USER MOD reduce.3.24.130724 H: found=0, std=0, add=852, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 850 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 90 TYR OH : rot 180:sc= 0.246 USER MOD Set 1.2: A 94 GLN : amide:sc= 0.289 K(o=0.54,f=-3.1!) USER MOD Single : A 1 MET CE :methyl 154:sc= -0.239 (180deg=-1) USER MOD Single : A 1 MET N :NH3+ -178:sc= 0 (180deg=-0.0049) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot -81:sc= -2.24 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0424 USER MOD Single : A 9 CYS SG : rot 29:sc= 0.247! USER MOD Single : A 10 GLN : amide:sc= -0.0698 K(o=-0.07,f=-0.73) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= -1.66! C(o=-1.7!,f=-14!) USER MOD Single : A 24 LYS NZ :NH3+ -146:sc= 0.38 (180deg=-0.119) USER MOD Single : A 25 THR OG1 : rot -22:sc= 0.108 USER MOD Single : A 28 TYR OH : rot 175:sc= 0.0442 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -80:sc= 0.0298 USER MOD Single : A 39 MET CE :methyl 159:sc= -0.221 (180deg=-0.85) USER MOD Single : A 45 SER OG : rot 48:sc= 0.622 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot -170:sc= 0 USER MOD Single : A 50 SER OG : rot -58:sc= 1.29 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 43:sc= 0.0904 USER MOD Single : A 62 MET CE :methyl -174:sc= 0 (180deg=-0.0385) USER MOD Single : A 68 GLN : amide:sc= 1.18 K(o=1.2,f=-0.23) USER MOD Single : A 70 GLN : amide:sc= -0.35 K(o=-0.35,f=-2.3!) USER MOD Single : A 75 GLN : amide:sc= -0.463 K(o=-0.46,f=-1.7) USER MOD Single : A 76 ASN : amide:sc= -0.165 X(o=-0.16,f=-0.41) USER MOD Single : A 78 ASN : amide:sc= -2.48 K(o=-2.5,f=-0.22) USER MOD Single : A 82 ASN : amide:sc= -4.58! C(o=-4.6!,f=-4.1!) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0.331 K(o=0.33,f=-2.4!) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.522 2.178 -1.522 1.00 0.00 N ATOM 2 CA MET A 1 2.284 1.789 -2.240 1.00 0.00 C ATOM 3 C MET A 1 1.456 3.018 -2.598 1.00 0.00 C ATOM 4 O MET A 1 0.996 3.156 -3.730 1.00 0.00 O ATOM 5 CB MET A 1 1.450 0.840 -1.374 1.00 0.00 C ATOM 6 CG MET A 1 0.158 0.383 -2.034 1.00 0.00 C ATOM 7 SD MET A 1 -0.904 -0.553 -0.915 1.00 0.00 S ATOM 8 CE MET A 1 -1.245 0.688 0.329 1.00 0.00 C ATOM 0 H1 MET A 1 4.087 1.329 -1.318 1.00 0.00 H new ATOM 0 H2 MET A 1 4.077 2.829 -2.114 1.00 0.00 H new ATOM 0 H3 MET A 1 3.272 2.650 -0.630 1.00 0.00 H new ATOM 0 HA MET A 1 2.570 1.281 -3.161 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.051 -0.035 -1.128 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.211 1.337 -0.434 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.386 1.254 -2.400 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.396 -0.232 -2.902 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.197 0.467 0.812 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.450 0.684 1.074 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.297 1.670 -0.141 1.00 0.00 H new ATOM 18 N SER A 2 1.267 3.904 -1.629 1.00 0.00 N ATOM 19 CA SER A 2 0.496 5.122 -1.842 1.00 0.00 C ATOM 20 C SER A 2 1.256 6.090 -2.750 1.00 0.00 C ATOM 21 O SER A 2 2.481 6.197 -2.665 1.00 0.00 O ATOM 22 CB SER A 2 0.208 5.780 -0.493 1.00 0.00 C ATOM 23 OG SER A 2 -0.239 4.816 0.450 1.00 0.00 O ATOM 0 H SER A 2 1.638 3.801 -0.685 1.00 0.00 H new ATOM 0 HA SER A 2 -0.444 4.866 -2.331 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.109 6.269 -0.122 1.00 0.00 H new ATOM 0 HB3 SER A 2 -0.549 6.555 -0.615 1.00 0.00 H new ATOM 0 HG SER A 2 -0.417 5.255 1.308 1.00 0.00 H new ATOM 29 N ILE A 3 0.532 6.781 -3.624 1.00 0.00 N ATOM 30 CA ILE A 3 1.149 7.747 -4.525 1.00 0.00 C ATOM 31 C ILE A 3 1.611 8.970 -3.736 1.00 0.00 C ATOM 32 O ILE A 3 0.938 9.405 -2.798 1.00 0.00 O ATOM 33 CB ILE A 3 0.180 8.185 -5.649 1.00 0.00 C ATOM 34 CG1 ILE A 3 -0.390 6.962 -6.381 1.00 0.00 C ATOM 35 CG2 ILE A 3 0.884 9.110 -6.633 1.00 0.00 C ATOM 36 CD1 ILE A 3 0.662 6.089 -7.033 1.00 0.00 C ATOM 0 H ILE A 3 -0.479 6.691 -3.727 1.00 0.00 H new ATOM 0 HA ILE A 3 2.006 7.263 -4.994 1.00 0.00 H new ATOM 0 HB ILE A 3 -0.646 8.729 -5.192 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -0.959 6.360 -5.673 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.090 7.302 -7.145 1.00 0.00 H new ATOM 0 HG21 ILE A 3 0.186 9.407 -7.416 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.240 9.997 -6.108 1.00 0.00 H new ATOM 0 HG23 ILE A 3 1.731 8.589 -7.080 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.180 5.247 -7.529 1.00 0.00 H new ATOM 0 HD12 ILE A 3 1.216 6.674 -7.767 1.00 0.00 H new ATOM 0 HD13 ILE A 3 1.349 5.717 -6.272 1.00 0.00 H new ATOM 48 N THR A 4 2.756 9.513 -4.108 1.00 0.00 N ATOM 49 CA THR A 4 3.366 10.597 -3.361 1.00 0.00 C ATOM 50 C THR A 4 3.069 11.965 -3.976 1.00 0.00 C ATOM 51 O THR A 4 2.467 12.070 -5.047 1.00 0.00 O ATOM 52 CB THR A 4 4.890 10.399 -3.291 1.00 0.00 C ATOM 53 OG1 THR A 4 5.412 10.220 -4.615 1.00 0.00 O ATOM 54 CG2 THR A 4 5.242 9.192 -2.433 1.00 0.00 C ATOM 0 H THR A 4 3.285 9.218 -4.929 1.00 0.00 H new ATOM 0 HA THR A 4 2.934 10.575 -2.360 1.00 0.00 H new ATOM 0 HB THR A 4 5.334 11.285 -2.837 1.00 0.00 H new ATOM 0 HG1 THR A 4 5.279 9.291 -4.896 1.00 0.00 H new ATOM 0 HG21 THR A 4 6.325 9.073 -2.399 1.00 0.00 H new ATOM 0 HG22 THR A 4 4.861 9.341 -1.422 1.00 0.00 H new ATOM 0 HG23 THR A 4 4.792 8.297 -2.862 1.00 0.00 H new ATOM 62 N SER A 5 3.503 12.999 -3.271 1.00 0.00 N ATOM 63 CA SER A 5 3.427 14.375 -3.736 1.00 0.00 C ATOM 64 C SER A 5 4.582 14.666 -4.696 1.00 0.00 C ATOM 65 O SER A 5 5.218 13.736 -5.201 1.00 0.00 O ATOM 66 CB SER A 5 3.462 15.325 -2.541 1.00 0.00 C ATOM 67 OG SER A 5 2.416 15.033 -1.629 1.00 0.00 O ATOM 0 H SER A 5 3.924 12.904 -2.347 1.00 0.00 H new ATOM 0 HA SER A 5 2.490 14.526 -4.272 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.424 15.243 -2.035 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.371 16.354 -2.887 1.00 0.00 H new ATOM 0 HG SER A 5 2.460 15.653 -0.871 1.00 0.00 H new ATOM 73 N THR A 6 4.830 15.953 -4.955 1.00 0.00 N ATOM 74 CA THR A 6 5.873 16.409 -5.883 1.00 0.00 C ATOM 75 C THR A 6 7.227 15.711 -5.641 1.00 0.00 C ATOM 76 O THR A 6 8.087 15.691 -6.525 1.00 0.00 O ATOM 77 CB THR A 6 6.058 17.936 -5.761 1.00 0.00 C ATOM 78 OG1 THR A 6 4.774 18.574 -5.702 1.00 0.00 O ATOM 79 CG2 THR A 6 6.840 18.495 -6.941 1.00 0.00 C ATOM 0 H THR A 6 4.309 16.716 -4.523 1.00 0.00 H new ATOM 0 HA THR A 6 5.540 16.147 -6.887 1.00 0.00 H new ATOM 0 HB THR A 6 6.620 18.135 -4.849 1.00 0.00 H new ATOM 0 HG1 THR A 6 4.894 19.543 -5.623 1.00 0.00 H new ATOM 0 HG21 THR A 6 6.953 19.573 -6.825 1.00 0.00 H new ATOM 0 HG22 THR A 6 7.825 18.029 -6.979 1.00 0.00 H new ATOM 0 HG23 THR A 6 6.303 18.284 -7.866 1.00 0.00 H new ATOM 87 N ASP A 7 7.407 15.146 -4.443 1.00 0.00 N ATOM 88 CA ASP A 7 8.602 14.363 -4.107 1.00 0.00 C ATOM 89 C ASP A 7 8.882 13.306 -5.177 1.00 0.00 C ATOM 90 O ASP A 7 10.033 12.953 -5.425 1.00 0.00 O ATOM 91 CB ASP A 7 8.410 13.639 -2.768 1.00 0.00 C ATOM 92 CG ASP A 7 8.120 14.567 -1.608 1.00 0.00 C ATOM 93 OD1 ASP A 7 7.003 15.125 -1.550 1.00 0.00 O ATOM 94 OD2 ASP A 7 8.993 14.719 -0.730 1.00 0.00 O ATOM 0 H ASP A 7 6.732 15.218 -3.681 1.00 0.00 H new ATOM 0 HA ASP A 7 9.439 15.059 -4.045 1.00 0.00 H new ATOM 0 HB2 ASP A 7 7.591 12.927 -2.865 1.00 0.00 H new ATOM 0 HB3 ASP A 7 9.308 13.063 -2.545 1.00 0.00 H new ATOM 99 N ILE A 8 7.817 12.819 -5.813 1.00 0.00 N ATOM 100 CA ILE A 8 7.925 11.809 -6.864 1.00 0.00 C ATOM 101 C ILE A 8 8.810 12.302 -8.014 1.00 0.00 C ATOM 102 O ILE A 8 9.557 11.529 -8.612 1.00 0.00 O ATOM 103 CB ILE A 8 6.523 11.410 -7.399 1.00 0.00 C ATOM 104 CG1 ILE A 8 6.621 10.261 -8.405 1.00 0.00 C ATOM 105 CG2 ILE A 8 5.817 12.603 -8.034 1.00 0.00 C ATOM 106 CD1 ILE A 8 5.274 9.747 -8.860 1.00 0.00 C ATOM 0 H ILE A 8 6.860 13.112 -5.615 1.00 0.00 H new ATOM 0 HA ILE A 8 8.391 10.927 -6.425 1.00 0.00 H new ATOM 0 HB ILE A 8 5.934 11.073 -6.546 1.00 0.00 H new ATOM 0 HG12 ILE A 8 7.187 10.596 -9.274 1.00 0.00 H new ATOM 0 HG13 ILE A 8 7.182 9.441 -7.956 1.00 0.00 H new ATOM 0 HG21 ILE A 8 4.838 12.294 -8.400 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.695 13.391 -7.291 1.00 0.00 H new ATOM 0 HG23 ILE A 8 6.413 12.978 -8.866 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.416 8.934 -9.572 1.00 0.00 H new ATOM 0 HD12 ILE A 8 4.714 9.382 -7.999 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.719 10.554 -9.338 1.00 0.00 H new ATOM 118 N CYS A 9 8.743 13.598 -8.290 1.00 0.00 N ATOM 119 CA CYS A 9 9.529 14.204 -9.354 1.00 0.00 C ATOM 120 C CYS A 9 10.992 14.323 -8.940 1.00 0.00 C ATOM 121 O CYS A 9 11.897 14.088 -9.740 1.00 0.00 O ATOM 122 CB CYS A 9 8.962 15.584 -9.698 1.00 0.00 C ATOM 123 SG CYS A 9 9.917 16.505 -10.927 1.00 0.00 S ATOM 0 H CYS A 9 8.146 14.254 -7.786 1.00 0.00 H new ATOM 0 HA CYS A 9 9.474 13.566 -10.236 1.00 0.00 H new ATOM 0 HB2 CYS A 9 7.943 15.462 -10.065 1.00 0.00 H new ATOM 0 HB3 CYS A 9 8.903 16.176 -8.785 1.00 0.00 H new ATOM 0 HG CYS A 9 10.525 15.671 -11.718 1.00 0.00 H new ATOM 129 N GLN A 10 11.217 14.673 -7.680 1.00 0.00 N ATOM 130 CA GLN A 10 12.568 14.892 -7.178 1.00 0.00 C ATOM 131 C GLN A 10 13.301 13.568 -6.989 1.00 0.00 C ATOM 132 O GLN A 10 14.499 13.469 -7.254 1.00 0.00 O ATOM 133 CB GLN A 10 12.529 15.659 -5.854 1.00 0.00 C ATOM 134 CG GLN A 10 11.749 16.965 -5.916 1.00 0.00 C ATOM 135 CD GLN A 10 12.246 17.914 -6.991 1.00 0.00 C ATOM 136 OE1 GLN A 10 13.423 17.908 -7.358 1.00 0.00 O ATOM 137 NE2 GLN A 10 11.348 18.745 -7.498 1.00 0.00 N ATOM 0 H GLN A 10 10.482 14.811 -6.987 1.00 0.00 H new ATOM 0 HA GLN A 10 13.108 15.485 -7.916 1.00 0.00 H new ATOM 0 HB2 GLN A 10 12.087 15.020 -5.089 1.00 0.00 H new ATOM 0 HB3 GLN A 10 13.551 15.873 -5.540 1.00 0.00 H new ATOM 0 HG2 GLN A 10 10.697 16.743 -6.096 1.00 0.00 H new ATOM 0 HG3 GLN A 10 11.809 17.462 -4.948 1.00 0.00 H new ATOM 0 HE21 GLN A 10 10.384 18.718 -7.167 1.00 0.00 H new ATOM 0 HE22 GLN A 10 11.621 19.412 -8.220 1.00 0.00 H new ATOM 146 N ALA A 11 12.569 12.548 -6.554 1.00 0.00 N ATOM 147 CA ALA A 11 13.150 11.233 -6.302 1.00 0.00 C ATOM 148 C ALA A 11 13.671 10.596 -7.588 1.00 0.00 C ATOM 149 O ALA A 11 14.493 9.681 -7.549 1.00 0.00 O ATOM 150 CB ALA A 11 12.130 10.325 -5.634 1.00 0.00 C ATOM 0 H ALA A 11 11.568 12.607 -6.368 1.00 0.00 H new ATOM 0 HA ALA A 11 13.999 11.365 -5.631 1.00 0.00 H new ATOM 0 HB1 ALA A 11 12.577 9.348 -5.452 1.00 0.00 H new ATOM 0 HB2 ALA A 11 11.818 10.764 -4.686 1.00 0.00 H new ATOM 0 HB3 ALA A 11 11.263 10.212 -6.284 1.00 0.00 H new ATOM 156 N ALA A 12 13.195 11.089 -8.725 1.00 0.00 N ATOM 157 CA ALA A 12 13.640 10.595 -10.021 1.00 0.00 C ATOM 158 C ALA A 12 15.079 11.020 -10.308 1.00 0.00 C ATOM 159 O ALA A 12 15.738 10.462 -11.183 1.00 0.00 O ATOM 160 CB ALA A 12 12.711 11.088 -11.120 1.00 0.00 C ATOM 0 H ALA A 12 12.499 11.833 -8.775 1.00 0.00 H new ATOM 0 HA ALA A 12 13.610 9.506 -9.997 1.00 0.00 H new ATOM 0 HB1 ALA A 12 13.055 10.712 -12.083 1.00 0.00 H new ATOM 0 HB2 ALA A 12 11.700 10.728 -10.930 1.00 0.00 H new ATOM 0 HB3 ALA A 12 12.712 12.178 -11.135 1.00 0.00 H new ATOM 166 N ASP A 13 15.565 12.006 -9.565 1.00 0.00 N ATOM 167 CA ASP A 13 16.931 12.487 -9.742 1.00 0.00 C ATOM 168 C ASP A 13 17.864 11.784 -8.762 1.00 0.00 C ATOM 169 O ASP A 13 19.087 11.900 -8.844 1.00 0.00 O ATOM 170 CB ASP A 13 16.997 14.002 -9.537 1.00 0.00 C ATOM 171 CG ASP A 13 18.205 14.626 -10.207 1.00 0.00 C ATOM 172 OD1 ASP A 13 18.109 14.953 -11.411 1.00 0.00 O ATOM 173 OD2 ASP A 13 19.250 14.803 -9.544 1.00 0.00 O ATOM 0 H ASP A 13 15.037 12.487 -8.837 1.00 0.00 H new ATOM 0 HA ASP A 13 17.250 12.261 -10.760 1.00 0.00 H new ATOM 0 HB2 ASP A 13 16.090 14.459 -9.932 1.00 0.00 H new ATOM 0 HB3 ASP A 13 17.024 14.220 -8.469 1.00 0.00 H new ATOM 178 N ALA A 14 17.271 11.039 -7.834 1.00 0.00 N ATOM 179 CA ALA A 14 18.034 10.301 -6.833 1.00 0.00 C ATOM 180 C ALA A 14 18.554 8.988 -7.408 1.00 0.00 C ATOM 181 O ALA A 14 19.342 8.282 -6.772 1.00 0.00 O ATOM 182 CB ALA A 14 17.183 10.043 -5.599 1.00 0.00 C ATOM 0 H ALA A 14 16.260 10.930 -7.755 1.00 0.00 H new ATOM 0 HA ALA A 14 18.891 10.908 -6.542 1.00 0.00 H new ATOM 0 HB1 ALA A 14 17.768 9.492 -4.863 1.00 0.00 H new ATOM 0 HB2 ALA A 14 16.865 10.994 -5.171 1.00 0.00 H new ATOM 0 HB3 ALA A 14 16.306 9.459 -5.877 1.00 0.00 H new ATOM 188 N LEU A 15 18.100 8.665 -8.612 1.00 0.00 N ATOM 189 CA LEU A 15 18.571 7.483 -9.317 1.00 0.00 C ATOM 190 C LEU A 15 20.029 7.688 -9.709 1.00 0.00 C ATOM 191 O LEU A 15 20.394 8.764 -10.187 1.00 0.00 O ATOM 192 CB LEU A 15 17.733 7.240 -10.580 1.00 0.00 C ATOM 193 CG LEU A 15 16.219 7.424 -10.431 1.00 0.00 C ATOM 194 CD1 LEU A 15 15.522 7.132 -11.749 1.00 0.00 C ATOM 195 CD2 LEU A 15 15.666 6.533 -9.334 1.00 0.00 C ATOM 0 H LEU A 15 17.403 9.208 -9.121 1.00 0.00 H new ATOM 0 HA LEU A 15 18.475 6.616 -8.663 1.00 0.00 H new ATOM 0 HB2 LEU A 15 18.085 7.915 -11.360 1.00 0.00 H new ATOM 0 HB3 LEU A 15 17.923 6.224 -10.927 1.00 0.00 H new ATOM 0 HG LEU A 15 16.029 8.460 -10.152 1.00 0.00 H new ATOM 0 HD11 LEU A 15 14.447 7.266 -11.630 1.00 0.00 H new ATOM 0 HD12 LEU A 15 15.890 7.815 -12.514 1.00 0.00 H new ATOM 0 HD13 LEU A 15 15.728 6.105 -12.050 1.00 0.00 H new ATOM 0 HD21 LEU A 15 14.590 6.684 -9.250 1.00 0.00 H new ATOM 0 HD22 LEU A 15 15.868 5.490 -9.576 1.00 0.00 H new ATOM 0 HD23 LEU A 15 16.142 6.784 -8.386 1.00 0.00 H new ATOM 207 N LYS A 16 20.864 6.680 -9.512 1.00 0.00 N ATOM 208 CA LYS A 16 22.276 6.814 -9.844 1.00 0.00 C ATOM 209 C LYS A 16 22.776 5.615 -10.636 1.00 0.00 C ATOM 210 O LYS A 16 22.501 4.463 -10.297 1.00 0.00 O ATOM 211 CB LYS A 16 23.126 7.023 -8.586 1.00 0.00 C ATOM 212 CG LYS A 16 23.106 5.861 -7.609 1.00 0.00 C ATOM 213 CD LYS A 16 23.945 6.168 -6.381 1.00 0.00 C ATOM 214 CE LYS A 16 23.970 4.999 -5.413 1.00 0.00 C ATOM 215 NZ LYS A 16 24.613 5.361 -4.125 1.00 0.00 N ATOM 0 H LYS A 16 20.596 5.773 -9.130 1.00 0.00 H new ATOM 0 HA LYS A 16 22.378 7.699 -10.472 1.00 0.00 H new ATOM 0 HB2 LYS A 16 24.157 7.210 -8.887 1.00 0.00 H new ATOM 0 HB3 LYS A 16 22.777 7.919 -8.072 1.00 0.00 H new ATOM 0 HG2 LYS A 16 22.079 5.651 -7.309 1.00 0.00 H new ATOM 0 HG3 LYS A 16 23.485 4.964 -8.098 1.00 0.00 H new ATOM 0 HD2 LYS A 16 24.963 6.410 -6.687 1.00 0.00 H new ATOM 0 HD3 LYS A 16 23.546 7.049 -5.878 1.00 0.00 H new ATOM 0 HE2 LYS A 16 22.951 4.659 -5.227 1.00 0.00 H new ATOM 0 HE3 LYS A 16 24.507 4.165 -5.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 24.610 4.536 -3.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 25.594 5.661 -4.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 24.086 6.140 -3.681 1.00 0.00 H new ATOM 229 N GLY A 17 23.504 5.901 -11.698 1.00 0.00 N ATOM 230 CA GLY A 17 24.000 4.860 -12.568 1.00 0.00 C ATOM 231 C GLY A 17 23.719 5.173 -14.019 1.00 0.00 C ATOM 232 O GLY A 17 22.931 6.069 -14.326 1.00 0.00 O ATOM 0 H GLY A 17 23.764 6.847 -11.977 1.00 0.00 H new ATOM 0 HA2 GLY A 17 25.074 4.742 -12.421 1.00 0.00 H new ATOM 0 HA3 GLY A 17 23.536 3.910 -12.303 1.00 0.00 H new ATOM 236 N PHE A 18 24.359 4.448 -14.914 1.00 0.00 N ATOM 237 CA PHE A 18 24.190 4.676 -16.336 1.00 0.00 C ATOM 238 C PHE A 18 23.494 3.489 -16.978 1.00 0.00 C ATOM 239 O PHE A 18 23.787 2.341 -16.659 1.00 0.00 O ATOM 240 CB PHE A 18 25.549 4.903 -17.004 1.00 0.00 C ATOM 241 CG PHE A 18 26.340 6.034 -16.405 1.00 0.00 C ATOM 242 CD1 PHE A 18 26.162 7.333 -16.850 1.00 0.00 C ATOM 243 CD2 PHE A 18 27.259 5.796 -15.395 1.00 0.00 C ATOM 244 CE1 PHE A 18 26.886 8.374 -16.299 1.00 0.00 C ATOM 245 CE2 PHE A 18 27.986 6.833 -14.841 1.00 0.00 C ATOM 246 CZ PHE A 18 27.798 8.124 -15.294 1.00 0.00 C ATOM 0 H PHE A 18 25.004 3.693 -14.681 1.00 0.00 H new ATOM 0 HA PHE A 18 23.576 5.566 -16.473 1.00 0.00 H new ATOM 0 HB2 PHE A 18 26.135 3.986 -16.935 1.00 0.00 H new ATOM 0 HB3 PHE A 18 25.393 5.103 -18.064 1.00 0.00 H new ATOM 0 HD1 PHE A 18 25.450 7.535 -17.636 1.00 0.00 H new ATOM 0 HD2 PHE A 18 27.409 4.788 -15.037 1.00 0.00 H new ATOM 0 HE1 PHE A 18 26.738 9.383 -16.655 1.00 0.00 H new ATOM 0 HE2 PHE A 18 28.700 6.634 -14.055 1.00 0.00 H new ATOM 0 HZ PHE A 18 28.364 8.936 -14.862 1.00 0.00 H new ATOM 256 N VAL A 19 22.554 3.765 -17.860 1.00 0.00 N ATOM 257 CA VAL A 19 21.897 2.718 -18.615 1.00 0.00 C ATOM 258 C VAL A 19 22.425 2.738 -20.040 1.00 0.00 C ATOM 259 O VAL A 19 22.381 3.774 -20.708 1.00 0.00 O ATOM 260 CB VAL A 19 20.364 2.895 -18.623 1.00 0.00 C ATOM 261 CG1 VAL A 19 19.684 1.669 -19.208 1.00 0.00 C ATOM 262 CG2 VAL A 19 19.848 3.173 -17.221 1.00 0.00 C ATOM 0 H VAL A 19 22.228 4.708 -18.071 1.00 0.00 H new ATOM 0 HA VAL A 19 22.113 1.761 -18.141 1.00 0.00 H new ATOM 0 HB VAL A 19 20.125 3.752 -19.253 1.00 0.00 H new ATOM 0 HG11 VAL A 19 18.604 1.815 -19.204 1.00 0.00 H new ATOM 0 HG12 VAL A 19 20.026 1.517 -20.232 1.00 0.00 H new ATOM 0 HG13 VAL A 19 19.934 0.794 -18.609 1.00 0.00 H new ATOM 0 HG21 VAL A 19 18.765 3.295 -17.249 1.00 0.00 H new ATOM 0 HG22 VAL A 19 20.103 2.339 -16.567 1.00 0.00 H new ATOM 0 HG23 VAL A 19 20.306 4.086 -16.839 1.00 0.00 H new ATOM 272 N GLY A 20 22.936 1.610 -20.499 1.00 0.00 N ATOM 273 CA GLY A 20 23.574 1.573 -21.794 1.00 0.00 C ATOM 274 C GLY A 20 23.295 0.293 -22.546 1.00 0.00 C ATOM 275 O GLY A 20 22.848 -0.695 -21.962 1.00 0.00 O ATOM 0 H GLY A 20 22.921 0.721 -19.999 1.00 0.00 H new ATOM 0 HA2 GLY A 20 23.231 2.420 -22.388 1.00 0.00 H new ATOM 0 HA3 GLY A 20 24.651 1.688 -21.667 1.00 0.00 H new ATOM 279 N PHE A 21 23.558 0.310 -23.841 1.00 0.00 N ATOM 280 CA PHE A 21 23.315 -0.850 -24.679 1.00 0.00 C ATOM 281 C PHE A 21 24.604 -1.631 -24.889 1.00 0.00 C ATOM 282 O PHE A 21 25.563 -1.121 -25.467 1.00 0.00 O ATOM 283 CB PHE A 21 22.732 -0.420 -26.028 1.00 0.00 C ATOM 284 CG PHE A 21 22.271 -1.567 -26.887 1.00 0.00 C ATOM 285 CD1 PHE A 21 20.991 -2.079 -26.748 1.00 0.00 C ATOM 286 CD2 PHE A 21 23.115 -2.130 -27.831 1.00 0.00 C ATOM 287 CE1 PHE A 21 20.562 -3.132 -27.534 1.00 0.00 C ATOM 288 CE2 PHE A 21 22.691 -3.183 -28.619 1.00 0.00 C ATOM 289 CZ PHE A 21 21.413 -3.684 -28.470 1.00 0.00 C ATOM 0 H PHE A 21 23.941 1.116 -24.335 1.00 0.00 H new ATOM 0 HA PHE A 21 22.594 -1.495 -24.177 1.00 0.00 H new ATOM 0 HB2 PHE A 21 21.891 0.250 -25.852 1.00 0.00 H new ATOM 0 HB3 PHE A 21 23.485 0.150 -26.573 1.00 0.00 H new ATOM 0 HD1 PHE A 21 20.321 -1.651 -26.017 1.00 0.00 H new ATOM 0 HD2 PHE A 21 24.115 -1.741 -27.952 1.00 0.00 H new ATOM 0 HE1 PHE A 21 19.562 -3.522 -27.416 1.00 0.00 H new ATOM 0 HE2 PHE A 21 23.359 -3.614 -29.351 1.00 0.00 H new ATOM 0 HZ PHE A 21 21.080 -4.507 -29.085 1.00 0.00 H new ATOM 299 N ASN A 22 24.623 -2.862 -24.404 1.00 0.00 N ATOM 300 CA ASN A 22 25.761 -3.743 -24.610 1.00 0.00 C ATOM 301 C ASN A 22 25.548 -4.550 -25.881 1.00 0.00 C ATOM 302 O ASN A 22 24.582 -5.303 -25.984 1.00 0.00 O ATOM 303 CB ASN A 22 25.949 -4.677 -23.411 1.00 0.00 C ATOM 304 CG ASN A 22 27.079 -5.667 -23.623 1.00 0.00 C ATOM 305 OD1 ASN A 22 26.867 -6.769 -24.125 1.00 0.00 O ATOM 306 ND2 ASN A 22 28.285 -5.281 -23.247 1.00 0.00 N ATOM 0 H ASN A 22 23.862 -3.274 -23.864 1.00 0.00 H new ATOM 0 HA ASN A 22 26.663 -3.140 -24.710 1.00 0.00 H new ATOM 0 HB2 ASN A 22 26.152 -4.084 -22.519 1.00 0.00 H new ATOM 0 HB3 ASN A 22 25.022 -5.221 -23.228 1.00 0.00 H new ATOM 0 HD21 ASN A 22 29.082 -5.906 -23.370 1.00 0.00 H new ATOM 0 HD22 ASN A 22 28.419 -4.358 -22.834 1.00 0.00 H new ATOM 313 N ARG A 23 26.451 -4.400 -26.838 1.00 0.00 N ATOM 314 CA ARG A 23 26.267 -4.991 -28.158 1.00 0.00 C ATOM 315 C ARG A 23 26.604 -6.479 -28.152 1.00 0.00 C ATOM 316 O ARG A 23 26.235 -7.208 -29.073 1.00 0.00 O ATOM 317 CB ARG A 23 27.126 -4.260 -29.194 1.00 0.00 C ATOM 318 CG ARG A 23 28.613 -4.551 -29.078 1.00 0.00 C ATOM 319 CD ARG A 23 29.428 -3.695 -30.030 1.00 0.00 C ATOM 320 NE ARG A 23 28.943 -3.774 -31.406 1.00 0.00 N ATOM 321 CZ ARG A 23 29.734 -3.793 -32.478 1.00 0.00 C ATOM 322 NH1 ARG A 23 31.056 -3.819 -32.341 1.00 0.00 N ATOM 323 NH2 ARG A 23 29.194 -3.804 -33.690 1.00 0.00 N ATOM 0 H ARG A 23 27.318 -3.875 -26.727 1.00 0.00 H new ATOM 0 HA ARG A 23 25.216 -4.884 -28.427 1.00 0.00 H new ATOM 0 HB2 ARG A 23 26.788 -4.538 -30.192 1.00 0.00 H new ATOM 0 HB3 ARG A 23 26.967 -3.187 -29.091 1.00 0.00 H new ATOM 0 HG2 ARG A 23 28.941 -4.370 -28.054 1.00 0.00 H new ATOM 0 HG3 ARG A 23 28.795 -5.605 -29.289 1.00 0.00 H new ATOM 0 HD2 ARG A 23 29.399 -2.658 -29.697 1.00 0.00 H new ATOM 0 HD3 ARG A 23 30.471 -4.011 -29.997 1.00 0.00 H new ATOM 0 HE ARG A 23 27.935 -3.817 -31.555 1.00 0.00 H new ATOM 0 HH11 ARG A 23 31.472 -3.825 -31.410 1.00 0.00 H new ATOM 0 HH12 ARG A 23 31.654 -3.833 -33.167 1.00 0.00 H new ATOM 0 HH21 ARG A 23 28.180 -3.798 -33.796 1.00 0.00 H new ATOM 0 HH22 ARG A 23 29.793 -3.819 -34.515 1.00 0.00 H new ATOM 337 N LYS A 24 27.299 -6.928 -27.114 1.00 0.00 N ATOM 338 CA LYS A 24 27.682 -8.330 -27.010 1.00 0.00 C ATOM 339 C LYS A 24 26.468 -9.189 -26.678 1.00 0.00 C ATOM 340 O LYS A 24 26.155 -10.136 -27.396 1.00 0.00 O ATOM 341 CB LYS A 24 28.772 -8.520 -25.950 1.00 0.00 C ATOM 342 CG LYS A 24 29.279 -9.954 -25.816 1.00 0.00 C ATOM 343 CD LYS A 24 30.209 -10.358 -26.960 1.00 0.00 C ATOM 344 CE LYS A 24 29.463 -10.602 -28.267 1.00 0.00 C ATOM 345 NZ LYS A 24 28.569 -11.792 -28.199 1.00 0.00 N ATOM 0 H LYS A 24 27.607 -6.345 -26.336 1.00 0.00 H new ATOM 0 HA LYS A 24 28.082 -8.645 -27.974 1.00 0.00 H new ATOM 0 HB2 LYS A 24 29.614 -7.871 -26.192 1.00 0.00 H new ATOM 0 HB3 LYS A 24 28.384 -8.193 -24.985 1.00 0.00 H new ATOM 0 HG2 LYS A 24 29.807 -10.062 -24.868 1.00 0.00 H new ATOM 0 HG3 LYS A 24 28.428 -10.635 -25.786 1.00 0.00 H new ATOM 0 HD2 LYS A 24 30.953 -9.576 -27.112 1.00 0.00 H new ATOM 0 HD3 LYS A 24 30.750 -11.262 -26.681 1.00 0.00 H new ATOM 0 HE2 LYS A 24 28.871 -9.721 -28.514 1.00 0.00 H new ATOM 0 HE3 LYS A 24 30.184 -10.738 -29.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 28.543 -12.260 -29.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 28.930 -12.457 -27.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 27.609 -11.490 -27.936 1.00 0.00 H new ATOM 359 N THR A 25 25.788 -8.854 -25.589 1.00 0.00 N ATOM 360 CA THR A 25 24.580 -9.567 -25.201 1.00 0.00 C ATOM 361 C THR A 25 23.371 -8.995 -25.941 1.00 0.00 C ATOM 362 O THR A 25 22.306 -9.611 -25.987 1.00 0.00 O ATOM 363 CB THR A 25 24.354 -9.510 -23.668 1.00 0.00 C ATOM 364 OG1 THR A 25 23.231 -10.321 -23.292 1.00 0.00 O ATOM 365 CG2 THR A 25 24.126 -8.082 -23.191 1.00 0.00 C ATOM 0 H THR A 25 26.052 -8.095 -24.961 1.00 0.00 H new ATOM 0 HA THR A 25 24.704 -10.614 -25.478 1.00 0.00 H new ATOM 0 HB THR A 25 25.256 -9.896 -23.194 1.00 0.00 H new ATOM 0 HG1 THR A 25 22.648 -10.453 -24.069 1.00 0.00 H new ATOM 0 HG21 THR A 25 23.971 -8.079 -22.112 1.00 0.00 H new ATOM 0 HG22 THR A 25 24.997 -7.474 -23.434 1.00 0.00 H new ATOM 0 HG23 THR A 25 23.246 -7.669 -23.685 1.00 0.00 H new ATOM 373 N GLY A 26 23.550 -7.810 -26.518 1.00 0.00 N ATOM 374 CA GLY A 26 22.504 -7.186 -27.305 1.00 0.00 C ATOM 375 C GLY A 26 21.357 -6.689 -26.450 1.00 0.00 C ATOM 376 O GLY A 26 20.240 -6.516 -26.935 1.00 0.00 O ATOM 0 H GLY A 26 24.411 -7.267 -26.452 1.00 0.00 H new ATOM 0 HA2 GLY A 26 22.924 -6.351 -27.866 1.00 0.00 H new ATOM 0 HA3 GLY A 26 22.126 -7.902 -28.035 1.00 0.00 H new ATOM 380 N ARG A 27 21.629 -6.457 -25.175 1.00 0.00 N ATOM 381 CA ARG A 27 20.590 -6.058 -24.235 1.00 0.00 C ATOM 382 C ARG A 27 20.844 -4.645 -23.732 1.00 0.00 C ATOM 383 O ARG A 27 21.981 -4.165 -23.747 1.00 0.00 O ATOM 384 CB ARG A 27 20.534 -7.022 -23.044 1.00 0.00 C ATOM 385 CG ARG A 27 20.317 -8.488 -23.407 1.00 0.00 C ATOM 386 CD ARG A 27 18.952 -8.748 -24.037 1.00 0.00 C ATOM 387 NE ARG A 27 18.906 -8.366 -25.448 1.00 0.00 N ATOM 388 CZ ARG A 27 18.188 -9.002 -26.374 1.00 0.00 C ATOM 389 NH1 ARG A 27 17.428 -10.035 -26.037 1.00 0.00 N ATOM 390 NH2 ARG A 27 18.239 -8.602 -27.639 1.00 0.00 N ATOM 0 H ARG A 27 22.560 -6.538 -24.766 1.00 0.00 H new ATOM 0 HA ARG A 27 19.634 -6.088 -24.759 1.00 0.00 H new ATOM 0 HB2 ARG A 27 21.465 -6.937 -22.483 1.00 0.00 H new ATOM 0 HB3 ARG A 27 19.731 -6.706 -22.378 1.00 0.00 H new ATOM 0 HG2 ARG A 27 21.097 -8.805 -24.099 1.00 0.00 H new ATOM 0 HG3 ARG A 27 20.420 -9.098 -22.510 1.00 0.00 H new ATOM 0 HD2 ARG A 27 18.707 -9.806 -23.942 1.00 0.00 H new ATOM 0 HD3 ARG A 27 18.190 -8.194 -23.489 1.00 0.00 H new ATOM 0 HE ARG A 27 19.459 -7.561 -25.743 1.00 0.00 H new ATOM 0 HH11 ARG A 27 17.391 -10.346 -25.066 1.00 0.00 H new ATOM 0 HH12 ARG A 27 16.880 -10.519 -26.749 1.00 0.00 H new ATOM 0 HH21 ARG A 27 18.826 -7.810 -27.900 1.00 0.00 H new ATOM 0 HH22 ARG A 27 17.691 -9.087 -28.350 1.00 0.00 H new ATOM 404 N TYR A 28 19.786 -3.989 -23.284 1.00 0.00 N ATOM 405 CA TYR A 28 19.895 -2.651 -22.731 1.00 0.00 C ATOM 406 C TYR A 28 19.985 -2.762 -21.215 1.00 0.00 C ATOM 407 O TYR A 28 18.993 -3.048 -20.542 1.00 0.00 O ATOM 408 CB TYR A 28 18.688 -1.808 -23.155 1.00 0.00 C ATOM 409 CG TYR A 28 18.938 -0.317 -23.119 1.00 0.00 C ATOM 410 CD1 TYR A 28 19.945 0.249 -23.887 1.00 0.00 C ATOM 411 CD2 TYR A 28 18.172 0.522 -22.323 1.00 0.00 C ATOM 412 CE1 TYR A 28 20.184 1.608 -23.865 1.00 0.00 C ATOM 413 CE2 TYR A 28 18.404 1.885 -22.296 1.00 0.00 C ATOM 414 CZ TYR A 28 19.412 2.422 -23.067 1.00 0.00 C ATOM 415 OH TYR A 28 19.648 3.778 -23.042 1.00 0.00 O ATOM 0 H TYR A 28 18.838 -4.365 -23.293 1.00 0.00 H new ATOM 0 HA TYR A 28 20.790 -2.156 -23.107 1.00 0.00 H new ATOM 0 HB2 TYR A 28 18.395 -2.093 -24.166 1.00 0.00 H new ATOM 0 HB3 TYR A 28 17.847 -2.041 -22.502 1.00 0.00 H new ATOM 0 HD1 TYR A 28 20.553 -0.386 -24.514 1.00 0.00 H new ATOM 0 HD2 TYR A 28 17.383 0.105 -21.715 1.00 0.00 H new ATOM 0 HE1 TYR A 28 20.972 2.031 -24.470 1.00 0.00 H new ATOM 0 HE2 TYR A 28 17.798 2.526 -21.673 1.00 0.00 H new ATOM 0 HH TYR A 28 18.966 4.219 -22.493 1.00 0.00 H new ATOM 425 N ILE A 29 21.179 -2.556 -20.684 1.00 0.00 N ATOM 426 CA ILE A 29 21.460 -2.897 -19.297 1.00 0.00 C ATOM 427 C ILE A 29 21.951 -1.700 -18.496 1.00 0.00 C ATOM 428 O ILE A 29 22.108 -0.601 -19.025 1.00 0.00 O ATOM 429 CB ILE A 29 22.494 -4.048 -19.207 1.00 0.00 C ATOM 430 CG1 ILE A 29 23.693 -3.798 -20.135 1.00 0.00 C ATOM 431 CG2 ILE A 29 21.836 -5.379 -19.539 1.00 0.00 C ATOM 432 CD1 ILE A 29 24.730 -2.844 -19.578 1.00 0.00 C ATOM 0 H ILE A 29 21.969 -2.155 -21.190 1.00 0.00 H new ATOM 0 HA ILE A 29 20.517 -3.226 -18.861 1.00 0.00 H new ATOM 0 HB ILE A 29 22.866 -4.083 -18.183 1.00 0.00 H new ATOM 0 HG12 ILE A 29 24.174 -4.752 -20.351 1.00 0.00 H new ATOM 0 HG13 ILE A 29 23.327 -3.404 -21.083 1.00 0.00 H new ATOM 0 HG21 ILE A 29 22.575 -6.177 -19.471 1.00 0.00 H new ATOM 0 HG22 ILE A 29 21.028 -5.572 -18.833 1.00 0.00 H new ATOM 0 HG23 ILE A 29 21.432 -5.343 -20.551 1.00 0.00 H new ATOM 0 HD11 ILE A 29 25.540 -2.726 -20.298 1.00 0.00 H new ATOM 0 HD12 ILE A 29 24.268 -1.875 -19.389 1.00 0.00 H new ATOM 0 HD13 ILE A 29 25.129 -3.244 -18.646 1.00 0.00 H new ATOM 444 N VAL A 30 22.197 -1.930 -17.216 1.00 0.00 N ATOM 445 CA VAL A 30 22.659 -0.882 -16.326 1.00 0.00 C ATOM 446 C VAL A 30 24.129 -1.080 -15.971 1.00 0.00 C ATOM 447 O VAL A 30 24.625 -2.209 -15.923 1.00 0.00 O ATOM 448 CB VAL A 30 21.819 -0.827 -15.031 1.00 0.00 C ATOM 449 CG1 VAL A 30 20.366 -0.522 -15.355 1.00 0.00 C ATOM 450 CG2 VAL A 30 21.929 -2.131 -14.250 1.00 0.00 C ATOM 0 H VAL A 30 22.083 -2.840 -16.770 1.00 0.00 H new ATOM 0 HA VAL A 30 22.542 0.063 -16.856 1.00 0.00 H new ATOM 0 HB VAL A 30 22.213 -0.026 -14.406 1.00 0.00 H new ATOM 0 HG11 VAL A 30 19.787 -0.487 -14.432 1.00 0.00 H new ATOM 0 HG12 VAL A 30 20.301 0.441 -15.862 1.00 0.00 H new ATOM 0 HG13 VAL A 30 19.967 -1.301 -16.004 1.00 0.00 H new ATOM 0 HG21 VAL A 30 21.328 -2.064 -13.343 1.00 0.00 H new ATOM 0 HG22 VAL A 30 21.567 -2.955 -14.865 1.00 0.00 H new ATOM 0 HG23 VAL A 30 22.971 -2.308 -13.982 1.00 0.00 H new ATOM 460 N ARG A 31 24.817 0.023 -15.744 1.00 0.00 N ATOM 461 CA ARG A 31 26.221 0.003 -15.382 1.00 0.00 C ATOM 462 C ARG A 31 26.542 1.241 -14.553 1.00 0.00 C ATOM 463 O ARG A 31 26.161 2.350 -14.917 1.00 0.00 O ATOM 464 CB ARG A 31 27.079 -0.021 -16.653 1.00 0.00 C ATOM 465 CG ARG A 31 28.566 -0.213 -16.403 1.00 0.00 C ATOM 466 CD ARG A 31 28.860 -1.581 -15.813 1.00 0.00 C ATOM 467 NE ARG A 31 30.294 -1.833 -15.690 1.00 0.00 N ATOM 468 CZ ARG A 31 30.813 -2.903 -15.089 1.00 0.00 C ATOM 469 NH1 ARG A 31 30.014 -3.827 -14.567 1.00 0.00 N ATOM 470 NH2 ARG A 31 32.132 -3.056 -15.030 1.00 0.00 N ATOM 0 H ARG A 31 24.417 0.959 -15.806 1.00 0.00 H new ATOM 0 HA ARG A 31 26.439 -0.889 -14.794 1.00 0.00 H new ATOM 0 HB2 ARG A 31 26.725 -0.823 -17.300 1.00 0.00 H new ATOM 0 HB3 ARG A 31 26.932 0.914 -17.194 1.00 0.00 H new ATOM 0 HG2 ARG A 31 29.111 -0.095 -17.339 1.00 0.00 H new ATOM 0 HG3 ARG A 31 28.925 0.561 -15.725 1.00 0.00 H new ATOM 0 HD2 ARG A 31 28.394 -1.659 -14.831 1.00 0.00 H new ATOM 0 HD3 ARG A 31 28.410 -2.350 -16.441 1.00 0.00 H new ATOM 0 HE ARG A 31 30.937 -1.148 -16.088 1.00 0.00 H new ATOM 0 HH11 ARG A 31 29.002 -3.718 -14.626 1.00 0.00 H new ATOM 0 HH12 ARG A 31 30.413 -4.645 -14.107 1.00 0.00 H new ATOM 0 HH21 ARG A 31 32.746 -2.355 -15.445 1.00 0.00 H new ATOM 0 HH22 ARG A 31 32.530 -3.875 -14.570 1.00 0.00 H new ATOM 484 N PHE A 32 27.226 1.060 -13.436 1.00 0.00 N ATOM 485 CA PHE A 32 27.593 2.191 -12.596 1.00 0.00 C ATOM 486 C PHE A 32 28.901 2.797 -13.086 1.00 0.00 C ATOM 487 O PHE A 32 29.134 3.998 -12.958 1.00 0.00 O ATOM 488 CB PHE A 32 27.716 1.757 -11.132 1.00 0.00 C ATOM 489 CG PHE A 32 27.969 2.893 -10.178 1.00 0.00 C ATOM 490 CD1 PHE A 32 26.951 3.773 -9.844 1.00 0.00 C ATOM 491 CD2 PHE A 32 29.223 3.083 -9.619 1.00 0.00 C ATOM 492 CE1 PHE A 32 27.179 4.820 -8.970 1.00 0.00 C ATOM 493 CE2 PHE A 32 29.457 4.129 -8.746 1.00 0.00 C ATOM 494 CZ PHE A 32 28.433 4.998 -8.421 1.00 0.00 C ATOM 0 H PHE A 32 27.536 0.152 -13.091 1.00 0.00 H new ATOM 0 HA PHE A 32 26.809 2.946 -12.661 1.00 0.00 H new ATOM 0 HB2 PHE A 32 26.800 1.245 -10.837 1.00 0.00 H new ATOM 0 HB3 PHE A 32 28.527 1.035 -11.044 1.00 0.00 H new ATOM 0 HD1 PHE A 32 25.968 3.639 -10.272 1.00 0.00 H new ATOM 0 HD2 PHE A 32 30.027 2.406 -9.868 1.00 0.00 H new ATOM 0 HE1 PHE A 32 26.377 5.498 -8.717 1.00 0.00 H new ATOM 0 HE2 PHE A 32 30.439 4.267 -8.318 1.00 0.00 H new ATOM 0 HZ PHE A 32 28.613 5.815 -7.738 1.00 0.00 H new ATOM 504 N SER A 33 29.742 1.953 -13.660 1.00 0.00 N ATOM 505 CA SER A 33 31.028 2.380 -14.176 1.00 0.00 C ATOM 506 C SER A 33 30.873 3.010 -15.558 1.00 0.00 C ATOM 507 O SER A 33 30.523 2.332 -16.523 1.00 0.00 O ATOM 508 CB SER A 33 31.969 1.178 -14.252 1.00 0.00 C ATOM 509 OG SER A 33 31.917 0.423 -13.052 1.00 0.00 O ATOM 0 H SER A 33 29.552 0.958 -13.780 1.00 0.00 H new ATOM 0 HA SER A 33 31.446 3.130 -13.504 1.00 0.00 H new ATOM 0 HB2 SER A 33 31.693 0.547 -15.097 1.00 0.00 H new ATOM 0 HB3 SER A 33 32.989 1.519 -14.429 1.00 0.00 H new ATOM 0 HG SER A 33 32.525 -0.343 -13.121 1.00 0.00 H new ATOM 515 N GLU A 34 31.122 4.311 -15.643 1.00 0.00 N ATOM 516 CA GLU A 34 31.071 5.018 -16.917 1.00 0.00 C ATOM 517 C GLU A 34 32.233 4.574 -17.801 1.00 0.00 C ATOM 518 O GLU A 34 32.135 4.568 -19.027 1.00 0.00 O ATOM 519 CB GLU A 34 31.106 6.534 -16.682 1.00 0.00 C ATOM 520 CG GLU A 34 31.139 7.366 -17.956 1.00 0.00 C ATOM 521 CD GLU A 34 32.490 8.010 -18.191 1.00 0.00 C ATOM 522 OE1 GLU A 34 33.451 7.294 -18.534 1.00 0.00 O ATOM 523 OE2 GLU A 34 32.606 9.239 -18.010 1.00 0.00 O ATOM 0 H GLU A 34 31.361 4.898 -14.844 1.00 0.00 H new ATOM 0 HA GLU A 34 30.138 4.777 -17.427 1.00 0.00 H new ATOM 0 HB2 GLU A 34 30.231 6.819 -16.098 1.00 0.00 H new ATOM 0 HB3 GLU A 34 31.983 6.776 -16.081 1.00 0.00 H new ATOM 0 HG2 GLU A 34 30.889 6.732 -18.807 1.00 0.00 H new ATOM 0 HG3 GLU A 34 30.375 8.141 -17.900 1.00 0.00 H new ATOM 530 N ASP A 35 33.319 4.166 -17.151 1.00 0.00 N ATOM 531 CA ASP A 35 34.536 3.727 -17.832 1.00 0.00 C ATOM 532 C ASP A 35 34.290 2.481 -18.682 1.00 0.00 C ATOM 533 O ASP A 35 35.112 2.119 -19.523 1.00 0.00 O ATOM 534 CB ASP A 35 35.628 3.443 -16.795 1.00 0.00 C ATOM 535 CG ASP A 35 36.951 3.028 -17.410 1.00 0.00 C ATOM 536 OD1 ASP A 35 37.673 3.904 -17.930 1.00 0.00 O ATOM 537 OD2 ASP A 35 37.291 1.825 -17.355 1.00 0.00 O ATOM 0 H ASP A 35 33.381 4.130 -16.134 1.00 0.00 H new ATOM 0 HA ASP A 35 34.856 4.526 -18.501 1.00 0.00 H new ATOM 0 HB2 ASP A 35 35.782 4.335 -16.188 1.00 0.00 H new ATOM 0 HB3 ASP A 35 35.285 2.656 -16.124 1.00 0.00 H new ATOM 542 N SER A 36 33.148 1.839 -18.475 1.00 0.00 N ATOM 543 CA SER A 36 32.805 0.620 -19.193 1.00 0.00 C ATOM 544 C SER A 36 32.331 0.927 -20.618 1.00 0.00 C ATOM 545 O SER A 36 31.232 0.538 -21.017 1.00 0.00 O ATOM 546 CB SER A 36 31.717 -0.135 -18.429 1.00 0.00 C ATOM 547 OG SER A 36 32.104 -0.354 -17.081 1.00 0.00 O ATOM 0 H SER A 36 32.438 2.146 -17.810 1.00 0.00 H new ATOM 0 HA SER A 36 33.699 0.001 -19.265 1.00 0.00 H new ATOM 0 HB2 SER A 36 30.787 0.433 -18.457 1.00 0.00 H new ATOM 0 HB3 SER A 36 31.522 -1.091 -18.915 1.00 0.00 H new ATOM 0 HG SER A 36 32.712 -1.121 -17.036 1.00 0.00 H new ATOM 553 N PHE A 37 33.163 1.625 -21.376 1.00 0.00 N ATOM 554 CA PHE A 37 32.863 1.926 -22.765 1.00 0.00 C ATOM 555 C PHE A 37 34.154 1.937 -23.578 1.00 0.00 C ATOM 556 O PHE A 37 35.231 1.675 -23.040 1.00 0.00 O ATOM 557 CB PHE A 37 32.125 3.270 -22.885 1.00 0.00 C ATOM 558 CG PHE A 37 33.009 4.486 -22.826 1.00 0.00 C ATOM 559 CD1 PHE A 37 33.730 4.790 -21.684 1.00 0.00 C ATOM 560 CD2 PHE A 37 33.113 5.325 -23.923 1.00 0.00 C ATOM 561 CE1 PHE A 37 34.539 5.908 -21.638 1.00 0.00 C ATOM 562 CE2 PHE A 37 33.920 6.445 -23.883 1.00 0.00 C ATOM 563 CZ PHE A 37 34.635 6.737 -22.738 1.00 0.00 C ATOM 0 H PHE A 37 34.056 1.995 -21.049 1.00 0.00 H new ATOM 0 HA PHE A 37 32.205 1.152 -23.161 1.00 0.00 H new ATOM 0 HB2 PHE A 37 31.576 3.283 -23.826 1.00 0.00 H new ATOM 0 HB3 PHE A 37 31.388 3.336 -22.085 1.00 0.00 H new ATOM 0 HD1 PHE A 37 33.659 4.146 -20.820 1.00 0.00 H new ATOM 0 HD2 PHE A 37 32.556 5.101 -24.821 1.00 0.00 H new ATOM 0 HE1 PHE A 37 35.097 6.134 -20.741 1.00 0.00 H new ATOM 0 HE2 PHE A 37 33.992 7.091 -24.745 1.00 0.00 H new ATOM 0 HZ PHE A 37 35.268 7.612 -22.703 1.00 0.00 H new ATOM 573 N GLY A 38 34.044 2.235 -24.865 1.00 0.00 N ATOM 574 CA GLY A 38 35.212 2.264 -25.720 1.00 0.00 C ATOM 575 C GLY A 38 34.840 2.333 -27.183 1.00 0.00 C ATOM 576 O GLY A 38 34.167 3.269 -27.616 1.00 0.00 O ATOM 0 H GLY A 38 33.165 2.457 -25.332 1.00 0.00 H new ATOM 0 HA2 GLY A 38 35.829 3.124 -25.462 1.00 0.00 H new ATOM 0 HA3 GLY A 38 35.815 1.374 -25.541 1.00 0.00 H new ATOM 580 N MET A 39 35.264 1.339 -27.946 1.00 0.00 N ATOM 581 CA MET A 39 34.950 1.284 -29.365 1.00 0.00 C ATOM 582 C MET A 39 33.712 0.430 -29.602 1.00 0.00 C ATOM 583 O MET A 39 33.009 0.604 -30.594 1.00 0.00 O ATOM 584 CB MET A 39 36.136 0.736 -30.167 1.00 0.00 C ATOM 585 CG MET A 39 36.479 -0.714 -29.865 1.00 0.00 C ATOM 586 SD MET A 39 37.937 -1.291 -30.759 1.00 0.00 S ATOM 587 CE MET A 39 39.191 -0.192 -30.101 1.00 0.00 C ATOM 0 H MET A 39 35.827 0.559 -27.607 1.00 0.00 H new ATOM 0 HA MET A 39 34.747 2.299 -29.707 1.00 0.00 H new ATOM 0 HB2 MET A 39 35.916 0.831 -31.230 1.00 0.00 H new ATOM 0 HB3 MET A 39 37.011 1.354 -29.967 1.00 0.00 H new ATOM 0 HG2 MET A 39 36.647 -0.827 -28.794 1.00 0.00 H new ATOM 0 HG3 MET A 39 35.628 -1.345 -30.122 1.00 0.00 H new ATOM 0 HE1 MET A 39 40.176 -0.634 -30.249 1.00 0.00 H new ATOM 0 HE2 MET A 39 39.142 0.766 -30.618 1.00 0.00 H new ATOM 0 HE3 MET A 39 39.018 -0.039 -29.036 1.00 0.00 H new ATOM 597 N ASP A 40 33.444 -0.491 -28.682 1.00 0.00 N ATOM 598 CA ASP A 40 32.266 -1.347 -28.786 1.00 0.00 C ATOM 599 C ASP A 40 31.065 -0.708 -28.107 1.00 0.00 C ATOM 600 O ASP A 40 29.933 -1.154 -28.281 1.00 0.00 O ATOM 601 CB ASP A 40 32.529 -2.728 -28.179 1.00 0.00 C ATOM 602 CG ASP A 40 33.201 -3.678 -29.149 1.00 0.00 C ATOM 603 OD1 ASP A 40 32.506 -4.224 -30.030 1.00 0.00 O ATOM 604 OD2 ASP A 40 34.421 -3.898 -29.031 1.00 0.00 O ATOM 0 H ASP A 40 34.023 -0.664 -27.860 1.00 0.00 H new ATOM 0 HA ASP A 40 32.047 -1.469 -29.847 1.00 0.00 H new ATOM 0 HB2 ASP A 40 33.155 -2.617 -27.294 1.00 0.00 H new ATOM 0 HB3 ASP A 40 31.584 -3.161 -27.849 1.00 0.00 H new ATOM 609 N VAL A 41 31.310 0.338 -27.337 1.00 0.00 N ATOM 610 CA VAL A 41 30.240 1.022 -26.629 1.00 0.00 C ATOM 611 C VAL A 41 30.141 2.474 -27.079 1.00 0.00 C ATOM 612 O VAL A 41 31.027 3.284 -26.795 1.00 0.00 O ATOM 613 CB VAL A 41 30.440 0.972 -25.099 1.00 0.00 C ATOM 614 CG1 VAL A 41 29.303 1.682 -24.381 1.00 0.00 C ATOM 615 CG2 VAL A 41 30.562 -0.466 -24.616 1.00 0.00 C ATOM 0 H VAL A 41 32.238 0.732 -27.186 1.00 0.00 H new ATOM 0 HA VAL A 41 29.314 0.501 -26.871 1.00 0.00 H new ATOM 0 HB VAL A 41 31.369 1.491 -24.864 1.00 0.00 H new ATOM 0 HG11 VAL A 41 29.466 1.634 -23.304 1.00 0.00 H new ATOM 0 HG12 VAL A 41 29.269 2.725 -24.696 1.00 0.00 H new ATOM 0 HG13 VAL A 41 28.358 1.197 -24.627 1.00 0.00 H new ATOM 0 HG21 VAL A 41 30.702 -0.476 -23.535 1.00 0.00 H new ATOM 0 HG22 VAL A 41 29.654 -1.013 -24.869 1.00 0.00 H new ATOM 0 HG23 VAL A 41 31.417 -0.940 -25.097 1.00 0.00 H new ATOM 625 N ALA A 42 29.075 2.783 -27.803 1.00 0.00 N ATOM 626 CA ALA A 42 28.816 4.142 -28.253 1.00 0.00 C ATOM 627 C ALA A 42 28.447 5.042 -27.076 1.00 0.00 C ATOM 628 O ALA A 42 27.639 4.667 -26.224 1.00 0.00 O ATOM 629 CB ALA A 42 27.711 4.142 -29.296 1.00 0.00 C ATOM 0 H ALA A 42 28.371 2.105 -28.093 1.00 0.00 H new ATOM 0 HA ALA A 42 29.725 4.538 -28.706 1.00 0.00 H new ATOM 0 HB1 ALA A 42 27.523 5.163 -29.627 1.00 0.00 H new ATOM 0 HB2 ALA A 42 28.015 3.534 -30.148 1.00 0.00 H new ATOM 0 HB3 ALA A 42 26.801 3.729 -28.862 1.00 0.00 H new ATOM 635 N ASP A 43 29.036 6.233 -27.043 1.00 0.00 N ATOM 636 CA ASP A 43 28.846 7.166 -25.930 1.00 0.00 C ATOM 637 C ASP A 43 27.414 7.694 -25.883 1.00 0.00 C ATOM 638 O ASP A 43 26.890 7.994 -24.809 1.00 0.00 O ATOM 639 CB ASP A 43 29.830 8.338 -26.034 1.00 0.00 C ATOM 640 CG ASP A 43 29.537 9.253 -27.208 1.00 0.00 C ATOM 641 OD1 ASP A 43 29.938 8.921 -28.343 1.00 0.00 O ATOM 642 OD2 ASP A 43 28.915 10.313 -27.001 1.00 0.00 O ATOM 0 H ASP A 43 29.653 6.579 -27.778 1.00 0.00 H new ATOM 0 HA ASP A 43 29.039 6.619 -25.007 1.00 0.00 H new ATOM 0 HB2 ASP A 43 29.796 8.917 -25.111 1.00 0.00 H new ATOM 0 HB3 ASP A 43 30.843 7.948 -26.128 1.00 0.00 H new ATOM 647 N ASP A 44 26.777 7.786 -27.045 1.00 0.00 N ATOM 648 CA ASP A 44 25.409 8.291 -27.134 1.00 0.00 C ATOM 649 C ASP A 44 24.445 7.300 -26.502 1.00 0.00 C ATOM 650 O ASP A 44 23.358 7.661 -26.052 1.00 0.00 O ATOM 651 CB ASP A 44 25.009 8.511 -28.595 1.00 0.00 C ATOM 652 CG ASP A 44 24.534 7.234 -29.265 1.00 0.00 C ATOM 653 OD1 ASP A 44 25.328 6.278 -29.363 1.00 0.00 O ATOM 654 OD2 ASP A 44 23.360 7.178 -29.687 1.00 0.00 O ATOM 0 H ASP A 44 27.185 7.517 -27.940 1.00 0.00 H new ATOM 0 HA ASP A 44 25.363 9.241 -26.602 1.00 0.00 H new ATOM 0 HB2 ASP A 44 24.218 9.259 -28.643 1.00 0.00 H new ATOM 0 HB3 ASP A 44 25.860 8.912 -29.145 1.00 0.00 H new ATOM 659 N SER A 45 24.866 6.047 -26.467 1.00 0.00 N ATOM 660 CA SER A 45 24.024 4.964 -26.006 1.00 0.00 C ATOM 661 C SER A 45 24.193 4.750 -24.505 1.00 0.00 C ATOM 662 O SER A 45 23.738 3.750 -23.950 1.00 0.00 O ATOM 663 CB SER A 45 24.373 3.699 -26.786 1.00 0.00 C ATOM 664 OG SER A 45 24.265 3.925 -28.187 1.00 0.00 O ATOM 0 H SER A 45 25.799 5.756 -26.757 1.00 0.00 H new ATOM 0 HA SER A 45 22.978 5.215 -26.181 1.00 0.00 H new ATOM 0 HB2 SER A 45 25.387 3.383 -26.541 1.00 0.00 H new ATOM 0 HB3 SER A 45 23.706 2.889 -26.491 1.00 0.00 H new ATOM 0 HG SER A 45 24.725 4.758 -28.420 1.00 0.00 H new ATOM 670 N ILE A 46 24.860 5.697 -23.860 1.00 0.00 N ATOM 671 CA ILE A 46 25.004 5.693 -22.415 1.00 0.00 C ATOM 672 C ILE A 46 24.180 6.830 -21.821 1.00 0.00 C ATOM 673 O ILE A 46 24.535 8.002 -21.957 1.00 0.00 O ATOM 674 CB ILE A 46 26.479 5.854 -21.981 1.00 0.00 C ATOM 675 CG1 ILE A 46 27.343 4.752 -22.602 1.00 0.00 C ATOM 676 CG2 ILE A 46 26.594 5.825 -20.461 1.00 0.00 C ATOM 677 CD1 ILE A 46 28.811 4.859 -22.247 1.00 0.00 C ATOM 0 H ILE A 46 25.314 6.485 -24.323 1.00 0.00 H new ATOM 0 HA ILE A 46 24.649 4.730 -22.048 1.00 0.00 H new ATOM 0 HB ILE A 46 26.839 6.819 -22.337 1.00 0.00 H new ATOM 0 HG12 ILE A 46 26.969 3.782 -22.276 1.00 0.00 H new ATOM 0 HG13 ILE A 46 27.237 4.786 -23.686 1.00 0.00 H new ATOM 0 HG21 ILE A 46 27.639 5.940 -20.173 1.00 0.00 H new ATOM 0 HG22 ILE A 46 26.009 6.641 -20.036 1.00 0.00 H new ATOM 0 HG23 ILE A 46 26.216 4.874 -20.086 1.00 0.00 H new ATOM 0 HD11 ILE A 46 29.360 4.046 -22.722 1.00 0.00 H new ATOM 0 HD12 ILE A 46 29.201 5.814 -22.598 1.00 0.00 H new ATOM 0 HD13 ILE A 46 28.929 4.794 -21.165 1.00 0.00 H new ATOM 689 N THR A 47 23.069 6.490 -21.193 1.00 0.00 N ATOM 690 CA THR A 47 22.200 7.489 -20.598 1.00 0.00 C ATOM 691 C THR A 47 22.080 7.272 -19.092 1.00 0.00 C ATOM 692 O THR A 47 21.606 6.227 -18.645 1.00 0.00 O ATOM 693 CB THR A 47 20.795 7.448 -21.232 1.00 0.00 C ATOM 694 OG1 THR A 47 20.900 7.510 -22.661 1.00 0.00 O ATOM 695 CG2 THR A 47 19.938 8.604 -20.736 1.00 0.00 C ATOM 0 H THR A 47 22.747 5.529 -21.082 1.00 0.00 H new ATOM 0 HA THR A 47 22.646 8.466 -20.787 1.00 0.00 H new ATOM 0 HB THR A 47 20.319 6.512 -20.939 1.00 0.00 H new ATOM 0 HG1 THR A 47 20.004 7.482 -23.056 1.00 0.00 H new ATOM 0 HG21 THR A 47 18.953 8.551 -21.199 1.00 0.00 H new ATOM 0 HG22 THR A 47 19.834 8.541 -19.653 1.00 0.00 H new ATOM 0 HG23 THR A 47 20.413 9.549 -21.001 1.00 0.00 H new ATOM 703 N PRO A 48 22.532 8.247 -18.288 1.00 0.00 N ATOM 704 CA PRO A 48 22.383 8.198 -16.832 1.00 0.00 C ATOM 705 C PRO A 48 20.923 8.013 -16.437 1.00 0.00 C ATOM 706 O PRO A 48 20.049 8.710 -16.949 1.00 0.00 O ATOM 707 CB PRO A 48 22.892 9.566 -16.367 1.00 0.00 C ATOM 708 CG PRO A 48 23.780 10.044 -17.464 1.00 0.00 C ATOM 709 CD PRO A 48 23.224 9.468 -18.737 1.00 0.00 C ATOM 0 HA PRO A 48 22.926 7.365 -16.385 1.00 0.00 H new ATOM 0 HB2 PRO A 48 22.066 10.257 -16.199 1.00 0.00 H new ATOM 0 HB3 PRO A 48 23.436 9.485 -15.426 1.00 0.00 H new ATOM 0 HG2 PRO A 48 23.796 11.133 -17.504 1.00 0.00 H new ATOM 0 HG3 PRO A 48 24.807 9.715 -17.304 1.00 0.00 H new ATOM 0 HD2 PRO A 48 22.539 10.161 -19.226 1.00 0.00 H new ATOM 0 HD3 PRO A 48 24.013 9.242 -19.454 1.00 0.00 H new ATOM 717 N THR A 49 20.659 7.084 -15.526 1.00 0.00 N ATOM 718 CA THR A 49 19.290 6.758 -15.136 1.00 0.00 C ATOM 719 C THR A 49 18.588 7.961 -14.500 1.00 0.00 C ATOM 720 O THR A 49 17.360 8.028 -14.473 1.00 0.00 O ATOM 721 CB THR A 49 19.246 5.549 -14.172 1.00 0.00 C ATOM 722 OG1 THR A 49 17.889 5.206 -13.863 1.00 0.00 O ATOM 723 CG2 THR A 49 20.002 5.843 -12.886 1.00 0.00 C ATOM 0 H THR A 49 21.375 6.542 -15.042 1.00 0.00 H new ATOM 0 HA THR A 49 18.757 6.489 -16.048 1.00 0.00 H new ATOM 0 HB THR A 49 19.727 4.709 -14.673 1.00 0.00 H new ATOM 0 HG1 THR A 49 17.875 4.549 -13.136 1.00 0.00 H new ATOM 0 HG21 THR A 49 19.953 4.975 -12.229 1.00 0.00 H new ATOM 0 HG22 THR A 49 21.044 6.064 -13.119 1.00 0.00 H new ATOM 0 HG23 THR A 49 19.552 6.701 -12.387 1.00 0.00 H new ATOM 731 N SER A 50 19.378 8.915 -14.018 1.00 0.00 N ATOM 732 CA SER A 50 18.852 10.143 -13.434 1.00 0.00 C ATOM 733 C SER A 50 18.131 10.979 -14.493 1.00 0.00 C ATOM 734 O SER A 50 17.268 11.797 -14.179 1.00 0.00 O ATOM 735 CB SER A 50 20.008 10.949 -12.844 1.00 0.00 C ATOM 736 OG SER A 50 21.033 10.084 -12.377 1.00 0.00 O ATOM 0 H SER A 50 20.396 8.859 -14.021 1.00 0.00 H new ATOM 0 HA SER A 50 18.137 9.887 -12.652 1.00 0.00 H new ATOM 0 HB2 SER A 50 20.410 11.624 -13.599 1.00 0.00 H new ATOM 0 HB3 SER A 50 19.645 11.568 -12.024 1.00 0.00 H new ATOM 0 HG SER A 50 20.663 9.470 -11.709 1.00 0.00 H new ATOM 742 N GLU A 51 18.501 10.765 -15.749 1.00 0.00 N ATOM 743 CA GLU A 51 17.935 11.516 -16.860 1.00 0.00 C ATOM 744 C GLU A 51 17.166 10.587 -17.797 1.00 0.00 C ATOM 745 O GLU A 51 16.333 11.030 -18.583 1.00 0.00 O ATOM 746 CB GLU A 51 19.058 12.222 -17.622 1.00 0.00 C ATOM 747 CG GLU A 51 18.580 13.106 -18.759 1.00 0.00 C ATOM 748 CD GLU A 51 19.729 13.691 -19.546 1.00 0.00 C ATOM 749 OE1 GLU A 51 20.247 13.000 -20.447 1.00 0.00 O ATOM 750 OE2 GLU A 51 20.128 14.836 -19.259 1.00 0.00 O ATOM 0 H GLU A 51 19.196 10.071 -16.024 1.00 0.00 H new ATOM 0 HA GLU A 51 17.240 12.259 -16.469 1.00 0.00 H new ATOM 0 HB2 GLU A 51 19.631 12.829 -16.921 1.00 0.00 H new ATOM 0 HB3 GLU A 51 19.738 11.470 -18.023 1.00 0.00 H new ATOM 0 HG2 GLU A 51 17.943 12.525 -19.426 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.968 13.914 -18.357 1.00 0.00 H new ATOM 757 N PHE A 52 17.449 9.293 -17.694 1.00 0.00 N ATOM 758 CA PHE A 52 16.839 8.291 -18.562 1.00 0.00 C ATOM 759 C PHE A 52 15.322 8.287 -18.430 1.00 0.00 C ATOM 760 O PHE A 52 14.608 8.137 -19.416 1.00 0.00 O ATOM 761 CB PHE A 52 17.394 6.900 -18.237 1.00 0.00 C ATOM 762 CG PHE A 52 16.818 5.805 -19.090 1.00 0.00 C ATOM 763 CD1 PHE A 52 17.252 5.628 -20.394 1.00 0.00 C ATOM 764 CD2 PHE A 52 15.846 4.952 -18.589 1.00 0.00 C ATOM 765 CE1 PHE A 52 16.727 4.622 -21.181 1.00 0.00 C ATOM 766 CE2 PHE A 52 15.319 3.946 -19.373 1.00 0.00 C ATOM 767 CZ PHE A 52 15.760 3.780 -20.670 1.00 0.00 C ATOM 0 H PHE A 52 18.103 8.910 -17.011 1.00 0.00 H new ATOM 0 HA PHE A 52 17.088 8.549 -19.591 1.00 0.00 H new ATOM 0 HB2 PHE A 52 18.477 6.913 -18.360 1.00 0.00 H new ATOM 0 HB3 PHE A 52 17.195 6.675 -17.189 1.00 0.00 H new ATOM 0 HD1 PHE A 52 18.009 6.284 -20.799 1.00 0.00 H new ATOM 0 HD2 PHE A 52 15.498 5.076 -17.574 1.00 0.00 H new ATOM 0 HE1 PHE A 52 17.073 4.494 -22.196 1.00 0.00 H new ATOM 0 HE2 PHE A 52 14.562 3.289 -18.972 1.00 0.00 H new ATOM 0 HZ PHE A 52 15.349 2.992 -21.284 1.00 0.00 H new ATOM 777 N VAL A 53 14.830 8.462 -17.214 1.00 0.00 N ATOM 778 CA VAL A 53 13.394 8.423 -16.968 1.00 0.00 C ATOM 779 C VAL A 53 12.705 9.691 -17.467 1.00 0.00 C ATOM 780 O VAL A 53 11.476 9.753 -17.539 1.00 0.00 O ATOM 781 CB VAL A 53 13.080 8.213 -15.475 1.00 0.00 C ATOM 782 CG1 VAL A 53 13.608 6.867 -15.007 1.00 0.00 C ATOM 783 CG2 VAL A 53 13.664 9.338 -14.630 1.00 0.00 C ATOM 0 H VAL A 53 15.399 8.632 -16.385 1.00 0.00 H new ATOM 0 HA VAL A 53 13.004 7.572 -17.527 1.00 0.00 H new ATOM 0 HB VAL A 53 11.997 8.226 -15.351 1.00 0.00 H new ATOM 0 HG11 VAL A 53 13.378 6.734 -13.950 1.00 0.00 H new ATOM 0 HG12 VAL A 53 13.137 6.071 -15.584 1.00 0.00 H new ATOM 0 HG13 VAL A 53 14.688 6.830 -15.151 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.428 9.165 -13.580 1.00 0.00 H new ATOM 0 HG22 VAL A 53 14.746 9.366 -14.759 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.237 10.290 -14.946 1.00 0.00 H new ATOM 793 N TRP A 54 13.500 10.689 -17.830 1.00 0.00 N ATOM 794 CA TRP A 54 12.969 11.951 -18.311 1.00 0.00 C ATOM 795 C TRP A 54 13.026 12.022 -19.828 1.00 0.00 C ATOM 796 O TRP A 54 14.101 11.993 -20.424 1.00 0.00 O ATOM 797 CB TRP A 54 13.743 13.127 -17.714 1.00 0.00 C ATOM 798 CG TRP A 54 13.539 13.283 -16.243 1.00 0.00 C ATOM 799 CD1 TRP A 54 14.383 12.885 -15.249 1.00 0.00 C ATOM 800 CD2 TRP A 54 12.407 13.877 -15.598 1.00 0.00 C ATOM 801 NE1 TRP A 54 13.849 13.202 -14.025 1.00 0.00 N ATOM 802 CE2 TRP A 54 12.636 13.812 -14.213 1.00 0.00 C ATOM 803 CE3 TRP A 54 11.224 14.463 -16.061 1.00 0.00 C ATOM 804 CZ2 TRP A 54 11.724 14.310 -13.286 1.00 0.00 C ATOM 805 CZ3 TRP A 54 10.321 14.956 -15.140 1.00 0.00 C ATOM 806 CH2 TRP A 54 10.576 14.877 -13.767 1.00 0.00 C ATOM 0 H TRP A 54 14.519 10.645 -17.799 1.00 0.00 H new ATOM 0 HA TRP A 54 11.928 12.013 -17.995 1.00 0.00 H new ATOM 0 HB2 TRP A 54 14.806 12.992 -17.914 1.00 0.00 H new ATOM 0 HB3 TRP A 54 13.438 14.046 -18.215 1.00 0.00 H new ATOM 0 HD1 TRP A 54 15.332 12.393 -15.402 1.00 0.00 H new ATOM 0 HE1 TRP A 54 14.284 13.014 -13.122 1.00 0.00 H new ATOM 0 HE3 TRP A 54 11.021 14.529 -17.120 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 11.916 14.251 -12.225 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 9.404 15.410 -15.485 1.00 0.00 H new ATOM 0 HH2 TRP A 54 9.851 15.272 -13.071 1.00 0.00 H new ATOM 817 N SER A 55 11.865 12.109 -20.447 1.00 0.00 N ATOM 818 CA SER A 55 11.787 12.291 -21.880 1.00 0.00 C ATOM 819 C SER A 55 11.849 13.778 -22.203 1.00 0.00 C ATOM 820 O SER A 55 10.987 14.555 -21.778 1.00 0.00 O ATOM 821 CB SER A 55 10.497 11.679 -22.421 1.00 0.00 C ATOM 822 OG SER A 55 10.371 10.328 -22.011 1.00 0.00 O ATOM 0 H SER A 55 10.961 12.056 -19.977 1.00 0.00 H new ATOM 0 HA SER A 55 12.628 11.787 -22.356 1.00 0.00 H new ATOM 0 HB2 SER A 55 9.640 12.253 -22.067 1.00 0.00 H new ATOM 0 HB3 SER A 55 10.491 11.736 -23.510 1.00 0.00 H new ATOM 0 HG SER A 55 9.537 9.955 -22.366 1.00 0.00 H new ATOM 828 N SER A 56 12.881 14.176 -22.925 1.00 0.00 N ATOM 829 CA SER A 56 13.074 15.569 -23.262 1.00 0.00 C ATOM 830 C SER A 56 12.186 15.966 -24.437 1.00 0.00 C ATOM 831 O SER A 56 12.333 15.455 -25.549 1.00 0.00 O ATOM 832 CB SER A 56 14.549 15.828 -23.572 1.00 0.00 C ATOM 833 OG SER A 56 15.071 14.855 -24.467 1.00 0.00 O ATOM 0 H SER A 56 13.599 13.549 -23.289 1.00 0.00 H new ATOM 0 HA SER A 56 12.787 16.184 -22.409 1.00 0.00 H new ATOM 0 HB2 SER A 56 14.662 16.821 -24.006 1.00 0.00 H new ATOM 0 HB3 SER A 56 15.124 15.818 -22.646 1.00 0.00 H new ATOM 0 HG SER A 56 14.421 14.684 -25.180 1.00 0.00 H new ATOM 839 N VAL A 57 11.244 16.860 -24.175 1.00 0.00 N ATOM 840 CA VAL A 57 10.337 17.334 -25.209 1.00 0.00 C ATOM 841 C VAL A 57 10.693 18.758 -25.620 1.00 0.00 C ATOM 842 O VAL A 57 10.262 19.246 -26.663 1.00 0.00 O ATOM 843 CB VAL A 57 8.866 17.276 -24.741 1.00 0.00 C ATOM 844 CG1 VAL A 57 8.467 15.844 -24.422 1.00 0.00 C ATOM 845 CG2 VAL A 57 8.639 18.175 -23.532 1.00 0.00 C ATOM 0 H VAL A 57 11.088 17.272 -23.255 1.00 0.00 H new ATOM 0 HA VAL A 57 10.447 16.674 -26.069 1.00 0.00 H new ATOM 0 HB VAL A 57 8.238 17.641 -25.554 1.00 0.00 H new ATOM 0 HG11 VAL A 57 7.428 15.820 -24.094 1.00 0.00 H new ATOM 0 HG12 VAL A 57 8.580 15.228 -25.314 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.107 15.456 -23.629 1.00 0.00 H new ATOM 0 HG21 VAL A 57 7.595 18.114 -23.224 1.00 0.00 H new ATOM 0 HG22 VAL A 57 9.279 17.850 -22.712 1.00 0.00 H new ATOM 0 HG23 VAL A 57 8.881 19.205 -23.794 1.00 0.00 H new ATOM 855 N ARG A 58 11.484 19.413 -24.782 1.00 0.00 N ATOM 856 CA ARG A 58 11.944 20.771 -25.039 1.00 0.00 C ATOM 857 C ARG A 58 13.344 20.946 -24.484 1.00 0.00 C ATOM 858 O ARG A 58 14.329 20.943 -25.224 1.00 0.00 O ATOM 859 CB ARG A 58 11.023 21.802 -24.370 1.00 0.00 C ATOM 860 CG ARG A 58 9.644 21.916 -24.989 1.00 0.00 C ATOM 861 CD ARG A 58 9.715 22.446 -26.408 1.00 0.00 C ATOM 862 NE ARG A 58 8.392 22.596 -27.005 1.00 0.00 N ATOM 863 CZ ARG A 58 8.166 23.217 -28.158 1.00 0.00 C ATOM 864 NH1 ARG A 58 9.164 23.805 -28.809 1.00 0.00 N ATOM 865 NH2 ARG A 58 6.933 23.270 -28.642 1.00 0.00 N ATOM 0 H ARG A 58 11.825 19.019 -23.905 1.00 0.00 H new ATOM 0 HA ARG A 58 11.935 20.931 -26.117 1.00 0.00 H new ATOM 0 HB2 ARG A 58 10.913 21.542 -23.317 1.00 0.00 H new ATOM 0 HB3 ARG A 58 11.505 22.779 -24.408 1.00 0.00 H new ATOM 0 HG2 ARG A 58 9.161 20.939 -24.988 1.00 0.00 H new ATOM 0 HG3 ARG A 58 9.025 22.578 -24.383 1.00 0.00 H new ATOM 0 HD2 ARG A 58 10.224 23.410 -26.409 1.00 0.00 H new ATOM 0 HD3 ARG A 58 10.313 21.769 -27.018 1.00 0.00 H new ATOM 0 HE ARG A 58 7.594 22.201 -26.508 1.00 0.00 H new ATOM 0 HH11 ARG A 58 10.108 23.781 -28.424 1.00 0.00 H new ATOM 0 HH12 ARG A 58 8.986 24.280 -29.694 1.00 0.00 H new ATOM 0 HH21 ARG A 58 6.165 22.836 -28.130 1.00 0.00 H new ATOM 0 HH22 ARG A 58 6.752 23.745 -29.526 1.00 0.00 H new ATOM 879 N ASP A 59 13.392 21.065 -23.161 1.00 0.00 N ATOM 880 CA ASP A 59 14.613 21.325 -22.403 1.00 0.00 C ATOM 881 C ASP A 59 14.210 21.801 -21.022 1.00 0.00 C ATOM 882 O ASP A 59 14.615 21.247 -20.002 1.00 0.00 O ATOM 883 CB ASP A 59 15.472 22.400 -23.068 1.00 0.00 C ATOM 884 CG ASP A 59 16.728 22.702 -22.275 1.00 0.00 C ATOM 885 OD1 ASP A 59 17.633 21.843 -22.239 1.00 0.00 O ATOM 886 OD2 ASP A 59 16.810 23.798 -21.676 1.00 0.00 O ATOM 0 H ASP A 59 12.564 20.981 -22.571 1.00 0.00 H new ATOM 0 HA ASP A 59 15.202 20.409 -22.356 1.00 0.00 H new ATOM 0 HB2 ASP A 59 15.747 22.073 -24.071 1.00 0.00 H new ATOM 0 HB3 ASP A 59 14.887 23.313 -23.179 1.00 0.00 H new ATOM 891 N ASP A 60 13.378 22.833 -21.017 1.00 0.00 N ATOM 892 CA ASP A 60 12.800 23.362 -19.794 1.00 0.00 C ATOM 893 C ASP A 60 11.703 22.421 -19.324 1.00 0.00 C ATOM 894 O ASP A 60 11.536 22.174 -18.132 1.00 0.00 O ATOM 895 CB ASP A 60 12.219 24.752 -20.065 1.00 0.00 C ATOM 896 CG ASP A 60 11.927 25.539 -18.805 1.00 0.00 C ATOM 897 OD1 ASP A 60 10.879 25.302 -18.177 1.00 0.00 O ATOM 898 OD2 ASP A 60 12.746 26.420 -18.455 1.00 0.00 O ATOM 0 H ASP A 60 13.086 23.325 -21.861 1.00 0.00 H new ATOM 0 HA ASP A 60 13.565 23.444 -19.022 1.00 0.00 H new ATOM 0 HB2 ASP A 60 12.918 25.316 -20.682 1.00 0.00 H new ATOM 0 HB3 ASP A 60 11.299 24.647 -20.640 1.00 0.00 H new ATOM 903 N VAL A 61 10.972 21.882 -20.294 1.00 0.00 N ATOM 904 CA VAL A 61 9.897 20.941 -20.023 1.00 0.00 C ATOM 905 C VAL A 61 10.378 19.507 -20.235 1.00 0.00 C ATOM 906 O VAL A 61 10.905 19.173 -21.301 1.00 0.00 O ATOM 907 CB VAL A 61 8.679 21.191 -20.941 1.00 0.00 C ATOM 908 CG1 VAL A 61 7.437 20.492 -20.400 1.00 0.00 C ATOM 909 CG2 VAL A 61 8.433 22.682 -21.125 1.00 0.00 C ATOM 0 H VAL A 61 11.109 22.085 -21.284 1.00 0.00 H new ATOM 0 HA VAL A 61 9.597 21.088 -18.986 1.00 0.00 H new ATOM 0 HB VAL A 61 8.902 20.766 -21.920 1.00 0.00 H new ATOM 0 HG11 VAL A 61 6.594 20.683 -21.064 1.00 0.00 H new ATOM 0 HG12 VAL A 61 7.619 19.419 -20.344 1.00 0.00 H new ATOM 0 HG13 VAL A 61 7.209 20.874 -19.405 1.00 0.00 H new ATOM 0 HG21 VAL A 61 7.571 22.831 -21.775 1.00 0.00 H new ATOM 0 HG22 VAL A 61 8.240 23.141 -20.155 1.00 0.00 H new ATOM 0 HG23 VAL A 61 9.312 23.143 -21.577 1.00 0.00 H new ATOM 919 N MET A 62 10.208 18.672 -19.220 1.00 0.00 N ATOM 920 CA MET A 62 10.546 17.255 -19.316 1.00 0.00 C ATOM 921 C MET A 62 9.393 16.411 -18.787 1.00 0.00 C ATOM 922 O MET A 62 8.709 16.814 -17.850 1.00 0.00 O ATOM 923 CB MET A 62 11.819 16.937 -18.523 1.00 0.00 C ATOM 924 CG MET A 62 13.074 17.606 -19.062 1.00 0.00 C ATOM 925 SD MET A 62 14.545 17.182 -18.108 1.00 0.00 S ATOM 926 CE MET A 62 15.799 18.112 -18.986 1.00 0.00 C ATOM 0 H MET A 62 9.835 18.952 -18.313 1.00 0.00 H new ATOM 0 HA MET A 62 10.724 17.019 -20.365 1.00 0.00 H new ATOM 0 HB2 MET A 62 11.674 17.243 -17.487 1.00 0.00 H new ATOM 0 HB3 MET A 62 11.970 15.858 -18.518 1.00 0.00 H new ATOM 0 HG2 MET A 62 13.221 17.312 -20.101 1.00 0.00 H new ATOM 0 HG3 MET A 62 12.938 18.687 -19.053 1.00 0.00 H new ATOM 0 HE1 MET A 62 16.782 17.869 -18.582 1.00 0.00 H new ATOM 0 HE2 MET A 62 15.769 17.854 -20.045 1.00 0.00 H new ATOM 0 HE3 MET A 62 15.611 19.179 -18.867 1.00 0.00 H new ATOM 936 N ARG A 63 9.168 15.254 -19.389 1.00 0.00 N ATOM 937 CA ARG A 63 8.098 14.369 -18.944 1.00 0.00 C ATOM 938 C ARG A 63 8.661 13.066 -18.398 1.00 0.00 C ATOM 939 O ARG A 63 9.658 12.551 -18.905 1.00 0.00 O ATOM 940 CB ARG A 63 7.107 14.084 -20.077 1.00 0.00 C ATOM 941 CG ARG A 63 7.758 13.640 -21.378 1.00 0.00 C ATOM 942 CD ARG A 63 6.722 13.153 -22.381 1.00 0.00 C ATOM 943 NE ARG A 63 5.653 14.130 -22.598 1.00 0.00 N ATOM 944 CZ ARG A 63 4.360 13.811 -22.647 1.00 0.00 C ATOM 945 NH1 ARG A 63 3.986 12.538 -22.586 1.00 0.00 N ATOM 946 NH2 ARG A 63 3.443 14.762 -22.785 1.00 0.00 N ATOM 0 H ARG A 63 9.707 14.905 -20.182 1.00 0.00 H new ATOM 0 HA ARG A 63 7.564 14.879 -18.142 1.00 0.00 H new ATOM 0 HB2 ARG A 63 6.411 13.312 -19.750 1.00 0.00 H new ATOM 0 HB3 ARG A 63 6.520 14.983 -20.266 1.00 0.00 H new ATOM 0 HG2 ARG A 63 8.320 14.470 -21.807 1.00 0.00 H new ATOM 0 HG3 ARG A 63 8.473 12.843 -21.175 1.00 0.00 H new ATOM 0 HD2 ARG A 63 7.212 12.938 -23.330 1.00 0.00 H new ATOM 0 HD3 ARG A 63 6.289 12.217 -22.027 1.00 0.00 H new ATOM 0 HE ARG A 63 5.912 15.109 -22.718 1.00 0.00 H new ATOM 0 HH11 ARG A 63 4.689 11.803 -22.502 1.00 0.00 H new ATOM 0 HH12 ARG A 63 2.996 12.295 -22.624 1.00 0.00 H new ATOM 0 HH21 ARG A 63 3.728 15.739 -22.854 1.00 0.00 H new ATOM 0 HH22 ARG A 63 2.454 14.515 -22.822 1.00 0.00 H new ATOM 960 N LEU A 64 8.020 12.544 -17.364 1.00 0.00 N ATOM 961 CA LEU A 64 8.453 11.305 -16.738 1.00 0.00 C ATOM 962 C LEU A 64 7.828 10.119 -17.466 1.00 0.00 C ATOM 963 O LEU A 64 6.606 9.966 -17.489 1.00 0.00 O ATOM 964 CB LEU A 64 8.050 11.301 -15.254 1.00 0.00 C ATOM 965 CG LEU A 64 8.911 10.438 -14.315 1.00 0.00 C ATOM 966 CD1 LEU A 64 8.797 8.957 -14.645 1.00 0.00 C ATOM 967 CD2 LEU A 64 10.362 10.882 -14.371 1.00 0.00 C ATOM 0 H LEU A 64 7.193 12.963 -16.939 1.00 0.00 H new ATOM 0 HA LEU A 64 9.538 11.224 -16.802 1.00 0.00 H new ATOM 0 HB2 LEU A 64 8.073 12.328 -14.891 1.00 0.00 H new ATOM 0 HB3 LEU A 64 7.017 10.960 -15.181 1.00 0.00 H new ATOM 0 HG LEU A 64 8.534 10.579 -13.302 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.420 8.382 -13.959 1.00 0.00 H new ATOM 0 HD12 LEU A 64 7.759 8.641 -14.544 1.00 0.00 H new ATOM 0 HD13 LEU A 64 9.131 8.786 -15.668 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.958 10.262 -13.701 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.735 10.778 -15.390 1.00 0.00 H new ATOM 0 HD23 LEU A 64 10.436 11.925 -14.062 1.00 0.00 H new ATOM 979 N GLY A 65 8.668 9.293 -18.069 1.00 0.00 N ATOM 980 CA GLY A 65 8.181 8.130 -18.781 1.00 0.00 C ATOM 981 C GLY A 65 8.156 6.898 -17.901 1.00 0.00 C ATOM 982 O GLY A 65 9.178 6.508 -17.341 1.00 0.00 O ATOM 0 H GLY A 65 9.682 9.407 -18.078 1.00 0.00 H new ATOM 0 HA2 GLY A 65 7.177 8.328 -19.156 1.00 0.00 H new ATOM 0 HA3 GLY A 65 8.815 7.944 -19.648 1.00 0.00 H new ATOM 986 N ARG A 66 6.990 6.299 -17.745 1.00 0.00 N ATOM 987 CA ARG A 66 6.865 5.109 -16.915 1.00 0.00 C ATOM 988 C ARG A 66 7.525 3.908 -17.577 1.00 0.00 C ATOM 989 O ARG A 66 8.121 3.064 -16.909 1.00 0.00 O ATOM 990 CB ARG A 66 5.398 4.780 -16.641 1.00 0.00 C ATOM 991 CG ARG A 66 4.554 5.970 -16.231 1.00 0.00 C ATOM 992 CD ARG A 66 3.077 5.617 -16.251 1.00 0.00 C ATOM 993 NE ARG A 66 2.677 5.043 -17.537 1.00 0.00 N ATOM 994 CZ ARG A 66 1.805 5.611 -18.368 1.00 0.00 C ATOM 995 NH1 ARG A 66 1.258 6.778 -18.068 1.00 0.00 N ATOM 996 NH2 ARG A 66 1.489 5.016 -19.509 1.00 0.00 N ATOM 0 H ARG A 66 6.121 6.612 -18.177 1.00 0.00 H new ATOM 0 HA ARG A 66 7.368 5.323 -15.972 1.00 0.00 H new ATOM 0 HB2 ARG A 66 4.965 4.335 -17.537 1.00 0.00 H new ATOM 0 HB3 ARG A 66 5.348 4.027 -15.855 1.00 0.00 H new ATOM 0 HG2 ARG A 66 4.841 6.298 -15.232 1.00 0.00 H new ATOM 0 HG3 ARG A 66 4.742 6.805 -16.906 1.00 0.00 H new ATOM 0 HD2 ARG A 66 2.861 4.907 -15.452 1.00 0.00 H new ATOM 0 HD3 ARG A 66 2.486 6.511 -16.051 1.00 0.00 H new ATOM 0 HE ARG A 66 3.092 4.153 -17.814 1.00 0.00 H new ATOM 0 HH11 ARG A 66 1.504 7.247 -17.196 1.00 0.00 H new ATOM 0 HH12 ARG A 66 0.591 7.208 -18.708 1.00 0.00 H new ATOM 0 HH21 ARG A 66 1.914 4.121 -19.752 1.00 0.00 H new ATOM 0 HH22 ARG A 66 0.821 5.453 -20.144 1.00 0.00 H new ATOM 1010 N GLU A 67 7.400 3.844 -18.898 1.00 0.00 N ATOM 1011 CA GLU A 67 7.922 2.729 -19.688 1.00 0.00 C ATOM 1012 C GLU A 67 9.421 2.554 -19.469 1.00 0.00 C ATOM 1013 O GLU A 67 9.971 1.467 -19.648 1.00 0.00 O ATOM 1014 CB GLU A 67 7.619 2.968 -21.165 1.00 0.00 C ATOM 1015 CG GLU A 67 6.132 3.091 -21.453 1.00 0.00 C ATOM 1016 CD GLU A 67 5.835 3.384 -22.907 1.00 0.00 C ATOM 1017 OE1 GLU A 67 5.976 2.468 -23.744 1.00 0.00 O ATOM 1018 OE2 GLU A 67 5.448 4.529 -23.220 1.00 0.00 O ATOM 0 H GLU A 67 6.935 4.562 -19.453 1.00 0.00 H new ATOM 0 HA GLU A 67 7.433 1.810 -19.364 1.00 0.00 H new ATOM 0 HB2 GLU A 67 8.123 3.878 -21.491 1.00 0.00 H new ATOM 0 HB3 GLU A 67 8.031 2.147 -21.752 1.00 0.00 H new ATOM 0 HG2 GLU A 67 5.634 2.165 -21.165 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.712 3.884 -20.835 1.00 0.00 H new ATOM 1025 N GLN A 68 10.060 3.636 -19.061 1.00 0.00 N ATOM 1026 CA GLN A 68 11.486 3.645 -18.771 1.00 0.00 C ATOM 1027 C GLN A 68 11.784 2.697 -17.613 1.00 0.00 C ATOM 1028 O GLN A 68 12.743 1.930 -17.648 1.00 0.00 O ATOM 1029 CB GLN A 68 11.930 5.060 -18.393 1.00 0.00 C ATOM 1030 CG GLN A 68 11.313 6.152 -19.254 1.00 0.00 C ATOM 1031 CD GLN A 68 11.805 6.142 -20.690 1.00 0.00 C ATOM 1032 OE1 GLN A 68 11.215 5.490 -21.552 1.00 0.00 O ATOM 1033 NE2 GLN A 68 12.883 6.856 -20.965 1.00 0.00 N ATOM 0 H GLN A 68 9.604 4.538 -18.920 1.00 0.00 H new ATOM 0 HA GLN A 68 12.030 3.318 -19.658 1.00 0.00 H new ATOM 0 HB2 GLN A 68 11.672 5.244 -17.350 1.00 0.00 H new ATOM 0 HB3 GLN A 68 13.016 5.122 -18.469 1.00 0.00 H new ATOM 0 HG2 GLN A 68 10.229 6.038 -19.249 1.00 0.00 H new ATOM 0 HG3 GLN A 68 11.534 7.122 -18.809 1.00 0.00 H new ATOM 0 HE21 GLN A 68 13.347 7.384 -20.226 1.00 0.00 H new ATOM 0 HE22 GLN A 68 13.251 6.879 -21.916 1.00 0.00 H new ATOM 1042 N LEU A 69 10.929 2.750 -16.597 1.00 0.00 N ATOM 1043 CA LEU A 69 11.069 1.907 -15.416 1.00 0.00 C ATOM 1044 C LEU A 69 10.750 0.458 -15.762 1.00 0.00 C ATOM 1045 O LEU A 69 11.278 -0.474 -15.155 1.00 0.00 O ATOM 1046 CB LEU A 69 10.138 2.400 -14.305 1.00 0.00 C ATOM 1047 CG LEU A 69 10.367 3.845 -13.858 1.00 0.00 C ATOM 1048 CD1 LEU A 69 9.276 4.281 -12.894 1.00 0.00 C ATOM 1049 CD2 LEU A 69 11.736 3.995 -13.212 1.00 0.00 C ATOM 0 H LEU A 69 10.124 3.375 -16.569 1.00 0.00 H new ATOM 0 HA LEU A 69 12.099 1.964 -15.065 1.00 0.00 H new ATOM 0 HB2 LEU A 69 9.107 2.301 -14.646 1.00 0.00 H new ATOM 0 HB3 LEU A 69 10.252 1.746 -13.440 1.00 0.00 H new ATOM 0 HG LEU A 69 10.330 4.487 -14.738 1.00 0.00 H new ATOM 0 HD11 LEU A 69 9.454 5.311 -12.585 1.00 0.00 H new ATOM 0 HD12 LEU A 69 8.306 4.212 -13.387 1.00 0.00 H new ATOM 0 HD13 LEU A 69 9.285 3.633 -12.017 1.00 0.00 H new ATOM 0 HD21 LEU A 69 11.880 5.030 -12.901 1.00 0.00 H new ATOM 0 HD22 LEU A 69 11.801 3.342 -12.342 1.00 0.00 H new ATOM 0 HD23 LEU A 69 12.509 3.721 -13.930 1.00 0.00 H new ATOM 1061 N GLN A 70 9.888 0.278 -16.756 1.00 0.00 N ATOM 1062 CA GLN A 70 9.527 -1.051 -17.226 1.00 0.00 C ATOM 1063 C GLN A 70 10.709 -1.714 -17.927 1.00 0.00 C ATOM 1064 O GLN A 70 10.770 -2.936 -18.041 1.00 0.00 O ATOM 1065 CB GLN A 70 8.312 -0.980 -18.152 1.00 0.00 C ATOM 1066 CG GLN A 70 7.032 -0.616 -17.416 1.00 0.00 C ATOM 1067 CD GLN A 70 5.823 -0.520 -18.325 1.00 0.00 C ATOM 1068 OE1 GLN A 70 5.493 0.554 -18.833 1.00 0.00 O ATOM 1069 NE2 GLN A 70 5.157 -1.644 -18.538 1.00 0.00 N ATOM 0 H GLN A 70 9.426 1.040 -17.252 1.00 0.00 H new ATOM 0 HA GLN A 70 9.262 -1.662 -16.363 1.00 0.00 H new ATOM 0 HB2 GLN A 70 8.499 -0.243 -18.933 1.00 0.00 H new ATOM 0 HB3 GLN A 70 8.181 -1.943 -18.646 1.00 0.00 H new ATOM 0 HG2 GLN A 70 6.840 -1.362 -16.645 1.00 0.00 H new ATOM 0 HG3 GLN A 70 7.172 0.338 -16.908 1.00 0.00 H new ATOM 0 HE21 GLN A 70 5.465 -2.511 -18.097 1.00 0.00 H new ATOM 0 HE22 GLN A 70 4.336 -1.643 -19.143 1.00 0.00 H new ATOM 1078 N ILE A 71 11.642 -0.900 -18.396 1.00 0.00 N ATOM 1079 CA ILE A 71 12.890 -1.404 -18.949 1.00 0.00 C ATOM 1080 C ILE A 71 13.814 -1.865 -17.822 1.00 0.00 C ATOM 1081 O ILE A 71 14.511 -2.871 -17.941 1.00 0.00 O ATOM 1082 CB ILE A 71 13.607 -0.326 -19.793 1.00 0.00 C ATOM 1083 CG1 ILE A 71 12.695 0.159 -20.921 1.00 0.00 C ATOM 1084 CG2 ILE A 71 14.915 -0.865 -20.361 1.00 0.00 C ATOM 1085 CD1 ILE A 71 13.281 1.297 -21.727 1.00 0.00 C ATOM 0 H ILE A 71 11.558 0.117 -18.405 1.00 0.00 H new ATOM 0 HA ILE A 71 12.651 -2.247 -19.598 1.00 0.00 H new ATOM 0 HB ILE A 71 13.840 0.518 -19.144 1.00 0.00 H new ATOM 0 HG12 ILE A 71 12.482 -0.676 -21.589 1.00 0.00 H new ATOM 0 HG13 ILE A 71 11.744 0.478 -20.496 1.00 0.00 H new ATOM 0 HG21 ILE A 71 15.402 -0.089 -20.951 1.00 0.00 H new ATOM 0 HG22 ILE A 71 15.571 -1.164 -19.543 1.00 0.00 H new ATOM 0 HG23 ILE A 71 14.708 -1.727 -20.995 1.00 0.00 H new ATOM 0 HD11 ILE A 71 12.579 1.588 -22.509 1.00 0.00 H new ATOM 0 HD12 ILE A 71 13.469 2.148 -21.072 1.00 0.00 H new ATOM 0 HD13 ILE A 71 14.218 0.976 -22.182 1.00 0.00 H new ATOM 1097 N LEU A 72 13.784 -1.126 -16.718 1.00 0.00 N ATOM 1098 CA LEU A 72 14.679 -1.371 -15.590 1.00 0.00 C ATOM 1099 C LEU A 72 14.250 -2.594 -14.777 1.00 0.00 C ATOM 1100 O LEU A 72 15.087 -3.284 -14.190 1.00 0.00 O ATOM 1101 CB LEU A 72 14.726 -0.141 -14.680 1.00 0.00 C ATOM 1102 CG LEU A 72 15.120 1.169 -15.369 1.00 0.00 C ATOM 1103 CD1 LEU A 72 15.112 2.318 -14.372 1.00 0.00 C ATOM 1104 CD2 LEU A 72 16.486 1.041 -16.027 1.00 0.00 C ATOM 0 H LEU A 72 13.143 -0.345 -16.579 1.00 0.00 H new ATOM 0 HA LEU A 72 15.671 -1.569 -15.997 1.00 0.00 H new ATOM 0 HB2 LEU A 72 13.745 -0.011 -14.222 1.00 0.00 H new ATOM 0 HB3 LEU A 72 15.432 -0.334 -13.872 1.00 0.00 H new ATOM 0 HG LEU A 72 14.386 1.382 -16.146 1.00 0.00 H new ATOM 0 HD11 LEU A 72 15.394 3.241 -14.878 1.00 0.00 H new ATOM 0 HD12 LEU A 72 14.113 2.427 -13.950 1.00 0.00 H new ATOM 0 HD13 LEU A 72 15.823 2.111 -13.572 1.00 0.00 H new ATOM 0 HD21 LEU A 72 16.747 1.982 -16.511 1.00 0.00 H new ATOM 0 HD22 LEU A 72 17.233 0.803 -15.270 1.00 0.00 H new ATOM 0 HD23 LEU A 72 16.458 0.246 -16.772 1.00 0.00 H new ATOM 1116 N LEU A 73 12.947 -2.860 -14.736 1.00 0.00 N ATOM 1117 CA LEU A 73 12.430 -3.995 -13.974 1.00 0.00 C ATOM 1118 C LEU A 73 12.930 -5.318 -14.551 1.00 0.00 C ATOM 1119 O LEU A 73 12.967 -6.330 -13.852 1.00 0.00 O ATOM 1120 CB LEU A 73 10.892 -3.959 -13.859 1.00 0.00 C ATOM 1121 CG LEU A 73 10.084 -3.991 -15.164 1.00 0.00 C ATOM 1122 CD1 LEU A 73 9.993 -5.402 -15.724 1.00 0.00 C ATOM 1123 CD2 LEU A 73 8.689 -3.429 -14.927 1.00 0.00 C ATOM 0 H LEU A 73 12.235 -2.311 -15.217 1.00 0.00 H new ATOM 0 HA LEU A 73 12.819 -3.913 -12.959 1.00 0.00 H new ATOM 0 HB2 LEU A 73 10.580 -4.807 -13.249 1.00 0.00 H new ATOM 0 HB3 LEU A 73 10.616 -3.056 -13.314 1.00 0.00 H new ATOM 0 HG LEU A 73 10.601 -3.372 -15.897 1.00 0.00 H new ATOM 0 HD11 LEU A 73 9.415 -5.390 -16.648 1.00 0.00 H new ATOM 0 HD12 LEU A 73 10.996 -5.778 -15.928 1.00 0.00 H new ATOM 0 HD13 LEU A 73 9.503 -6.051 -14.998 1.00 0.00 H new ATOM 0 HD21 LEU A 73 8.123 -3.456 -15.858 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.178 -4.029 -14.174 1.00 0.00 H new ATOM 0 HD23 LEU A 73 8.766 -2.399 -14.579 1.00 0.00 H new ATOM 1135 N GLU A 74 13.300 -5.303 -15.833 1.00 0.00 N ATOM 1136 CA GLU A 74 13.866 -6.477 -16.491 1.00 0.00 C ATOM 1137 C GLU A 74 15.106 -6.976 -15.750 1.00 0.00 C ATOM 1138 O GLU A 74 15.369 -8.179 -15.702 1.00 0.00 O ATOM 1139 CB GLU A 74 14.227 -6.153 -17.941 1.00 0.00 C ATOM 1140 CG GLU A 74 13.021 -5.866 -18.820 1.00 0.00 C ATOM 1141 CD GLU A 74 12.097 -7.058 -18.939 1.00 0.00 C ATOM 1142 OE1 GLU A 74 12.449 -8.019 -19.650 1.00 0.00 O ATOM 1143 OE2 GLU A 74 11.008 -7.040 -18.330 1.00 0.00 O ATOM 0 H GLU A 74 13.216 -4.485 -16.437 1.00 0.00 H new ATOM 0 HA GLU A 74 13.112 -7.264 -16.476 1.00 0.00 H new ATOM 0 HB2 GLU A 74 14.891 -5.289 -17.957 1.00 0.00 H new ATOM 0 HB3 GLU A 74 14.783 -6.990 -18.364 1.00 0.00 H new ATOM 0 HG2 GLU A 74 12.468 -5.021 -18.409 1.00 0.00 H new ATOM 0 HG3 GLU A 74 13.360 -5.572 -19.813 1.00 0.00 H new ATOM 1150 N GLN A 75 15.870 -6.047 -15.188 1.00 0.00 N ATOM 1151 CA GLN A 75 17.029 -6.398 -14.378 1.00 0.00 C ATOM 1152 C GLN A 75 16.603 -6.605 -12.928 1.00 0.00 C ATOM 1153 O GLN A 75 17.138 -7.466 -12.231 1.00 0.00 O ATOM 1154 CB GLN A 75 18.115 -5.318 -14.468 1.00 0.00 C ATOM 1155 CG GLN A 75 18.826 -5.254 -15.818 1.00 0.00 C ATOM 1156 CD GLN A 75 17.948 -4.720 -16.936 1.00 0.00 C ATOM 1157 OE1 GLN A 75 17.065 -3.896 -16.709 1.00 0.00 O ATOM 1158 NE2 GLN A 75 18.183 -5.193 -18.152 1.00 0.00 N ATOM 0 H GLN A 75 15.707 -5.044 -15.279 1.00 0.00 H new ATOM 0 HA GLN A 75 17.450 -7.327 -14.764 1.00 0.00 H new ATOM 0 HB2 GLN A 75 17.664 -4.347 -14.262 1.00 0.00 H new ATOM 0 HB3 GLN A 75 18.855 -5.498 -13.689 1.00 0.00 H new ATOM 0 HG2 GLN A 75 19.709 -4.622 -15.726 1.00 0.00 H new ATOM 0 HG3 GLN A 75 19.175 -6.252 -16.085 1.00 0.00 H new ATOM 0 HE21 GLN A 75 18.926 -5.876 -18.299 1.00 0.00 H new ATOM 0 HE22 GLN A 75 17.621 -4.873 -18.941 1.00 0.00 H new ATOM 1167 N ASN A 76 15.648 -5.783 -12.485 1.00 0.00 N ATOM 1168 CA ASN A 76 14.987 -5.951 -11.180 1.00 0.00 C ATOM 1169 C ASN A 76 15.922 -5.587 -10.020 1.00 0.00 C ATOM 1170 O ASN A 76 15.588 -5.764 -8.849 1.00 0.00 O ATOM 1171 CB ASN A 76 14.459 -7.392 -11.039 1.00 0.00 C ATOM 1172 CG ASN A 76 13.505 -7.582 -9.870 1.00 0.00 C ATOM 1173 OD1 ASN A 76 13.909 -7.970 -8.774 1.00 0.00 O ATOM 1174 ND2 ASN A 76 12.227 -7.322 -10.100 1.00 0.00 N ATOM 0 H ASN A 76 15.309 -4.982 -13.017 1.00 0.00 H new ATOM 0 HA ASN A 76 14.143 -5.263 -11.135 1.00 0.00 H new ATOM 0 HB2 ASN A 76 13.951 -7.675 -11.961 1.00 0.00 H new ATOM 0 HB3 ASN A 76 15.305 -8.069 -10.920 1.00 0.00 H new ATOM 0 HD21 ASN A 76 11.540 -7.442 -9.355 1.00 0.00 H new ATOM 0 HD22 ASN A 76 11.930 -7.002 -11.022 1.00 0.00 H new ATOM 1181 N ILE A 77 17.084 -5.043 -10.349 1.00 0.00 N ATOM 1182 CA ILE A 77 18.053 -4.653 -9.335 1.00 0.00 C ATOM 1183 C ILE A 77 17.776 -3.247 -8.794 1.00 0.00 C ATOM 1184 O ILE A 77 18.505 -2.291 -9.071 1.00 0.00 O ATOM 1185 CB ILE A 77 19.510 -4.765 -9.853 1.00 0.00 C ATOM 1186 CG1 ILE A 77 19.607 -4.488 -11.363 1.00 0.00 C ATOM 1187 CG2 ILE A 77 20.069 -6.142 -9.536 1.00 0.00 C ATOM 1188 CD1 ILE A 77 19.429 -3.036 -11.754 1.00 0.00 C ATOM 0 H ILE A 77 17.379 -4.862 -11.308 1.00 0.00 H new ATOM 0 HA ILE A 77 17.939 -5.356 -8.510 1.00 0.00 H new ATOM 0 HB ILE A 77 20.102 -4.005 -9.343 1.00 0.00 H new ATOM 0 HG12 ILE A 77 20.579 -4.829 -11.719 1.00 0.00 H new ATOM 0 HG13 ILE A 77 18.852 -5.083 -11.877 1.00 0.00 H new ATOM 0 HG21 ILE A 77 21.093 -6.212 -9.903 1.00 0.00 H new ATOM 0 HG22 ILE A 77 20.059 -6.299 -8.457 1.00 0.00 H new ATOM 0 HG23 ILE A 77 19.457 -6.903 -10.020 1.00 0.00 H new ATOM 0 HD11 ILE A 77 19.513 -2.938 -12.836 1.00 0.00 H new ATOM 0 HD12 ILE A 77 18.446 -2.691 -11.434 1.00 0.00 H new ATOM 0 HD13 ILE A 77 20.199 -2.433 -11.274 1.00 0.00 H new ATOM 1200 N ASN A 78 16.712 -3.135 -8.008 1.00 0.00 N ATOM 1201 CA ASN A 78 16.288 -1.850 -7.456 1.00 0.00 C ATOM 1202 C ASN A 78 17.366 -1.235 -6.575 1.00 0.00 C ATOM 1203 O ASN A 78 17.583 -0.026 -6.610 1.00 0.00 O ATOM 1204 CB ASN A 78 14.996 -2.002 -6.646 1.00 0.00 C ATOM 1205 CG ASN A 78 13.783 -2.288 -7.508 1.00 0.00 C ATOM 1206 OD1 ASN A 78 13.458 -3.442 -7.785 1.00 0.00 O ATOM 1207 ND2 ASN A 78 13.091 -1.239 -7.925 1.00 0.00 N ATOM 0 H ASN A 78 16.123 -3.922 -7.736 1.00 0.00 H new ATOM 0 HA ASN A 78 16.108 -1.185 -8.301 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.120 -2.809 -5.924 1.00 0.00 H new ATOM 0 HB3 ASN A 78 14.822 -1.089 -6.076 1.00 0.00 H new ATOM 0 HD21 ASN A 78 12.257 -1.373 -8.497 1.00 0.00 H new ATOM 0 HD22 ASN A 78 13.392 -0.297 -7.675 1.00 0.00 H new ATOM 1214 N GLU A 79 18.050 -2.066 -5.800 1.00 0.00 N ATOM 1215 CA GLU A 79 19.070 -1.580 -4.880 1.00 0.00 C ATOM 1216 C GLU A 79 20.347 -1.214 -5.626 1.00 0.00 C ATOM 1217 O GLU A 79 21.100 -0.345 -5.192 1.00 0.00 O ATOM 1218 CB GLU A 79 19.368 -2.623 -3.804 1.00 0.00 C ATOM 1219 CG GLU A 79 18.174 -2.934 -2.916 1.00 0.00 C ATOM 1220 CD GLU A 79 18.512 -3.911 -1.813 1.00 0.00 C ATOM 1221 OE1 GLU A 79 18.968 -3.465 -0.738 1.00 0.00 O ATOM 1222 OE2 GLU A 79 18.326 -5.130 -2.015 1.00 0.00 O ATOM 0 H GLU A 79 17.918 -3.077 -5.790 1.00 0.00 H new ATOM 0 HA GLU A 79 18.684 -0.682 -4.398 1.00 0.00 H new ATOM 0 HB2 GLU A 79 19.704 -3.543 -4.283 1.00 0.00 H new ATOM 0 HB3 GLU A 79 20.191 -2.268 -3.183 1.00 0.00 H new ATOM 0 HG2 GLU A 79 17.802 -2.009 -2.476 1.00 0.00 H new ATOM 0 HG3 GLU A 79 17.369 -3.344 -3.526 1.00 0.00 H new ATOM 1229 N ARG A 80 20.584 -1.883 -6.747 1.00 0.00 N ATOM 1230 CA ARG A 80 21.779 -1.637 -7.546 1.00 0.00 C ATOM 1231 C ARG A 80 21.710 -0.263 -8.205 1.00 0.00 C ATOM 1232 O ARG A 80 22.596 0.572 -8.025 1.00 0.00 O ATOM 1233 CB ARG A 80 21.917 -2.718 -8.621 1.00 0.00 C ATOM 1234 CG ARG A 80 23.257 -2.718 -9.342 1.00 0.00 C ATOM 1235 CD ARG A 80 23.338 -3.848 -10.358 1.00 0.00 C ATOM 1236 NE ARG A 80 24.628 -3.884 -11.047 1.00 0.00 N ATOM 1237 CZ ARG A 80 25.094 -4.946 -11.704 1.00 0.00 C ATOM 1238 NH1 ARG A 80 24.366 -6.050 -11.797 1.00 0.00 N ATOM 1239 NH2 ARG A 80 26.289 -4.903 -12.279 1.00 0.00 N ATOM 0 H ARG A 80 19.965 -2.600 -7.124 1.00 0.00 H new ATOM 0 HA ARG A 80 22.648 -1.666 -6.888 1.00 0.00 H new ATOM 0 HB2 ARG A 80 21.766 -3.694 -8.160 1.00 0.00 H new ATOM 0 HB3 ARG A 80 21.123 -2.587 -9.356 1.00 0.00 H new ATOM 0 HG2 ARG A 80 23.401 -1.762 -9.846 1.00 0.00 H new ATOM 0 HG3 ARG A 80 24.063 -2.821 -8.616 1.00 0.00 H new ATOM 0 HD2 ARG A 80 23.171 -4.800 -9.854 1.00 0.00 H new ATOM 0 HD3 ARG A 80 22.540 -3.732 -11.091 1.00 0.00 H new ATOM 0 HE ARG A 80 25.207 -3.044 -11.023 1.00 0.00 H new ATOM 0 HH11 ARG A 80 23.443 -6.090 -11.364 1.00 0.00 H new ATOM 0 HH12 ARG A 80 24.729 -6.859 -12.301 1.00 0.00 H new ATOM 0 HH21 ARG A 80 26.854 -4.056 -12.219 1.00 0.00 H new ATOM 0 HH22 ARG A 80 26.643 -5.717 -12.781 1.00 0.00 H new ATOM 1253 N LEU A 81 20.633 -0.026 -8.941 1.00 0.00 N ATOM 1254 CA LEU A 81 20.480 1.212 -9.701 1.00 0.00 C ATOM 1255 C LEU A 81 19.861 2.317 -8.845 1.00 0.00 C ATOM 1256 O LEU A 81 19.912 3.493 -9.204 1.00 0.00 O ATOM 1257 CB LEU A 81 19.610 0.962 -10.932 1.00 0.00 C ATOM 1258 CG LEU A 81 19.641 2.072 -11.985 1.00 0.00 C ATOM 1259 CD1 LEU A 81 21.029 2.191 -12.596 1.00 0.00 C ATOM 1260 CD2 LEU A 81 18.600 1.812 -13.060 1.00 0.00 C ATOM 0 H LEU A 81 19.850 -0.674 -9.030 1.00 0.00 H new ATOM 0 HA LEU A 81 21.471 1.541 -10.014 1.00 0.00 H new ATOM 0 HB2 LEU A 81 19.928 0.030 -11.399 1.00 0.00 H new ATOM 0 HB3 LEU A 81 18.579 0.820 -10.607 1.00 0.00 H new ATOM 0 HG LEU A 81 19.402 3.018 -11.498 1.00 0.00 H new ATOM 0 HD11 LEU A 81 21.031 2.985 -13.342 1.00 0.00 H new ATOM 0 HD12 LEU A 81 21.752 2.426 -11.814 1.00 0.00 H new ATOM 0 HD13 LEU A 81 21.300 1.247 -13.070 1.00 0.00 H new ATOM 0 HD21 LEU A 81 18.635 2.610 -13.801 1.00 0.00 H new ATOM 0 HD22 LEU A 81 18.808 0.858 -13.544 1.00 0.00 H new ATOM 0 HD23 LEU A 81 17.609 1.781 -12.607 1.00 0.00 H new ATOM 1272 N ASN A 82 19.279 1.922 -7.714 1.00 0.00 N ATOM 1273 CA ASN A 82 18.627 2.854 -6.786 1.00 0.00 C ATOM 1274 C ASN A 82 17.351 3.424 -7.389 1.00 0.00 C ATOM 1275 O ASN A 82 17.211 4.638 -7.520 1.00 0.00 O ATOM 1276 CB ASN A 82 19.549 4.014 -6.371 1.00 0.00 C ATOM 1277 CG ASN A 82 20.698 3.600 -5.472 1.00 0.00 C ATOM 1278 OD1 ASN A 82 21.062 4.329 -4.551 1.00 0.00 O ATOM 1279 ND2 ASN A 82 21.300 2.457 -5.745 1.00 0.00 N ATOM 0 H ASN A 82 19.244 0.948 -7.412 1.00 0.00 H new ATOM 0 HA ASN A 82 18.386 2.274 -5.895 1.00 0.00 H new ATOM 0 HB2 ASN A 82 19.954 4.481 -7.269 1.00 0.00 H new ATOM 0 HB3 ASN A 82 18.955 4.771 -5.858 1.00 0.00 H new ATOM 0 HD21 ASN A 82 22.095 2.153 -5.184 1.00 0.00 H new ATOM 0 HD22 ASN A 82 20.970 1.878 -6.517 1.00 0.00 H new ATOM 1286 N ILE A 83 16.421 2.549 -7.758 1.00 0.00 N ATOM 1287 CA ILE A 83 15.133 2.998 -8.274 1.00 0.00 C ATOM 1288 C ILE A 83 14.285 3.543 -7.130 1.00 0.00 C ATOM 1289 O ILE A 83 14.077 2.864 -6.124 1.00 0.00 O ATOM 1290 CB ILE A 83 14.350 1.880 -9.017 1.00 0.00 C ATOM 1291 CG1 ILE A 83 15.015 1.529 -10.352 1.00 0.00 C ATOM 1292 CG2 ILE A 83 12.906 2.299 -9.260 1.00 0.00 C ATOM 1293 CD1 ILE A 83 16.227 0.635 -10.225 1.00 0.00 C ATOM 0 H ILE A 83 16.533 1.536 -7.710 1.00 0.00 H new ATOM 0 HA ILE A 83 15.339 3.780 -9.005 1.00 0.00 H new ATOM 0 HB ILE A 83 14.362 0.996 -8.379 1.00 0.00 H new ATOM 0 HG12 ILE A 83 14.282 1.039 -10.992 1.00 0.00 H new ATOM 0 HG13 ILE A 83 15.309 2.452 -10.852 1.00 0.00 H new ATOM 0 HG21 ILE A 83 12.378 1.500 -9.781 1.00 0.00 H new ATOM 0 HG22 ILE A 83 12.418 2.493 -8.305 1.00 0.00 H new ATOM 0 HG23 ILE A 83 12.887 3.204 -9.868 1.00 0.00 H new ATOM 0 HD11 ILE A 83 16.637 0.435 -11.215 1.00 0.00 H new ATOM 0 HD12 ILE A 83 16.981 1.129 -9.613 1.00 0.00 H new ATOM 0 HD13 ILE A 83 15.938 -0.305 -9.755 1.00 0.00 H new ATOM 1305 N GLY A 84 13.815 4.773 -7.294 1.00 0.00 N ATOM 1306 CA GLY A 84 13.059 5.436 -6.253 1.00 0.00 C ATOM 1307 C GLY A 84 11.736 4.762 -5.951 1.00 0.00 C ATOM 1308 O GLY A 84 11.114 4.164 -6.830 1.00 0.00 O ATOM 0 H GLY A 84 13.947 5.327 -8.140 1.00 0.00 H new ATOM 0 HA2 GLY A 84 13.658 5.469 -5.343 1.00 0.00 H new ATOM 0 HA3 GLY A 84 12.874 6.468 -6.550 1.00 0.00 H new ATOM 1312 N GLU A 85 11.300 4.882 -4.709 1.00 0.00 N ATOM 1313 CA GLU A 85 10.043 4.298 -4.266 1.00 0.00 C ATOM 1314 C GLU A 85 8.838 5.046 -4.856 1.00 0.00 C ATOM 1315 O GLU A 85 7.899 4.412 -5.334 1.00 0.00 O ATOM 1316 CB GLU A 85 9.978 4.273 -2.742 1.00 0.00 C ATOM 1317 CG GLU A 85 11.100 3.470 -2.108 1.00 0.00 C ATOM 1318 CD GLU A 85 10.979 3.388 -0.605 1.00 0.00 C ATOM 1319 OE1 GLU A 85 11.365 4.358 0.081 1.00 0.00 O ATOM 1320 OE2 GLU A 85 10.495 2.355 -0.101 1.00 0.00 O ATOM 0 H GLU A 85 11.805 5.386 -3.980 1.00 0.00 H new ATOM 0 HA GLU A 85 10.000 3.272 -4.631 1.00 0.00 H new ATOM 0 HB2 GLU A 85 10.015 5.296 -2.367 1.00 0.00 H new ATOM 0 HB3 GLU A 85 9.020 3.854 -2.433 1.00 0.00 H new ATOM 0 HG2 GLU A 85 11.101 2.463 -2.524 1.00 0.00 H new ATOM 0 HG3 GLU A 85 12.057 3.923 -2.367 1.00 0.00 H new ATOM 1327 N PRO A 86 8.830 6.403 -4.842 1.00 0.00 N ATOM 1328 CA PRO A 86 7.800 7.180 -5.547 1.00 0.00 C ATOM 1329 C PRO A 86 7.762 6.847 -7.039 1.00 0.00 C ATOM 1330 O PRO A 86 6.758 7.053 -7.713 1.00 0.00 O ATOM 1331 CB PRO A 86 8.230 8.633 -5.333 1.00 0.00 C ATOM 1332 CG PRO A 86 9.056 8.606 -4.097 1.00 0.00 C ATOM 1333 CD PRO A 86 9.765 7.283 -4.112 1.00 0.00 C ATOM 0 HA PRO A 86 6.798 6.967 -5.174 1.00 0.00 H new ATOM 0 HB2 PRO A 86 8.802 9.006 -6.183 1.00 0.00 H new ATOM 0 HB3 PRO A 86 7.367 9.288 -5.218 1.00 0.00 H new ATOM 0 HG2 PRO A 86 9.768 9.432 -4.083 1.00 0.00 H new ATOM 0 HG3 PRO A 86 8.434 8.707 -3.208 1.00 0.00 H new ATOM 0 HD2 PRO A 86 10.730 7.350 -4.615 1.00 0.00 H new ATOM 0 HD3 PRO A 86 9.956 6.918 -3.103 1.00 0.00 H new ATOM 1341 N LEU A 87 8.866 6.318 -7.541 1.00 0.00 N ATOM 1342 CA LEU A 87 8.951 5.899 -8.930 1.00 0.00 C ATOM 1343 C LEU A 87 8.258 4.552 -9.103 1.00 0.00 C ATOM 1344 O LEU A 87 7.590 4.305 -10.106 1.00 0.00 O ATOM 1345 CB LEU A 87 10.417 5.807 -9.385 1.00 0.00 C ATOM 1346 CG LEU A 87 11.154 7.143 -9.577 1.00 0.00 C ATOM 1347 CD1 LEU A 87 10.460 7.990 -10.632 1.00 0.00 C ATOM 1348 CD2 LEU A 87 11.266 7.912 -8.270 1.00 0.00 C ATOM 0 H LEU A 87 9.720 6.168 -7.004 1.00 0.00 H new ATOM 0 HA LEU A 87 8.451 6.643 -9.550 1.00 0.00 H new ATOM 0 HB2 LEU A 87 10.966 5.215 -8.653 1.00 0.00 H new ATOM 0 HB3 LEU A 87 10.450 5.259 -10.327 1.00 0.00 H new ATOM 0 HG LEU A 87 12.164 6.916 -9.918 1.00 0.00 H new ATOM 0 HD11 LEU A 87 10.996 8.931 -10.754 1.00 0.00 H new ATOM 0 HD12 LEU A 87 10.450 7.453 -11.581 1.00 0.00 H new ATOM 0 HD13 LEU A 87 9.436 8.194 -10.319 1.00 0.00 H new ATOM 0 HD21 LEU A 87 11.792 8.850 -8.444 1.00 0.00 H new ATOM 0 HD22 LEU A 87 10.268 8.122 -7.885 1.00 0.00 H new ATOM 0 HD23 LEU A 87 11.818 7.316 -7.543 1.00 0.00 H new ATOM 1360 N LEU A 88 8.403 3.695 -8.097 1.00 0.00 N ATOM 1361 CA LEU A 88 7.766 2.384 -8.101 1.00 0.00 C ATOM 1362 C LEU A 88 6.251 2.518 -8.029 1.00 0.00 C ATOM 1363 O LEU A 88 5.524 1.781 -8.694 1.00 0.00 O ATOM 1364 CB LEU A 88 8.271 1.539 -6.930 1.00 0.00 C ATOM 1365 CG LEU A 88 9.748 1.147 -7.005 1.00 0.00 C ATOM 1366 CD1 LEU A 88 10.169 0.415 -5.742 1.00 0.00 C ATOM 1367 CD2 LEU A 88 10.006 0.285 -8.231 1.00 0.00 C ATOM 0 H LEU A 88 8.960 3.887 -7.264 1.00 0.00 H new ATOM 0 HA LEU A 88 8.027 1.886 -9.035 1.00 0.00 H new ATOM 0 HB2 LEU A 88 8.104 2.090 -6.005 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.672 0.630 -6.872 1.00 0.00 H new ATOM 0 HG LEU A 88 10.343 2.056 -7.090 1.00 0.00 H new ATOM 0 HD11 LEU A 88 11.222 0.144 -5.813 1.00 0.00 H new ATOM 0 HD12 LEU A 88 10.018 1.063 -4.879 1.00 0.00 H new ATOM 0 HD13 LEU A 88 9.569 -0.488 -5.627 1.00 0.00 H new ATOM 0 HD21 LEU A 88 11.061 0.014 -8.270 1.00 0.00 H new ATOM 0 HD22 LEU A 88 9.401 -0.620 -8.173 1.00 0.00 H new ATOM 0 HD23 LEU A 88 9.741 0.842 -9.130 1.00 0.00 H new ATOM 1379 N VAL A 89 5.773 3.466 -7.230 1.00 0.00 N ATOM 1380 CA VAL A 89 4.340 3.692 -7.108 1.00 0.00 C ATOM 1381 C VAL A 89 3.785 4.302 -8.392 1.00 0.00 C ATOM 1382 O VAL A 89 2.648 4.029 -8.772 1.00 0.00 O ATOM 1383 CB VAL A 89 3.968 4.565 -5.884 1.00 0.00 C ATOM 1384 CG1 VAL A 89 4.521 3.950 -4.612 1.00 0.00 C ATOM 1385 CG2 VAL A 89 4.451 5.997 -6.038 1.00 0.00 C ATOM 0 H VAL A 89 6.352 4.085 -6.662 1.00 0.00 H new ATOM 0 HA VAL A 89 3.881 2.717 -6.945 1.00 0.00 H new ATOM 0 HB VAL A 89 2.880 4.596 -5.821 1.00 0.00 H new ATOM 0 HG11 VAL A 89 4.252 4.574 -3.760 1.00 0.00 H new ATOM 0 HG12 VAL A 89 4.102 2.953 -4.478 1.00 0.00 H new ATOM 0 HG13 VAL A 89 5.606 3.881 -4.683 1.00 0.00 H new ATOM 0 HG21 VAL A 89 4.168 6.573 -5.157 1.00 0.00 H new ATOM 0 HG22 VAL A 89 5.536 6.006 -6.145 1.00 0.00 H new ATOM 0 HG23 VAL A 89 3.996 6.441 -6.923 1.00 0.00 H new ATOM 1395 N TYR A 90 4.603 5.115 -9.062 1.00 0.00 N ATOM 1396 CA TYR A 90 4.228 5.704 -10.344 1.00 0.00 C ATOM 1397 C TYR A 90 4.051 4.607 -11.390 1.00 0.00 C ATOM 1398 O TYR A 90 3.274 4.743 -12.336 1.00 0.00 O ATOM 1399 CB TYR A 90 5.297 6.697 -10.806 1.00 0.00 C ATOM 1400 CG TYR A 90 4.850 7.601 -11.938 1.00 0.00 C ATOM 1401 CD1 TYR A 90 3.671 8.328 -11.843 1.00 0.00 C ATOM 1402 CD2 TYR A 90 5.615 7.743 -13.090 1.00 0.00 C ATOM 1403 CE1 TYR A 90 3.264 9.167 -12.863 1.00 0.00 C ATOM 1404 CE2 TYR A 90 5.212 8.581 -14.117 1.00 0.00 C ATOM 1405 CZ TYR A 90 4.036 9.291 -13.997 1.00 0.00 C ATOM 1406 OH TYR A 90 3.631 10.133 -15.011 1.00 0.00 O ATOM 0 H TYR A 90 5.532 5.380 -8.735 1.00 0.00 H new ATOM 0 HA TYR A 90 3.285 6.236 -10.221 1.00 0.00 H new ATOM 0 HB2 TYR A 90 5.596 7.314 -9.958 1.00 0.00 H new ATOM 0 HB3 TYR A 90 6.180 6.143 -11.124 1.00 0.00 H new ATOM 0 HD1 TYR A 90 3.061 8.236 -10.956 1.00 0.00 H new ATOM 0 HD2 TYR A 90 6.538 7.191 -13.186 1.00 0.00 H new ATOM 0 HE1 TYR A 90 2.343 9.724 -12.771 1.00 0.00 H new ATOM 0 HE2 TYR A 90 5.816 8.678 -15.007 1.00 0.00 H new ATOM 0 HH TYR A 90 4.287 10.107 -15.739 1.00 0.00 H new ATOM 1416 N LEU A 91 4.791 3.519 -11.208 1.00 0.00 N ATOM 1417 CA LEU A 91 4.679 2.359 -12.076 1.00 0.00 C ATOM 1418 C LEU A 91 3.381 1.610 -11.785 1.00 0.00 C ATOM 1419 O LEU A 91 2.789 1.000 -12.676 1.00 0.00 O ATOM 1420 CB LEU A 91 5.887 1.437 -11.882 1.00 0.00 C ATOM 1421 CG LEU A 91 5.969 0.251 -12.844 1.00 0.00 C ATOM 1422 CD1 LEU A 91 6.072 0.737 -14.280 1.00 0.00 C ATOM 1423 CD2 LEU A 91 7.155 -0.635 -12.494 1.00 0.00 C ATOM 0 H LEU A 91 5.478 3.419 -10.461 1.00 0.00 H new ATOM 0 HA LEU A 91 4.662 2.693 -13.114 1.00 0.00 H new ATOM 0 HB2 LEU A 91 6.796 2.030 -11.985 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.870 1.055 -10.861 1.00 0.00 H new ATOM 0 HG LEU A 91 5.057 -0.338 -12.745 1.00 0.00 H new ATOM 0 HD11 LEU A 91 6.129 -0.120 -14.951 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.193 1.333 -14.527 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.968 1.348 -14.394 1.00 0.00 H new ATOM 0 HD21 LEU A 91 7.199 -1.474 -13.188 1.00 0.00 H new ATOM 0 HD22 LEU A 91 8.076 -0.056 -12.566 1.00 0.00 H new ATOM 0 HD23 LEU A 91 7.041 -1.011 -11.477 1.00 0.00 H new ATOM 1435 N ARG A 92 2.944 1.662 -10.530 1.00 0.00 N ATOM 1436 CA ARG A 92 1.674 1.065 -10.136 1.00 0.00 C ATOM 1437 C ARG A 92 0.530 1.846 -10.771 1.00 0.00 C ATOM 1438 O ARG A 92 -0.239 1.316 -11.575 1.00 0.00 O ATOM 1439 CB ARG A 92 1.496 1.087 -8.613 1.00 0.00 C ATOM 1440 CG ARG A 92 2.665 0.533 -7.814 1.00 0.00 C ATOM 1441 CD ARG A 92 2.885 -0.951 -8.054 1.00 0.00 C ATOM 1442 NE ARG A 92 3.621 -1.559 -6.946 1.00 0.00 N ATOM 1443 CZ ARG A 92 4.620 -2.432 -7.085 1.00 0.00 C ATOM 1444 NH1 ARG A 92 5.025 -2.811 -8.291 1.00 0.00 N ATOM 1445 NH2 ARG A 92 5.217 -2.928 -6.008 1.00 0.00 N ATOM 0 H ARG A 92 3.452 2.112 -9.769 1.00 0.00 H new ATOM 0 HA ARG A 92 1.669 0.029 -10.475 1.00 0.00 H new ATOM 0 HB2 ARG A 92 1.318 2.116 -8.299 1.00 0.00 H new ATOM 0 HB3 ARG A 92 0.602 0.517 -8.360 1.00 0.00 H new ATOM 0 HG2 ARG A 92 3.571 1.078 -8.077 1.00 0.00 H new ATOM 0 HG3 ARG A 92 2.488 0.703 -6.752 1.00 0.00 H new ATOM 0 HD2 ARG A 92 1.923 -1.450 -8.173 1.00 0.00 H new ATOM 0 HD3 ARG A 92 3.436 -1.095 -8.983 1.00 0.00 H new ATOM 0 HE ARG A 92 3.351 -1.296 -5.998 1.00 0.00 H new ATOM 0 HH11 ARG A 92 4.571 -2.434 -9.123 1.00 0.00 H new ATOM 0 HH12 ARG A 92 5.790 -3.479 -8.386 1.00 0.00 H new ATOM 0 HH21 ARG A 92 4.911 -2.641 -5.078 1.00 0.00 H new ATOM 0 HH22 ARG A 92 5.981 -3.596 -6.111 1.00 0.00 H new ATOM 1459 N ARG A 93 0.432 3.116 -10.397 1.00 0.00 N ATOM 1460 CA ARG A 93 -0.592 4.013 -10.917 1.00 0.00 C ATOM 1461 C ARG A 93 -0.028 5.418 -11.013 1.00 0.00 C ATOM 1462 O ARG A 93 1.032 5.704 -10.463 1.00 0.00 O ATOM 1463 CB ARG A 93 -1.832 4.035 -10.017 1.00 0.00 C ATOM 1464 CG ARG A 93 -2.520 2.691 -9.863 1.00 0.00 C ATOM 1465 CD ARG A 93 -3.831 2.827 -9.113 1.00 0.00 C ATOM 1466 NE ARG A 93 -3.663 3.486 -7.819 1.00 0.00 N ATOM 1467 CZ ARG A 93 -4.601 3.516 -6.875 1.00 0.00 C ATOM 1468 NH1 ARG A 93 -5.785 2.961 -7.100 1.00 0.00 N ATOM 1469 NH2 ARG A 93 -4.362 4.122 -5.717 1.00 0.00 N ATOM 0 H ARG A 93 1.061 3.553 -9.724 1.00 0.00 H new ATOM 0 HA ARG A 93 -0.888 3.650 -11.901 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -1.543 4.397 -9.030 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -2.547 4.751 -10.422 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -2.704 2.259 -10.847 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -1.864 2.003 -9.331 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -4.537 3.395 -9.719 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -4.265 1.839 -8.961 1.00 0.00 H new ATOM 0 HE ARG A 93 -2.775 3.950 -7.628 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -5.976 2.512 -7.996 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -6.504 2.983 -6.377 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -3.459 4.565 -5.550 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -5.082 4.144 -4.995 1.00 0.00 H new ATOM 1483 N GLN A 94 -0.740 6.300 -11.687 1.00 0.00 N ATOM 1484 CA GLN A 94 -0.281 7.668 -11.833 1.00 0.00 C ATOM 1485 C GLN A 94 -1.335 8.645 -11.326 1.00 0.00 C ATOM 1486 O GLN A 94 -2.504 8.580 -11.711 1.00 0.00 O ATOM 1487 CB GLN A 94 0.089 7.955 -13.291 1.00 0.00 C ATOM 1488 CG GLN A 94 -1.073 7.859 -14.263 1.00 0.00 C ATOM 1489 CD GLN A 94 -0.621 7.953 -15.703 1.00 0.00 C ATOM 1490 OE1 GLN A 94 0.414 8.545 -16.006 1.00 0.00 O ATOM 1491 NE2 GLN A 94 -1.402 7.385 -16.606 1.00 0.00 N ATOM 0 H GLN A 94 -1.632 6.097 -12.139 1.00 0.00 H new ATOM 0 HA GLN A 94 0.615 7.802 -11.227 1.00 0.00 H new ATOM 0 HB2 GLN A 94 0.518 8.955 -13.354 1.00 0.00 H new ATOM 0 HB3 GLN A 94 0.865 7.255 -13.601 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -1.597 6.915 -14.109 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -1.786 8.657 -14.055 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -2.252 6.903 -16.314 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -1.154 7.429 -17.594 1.00 0.00 H new ATOM 1500 N ASP A 95 -0.915 9.535 -10.438 1.00 0.00 N ATOM 1501 CA ASP A 95 -1.814 10.523 -9.847 1.00 0.00 C ATOM 1502 C ASP A 95 -2.135 11.614 -10.864 1.00 0.00 C ATOM 1503 O ASP A 95 -3.215 12.205 -10.851 1.00 0.00 O ATOM 1504 CB ASP A 95 -1.173 11.129 -8.596 1.00 0.00 C ATOM 1505 CG ASP A 95 -2.134 11.970 -7.780 1.00 0.00 C ATOM 1506 OD1 ASP A 95 -2.932 11.389 -7.011 1.00 0.00 O ATOM 1507 OD2 ASP A 95 -2.075 13.215 -7.880 1.00 0.00 O ATOM 0 H ASP A 95 0.048 9.595 -10.108 1.00 0.00 H new ATOM 0 HA ASP A 95 -2.744 10.032 -9.560 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -0.782 10.326 -7.971 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -0.324 11.744 -8.893 1.00 0.00 H new ATOM 1512 N LEU A 96 -1.183 11.867 -11.746 1.00 0.00 N ATOM 1513 CA LEU A 96 -1.367 12.808 -12.838 1.00 0.00 C ATOM 1514 C LEU A 96 -1.382 12.047 -14.157 1.00 0.00 C ATOM 1515 O LEU A 96 -0.655 11.068 -14.302 1.00 0.00 O ATOM 1516 CB LEU A 96 -0.238 13.846 -12.849 1.00 0.00 C ATOM 1517 CG LEU A 96 -0.156 14.745 -11.614 1.00 0.00 C ATOM 1518 CD1 LEU A 96 1.078 15.633 -11.683 1.00 0.00 C ATOM 1519 CD2 LEU A 96 -1.411 15.595 -11.489 1.00 0.00 C ATOM 0 H LEU A 96 -0.263 11.427 -11.726 1.00 0.00 H new ATOM 0 HA LEU A 96 -2.314 13.330 -12.703 1.00 0.00 H new ATOM 0 HB2 LEU A 96 0.712 13.323 -12.959 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -0.358 14.478 -13.729 1.00 0.00 H new ATOM 0 HG LEU A 96 -0.078 14.110 -10.732 1.00 0.00 H new ATOM 0 HD11 LEU A 96 1.121 16.266 -10.797 1.00 0.00 H new ATOM 0 HD12 LEU A 96 1.972 15.011 -11.728 1.00 0.00 H new ATOM 0 HD13 LEU A 96 1.026 16.259 -12.574 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -1.335 16.228 -10.605 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -1.517 16.221 -12.375 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -2.282 14.946 -11.397 1.00 0.00 H new ATOM 1531 N PRO A 97 -2.212 12.475 -15.126 1.00 0.00 N ATOM 1532 CA PRO A 97 -2.297 11.825 -16.442 1.00 0.00 C ATOM 1533 C PRO A 97 -0.924 11.667 -17.090 1.00 0.00 C ATOM 1534 O PRO A 97 -0.608 10.625 -17.662 1.00 0.00 O ATOM 1535 CB PRO A 97 -3.164 12.785 -17.257 1.00 0.00 C ATOM 1536 CG PRO A 97 -3.994 13.494 -16.245 1.00 0.00 C ATOM 1537 CD PRO A 97 -3.139 13.615 -15.013 1.00 0.00 C ATOM 0 HA PRO A 97 -2.704 10.816 -16.377 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -2.552 13.484 -17.828 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -3.786 12.247 -17.973 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -4.296 14.477 -16.608 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -4.907 12.939 -16.032 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -2.606 14.565 -14.986 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -3.736 13.559 -14.103 1.00 0.00 H new ATOM 1545 N GLU A 98 -0.126 12.720 -17.002 1.00 0.00 N ATOM 1546 CA GLU A 98 1.260 12.692 -17.444 1.00 0.00 C ATOM 1547 C GLU A 98 2.072 13.626 -16.567 1.00 0.00 C ATOM 1548 O GLU A 98 1.843 14.836 -16.582 1.00 0.00 O ATOM 1549 CB GLU A 98 1.406 13.158 -18.898 1.00 0.00 C ATOM 1550 CG GLU A 98 0.649 12.333 -19.922 1.00 0.00 C ATOM 1551 CD GLU A 98 0.889 12.831 -21.330 1.00 0.00 C ATOM 1552 OE1 GLU A 98 0.575 14.008 -21.608 1.00 0.00 O ATOM 1553 OE2 GLU A 98 1.403 12.058 -22.162 1.00 0.00 O ATOM 0 H GLU A 98 -0.421 13.619 -16.622 1.00 0.00 H new ATOM 0 HA GLU A 98 1.613 11.663 -17.372 1.00 0.00 H new ATOM 0 HB2 GLU A 98 1.068 14.192 -18.967 1.00 0.00 H new ATOM 0 HB3 GLU A 98 2.464 13.151 -19.160 1.00 0.00 H new ATOM 0 HG2 GLU A 98 0.956 11.290 -19.848 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -0.418 12.368 -19.701 1.00 0.00 H new ATOM 1560 N ILE A 99 3.002 13.095 -15.790 1.00 0.00 N ATOM 1561 CA ILE A 99 3.868 13.964 -15.019 1.00 0.00 C ATOM 1562 C ILE A 99 4.859 14.647 -15.947 1.00 0.00 C ATOM 1563 O ILE A 99 5.809 14.035 -16.442 1.00 0.00 O ATOM 1564 CB ILE A 99 4.617 13.225 -13.886 1.00 0.00 C ATOM 1565 CG1 ILE A 99 3.624 12.773 -12.810 1.00 0.00 C ATOM 1566 CG2 ILE A 99 5.694 14.120 -13.278 1.00 0.00 C ATOM 1567 CD1 ILE A 99 4.279 12.153 -11.593 1.00 0.00 C ATOM 0 H ILE A 99 3.173 12.096 -15.679 1.00 0.00 H new ATOM 0 HA ILE A 99 3.232 14.705 -14.535 1.00 0.00 H new ATOM 0 HB ILE A 99 5.105 12.346 -14.306 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.030 13.631 -12.494 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.934 12.051 -13.247 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.209 13.581 -12.483 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.411 14.401 -14.049 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.232 15.018 -12.867 1.00 0.00 H new ATOM 0 HD11 ILE A 99 3.512 11.859 -10.877 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.850 11.275 -11.895 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.948 12.879 -11.130 1.00 0.00 H new ATOM 1579 N THR A 100 4.595 15.911 -16.212 1.00 0.00 N ATOM 1580 CA THR A 100 5.472 16.726 -17.019 1.00 0.00 C ATOM 1581 C THR A 100 5.885 17.933 -16.201 1.00 0.00 C ATOM 1582 O THR A 100 5.037 18.708 -15.760 1.00 0.00 O ATOM 1583 CB THR A 100 4.773 17.184 -18.315 1.00 0.00 C ATOM 1584 OG1 THR A 100 3.905 16.141 -18.788 1.00 0.00 O ATOM 1585 CG2 THR A 100 5.792 17.518 -19.392 1.00 0.00 C ATOM 0 H THR A 100 3.766 16.399 -15.873 1.00 0.00 H new ATOM 0 HA THR A 100 6.345 16.140 -17.305 1.00 0.00 H new ATOM 0 HB THR A 100 4.193 18.080 -18.095 1.00 0.00 H new ATOM 0 HG1 THR A 100 3.460 16.434 -19.611 1.00 0.00 H new ATOM 0 HG21 THR A 100 5.274 17.838 -20.296 1.00 0.00 H new ATOM 0 HG22 THR A 100 6.441 18.320 -19.042 1.00 0.00 H new ATOM 0 HG23 THR A 100 6.392 16.635 -19.611 1.00 0.00 H new ATOM 1593 N ALA A 101 7.174 18.090 -15.993 1.00 0.00 N ATOM 1594 CA ALA A 101 7.668 19.128 -15.115 1.00 0.00 C ATOM 1595 C ALA A 101 8.540 20.093 -15.885 1.00 0.00 C ATOM 1596 O ALA A 101 9.482 19.692 -16.573 1.00 0.00 O ATOM 1597 CB ALA A 101 8.441 18.518 -13.954 1.00 0.00 C ATOM 0 H ALA A 101 7.899 17.513 -16.420 1.00 0.00 H new ATOM 0 HA ALA A 101 6.818 19.677 -14.710 1.00 0.00 H new ATOM 0 HB1 ALA A 101 8.806 19.312 -13.303 1.00 0.00 H new ATOM 0 HB2 ALA A 101 7.785 17.857 -13.388 1.00 0.00 H new ATOM 0 HB3 ALA A 101 9.286 17.948 -14.339 1.00 0.00 H new ATOM 1603 N GLN A 102 8.202 21.362 -15.791 1.00 0.00 N ATOM 1604 CA GLN A 102 8.959 22.397 -16.456 1.00 0.00 C ATOM 1605 C GLN A 102 9.446 23.416 -15.442 1.00 0.00 C ATOM 1606 O GLN A 102 8.819 23.623 -14.399 1.00 0.00 O ATOM 1607 CB GLN A 102 8.133 23.064 -17.558 1.00 0.00 C ATOM 1608 CG GLN A 102 6.867 23.744 -17.072 1.00 0.00 C ATOM 1609 CD GLN A 102 6.112 24.420 -18.199 1.00 0.00 C ATOM 1610 OE1 GLN A 102 6.116 23.953 -19.338 1.00 0.00 O ATOM 1611 NE2 GLN A 102 5.482 25.539 -17.897 1.00 0.00 N ATOM 0 H GLN A 102 7.402 21.701 -15.256 1.00 0.00 H new ATOM 0 HA GLN A 102 9.827 21.941 -16.933 1.00 0.00 H new ATOM 0 HB2 GLN A 102 8.755 23.802 -18.064 1.00 0.00 H new ATOM 0 HB3 GLN A 102 7.864 22.311 -18.299 1.00 0.00 H new ATOM 0 HG2 GLN A 102 6.221 23.007 -16.595 1.00 0.00 H new ATOM 0 HG3 GLN A 102 7.122 24.483 -16.313 1.00 0.00 H new ATOM 0 HE21 GLN A 102 5.502 25.894 -16.941 1.00 0.00 H new ATOM 0 HE22 GLN A 102 4.975 26.050 -18.620 1.00 0.00 H new ATOM 1620 N ARG A 103 10.576 24.022 -15.744 1.00 0.00 N ATOM 1621 CA ARG A 103 11.227 24.953 -14.842 1.00 0.00 C ATOM 1622 C ARG A 103 10.406 26.234 -14.720 1.00 0.00 C ATOM 1623 O ARG A 103 10.248 26.786 -13.629 1.00 0.00 O ATOM 1624 CB ARG A 103 12.627 25.246 -15.372 1.00 0.00 C ATOM 1625 CG ARG A 103 13.518 26.031 -14.432 1.00 0.00 C ATOM 1626 CD ARG A 103 14.895 26.203 -15.046 1.00 0.00 C ATOM 1627 NE ARG A 103 15.816 26.919 -14.173 1.00 0.00 N ATOM 1628 CZ ARG A 103 16.849 27.629 -14.622 1.00 0.00 C ATOM 1629 NH1 ARG A 103 17.047 27.766 -15.930 1.00 0.00 N ATOM 1630 NH2 ARG A 103 17.677 28.214 -13.770 1.00 0.00 N ATOM 0 H ARG A 103 11.071 23.883 -16.625 1.00 0.00 H new ATOM 0 HA ARG A 103 11.304 24.517 -13.846 1.00 0.00 H new ATOM 0 HB2 ARG A 103 13.116 24.300 -15.606 1.00 0.00 H new ATOM 0 HB3 ARG A 103 12.536 25.798 -16.308 1.00 0.00 H new ATOM 0 HG2 ARG A 103 13.077 27.007 -14.229 1.00 0.00 H new ATOM 0 HG3 ARG A 103 13.599 25.513 -13.476 1.00 0.00 H new ATOM 0 HD2 ARG A 103 15.310 25.222 -15.278 1.00 0.00 H new ATOM 0 HD3 ARG A 103 14.803 26.741 -15.989 1.00 0.00 H new ATOM 0 HE ARG A 103 15.661 26.874 -13.166 1.00 0.00 H new ATOM 0 HH11 ARG A 103 16.407 27.327 -16.591 1.00 0.00 H new ATOM 0 HH12 ARG A 103 17.839 28.310 -16.272 1.00 0.00 H new ATOM 0 HH21 ARG A 103 17.525 28.122 -12.766 1.00 0.00 H new ATOM 0 HH22 ARG A 103 18.467 28.757 -14.118 1.00 0.00 H new ATOM 1644 N GLN A 104 9.872 26.691 -15.841 1.00 0.00 N ATOM 1645 CA GLN A 104 9.004 27.861 -15.853 1.00 0.00 C ATOM 1646 C GLN A 104 7.572 27.463 -15.507 1.00 0.00 C ATOM 1647 O GLN A 104 7.237 26.281 -15.492 1.00 0.00 O ATOM 1648 CB GLN A 104 9.058 28.548 -17.218 1.00 0.00 C ATOM 1649 CG GLN A 104 8.693 27.635 -18.376 1.00 0.00 C ATOM 1650 CD GLN A 104 8.929 28.286 -19.721 1.00 0.00 C ATOM 1651 OE1 GLN A 104 8.818 29.505 -19.866 1.00 0.00 O ATOM 1652 NE2 GLN A 104 9.279 27.484 -20.712 1.00 0.00 N ATOM 0 H GLN A 104 10.024 26.270 -16.757 1.00 0.00 H new ATOM 0 HA GLN A 104 9.356 28.565 -15.099 1.00 0.00 H new ATOM 0 HB2 GLN A 104 8.380 29.402 -17.212 1.00 0.00 H new ATOM 0 HB3 GLN A 104 10.063 28.940 -17.378 1.00 0.00 H new ATOM 0 HG2 GLN A 104 9.280 26.719 -18.311 1.00 0.00 H new ATOM 0 HG3 GLN A 104 7.644 27.349 -18.293 1.00 0.00 H new ATOM 0 HE21 GLN A 104 9.360 26.480 -20.551 1.00 0.00 H new ATOM 0 HE22 GLN A 104 9.468 27.869 -21.637 1.00 0.00 H new ATOM 1661 N LEU A 105 6.726 28.443 -15.224 1.00 0.00 N ATOM 1662 CA LEU A 105 5.353 28.155 -14.827 1.00 0.00 C ATOM 1663 C LEU A 105 4.437 28.046 -16.043 1.00 0.00 C ATOM 1664 O LEU A 105 3.417 27.362 -15.999 1.00 0.00 O ATOM 1665 CB LEU A 105 4.814 29.221 -13.859 1.00 0.00 C ATOM 1666 CG LEU A 105 4.461 30.580 -14.478 1.00 0.00 C ATOM 1667 CD1 LEU A 105 3.624 31.394 -13.507 1.00 0.00 C ATOM 1668 CD2 LEU A 105 5.714 31.352 -14.863 1.00 0.00 C ATOM 0 H LEU A 105 6.961 29.435 -15.261 1.00 0.00 H new ATOM 0 HA LEU A 105 5.364 27.194 -14.312 1.00 0.00 H new ATOM 0 HB2 LEU A 105 3.923 28.824 -13.373 1.00 0.00 H new ATOM 0 HB3 LEU A 105 5.557 29.383 -13.078 1.00 0.00 H new ATOM 0 HG LEU A 105 3.884 30.399 -15.385 1.00 0.00 H new ATOM 0 HD11 LEU A 105 3.379 32.357 -13.956 1.00 0.00 H new ATOM 0 HD12 LEU A 105 2.704 30.855 -13.279 1.00 0.00 H new ATOM 0 HD13 LEU A 105 4.187 31.555 -12.588 1.00 0.00 H new ATOM 0 HD21 LEU A 105 5.431 32.310 -15.299 1.00 0.00 H new ATOM 0 HD22 LEU A 105 6.323 31.523 -13.975 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.286 30.777 -15.591 1.00 0.00 H new ATOM 1680 N ARG A 106 4.805 28.714 -17.131 1.00 0.00 N ATOM 1681 CA ARG A 106 3.985 28.726 -18.337 1.00 0.00 C ATOM 1682 C ARG A 106 4.852 28.531 -19.570 1.00 0.00 C ATOM 1683 O ARG A 106 5.419 29.533 -20.055 1.00 0.00 O ATOM 1684 CB ARG A 106 3.214 30.043 -18.448 1.00 0.00 C ATOM 1685 CG ARG A 106 2.267 30.289 -17.291 1.00 0.00 C ATOM 1686 CD ARG A 106 1.676 31.683 -17.339 1.00 0.00 C ATOM 1687 NE ARG A 106 0.873 31.955 -16.154 1.00 0.00 N ATOM 1688 CZ ARG A 106 0.954 33.070 -15.435 1.00 0.00 C ATOM 1689 NH1 ARG A 106 1.783 34.042 -15.796 1.00 0.00 N ATOM 1690 NH2 ARG A 106 0.201 33.205 -14.351 1.00 0.00 N ATOM 1691 OXT ARG A 106 4.971 27.381 -20.035 1.00 0.00 O ATOM 0 H ARG A 106 5.667 29.255 -17.202 1.00 0.00 H new ATOM 0 HA ARG A 106 3.272 27.904 -18.272 1.00 0.00 H new ATOM 0 HB2 ARG A 106 3.925 30.867 -18.507 1.00 0.00 H new ATOM 0 HB3 ARG A 106 2.646 30.045 -19.378 1.00 0.00 H new ATOM 0 HG2 ARG A 106 1.464 29.552 -17.315 1.00 0.00 H new ATOM 0 HG3 ARG A 106 2.799 30.151 -16.350 1.00 0.00 H new ATOM 0 HD2 ARG A 106 2.477 32.418 -17.415 1.00 0.00 H new ATOM 0 HD3 ARG A 106 1.060 31.789 -18.232 1.00 0.00 H new ATOM 0 HE ARG A 106 0.205 31.243 -15.857 1.00 0.00 H new ATOM 0 HH11 ARG A 106 2.362 33.935 -16.629 1.00 0.00 H new ATOM 0 HH12 ARG A 106 1.841 34.895 -15.240 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -0.434 32.456 -14.075 1.00 0.00 H new ATOM 0 HH22 ARG A 106 0.257 34.058 -13.794 1.00 0.00 H new TER 1705 ARG A 106