USER MOD reduce.3.24.130724 H: found=0, std=0, add=715, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 586 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -133:sc= 0.0205 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 38:sc= 0.79 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 165:sc= 0.435 (180deg=-0.154) USER MOD Single : A 11 MET CE :methyl 146:sc= -0.28 (180deg=-1.92!) USER MOD Single : A 20 TYR OH : rot 180:sc= -0.33 USER MOD Single : A 21 SER OG : rot 124:sc= 0.253 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot -2:sc= 1.05 USER MOD Single : A 47 GLN : amide:sc= -0.19 X(o=-0.19,f=-0.63) USER MOD Single : A 61 TYR OH : rot 62:sc= 0.507 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 MET CE :methyl -117:sc= -3.94! (180deg=-8.77!) USER MOD Single : A 72 HIS : no HD1:sc= -4.41! C(o=-4.4!,f=-4.4!) USER MOD Single : A 73 SER OG : rot 180:sc= -0.389 USER MOD Single : A 74 HIS : no HD1:sc= -8.55! C(o=-8.6!,f=-8.3!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -0.804 -16.884 5.156 1.00 0.00 N ATOM 2 CA GLY A 1 0.070 -15.939 4.482 1.00 0.00 C ATOM 3 C GLY A 1 1.535 -16.195 4.842 1.00 0.00 C ATOM 4 O GLY A 1 1.957 -17.344 4.961 1.00 0.00 O ATOM 0 H1 GLY A 1 -1.486 -17.273 4.474 1.00 0.00 H new ATOM 0 H2 GLY A 1 -0.236 -17.657 5.557 1.00 0.00 H new ATOM 0 H3 GLY A 1 -1.316 -16.399 5.920 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.063 -16.021 3.403 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -0.204 -14.922 4.761 1.00 0.00 H new ATOM 8 N SER A 2 2.270 -15.105 5.006 1.00 0.00 N ATOM 9 CA SER A 2 3.679 -15.196 5.351 1.00 0.00 C ATOM 10 C SER A 2 4.118 -13.936 6.098 1.00 0.00 C ATOM 11 O SER A 2 3.377 -12.956 6.159 1.00 0.00 O ATOM 12 CB SER A 2 4.539 -15.400 4.101 1.00 0.00 C ATOM 13 OG SER A 2 5.363 -16.558 4.203 1.00 0.00 O ATOM 0 H SER A 2 1.916 -14.154 4.906 1.00 0.00 H new ATOM 0 HA SER A 2 3.817 -16.061 6.000 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.893 -15.490 3.228 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.166 -14.522 3.945 1.00 0.00 H new ATOM 0 HG SER A 2 5.895 -16.654 3.385 1.00 0.00 H new ATOM 18 N SER A 3 5.322 -14.002 6.648 1.00 0.00 N ATOM 19 CA SER A 3 5.869 -12.878 7.389 1.00 0.00 C ATOM 20 C SER A 3 7.329 -12.652 6.994 1.00 0.00 C ATOM 21 O SER A 3 7.979 -13.550 6.460 1.00 0.00 O ATOM 22 CB SER A 3 5.757 -13.107 8.898 1.00 0.00 C ATOM 23 OG SER A 3 6.326 -14.352 9.293 1.00 0.00 O ATOM 0 H SER A 3 5.934 -14.816 6.595 1.00 0.00 H new ATOM 0 HA SER A 3 5.290 -11.989 7.139 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.258 -12.296 9.426 1.00 0.00 H new ATOM 0 HB3 SER A 3 4.708 -13.078 9.192 1.00 0.00 H new ATOM 0 HG SER A 3 6.236 -14.460 10.263 1.00 0.00 H new ATOM 28 N GLY A 4 7.803 -11.446 7.270 1.00 0.00 N ATOM 29 CA GLY A 4 9.175 -11.090 6.949 1.00 0.00 C ATOM 30 C GLY A 4 9.345 -9.571 6.878 1.00 0.00 C ATOM 31 O GLY A 4 8.407 -8.853 6.532 1.00 0.00 O ATOM 0 H GLY A 4 7.262 -10.703 7.712 1.00 0.00 H new ATOM 0 HA2 GLY A 4 9.847 -11.500 7.703 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.457 -11.536 5.995 1.00 0.00 H new ATOM 35 N SER A 5 10.547 -9.125 7.212 1.00 0.00 N ATOM 36 CA SER A 5 10.852 -7.705 7.191 1.00 0.00 C ATOM 37 C SER A 5 12.367 -7.495 7.206 1.00 0.00 C ATOM 38 O SER A 5 12.998 -7.571 8.260 1.00 0.00 O ATOM 39 CB SER A 5 10.204 -6.985 8.376 1.00 0.00 C ATOM 40 OG SER A 5 10.665 -7.492 9.625 1.00 0.00 O ATOM 0 H SER A 5 11.322 -9.723 7.499 1.00 0.00 H new ATOM 0 HA SER A 5 10.442 -7.280 6.275 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.421 -5.919 8.315 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.121 -7.094 8.318 1.00 0.00 H new ATOM 0 HG SER A 5 11.620 -7.703 9.560 1.00 0.00 H new ATOM 45 N SER A 6 12.909 -7.233 6.026 1.00 0.00 N ATOM 46 CA SER A 6 14.338 -7.012 5.889 1.00 0.00 C ATOM 47 C SER A 6 14.599 -5.872 4.903 1.00 0.00 C ATOM 48 O SER A 6 15.073 -4.805 5.293 1.00 0.00 O ATOM 49 CB SER A 6 15.052 -8.285 5.431 1.00 0.00 C ATOM 50 OG SER A 6 16.457 -8.221 5.662 1.00 0.00 O ATOM 0 H SER A 6 12.383 -7.169 5.155 1.00 0.00 H new ATOM 0 HA SER A 6 14.736 -6.737 6.866 1.00 0.00 H new ATOM 0 HB2 SER A 6 14.637 -9.144 5.959 1.00 0.00 H new ATOM 0 HB3 SER A 6 14.866 -8.443 4.369 1.00 0.00 H new ATOM 0 HG SER A 6 16.877 -9.053 5.358 1.00 0.00 H new ATOM 55 N GLY A 7 14.279 -6.136 3.645 1.00 0.00 N ATOM 56 CA GLY A 7 14.474 -5.146 2.599 1.00 0.00 C ATOM 57 C GLY A 7 13.529 -3.957 2.788 1.00 0.00 C ATOM 58 O GLY A 7 12.559 -4.043 3.541 1.00 0.00 O ATOM 0 H GLY A 7 13.886 -7.021 3.326 1.00 0.00 H new ATOM 0 HA2 GLY A 7 15.507 -4.799 2.609 1.00 0.00 H new ATOM 0 HA3 GLY A 7 14.300 -5.602 1.624 1.00 0.00 H new ATOM 62 N LEU A 8 13.844 -2.875 2.090 1.00 0.00 N ATOM 63 CA LEU A 8 13.034 -1.671 2.171 1.00 0.00 C ATOM 64 C LEU A 8 11.773 -1.851 1.324 1.00 0.00 C ATOM 65 O LEU A 8 10.658 -1.729 1.829 1.00 0.00 O ATOM 66 CB LEU A 8 13.862 -0.442 1.789 1.00 0.00 C ATOM 67 CG LEU A 8 14.496 0.327 2.950 1.00 0.00 C ATOM 68 CD1 LEU A 8 15.100 1.647 2.467 1.00 0.00 C ATOM 69 CD2 LEU A 8 13.490 0.537 4.083 1.00 0.00 C ATOM 0 H LEU A 8 14.648 -2.807 1.466 1.00 0.00 H new ATOM 0 HA LEU A 8 12.707 -1.500 3.197 1.00 0.00 H new ATOM 0 HB2 LEU A 8 14.656 -0.759 1.113 1.00 0.00 H new ATOM 0 HB3 LEU A 8 13.223 0.243 1.231 1.00 0.00 H new ATOM 0 HG LEU A 8 15.312 -0.273 3.352 1.00 0.00 H new ATOM 0 HD11 LEU A 8 15.544 2.174 3.311 1.00 0.00 H new ATOM 0 HD12 LEU A 8 15.868 1.444 1.721 1.00 0.00 H new ATOM 0 HD13 LEU A 8 14.318 2.264 2.024 1.00 0.00 H new ATOM 0 HD21 LEU A 8 13.966 1.086 4.895 1.00 0.00 H new ATOM 0 HD22 LEU A 8 12.637 1.106 3.712 1.00 0.00 H new ATOM 0 HD23 LEU A 8 13.148 -0.431 4.450 1.00 0.00 H new ATOM 80 N ARG A 9 11.992 -2.138 0.049 1.00 0.00 N ATOM 81 CA ARG A 9 10.887 -2.337 -0.874 1.00 0.00 C ATOM 82 C ARG A 9 10.082 -3.576 -0.479 1.00 0.00 C ATOM 83 O ARG A 9 8.867 -3.618 -0.669 1.00 0.00 O ATOM 84 CB ARG A 9 11.391 -2.499 -2.310 1.00 0.00 C ATOM 85 CG ARG A 9 10.226 -2.712 -3.278 1.00 0.00 C ATOM 86 CD ARG A 9 10.424 -3.986 -4.102 1.00 0.00 C ATOM 87 NE ARG A 9 10.506 -5.161 -3.205 1.00 0.00 N ATOM 88 CZ ARG A 9 10.337 -6.427 -3.609 1.00 0.00 C ATOM 89 NH1 ARG A 9 10.075 -6.691 -4.896 1.00 0.00 N ATOM 90 NH2 ARG A 9 10.429 -7.430 -2.724 1.00 0.00 N ATOM 0 H ARG A 9 12.918 -2.237 -0.367 1.00 0.00 H new ATOM 0 HA ARG A 9 10.249 -1.455 -0.823 1.00 0.00 H new ATOM 0 HB2 ARG A 9 11.955 -1.614 -2.603 1.00 0.00 H new ATOM 0 HB3 ARG A 9 12.075 -3.346 -2.366 1.00 0.00 H new ATOM 0 HG2 ARG A 9 9.292 -2.777 -2.720 1.00 0.00 H new ATOM 0 HG3 ARG A 9 10.140 -1.853 -3.944 1.00 0.00 H new ATOM 0 HD2 ARG A 9 9.597 -4.109 -4.801 1.00 0.00 H new ATOM 0 HD3 ARG A 9 11.335 -3.907 -4.696 1.00 0.00 H new ATOM 0 HE ARG A 9 10.703 -4.996 -2.218 1.00 0.00 H new ATOM 0 HH11 ARG A 9 10.004 -5.928 -5.569 1.00 0.00 H new ATOM 0 HH12 ARG A 9 9.946 -7.655 -5.203 1.00 0.00 H new ATOM 0 HH21 ARG A 9 10.628 -7.229 -1.744 1.00 0.00 H new ATOM 0 HH22 ARG A 9 10.300 -8.394 -3.031 1.00 0.00 H new ATOM 101 N LYS A 10 10.790 -4.556 0.062 1.00 0.00 N ATOM 102 CA LYS A 10 10.157 -5.792 0.485 1.00 0.00 C ATOM 103 C LYS A 10 9.195 -5.499 1.638 1.00 0.00 C ATOM 104 O LYS A 10 8.159 -6.150 1.767 1.00 0.00 O ATOM 105 CB LYS A 10 11.212 -6.849 0.819 1.00 0.00 C ATOM 106 CG LYS A 10 10.609 -7.985 1.647 1.00 0.00 C ATOM 107 CD LYS A 10 9.357 -8.548 0.973 1.00 0.00 C ATOM 108 CE LYS A 10 8.227 -8.738 1.986 1.00 0.00 C ATOM 109 NZ LYS A 10 6.912 -8.507 1.347 1.00 0.00 N ATOM 0 H LYS A 10 11.797 -4.518 0.217 1.00 0.00 H new ATOM 0 HA LYS A 10 9.564 -6.212 -0.327 1.00 0.00 H new ATOM 0 HB2 LYS A 10 11.634 -7.250 -0.102 1.00 0.00 H new ATOM 0 HB3 LYS A 10 12.032 -6.388 1.370 1.00 0.00 H new ATOM 0 HG2 LYS A 10 11.346 -8.778 1.774 1.00 0.00 H new ATOM 0 HG3 LYS A 10 10.358 -7.620 2.643 1.00 0.00 H new ATOM 0 HD2 LYS A 10 9.031 -7.873 0.182 1.00 0.00 H new ATOM 0 HD3 LYS A 10 9.592 -9.502 0.501 1.00 0.00 H new ATOM 0 HE2 LYS A 10 8.266 -9.747 2.397 1.00 0.00 H new ATOM 0 HE3 LYS A 10 8.359 -8.048 2.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 6.158 -8.880 1.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 6.770 -7.487 1.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 6.883 -8.992 0.428 1.00 0.00 H new ATOM 119 N MET A 11 9.571 -4.519 2.447 1.00 0.00 N ATOM 120 CA MET A 11 8.754 -4.132 3.583 1.00 0.00 C ATOM 121 C MET A 11 7.473 -3.433 3.126 1.00 0.00 C ATOM 122 O MET A 11 6.372 -3.862 3.468 1.00 0.00 O ATOM 123 CB MET A 11 9.554 -3.193 4.490 1.00 0.00 C ATOM 124 CG MET A 11 10.284 -3.976 5.583 1.00 0.00 C ATOM 125 SD MET A 11 10.028 -3.195 7.167 1.00 0.00 S ATOM 126 CE MET A 11 11.200 -1.854 7.045 1.00 0.00 C ATOM 0 H MET A 11 10.431 -3.982 2.337 1.00 0.00 H new ATOM 0 HA MET A 11 8.477 -5.033 4.131 1.00 0.00 H new ATOM 0 HB2 MET A 11 10.276 -2.634 3.894 1.00 0.00 H new ATOM 0 HB3 MET A 11 8.884 -2.464 4.946 1.00 0.00 H new ATOM 0 HG2 MET A 11 9.920 -5.003 5.611 1.00 0.00 H new ATOM 0 HG3 MET A 11 11.350 -4.022 5.359 1.00 0.00 H new ATOM 0 HE1 MET A 11 10.810 -0.981 7.568 1.00 0.00 H new ATOM 0 HE2 MET A 11 12.145 -2.155 7.497 1.00 0.00 H new ATOM 0 HE3 MET A 11 11.362 -1.606 5.996 1.00 0.00 H new ATOM 134 N VAL A 12 7.660 -2.367 2.362 1.00 0.00 N ATOM 135 CA VAL A 12 6.532 -1.604 1.853 1.00 0.00 C ATOM 136 C VAL A 12 5.684 -2.498 0.947 1.00 0.00 C ATOM 137 O VAL A 12 4.494 -2.247 0.759 1.00 0.00 O ATOM 138 CB VAL A 12 7.030 -0.340 1.149 1.00 0.00 C ATOM 139 CG1 VAL A 12 8.272 -0.636 0.305 1.00 0.00 C ATOM 140 CG2 VAL A 12 5.924 0.285 0.298 1.00 0.00 C ATOM 0 H VAL A 12 8.575 -2.013 2.083 1.00 0.00 H new ATOM 0 HA VAL A 12 5.894 -1.273 2.673 1.00 0.00 H new ATOM 0 HB VAL A 12 7.311 0.382 1.915 1.00 0.00 H new ATOM 0 HG11 VAL A 12 8.606 0.279 -0.185 1.00 0.00 H new ATOM 0 HG12 VAL A 12 9.067 -1.014 0.948 1.00 0.00 H new ATOM 0 HG13 VAL A 12 8.029 -1.384 -0.450 1.00 0.00 H new ATOM 0 HG21 VAL A 12 6.304 1.182 -0.191 1.00 0.00 H new ATOM 0 HG22 VAL A 12 5.598 -0.430 -0.457 1.00 0.00 H new ATOM 0 HG23 VAL A 12 5.080 0.550 0.935 1.00 0.00 H new ATOM 150 N GLU A 13 6.328 -3.523 0.409 1.00 0.00 N ATOM 151 CA GLU A 13 5.648 -4.456 -0.473 1.00 0.00 C ATOM 152 C GLU A 13 4.456 -5.092 0.245 1.00 0.00 C ATOM 153 O GLU A 13 3.369 -5.197 -0.322 1.00 0.00 O ATOM 154 CB GLU A 13 6.612 -5.526 -0.988 1.00 0.00 C ATOM 155 CG GLU A 13 7.352 -5.043 -2.237 1.00 0.00 C ATOM 156 CD GLU A 13 6.647 -5.517 -3.509 1.00 0.00 C ATOM 157 OE1 GLU A 13 5.453 -5.175 -3.659 1.00 0.00 O ATOM 158 OE2 GLU A 13 7.317 -6.212 -4.305 1.00 0.00 O ATOM 0 H GLU A 13 7.315 -3.728 0.567 1.00 0.00 H new ATOM 0 HA GLU A 13 5.276 -3.904 -1.336 1.00 0.00 H new ATOM 0 HB2 GLU A 13 7.332 -5.777 -0.209 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.060 -6.437 -1.218 1.00 0.00 H new ATOM 0 HG2 GLU A 13 7.409 -3.954 -2.232 1.00 0.00 H new ATOM 0 HG3 GLU A 13 8.376 -5.416 -2.224 1.00 0.00 H new ATOM 163 N GLU A 14 4.698 -5.499 1.481 1.00 0.00 N ATOM 164 CA GLU A 14 3.658 -6.122 2.282 1.00 0.00 C ATOM 165 C GLU A 14 2.686 -5.062 2.807 1.00 0.00 C ATOM 166 O GLU A 14 1.480 -5.298 2.867 1.00 0.00 O ATOM 167 CB GLU A 14 4.262 -6.930 3.434 1.00 0.00 C ATOM 168 CG GLU A 14 4.434 -6.061 4.681 1.00 0.00 C ATOM 169 CD GLU A 14 5.384 -6.722 5.682 1.00 0.00 C ATOM 170 OE1 GLU A 14 6.339 -7.376 5.210 1.00 0.00 O ATOM 171 OE2 GLU A 14 5.134 -6.557 6.895 1.00 0.00 O ATOM 0 H GLU A 14 5.600 -5.410 1.949 1.00 0.00 H new ATOM 0 HA GLU A 14 3.104 -6.814 1.648 1.00 0.00 H new ATOM 0 HB2 GLU A 14 3.619 -7.779 3.664 1.00 0.00 H new ATOM 0 HB3 GLU A 14 5.228 -7.335 3.132 1.00 0.00 H new ATOM 0 HG2 GLU A 14 4.822 -5.083 4.397 1.00 0.00 H new ATOM 0 HG3 GLU A 14 3.464 -5.895 5.150 1.00 0.00 H new ATOM 176 N VAL A 15 3.247 -3.919 3.172 1.00 0.00 N ATOM 177 CA VAL A 15 2.446 -2.824 3.689 1.00 0.00 C ATOM 178 C VAL A 15 1.248 -2.594 2.766 1.00 0.00 C ATOM 179 O VAL A 15 0.118 -2.932 3.113 1.00 0.00 O ATOM 180 CB VAL A 15 3.315 -1.576 3.863 1.00 0.00 C ATOM 181 CG1 VAL A 15 2.451 -0.334 4.090 1.00 0.00 C ATOM 182 CG2 VAL A 15 4.320 -1.761 5.001 1.00 0.00 C ATOM 0 H VAL A 15 4.248 -3.728 3.120 1.00 0.00 H new ATOM 0 HA VAL A 15 2.054 -3.071 4.676 1.00 0.00 H new ATOM 0 HB VAL A 15 3.878 -1.429 2.941 1.00 0.00 H new ATOM 0 HG11 VAL A 15 3.093 0.539 4.211 1.00 0.00 H new ATOM 0 HG12 VAL A 15 1.794 -0.186 3.233 1.00 0.00 H new ATOM 0 HG13 VAL A 15 1.849 -0.469 4.989 1.00 0.00 H new ATOM 0 HG21 VAL A 15 4.924 -0.860 5.103 1.00 0.00 H new ATOM 0 HG22 VAL A 15 3.785 -1.946 5.932 1.00 0.00 H new ATOM 0 HG23 VAL A 15 4.968 -2.609 4.780 1.00 0.00 H new ATOM 192 N PHE A 16 1.537 -2.020 1.606 1.00 0.00 N ATOM 193 CA PHE A 16 0.497 -1.742 0.630 1.00 0.00 C ATOM 194 C PHE A 16 -0.447 -2.936 0.478 1.00 0.00 C ATOM 195 O PHE A 16 -1.651 -2.761 0.297 1.00 0.00 O ATOM 196 CB PHE A 16 1.196 -1.486 -0.707 1.00 0.00 C ATOM 197 CG PHE A 16 1.782 -0.080 -0.845 1.00 0.00 C ATOM 198 CD1 PHE A 16 1.095 0.993 -0.369 1.00 0.00 C ATOM 199 CD2 PHE A 16 2.992 0.096 -1.442 1.00 0.00 C ATOM 200 CE1 PHE A 16 1.639 2.297 -0.497 1.00 0.00 C ATOM 201 CE2 PHE A 16 3.536 1.402 -1.569 1.00 0.00 C ATOM 202 CZ PHE A 16 2.849 2.474 -1.094 1.00 0.00 C ATOM 0 H PHE A 16 2.476 -1.740 1.321 1.00 0.00 H new ATOM 0 HA PHE A 16 -0.095 -0.885 0.951 1.00 0.00 H new ATOM 0 HB2 PHE A 16 1.996 -2.216 -0.832 1.00 0.00 H new ATOM 0 HB3 PHE A 16 0.484 -1.652 -1.515 1.00 0.00 H new ATOM 0 HD1 PHE A 16 0.135 0.852 0.106 1.00 0.00 H new ATOM 0 HD2 PHE A 16 3.538 -0.756 -1.819 1.00 0.00 H new ATOM 0 HE1 PHE A 16 1.093 3.149 -0.121 1.00 0.00 H new ATOM 0 HE2 PHE A 16 4.496 1.543 -2.043 1.00 0.00 H new ATOM 0 HZ PHE A 16 3.263 3.467 -1.190 1.00 0.00 H new ATOM 211 N ASP A 17 0.135 -4.124 0.559 1.00 0.00 N ATOM 212 CA ASP A 17 -0.641 -5.346 0.434 1.00 0.00 C ATOM 213 C ASP A 17 -1.585 -5.472 1.632 1.00 0.00 C ATOM 214 O ASP A 17 -2.803 -5.474 1.469 1.00 0.00 O ATOM 215 CB ASP A 17 0.269 -6.576 0.418 1.00 0.00 C ATOM 216 CG ASP A 17 0.664 -7.070 -0.976 1.00 0.00 C ATOM 217 OD1 ASP A 17 0.886 -6.200 -1.844 1.00 0.00 O ATOM 218 OD2 ASP A 17 0.734 -8.307 -1.140 1.00 0.00 O ATOM 0 H ASP A 17 1.134 -4.266 0.710 1.00 0.00 H new ATOM 0 HA ASP A 17 -1.199 -5.297 -0.501 1.00 0.00 H new ATOM 0 HB2 ASP A 17 1.176 -6.345 0.976 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -0.232 -7.387 0.946 1.00 0.00 H new ATOM 222 N VAL A 18 -0.985 -5.576 2.808 1.00 0.00 N ATOM 223 CA VAL A 18 -1.756 -5.702 4.033 1.00 0.00 C ATOM 224 C VAL A 18 -2.897 -4.683 4.020 1.00 0.00 C ATOM 225 O VAL A 18 -4.067 -5.054 4.103 1.00 0.00 O ATOM 226 CB VAL A 18 -0.837 -5.555 5.248 1.00 0.00 C ATOM 227 CG1 VAL A 18 -1.625 -5.103 6.480 1.00 0.00 C ATOM 228 CG2 VAL A 18 -0.084 -6.858 5.526 1.00 0.00 C ATOM 0 H VAL A 18 0.027 -5.576 2.939 1.00 0.00 H new ATOM 0 HA VAL A 18 -2.206 -6.693 4.100 1.00 0.00 H new ATOM 0 HB VAL A 18 -0.101 -4.784 5.020 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.949 -5.006 7.329 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -2.094 -4.140 6.279 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -2.394 -5.840 6.711 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.562 -6.727 6.394 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -0.799 -7.657 5.723 1.00 0.00 H new ATOM 0 HG23 VAL A 18 0.522 -7.120 4.659 1.00 0.00 H new ATOM 238 N LEU A 19 -2.516 -3.418 3.915 1.00 0.00 N ATOM 239 CA LEU A 19 -3.493 -2.342 3.890 1.00 0.00 C ATOM 240 C LEU A 19 -4.604 -2.691 2.897 1.00 0.00 C ATOM 241 O LEU A 19 -5.769 -2.794 3.275 1.00 0.00 O ATOM 242 CB LEU A 19 -2.808 -1.004 3.602 1.00 0.00 C ATOM 243 CG LEU A 19 -1.626 -0.647 4.505 1.00 0.00 C ATOM 244 CD1 LEU A 19 -1.264 0.834 4.375 1.00 0.00 C ATOM 245 CD2 LEU A 19 -1.906 -1.044 5.956 1.00 0.00 C ATOM 0 H LEU A 19 -1.545 -3.114 3.846 1.00 0.00 H new ATOM 0 HA LEU A 19 -3.962 -2.230 4.867 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.461 -1.011 2.569 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.553 -0.212 3.682 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.759 -1.220 4.176 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -0.421 1.061 5.027 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -0.993 1.053 3.342 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.120 1.444 4.663 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -1.050 -0.779 6.577 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.791 -0.517 6.313 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -2.077 -2.119 6.013 1.00 0.00 H new ATOM 256 N TYR A 20 -4.203 -2.863 1.646 1.00 0.00 N ATOM 257 CA TYR A 20 -5.150 -3.198 0.596 1.00 0.00 C ATOM 258 C TYR A 20 -6.071 -4.339 1.032 1.00 0.00 C ATOM 259 O TYR A 20 -7.293 -4.222 0.948 1.00 0.00 O ATOM 260 CB TYR A 20 -4.311 -3.664 -0.595 1.00 0.00 C ATOM 261 CG TYR A 20 -5.139 -4.127 -1.796 1.00 0.00 C ATOM 262 CD1 TYR A 20 -6.203 -3.366 -2.235 1.00 0.00 C ATOM 263 CD2 TYR A 20 -4.821 -5.306 -2.440 1.00 0.00 C ATOM 264 CE1 TYR A 20 -6.982 -3.802 -3.365 1.00 0.00 C ATOM 265 CE2 TYR A 20 -5.600 -5.742 -3.570 1.00 0.00 C ATOM 266 CZ TYR A 20 -6.642 -4.968 -3.977 1.00 0.00 C ATOM 267 OH TYR A 20 -7.378 -5.380 -5.044 1.00 0.00 O ATOM 0 H TYR A 20 -3.235 -2.777 1.336 1.00 0.00 H new ATOM 0 HA TYR A 20 -5.777 -2.339 0.356 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -3.659 -2.848 -0.909 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -3.666 -4.482 -0.274 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -6.452 -2.444 -1.731 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -3.988 -5.901 -2.096 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -7.818 -3.216 -3.719 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -5.362 -6.662 -4.083 1.00 0.00 H new ATOM 0 HH TYR A 20 -7.020 -6.228 -5.381 1.00 0.00 H new ATOM 276 N SER A 21 -5.451 -5.416 1.491 1.00 0.00 N ATOM 277 CA SER A 21 -6.199 -6.577 1.941 1.00 0.00 C ATOM 278 C SER A 21 -7.143 -6.182 3.079 1.00 0.00 C ATOM 279 O SER A 21 -8.282 -6.645 3.134 1.00 0.00 O ATOM 280 CB SER A 21 -5.260 -7.696 2.394 1.00 0.00 C ATOM 281 OG SER A 21 -5.959 -8.740 3.068 1.00 0.00 O ATOM 0 H SER A 21 -4.438 -5.509 1.561 1.00 0.00 H new ATOM 0 HA SER A 21 -6.787 -6.951 1.103 1.00 0.00 H new ATOM 0 HB2 SER A 21 -4.742 -8.107 1.528 1.00 0.00 H new ATOM 0 HB3 SER A 21 -4.498 -7.284 3.056 1.00 0.00 H new ATOM 0 HG SER A 21 -5.779 -9.594 2.623 1.00 0.00 H new ATOM 286 N GLU A 22 -6.635 -5.331 3.957 1.00 0.00 N ATOM 287 CA GLU A 22 -7.419 -4.869 5.090 1.00 0.00 C ATOM 288 C GLU A 22 -8.675 -4.141 4.605 1.00 0.00 C ATOM 289 O GLU A 22 -9.781 -4.445 5.048 1.00 0.00 O ATOM 290 CB GLU A 22 -6.583 -3.970 6.004 1.00 0.00 C ATOM 291 CG GLU A 22 -5.526 -4.783 6.754 1.00 0.00 C ATOM 292 CD GLU A 22 -5.552 -4.467 8.251 1.00 0.00 C ATOM 293 OE1 GLU A 22 -4.929 -3.451 8.628 1.00 0.00 O ATOM 294 OE2 GLU A 22 -6.195 -5.249 8.985 1.00 0.00 O ATOM 0 H GLU A 22 -5.691 -4.949 3.907 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.728 -5.737 5.672 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.098 -3.194 5.412 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -7.234 -3.466 6.718 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -5.704 -5.847 6.600 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -4.538 -4.563 6.349 1.00 0.00 H new ATOM 299 N ALA A 23 -8.461 -3.195 3.703 1.00 0.00 N ATOM 300 CA ALA A 23 -9.562 -2.422 3.153 1.00 0.00 C ATOM 301 C ALA A 23 -10.500 -3.355 2.384 1.00 0.00 C ATOM 302 O ALA A 23 -11.709 -3.131 2.346 1.00 0.00 O ATOM 303 CB ALA A 23 -9.009 -1.298 2.275 1.00 0.00 C ATOM 0 H ALA A 23 -7.541 -2.946 3.339 1.00 0.00 H new ATOM 0 HA ALA A 23 -10.141 -1.957 3.951 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -9.835 -0.719 1.863 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -8.373 -0.647 2.875 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -8.424 -1.726 1.461 1.00 0.00 H new ATOM 309 N LEU A 24 -9.906 -4.381 1.790 1.00 0.00 N ATOM 310 CA LEU A 24 -10.675 -5.348 1.024 1.00 0.00 C ATOM 311 C LEU A 24 -11.418 -6.277 1.985 1.00 0.00 C ATOM 312 O LEU A 24 -12.428 -6.877 1.617 1.00 0.00 O ATOM 313 CB LEU A 24 -9.772 -6.083 0.031 1.00 0.00 C ATOM 314 CG LEU A 24 -9.839 -5.602 -1.419 1.00 0.00 C ATOM 315 CD1 LEU A 24 -8.730 -6.237 -2.260 1.00 0.00 C ATOM 316 CD2 LEU A 24 -11.225 -5.851 -2.016 1.00 0.00 C ATOM 0 H LEU A 24 -8.903 -4.563 1.824 1.00 0.00 H new ATOM 0 HA LEU A 24 -11.430 -4.844 0.420 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -8.741 -5.996 0.375 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -10.027 -7.142 0.054 1.00 0.00 H new ATOM 0 HG LEU A 24 -9.673 -4.525 -1.429 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -8.801 -5.878 -3.287 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.759 -5.965 -1.847 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -8.839 -7.321 -2.247 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -11.245 -5.500 -3.048 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -11.445 -6.918 -1.992 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -11.974 -5.313 -1.435 1.00 0.00 H new ATOM 327 N GLY A 25 -10.890 -6.371 3.196 1.00 0.00 N ATOM 328 CA GLY A 25 -11.490 -7.218 4.212 1.00 0.00 C ATOM 329 C GLY A 25 -11.400 -8.694 3.819 1.00 0.00 C ATOM 330 O GLY A 25 -12.370 -9.437 3.952 1.00 0.00 O ATOM 0 H GLY A 25 -10.052 -5.874 3.497 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -10.986 -7.061 5.166 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -12.534 -6.939 4.353 1.00 0.00 H new ATOM 334 N ARG A 26 -10.223 -9.075 3.341 1.00 0.00 N ATOM 335 CA ARG A 26 -9.993 -10.448 2.928 1.00 0.00 C ATOM 336 C ARG A 26 -9.338 -11.241 4.062 1.00 0.00 C ATOM 337 O ARG A 26 -9.003 -10.679 5.103 1.00 0.00 O ATOM 338 CB ARG A 26 -9.097 -10.508 1.689 1.00 0.00 C ATOM 339 CG ARG A 26 -9.739 -9.769 0.513 1.00 0.00 C ATOM 340 CD ARG A 26 -10.259 -10.756 -0.535 1.00 0.00 C ATOM 341 NE ARG A 26 -11.374 -10.147 -1.294 1.00 0.00 N ATOM 342 CZ ARG A 26 -12.175 -10.825 -2.127 1.00 0.00 C ATOM 343 NH1 ARG A 26 -11.990 -12.139 -2.313 1.00 0.00 N ATOM 344 NH2 ARG A 26 -13.161 -10.189 -2.774 1.00 0.00 N ATOM 0 H ARG A 26 -9.420 -8.456 3.231 1.00 0.00 H new ATOM 0 HA ARG A 26 -10.960 -10.887 2.684 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -8.127 -10.066 1.915 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -8.917 -11.548 1.416 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -10.560 -9.149 0.873 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -9.009 -9.099 0.057 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -9.454 -11.034 -1.215 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -10.596 -11.671 -0.049 1.00 0.00 H new ATOM 0 HE ARG A 26 -11.543 -9.148 -1.176 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -11.239 -12.623 -1.820 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -12.600 -12.655 -2.947 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -13.302 -9.189 -2.632 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -13.771 -10.705 -3.408 1.00 0.00 H new ATOM 355 N ALA A 27 -9.176 -12.533 3.819 1.00 0.00 N ATOM 356 CA ALA A 27 -8.566 -13.409 4.807 1.00 0.00 C ATOM 357 C ALA A 27 -7.061 -13.497 4.544 1.00 0.00 C ATOM 358 O ALA A 27 -6.258 -13.357 5.465 1.00 0.00 O ATOM 359 CB ALA A 27 -9.247 -14.779 4.763 1.00 0.00 C ATOM 0 H ALA A 27 -9.456 -12.995 2.954 1.00 0.00 H new ATOM 0 HA ALA A 27 -8.702 -13.009 5.812 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -8.790 -15.436 5.503 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -10.308 -14.665 4.984 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -9.128 -15.213 3.770 1.00 0.00 H new ATOM 365 N SER A 28 -6.725 -13.729 3.284 1.00 0.00 N ATOM 366 CA SER A 28 -5.331 -13.836 2.889 1.00 0.00 C ATOM 367 C SER A 28 -4.827 -12.487 2.374 1.00 0.00 C ATOM 368 O SER A 28 -5.621 -11.621 2.009 1.00 0.00 O ATOM 369 CB SER A 28 -5.143 -14.915 1.821 1.00 0.00 C ATOM 370 OG SER A 28 -5.854 -16.109 2.137 1.00 0.00 O ATOM 0 H SER A 28 -7.394 -13.846 2.523 1.00 0.00 H new ATOM 0 HA SER A 28 -4.749 -14.123 3.765 1.00 0.00 H new ATOM 0 HB2 SER A 28 -5.483 -14.535 0.858 1.00 0.00 H new ATOM 0 HB3 SER A 28 -4.082 -15.142 1.718 1.00 0.00 H new ATOM 0 HG SER A 28 -5.710 -16.772 1.430 1.00 0.00 H new ATOM 375 N VAL A 29 -3.508 -12.349 2.360 1.00 0.00 N ATOM 376 CA VAL A 29 -2.889 -11.120 1.897 1.00 0.00 C ATOM 377 C VAL A 29 -2.741 -11.172 0.374 1.00 0.00 C ATOM 378 O VAL A 29 -2.010 -12.008 -0.153 1.00 0.00 O ATOM 379 CB VAL A 29 -1.559 -10.899 2.619 1.00 0.00 C ATOM 380 CG1 VAL A 29 -0.806 -9.704 2.029 1.00 0.00 C ATOM 381 CG2 VAL A 29 -1.776 -10.722 4.124 1.00 0.00 C ATOM 0 H VAL A 29 -2.852 -13.069 2.662 1.00 0.00 H new ATOM 0 HA VAL A 29 -3.518 -10.262 2.134 1.00 0.00 H new ATOM 0 HB VAL A 29 -0.945 -11.787 2.471 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.136 -9.569 2.561 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -0.604 -9.886 0.973 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -1.413 -8.805 2.132 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -0.815 -10.566 4.614 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -2.417 -9.858 4.300 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.250 -11.615 4.531 1.00 0.00 H new ATOM 391 N VAL A 30 -3.446 -10.266 -0.288 1.00 0.00 N ATOM 392 CA VAL A 30 -3.403 -10.199 -1.738 1.00 0.00 C ATOM 393 C VAL A 30 -2.436 -9.092 -2.164 1.00 0.00 C ATOM 394 O VAL A 30 -2.189 -8.154 -1.408 1.00 0.00 O ATOM 395 CB VAL A 30 -4.815 -10.005 -2.297 1.00 0.00 C ATOM 396 CG1 VAL A 30 -5.565 -11.336 -2.362 1.00 0.00 C ATOM 397 CG2 VAL A 30 -5.593 -8.977 -1.474 1.00 0.00 C ATOM 0 H VAL A 30 -4.050 -9.573 0.154 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.030 -11.136 -2.152 1.00 0.00 H new ATOM 0 HB VAL A 30 -4.724 -9.621 -3.313 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -6.565 -11.171 -2.762 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -5.025 -12.027 -3.009 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -5.641 -11.760 -1.361 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.593 -8.858 -1.892 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -5.670 -9.320 -0.442 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.072 -8.020 -1.501 1.00 0.00 H new ATOM 407 N PRO A 31 -1.900 -9.243 -3.405 1.00 0.00 N ATOM 408 CA PRO A 31 -0.964 -8.269 -3.940 1.00 0.00 C ATOM 409 C PRO A 31 -1.690 -6.992 -4.371 1.00 0.00 C ATOM 410 O PRO A 31 -2.919 -6.939 -4.360 1.00 0.00 O ATOM 411 CB PRO A 31 -0.274 -8.977 -5.094 1.00 0.00 C ATOM 412 CG PRO A 31 -1.168 -10.152 -5.457 1.00 0.00 C ATOM 413 CD PRO A 31 -2.169 -10.342 -4.328 1.00 0.00 C ATOM 0 HA PRO A 31 -0.234 -7.937 -3.201 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -0.147 -8.306 -5.944 1.00 0.00 H new ATOM 0 HB3 PRO A 31 0.720 -9.317 -4.805 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -1.685 -9.962 -6.398 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -0.574 -11.055 -5.596 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -3.194 -10.307 -4.697 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -2.038 -11.309 -3.842 1.00 0.00 H new ATOM 418 N LEU A 32 -0.898 -5.996 -4.740 1.00 0.00 N ATOM 419 CA LEU A 32 -1.449 -4.723 -5.174 1.00 0.00 C ATOM 420 C LEU A 32 -1.094 -4.493 -6.644 1.00 0.00 C ATOM 421 O LEU A 32 0.025 -4.091 -6.960 1.00 0.00 O ATOM 422 CB LEU A 32 -0.990 -3.597 -4.246 1.00 0.00 C ATOM 423 CG LEU A 32 -1.249 -2.173 -4.742 1.00 0.00 C ATOM 424 CD1 LEU A 32 -2.620 -2.067 -5.413 1.00 0.00 C ATOM 425 CD2 LEU A 32 -1.086 -1.158 -3.608 1.00 0.00 C ATOM 0 H LEU A 32 0.121 -6.045 -4.747 1.00 0.00 H new ATOM 0 HA LEU A 32 -2.537 -4.736 -5.107 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -1.486 -3.721 -3.283 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.080 -3.711 -4.071 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.501 -1.934 -5.498 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.779 -1.045 -5.756 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -2.662 -2.746 -6.264 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -3.397 -2.334 -4.697 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.276 -0.154 -3.988 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.795 -1.385 -2.812 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.071 -1.211 -3.215 1.00 0.00 H new ATOM 436 N PRO A 33 -2.093 -4.764 -7.526 1.00 0.00 N ATOM 437 CA PRO A 33 -1.897 -4.591 -8.955 1.00 0.00 C ATOM 438 C PRO A 33 -1.917 -3.109 -9.336 1.00 0.00 C ATOM 439 O PRO A 33 -2.879 -2.631 -9.936 1.00 0.00 O ATOM 440 CB PRO A 33 -3.018 -5.386 -9.605 1.00 0.00 C ATOM 441 CG PRO A 33 -4.066 -5.590 -8.523 1.00 0.00 C ATOM 442 CD PRO A 33 -3.430 -5.241 -7.187 1.00 0.00 C ATOM 0 HA PRO A 33 -0.925 -4.950 -9.292 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -3.435 -4.848 -10.456 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -2.652 -6.342 -9.980 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -4.935 -4.958 -8.709 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -4.417 -6.622 -8.521 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -4.003 -4.475 -6.664 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -3.386 -6.110 -6.531 1.00 0.00 H new ATOM 447 N TYR A 34 -0.843 -2.423 -8.971 1.00 0.00 N ATOM 448 CA TYR A 34 -0.725 -1.005 -9.266 1.00 0.00 C ATOM 449 C TYR A 34 -1.072 -0.719 -10.728 1.00 0.00 C ATOM 450 O TYR A 34 -1.915 0.130 -11.015 1.00 0.00 O ATOM 451 CB TYR A 34 0.742 -0.645 -9.023 1.00 0.00 C ATOM 452 CG TYR A 34 1.205 -0.864 -7.582 1.00 0.00 C ATOM 453 CD1 TYR A 34 1.041 0.137 -6.645 1.00 0.00 C ATOM 454 CD2 TYR A 34 1.789 -2.060 -7.218 1.00 0.00 C ATOM 455 CE1 TYR A 34 1.478 -0.070 -5.288 1.00 0.00 C ATOM 456 CE2 TYR A 34 2.225 -2.267 -5.862 1.00 0.00 C ATOM 457 CZ TYR A 34 2.048 -1.261 -4.964 1.00 0.00 C ATOM 458 OH TYR A 34 2.460 -1.455 -3.682 1.00 0.00 O ATOM 0 H TYR A 34 -0.047 -2.823 -8.474 1.00 0.00 H new ATOM 0 HA TYR A 34 -1.407 -0.425 -8.644 1.00 0.00 H new ATOM 0 HB2 TYR A 34 1.367 -1.240 -9.689 1.00 0.00 H new ATOM 0 HB3 TYR A 34 0.898 0.400 -9.289 1.00 0.00 H new ATOM 0 HD1 TYR A 34 0.586 1.074 -6.929 1.00 0.00 H new ATOM 0 HD2 TYR A 34 1.919 -2.842 -7.952 1.00 0.00 H new ATOM 0 HE1 TYR A 34 1.356 0.704 -4.545 1.00 0.00 H new ATOM 0 HE2 TYR A 34 2.682 -3.199 -5.565 1.00 0.00 H new ATOM 0 HH TYR A 34 2.300 -0.641 -3.160 1.00 0.00 H new ATOM 467 N GLU A 35 -0.405 -1.444 -11.615 1.00 0.00 N ATOM 468 CA GLU A 35 -0.634 -1.279 -13.040 1.00 0.00 C ATOM 469 C GLU A 35 -2.120 -1.053 -13.317 1.00 0.00 C ATOM 470 O GLU A 35 -2.480 -0.341 -14.254 1.00 0.00 O ATOM 471 CB GLU A 35 -0.106 -2.483 -13.823 1.00 0.00 C ATOM 472 CG GLU A 35 -0.849 -3.761 -13.428 1.00 0.00 C ATOM 473 CD GLU A 35 -0.248 -4.982 -14.126 1.00 0.00 C ATOM 474 OE1 GLU A 35 -0.422 -5.073 -15.361 1.00 0.00 O ATOM 475 OE2 GLU A 35 0.372 -5.798 -13.409 1.00 0.00 O ATOM 0 H GLU A 35 0.294 -2.147 -11.374 1.00 0.00 H new ATOM 0 HA GLU A 35 -0.085 -0.399 -13.377 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -0.223 -2.306 -14.892 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.961 -2.605 -13.634 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -0.801 -3.895 -12.347 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -1.903 -3.669 -13.691 1.00 0.00 H new ATOM 480 N ARG A 36 -2.946 -1.672 -12.487 1.00 0.00 N ATOM 481 CA ARG A 36 -4.386 -1.548 -12.630 1.00 0.00 C ATOM 482 C ARG A 36 -4.907 -0.393 -11.773 1.00 0.00 C ATOM 483 O ARG A 36 -5.372 0.617 -12.301 1.00 0.00 O ATOM 484 CB ARG A 36 -5.095 -2.839 -12.218 1.00 0.00 C ATOM 485 CG ARG A 36 -4.943 -3.916 -13.295 1.00 0.00 C ATOM 486 CD ARG A 36 -6.237 -4.716 -13.456 1.00 0.00 C ATOM 487 NE ARG A 36 -6.000 -6.136 -13.110 1.00 0.00 N ATOM 488 CZ ARG A 36 -6.891 -7.116 -13.309 1.00 0.00 C ATOM 489 NH1 ARG A 36 -8.084 -6.837 -13.853 1.00 0.00 N ATOM 490 NH2 ARG A 36 -6.591 -8.376 -12.965 1.00 0.00 N ATOM 0 H ARG A 36 -2.645 -2.262 -11.712 1.00 0.00 H new ATOM 0 HA ARG A 36 -4.598 -1.351 -13.681 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -4.682 -3.200 -11.276 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -6.152 -2.638 -12.046 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -4.678 -3.451 -14.245 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -4.126 -4.588 -13.030 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -7.013 -4.301 -12.813 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -6.597 -4.638 -14.482 1.00 0.00 H new ATOM 0 HE ARG A 36 -5.102 -6.383 -12.694 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -8.313 -5.878 -14.115 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -8.763 -7.583 -14.005 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -5.683 -8.589 -12.551 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -7.270 -9.122 -13.117 1.00 0.00 H new ATOM 501 N LEU A 37 -4.813 -0.579 -10.464 1.00 0.00 N ATOM 502 CA LEU A 37 -5.269 0.435 -9.529 1.00 0.00 C ATOM 503 C LEU A 37 -4.836 1.815 -10.029 1.00 0.00 C ATOM 504 O LEU A 37 -5.530 2.806 -9.804 1.00 0.00 O ATOM 505 CB LEU A 37 -4.785 0.114 -8.114 1.00 0.00 C ATOM 506 CG LEU A 37 -5.083 -1.298 -7.607 1.00 0.00 C ATOM 507 CD1 LEU A 37 -5.234 -1.314 -6.084 1.00 0.00 C ATOM 508 CD2 LEU A 37 -6.308 -1.886 -8.310 1.00 0.00 C ATOM 0 H LEU A 37 -4.428 -1.417 -10.029 1.00 0.00 H new ATOM 0 HA LEU A 37 -6.358 0.442 -9.475 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -3.707 0.272 -8.075 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -5.237 0.828 -7.426 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.233 -1.935 -7.853 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -5.445 -2.330 -5.750 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -4.310 -0.965 -5.623 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -6.054 -0.658 -5.793 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -6.498 -2.890 -7.931 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.176 -1.255 -8.117 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.124 -1.932 -9.383 1.00 0.00 H new ATOM 519 N LEU A 38 -3.693 1.836 -10.697 1.00 0.00 N ATOM 520 CA LEU A 38 -3.160 3.078 -11.231 1.00 0.00 C ATOM 521 C LEU A 38 -4.084 3.591 -12.336 1.00 0.00 C ATOM 522 O LEU A 38 -4.490 4.752 -12.322 1.00 0.00 O ATOM 523 CB LEU A 38 -1.710 2.889 -11.680 1.00 0.00 C ATOM 524 CG LEU A 38 -0.689 2.640 -10.567 1.00 0.00 C ATOM 525 CD1 LEU A 38 0.643 2.156 -11.144 1.00 0.00 C ATOM 526 CD2 LEU A 38 -0.518 3.883 -9.692 1.00 0.00 C ATOM 0 H LEU A 38 -3.120 1.012 -10.881 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.132 3.845 -10.457 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.672 2.050 -12.375 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -1.404 3.776 -12.235 1.00 0.00 H new ATOM 0 HG LEU A 38 -1.069 1.845 -9.925 1.00 0.00 H new ATOM 0 HD11 LEU A 38 1.351 1.987 -10.333 1.00 0.00 H new ATOM 0 HD12 LEU A 38 0.487 1.225 -11.689 1.00 0.00 H new ATOM 0 HD13 LEU A 38 1.042 2.911 -11.822 1.00 0.00 H new ATOM 0 HD21 LEU A 38 0.213 3.679 -8.909 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -0.171 4.715 -10.305 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.474 4.142 -9.237 1.00 0.00 H new ATOM 537 N ARG A 39 -4.391 2.701 -13.269 1.00 0.00 N ATOM 538 CA ARG A 39 -5.260 3.050 -14.380 1.00 0.00 C ATOM 539 C ARG A 39 -6.528 3.734 -13.867 1.00 0.00 C ATOM 540 O ARG A 39 -6.946 4.757 -14.406 1.00 0.00 O ATOM 541 CB ARG A 39 -5.648 1.808 -15.186 1.00 0.00 C ATOM 542 CG ARG A 39 -6.454 2.191 -16.428 1.00 0.00 C ATOM 543 CD ARG A 39 -6.591 1.002 -17.381 1.00 0.00 C ATOM 544 NE ARG A 39 -7.579 1.313 -18.440 1.00 0.00 N ATOM 545 CZ ARG A 39 -7.309 2.047 -19.527 1.00 0.00 C ATOM 546 NH1 ARG A 39 -6.080 2.550 -19.708 1.00 0.00 N ATOM 547 NH2 ARG A 39 -8.267 2.277 -20.435 1.00 0.00 N ATOM 0 H ARG A 39 -4.053 1.739 -13.278 1.00 0.00 H new ATOM 0 HA ARG A 39 -4.712 3.734 -15.029 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -4.749 1.268 -15.484 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -6.234 1.133 -14.562 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -7.443 2.539 -16.131 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -5.966 3.019 -16.942 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -5.625 0.772 -17.830 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -6.905 0.116 -16.828 1.00 0.00 H new ATOM 0 HE ARG A 39 -8.524 0.945 -18.335 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -5.350 2.374 -19.018 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -5.875 3.109 -20.536 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -9.202 1.893 -20.298 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -8.061 2.836 -21.263 1.00 0.00 H new ATOM 558 N GLU A 40 -7.105 3.141 -12.832 1.00 0.00 N ATOM 559 CA GLU A 40 -8.317 3.681 -12.240 1.00 0.00 C ATOM 560 C GLU A 40 -8.075 4.050 -10.776 1.00 0.00 C ATOM 561 O GLU A 40 -8.003 3.175 -9.915 1.00 0.00 O ATOM 562 CB GLU A 40 -9.478 2.692 -12.371 1.00 0.00 C ATOM 563 CG GLU A 40 -8.968 1.250 -12.420 1.00 0.00 C ATOM 564 CD GLU A 40 -10.113 0.273 -12.692 1.00 0.00 C ATOM 565 OE1 GLU A 40 -11.225 0.548 -12.193 1.00 0.00 O ATOM 566 OE2 GLU A 40 -9.850 -0.728 -13.393 1.00 0.00 O ATOM 0 H GLU A 40 -6.755 2.292 -12.388 1.00 0.00 H new ATOM 0 HA GLU A 40 -8.590 4.587 -12.782 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -10.159 2.812 -11.529 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -10.047 2.911 -13.275 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -8.211 1.154 -13.198 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.487 0.998 -11.475 1.00 0.00 H new ATOM 571 N PRO A 41 -7.950 5.382 -10.533 1.00 0.00 N ATOM 572 CA PRO A 41 -7.717 5.878 -9.186 1.00 0.00 C ATOM 573 C PRO A 41 -8.994 5.809 -8.347 1.00 0.00 C ATOM 574 O PRO A 41 -8.931 5.703 -7.123 1.00 0.00 O ATOM 575 CB PRO A 41 -7.205 7.297 -9.373 1.00 0.00 C ATOM 576 CG PRO A 41 -7.610 7.704 -10.782 1.00 0.00 C ATOM 577 CD PRO A 41 -8.028 6.448 -11.528 1.00 0.00 C ATOM 0 HA PRO A 41 -6.994 5.277 -8.636 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -7.638 7.969 -8.632 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -6.123 7.341 -9.249 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -8.431 8.421 -10.751 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -6.779 8.192 -11.292 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -9.037 6.543 -11.928 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -7.367 6.251 -12.372 1.00 0.00 H new ATOM 582 N GLY A 42 -10.122 5.871 -9.039 1.00 0.00 N ATOM 583 CA GLY A 42 -11.412 5.816 -8.372 1.00 0.00 C ATOM 584 C GLY A 42 -11.664 4.429 -7.777 1.00 0.00 C ATOM 585 O GLY A 42 -12.348 4.299 -6.763 1.00 0.00 O ATOM 0 H GLY A 42 -10.170 5.959 -10.054 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -11.449 6.566 -7.582 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -12.203 6.060 -9.081 1.00 0.00 H new ATOM 589 N LEU A 43 -11.097 3.428 -8.434 1.00 0.00 N ATOM 590 CA LEU A 43 -11.252 2.055 -7.984 1.00 0.00 C ATOM 591 C LEU A 43 -10.653 1.911 -6.583 1.00 0.00 C ATOM 592 O LEU A 43 -11.235 1.261 -5.718 1.00 0.00 O ATOM 593 CB LEU A 43 -10.660 1.085 -9.009 1.00 0.00 C ATOM 594 CG LEU A 43 -11.068 -0.382 -8.857 1.00 0.00 C ATOM 595 CD1 LEU A 43 -12.501 -0.606 -9.348 1.00 0.00 C ATOM 596 CD2 LEU A 43 -10.071 -1.304 -9.561 1.00 0.00 C ATOM 0 H LEU A 43 -10.530 3.540 -9.274 1.00 0.00 H new ATOM 0 HA LEU A 43 -12.308 1.796 -7.908 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -10.948 1.420 -10.005 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -9.573 1.147 -8.953 1.00 0.00 H new ATOM 0 HG LEU A 43 -11.047 -0.634 -7.797 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -12.766 -1.657 -9.229 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -13.186 0.010 -8.765 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -12.572 -0.331 -10.400 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -10.384 -2.341 -9.438 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -10.036 -1.059 -10.623 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -9.081 -1.170 -9.125 1.00 0.00 H new ATOM 607 N LEU A 44 -9.495 2.530 -6.404 1.00 0.00 N ATOM 608 CA LEU A 44 -8.810 2.480 -5.124 1.00 0.00 C ATOM 609 C LEU A 44 -7.846 3.664 -5.020 1.00 0.00 C ATOM 610 O LEU A 44 -6.853 3.726 -5.743 1.00 0.00 O ATOM 611 CB LEU A 44 -8.137 1.120 -4.930 1.00 0.00 C ATOM 612 CG LEU A 44 -7.096 1.039 -3.810 1.00 0.00 C ATOM 613 CD1 LEU A 44 -7.594 1.751 -2.549 1.00 0.00 C ATOM 614 CD2 LEU A 44 -6.701 -0.412 -3.532 1.00 0.00 C ATOM 0 H LEU A 44 -9.014 3.069 -7.124 1.00 0.00 H new ATOM 0 HA LEU A 44 -9.523 2.576 -4.306 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -8.911 0.379 -4.733 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.656 0.838 -5.867 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.196 1.558 -4.140 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.837 1.680 -1.768 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.785 2.800 -2.775 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.515 1.281 -2.205 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -5.961 -0.441 -2.733 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -7.583 -0.978 -3.231 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -6.278 -0.853 -4.434 1.00 0.00 H new ATOM 625 N ALA A 45 -8.172 4.572 -4.112 1.00 0.00 N ATOM 626 CA ALA A 45 -7.347 5.750 -3.903 1.00 0.00 C ATOM 627 C ALA A 45 -6.463 5.537 -2.673 1.00 0.00 C ATOM 628 O ALA A 45 -6.938 5.084 -1.633 1.00 0.00 O ATOM 629 CB ALA A 45 -8.243 6.983 -3.770 1.00 0.00 C ATOM 0 H ALA A 45 -8.996 4.516 -3.513 1.00 0.00 H new ATOM 0 HA ALA A 45 -6.690 5.914 -4.757 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -7.625 7.867 -3.613 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -8.829 7.107 -4.681 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -8.915 6.855 -2.921 1.00 0.00 H new ATOM 635 N VAL A 46 -5.191 5.873 -2.833 1.00 0.00 N ATOM 636 CA VAL A 46 -4.236 5.724 -1.748 1.00 0.00 C ATOM 637 C VAL A 46 -4.088 7.060 -1.017 1.00 0.00 C ATOM 638 O VAL A 46 -3.651 8.048 -1.606 1.00 0.00 O ATOM 639 CB VAL A 46 -2.909 5.187 -2.290 1.00 0.00 C ATOM 640 CG1 VAL A 46 -1.947 4.851 -1.149 1.00 0.00 C ATOM 641 CG2 VAL A 46 -3.136 3.973 -3.192 1.00 0.00 C ATOM 0 H VAL A 46 -4.800 6.248 -3.697 1.00 0.00 H new ATOM 0 HA VAL A 46 -4.594 4.995 -1.021 1.00 0.00 H new ATOM 0 HB VAL A 46 -2.452 5.971 -2.894 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -1.012 4.472 -1.561 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -1.748 5.749 -0.565 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -2.395 4.092 -0.507 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -2.177 3.611 -3.564 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -3.626 3.183 -2.623 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -3.767 4.258 -4.034 1.00 0.00 H new ATOM 651 N GLN A 47 -4.459 7.047 0.254 1.00 0.00 N ATOM 652 CA GLN A 47 -4.372 8.245 1.070 1.00 0.00 C ATOM 653 C GLN A 47 -3.376 8.038 2.213 1.00 0.00 C ATOM 654 O GLN A 47 -2.999 6.907 2.516 1.00 0.00 O ATOM 655 CB GLN A 47 -5.748 8.642 1.609 1.00 0.00 C ATOM 656 CG GLN A 47 -6.546 9.417 0.557 1.00 0.00 C ATOM 657 CD GLN A 47 -6.034 10.853 0.429 1.00 0.00 C ATOM 658 OE1 GLN A 47 -5.120 11.149 -0.323 1.00 0.00 O ATOM 659 NE2 GLN A 47 -6.672 11.725 1.204 1.00 0.00 N ATOM 0 H GLN A 47 -4.821 6.226 0.739 1.00 0.00 H new ATOM 0 HA GLN A 47 -4.013 9.062 0.444 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -6.299 7.749 1.903 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -5.630 9.253 2.504 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -6.470 8.913 -0.406 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -7.601 9.426 0.830 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -7.429 11.410 1.811 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -6.404 12.709 1.192 1.00 0.00 H new ATOM 666 N GLY A 48 -2.977 9.148 2.817 1.00 0.00 N ATOM 667 CA GLY A 48 -2.031 9.103 3.919 1.00 0.00 C ATOM 668 C GLY A 48 -0.644 8.677 3.434 1.00 0.00 C ATOM 669 O GLY A 48 0.118 8.065 4.181 1.00 0.00 O ATOM 0 H GLY A 48 -3.292 10.085 2.564 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -1.970 10.084 4.391 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -2.385 8.406 4.678 1.00 0.00 H new ATOM 673 N LEU A 49 -0.358 9.017 2.186 1.00 0.00 N ATOM 674 CA LEU A 49 0.924 8.678 1.593 1.00 0.00 C ATOM 675 C LEU A 49 2.005 9.598 2.165 1.00 0.00 C ATOM 676 O LEU A 49 1.697 10.613 2.787 1.00 0.00 O ATOM 677 CB LEU A 49 0.833 8.712 0.066 1.00 0.00 C ATOM 678 CG LEU A 49 0.449 7.395 -0.612 1.00 0.00 C ATOM 679 CD1 LEU A 49 -0.172 7.648 -1.988 1.00 0.00 C ATOM 680 CD2 LEU A 49 1.648 6.448 -0.690 1.00 0.00 C ATOM 0 H LEU A 49 -0.993 9.524 1.569 1.00 0.00 H new ATOM 0 HA LEU A 49 1.205 7.657 1.850 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.103 9.470 -0.218 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.797 9.033 -0.329 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.309 6.905 -0.001 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.436 6.696 -2.449 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.068 8.258 -1.876 1.00 0.00 H new ATOM 0 HD13 LEU A 49 0.546 8.171 -2.621 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.348 5.520 -1.176 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.446 6.917 -1.266 1.00 0.00 H new ATOM 0 HD23 LEU A 49 2.006 6.231 0.316 1.00 0.00 H new ATOM 691 N PRO A 50 3.283 9.197 1.929 1.00 0.00 N ATOM 692 CA PRO A 50 4.412 9.973 2.415 1.00 0.00 C ATOM 693 C PRO A 50 4.615 11.233 1.571 1.00 0.00 C ATOM 694 O PRO A 50 5.157 11.166 0.469 1.00 0.00 O ATOM 695 CB PRO A 50 5.597 9.022 2.356 1.00 0.00 C ATOM 696 CG PRO A 50 5.189 7.905 1.411 1.00 0.00 C ATOM 697 CD PRO A 50 3.686 8.000 1.197 1.00 0.00 C ATOM 0 HA PRO A 50 4.263 10.342 3.430 1.00 0.00 H new ATOM 0 HB2 PRO A 50 6.490 9.533 1.995 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.833 8.630 3.345 1.00 0.00 H new ATOM 0 HG2 PRO A 50 5.716 7.997 0.461 1.00 0.00 H new ATOM 0 HG3 PRO A 50 5.454 6.934 1.830 1.00 0.00 H new ATOM 0 HD2 PRO A 50 3.441 8.082 0.138 1.00 0.00 H new ATOM 0 HD3 PRO A 50 3.175 7.114 1.575 1.00 0.00 H new ATOM 702 N GLU A 51 4.166 12.352 2.120 1.00 0.00 N ATOM 703 CA GLU A 51 4.291 13.626 1.432 1.00 0.00 C ATOM 704 C GLU A 51 5.548 13.637 0.560 1.00 0.00 C ATOM 705 O GLU A 51 6.565 13.050 0.924 1.00 0.00 O ATOM 706 CB GLU A 51 4.303 14.788 2.427 1.00 0.00 C ATOM 707 CG GLU A 51 2.962 14.901 3.156 1.00 0.00 C ATOM 708 CD GLU A 51 3.169 15.041 4.665 1.00 0.00 C ATOM 709 OE1 GLU A 51 4.143 15.727 5.044 1.00 0.00 O ATOM 710 OE2 GLU A 51 2.348 14.457 5.406 1.00 0.00 O ATOM 0 H GLU A 51 3.715 12.403 3.033 1.00 0.00 H new ATOM 0 HA GLU A 51 3.423 13.754 0.785 1.00 0.00 H new ATOM 0 HB2 GLU A 51 5.104 14.642 3.152 1.00 0.00 H new ATOM 0 HB3 GLU A 51 4.515 15.719 1.901 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.411 15.763 2.779 1.00 0.00 H new ATOM 0 HG3 GLU A 51 2.356 14.019 2.949 1.00 0.00 H new ATOM 715 N GLY A 52 5.436 14.312 -0.575 1.00 0.00 N ATOM 716 CA GLY A 52 6.552 14.407 -1.502 1.00 0.00 C ATOM 717 C GLY A 52 6.799 13.070 -2.201 1.00 0.00 C ATOM 718 O GLY A 52 7.933 12.595 -2.259 1.00 0.00 O ATOM 0 H GLY A 52 4.590 14.798 -0.874 1.00 0.00 H new ATOM 0 HA2 GLY A 52 6.347 15.178 -2.245 1.00 0.00 H new ATOM 0 HA3 GLY A 52 7.450 14.712 -0.965 1.00 0.00 H new ATOM 722 N LEU A 53 5.719 12.498 -2.715 1.00 0.00 N ATOM 723 CA LEU A 53 5.806 11.224 -3.409 1.00 0.00 C ATOM 724 C LEU A 53 4.586 11.060 -4.317 1.00 0.00 C ATOM 725 O LEU A 53 3.844 12.015 -4.546 1.00 0.00 O ATOM 726 CB LEU A 53 5.986 10.081 -2.409 1.00 0.00 C ATOM 727 CG LEU A 53 7.420 9.590 -2.201 1.00 0.00 C ATOM 728 CD1 LEU A 53 7.504 8.626 -1.016 1.00 0.00 C ATOM 729 CD2 LEU A 53 7.977 8.971 -3.484 1.00 0.00 C ATOM 0 H LEU A 53 4.780 12.893 -2.665 1.00 0.00 H new ATOM 0 HA LEU A 53 6.687 11.198 -4.050 1.00 0.00 H new ATOM 0 HB2 LEU A 53 5.590 10.402 -1.446 1.00 0.00 H new ATOM 0 HB3 LEU A 53 5.379 9.238 -2.738 1.00 0.00 H new ATOM 0 HG LEU A 53 8.044 10.450 -1.960 1.00 0.00 H new ATOM 0 HD11 LEU A 53 8.534 8.292 -0.891 1.00 0.00 H new ATOM 0 HD12 LEU A 53 7.174 9.134 -0.110 1.00 0.00 H new ATOM 0 HD13 LEU A 53 6.864 7.764 -1.202 1.00 0.00 H new ATOM 0 HD21 LEU A 53 8.997 8.630 -3.310 1.00 0.00 H new ATOM 0 HD22 LEU A 53 7.357 8.125 -3.779 1.00 0.00 H new ATOM 0 HD23 LEU A 53 7.974 9.717 -4.279 1.00 0.00 H new ATOM 740 N ALA A 54 4.415 9.842 -4.811 1.00 0.00 N ATOM 741 CA ALA A 54 3.298 9.541 -5.691 1.00 0.00 C ATOM 742 C ALA A 54 2.982 8.046 -5.612 1.00 0.00 C ATOM 743 O ALA A 54 3.890 7.217 -5.575 1.00 0.00 O ATOM 744 CB ALA A 54 3.631 9.993 -7.114 1.00 0.00 C ATOM 0 H ALA A 54 5.031 9.052 -4.619 1.00 0.00 H new ATOM 0 HA ALA A 54 2.406 10.084 -5.378 1.00 0.00 H new ATOM 0 HB1 ALA A 54 2.793 9.767 -7.773 1.00 0.00 H new ATOM 0 HB2 ALA A 54 3.818 11.067 -7.120 1.00 0.00 H new ATOM 0 HB3 ALA A 54 4.520 9.468 -7.464 1.00 0.00 H new ATOM 750 N PHE A 55 1.692 7.747 -5.590 1.00 0.00 N ATOM 751 CA PHE A 55 1.245 6.367 -5.516 1.00 0.00 C ATOM 752 C PHE A 55 1.759 5.560 -6.711 1.00 0.00 C ATOM 753 O PHE A 55 1.350 5.796 -7.846 1.00 0.00 O ATOM 754 CB PHE A 55 -0.285 6.388 -5.551 1.00 0.00 C ATOM 755 CG PHE A 55 -0.922 5.015 -5.770 1.00 0.00 C ATOM 756 CD1 PHE A 55 -0.531 3.955 -5.014 1.00 0.00 C ATOM 757 CD2 PHE A 55 -1.880 4.855 -6.722 1.00 0.00 C ATOM 758 CE1 PHE A 55 -1.122 2.680 -5.217 1.00 0.00 C ATOM 759 CE2 PHE A 55 -2.473 3.580 -6.925 1.00 0.00 C ATOM 760 CZ PHE A 55 -2.080 2.520 -6.169 1.00 0.00 C ATOM 0 H PHE A 55 0.942 8.437 -5.622 1.00 0.00 H new ATOM 0 HA PHE A 55 1.624 5.902 -4.606 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -0.654 6.803 -4.613 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -0.611 7.059 -6.346 1.00 0.00 H new ATOM 0 HD1 PHE A 55 0.230 4.083 -4.258 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -2.190 5.697 -7.323 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -0.811 1.838 -4.616 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -3.235 3.453 -7.679 1.00 0.00 H new ATOM 0 HZ PHE A 55 -2.529 1.550 -6.325 1.00 0.00 H new ATOM 769 N ARG A 56 2.647 4.623 -6.413 1.00 0.00 N ATOM 770 CA ARG A 56 3.221 3.781 -7.448 1.00 0.00 C ATOM 771 C ARG A 56 3.891 2.554 -6.824 1.00 0.00 C ATOM 772 O ARG A 56 4.041 2.478 -5.606 1.00 0.00 O ATOM 773 CB ARG A 56 4.253 4.550 -8.276 1.00 0.00 C ATOM 774 CG ARG A 56 4.936 5.630 -7.434 1.00 0.00 C ATOM 775 CD ARG A 56 6.422 5.738 -7.782 1.00 0.00 C ATOM 776 NE ARG A 56 6.583 6.260 -9.158 1.00 0.00 N ATOM 777 CZ ARG A 56 7.710 6.818 -9.622 1.00 0.00 C ATOM 778 NH1 ARG A 56 8.781 6.928 -8.825 1.00 0.00 N ATOM 779 NH2 ARG A 56 7.765 7.264 -10.884 1.00 0.00 N ATOM 0 H ARG A 56 2.983 4.429 -5.470 1.00 0.00 H new ATOM 0 HA ARG A 56 2.410 3.463 -8.103 1.00 0.00 H new ATOM 0 HB2 ARG A 56 5.001 3.859 -8.664 1.00 0.00 H new ATOM 0 HB3 ARG A 56 3.766 5.008 -9.136 1.00 0.00 H new ATOM 0 HG2 ARG A 56 4.449 6.590 -7.603 1.00 0.00 H new ATOM 0 HG3 ARG A 56 4.823 5.397 -6.375 1.00 0.00 H new ATOM 0 HD2 ARG A 56 6.923 6.397 -7.073 1.00 0.00 H new ATOM 0 HD3 ARG A 56 6.896 4.760 -7.697 1.00 0.00 H new ATOM 0 HE ARG A 56 5.787 6.191 -9.792 1.00 0.00 H new ATOM 0 HH11 ARG A 56 8.739 6.587 -7.865 1.00 0.00 H new ATOM 0 HH12 ARG A 56 9.638 7.353 -9.179 1.00 0.00 H new ATOM 0 HH21 ARG A 56 6.950 7.179 -11.491 1.00 0.00 H new ATOM 0 HH22 ARG A 56 8.622 7.689 -11.238 1.00 0.00 H new ATOM 790 N ARG A 57 4.274 1.626 -7.688 1.00 0.00 N ATOM 791 CA ARG A 57 4.924 0.407 -7.236 1.00 0.00 C ATOM 792 C ARG A 57 5.986 0.730 -6.183 1.00 0.00 C ATOM 793 O ARG A 57 6.582 1.805 -6.207 1.00 0.00 O ATOM 794 CB ARG A 57 5.581 -0.332 -8.404 1.00 0.00 C ATOM 795 CG ARG A 57 4.851 -1.643 -8.704 1.00 0.00 C ATOM 796 CD ARG A 57 5.026 -2.044 -10.169 1.00 0.00 C ATOM 797 NE ARG A 57 4.696 -3.476 -10.346 1.00 0.00 N ATOM 798 CZ ARG A 57 5.541 -4.480 -10.075 1.00 0.00 C ATOM 799 NH1 ARG A 57 6.772 -4.215 -9.615 1.00 0.00 N ATOM 800 NH2 ARG A 57 5.156 -5.749 -10.265 1.00 0.00 N ATOM 0 H ARG A 57 4.147 1.693 -8.698 1.00 0.00 H new ATOM 0 HA ARG A 57 4.159 -0.235 -6.799 1.00 0.00 H new ATOM 0 HB2 ARG A 57 5.575 0.303 -9.290 1.00 0.00 H new ATOM 0 HB3 ARG A 57 6.625 -0.539 -8.167 1.00 0.00 H new ATOM 0 HG2 ARG A 57 5.235 -2.433 -8.059 1.00 0.00 H new ATOM 0 HG3 ARG A 57 3.790 -1.533 -8.477 1.00 0.00 H new ATOM 0 HD2 ARG A 57 4.381 -1.433 -10.801 1.00 0.00 H new ATOM 0 HD3 ARG A 57 6.052 -1.857 -10.485 1.00 0.00 H new ATOM 0 HE ARG A 57 3.768 -3.713 -10.696 1.00 0.00 H new ATOM 0 HH11 ARG A 57 7.066 -3.249 -9.471 1.00 0.00 H new ATOM 0 HH12 ARG A 57 7.415 -4.980 -9.409 1.00 0.00 H new ATOM 0 HH21 ARG A 57 4.220 -5.951 -10.616 1.00 0.00 H new ATOM 0 HH22 ARG A 57 5.799 -6.513 -10.059 1.00 0.00 H new ATOM 811 N PRO A 58 6.195 -0.246 -5.260 1.00 0.00 N ATOM 812 CA PRO A 58 7.174 -0.077 -4.199 1.00 0.00 C ATOM 813 C PRO A 58 8.597 -0.233 -4.738 1.00 0.00 C ATOM 814 O PRO A 58 9.553 0.241 -4.126 1.00 0.00 O ATOM 815 CB PRO A 58 6.814 -1.124 -3.159 1.00 0.00 C ATOM 816 CG PRO A 58 5.944 -2.142 -3.877 1.00 0.00 C ATOM 817 CD PRO A 58 5.507 -1.533 -5.199 1.00 0.00 C ATOM 0 HA PRO A 58 7.152 0.921 -3.762 1.00 0.00 H new ATOM 0 HB2 PRO A 58 7.709 -1.594 -2.751 1.00 0.00 H new ATOM 0 HB3 PRO A 58 6.280 -0.675 -2.321 1.00 0.00 H new ATOM 0 HG2 PRO A 58 6.498 -3.065 -4.047 1.00 0.00 H new ATOM 0 HG3 PRO A 58 5.076 -2.398 -3.269 1.00 0.00 H new ATOM 0 HD2 PRO A 58 5.784 -2.170 -6.039 1.00 0.00 H new ATOM 0 HD3 PRO A 58 4.425 -1.406 -5.238 1.00 0.00 H new ATOM 822 N ALA A 59 8.694 -0.899 -5.879 1.00 0.00 N ATOM 823 CA ALA A 59 9.985 -1.124 -6.507 1.00 0.00 C ATOM 824 C ALA A 59 10.329 0.071 -7.398 1.00 0.00 C ATOM 825 O ALA A 59 11.488 0.265 -7.763 1.00 0.00 O ATOM 826 CB ALA A 59 9.951 -2.441 -7.286 1.00 0.00 C ATOM 0 H ALA A 59 7.900 -1.290 -6.385 1.00 0.00 H new ATOM 0 HA ALA A 59 10.768 -1.210 -5.754 1.00 0.00 H new ATOM 0 HB1 ALA A 59 10.919 -2.610 -7.757 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.731 -3.262 -6.603 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.178 -2.390 -8.053 1.00 0.00 H new ATOM 832 N GLU A 60 9.302 0.842 -7.723 1.00 0.00 N ATOM 833 CA GLU A 60 9.481 2.013 -8.563 1.00 0.00 C ATOM 834 C GLU A 60 9.810 3.237 -7.706 1.00 0.00 C ATOM 835 O GLU A 60 10.334 4.229 -8.210 1.00 0.00 O ATOM 836 CB GLU A 60 8.241 2.265 -9.424 1.00 0.00 C ATOM 837 CG GLU A 60 8.119 1.216 -10.530 1.00 0.00 C ATOM 838 CD GLU A 60 8.170 1.867 -11.913 1.00 0.00 C ATOM 839 OE1 GLU A 60 7.569 2.954 -12.051 1.00 0.00 O ATOM 840 OE2 GLU A 60 8.810 1.263 -12.801 1.00 0.00 O ATOM 0 H GLU A 60 8.342 0.678 -7.419 1.00 0.00 H new ATOM 0 HA GLU A 60 10.319 1.828 -9.235 1.00 0.00 H new ATOM 0 HB2 GLU A 60 7.349 2.244 -8.798 1.00 0.00 H new ATOM 0 HB3 GLU A 60 8.297 3.260 -9.866 1.00 0.00 H new ATOM 0 HG2 GLU A 60 8.926 0.489 -10.437 1.00 0.00 H new ATOM 0 HG3 GLU A 60 7.183 0.670 -10.416 1.00 0.00 H new ATOM 845 N TYR A 61 9.492 3.126 -6.425 1.00 0.00 N ATOM 846 CA TYR A 61 9.747 4.210 -5.493 1.00 0.00 C ATOM 847 C TYR A 61 11.249 4.395 -5.266 1.00 0.00 C ATOM 848 O TYR A 61 12.050 3.554 -5.671 1.00 0.00 O ATOM 849 CB TYR A 61 9.091 3.797 -4.174 1.00 0.00 C ATOM 850 CG TYR A 61 7.706 4.407 -3.950 1.00 0.00 C ATOM 851 CD1 TYR A 61 7.453 5.707 -4.339 1.00 0.00 C ATOM 852 CD2 TYR A 61 6.709 3.658 -3.359 1.00 0.00 C ATOM 853 CE1 TYR A 61 6.150 6.282 -4.129 1.00 0.00 C ATOM 854 CE2 TYR A 61 5.405 4.232 -3.148 1.00 0.00 C ATOM 855 CZ TYR A 61 5.190 5.516 -3.544 1.00 0.00 C ATOM 856 OH TYR A 61 3.959 6.058 -3.345 1.00 0.00 O ATOM 0 H TYR A 61 9.059 2.301 -6.010 1.00 0.00 H new ATOM 0 HA TYR A 61 9.351 5.149 -5.880 1.00 0.00 H new ATOM 0 HB2 TYR A 61 9.007 2.711 -4.146 1.00 0.00 H new ATOM 0 HB3 TYR A 61 9.742 4.087 -3.350 1.00 0.00 H new ATOM 0 HD1 TYR A 61 8.233 6.293 -4.801 1.00 0.00 H new ATOM 0 HD2 TYR A 61 6.907 2.641 -3.055 1.00 0.00 H new ATOM 0 HE1 TYR A 61 5.940 7.298 -4.429 1.00 0.00 H new ATOM 0 HE2 TYR A 61 4.616 3.657 -2.686 1.00 0.00 H new ATOM 0 HH TYR A 61 3.561 6.293 -4.209 1.00 0.00 H new ATOM 865 N ASP A 62 11.586 5.501 -4.618 1.00 0.00 N ATOM 866 CA ASP A 62 12.977 5.806 -4.331 1.00 0.00 C ATOM 867 C ASP A 62 13.397 5.091 -3.046 1.00 0.00 C ATOM 868 O ASP A 62 12.602 4.375 -2.440 1.00 0.00 O ATOM 869 CB ASP A 62 13.180 7.308 -4.125 1.00 0.00 C ATOM 870 CG ASP A 62 11.995 8.184 -4.537 1.00 0.00 C ATOM 871 OD1 ASP A 62 11.495 7.969 -5.663 1.00 0.00 O ATOM 872 OD2 ASP A 62 11.616 9.048 -3.718 1.00 0.00 O ATOM 0 H ASP A 62 10.919 6.197 -4.284 1.00 0.00 H new ATOM 0 HA ASP A 62 13.577 5.474 -5.178 1.00 0.00 H new ATOM 0 HB2 ASP A 62 13.397 7.489 -3.072 1.00 0.00 H new ATOM 0 HB3 ASP A 62 14.058 7.621 -4.690 1.00 0.00 H new ATOM 876 N PRO A 63 14.681 5.316 -2.657 1.00 0.00 N ATOM 877 CA PRO A 63 15.218 4.702 -1.454 1.00 0.00 C ATOM 878 C PRO A 63 14.679 5.393 -0.199 1.00 0.00 C ATOM 879 O PRO A 63 14.144 4.737 0.693 1.00 0.00 O ATOM 880 CB PRO A 63 16.727 4.815 -1.593 1.00 0.00 C ATOM 881 CG PRO A 63 16.969 5.895 -2.636 1.00 0.00 C ATOM 882 CD PRO A 63 15.652 6.158 -3.349 1.00 0.00 C ATOM 0 HA PRO A 63 14.920 3.659 -1.345 1.00 0.00 H new ATOM 0 HB2 PRO A 63 17.188 5.080 -0.642 1.00 0.00 H new ATOM 0 HB3 PRO A 63 17.163 3.866 -1.905 1.00 0.00 H new ATOM 0 HG2 PRO A 63 17.336 6.806 -2.164 1.00 0.00 H new ATOM 0 HG3 PRO A 63 17.731 5.575 -3.347 1.00 0.00 H new ATOM 0 HD2 PRO A 63 15.375 7.211 -3.293 1.00 0.00 H new ATOM 0 HD3 PRO A 63 15.716 5.901 -4.406 1.00 0.00 H new ATOM 887 N LYS A 64 14.841 6.707 -0.170 1.00 0.00 N ATOM 888 CA LYS A 64 14.378 7.494 0.960 1.00 0.00 C ATOM 889 C LYS A 64 12.850 7.447 1.018 1.00 0.00 C ATOM 890 O LYS A 64 12.260 7.641 2.079 1.00 0.00 O ATOM 891 CB LYS A 64 14.947 8.913 0.895 1.00 0.00 C ATOM 892 CG LYS A 64 16.370 8.960 1.455 1.00 0.00 C ATOM 893 CD LYS A 64 17.402 8.713 0.354 1.00 0.00 C ATOM 894 CE LYS A 64 18.686 9.504 0.617 1.00 0.00 C ATOM 895 NZ LYS A 64 19.783 9.012 -0.246 1.00 0.00 N ATOM 0 H LYS A 64 15.287 7.247 -0.912 1.00 0.00 H new ATOM 0 HA LYS A 64 14.746 7.070 1.894 1.00 0.00 H new ATOM 0 HB2 LYS A 64 14.947 9.261 -0.138 1.00 0.00 H new ATOM 0 HB3 LYS A 64 14.308 9.591 1.460 1.00 0.00 H new ATOM 0 HG2 LYS A 64 16.551 9.931 1.916 1.00 0.00 H new ATOM 0 HG3 LYS A 64 16.481 8.209 2.238 1.00 0.00 H new ATOM 0 HD2 LYS A 64 17.631 7.649 0.298 1.00 0.00 H new ATOM 0 HD3 LYS A 64 16.985 9.000 -0.611 1.00 0.00 H new ATOM 0 HE2 LYS A 64 18.513 10.563 0.427 1.00 0.00 H new ATOM 0 HE3 LYS A 64 18.970 9.410 1.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 20.647 9.559 -0.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 19.958 8.007 -0.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 19.516 9.124 -1.245 1.00 0.00 H new ATOM 905 N ALA A 65 12.254 7.185 -0.136 1.00 0.00 N ATOM 906 CA ALA A 65 10.805 7.109 -0.230 1.00 0.00 C ATOM 907 C ALA A 65 10.304 5.940 0.620 1.00 0.00 C ATOM 908 O ALA A 65 9.522 6.133 1.548 1.00 0.00 O ATOM 909 CB ALA A 65 10.395 6.980 -1.698 1.00 0.00 C ATOM 0 H ALA A 65 12.748 7.023 -1.014 1.00 0.00 H new ATOM 0 HA ALA A 65 10.347 8.019 0.158 1.00 0.00 H new ATOM 0 HB1 ALA A 65 9.309 6.923 -1.769 1.00 0.00 H new ATOM 0 HB2 ALA A 65 10.750 7.849 -2.253 1.00 0.00 H new ATOM 0 HB3 ALA A 65 10.834 6.076 -2.120 1.00 0.00 H new ATOM 915 N LEU A 66 10.776 4.752 0.270 1.00 0.00 N ATOM 916 CA LEU A 66 10.386 3.551 0.990 1.00 0.00 C ATOM 917 C LEU A 66 10.451 3.819 2.495 1.00 0.00 C ATOM 918 O LEU A 66 9.464 3.631 3.205 1.00 0.00 O ATOM 919 CB LEU A 66 11.232 2.358 0.540 1.00 0.00 C ATOM 920 CG LEU A 66 11.128 1.980 -0.939 1.00 0.00 C ATOM 921 CD1 LEU A 66 12.160 0.913 -1.306 1.00 0.00 C ATOM 922 CD2 LEU A 66 9.704 1.548 -1.295 1.00 0.00 C ATOM 0 H LEU A 66 11.424 4.596 -0.502 1.00 0.00 H new ATOM 0 HA LEU A 66 9.354 3.286 0.758 1.00 0.00 H new ATOM 0 HB2 LEU A 66 12.276 2.573 0.767 1.00 0.00 H new ATOM 0 HB3 LEU A 66 10.948 1.491 1.137 1.00 0.00 H new ATOM 0 HG LEU A 66 11.355 2.864 -1.535 1.00 0.00 H new ATOM 0 HD11 LEU A 66 12.064 0.663 -2.363 1.00 0.00 H new ATOM 0 HD12 LEU A 66 13.163 1.295 -1.113 1.00 0.00 H new ATOM 0 HD13 LEU A 66 11.990 0.020 -0.705 1.00 0.00 H new ATOM 0 HD21 LEU A 66 9.657 1.285 -2.352 1.00 0.00 H new ATOM 0 HD22 LEU A 66 9.425 0.683 -0.693 1.00 0.00 H new ATOM 0 HD23 LEU A 66 9.014 2.368 -1.094 1.00 0.00 H new ATOM 933 N MET A 67 11.622 4.254 2.936 1.00 0.00 N ATOM 934 CA MET A 67 11.829 4.550 4.344 1.00 0.00 C ATOM 935 C MET A 67 10.763 5.518 4.863 1.00 0.00 C ATOM 936 O MET A 67 10.342 5.423 6.014 1.00 0.00 O ATOM 937 CB MET A 67 13.216 5.164 4.538 1.00 0.00 C ATOM 938 CG MET A 67 14.287 4.078 4.644 1.00 0.00 C ATOM 939 SD MET A 67 15.912 4.809 4.535 1.00 0.00 S ATOM 940 CE MET A 67 16.215 4.630 2.786 1.00 0.00 C ATOM 0 H MET A 67 12.438 4.409 2.343 1.00 0.00 H new ATOM 0 HA MET A 67 11.753 3.620 4.907 1.00 0.00 H new ATOM 0 HB2 MET A 67 13.445 5.825 3.702 1.00 0.00 H new ATOM 0 HB3 MET A 67 13.224 5.776 5.440 1.00 0.00 H new ATOM 0 HG2 MET A 67 14.182 3.544 5.588 1.00 0.00 H new ATOM 0 HG3 MET A 67 14.154 3.346 3.847 1.00 0.00 H new ATOM 0 HE1 MET A 67 17.073 3.976 2.630 1.00 0.00 H new ATOM 0 HE2 MET A 67 15.337 4.197 2.307 1.00 0.00 H new ATOM 0 HE3 MET A 67 16.421 5.608 2.350 1.00 0.00 H new ATOM 948 N ALA A 68 10.359 6.426 3.987 1.00 0.00 N ATOM 949 CA ALA A 68 9.351 7.411 4.343 1.00 0.00 C ATOM 950 C ALA A 68 7.976 6.740 4.367 1.00 0.00 C ATOM 951 O ALA A 68 7.100 7.140 5.132 1.00 0.00 O ATOM 952 CB ALA A 68 9.412 8.581 3.359 1.00 0.00 C ATOM 0 H ALA A 68 10.711 6.501 3.032 1.00 0.00 H new ATOM 0 HA ALA A 68 9.540 7.812 5.339 1.00 0.00 H new ATOM 0 HB1 ALA A 68 8.656 9.320 3.625 1.00 0.00 H new ATOM 0 HB2 ALA A 68 10.400 9.040 3.401 1.00 0.00 H new ATOM 0 HB3 ALA A 68 9.224 8.217 2.349 1.00 0.00 H new ATOM 958 N ILE A 69 7.829 5.733 3.520 1.00 0.00 N ATOM 959 CA ILE A 69 6.575 5.003 3.434 1.00 0.00 C ATOM 960 C ILE A 69 6.386 4.174 4.706 1.00 0.00 C ATOM 961 O ILE A 69 5.273 4.065 5.220 1.00 0.00 O ATOM 962 CB ILE A 69 6.522 4.177 2.148 1.00 0.00 C ATOM 963 CG1 ILE A 69 6.643 5.074 0.915 1.00 0.00 C ATOM 964 CG2 ILE A 69 5.263 3.309 2.105 1.00 0.00 C ATOM 965 CD1 ILE A 69 7.405 4.366 -0.207 1.00 0.00 C ATOM 0 H ILE A 69 8.558 5.405 2.886 1.00 0.00 H new ATOM 0 HA ILE A 69 5.735 5.695 3.375 1.00 0.00 H new ATOM 0 HB ILE A 69 7.378 3.502 2.140 1.00 0.00 H new ATOM 0 HG12 ILE A 69 5.649 5.352 0.565 1.00 0.00 H new ATOM 0 HG13 ILE A 69 7.157 5.997 1.182 1.00 0.00 H new ATOM 0 HG21 ILE A 69 5.250 2.732 1.180 1.00 0.00 H new ATOM 0 HG22 ILE A 69 5.261 2.629 2.957 1.00 0.00 H new ATOM 0 HG23 ILE A 69 4.380 3.947 2.147 1.00 0.00 H new ATOM 0 HD11 ILE A 69 7.476 5.026 -1.071 1.00 0.00 H new ATOM 0 HD12 ILE A 69 8.407 4.111 0.138 1.00 0.00 H new ATOM 0 HD13 ILE A 69 6.875 3.456 -0.488 1.00 0.00 H new ATOM 976 N LEU A 70 7.488 3.610 5.177 1.00 0.00 N ATOM 977 CA LEU A 70 7.457 2.795 6.379 1.00 0.00 C ATOM 978 C LEU A 70 7.209 3.691 7.593 1.00 0.00 C ATOM 979 O LEU A 70 6.665 3.242 8.601 1.00 0.00 O ATOM 980 CB LEU A 70 8.729 1.951 6.487 1.00 0.00 C ATOM 981 CG LEU A 70 9.192 1.267 5.199 1.00 0.00 C ATOM 982 CD1 LEU A 70 10.718 1.208 5.127 1.00 0.00 C ATOM 983 CD2 LEU A 70 8.558 -0.119 5.056 1.00 0.00 C ATOM 0 H LEU A 70 8.409 3.701 4.748 1.00 0.00 H new ATOM 0 HA LEU A 70 6.632 2.084 6.335 1.00 0.00 H new ATOM 0 HB2 LEU A 70 9.536 2.590 6.846 1.00 0.00 H new ATOM 0 HB3 LEU A 70 8.569 1.184 7.245 1.00 0.00 H new ATOM 0 HG LEU A 70 8.853 1.866 4.354 1.00 0.00 H new ATOM 0 HD11 LEU A 70 11.020 0.717 4.202 1.00 0.00 H new ATOM 0 HD12 LEU A 70 11.123 2.220 5.150 1.00 0.00 H new ATOM 0 HD13 LEU A 70 11.101 0.645 5.978 1.00 0.00 H new ATOM 0 HD21 LEU A 70 8.903 -0.584 4.132 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.846 -0.740 5.904 1.00 0.00 H new ATOM 0 HD23 LEU A 70 7.473 -0.022 5.029 1.00 0.00 H new ATOM 994 N GLU A 71 7.621 4.943 7.458 1.00 0.00 N ATOM 995 CA GLU A 71 7.451 5.908 8.531 1.00 0.00 C ATOM 996 C GLU A 71 6.066 6.553 8.451 1.00 0.00 C ATOM 997 O GLU A 71 5.417 6.771 9.473 1.00 0.00 O ATOM 998 CB GLU A 71 8.552 6.968 8.496 1.00 0.00 C ATOM 999 CG GLU A 71 9.830 6.455 9.163 1.00 0.00 C ATOM 1000 CD GLU A 71 10.631 7.608 9.774 1.00 0.00 C ATOM 1001 OE1 GLU A 71 9.978 8.556 10.261 1.00 0.00 O ATOM 1002 OE2 GLU A 71 11.876 7.514 9.740 1.00 0.00 O ATOM 0 H GLU A 71 8.073 5.312 6.621 1.00 0.00 H new ATOM 0 HA GLU A 71 7.531 5.381 9.482 1.00 0.00 H new ATOM 0 HB2 GLU A 71 8.763 7.244 7.463 1.00 0.00 H new ATOM 0 HB3 GLU A 71 8.210 7.870 9.004 1.00 0.00 H new ATOM 0 HG2 GLU A 71 9.575 5.733 9.939 1.00 0.00 H new ATOM 0 HG3 GLU A 71 10.442 5.931 8.429 1.00 0.00 H new ATOM 1007 N HIS A 72 5.652 6.840 7.225 1.00 0.00 N ATOM 1008 CA HIS A 72 4.356 7.455 6.997 1.00 0.00 C ATOM 1009 C HIS A 72 3.278 6.371 6.931 1.00 0.00 C ATOM 1010 O HIS A 72 2.086 6.676 6.941 1.00 0.00 O ATOM 1011 CB HIS A 72 4.386 8.339 5.749 1.00 0.00 C ATOM 1012 CG HIS A 72 5.336 9.509 5.846 1.00 0.00 C ATOM 1013 ND1 HIS A 72 4.983 10.795 5.477 1.00 0.00 N ATOM 1014 CD2 HIS A 72 6.629 9.574 6.277 1.00 0.00 C ATOM 1015 CE1 HIS A 72 6.024 11.589 5.679 1.00 0.00 C ATOM 1016 NE2 HIS A 72 7.043 10.830 6.175 1.00 0.00 N ATOM 0 H HIS A 72 6.192 6.658 6.379 1.00 0.00 H new ATOM 0 HA HIS A 72 4.110 8.113 7.831 1.00 0.00 H new ATOM 0 HB2 HIS A 72 4.665 7.728 4.891 1.00 0.00 H new ATOM 0 HB3 HIS A 72 3.381 8.715 5.559 1.00 0.00 H new ATOM 0 HD2 HIS A 72 7.216 8.743 6.640 1.00 0.00 H new ATOM 0 HE1 HIS A 72 6.060 12.651 5.485 1.00 0.00 H new ATOM 0 HE2 HIS A 72 7.971 11.172 6.426 1.00 0.00 H new ATOM 1023 N SER A 73 3.736 5.130 6.863 1.00 0.00 N ATOM 1024 CA SER A 73 2.825 4.000 6.795 1.00 0.00 C ATOM 1025 C SER A 73 1.678 4.191 7.788 1.00 0.00 C ATOM 1026 O SER A 73 0.509 4.125 7.413 1.00 0.00 O ATOM 1027 CB SER A 73 3.557 2.686 7.074 1.00 0.00 C ATOM 1028 OG SER A 73 3.355 2.237 8.412 1.00 0.00 O ATOM 0 H SER A 73 4.725 4.882 6.854 1.00 0.00 H new ATOM 0 HA SER A 73 2.417 3.950 5.786 1.00 0.00 H new ATOM 0 HB2 SER A 73 3.209 1.922 6.379 1.00 0.00 H new ATOM 0 HB3 SER A 73 4.624 2.819 6.893 1.00 0.00 H new ATOM 0 HG SER A 73 3.837 1.395 8.551 1.00 0.00 H new ATOM 1033 N HIS A 74 2.053 4.424 9.038 1.00 0.00 N ATOM 1034 CA HIS A 74 1.070 4.625 10.089 1.00 0.00 C ATOM 1035 C HIS A 74 -0.057 5.522 9.572 1.00 0.00 C ATOM 1036 O HIS A 74 -1.197 5.416 10.025 1.00 0.00 O ATOM 1037 CB HIS A 74 1.732 5.175 11.354 1.00 0.00 C ATOM 1038 CG HIS A 74 2.117 6.632 11.262 1.00 0.00 C ATOM 1039 ND1 HIS A 74 1.786 7.558 12.235 1.00 0.00 N ATOM 1040 CD2 HIS A 74 2.811 7.312 10.304 1.00 0.00 C ATOM 1041 CE1 HIS A 74 2.262 8.738 11.869 1.00 0.00 C ATOM 1042 NE2 HIS A 74 2.896 8.584 10.671 1.00 0.00 N ATOM 0 H HIS A 74 3.024 4.478 9.346 1.00 0.00 H new ATOM 0 HA HIS A 74 0.628 3.668 10.367 1.00 0.00 H new ATOM 0 HB2 HIS A 74 1.051 5.042 12.195 1.00 0.00 H new ATOM 0 HB3 HIS A 74 2.624 4.587 11.570 1.00 0.00 H new ATOM 0 HD2 HIS A 74 3.222 6.887 9.400 1.00 0.00 H new ATOM 0 HE1 HIS A 74 2.165 9.661 12.422 1.00 0.00 H new ATOM 0 HE2 HIS A 74 3.359 9.325 10.144 1.00 0.00 H new ATOM 1049 N ARG A 75 0.299 6.384 8.632 1.00 0.00 N ATOM 1050 CA ARG A 75 -0.668 7.298 8.049 1.00 0.00 C ATOM 1051 C ARG A 75 -1.260 6.701 6.772 1.00 0.00 C ATOM 1052 O ARG A 75 -2.443 6.883 6.487 1.00 0.00 O ATOM 1053 CB ARG A 75 -0.023 8.647 7.723 1.00 0.00 C ATOM 1054 CG ARG A 75 0.982 9.051 8.803 1.00 0.00 C ATOM 1055 CD ARG A 75 0.934 10.558 9.063 1.00 0.00 C ATOM 1056 NE ARG A 75 -0.413 10.946 9.540 1.00 0.00 N ATOM 1057 CZ ARG A 75 -0.697 12.126 10.108 1.00 0.00 C ATOM 1058 NH1 ARG A 75 0.269 13.040 10.272 1.00 0.00 N ATOM 1059 NH2 ARG A 75 -1.947 12.391 10.513 1.00 0.00 N ATOM 0 H ARG A 75 1.245 6.469 8.259 1.00 0.00 H new ATOM 0 HA ARG A 75 -1.460 7.454 8.781 1.00 0.00 H new ATOM 0 HB2 ARG A 75 0.479 8.590 6.757 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -0.795 9.411 7.636 1.00 0.00 H new ATOM 0 HG2 ARG A 75 0.765 8.512 9.726 1.00 0.00 H new ATOM 0 HG3 ARG A 75 1.987 8.764 8.495 1.00 0.00 H new ATOM 0 HD2 ARG A 75 1.684 10.832 9.805 1.00 0.00 H new ATOM 0 HD3 ARG A 75 1.176 11.101 8.149 1.00 0.00 H new ATOM 0 HE ARG A 75 -1.172 10.273 9.429 1.00 0.00 H new ATOM 0 HH11 ARG A 75 1.220 12.837 9.964 1.00 0.00 H new ATOM 0 HH12 ARG A 75 0.053 13.938 10.704 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -2.682 11.695 10.389 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -2.163 13.289 10.945 1.00 0.00 H new ATOM 1070 N ILE A 76 -0.411 6.000 6.035 1.00 0.00 N ATOM 1071 CA ILE A 76 -0.835 5.374 4.795 1.00 0.00 C ATOM 1072 C ILE A 76 -2.157 4.638 5.025 1.00 0.00 C ATOM 1073 O ILE A 76 -2.252 3.792 5.913 1.00 0.00 O ATOM 1074 CB ILE A 76 0.276 4.484 4.236 1.00 0.00 C ATOM 1075 CG1 ILE A 76 1.549 5.291 3.979 1.00 0.00 C ATOM 1076 CG2 ILE A 76 -0.195 3.740 2.984 1.00 0.00 C ATOM 1077 CD1 ILE A 76 2.637 4.417 3.351 1.00 0.00 C ATOM 0 H ILE A 76 0.570 5.852 6.274 1.00 0.00 H new ATOM 0 HA ILE A 76 -1.020 6.130 4.031 1.00 0.00 H new ATOM 0 HB ILE A 76 0.519 3.731 4.985 1.00 0.00 H new ATOM 0 HG12 ILE A 76 1.325 6.129 3.319 1.00 0.00 H new ATOM 0 HG13 ILE A 76 1.912 5.712 4.917 1.00 0.00 H new ATOM 0 HG21 ILE A 76 0.614 3.114 2.607 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -1.052 3.114 3.233 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -0.483 4.461 2.219 1.00 0.00 H new ATOM 0 HD11 ILE A 76 3.531 5.016 3.179 1.00 0.00 H new ATOM 0 HD12 ILE A 76 2.876 3.594 4.024 1.00 0.00 H new ATOM 0 HD13 ILE A 76 2.280 4.017 2.402 1.00 0.00 H new ATOM 1088 N ARG A 77 -3.141 4.987 4.211 1.00 0.00 N ATOM 1089 CA ARG A 77 -4.453 4.369 4.316 1.00 0.00 C ATOM 1090 C ARG A 77 -5.079 4.214 2.929 1.00 0.00 C ATOM 1091 O ARG A 77 -5.101 5.161 2.144 1.00 0.00 O ATOM 1092 CB ARG A 77 -5.385 5.202 5.199 1.00 0.00 C ATOM 1093 CG ARG A 77 -5.152 4.900 6.680 1.00 0.00 C ATOM 1094 CD ARG A 77 -5.918 3.646 7.111 1.00 0.00 C ATOM 1095 NE ARG A 77 -6.458 3.828 8.477 1.00 0.00 N ATOM 1096 CZ ARG A 77 -7.279 2.959 9.082 1.00 0.00 C ATOM 1097 NH1 ARG A 77 -7.661 1.843 8.445 1.00 0.00 N ATOM 1098 NH2 ARG A 77 -7.720 3.206 10.323 1.00 0.00 N ATOM 0 H ARG A 77 -3.057 5.689 3.476 1.00 0.00 H new ATOM 0 HA ARG A 77 -4.322 3.387 4.771 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -5.219 6.263 5.010 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -6.422 4.991 4.940 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -4.087 4.761 6.863 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -5.471 5.750 7.283 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -6.731 3.449 6.413 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -5.258 2.779 7.084 1.00 0.00 H new ATOM 0 HE ARG A 77 -6.188 4.667 8.990 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -7.327 1.655 7.500 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -8.286 1.181 8.906 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -7.431 4.056 10.807 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -8.345 2.544 10.783 1.00 0.00 H new ATOM 1109 N PHE A 78 -5.573 3.013 2.669 1.00 0.00 N ATOM 1110 CA PHE A 78 -6.198 2.722 1.390 1.00 0.00 C ATOM 1111 C PHE A 78 -7.674 3.127 1.395 1.00 0.00 C ATOM 1112 O PHE A 78 -8.313 3.141 2.445 1.00 0.00 O ATOM 1113 CB PHE A 78 -6.098 1.210 1.176 1.00 0.00 C ATOM 1114 CG PHE A 78 -4.725 0.740 0.688 1.00 0.00 C ATOM 1115 CD1 PHE A 78 -3.603 1.099 1.367 1.00 0.00 C ATOM 1116 CD2 PHE A 78 -4.629 -0.037 -0.423 1.00 0.00 C ATOM 1117 CE1 PHE A 78 -2.330 0.664 0.914 1.00 0.00 C ATOM 1118 CE2 PHE A 78 -3.356 -0.473 -0.875 1.00 0.00 C ATOM 1119 CZ PHE A 78 -2.233 -0.114 -0.197 1.00 0.00 C ATOM 0 H PHE A 78 -5.553 2.230 3.322 1.00 0.00 H new ATOM 0 HA PHE A 78 -5.698 3.279 0.598 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -6.332 0.704 2.113 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -6.854 0.905 0.452 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -3.680 1.715 2.251 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -5.521 -0.322 -0.962 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -1.438 0.951 1.452 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -3.279 -1.090 -1.758 1.00 0.00 H new ATOM 0 HZ PHE A 78 -1.265 -0.447 -0.541 1.00 0.00 H new ATOM 1128 N LYS A 79 -8.170 3.447 0.209 1.00 0.00 N ATOM 1129 CA LYS A 79 -9.559 3.852 0.064 1.00 0.00 C ATOM 1130 C LYS A 79 -10.162 3.161 -1.160 1.00 0.00 C ATOM 1131 O LYS A 79 -9.728 3.397 -2.287 1.00 0.00 O ATOM 1132 CB LYS A 79 -9.671 5.377 0.027 1.00 0.00 C ATOM 1133 CG LYS A 79 -9.931 5.942 1.426 1.00 0.00 C ATOM 1134 CD LYS A 79 -11.432 6.038 1.707 1.00 0.00 C ATOM 1135 CE LYS A 79 -11.999 7.371 1.214 1.00 0.00 C ATOM 1136 NZ LYS A 79 -13.478 7.352 1.253 1.00 0.00 N ATOM 0 H LYS A 79 -7.636 3.434 -0.660 1.00 0.00 H new ATOM 0 HA LYS A 79 -10.141 3.534 0.929 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -8.752 5.803 -0.376 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -10.479 5.670 -0.643 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -9.457 5.305 2.173 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -9.477 6.929 1.514 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -11.951 5.215 1.216 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -11.612 5.936 2.777 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -11.624 8.184 1.835 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -11.659 7.563 0.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -13.846 8.264 0.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -13.832 6.588 0.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -13.797 7.190 2.229 1.00 0.00 H new ATOM 1146 N LEU A 80 -11.151 2.320 -0.899 1.00 0.00 N ATOM 1147 CA LEU A 80 -11.818 1.594 -1.965 1.00 0.00 C ATOM 1148 C LEU A 80 -12.985 2.429 -2.494 1.00 0.00 C ATOM 1149 O LEU A 80 -13.488 3.310 -1.799 1.00 0.00 O ATOM 1150 CB LEU A 80 -12.227 0.199 -1.489 1.00 0.00 C ATOM 1151 CG LEU A 80 -11.123 -0.861 -1.489 1.00 0.00 C ATOM 1152 CD1 LEU A 80 -11.658 -2.212 -1.011 1.00 0.00 C ATOM 1153 CD2 LEU A 80 -10.460 -0.961 -2.865 1.00 0.00 C ATOM 0 H LEU A 80 -11.507 2.125 0.037 1.00 0.00 H new ATOM 0 HA LEU A 80 -11.136 1.434 -2.800 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -12.622 0.284 -0.477 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -13.042 -0.154 -2.121 1.00 0.00 H new ATOM 0 HG LEU A 80 -10.353 -0.552 -0.782 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -10.853 -2.946 -1.021 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -12.045 -2.112 0.003 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -12.458 -2.542 -1.674 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.679 -1.721 -2.838 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -11.207 -1.234 -3.610 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -10.021 0.001 -3.128 1.00 0.00 H new ATOM 1164 N LYS A 81 -13.383 2.123 -3.720 1.00 0.00 N ATOM 1165 CA LYS A 81 -14.482 2.835 -4.350 1.00 0.00 C ATOM 1166 C LYS A 81 -15.723 2.740 -3.460 1.00 0.00 C ATOM 1167 O LYS A 81 -16.585 3.616 -3.496 1.00 0.00 O ATOM 1168 CB LYS A 81 -14.705 2.323 -5.775 1.00 0.00 C ATOM 1169 CG LYS A 81 -15.456 0.989 -5.766 1.00 0.00 C ATOM 1170 CD LYS A 81 -14.695 -0.073 -6.563 1.00 0.00 C ATOM 1171 CE LYS A 81 -15.055 -1.481 -6.083 1.00 0.00 C ATOM 1172 NZ LYS A 81 -13.833 -2.296 -5.907 1.00 0.00 N ATOM 0 H LYS A 81 -12.964 1.391 -4.294 1.00 0.00 H new ATOM 0 HA LYS A 81 -14.243 3.894 -4.450 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -15.271 3.059 -6.346 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -13.745 2.201 -6.276 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -15.591 0.651 -4.739 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -16.451 1.124 -6.191 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.930 0.025 -7.623 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -13.622 0.088 -6.458 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -15.599 -1.422 -5.140 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -15.718 -1.959 -6.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -14.095 -3.248 -5.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -13.329 -2.367 -6.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -13.215 -1.847 -5.202 1.00 0.00 H new ATOM 1182 N ARG A 82 -15.773 1.668 -2.683 1.00 0.00 N ATOM 1183 CA ARG A 82 -16.894 1.447 -1.785 1.00 0.00 C ATOM 1184 C ARG A 82 -16.526 1.870 -0.363 1.00 0.00 C ATOM 1185 O ARG A 82 -15.471 1.497 0.148 1.00 0.00 O ATOM 1186 CB ARG A 82 -17.312 -0.025 -1.780 1.00 0.00 C ATOM 1187 CG ARG A 82 -18.476 -0.261 -0.814 1.00 0.00 C ATOM 1188 CD ARG A 82 -18.484 -1.704 -0.306 1.00 0.00 C ATOM 1189 NE ARG A 82 -19.874 -2.207 -0.235 1.00 0.00 N ATOM 1190 CZ ARG A 82 -20.241 -3.307 0.437 1.00 0.00 C ATOM 1191 NH1 ARG A 82 -19.323 -4.026 1.097 1.00 0.00 N ATOM 1192 NH2 ARG A 82 -21.526 -3.688 0.448 1.00 0.00 N ATOM 0 H ARG A 82 -15.056 0.943 -2.657 1.00 0.00 H new ATOM 0 HA ARG A 82 -17.729 2.050 -2.142 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -17.602 -0.328 -2.786 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -16.464 -0.647 -1.492 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -18.398 0.425 0.030 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -19.419 -0.043 -1.315 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -17.893 -2.335 -0.970 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -18.019 -1.754 0.679 1.00 0.00 H new ATOM 0 HE ARG A 82 -20.598 -1.684 -0.728 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -18.345 -3.736 1.088 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -19.602 -4.863 1.609 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -22.225 -3.141 -0.055 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -21.805 -4.525 0.959 1.00 0.00 H new ATOM 1203 N PRO A 83 -17.440 2.666 0.255 1.00 0.00 N ATOM 1204 CA PRO A 83 -17.223 3.146 1.609 1.00 0.00 C ATOM 1205 C PRO A 83 -17.454 2.030 2.629 1.00 0.00 C ATOM 1206 O PRO A 83 -18.578 1.555 2.792 1.00 0.00 O ATOM 1207 CB PRO A 83 -18.186 4.310 1.774 1.00 0.00 C ATOM 1208 CG PRO A 83 -19.228 4.147 0.679 1.00 0.00 C ATOM 1209 CD PRO A 83 -18.701 3.129 -0.319 1.00 0.00 C ATOM 0 HA PRO A 83 -16.196 3.469 1.781 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -18.650 4.296 2.760 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -17.666 5.263 1.680 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -20.176 3.813 1.101 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -19.417 5.101 0.187 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -19.402 2.305 -0.452 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -18.548 3.579 -1.300 1.00 0.00 H new ATOM 1214 N SER A 84 -16.373 1.642 3.291 1.00 0.00 N ATOM 1215 CA SER A 84 -16.444 0.591 4.291 1.00 0.00 C ATOM 1216 C SER A 84 -16.267 1.185 5.689 1.00 0.00 C ATOM 1217 O SER A 84 -16.086 2.393 5.835 1.00 0.00 O ATOM 1218 CB SER A 84 -15.389 -0.487 4.033 1.00 0.00 C ATOM 1219 OG SER A 84 -15.913 -1.581 3.288 1.00 0.00 O ATOM 0 H SER A 84 -15.443 2.037 3.154 1.00 0.00 H new ATOM 0 HA SER A 84 -17.426 0.122 4.225 1.00 0.00 H new ATOM 0 HB2 SER A 84 -14.549 -0.050 3.493 1.00 0.00 H new ATOM 0 HB3 SER A 84 -15.001 -0.850 4.985 1.00 0.00 H new ATOM 0 HG SER A 84 -15.208 -2.246 3.143 1.00 0.00 H new ATOM 1224 N SER A 85 -16.323 0.309 6.681 1.00 0.00 N ATOM 1225 CA SER A 85 -16.171 0.733 8.063 1.00 0.00 C ATOM 1226 C SER A 85 -15.255 -0.239 8.810 1.00 0.00 C ATOM 1227 O SER A 85 -15.106 -1.391 8.406 1.00 0.00 O ATOM 1228 CB SER A 85 -17.529 0.828 8.763 1.00 0.00 C ATOM 1229 OG SER A 85 -18.074 2.142 8.694 1.00 0.00 O ATOM 0 H SER A 85 -16.471 -0.692 6.556 1.00 0.00 H new ATOM 0 HA SER A 85 -15.720 1.725 8.069 1.00 0.00 H new ATOM 0 HB2 SER A 85 -18.223 0.123 8.305 1.00 0.00 H new ATOM 0 HB3 SER A 85 -17.420 0.535 9.807 1.00 0.00 H new ATOM 0 HG SER A 85 -18.941 2.161 9.150 1.00 0.00 H new ATOM 1234 N GLY A 86 -14.666 0.262 9.886 1.00 0.00 N ATOM 1235 CA GLY A 86 -13.770 -0.548 10.693 1.00 0.00 C ATOM 1236 C GLY A 86 -12.947 0.326 11.643 1.00 0.00 C ATOM 1237 O GLY A 86 -12.400 1.350 11.234 1.00 0.00 O ATOM 0 H GLY A 86 -14.792 1.218 10.217 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -14.347 -1.273 11.268 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -13.102 -1.115 10.044 1.00 0.00 H new ATOM 1241 N PRO A 87 -12.884 -0.121 12.925 1.00 0.00 N ATOM 1242 CA PRO A 87 -12.138 0.608 13.936 1.00 0.00 C ATOM 1243 C PRO A 87 -10.632 0.409 13.756 1.00 0.00 C ATOM 1244 O PRO A 87 -10.203 -0.463 13.004 1.00 0.00 O ATOM 1245 CB PRO A 87 -12.653 0.078 15.264 1.00 0.00 C ATOM 1246 CG PRO A 87 -13.326 -1.248 14.951 1.00 0.00 C ATOM 1247 CD PRO A 87 -13.519 -1.328 13.446 1.00 0.00 C ATOM 0 HA PRO A 87 -12.283 1.686 13.870 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -11.837 -0.056 15.974 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -13.357 0.776 15.716 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -12.714 -2.079 15.302 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -14.285 -1.320 15.463 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -13.058 -2.226 13.035 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -14.576 -1.364 13.184 1.00 0.00 H new ATOM 1252 N SER A 88 -9.870 1.234 14.460 1.00 0.00 N ATOM 1253 CA SER A 88 -8.421 1.159 14.387 1.00 0.00 C ATOM 1254 C SER A 88 -7.795 2.200 15.319 1.00 0.00 C ATOM 1255 O SER A 88 -8.453 3.166 15.706 1.00 0.00 O ATOM 1256 CB SER A 88 -7.929 1.367 12.953 1.00 0.00 C ATOM 1257 OG SER A 88 -6.841 0.506 12.632 1.00 0.00 O ATOM 0 H SER A 88 -10.229 1.957 15.083 1.00 0.00 H new ATOM 0 HA SER A 88 -8.114 0.163 14.706 1.00 0.00 H new ATOM 0 HB2 SER A 88 -8.750 1.188 12.259 1.00 0.00 H new ATOM 0 HB3 SER A 88 -7.621 2.404 12.822 1.00 0.00 H new ATOM 0 HG SER A 88 -6.557 0.668 11.708 1.00 0.00 H new ATOM 1262 N SER A 89 -6.534 1.969 15.652 1.00 0.00 N ATOM 1263 CA SER A 89 -5.813 2.875 16.530 1.00 0.00 C ATOM 1264 C SER A 89 -4.588 3.437 15.810 1.00 0.00 C ATOM 1265 O SER A 89 -3.705 2.685 15.397 1.00 0.00 O ATOM 1266 CB SER A 89 -5.393 2.171 17.822 1.00 0.00 C ATOM 1267 OG SER A 89 -6.500 1.937 18.688 1.00 0.00 O ATOM 0 H SER A 89 -5.993 1.167 15.329 1.00 0.00 H new ATOM 0 HA SER A 89 -6.479 3.696 16.795 1.00 0.00 H new ATOM 0 HB2 SER A 89 -4.916 1.221 17.579 1.00 0.00 H new ATOM 0 HB3 SER A 89 -4.650 2.777 18.340 1.00 0.00 H new ATOM 0 HG SER A 89 -6.190 1.485 19.500 1.00 0.00 H new ATOM 1272 N GLY A 90 -4.571 4.755 15.678 1.00 0.00 N ATOM 1273 CA GLY A 90 -3.468 5.428 15.014 1.00 0.00 C ATOM 1274 C GLY A 90 -2.384 5.826 16.017 1.00 0.00 C ATOM 1275 O GLY A 90 -2.518 6.830 16.716 1.00 0.00 O ATOM 0 H GLY A 90 -5.305 5.376 16.020 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -3.042 4.773 14.254 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -3.836 6.316 14.500 1.00 0.00 H new TER 1279 GLY A 90