 0.00 H new ATOM 967 N THR A 66 33.036 3.139 -8.999 1.00 0.00 N ATOM 968 CA THR A 66 32.057 3.981 -8.325 1.00 0.00 C ATOM 969 C THR A 66 31.421 5.077 -9.198 1.00 0.00 C ATOM 970 O THR A 66 30.810 5.994 -8.647 1.00 0.00 O ATOM 971 CB THR A 66 32.628 4.590 -7.034 1.00 0.00 C ATOM 972 OG1 THR A 66 33.334 5.774 -7.343 1.00 0.00 O ATOM 973 CG2 THR A 66 33.568 3.641 -6.295 1.00 0.00 C ATOM 0 H THR A 66 33.648 3.658 -9.629 1.00 0.00 H new ATOM 0 HA THR A 66 31.244 3.297 -8.080 1.00 0.00 H new ATOM 0 HB THR A 66 31.780 4.795 -6.380 1.00 0.00 H new ATOM 0 HG1 THR A 66 33.696 6.163 -6.520 1.00 0.00 H new ATOM 0 HG21 THR A 66 33.939 4.126 -5.392 1.00 0.00 H new ATOM 0 HG22 THR A 66 33.029 2.733 -6.024 1.00 0.00 H new ATOM 0 HG23 THR A 66 34.408 3.385 -6.941 1.00 0.00 H new ATOM 981 N PRO A 67 31.533 5.031 -10.538 1.00 0.00 N ATOM 982 CA PRO A 67 31.102 6.133 -11.386 1.00 0.00 C ATOM 983 C PRO A 67 29.583 6.318 -11.332 1.00 0.00 C ATOM 984 O PRO A 67 29.091 7.425 -11.537 1.00 0.00 O ATOM 985 CB PRO A 67 31.564 5.773 -12.797 1.00 0.00 C ATOM 986 CG PRO A 67 31.647 4.252 -12.772 1.00 0.00 C ATOM 987 CD PRO A 67 32.060 3.944 -11.338 1.00 0.00 C ATOM 0 HA PRO A 67 31.529 7.079 -11.054 1.00 0.00 H new ATOM 0 HB2 PRO A 67 30.859 6.123 -13.551 1.00 0.00 H new ATOM 0 HB3 PRO A 67 32.529 6.223 -13.030 1.00 0.00 H new ATOM 0 HG2 PRO A 67 30.690 3.793 -13.022 1.00 0.00 H new ATOM 0 HG3 PRO A 67 32.377 3.878 -13.490 1.00 0.00 H new ATOM 0 HD2 PRO A 67 31.656 2.986 -11.011 1.00 0.00 H new ATOM 0 HD3 PRO A 67 33.144 3.881 -11.247 1.00 0.00 H new ATOM 995 N VAL A 68 28.842 5.238 -11.056 1.00 0.00 N ATOM 996 CA VAL A 68 27.391 5.316 -10.943 1.00 0.00 C ATOM 997 C VAL A 68 26.954 5.640 -9.522 1.00 0.00 C ATOM 998 O VAL A 68 25.881 6.196 -9.331 1.00 0.00 O ATOM 999 CB VAL A 68 26.748 4.017 -11.426 1.00 0.00 C ATOM 1000 CG1 VAL A 68 27.201 3.717 -12.848 1.00 0.00 C ATOM 1001 CG2 VAL A 68 27.102 2.840 -10.521 1.00 0.00 C ATOM 0 H VAL A 68 29.227 4.305 -10.908 1.00 0.00 H new ATOM 0 HA VAL A 68 27.051 6.132 -11.581 1.00 0.00 H new ATOM 0 HB VAL A 68 25.667 4.151 -11.397 1.00 0.00 H new ATOM 0 HG11 VAL A 68 26.740 2.790 -13.189 1.00 0.00 H new ATOM 0 HG12 VAL A 68 26.902 4.534 -13.505 1.00 0.00 H new ATOM 0 HG13 VAL A 68 28.286 3.612 -12.870 1.00 0.00 H new ATOM 0 HG21 VAL A 68 26.626 1.935 -10.898 1.00 0.00 H new ATOM 0 HG22 VAL A 68 28.183 2.703 -10.509 1.00 0.00 H new ATOM 0 HG23 VAL A 68 26.750 3.040 -9.509 1.00 0.00 H new ATOM 1011 N ALA A 69 27.768 5.306 -8.520 1.00 0.00 N ATOM 1012 CA ALA A 69 27.433 5.641 -7.148 1.00 0.00 C ATOM 1013 C ALA A 69 27.604 7.144 -6.934 1.00 0.00 C ATOM 1014 O ALA A 69 26.932 7.740 -6.095 1.00 0.00 O ATOM 1015 CB ALA A 69 28.329 4.843 -6.210 1.00 0.00 C ATOM 0 H ALA A 69 28.652 4.810 -8.636 1.00 0.00 H new ATOM 0 HA ALA A 69 26.395 5.386 -6.937 1.00 0.00 H new ATOM 0 HB1 ALA A 69 28.084 5.088 -5.177 1.00 0.00 H new ATOM 0 HB2 ALA A 69 28.173 3.777 -6.377 1.00 0.00 H new ATOM 0 HB3 ALA A 69 29.372 5.091 -6.405 1.00 0.00 H new ATOM 1021 N GLU A 70 28.508 7.751 -7.704 1.00 0.00 N ATOM 1022 CA GLU A 70 28.688 9.194 -7.714 1.00 0.00 C ATOM 1023 C GLU A 70 27.539 9.856 -8.472 1.00 0.00 C ATOM 1024 O GLU A 70 27.160 10.983 -8.163 1.00 0.00 O ATOM 1025 CB GLU A 70 30.029 9.525 -8.375 1.00 0.00 C ATOM 1026 CG GLU A 70 31.196 9.065 -7.492 1.00 0.00 C ATOM 1027 CD GLU A 70 31.421 9.993 -6.301 1.00 0.00 C ATOM 1028 OE1 GLU A 70 32.345 9.694 -5.511 1.00 0.00 O ATOM 1029 OE2 GLU A 70 30.678 10.993 -6.182 1.00 0.00 O ATOM 0 H GLU A 70 29.133 7.252 -8.336 1.00 0.00 H new ATOM 0 HA GLU A 70 28.688 9.574 -6.692 1.00 0.00 H new ATOM 0 HB2 GLU A 70 30.090 9.039 -9.349 1.00 0.00 H new ATOM 0 HB3 GLU A 70 30.099 10.599 -8.549 1.00 0.00 H new ATOM 0 HG2 GLU A 70 31.000 8.055 -7.131 1.00 0.00 H new ATOM 0 HG3 GLU A 70 32.106 9.019 -8.091 1.00 0.00 H new ATOM 1036 N ALA A 71 26.982 9.155 -9.465 1.00 0.00 N ATOM 1037 CA ALA A 71 25.858 9.660 -10.235 1.00 0.00 C ATOM 1038 C ALA A 71 24.558 9.517 -9.442 1.00 0.00 C ATOM 1039 O ALA A 71 23.655 10.337 -9.589 1.00 0.00 O ATOM 1040 CB ALA A 71 25.774 8.894 -11.554 1.00 0.00 C ATOM 0 H ALA A 71 27.300 8.229 -9.750 1.00 0.00 H new ATOM 0 HA ALA A 71 26.006 10.720 -10.443 1.00 0.00 H new ATOM 0 HB1 ALA A 71 24.933 9.267 -12.138 1.00 0.00 H new ATOM 0 HB2 ALA A 71 26.697 9.035 -12.116 1.00 0.00 H new ATOM 0 HB3 ALA A 71 25.632 7.833 -11.350 1.00 0.00 H new ATOM 1046 N LEU A 72 24.455 8.481 -8.603 1.00 0.00 N ATOM 1047 CA LEU A 72 23.276 8.282 -7.770 1.00 0.00 C ATOM 1048 C LEU A 72 23.231 9.368 -6.695 1.00 0.00 C ATOM 1049 O LEU A 72 22.152 9.789 -6.282 1.00 0.00 O ATOM 1050 CB LEU A 72 23.334 6.890 -7.128 1.00 0.00 C ATOM 1051 CG LEU A 72 22.822 5.749 -8.028 1.00 0.00 C ATOM 1052 CD1 LEU A 72 21.440 5.304 -7.553 1.00 0.00 C ATOM 1053 CD2 LEU A 72 22.716 6.115 -9.505 1.00 0.00 C ATOM 0 H LEU A 72 25.177 7.770 -8.486 1.00 0.00 H new ATOM 0 HA LEU A 72 22.373 8.349 -8.377 1.00 0.00 H new ATOM 0 HB2 LEU A 72 24.365 6.677 -6.844 1.00 0.00 H new ATOM 0 HB3 LEU A 72 22.747 6.903 -6.210 1.00 0.00 H new ATOM 0 HG LEU A 72 23.563 4.954 -7.943 1.00 0.00 H new ATOM 0 HD11 LEU A 72 21.079 4.497 -8.190 1.00 0.00 H new ATOM 0 HD12 LEU A 72 21.505 4.952 -6.523 1.00 0.00 H new ATOM 0 HD13 LEU A 72 20.749 6.145 -7.606 1.00 0.00 H new ATOM 0 HD21 LEU A 72 22.348 5.257 -10.067 1.00 0.00 H new ATOM 0 HD22 LEU A 72 22.025 6.950 -9.624 1.00 0.00 H new ATOM 0 HD23 LEU A 72 23.699 6.401 -9.880 1.00 0.00 H new ATOM 1065 N ALA A 73 24.400 9.828 -6.245 1.00 0.00 N ATOM 1066 CA ALA A 73 24.480 10.906 -5.272 1.00 0.00 C ATOM 1067 C ALA A 73 24.150 12.251 -5.930 1.00 0.00 C ATOM 1068 O ALA A 73 23.648 13.156 -5.267 1.00 0.00 O ATOM 1069 CB ALA A 73 25.885 10.934 -4.677 1.00 0.00 C ATOM 0 H ALA A 73 25.305 9.465 -6.544 1.00 0.00 H new ATOM 0 HA ALA A 73 23.752 10.733 -4.479 1.00 0.00 H new ATOM 0 HB1 ALA A 73 25.955 11.740 -3.946 1.00 0.00 H new ATOM 0 HB2 ALA A 73 26.092 9.982 -4.189 1.00 0.00 H new ATOM 0 HB3 ALA A 73 26.613 11.101 -5.471 1.00 0.00 H new ATOM 1075 N ALA A 74 24.430 12.385 -7.232 1.00 0.00 N ATOM 1076 CA ALA A 74 24.140 13.605 -7.973 1.00 0.00 C ATOM 1077 C ALA A 74 22.664 13.661 -8.370 1.00 0.00 C ATOM 1078 O ALA A 74 22.077 14.739 -8.437 1.00 0.00 O ATOM 1079 CB ALA A 74 25.018 13.648 -9.222 1.00 0.00 C ATOM 0 H ALA A 74 24.862 11.651 -7.794 1.00 0.00 H new ATOM 0 HA ALA A 74 24.353 14.466 -7.339 1.00 0.00 H new ATOM 0 HB1 ALA A 74 24.808 14.558 -9.783 1.00 0.00 H new ATOM 0 HB2 ALA A 74 26.068 13.637 -8.929 1.00 0.00 H new ATOM 0 HB3 ALA A 74 24.806 12.780 -9.846 1.00 0.00 H new ATOM 1085 N ARG A 75 22.069 12.495 -8.632 1.00 0.00 N ATOM 1086 CA ARG A 75 20.665 12.377 -9.008 1.00 0.00 C ATOM 1087 C ARG A 75 19.761 12.307 -7.776 1.00 0.00 C ATOM 1088 O ARG A 75 18.547 12.173 -7.909 1.00 0.00 O ATOM 1089 CB ARG A 75 20.489 11.138 -9.888 1.00 0.00 C ATOM 1090 CG ARG A 75 21.199 11.342 -11.228 1.00 0.00 C ATOM 1091 CD ARG A 75 21.234 10.023 -12.000 1.00 0.00 C ATOM 1092 NE ARG A 75 22.054 10.139 -13.214 1.00 0.00 N ATOM 1093 CZ ARG A 75 21.565 10.295 -14.446 1.00 0.00 C ATOM 1094 NH1 ARG A 75 20.255 10.375 -14.657 1.00 0.00 N ATOM 1095 NH2 ARG A 75 22.394 10.373 -15.480 1.00 0.00 N ATOM 0 H ARG A 75 22.556 11.600 -8.588 1.00 0.00 H new ATOM 0 HA ARG A 75 20.371 13.265 -9.567 1.00 0.00 H new ATOM 0 HB2 ARG A 75 20.895 10.262 -9.382 1.00 0.00 H new ATOM 0 HB3 ARG A 75 19.429 10.948 -10.054 1.00 0.00 H new ATOM 0 HG2 ARG A 75 20.681 12.103 -11.812 1.00 0.00 H new ATOM 0 HG3 ARG A 75 22.214 11.704 -11.061 1.00 0.00 H new ATOM 0 HD2 ARG A 75 21.634 9.235 -11.362 1.00 0.00 H new ATOM 0 HD3 ARG A 75 20.220 9.730 -12.270 1.00 0.00 H new ATOM 0 HE ARG A 75 23.068 10.097 -13.108 1.00 0.00 H new ATOM 0 HH11 ARG A 75 19.607 10.317 -13.871 1.00 0.00 H new ATOM 0 HH12 ARG A 75 19.897 10.494 -15.605 1.00 0.00 H new ATOM 0 HH21 ARG A 75 23.401 10.314 -15.332 1.00 0.00 H new ATOM 0 HH22 ARG A 75 22.024 10.492 -16.423 1.00 0.00 H new ATOM 1109 N ASP A 76 20.358 12.395 -6.584 1.00 0.00 N ATOM 1110 CA ASP A 76 19.640 12.351 -5.317 1.00 0.00 C ATOM 1111 C ASP A 76 18.766 11.094 -5.214 1.00 0.00 C ATOM 1112 O ASP A 76 17.588 11.169 -4.867 1.00 0.00 O ATOM 1113 CB ASP A 76 18.863 13.658 -5.108 1.00 0.00 C ATOM 1114 CG ASP A 76 18.103 13.679 -3.783 1.00 0.00 C ATOM 1115 OD1 ASP A 76 17.105 14.433 -3.707 1.00 0.00 O ATOM 1116 OD2 ASP A 76 18.524 12.949 -2.861 1.00 0.00 O ATOM 0 H ASP A 76 21.367 12.500 -6.476 1.00 0.00 H new ATOM 0 HA ASP A 76 20.356 12.274 -4.499 1.00 0.00 H new ATOM 0 HB2 ASP A 76 19.556 14.498 -5.139 1.00 0.00 H new ATOM 0 HB3 ASP A 76 18.159 13.794 -5.929 1.00 0.00 H new ATOM 1121 N ILE A 77 19.351 9.930 -5.516 1.00 0.00 N ATOM 1122 CA ILE A 77 18.679 8.644 -5.365 1.00 0.00 C ATOM 1123 C ILE A 77 19.540 7.706 -4.510 1.00 0.00 C ATOM 1124 O ILE A 77 20.763 7.721 -4.626 1.00 0.00 O ATOM 1125 CB ILE A 77 18.372 8.020 -6.736 1.00 0.00 C ATOM 1126 CG1 ILE A 77 19.363 8.490 -7.809 1.00 0.00 C ATOM 1127 CG2 ILE A 77 16.962 8.429 -7.161 1.00 0.00 C ATOM 1128 CD1 ILE A 77 19.124 7.772 -9.138 1.00 0.00 C ATOM 0 H ILE A 77 20.304 9.858 -5.872 1.00 0.00 H new ATOM 0 HA ILE A 77 17.727 8.801 -4.858 1.00 0.00 H new ATOM 0 HB ILE A 77 18.457 6.937 -6.641 1.00 0.00 H new ATOM 0 HG12 ILE A 77 19.265 9.566 -7.952 1.00 0.00 H new ATOM 0 HG13 ILE A 77 20.383 8.305 -7.471 1.00 0.00 H new ATOM 0 HG21 ILE A 77 16.734 7.992 -8.133 1.00 0.00 H new ATOM 0 HG22 ILE A 77 16.242 8.072 -6.424 1.00 0.00 H new ATOM 0 HG23 ILE A 77 16.903 9.515 -7.229 1.00 0.00 H new ATOM 0 HD11 ILE A 77 19.842 8.127 -9.878 1.00 0.00 H new ATOM 0 HD12 ILE A 77 19.247 6.698 -8.999 1.00 0.00 H new ATOM 0 HD13 ILE A 77 18.112 7.979 -9.486 1.00 0.00 H new ATOM 1140 N PRO A 78 18.914 6.884 -3.648 1.00 0.00 N ATOM 1141 CA PRO A 78 19.621 5.995 -2.742 1.00 0.00 C ATOM 1142 C PRO A 78 20.407 4.925 -3.496 1.00 0.00 C ATOM 1143 O PRO A 78 20.073 4.581 -4.629 1.00 0.00 O ATOM 1144 CB PRO A 78 18.548 5.363 -1.850 1.00 0.00 C ATOM 1145 CG PRO A 78 17.307 6.237 -2.051 1.00 0.00 C ATOM 1146 CD PRO A 78 17.485 6.783 -3.457 1.00 0.00 C ATOM 0 HA PRO A 78 20.358 6.544 -2.156 1.00 0.00 H new ATOM 0 HB2 PRO A 78 18.354 4.329 -2.136 1.00 0.00 H new ATOM 0 HB3 PRO A 78 18.859 5.352 -0.805 1.00 0.00 H new ATOM 0 HG2 PRO A 78 16.388 5.658 -1.958 1.00 0.00 H new ATOM 0 HG3 PRO A 78 17.255 7.037 -1.313 1.00 0.00 H new ATOM 0 HD2 PRO A 78 17.035 6.120 -4.196 1.00 0.00 H new ATOM 0 HD3 PRO A 78 17.004 7.755 -3.565 1.00 0.00 H new ATOM 1154 N PHE A 79 21.455 4.396 -2.861 1.00 0.00 N ATOM 1155 CA PHE A 79 22.295 3.372 -3.461 1.00 0.00 C ATOM 1156 C PHE A 79 22.813 2.365 -2.432 1.00 0.00 C ATOM 1157 O PHE A 79 23.144 2.741 -1.309 1.00 0.00 O ATOM 1158 CB PHE A 79 23.443 4.030 -4.235 1.00 0.00 C ATOM 1159 CG PHE A 79 24.209 5.059 -3.434 1.00 0.00 C ATOM 1160 CD1 PHE A 79 23.823 6.405 -3.464 1.00 0.00 C ATOM 1161 CD2 PHE A 79 25.305 4.665 -2.659 1.00 0.00 C ATOM 1162 CE1 PHE A 79 24.532 7.359 -2.719 1.00 0.00 C ATOM 1163 CE2 PHE A 79 26.011 5.618 -1.908 1.00 0.00 C ATOM 1164 CZ PHE A 79 25.625 6.964 -1.940 1.00 0.00 C ATOM 0 H PHE A 79 21.740 4.668 -1.920 1.00 0.00 H new ATOM 0 HA PHE A 79 21.682 2.801 -4.158 1.00 0.00 H new ATOM 0 HB2 PHE A 79 24.134 3.256 -4.569 1.00 0.00 H new ATOM 0 HB3 PHE A 79 23.040 4.506 -5.129 1.00 0.00 H new ATOM 0 HD1 PHE A 79 22.977 6.709 -4.062 1.00 0.00 H new ATOM 0 HD2 PHE A 79 25.608 3.628 -2.638 1.00 0.00 H new ATOM 0 HE1 PHE A 79 24.235 8.397 -2.747 1.00 0.00 H new ATOM 0 HE2 PHE A 79 26.853 5.313 -1.305 1.00 0.00 H new ATOM 0 HZ PHE A 79 26.171 7.696 -1.364 1.00 0.00 H new ATOM 1174 N VAL A 80 22.887 1.088 -2.818 1.00 0.00 N ATOM 1175 CA VAL A 80 23.451 0.045 -1.973 1.00 0.00 C ATOM 1176 C VAL A 80 24.751 -0.445 -2.586 1.00 0.00 C ATOM 1177 O VAL A 80 24.870 -0.526 -3.806 1.00 0.00 O ATOM 1178 CB VAL A 80 22.470 -1.132 -1.836 1.00 0.00 C ATOM 1179 CG1 VAL A 80 23.091 -2.250 -1.001 1.00 0.00 C ATOM 1180 CG2 VAL A 80 21.188 -0.731 -1.133 1.00 0.00 C ATOM 0 H VAL A 80 22.557 0.754 -3.724 1.00 0.00 H new ATOM 0 HA VAL A 80 23.638 0.457 -0.981 1.00 0.00 H new ATOM 0 HB VAL A 80 22.251 -1.460 -2.852 1.00 0.00 H new ATOM 0 HG11 VAL A 80 22.384 -3.075 -0.914 1.00 0.00 H new ATOM 0 HG12 VAL A 80 24.002 -2.603 -1.485 1.00 0.00 H new ATOM 0 HG13 VAL A 80 23.331 -1.872 -0.007 1.00 0.00 H new ATOM 0 HG21 VAL A 80 20.527 -1.595 -1.060 1.00 0.00 H new ATOM 0 HG22 VAL A 80 21.420 -0.366 -0.132 1.00 0.00 H new ATOM 0 HG23 VAL A 80 20.693 0.057 -1.700 1.00 0.00 H new ATOM 1190 N PHE A 81 25.727 -0.781 -1.744 1.00 0.00 N ATOM 1191 CA PHE A 81 26.932 -1.451 -2.205 1.00 0.00 C ATOM 1192 C PHE A 81 26.875 -2.966 -2.042 1.00 0.00 C ATOM 1193 O PHE A 81 26.125 -3.473 -1.211 1.00 0.00 O ATOM 1194 CB PHE A 81 28.183 -0.834 -1.585 1.00 0.00 C ATOM 1195 CG PHE A 81 28.613 0.454 -2.248 1.00 0.00 C ATOM 1196 CD1 PHE A 81 29.388 0.410 -3.418 1.00 0.00 C ATOM 1197 CD2 PHE A 81 28.248 1.691 -1.700 1.00 0.00 C ATOM 1198 CE1 PHE A 81 29.810 1.599 -4.026 1.00 0.00 C ATOM 1199 CE2 PHE A 81 28.660 2.881 -2.317 1.00 0.00 C ATOM 1200 CZ PHE A 81 29.445 2.834 -3.475 1.00 0.00 C ATOM 0 H PHE A 81 25.703 -0.599 -0.741 1.00 0.00 H new ATOM 0 HA PHE A 81 26.993 -1.285 -3.281 1.00 0.00 H new ATOM 0 HB2 PHE A 81 27.999 -0.645 -0.527 1.00 0.00 H new ATOM 0 HB3 PHE A 81 29.000 -1.553 -1.643 1.00 0.00 H new ATOM 0 HD1 PHE A 81 29.659 -0.542 -3.850 1.00 0.00 H new ATOM 0 HD2 PHE A 81 27.649 1.728 -0.802 1.00 0.00 H new ATOM 0 HE1 PHE A 81 30.416 1.564 -4.919 1.00 0.00 H new ATOM 0 HE2 PHE A 81 28.372 3.834 -1.899 1.00 0.00 H new ATOM 0 HZ PHE A 81 29.770 3.751 -3.944 1.00 0.00 H new ATOM 1210 N ALA A 82 27.670 -3.690 -2.825 1.00 0.00 N ATOM 1211 CA ALA A 82 27.778 -5.131 -2.695 1.00 0.00 C ATOM 1212 C ALA A 82 29.243 -5.519 -2.534 1.00 0.00 C ATOM 1213 O ALA A 82 30.119 -4.905 -3.141 1.00 0.00 O ATOM 1214 CB ALA A 82 27.126 -5.816 -3.897 1.00 0.00 C ATOM 0 H ALA A 82 28.252 -3.293 -3.562 1.00 0.00 H new ATOM 0 HA ALA A 82 27.246 -5.467 -1.805 1.00 0.00 H new ATOM 0 HB1 ALA A 82 27.212 -6.897 -3.790 1.00 0.00 H new ATOM 0 HB2 ALA A 82 26.073 -5.539 -3.947 1.00 0.00 H new ATOM 0 HB3 ALA A 82 27.628 -5.501 -4.812 1.00 0.00 H new ATOM 1220 N THR A 83 29.503 -6.537 -1.714 1.00 0.00 N ATOM 1221 CA THR A 83 30.864 -6.954 -1.379 1.00 0.00 C ATOM 1222 C THR A 83 30.907 -8.475 -1.304 1.00 0.00 C ATOM 1223 O THR A 83 29.888 -9.146 -1.466 1.00 0.00 O ATOM 1224 CB THR A 83 31.261 -6.343 -0.030 1.00 0.00 C ATOM 1225 OG1 THR A 83 30.270 -6.609 0.940 1.00 0.00 O ATOM 1226 CG2 THR A 83 31.439 -4.833 -0.153 1.00 0.00 C ATOM 0 H THR A 83 28.777 -7.095 -1.264 1.00 0.00 H new ATOM 0 HA THR A 83 31.564 -6.612 -2.141 1.00 0.00 H new ATOM 0 HB THR A 83 32.205 -6.794 0.276 1.00 0.00 H new ATOM 0 HG1 THR A 83 30.537 -6.215 1.797 1.00 0.00 H new ATOM 0 HG21 THR A 83 31.721 -4.420 0.816 1.00 0.00 H new ATOM 0 HG22 THR A 83 32.221 -4.617 -0.881 1.00 0.00 H new ATOM 0 HG23 THR A 83 30.503 -4.382 -0.482 1.00 0.00 H new ATOM 1234 N GLY A 84 32.096 -9.024 -1.055 1.00 0.00 N ATOM 1235 CA GLY A 84 32.298 -10.462 -0.981 1.00 0.00 C ATOM 1236 C GLY A 84 33.589 -10.786 -0.239 1.00 0.00 C ATOM 1237 O GLY A 84 34.205 -9.900 0.352 1.00 0.00 O ATOM 0 H GLY A 84 32.944 -8.479 -0.899 1.00 0.00 H new ATOM 0 HA2 GLY A 84 31.454 -10.927 -0.473 1.00 0.00 H new ATOM 0 HA3 GLY A 84 32.335 -10.881 -1.986 1.00 0.00 H new ATOM 1241 N GLY A 85 34.002 -12.055 -0.272 1.00 0.00 N ATOM 1242 CA GLY A 85 35.186 -12.515 0.448 1.00 0.00 C ATOM 1243 C GLY A 85 36.481 -11.957 -0.146 1.00 0.00 C ATOM 1244 O GLY A 85 37.548 -12.138 0.437 1.00 0.00 O ATOM 0 H GLY A 85 33.525 -12.788 -0.797 1.00 0.00 H new ATOM 0 HA2 GLY A 85 35.111 -12.217 1.494 1.00 0.00 H new ATOM 0 HA3 GLY A 85 35.220 -13.604 0.428 1.00 0.00 H new ATOM 1248 N SER A 86 36.391 -11.279 -1.295 1.00 0.00 N ATOM 1249 CA SER A 86 37.542 -10.660 -1.943 1.00 0.00 C ATOM 1250 C SER A 86 37.165 -9.297 -2.522 1.00 0.00 C ATOM 1251 O SER A 86 37.950 -8.692 -3.252 1.00 0.00 O ATOM 1252 CB SER A 86 38.077 -11.581 -3.043 1.00 0.00 C ATOM 1253 OG SER A 86 38.550 -12.788 -2.486 1.00 0.00 O ATOM 0 H SER A 86 35.514 -11.146 -1.799 1.00 0.00 H new ATOM 0 HA SER A 86 38.324 -10.507 -1.199 1.00 0.00 H new ATOM 0 HB2 SER A 86 37.289 -11.791 -3.766 1.00 0.00 H new ATOM 0 HB3 SER A 86 38.881 -11.083 -3.584 1.00 0.00 H new ATOM 0 HG SER A 86 38.887 -13.368 -3.200 1.00 0.00 H new ATOM 1259 N ASP A 87 35.962 -8.818 -2.195 1.00 0.00 N ATOM 1260 CA ASP A 87 35.424 -7.569 -2.721 1.00 0.00 C ATOM 1261 C ASP A 87 34.976 -6.612 -1.615 1.00 0.00 C ATOM 1262 O ASP A 87 34.356 -5.586 -1.893 1.00 0.00 O ATOM 1263 CB ASP A 87 34.282 -7.866 -3.700 1.00 0.00 C ATOM 1264 CG ASP A 87 34.777 -8.560 -4.965 1.00 0.00 C ATOM 1265 OD1 ASP A 87 34.016 -9.406 -5.486 1.00 0.00 O ATOM 1266 OD2 ASP A 87 35.905 -8.241 -5.403 1.00 0.00 O ATOM 0 H ASP A 87 35.331 -9.294 -1.551 1.00 0.00 H new ATOM 0 HA ASP A 87 36.226 -7.060 -3.255 1.00 0.00 H new ATOM 0 HB2 ASP A 87 33.539 -8.494 -3.209 1.00 0.00 H new ATOM 0 HB3 ASP A 87 33.784 -6.934 -3.969 1.00 0.00 H new ATOM 1271 N ASP A 88 35.287 -6.949 -0.361 1.00 0.00 N ATOM 1272 CA ASP A 88 34.900 -6.149 0.792 1.00 0.00 C ATOM 1273 C ASP A 88 35.772 -4.902 0.973 1.00 0.00 C ATOM 1274 O ASP A 88 35.760 -4.280 2.035 1.00 0.00 O ATOM 1275 CB ASP A 88 34.848 -7.008 2.058 1.00 0.00 C ATOM 1276 CG ASP A 88 36.142 -7.790 2.304 1.00 0.00 C ATOM 1277 OD1 ASP A 88 37.138 -7.542 1.584 1.00 0.00 O ATOM 1278 OD2 ASP A 88 36.121 -8.638 3.222 1.00 0.00 O ATOM 0 H ASP A 88 35.816 -7.788 -0.121 1.00 0.00 H new ATOM 0 HA ASP A 88 33.894 -5.776 0.600 1.00 0.00 H new ATOM 0 HB2 ASP A 88 34.648 -6.368 2.917 1.00 0.00 H new ATOM 0 HB3 ASP A 88 34.016 -7.708 1.982 1.00 0.00 H new ATOM 1283 N SER A 89 36.528 -4.539 -0.070 1.00 0.00 N ATOM 1284 CA SER A 89 37.379 -3.356 -0.072 1.00 0.00 C ATOM 1285 C SER A 89 36.558 -2.081 -0.276 1.00 0.00 C ATOM 1286 O SER A 89 37.018 -1.141 -0.926 1.00 0.00 O ATOM 1287 CB SER A 89 38.441 -3.495 -1.165 1.00 0.00 C ATOM 1288 OG SER A 89 39.240 -4.631 -0.912 1.00 0.00 O ATOM 0 H SER A 89 36.562 -5.067 -0.942 1.00 0.00 H new ATOM 0 HA SER A 89 37.868 -3.276 0.899 1.00 0.00 H new ATOM 0 HB2 SER A 89 37.963 -3.585 -2.140 1.00 0.00 H new ATOM 0 HB3 SER A 89 39.063 -2.601 -1.196 1.00 0.00 H new ATOM 0 HG SER A 89 39.918 -4.718 -1.615 1.00 0.00 H new ATOM 1294 N VAL A 90 35.341 -2.044 0.273 1.00 0.00 N ATOM 1295 CA VAL A 90 34.447 -0.904 0.122 1.00 0.00 C ATOM 1296 C VAL A 90 35.099 0.356 0.689 1.00 0.00 C ATOM 1297 O VAL A 90 35.836 0.300 1.677 1.00 0.00 O ATOM 1298 CB VAL A 90 33.099 -1.201 0.797 1.00 0.00 C ATOM 1299 CG1 VAL A 90 33.270 -1.498 2.288 1.00 0.00 C ATOM 1300 CG2 VAL A 90 32.145 -0.015 0.643 1.00 0.00 C ATOM 0 H VAL A 90 34.953 -2.804 0.832 1.00 0.00 H new ATOM 0 HA VAL A 90 34.258 -0.729 -0.937 1.00 0.00 H new ATOM 0 HB VAL A 90 32.684 -2.080 0.304 1.00 0.00 H new ATOM 0 HG11 VAL A 90 32.296 -1.703 2.732 1.00 0.00 H new ATOM 0 HG12 VAL A 90 33.917 -2.366 2.414 1.00 0.00 H new ATOM 0 HG13 VAL A 90 33.719 -0.636 2.781 1.00 0.00 H new ATOM 0 HG21 VAL A 90 31.196 -0.246 1.128 1.00 0.00 H new ATOM 0 HG22 VAL A 90 32.584 0.868 1.107 1.00 0.00 H new ATOM 0 HG23 VAL A 90 31.974 0.179 -0.416 1.00 0.00 H new ATOM 1310 N ASP A 91 34.819 1.497 0.055 1.00 0.00 N ATOM 1311 CA ASP A 91 35.397 2.772 0.440 1.00 0.00 C ATOM 1312 C ASP A 91 34.778 3.233 1.763 1.00 0.00 C ATOM 1313 O ASP A 91 33.558 3.183 1.925 1.00 0.00 O ATOM 1314 CB ASP A 91 35.136 3.775 -0.685 1.00 0.00 C ATOM 1315 CG ASP A 91 35.806 5.130 -0.452 1.00 0.00 C ATOM 1316 OD1 ASP A 91 36.476 5.282 0.595 1.00 0.00 O ATOM 1317 OD2 ASP A 91 35.640 6.002 -1.333 1.00 0.00 O ATOM 0 H ASP A 91 34.183 1.555 -0.740 1.00 0.00 H new ATOM 0 HA ASP A 91 36.473 2.685 0.591 1.00 0.00 H new ATOM 0 HB2 ASP A 91 35.494 3.357 -1.626 1.00 0.00 H new ATOM 0 HB3 ASP A 91 34.061 3.922 -0.790 1.00 0.00 H new ATOM 1322 N SER A 92 35.610 3.684 2.706 1.00 0.00 N ATOM 1323 CA SER A 92 35.148 4.138 4.010 1.00 0.00 C ATOM 1324 C SER A 92 34.343 5.431 3.887 1.00 0.00 C ATOM 1325 O SER A 92 33.689 5.850 4.842 1.00 0.00 O ATOM 1326 CB SER A 92 36.348 4.340 4.936 1.00 0.00 C ATOM 1327 OG SER A 92 37.169 5.377 4.439 1.00 0.00 O ATOM 0 H SER A 92 36.621 3.743 2.582 1.00 0.00 H new ATOM 0 HA SER A 92 34.492 3.377 4.433 1.00 0.00 H new ATOM 0 HB2 SER A 92 36.006 4.585 5.941 1.00 0.00 H new ATOM 0 HB3 SER A 92 36.920 3.415 5.011 1.00 0.00 H new ATOM 0 HG SER A 92 37.935 5.503 5.037 1.00 0.00 H new ATOM 1333 N ARG A 93 34.386 6.069 2.713 1.00 0.00 N ATOM 1334 CA ARG A 93 33.590 7.255 2.439 1.00 0.00 C ATOM 1335 C ARG A 93 32.122 6.884 2.201 1.00 0.00 C ATOM 1336 O ARG A 93 31.244 7.739 2.311 1.00 0.00 O ATOM 1337 CB ARG A 93 34.197 7.969 1.227 1.00 0.00 C ATOM 1338 CG ARG A 93 33.358 9.173 0.786 1.00 0.00 C ATOM 1339 CD ARG A 93 34.124 9.940 -0.286 1.00 0.00 C ATOM 1340 NE ARG A 93 33.267 10.938 -0.937 1.00 0.00 N ATOM 1341 CZ ARG A 93 32.907 10.886 -2.223 1.00 0.00 C ATOM 1342 NH1 ARG A 93 33.328 9.894 -3.003 1.00 0.00 N ATOM 1343 NH2 ARG A 93 32.122 11.826 -2.737 1.00 0.00 N ATOM 0 H ARG A 93 34.973 5.774 1.933 1.00 0.00 H new ATOM 0 HA ARG A 93 33.606 7.925 3.298 1.00 0.00 H new ATOM 0 HB2 ARG A 93 35.206 8.301 1.471 1.00 0.00 H new ATOM 0 HB3 ARG A 93 34.284 7.266 0.399 1.00 0.00 H new ATOM 0 HG2 ARG A 93 32.396 8.840 0.397 1.00 0.00 H new ATOM 0 HG3 ARG A 93 33.151 9.821 1.638 1.00 0.00 H new ATOM 0 HD2 ARG A 93 34.986 10.434 0.162 1.00 0.00 H new ATOM 0 HD3 ARG A 93 34.507 9.244 -1.032 1.00 0.00 H new ATOM 0 HE ARG A 93 32.926 11.718 -0.375 1.00 0.00 H new ATOM 0 HH11 ARG A 93 33.930 9.165 -2.621 1.00 0.00 H new ATOM 0 HH12 ARG A 93 33.048 9.862 -3.983 1.00 0.00 H new ATOM 0 HH21 ARG A 93 31.791 12.592 -2.150 1.00 0.00 H new ATOM 0 HH22 ARG A 93 31.850 11.782 -3.719 1.00 0.00 H new ATOM 1357 N PHE A 94 31.853 5.616 1.875 1.00 0.00 N ATOM 1358 CA PHE A 94 30.502 5.143 1.604 1.00 0.00 C ATOM 1359 C PHE A 94 29.989 4.101 2.593 1.00 0.00 C ATOM 1360 O PHE A 94 28.880 3.595 2.430 1.00 0.00 O ATOM 1361 CB PHE A 94 30.395 4.648 0.165 1.00 0.00 C ATOM 1362 CG PHE A 94 30.516 5.747 -0.862 1.00 0.00 C ATOM 1363 CD1 PHE A 94 31.697 5.887 -1.603 1.00 0.00 C ATOM 1364 CD2 PHE A 94 29.451 6.633 -1.069 1.00 0.00 C ATOM 1365 CE1 PHE A 94 31.810 6.910 -2.554 1.00 0.00 C ATOM 1366 CE2 PHE A 94 29.560 7.647 -2.029 1.00 0.00 C ATOM 1367 CZ PHE A 94 30.739 7.787 -2.775 1.00 0.00 C ATOM 0 H PHE A 94 32.568 4.893 1.793 1.00 0.00 H new ATOM 0 HA PHE A 94 29.846 6.003 1.741 1.00 0.00 H new ATOM 0 HB2 PHE A 94 31.174 3.907 -0.014 1.00 0.00 H new ATOM 0 HB3 PHE A 94 29.438 4.143 0.033 1.00 0.00 H new ATOM 0 HD1 PHE A 94 32.520 5.207 -1.441 1.00 0.00 H new ATOM 0 HD2 PHE A 94 28.546 6.534 -0.488 1.00 0.00 H new ATOM 0 HE1 PHE A 94 32.724 7.023 -3.118 1.00 0.00 H new ATOM 0 HE2 PHE A 94 28.734 8.323 -2.195 1.00 0.00 H new ATOM 0 HZ PHE A 94 30.822 8.567 -3.517 1.00 0.00 H new ATOM 1377 N ARG A 95 30.783 3.774 3.621 1.00 0.00 N ATOM 1378 CA ARG A 95 30.395 2.768 4.606 1.00 0.00 C ATOM 1379 C ARG A 95 29.213 3.251 5.452 1.00 0.00 C ATOM 1380 O ARG A 95 28.619 2.466 6.184 1.00 0.00 O ATOM 1381 CB ARG A 95 31.610 2.416 5.471 1.00 0.00 C ATOM 1382 CG ARG A 95 32.084 3.606 6.309 1.00 0.00 C ATOM 1383 CD ARG A 95 31.428 3.605 7.691 1.00 0.00 C ATOM 1384 NE ARG A 95 31.749 4.828 8.431 1.00 0.00 N ATOM 1385 CZ ARG A 95 32.813 4.971 9.228 1.00 0.00 C ATOM 1386 NH1 ARG A 95 33.676 3.972 9.391 1.00 0.00 N ATOM 1387 NH2 ARG A 95 33.014 6.123 9.863 1.00 0.00 N ATOM 0 H ARG A 95 31.697 4.194 3.788 1.00 0.00 H new ATOM 0 HA ARG A 95 30.061 1.867 4.091 1.00 0.00 H new ATOM 0 HB2 ARG A 95 31.357 1.586 6.131 1.00 0.00 H new ATOM 0 HB3 ARG A 95 32.424 2.077 4.831 1.00 0.00 H new ATOM 0 HG2 ARG A 95 33.168 3.569 6.418 1.00 0.00 H new ATOM 0 HG3 ARG A 95 31.847 4.536 5.792 1.00 0.00 H new ATOM 0 HD2 ARG A 95 30.347 3.515 7.583 1.00 0.00 H new ATOM 0 HD3 ARG A 95 31.765 2.736 8.256 1.00 0.00 H new ATOM 0 HE ARG A 95 31.119 5.624 8.332 1.00 0.00 H new ATOM 0 HH11 ARG A 95 33.529 3.087 8.906 1.00 0.00 H new ATOM 0 HH12 ARG A 95 34.485 4.091 10.001 1.00 0.00 H new ATOM 0 HH21 ARG A 95 32.357 6.894 9.741 1.00 0.00 H new ATOM 0 HH22 ARG A 95 33.825 6.235 10.472 1.00 0.00 H new ATOM 1401 N ASP A 96 28.870 4.541 5.348 1.00 0.00 N ATOM 1402 CA ASP A 96 27.687 5.091 6.004 1.00 0.00 C ATOM 1403 C ASP A 96 26.403 4.601 5.332 1.00 0.00 C ATOM 1404 O ASP A 96 25.326 4.669 5.924 1.00 0.00 O ATOM 1405 CB ASP A 96 27.743 6.622 5.997 1.00 0.00 C ATOM 1406 CG ASP A 96 28.897 7.177 6.833 1.00 0.00 C ATOM 1407 OD1 ASP A 96 29.564 6.377 7.528 1.00 0.00 O ATOM 1408 OD2 ASP A 96 29.102 8.411 6.770 1.00 0.00 O ATOM 0 H ASP A 96 29.403 5.225 4.810 1.00 0.00 H new ATOM 0 HA ASP A 96 27.678 4.741 7.036 1.00 0.00 H new ATOM 0 HB2 ASP A 96 27.843 6.973 4.970 1.00 0.00 H new ATOM 0 HB3 ASP A 96 26.801 7.017 6.378 1.00 0.00 H new ATOM 1413 N ARG A 97 26.525 4.106 4.097 1.00 0.00 N ATOM 1414 CA ARG A 97 25.430 3.486 3.367 1.00 0.00 C ATOM 1415 C ARG A 97 25.460 1.975 3.598 1.00 0.00 C ATOM 1416 O ARG A 97 26.497 1.428 3.975 1.00 0.00 O ATOM 1417 CB ARG A 97 25.538 3.840 1.878 1.00 0.00 C ATOM 1418 CG ARG A 97 24.515 4.919 1.508 1.00 0.00 C ATOM 1419 CD ARG A 97 24.807 6.218 2.264 1.00 0.00 C ATOM 1420 NE ARG A 97 23.742 7.203 2.047 1.00 0.00 N ATOM 1421 CZ ARG A 97 22.754 7.440 2.915 1.00 0.00 C ATOM 1422 NH1 ARG A 97 22.677 6.770 4.061 1.00 0.00 N ATOM 1423 NH2 ARG A 97 21.830 8.353 2.639 1.00 0.00 N ATOM 0 H ARG A 97 27.401 4.128 3.575 1.00 0.00 H new ATOM 0 HA ARG A 97 24.473 3.862 3.728 1.00 0.00 H new ATOM 0 HB2 ARG A 97 26.545 4.193 1.654 1.00 0.00 H new ATOM 0 HB3 ARG A 97 25.371 2.949 1.273 1.00 0.00 H new ATOM 0 HG2 ARG A 97 24.544 5.102 0.434 1.00 0.00 H new ATOM 0 HG3 ARG A 97 23.509 4.572 1.745 1.00 0.00 H new ATOM 0 HD2 ARG A 97 24.903 6.009 3.330 1.00 0.00 H new ATOM 0 HD3 ARG A 97 25.761 6.629 1.933 1.00 0.00 H new ATOM 0 HE ARG A 97 23.756 7.740 1.180 1.00 0.00 H new ATOM 0 HH11 ARG A 97 23.378 6.064 4.287 1.00 0.00 H new ATOM 0 HH12 ARG A 97 21.917 6.962 4.714 1.00 0.00 H new ATOM 0 HH21 ARG A 97 21.874 8.874 1.763 1.00 0.00 H new ATOM 0 HH22 ARG A 97 21.076 8.533 3.303 1.00 0.00 H new ATOM 1437 N PRO A 98 24.336 1.288 3.376 1.00 0.00 N ATOM 1438 CA PRO A 98 24.222 -0.137 3.615 1.00 0.00 C ATOM 1439 C PRO A 98 25.021 -0.913 2.577 1.00 0.00 C ATOM 1440 O PRO A 98 25.343 -0.387 1.510 1.00 0.00 O ATOM 1441 CB PRO A 98 22.733 -0.449 3.498 1.00 0.00 C ATOM 1442 CG PRO A 98 22.219 0.631 2.548 1.00 0.00 C ATOM 1443 CD PRO A 98 23.096 1.838 2.864 1.00 0.00 C ATOM 0 HA PRO A 98 24.616 -0.421 4.591 1.00 0.00 H new ATOM 0 HB2 PRO A 98 22.562 -1.449 3.100 1.00 0.00 H new ATOM 0 HB3 PRO A 98 22.235 -0.402 4.467 1.00 0.00 H new ATOM 0 HG2 PRO A 98 22.317 0.327 1.506 1.00 0.00 H new ATOM 0 HG3 PRO A 98 21.164 0.846 2.720 1.00 0.00 H new ATOM 0 HD2 PRO A 98 23.272 2.440 1.973 1.00 0.00 H new ATOM 0 HD3 PRO A 98 22.621 2.487 3.599 1.00 0.00 H new ATOM 1451 N VAL A 99 25.343 -2.169 2.887 1.00 0.00 N ATOM 1452 CA VAL A 99 26.097 -3.013 1.981 1.00 0.00 C ATOM 1453 C VAL A 99 25.654 -4.459 2.140 1.00 0.00 C ATOM 1454 O VAL A 99 25.646 -5.004 3.245 1.00 0.00 O ATOM 1455 CB VAL A 99 27.601 -2.848 2.248 1.00 0.00 C ATOM 1456 CG1 VAL A 99 27.954 -3.060 3.722 1.00 0.00 C ATOM 1457 CG2 VAL A 99 28.410 -3.847 1.423 1.00 0.00 C ATOM 0 H VAL A 99 25.088 -2.620 3.766 1.00 0.00 H new ATOM 0 HA VAL A 99 25.906 -2.715 0.950 1.00 0.00 H new ATOM 0 HB VAL A 99 27.849 -1.825 1.965 1.00 0.00 H new ATOM 0 HG11 VAL A 99 29.028 -2.933 3.861 1.00 0.00 H new ATOM 0 HG12 VAL A 99 27.420 -2.331 4.332 1.00 0.00 H new ATOM 0 HG13 VAL A 99 27.666 -4.067 4.024 1.00 0.00 H new ATOM 0 HG21 VAL A 99 29.472 -3.712 1.628 1.00 0.00 H new ATOM 0 HG22 VAL A 99 28.115 -4.862 1.689 1.00 0.00 H new ATOM 0 HG23 VAL A 99 28.221 -3.681 0.362 1.00 0.00 H new ATOM 1467 N LEU A 100 25.282 -5.073 1.019 1.00 0.00 N ATOM 1468 CA LEU A 100 25.030 -6.504 0.956 1.00 0.00 C ATOM 1469 C LEU A 100 26.343 -7.227 0.657 1.00 0.00 C ATOM 1470 O LEU A 100 27.249 -6.643 0.069 1.00 0.00 O ATOM 1471 CB LEU A 100 23.971 -6.794 -0.107 1.00 0.00 C ATOM 1472 CG LEU A 100 22.626 -6.141 0.248 1.00 0.00 C ATOM 1473 CD1 LEU A 100 21.624 -6.403 -0.876 1.00 0.00 C ATOM 1474 CD2 LEU A 100 22.066 -6.748 1.535 1.00 0.00 C ATOM 0 H LEU A 100 25.148 -4.589 0.131 1.00 0.00 H new ATOM 0 HA LEU A 100 24.648 -6.866 1.911 1.00 0.00 H new ATOM 0 HB2 LEU A 100 24.313 -6.424 -1.074 1.00 0.00 H new ATOM 0 HB3 LEU A 100 23.839 -7.871 -0.207 1.00 0.00 H new ATOM 0 HG LEU A 100 22.784 -5.071 0.382 1.00 0.00 H new ATOM 0 HD11 LEU A 100 20.669 -5.941 -0.627 1.00 0.00 H new ATOM 0 HD12 LEU A 100 22.001 -5.978 -1.806 1.00 0.00 H new ATOM 0 HD13 LEU A 100 21.486 -7.477 -0.998 1.00 0.00 H new ATOM 0 HD21 LEU A 100 21.113 -6.276 1.775 1.00 0.00 H new ATOM 0 HD22 LEU A 100 21.916 -7.819 1.397 1.00 0.00 H new ATOM 0 HD23 LEU A 100 22.769 -6.582 2.351 1.00 0.00 H new ATOM 1486 N GLN A 101 26.459 -8.492 1.064 1.00 0.00 N ATOM 1487 CA GLN A 101 27.716 -9.220 0.964 1.00 0.00 C ATOM 1488 C GLN A 101 27.444 -10.657 0.512 1.00 0.00 C ATOM 1489 O GLN A 101 26.818 -10.875 -0.526 1.00 0.00 O ATOM 1490 CB GLN A 101 28.437 -9.121 2.317 1.00 0.00 C ATOM 1491 CG GLN A 101 29.920 -9.497 2.205 1.00 0.00 C ATOM 1492 CD GLN A 101 30.687 -9.118 3.466 1.00 0.00 C ATOM 1493 OE1 GLN A 101 30.097 -8.915 4.525 1.00 0.00 O ATOM 1494 NE2 GLN A 101 32.006 -9.022 3.360 1.00 0.00 N ATOM 0 H GLN A 101 25.693 -9.031 1.467 1.00 0.00 H new ATOM 0 HA GLN A 101 28.375 -8.789 0.210 1.00 0.00 H new ATOM 0 HB2 GLN A 101 28.348 -8.105 2.702 1.00 0.00 H new ATOM 0 HB3 GLN A 101 27.949 -9.778 3.037 1.00 0.00 H new ATOM 0 HG2 GLN A 101 30.013 -10.569 2.029 1.00 0.00 H new ATOM 0 HG3 GLN A 101 30.360 -8.994 1.344 1.00 0.00 H new ATOM 0 HE21 GLN A 101 32.460 -9.198 2.464 1.00 0.00 H new ATOM 0 HE22 GLN A 101 32.566 -8.772 4.175 1.00 0.00 H new ATOM 1503 N LYS A 102 27.912 -11.635 1.295 1.00 0.00 N ATOM 1504 CA LYS A 102 27.631 -13.053 1.088 1.00 0.00 C ATOM 1505 C LYS A 102 26.115 -13.290 1.034 1.00 0.00 C ATOM 1506 O LYS A 102 25.349 -12.407 1.418 1.00 0.00 O ATOM 1507 CB LYS A 102 28.326 -13.872 2.183 1.00 0.00 C ATOM 1508 CG LYS A 102 28.193 -13.276 3.592 1.00 0.00 C ATOM 1509 CD LYS A 102 26.747 -13.263 4.096 1.00 0.00 C ATOM 1510 CE LYS A 102 26.688 -12.832 5.560 1.00 0.00 C ATOM 1511 NZ LYS A 102 27.415 -13.774 6.436 1.00 0.00 N ATOM 0 H LYS A 102 28.507 -11.456 2.104 1.00 0.00 H new ATOM 0 HA LYS A 102 28.031 -13.383 0.129 1.00 0.00 H new ATOM 0 HB2 LYS A 102 27.911 -14.880 2.186 1.00 0.00 H new ATOM 0 HB3 LYS A 102 29.384 -13.963 1.937 1.00 0.00 H new ATOM 0 HG2 LYS A 102 28.809 -13.850 4.284 1.00 0.00 H new ATOM 0 HG3 LYS A 102 28.581 -12.257 3.589 1.00 0.00 H new ATOM 0 HD2 LYS A 102 26.151 -12.583 3.487 1.00 0.00 H new ATOM 0 HD3 LYS A 102 26.310 -14.255 3.986 1.00 0.00 H new ATOM 0 HE2 LYS A 102 27.116 -11.835 5.663 1.00 0.00 H new ATOM 0 HE3 LYS A 102 25.648 -12.767 5.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 26.813 -14.031 7.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 27.657 -14.631 5.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 28.287 -13.324 6.782 1.00 0.00 H new ATOM 1525 N PRO A 103 25.669 -14.465 0.564 1.00 0.00 N ATOM 1526 CA PRO A 103 24.257 -14.778 0.438 1.00 0.00 C ATOM 1527 C PRO A 103 23.480 -14.377 1.690 1.00 0.00 C ATOM 1528 O PRO A 103 23.949 -14.573 2.813 1.00 0.00 O ATOM 1529 CB PRO A 103 24.190 -16.277 0.153 1.00 0.00 C ATOM 1530 CG PRO A 103 25.523 -16.559 -0.544 1.00 0.00 C ATOM 1531 CD PRO A 103 26.490 -15.567 0.104 1.00 0.00 C ATOM 0 HA PRO A 103 23.787 -14.215 -0.368 1.00 0.00 H new ATOM 0 HB2 PRO A 103 24.084 -16.857 1.070 1.00 0.00 H new ATOM 0 HB3 PRO A 103 23.341 -16.529 -0.483 1.00 0.00 H new ATOM 0 HG2 PRO A 103 25.844 -17.589 -0.391 1.00 0.00 H new ATOM 0 HG3 PRO A 103 25.452 -16.404 -1.621 1.00 0.00 H new ATOM 0 HD2 PRO A 103 27.027 -16.028 0.933 1.00 0.00 H new ATOM 0 HD3 PRO A 103 27.239 -15.226 -0.611 1.00 0.00 H new ATOM 1539 N PHE A 104 22.292 -13.810 1.485 1.00 0.00 N ATOM 1540 CA PHE A 104 21.512 -13.164 2.530 1.00 0.00 C ATOM 1541 C PHE A 104 20.075 -13.654 2.638 1.00 0.00 C ATOM 1542 O PHE A 104 19.487 -14.096 1.652 1.00 0.00 O ATOM 1543 CB PHE A 104 21.614 -11.643 2.391 1.00 0.00 C ATOM 1544 CG PHE A 104 21.808 -11.193 0.957 1.00 0.00 C ATOM 1545 CD1 PHE A 104 23.038 -10.657 0.557 1.00 0.00 C ATOM 1546 CD2 PHE A 104 20.770 -11.334 0.025 1.00 0.00 C ATOM 1547 CE1 PHE A 104 23.241 -10.291 -0.784 1.00 0.00 C ATOM 1548 CE2 PHE A 104 20.972 -10.960 -1.313 1.00 0.00 C ATOM 1549 CZ PHE A 104 22.209 -10.446 -1.718 1.00 0.00 C ATOM 0 H PHE A 104 21.840 -13.788 0.571 1.00 0.00 H new ATOM 0 HA PHE A 104 21.953 -13.458 3.483 1.00 0.00 H new ATOM 0 HB2 PHE A 104 20.709 -11.185 2.791 1.00 0.00 H new ATOM 0 HB3 PHE A 104 22.447 -11.283 2.995 1.00 0.00 H new ATOM 0 HD1 PHE A 104 23.830 -10.525 1.279 1.00 0.00 H new ATOM 0 HD2 PHE A 104 19.815 -11.730 0.336 1.00 0.00 H new ATOM 0 HE1 PHE A 104 24.194 -9.890 -1.095 1.00 0.00 H new ATOM 0 HE2 PHE A 104 20.172 -11.069 -2.030 1.00 0.00 H new ATOM 0 HZ PHE A 104 22.368 -10.169 -2.750 1.00 0.00 H new ATOM 1559 N THR A 105 19.513 -13.569 3.846 1.00 0.00 N ATOM 1560 CA THR A 105 18.130 -13.950 4.103 1.00 0.00 C ATOM 1561 C THR A 105 17.132 -12.901 3.630 1.00 0.00 C ATOM 1562 O THR A 105 17.519 -11.797 3.241 1.00 0.00 O ATOM 1563 CB THR A 105 17.923 -14.317 5.577 1.00 0.00 C ATOM 1564 OG1 THR A 105 17.628 -13.153 6.313 1.00 0.00 O ATOM 1565 CG2 THR A 105 19.164 -14.986 6.169 1.00 0.00 C ATOM 0 H THR A 105 20.008 -13.233 4.672 1.00 0.00 H new ATOM 0 HA THR A 105 17.931 -14.841 3.508 1.00 0.00 H new ATOM 0 HB THR A 105 17.095 -15.023 5.635 1.00 0.00 H new ATOM 0 HG1 THR A 105 17.494 -13.387 7.255 1.00 0.00 H new ATOM 0 HG21 THR A 105 18.981 -15.232 7.215 1.00 0.00 H new ATOM 0 HG22 THR A 105 19.385 -15.898 5.615 1.00 0.00 H new ATOM 0 HG23 THR A 105 20.012 -14.305 6.100 1.00 0.00 H new ATOM 1573 N MET A 106 15.844 -13.243 3.671 1.00 0.00 N ATOM 1574 CA MET A 106 14.780 -12.323 3.302 1.00 0.00 C ATOM 1575 C MET A 106 14.828 -11.108 4.238 1.00 0.00 C ATOM 1576 O MET A 106 14.492 -9.993 3.843 1.00 0.00 O ATOM 1577 CB MET A 106 13.447 -13.075 3.426 1.00 0.00 C ATOM 1578 CG MET A 106 12.364 -12.559 2.470 1.00 0.00 C ATOM 1579 SD MET A 106 11.900 -10.821 2.659 1.00 0.00 S ATOM 1580 CE MET A 106 12.892 -10.115 1.318 1.00 0.00 C ATOM 0 H MET A 106 15.515 -14.164 3.961 1.00 0.00 H new ATOM 0 HA MET A 106 14.894 -11.965 2.279 1.00 0.00 H new ATOM 0 HB2 MET A 106 13.617 -14.134 3.233 1.00 0.00 H new ATOM 0 HB3 MET A 106 13.086 -12.992 4.451 1.00 0.00 H new ATOM 0 HG2 MET A 106 12.707 -12.713 1.447 1.00 0.00 H new ATOM 0 HG3 MET A 106 11.470 -13.169 2.602 1.00 0.00 H new ATOM 0 HE1 MET A 106 13.129 -9.076 1.549 1.00 0.00 H new ATOM 0 HE2 MET A 106 13.816 -10.683 1.211 1.00 0.00 H new ATOM 0 HE3 MET A 106 12.328 -10.160 0.386 1.00 0.00 H new ATOM 1590 N ASP A 107 15.253 -11.323 5.485 1.00 0.00 N ATOM 1591 CA ASP A 107 15.395 -10.247 6.456 1.00 0.00 C ATOM 1592 C ASP A 107 16.713 -9.492 6.288 1.00 0.00 C ATOM 1593 O ASP A 107 16.835 -8.353 6.736 1.00 0.00 O ATOM 1594 CB ASP A 107 15.262 -10.802 7.875 1.00 0.00 C ATOM 1595 CG ASP A 107 13.850 -11.307 8.181 1.00 0.00 C ATOM 1596 OD1 ASP A 107 12.961 -11.133 7.316 1.00 0.00 O ATOM 1597 OD2 ASP A 107 13.678 -11.868 9.289 1.00 0.00 O ATOM 0 H ASP A 107 15.506 -12.244 5.844 1.00 0.00 H new ATOM 0 HA ASP A 107 14.594 -9.529 6.278 1.00 0.00 H new ATOM 0 HB2 ASP A 107 15.972 -11.618 8.010 1.00 0.00 H new ATOM 0 HB3 ASP A 107 15.529 -10.025 8.591 1.00 0.00 H new ATOM 1602 N GLY A 108 17.704 -10.122 5.644 1.00 0.00 N ATOM 1603 CA GLY A 108 19.016 -9.517 5.459 1.00 0.00 C ATOM 1604 C GLY A 108 18.973 -8.399 4.418 1.00 0.00 C ATOM 1605 O GLY A 108 19.651 -7.383 4.572 1.00 0.00 O ATOM 0 H GLY A 108 17.614 -11.055 5.243 1.00 0.00 H new ATOM 0 HA2 GLY A 108 19.372 -9.118 6.409 1.00 0.00 H new ATOM 0 HA3 GLY A 108 19.729 -10.280 5.147 1.00 0.00 H new ATOM 1609 N VAL A 109 18.177 -8.577 3.361 1.00 0.00 N ATOM 1610 CA VAL A 109 18.014 -7.552 2.343 1.00 0.00 C ATOM 1611 C VAL A 109 17.064 -6.461 2.826 1.00 0.00 C ATOM 1612 O VAL A 109 17.175 -5.314 2.396 1.00 0.00 O ATOM 1613 CB VAL A 109 17.515 -8.181 1.038 1.00 0.00 C ATOM 1614 CG1 VAL A 109 18.461 -9.294 0.598 1.00 0.00 C ATOM 1615 CG2 VAL A 109 16.112 -8.759 1.216 1.00 0.00 C ATOM 0 H VAL A 109 17.637 -9.426 3.193 1.00 0.00 H new ATOM 0 HA VAL A 109 18.982 -7.089 2.152 1.00 0.00 H new ATOM 0 HB VAL A 109 17.484 -7.401 0.277 1.00 0.00 H new ATOM 0 HG11 VAL A 109 18.098 -9.735 -0.330 1.00 0.00 H new ATOM 0 HG12 VAL A 109 19.458 -8.883 0.439 1.00 0.00 H new ATOM 0 HG13 VAL A 109 18.505 -10.061 1.371 1.00 0.00 H new ATOM 0 HG21 VAL A 109 15.778 -9.200 0.277 1.00 0.00 H new ATOM 0 HG22 VAL A 109 16.130 -9.525 1.991 1.00 0.00 H new ATOM 0 HG23 VAL A 109 15.425 -7.964 1.508 1.00 0.00 H new ATOM 1625 N ALA A 110 16.134 -6.807 3.720 1.00 0.00 N ATOM 1626 CA ALA A 110 15.235 -5.827 4.299 1.00 0.00 C ATOM 1627 C ALA A 110 15.991 -4.957 5.304 1.00 0.00 C ATOM 1628 O ALA A 110 15.607 -3.813 5.550 1.00 0.00 O ATOM 1629 CB ALA A 110 14.074 -6.552 4.977 1.00 0.00 C ATOM 0 H ALA A 110 15.990 -7.760 4.053 1.00 0.00 H new ATOM 0 HA ALA A 110 14.840 -5.179 3.517 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.394 -5.821 5.415 1.00 0.00 H new ATOM 0 HB2 ALA A 110 13.538 -7.150 4.240 1.00 0.00 H new ATOM 0 HB3 ALA A 110 14.460 -7.203 5.761 1.00 0.00 H new ATOM 1635 N LYS A 111 17.067 -5.496 5.883 1.00 0.00 N ATOM 1636 CA LYS A 111 17.909 -4.767 6.813 1.00 0.00 C ATOM 1637 C LYS A 111 18.687 -3.678 6.079 1.00 0.00 C ATOM 1638 O LYS A 111 18.869 -2.581 6.603 1.00 0.00 O ATOM 1639 CB LYS A 111 18.864 -5.762 7.473 1.00 0.00 C ATOM 1640 CG LYS A 111 19.704 -5.096 8.560 1.00 0.00 C ATOM 1641 CD LYS A 111 20.651 -6.142 9.143 1.00 0.00 C ATOM 1642 CE LYS A 111 21.362 -5.569 10.370 1.00 0.00 C ATOM 1643 NZ LYS A 111 22.302 -6.548 10.949 1.00 0.00 N ATOM 0 H LYS A 111 17.373 -6.454 5.714 1.00 0.00 H new ATOM 0 HA LYS A 111 17.298 -4.282 7.574 1.00 0.00 H new ATOM 0 HB2 LYS A 111 18.293 -6.584 7.905 1.00 0.00 H new ATOM 0 HB3 LYS A 111 19.521 -6.193 6.717 1.00 0.00 H new ATOM 0 HG2 LYS A 111 20.269 -4.261 8.145 1.00 0.00 H new ATOM 0 HG3 LYS A 111 19.061 -4.689 9.340 1.00 0.00 H new ATOM 0 HD2 LYS A 111 20.094 -7.037 9.419 1.00 0.00 H new ATOM 0 HD3 LYS A 111 21.383 -6.441 8.393 1.00 0.00 H new ATOM 0 HE2 LYS A 111 21.902 -4.664 10.091 1.00 0.00 H new ATOM 0 HE3 LYS A 111 20.625 -5.282 11.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 22.769 -6.131 11.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 21.781 -7.401 11.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 23.019 -6.802 10.240 1.00 0.00 H new ATOM 1657 N ALA A 112 19.142 -3.987 4.863 1.00 0.00 N ATOM 1658 CA ALA A 112 19.901 -3.045 4.060 1.00 0.00 C ATOM 1659 C ALA A 112 19.000 -1.934 3.530 1.00 0.00 C ATOM 1660 O ALA A 112 19.381 -0.766 3.543 1.00 0.00 O ATOM 1661 CB ALA A 112 20.561 -3.796 2.903 1.00 0.00 C ATOM 0 H ALA A 112 18.993 -4.892 4.416 1.00 0.00 H new ATOM 0 HA ALA A 112 20.668 -2.582 4.680 1.00 0.00 H new ATOM 0 HB1 ALA A 112 21.133 -3.096 2.294 1.00 0.00 H new ATOM 0 HB2 ALA A 112 21.228 -4.562 3.299 1.00 0.00 H new ATOM 0 HB3 ALA A 112 19.793 -4.266 2.289 1.00 0.00 H new ATOM 1667 N LEU A 113 17.801 -2.289 3.064 1.00 0.00 N ATOM 1668 CA LEU A 113 16.870 -1.318 2.504 1.00 0.00 C ATOM 1669 C LEU A 113 16.301 -0.422 3.608 1.00 0.00 C ATOM 1670 O LEU A 113 15.911 0.711 3.332 1.00 0.00 O ATOM 1671 CB LEU A 113 15.741 -2.064 1.779 1.00 0.00 C ATOM 1672 CG LEU A 113 15.953 -2.143 0.264 1.00 0.00 C ATOM 1673 CD1 LEU A 113 15.799 -0.753 -0.349 1.00 0.00 C ATOM 1674 CD2 LEU A 113 17.330 -2.696 -0.102 1.00 0.00 C ATOM 0 H LEU A 113 17.454 -3.248 3.065 1.00 0.00 H new ATOM 0 HA LEU A 113 17.396 -0.681 1.793 1.00 0.00 H new ATOM 0 HB2 LEU A 113 15.662 -3.073 2.183 1.00 0.00 H new ATOM 0 HB3 LEU A 113 14.794 -1.565 1.982 1.00 0.00 H new ATOM 0 HG LEU A 113 15.201 -2.825 -0.132 1.00 0.00 H new ATOM 0 HD11 LEU A 113 15.950 -0.812 -1.427 1.00 0.00 H new ATOM 0 HD12 LEU A 113 14.798 -0.373 -0.143 1.00 0.00 H new ATOM 0 HD13 LEU A 113 16.539 -0.080 0.085 1.00 0.00 H new ATOM 0 HD21 LEU A 113 17.431 -2.732 -1.187 1.00 0.00 H new ATOM 0 HD22 LEU A 113 18.104 -2.050 0.313 1.00 0.00 H new ATOM 0 HD23 LEU A 113 17.439 -3.701 0.306 1.00 0.00 H new ATOM 1686 N ALA A 114 16.252 -0.913 4.851 1.00 0.00 N ATOM 1687 CA ALA A 114 15.773 -0.110 5.968 1.00 0.00 C ATOM 1688 C ALA A 114 16.826 0.916 6.375 1.00 0.00 C ATOM 1689 O ALA A 114 16.486 2.010 6.823 1.00 0.00 O ATOM 1690 CB ALA A 114 15.450 -1.028 7.145 1.00 0.00 C ATOM 0 H ALA A 114 16.538 -1.859 5.103 1.00 0.00 H new ATOM 0 HA ALA A 114 14.873 0.425 5.666 1.00 0.00 H new ATOM 0 HB1 ALA A 114 15.091 -0.432 7.984 1.00 0.00 H new ATOM 0 HB2 ALA A 114 14.679 -1.740 6.850 1.00 0.00 H new ATOM 0 HB3 ALA A 114 16.349 -1.568 7.442 1.00 0.00 H new ATOM 1696 N ALA A 115 18.105 0.564 6.219 1.00 0.00 N ATOM 1697 CA ALA A 115 19.214 1.451 6.537 1.00 0.00 C ATOM 1698 C ALA A 115 19.543 2.362 5.349 1.00 0.00 C ATOM 1699 O ALA A 115 20.355 3.273 5.474 1.00 0.00 O ATOM 1700 CB ALA A 115 20.431 0.625 6.945 1.00 0.00 C ATOM 0 H ALA A 115 18.396 -0.348 5.867 1.00 0.00 H new ATOM 0 HA ALA A 115 18.927 2.090 7.372 1.00 0.00 H new ATOM 0 HB1 ALA A 115 21.260 1.292 7.183 1.00 0.00 H new ATOM 0 HB2 ALA A 115 20.186 0.024 7.821 1.00 0.00 H new ATOM 0 HB3 ALA A 115 20.717 -0.031 6.123 1.00 0.00 H new ATOM 1706 N LEU A 116 18.922 2.117 4.193 1.00 0.00 N ATOM 1707 CA LEU A 116 19.186 2.894 2.996 1.00 0.00 C ATOM 1708 C LEU A 116 18.569 4.293 3.074 1.00 0.00 C ATOM 1709 O LEU A 116 19.049 5.218 2.417 1.00 0.00 O ATOM 1710 CB LEU A 116 18.620 2.122 1.802 1.00 0.00 C ATOM 1711 CG LEU A 116 18.977 2.775 0.475 1.00 0.00 C ATOM 1712 CD1 LEU A 116 20.489 2.873 0.303 1.00 0.00 C ATOM 1713 CD2 LEU A 116 18.423 1.910 -0.651 1.00 0.00 C ATOM 0 H LEU A 116 18.229 1.379 4.068 1.00 0.00 H new ATOM 0 HA LEU A 116 20.261 3.036 2.888 1.00 0.00 H new ATOM 0 HB2 LEU A 116 19.002 1.101 1.817 1.00 0.00 H new ATOM 0 HB3 LEU A 116 17.536 2.058 1.894 1.00 0.00 H new ATOM 0 HG LEU A 116 18.553 3.779 0.453 1.00 0.00 H new ATOM 0 HD11 LEU A 116 20.717 3.343 -0.654 1.00 0.00 H new ATOM 0 HD12 LEU A 116 20.909 3.472 1.111 1.00 0.00 H new ATOM 0 HD13 LEU A 116 20.924 1.874 0.328 1.00 0.00 H new ATOM 0 HD21 LEU A 116 18.669 2.362 -1.612 1.00 0.00 H new ATOM 0 HD22 LEU A 116 18.863 0.914 -0.595 1.00 0.00 H new ATOM 0 HD23 LEU A 116 17.340 1.834 -0.552 1.00 0.00 H new ATOM 1725 N LEU A 117 17.508 4.448 3.870 1.00 0.00 N ATOM 1726 CA LEU A 117 16.777 5.705 3.962 1.00 0.00 C ATOM 1727 C LEU A 117 17.380 6.627 5.029 1.00 0.00 C ATOM 1728 O LEU A 117 16.933 7.764 5.176 1.00 0.00 O ATOM 1729 CB LEU A 117 15.305 5.417 4.280 1.00 0.00 C ATOM 1730 CG LEU A 117 14.491 5.133 3.007 1.00 0.00 C ATOM 1731 CD1 LEU A 117 14.987 3.881 2.292 1.00 0.00 C ATOM 1732 CD2 LEU A 117 13.026 4.933 3.395 1.00 0.00 C ATOM 0 H LEU A 117 17.136 3.707 4.464 1.00 0.00 H new ATOM 0 HA LEU A 117 16.851 6.218 3.003 1.00 0.00 H new ATOM 0 HB2 LEU A 117 15.239 4.561 4.952 1.00 0.00 H new ATOM 0 HB3 LEU A 117 14.873 6.269 4.805 1.00 0.00 H new ATOM 0 HG LEU A 117 14.605 5.980 2.330 1.00 0.00 H new ATOM 0 HD11 LEU A 117 14.388 3.712 1.397 1.00 0.00 H new ATOM 0 HD12 LEU A 117 16.032 4.013 2.010 1.00 0.00 H new ATOM 0 HD13 LEU A 117 14.896 3.022 2.957 1.00 0.00 H new ATOM 0 HD21 LEU A 117 12.437 4.731 2.500 1.00 0.00 H new ATOM 0 HD22 LEU A 117 12.943 4.091 4.082 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.652 5.835 3.880 1.00 0.00 H new ATOM 1744 N VAL A 118 18.387 6.156 5.772 1.00 0.00 N ATOM 1745 CA VAL A 118 19.004 6.953 6.833 1.00 0.00 C ATOM 1746 C VAL A 118 19.871 8.083 6.282 1.00 0.00 C ATOM 1747 O VAL A 118 19.995 9.106 6.990 1.00 0.00 O ATOM 1748 CB VAL A 118 19.769 6.070 7.826 1.00 0.00 C ATOM 1749 CG1 VAL A 118 19.009 4.773 8.105 1.00 0.00 C ATOM 1750 CG2 VAL A 118 21.165 5.755 7.292 1.00 0.00 C ATOM 0 H VAL A 118 18.791 5.226 5.657 1.00 0.00 H new ATOM 0 HA VAL A 118 18.194 7.431 7.383 1.00 0.00 H new ATOM 0 HB VAL A 118 19.863 6.620 8.762 1.00 0.00 H new ATOM 0 HG11 VAL A 118 19.574 4.165 8.812 1.00 0.00 H new ATOM 0 HG12 VAL A 118 18.032 5.007 8.527 1.00 0.00 H new ATOM 0 HG13 VAL A 118 18.879 4.220 7.175 1.00 0.00 H new ATOM 0 HG21 VAL A 118 21.695 5.127 8.008 1.00 0.00 H new ATOM 0 HG22 VAL A 118 21.081 5.229 6.341 1.00 0.00 H new ATOM 0 HG23 VAL A 118 21.716 6.684 7.145 1.00 0.00 H new TER 1760 VAL A 118