USER MOD reduce.3.24.130724 H: found=0, std=0, add=690, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 690 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -125:sc= 0.084 (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 -51:sc= 0.558 USER MOD Single : A 6 SER OG : rot 41:sc= 0.82 USER MOD Single : A 12 CYS SG : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 GLN : amide:sc= -1.54 X(o=-1.5,f=-1) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 180:sc= -0.237 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -0.0534 K(o=-0.053,f=-1.1) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.0959 K(o=-0.096,f=-0.8) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 CYS SG : rot -126:sc= -1.64 USER MOD Single : A 76 CYS SG : rot 57:sc= -2.04 USER MOD Single : A 84 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000196) USER MOD Single : A 90 SER OG : rot -84:sc= 0.266 USER MOD Single : A 93 SER OG : rot 180:sc= 0.0575 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 20.432 -7.040 -6.577 1.00 0.00 N ATOM 2 CA GLY A 1 20.857 -8.099 -5.621 1.00 0.00 C ATOM 3 C GLY A 1 19.712 -8.599 -4.761 1.00 0.00 C ATOM 4 O GLY A 1 18.565 -8.193 -4.947 1.00 0.00 O ATOM 0 H1 GLY A 1 20.692 -7.321 -7.544 1.00 0.00 H new ATOM 0 H2 GLY A 1 19.401 -6.913 -6.519 1.00 0.00 H new ATOM 0 H3 GLY A 1 20.905 -6.145 -6.337 1.00 0.00 H new ATOM 0 HA2 GLY A 1 21.282 -8.935 -6.176 1.00 0.00 H new ATOM 0 HA3 GLY A 1 21.646 -7.708 -4.978 1.00 0.00 H new ATOM 10 N SER A 2 20.025 -9.482 -3.818 1.00 0.00 N ATOM 11 CA SER A 2 19.013 -10.037 -2.926 1.00 0.00 C ATOM 12 C SER A 2 18.733 -9.091 -1.764 1.00 0.00 C ATOM 13 O SER A 2 17.581 -8.871 -1.392 1.00 0.00 O ATOM 14 CB SER A 2 19.463 -11.398 -2.395 1.00 0.00 C ATOM 15 OG SER A 2 18.995 -12.450 -3.222 1.00 0.00 O ATOM 0 H SER A 2 20.970 -9.828 -3.652 1.00 0.00 H new ATOM 0 HA SER A 2 18.093 -10.164 -3.496 1.00 0.00 H new ATOM 0 HB2 SER A 2 20.551 -11.429 -2.343 1.00 0.00 H new ATOM 0 HB3 SER A 2 19.091 -11.537 -1.380 1.00 0.00 H new ATOM 0 HG SER A 2 19.298 -13.309 -2.861 1.00 0.00 H new ATOM 21 N SER A 3 19.797 -8.534 -1.192 1.00 0.00 N ATOM 22 CA SER A 3 19.667 -7.612 -0.071 1.00 0.00 C ATOM 23 C SER A 3 19.044 -6.293 -0.521 1.00 0.00 C ATOM 24 O SER A 3 19.694 -5.482 -1.182 1.00 0.00 O ATOM 25 CB SER A 3 21.033 -7.353 0.566 1.00 0.00 C ATOM 26 OG SER A 3 21.508 -8.505 1.241 1.00 0.00 O ATOM 0 H SER A 3 20.758 -8.706 -1.487 1.00 0.00 H new ATOM 0 HA SER A 3 19.011 -8.070 0.669 1.00 0.00 H new ATOM 0 HB2 SER A 3 21.747 -7.059 -0.204 1.00 0.00 H new ATOM 0 HB3 SER A 3 20.959 -6.522 1.267 1.00 0.00 H new ATOM 0 HG SER A 3 22.383 -8.314 1.638 1.00 0.00 H new ATOM 32 N GLY A 4 17.783 -6.085 -0.157 1.00 0.00 N ATOM 33 CA GLY A 4 17.094 -4.864 -0.532 1.00 0.00 C ATOM 34 C GLY A 4 15.715 -5.127 -1.101 1.00 0.00 C ATOM 35 O GLY A 4 15.551 -5.260 -2.314 1.00 0.00 O ATOM 0 H GLY A 4 17.226 -6.740 0.391 1.00 0.00 H new ATOM 0 HA2 GLY A 4 17.006 -4.218 0.341 1.00 0.00 H new ATOM 0 HA3 GLY A 4 17.691 -4.326 -1.268 1.00 0.00 H new ATOM 39 N SER A 5 14.719 -5.204 -0.224 1.00 0.00 N ATOM 40 CA SER A 5 13.346 -5.453 -0.646 1.00 0.00 C ATOM 41 C SER A 5 12.356 -4.996 0.421 1.00 0.00 C ATOM 42 O SER A 5 11.285 -5.581 0.580 1.00 0.00 O ATOM 43 CB SER A 5 13.144 -6.941 -0.942 1.00 0.00 C ATOM 44 OG SER A 5 11.882 -7.175 -1.544 1.00 0.00 O ATOM 0 H SER A 5 14.838 -5.097 0.783 1.00 0.00 H new ATOM 0 HA SER A 5 13.162 -4.880 -1.555 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.936 -7.294 -1.602 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.221 -7.513 -0.017 1.00 0.00 H new ATOM 0 HG SER A 5 11.180 -6.750 -1.008 1.00 0.00 H new ATOM 50 N SER A 6 12.723 -3.947 1.150 1.00 0.00 N ATOM 51 CA SER A 6 11.867 -3.411 2.201 1.00 0.00 C ATOM 52 C SER A 6 12.347 -2.032 2.644 1.00 0.00 C ATOM 53 O SER A 6 13.364 -1.534 2.160 1.00 0.00 O ATOM 54 CB SER A 6 11.839 -4.363 3.399 1.00 0.00 C ATOM 55 OG SER A 6 10.758 -5.273 3.303 1.00 0.00 O ATOM 0 H SER A 6 13.607 -3.452 1.032 1.00 0.00 H new ATOM 0 HA SER A 6 10.859 -3.313 1.799 1.00 0.00 H new ATOM 0 HB2 SER A 6 12.778 -4.914 3.452 1.00 0.00 H new ATOM 0 HB3 SER A 6 11.754 -3.789 4.322 1.00 0.00 H new ATOM 0 HG SER A 6 10.667 -5.576 2.375 1.00 0.00 H new ATOM 61 N GLY A 7 11.610 -1.422 3.565 1.00 0.00 N ATOM 62 CA GLY A 7 11.976 -0.106 4.056 1.00 0.00 C ATOM 63 C GLY A 7 10.827 0.593 4.755 1.00 0.00 C ATOM 64 O GLY A 7 10.894 0.869 5.952 1.00 0.00 O ATOM 0 H GLY A 7 10.765 -1.815 3.981 1.00 0.00 H new ATOM 0 HA2 GLY A 7 12.814 -0.200 4.747 1.00 0.00 H new ATOM 0 HA3 GLY A 7 12.317 0.508 3.222 1.00 0.00 H new ATOM 68 N ILE A 8 9.769 0.882 4.003 1.00 0.00 N ATOM 69 CA ILE A 8 8.600 1.555 4.557 1.00 0.00 C ATOM 70 C ILE A 8 7.686 0.568 5.275 1.00 0.00 C ATOM 71 O ILE A 8 7.572 -0.591 4.875 1.00 0.00 O ATOM 72 CB ILE A 8 7.795 2.277 3.460 1.00 0.00 C ATOM 73 CG1 ILE A 8 8.723 3.134 2.596 1.00 0.00 C ATOM 74 CG2 ILE A 8 6.701 3.132 4.081 1.00 0.00 C ATOM 75 CD1 ILE A 8 8.067 3.651 1.335 1.00 0.00 C ATOM 0 H ILE A 8 9.698 0.661 3.010 1.00 0.00 H new ATOM 0 HA ILE A 8 8.968 2.291 5.271 1.00 0.00 H new ATOM 0 HB ILE A 8 7.325 1.528 2.823 1.00 0.00 H new ATOM 0 HG12 ILE A 8 9.076 3.980 3.185 1.00 0.00 H new ATOM 0 HG13 ILE A 8 9.600 2.546 2.325 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.141 3.636 3.293 1.00 0.00 H new ATOM 0 HG22 ILE A 8 6.027 2.498 4.657 1.00 0.00 H new ATOM 0 HG23 ILE A 8 7.150 3.876 4.739 1.00 0.00 H new ATOM 0 HD11 ILE A 8 8.783 4.250 0.772 1.00 0.00 H new ATOM 0 HD12 ILE A 8 7.738 2.810 0.725 1.00 0.00 H new ATOM 0 HD13 ILE A 8 7.207 4.266 1.598 1.00 0.00 H new ATOM 87 N ASP A 9 7.037 1.033 6.337 1.00 0.00 N ATOM 88 CA ASP A 9 6.132 0.192 7.110 1.00 0.00 C ATOM 89 C ASP A 9 4.947 1.000 7.629 1.00 0.00 C ATOM 90 O ASP A 9 4.823 2.192 7.345 1.00 0.00 O ATOM 91 CB ASP A 9 6.877 -0.451 8.282 1.00 0.00 C ATOM 92 CG ASP A 9 7.479 0.578 9.220 1.00 0.00 C ATOM 93 OD1 ASP A 9 6.713 1.397 9.770 1.00 0.00 O ATOM 94 OD2 ASP A 9 8.713 0.564 9.404 1.00 0.00 O ATOM 0 H ASP A 9 7.121 1.989 6.682 1.00 0.00 H new ATOM 0 HA ASP A 9 5.754 -0.592 6.453 1.00 0.00 H new ATOM 0 HB2 ASP A 9 6.191 -1.089 8.839 1.00 0.00 H new ATOM 0 HB3 ASP A 9 7.668 -1.094 7.897 1.00 0.00 H new ATOM 99 N VAL A 10 4.079 0.344 8.392 1.00 0.00 N ATOM 100 CA VAL A 10 2.905 1.001 8.951 1.00 0.00 C ATOM 101 C VAL A 10 3.302 2.051 9.984 1.00 0.00 C ATOM 102 O VAL A 10 4.081 1.775 10.896 1.00 0.00 O ATOM 103 CB VAL A 10 1.950 -0.015 9.608 1.00 0.00 C ATOM 104 CG1 VAL A 10 0.670 0.668 10.066 1.00 0.00 C ATOM 105 CG2 VAL A 10 1.638 -1.154 8.648 1.00 0.00 C ATOM 0 H VAL A 10 4.167 -0.642 8.637 1.00 0.00 H new ATOM 0 HA VAL A 10 2.391 1.487 8.122 1.00 0.00 H new ATOM 0 HB VAL A 10 2.445 -0.432 10.485 1.00 0.00 H new ATOM 0 HG11 VAL A 10 0.010 -0.067 10.527 1.00 0.00 H new ATOM 0 HG12 VAL A 10 0.912 1.444 10.792 1.00 0.00 H new ATOM 0 HG13 VAL A 10 0.170 1.117 9.208 1.00 0.00 H new ATOM 0 HG21 VAL A 10 0.963 -1.861 9.130 1.00 0.00 H new ATOM 0 HG22 VAL A 10 1.166 -0.754 7.751 1.00 0.00 H new ATOM 0 HG23 VAL A 10 2.562 -1.663 8.375 1.00 0.00 H new ATOM 115 N GLY A 11 2.760 3.256 9.834 1.00 0.00 N ATOM 116 CA GLY A 11 3.070 4.329 10.760 1.00 0.00 C ATOM 117 C GLY A 11 4.301 5.113 10.348 1.00 0.00 C ATOM 118 O GLY A 11 5.151 5.428 11.181 1.00 0.00 O ATOM 0 H GLY A 11 2.112 3.508 9.088 1.00 0.00 H new ATOM 0 HA2 GLY A 11 2.218 5.005 10.826 1.00 0.00 H new ATOM 0 HA3 GLY A 11 3.225 3.913 11.755 1.00 0.00 H new ATOM 122 N CYS A 12 4.396 5.430 9.061 1.00 0.00 N ATOM 123 CA CYS A 12 5.532 6.182 8.543 1.00 0.00 C ATOM 124 C CYS A 12 5.086 7.169 7.463 1.00 0.00 C ATOM 125 O CYS A 12 4.230 6.850 6.638 1.00 0.00 O ATOM 126 CB CYS A 12 6.586 5.228 7.978 1.00 0.00 C ATOM 127 SG CYS A 12 8.118 5.170 8.937 1.00 0.00 S ATOM 0 H CYS A 12 3.701 5.178 8.359 1.00 0.00 H new ATOM 0 HA CYS A 12 5.969 6.747 9.366 1.00 0.00 H new ATOM 0 HB2 CYS A 12 6.163 4.225 7.928 1.00 0.00 H new ATOM 0 HB3 CYS A 12 6.820 5.526 6.956 1.00 0.00 H new ATOM 0 HG CYS A 12 8.946 4.335 8.382 1.00 0.00 H new ATOM 133 N PRO A 13 5.663 8.384 7.454 1.00 0.00 N ATOM 134 CA PRO A 13 5.318 9.413 6.469 1.00 0.00 C ATOM 135 C PRO A 13 5.957 9.152 5.109 1.00 0.00 C ATOM 136 O PRO A 13 7.181 9.114 4.985 1.00 0.00 O ATOM 137 CB PRO A 13 5.885 10.687 7.089 1.00 0.00 C ATOM 138 CG PRO A 13 7.050 10.225 7.894 1.00 0.00 C ATOM 139 CD PRO A 13 6.694 8.852 8.401 1.00 0.00 C ATOM 0 HA PRO A 13 4.246 9.453 6.274 1.00 0.00 H new ATOM 0 HB2 PRO A 13 6.190 11.399 6.323 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.145 11.188 7.713 1.00 0.00 H new ATOM 0 HG2 PRO A 13 7.954 10.193 7.287 1.00 0.00 H new ATOM 0 HG3 PRO A 13 7.246 10.907 8.722 1.00 0.00 H new ATOM 0 HD2 PRO A 13 7.561 8.191 8.408 1.00 0.00 H new ATOM 0 HD3 PRO A 13 6.313 8.889 9.422 1.00 0.00 H new ATOM 147 N VAL A 14 5.121 8.974 4.091 1.00 0.00 N ATOM 148 CA VAL A 14 5.606 8.718 2.740 1.00 0.00 C ATOM 149 C VAL A 14 4.746 9.431 1.703 1.00 0.00 C ATOM 150 O VAL A 14 3.521 9.465 1.813 1.00 0.00 O ATOM 151 CB VAL A 14 5.625 7.210 2.425 1.00 0.00 C ATOM 152 CG1 VAL A 14 6.797 6.533 3.119 1.00 0.00 C ATOM 153 CG2 VAL A 14 4.309 6.562 2.827 1.00 0.00 C ATOM 0 H VAL A 14 4.105 9.002 4.176 1.00 0.00 H new ATOM 0 HA VAL A 14 6.624 9.104 2.692 1.00 0.00 H new ATOM 0 HB VAL A 14 5.749 7.085 1.349 1.00 0.00 H new ATOM 0 HG11 VAL A 14 6.793 5.469 2.884 1.00 0.00 H new ATOM 0 HG12 VAL A 14 7.730 6.977 2.774 1.00 0.00 H new ATOM 0 HG13 VAL A 14 6.708 6.667 4.197 1.00 0.00 H new ATOM 0 HG21 VAL A 14 4.342 5.497 2.596 1.00 0.00 H new ATOM 0 HG22 VAL A 14 4.149 6.697 3.897 1.00 0.00 H new ATOM 0 HG23 VAL A 14 3.491 7.027 2.276 1.00 0.00 H new ATOM 163 N LYS A 15 5.398 10.002 0.696 1.00 0.00 N ATOM 164 CA LYS A 15 4.695 10.718 -0.363 1.00 0.00 C ATOM 165 C LYS A 15 4.202 9.756 -1.439 1.00 0.00 C ATOM 166 O LYS A 15 4.977 8.974 -1.990 1.00 0.00 O ATOM 167 CB LYS A 15 5.609 11.775 -0.986 1.00 0.00 C ATOM 168 CG LYS A 15 6.354 12.614 0.041 1.00 0.00 C ATOM 169 CD LYS A 15 7.856 12.597 -0.203 1.00 0.00 C ATOM 170 CE LYS A 15 8.329 13.885 -0.858 1.00 0.00 C ATOM 171 NZ LYS A 15 8.628 14.942 0.147 1.00 0.00 N ATOM 0 H LYS A 15 6.412 9.983 0.591 1.00 0.00 H new ATOM 0 HA LYS A 15 3.830 11.211 0.080 1.00 0.00 H new ATOM 0 HB2 LYS A 15 6.333 11.281 -1.634 1.00 0.00 H new ATOM 0 HB3 LYS A 15 5.012 12.433 -1.617 1.00 0.00 H new ATOM 0 HG2 LYS A 15 5.991 13.641 0.005 1.00 0.00 H new ATOM 0 HG3 LYS A 15 6.143 12.237 1.042 1.00 0.00 H new ATOM 0 HD2 LYS A 15 8.378 12.456 0.744 1.00 0.00 H new ATOM 0 HD3 LYS A 15 8.113 11.749 -0.838 1.00 0.00 H new ATOM 0 HE2 LYS A 15 9.222 13.684 -1.450 1.00 0.00 H new ATOM 0 HE3 LYS A 15 7.564 14.244 -1.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 8.947 15.804 -0.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 7.770 15.152 0.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 9.376 14.610 0.788 1.00 0.00 H new ATOM 185 N VAL A 16 2.909 9.824 -1.734 1.00 0.00 N ATOM 186 CA VAL A 16 2.308 8.961 -2.746 1.00 0.00 C ATOM 187 C VAL A 16 2.087 9.720 -4.050 1.00 0.00 C ATOM 188 O VAL A 16 1.501 10.803 -4.057 1.00 0.00 O ATOM 189 CB VAL A 16 0.963 8.383 -2.267 1.00 0.00 C ATOM 190 CG1 VAL A 16 0.427 7.370 -3.267 1.00 0.00 C ATOM 191 CG2 VAL A 16 1.110 7.753 -0.889 1.00 0.00 C ATOM 0 H VAL A 16 2.256 10.468 -1.287 1.00 0.00 H new ATOM 0 HA VAL A 16 3.005 8.141 -2.918 1.00 0.00 H new ATOM 0 HB VAL A 16 0.246 9.201 -2.194 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -0.524 6.974 -2.910 1.00 0.00 H new ATOM 0 HG12 VAL A 16 0.278 7.855 -4.232 1.00 0.00 H new ATOM 0 HG13 VAL A 16 1.142 6.554 -3.377 1.00 0.00 H new ATOM 0 HG21 VAL A 16 0.149 7.351 -0.569 1.00 0.00 H new ATOM 0 HG22 VAL A 16 1.844 6.948 -0.933 1.00 0.00 H new ATOM 0 HG23 VAL A 16 1.443 8.508 -0.177 1.00 0.00 H new ATOM 201 N GLN A 17 2.560 9.147 -5.152 1.00 0.00 N ATOM 202 CA GLN A 17 2.414 9.770 -6.462 1.00 0.00 C ATOM 203 C GLN A 17 1.110 9.342 -7.127 1.00 0.00 C ATOM 204 O GLN A 17 0.788 8.155 -7.178 1.00 0.00 O ATOM 205 CB GLN A 17 3.600 9.410 -7.357 1.00 0.00 C ATOM 206 CG GLN A 17 3.594 10.131 -8.695 1.00 0.00 C ATOM 207 CD GLN A 17 4.973 10.202 -9.324 1.00 0.00 C ATOM 208 OE1 GLN A 17 5.430 9.249 -9.954 1.00 0.00 O ATOM 209 NE2 GLN A 17 5.642 11.338 -9.156 1.00 0.00 N ATOM 0 H GLN A 17 3.048 8.251 -5.163 1.00 0.00 H new ATOM 0 HA GLN A 17 2.390 10.851 -6.321 1.00 0.00 H new ATOM 0 HB2 GLN A 17 4.526 9.645 -6.831 1.00 0.00 H new ATOM 0 HB3 GLN A 17 3.598 8.334 -7.533 1.00 0.00 H new ATOM 0 HG2 GLN A 17 2.914 9.620 -9.376 1.00 0.00 H new ATOM 0 HG3 GLN A 17 3.209 11.141 -8.558 1.00 0.00 H new ATOM 0 HE21 GLN A 17 5.224 12.103 -8.626 1.00 0.00 H new ATOM 0 HE22 GLN A 17 6.574 11.445 -9.557 1.00 0.00 H new ATOM 218 N LEU A 18 0.364 10.318 -7.638 1.00 0.00 N ATOM 219 CA LEU A 18 -0.906 10.042 -8.302 1.00 0.00 C ATOM 220 C LEU A 18 -0.808 10.324 -9.798 1.00 0.00 C ATOM 221 O LEU A 18 -1.067 9.447 -10.623 1.00 0.00 O ATOM 222 CB LEU A 18 -2.021 10.886 -7.684 1.00 0.00 C ATOM 223 CG LEU A 18 -2.372 10.536 -6.236 1.00 0.00 C ATOM 224 CD1 LEU A 18 -3.538 11.383 -5.750 1.00 0.00 C ATOM 225 CD2 LEU A 18 -2.699 9.055 -6.112 1.00 0.00 C ATOM 0 H LEU A 18 0.617 11.306 -7.605 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.140 8.986 -8.164 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -1.728 11.935 -7.727 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.917 10.780 -8.295 1.00 0.00 H new ATOM 0 HG LEU A 18 -1.507 10.752 -5.609 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -3.774 11.120 -4.719 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.269 12.438 -5.803 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -4.409 11.199 -6.379 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -2.946 8.822 -5.076 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.549 8.815 -6.751 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -1.836 8.465 -6.420 1.00 0.00 H new ATOM 237 N ARG A 19 -0.435 11.553 -10.140 1.00 0.00 N ATOM 238 CA ARG A 19 -0.304 11.950 -11.537 1.00 0.00 C ATOM 239 C ARG A 19 0.858 11.221 -12.204 1.00 0.00 C ATOM 240 O ARG A 19 1.642 10.543 -11.540 1.00 0.00 O ATOM 241 CB ARG A 19 -0.099 13.463 -11.641 1.00 0.00 C ATOM 242 CG ARG A 19 -0.782 14.087 -12.848 1.00 0.00 C ATOM 243 CD ARG A 19 -1.818 15.119 -12.434 1.00 0.00 C ATOM 244 NE ARG A 19 -3.071 14.497 -12.009 1.00 0.00 N ATOM 245 CZ ARG A 19 -4.230 15.146 -11.926 1.00 0.00 C ATOM 246 NH1 ARG A 19 -4.301 16.435 -12.235 1.00 0.00 N ATOM 247 NH2 ARG A 19 -5.321 14.505 -11.533 1.00 0.00 N ATOM 0 H ARG A 19 -0.218 12.290 -9.469 1.00 0.00 H new ATOM 0 HA ARG A 19 -1.224 11.678 -12.054 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -0.477 13.936 -10.735 1.00 0.00 H new ATOM 0 HB3 ARG A 19 0.969 13.674 -11.689 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -0.034 14.557 -13.487 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -1.261 13.307 -13.439 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -1.420 15.726 -11.621 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -2.012 15.793 -13.269 1.00 0.00 H new ATOM 0 HE ARG A 19 -3.056 13.508 -11.762 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -3.464 16.934 -12.538 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -5.192 16.927 -12.169 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -5.272 13.515 -11.294 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -6.209 15.002 -11.469 1.00 0.00 H new ATOM 261 N SER A 20 0.964 11.366 -13.522 1.00 0.00 N ATOM 262 CA SER A 20 2.032 10.723 -14.277 1.00 0.00 C ATOM 263 C SER A 20 3.370 11.407 -14.018 1.00 0.00 C ATOM 264 O SER A 20 3.844 12.198 -14.834 1.00 0.00 O ATOM 265 CB SER A 20 1.713 10.750 -15.773 1.00 0.00 C ATOM 266 OG SER A 20 0.414 10.245 -16.028 1.00 0.00 O ATOM 0 H SER A 20 0.323 11.923 -14.088 1.00 0.00 H new ATOM 0 HA SER A 20 2.105 9.687 -13.946 1.00 0.00 H new ATOM 0 HB2 SER A 20 1.789 11.772 -16.145 1.00 0.00 H new ATOM 0 HB3 SER A 20 2.450 10.157 -16.316 1.00 0.00 H new ATOM 0 HG SER A 20 0.235 10.275 -16.991 1.00 0.00 H new ATOM 272 N GLY A 21 3.973 11.100 -12.875 1.00 0.00 N ATOM 273 CA GLY A 21 5.249 11.694 -12.526 1.00 0.00 C ATOM 274 C GLY A 21 5.186 13.208 -12.457 1.00 0.00 C ATOM 275 O GLY A 21 5.863 13.900 -13.216 1.00 0.00 O ATOM 0 H GLY A 21 3.600 10.450 -12.183 1.00 0.00 H new ATOM 0 HA2 GLY A 21 5.577 11.303 -11.563 1.00 0.00 H new ATOM 0 HA3 GLY A 21 5.997 11.398 -13.261 1.00 0.00 H new ATOM 279 N GLU A 22 4.370 13.721 -11.542 1.00 0.00 N ATOM 280 CA GLU A 22 4.218 15.162 -11.376 1.00 0.00 C ATOM 281 C GLU A 22 4.558 15.583 -9.949 1.00 0.00 C ATOM 282 O GLU A 22 5.527 16.306 -9.719 1.00 0.00 O ATOM 283 CB GLU A 22 2.790 15.589 -11.718 1.00 0.00 C ATOM 284 CG GLU A 22 2.609 17.096 -11.798 1.00 0.00 C ATOM 285 CD GLU A 22 3.230 17.692 -13.047 1.00 0.00 C ATOM 286 OE1 GLU A 22 4.443 17.484 -13.263 1.00 0.00 O ATOM 287 OE2 GLU A 22 2.504 18.366 -13.808 1.00 0.00 O ATOM 0 H GLU A 22 3.804 13.161 -10.905 1.00 0.00 H new ATOM 0 HA GLU A 22 4.910 15.656 -12.058 1.00 0.00 H new ATOM 0 HB2 GLU A 22 2.506 15.146 -12.673 1.00 0.00 H new ATOM 0 HB3 GLU A 22 2.110 15.189 -10.966 1.00 0.00 H new ATOM 0 HG2 GLU A 22 1.545 17.332 -11.777 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.055 17.559 -10.918 1.00 0.00 H new ATOM 294 N GLU A 23 3.754 15.124 -8.995 1.00 0.00 N ATOM 295 CA GLU A 23 3.970 15.452 -7.591 1.00 0.00 C ATOM 296 C GLU A 23 3.627 14.265 -6.696 1.00 0.00 C ATOM 297 O GLU A 23 2.940 13.335 -7.119 1.00 0.00 O ATOM 298 CB GLU A 23 3.128 16.665 -7.192 1.00 0.00 C ATOM 299 CG GLU A 23 3.590 17.963 -7.834 1.00 0.00 C ATOM 300 CD GLU A 23 2.483 18.995 -7.926 1.00 0.00 C ATOM 301 OE1 GLU A 23 1.554 18.797 -8.737 1.00 0.00 O ATOM 302 OE2 GLU A 23 2.545 20.000 -7.188 1.00 0.00 O ATOM 0 H GLU A 23 2.948 14.524 -9.169 1.00 0.00 H new ATOM 0 HA GLU A 23 5.025 15.692 -7.459 1.00 0.00 H new ATOM 0 HB2 GLU A 23 2.089 16.482 -7.468 1.00 0.00 H new ATOM 0 HB3 GLU A 23 3.156 16.775 -6.108 1.00 0.00 H new ATOM 0 HG2 GLU A 23 4.418 18.375 -7.257 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.971 17.754 -8.834 1.00 0.00 H new ATOM 309 N LYS A 24 4.110 14.302 -5.459 1.00 0.00 N ATOM 310 CA LYS A 24 3.855 13.229 -4.505 1.00 0.00 C ATOM 311 C LYS A 24 3.279 13.782 -3.206 1.00 0.00 C ATOM 312 O LYS A 24 3.959 14.494 -2.468 1.00 0.00 O ATOM 313 CB LYS A 24 5.145 12.457 -4.217 1.00 0.00 C ATOM 314 CG LYS A 24 5.722 11.761 -5.438 1.00 0.00 C ATOM 315 CD LYS A 24 6.339 10.420 -5.075 1.00 0.00 C ATOM 316 CE LYS A 24 7.394 10.000 -6.085 1.00 0.00 C ATOM 317 NZ LYS A 24 7.363 8.534 -6.345 1.00 0.00 N ATOM 0 H LYS A 24 4.681 15.064 -5.093 1.00 0.00 H new ATOM 0 HA LYS A 24 3.124 12.551 -4.946 1.00 0.00 H new ATOM 0 HB2 LYS A 24 5.889 13.145 -3.816 1.00 0.00 H new ATOM 0 HB3 LYS A 24 4.949 11.714 -3.444 1.00 0.00 H new ATOM 0 HG2 LYS A 24 4.936 11.613 -6.179 1.00 0.00 H new ATOM 0 HG3 LYS A 24 6.478 12.398 -5.898 1.00 0.00 H new ATOM 0 HD2 LYS A 24 6.787 10.481 -4.083 1.00 0.00 H new ATOM 0 HD3 LYS A 24 5.558 9.661 -5.026 1.00 0.00 H new ATOM 0 HE2 LYS A 24 7.236 10.538 -7.020 1.00 0.00 H new ATOM 0 HE3 LYS A 24 8.381 10.283 -5.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 8.098 8.289 -7.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 7.539 8.020 -5.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 6.430 8.268 -6.720 1.00 0.00 H new ATOM 331 N PHE A 25 2.023 13.447 -2.932 1.00 0.00 N ATOM 332 CA PHE A 25 1.356 13.909 -1.721 1.00 0.00 C ATOM 333 C PHE A 25 1.825 13.111 -0.504 1.00 0.00 C ATOM 334 O PHE A 25 1.794 11.880 -0.514 1.00 0.00 O ATOM 335 CB PHE A 25 -0.162 13.788 -1.871 1.00 0.00 C ATOM 336 CG PHE A 25 -0.736 14.701 -2.916 1.00 0.00 C ATOM 337 CD1 PHE A 25 -0.433 16.054 -2.915 1.00 0.00 C ATOM 338 CD2 PHE A 25 -1.580 14.207 -3.898 1.00 0.00 C ATOM 339 CE1 PHE A 25 -0.961 16.896 -3.875 1.00 0.00 C ATOM 340 CE2 PHE A 25 -2.110 15.046 -4.861 1.00 0.00 C ATOM 341 CZ PHE A 25 -1.800 16.391 -4.848 1.00 0.00 C ATOM 0 H PHE A 25 1.447 12.857 -3.532 1.00 0.00 H new ATOM 0 HA PHE A 25 1.616 14.957 -1.569 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -0.413 12.758 -2.123 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -0.632 14.006 -0.912 1.00 0.00 H new ATOM 0 HD1 PHE A 25 0.223 16.454 -2.156 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -1.826 13.156 -3.911 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -0.718 17.948 -3.864 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -2.766 14.649 -5.622 1.00 0.00 H new ATOM 0 HZ PHE A 25 -2.214 17.048 -5.599 1.00 0.00 H new ATOM 351 N PRO A 26 2.267 13.799 0.565 1.00 0.00 N ATOM 352 CA PRO A 26 2.739 13.138 1.786 1.00 0.00 C ATOM 353 C PRO A 26 1.602 12.502 2.577 1.00 0.00 C ATOM 354 O PRO A 26 0.468 12.979 2.545 1.00 0.00 O ATOM 355 CB PRO A 26 3.375 14.279 2.582 1.00 0.00 C ATOM 356 CG PRO A 26 2.662 15.502 2.121 1.00 0.00 C ATOM 357 CD PRO A 26 2.340 15.270 0.670 1.00 0.00 C ATOM 0 HA PRO A 26 3.424 12.319 1.569 1.00 0.00 H new ATOM 0 HB2 PRO A 26 3.253 14.130 3.655 1.00 0.00 H new ATOM 0 HB3 PRO A 26 4.446 14.348 2.389 1.00 0.00 H new ATOM 0 HG2 PRO A 26 1.754 15.667 2.701 1.00 0.00 H new ATOM 0 HG3 PRO A 26 3.285 16.388 2.246 1.00 0.00 H new ATOM 0 HD2 PRO A 26 1.398 15.740 0.388 1.00 0.00 H new ATOM 0 HD3 PRO A 26 3.110 15.681 0.017 1.00 0.00 H new ATOM 365 N GLY A 27 1.913 11.422 3.288 1.00 0.00 N ATOM 366 CA GLY A 27 0.906 10.739 4.076 1.00 0.00 C ATOM 367 C GLY A 27 1.499 9.680 4.984 1.00 0.00 C ATOM 368 O GLY A 27 2.526 9.082 4.663 1.00 0.00 O ATOM 0 H GLY A 27 2.845 11.009 3.332 1.00 0.00 H new ATOM 0 HA2 GLY A 27 0.365 11.468 4.679 1.00 0.00 H new ATOM 0 HA3 GLY A 27 0.180 10.275 3.408 1.00 0.00 H new ATOM 372 N VAL A 28 0.850 9.447 6.121 1.00 0.00 N ATOM 373 CA VAL A 28 1.319 8.452 7.078 1.00 0.00 C ATOM 374 C VAL A 28 0.744 7.074 6.763 1.00 0.00 C ATOM 375 O VAL A 28 -0.455 6.930 6.527 1.00 0.00 O ATOM 376 CB VAL A 28 0.942 8.841 8.522 1.00 0.00 C ATOM 377 CG1 VAL A 28 -0.570 8.914 8.684 1.00 0.00 C ATOM 378 CG2 VAL A 28 1.545 7.861 9.516 1.00 0.00 C ATOM 0 H VAL A 28 -0.001 9.934 6.401 1.00 0.00 H new ATOM 0 HA VAL A 28 2.405 8.416 6.993 1.00 0.00 H new ATOM 0 HB VAL A 28 1.352 9.830 8.727 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -0.813 9.190 9.710 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -0.973 9.662 8.002 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.008 7.942 8.456 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.267 8.153 10.529 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.170 6.858 9.312 1.00 0.00 H new ATOM 0 HG23 VAL A 28 2.631 7.868 9.421 1.00 0.00 H new ATOM 388 N VAL A 29 1.609 6.064 6.761 1.00 0.00 N ATOM 389 CA VAL A 29 1.188 4.699 6.476 1.00 0.00 C ATOM 390 C VAL A 29 0.299 4.157 7.590 1.00 0.00 C ATOM 391 O VAL A 29 0.624 4.276 8.772 1.00 0.00 O ATOM 392 CB VAL A 29 2.398 3.762 6.298 1.00 0.00 C ATOM 393 CG1 VAL A 29 1.946 2.380 5.849 1.00 0.00 C ATOM 394 CG2 VAL A 29 3.392 4.352 5.309 1.00 0.00 C ATOM 0 H VAL A 29 2.605 6.167 6.954 1.00 0.00 H new ATOM 0 HA VAL A 29 0.623 4.729 5.544 1.00 0.00 H new ATOM 0 HB VAL A 29 2.896 3.660 7.262 1.00 0.00 H new ATOM 0 HG11 VAL A 29 2.816 1.734 5.729 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.278 1.954 6.598 1.00 0.00 H new ATOM 0 HG13 VAL A 29 1.420 2.460 4.898 1.00 0.00 H new ATOM 0 HG21 VAL A 29 4.239 3.675 5.197 1.00 0.00 H new ATOM 0 HG22 VAL A 29 2.906 4.488 4.343 1.00 0.00 H new ATOM 0 HG23 VAL A 29 3.744 5.316 5.678 1.00 0.00 H new ATOM 404 N ARG A 30 -0.826 3.561 7.208 1.00 0.00 N ATOM 405 CA ARG A 30 -1.762 3.000 8.176 1.00 0.00 C ATOM 406 C ARG A 30 -1.846 1.484 8.038 1.00 0.00 C ATOM 407 O ARG A 30 -1.971 0.766 9.032 1.00 0.00 O ATOM 408 CB ARG A 30 -3.150 3.619 7.993 1.00 0.00 C ATOM 409 CG ARG A 30 -3.173 5.128 8.168 1.00 0.00 C ATOM 410 CD ARG A 30 -2.739 5.540 9.568 1.00 0.00 C ATOM 411 NE ARG A 30 -3.830 6.157 10.320 1.00 0.00 N ATOM 412 CZ ARG A 30 -4.717 5.474 11.043 1.00 0.00 C ATOM 413 NH1 ARG A 30 -4.650 4.150 11.116 1.00 0.00 N ATOM 414 NH2 ARG A 30 -5.674 6.118 11.695 1.00 0.00 N ATOM 0 H ARG A 30 -1.112 3.454 6.235 1.00 0.00 H new ATOM 0 HA ARG A 30 -1.396 3.235 9.175 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -3.520 3.372 6.998 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -3.837 3.168 8.710 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -2.514 5.590 7.432 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -4.179 5.501 7.974 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -2.376 4.665 10.107 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -1.906 6.239 9.498 1.00 0.00 H new ATOM 0 HE ARG A 30 -3.918 7.173 10.290 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -3.916 3.648 10.617 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -5.333 3.635 11.672 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -5.731 7.135 11.643 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -6.354 5.597 12.249 1.00 0.00 H new ATOM 428 N PHE A 31 -1.778 1.001 6.802 1.00 0.00 N ATOM 429 CA PHE A 31 -1.847 -0.432 6.537 1.00 0.00 C ATOM 430 C PHE A 31 -0.812 -0.844 5.495 1.00 0.00 C ATOM 431 O PHE A 31 -0.227 0.000 4.818 1.00 0.00 O ATOM 432 CB PHE A 31 -3.249 -0.817 6.060 1.00 0.00 C ATOM 433 CG PHE A 31 -3.532 -2.289 6.157 1.00 0.00 C ATOM 434 CD1 PHE A 31 -3.904 -2.859 7.364 1.00 0.00 C ATOM 435 CD2 PHE A 31 -3.426 -3.102 5.040 1.00 0.00 C ATOM 436 CE1 PHE A 31 -4.164 -4.213 7.456 1.00 0.00 C ATOM 437 CE2 PHE A 31 -3.686 -4.457 5.126 1.00 0.00 C ATOM 438 CZ PHE A 31 -4.055 -5.013 6.335 1.00 0.00 C ATOM 0 H PHE A 31 -1.675 1.580 5.968 1.00 0.00 H new ATOM 0 HA PHE A 31 -1.629 -0.958 7.466 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -3.987 -0.274 6.650 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -3.372 -0.499 5.025 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -3.992 -2.238 8.243 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -3.137 -2.673 4.092 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -4.452 -4.645 8.403 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -3.601 -5.080 4.248 1.00 0.00 H new ATOM 0 HZ PHE A 31 -4.258 -6.071 6.404 1.00 0.00 H new ATOM 448 N ARG A 32 -0.593 -2.150 5.372 1.00 0.00 N ATOM 449 CA ARG A 32 0.370 -2.676 4.413 1.00 0.00 C ATOM 450 C ARG A 32 0.160 -4.171 4.196 1.00 0.00 C ATOM 451 O ARG A 32 0.247 -4.962 5.135 1.00 0.00 O ATOM 452 CB ARG A 32 1.798 -2.415 4.896 1.00 0.00 C ATOM 453 CG ARG A 32 2.866 -2.902 3.929 1.00 0.00 C ATOM 454 CD ARG A 32 4.155 -3.253 4.654 1.00 0.00 C ATOM 455 NE ARG A 32 4.791 -4.443 4.095 1.00 0.00 N ATOM 456 CZ ARG A 32 4.260 -5.663 4.150 1.00 0.00 C ATOM 457 NH1 ARG A 32 3.086 -5.857 4.740 1.00 0.00 N ATOM 458 NH2 ARG A 32 4.904 -6.691 3.617 1.00 0.00 N ATOM 0 H ARG A 32 -1.070 -2.862 5.925 1.00 0.00 H new ATOM 0 HA ARG A 32 0.216 -2.164 3.463 1.00 0.00 H new ATOM 0 HB2 ARG A 32 1.928 -1.345 5.059 1.00 0.00 H new ATOM 0 HB3 ARG A 32 1.942 -2.904 5.860 1.00 0.00 H new ATOM 0 HG2 ARG A 32 2.500 -3.777 3.391 1.00 0.00 H new ATOM 0 HG3 ARG A 32 3.064 -2.130 3.185 1.00 0.00 H new ATOM 0 HD2 ARG A 32 4.845 -2.411 4.594 1.00 0.00 H new ATOM 0 HD3 ARG A 32 3.943 -3.418 5.711 1.00 0.00 H new ATOM 0 HE ARG A 32 5.695 -4.333 3.635 1.00 0.00 H new ATOM 0 HH11 ARG A 32 2.587 -5.070 5.154 1.00 0.00 H new ATOM 0 HH12 ARG A 32 2.684 -6.793 4.779 1.00 0.00 H new ATOM 0 HH21 ARG A 32 5.807 -6.548 3.164 1.00 0.00 H new ATOM 0 HH22 ARG A 32 4.497 -7.625 3.659 1.00 0.00 H new ATOM 472 N GLY A 33 -0.117 -4.550 2.953 1.00 0.00 N ATOM 473 CA GLY A 33 -0.336 -5.950 2.636 1.00 0.00 C ATOM 474 C GLY A 33 -1.017 -6.142 1.294 1.00 0.00 C ATOM 475 O GLY A 33 -1.735 -5.256 0.828 1.00 0.00 O ATOM 0 H GLY A 33 -0.194 -3.914 2.160 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.621 -6.472 2.632 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -0.945 -6.405 3.417 1.00 0.00 H new ATOM 479 N PRO A 34 -0.811 -7.299 0.644 1.00 0.00 N ATOM 480 CA PRO A 34 -1.418 -7.593 -0.659 1.00 0.00 C ATOM 481 C PRO A 34 -2.921 -7.828 -0.558 1.00 0.00 C ATOM 482 O PRO A 34 -3.411 -8.360 0.438 1.00 0.00 O ATOM 483 CB PRO A 34 -0.705 -8.872 -1.102 1.00 0.00 C ATOM 484 CG PRO A 34 -0.283 -9.527 0.167 1.00 0.00 C ATOM 485 CD PRO A 34 0.031 -8.411 1.126 1.00 0.00 C ATOM 0 HA PRO A 34 -1.307 -6.763 -1.357 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -1.369 -9.516 -1.679 1.00 0.00 H new ATOM 0 HB3 PRO A 34 0.153 -8.648 -1.737 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -1.075 -10.166 0.558 1.00 0.00 H new ATOM 0 HG3 PRO A 34 0.589 -10.161 0.007 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -0.212 -8.683 2.153 1.00 0.00 H new ATOM 0 HD3 PRO A 34 1.089 -8.151 1.107 1.00 0.00 H new ATOM 493 N LEU A 35 -3.648 -7.428 -1.596 1.00 0.00 N ATOM 494 CA LEU A 35 -5.097 -7.595 -1.625 1.00 0.00 C ATOM 495 C LEU A 35 -5.470 -9.052 -1.883 1.00 0.00 C ATOM 496 O LEU A 35 -5.994 -9.733 -1.003 1.00 0.00 O ATOM 497 CB LEU A 35 -5.713 -6.699 -2.703 1.00 0.00 C ATOM 498 CG LEU A 35 -5.588 -5.197 -2.444 1.00 0.00 C ATOM 499 CD1 LEU A 35 -5.924 -4.410 -3.702 1.00 0.00 C ATOM 500 CD2 LEU A 35 -6.490 -4.778 -1.294 1.00 0.00 C ATOM 0 H LEU A 35 -3.258 -6.986 -2.428 1.00 0.00 H new ATOM 0 HA LEU A 35 -5.492 -7.304 -0.652 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -5.241 -6.928 -3.658 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -6.769 -6.949 -2.802 1.00 0.00 H new ATOM 0 HG LEU A 35 -4.556 -4.979 -2.168 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -5.830 -3.343 -3.500 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -5.237 -4.690 -4.501 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -6.946 -4.632 -4.008 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.388 -3.706 -1.124 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -7.526 -5.009 -1.541 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -6.203 -5.318 -0.391 1.00 0.00 H new ATOM 512 N LEU A 36 -5.197 -9.521 -3.096 1.00 0.00 N ATOM 513 CA LEU A 36 -5.503 -10.897 -3.471 1.00 0.00 C ATOM 514 C LEU A 36 -4.705 -11.315 -4.702 1.00 0.00 C ATOM 515 O LEU A 36 -4.164 -10.474 -5.419 1.00 0.00 O ATOM 516 CB LEU A 36 -7.002 -11.052 -3.740 1.00 0.00 C ATOM 517 CG LEU A 36 -7.804 -11.668 -2.592 1.00 0.00 C ATOM 518 CD1 LEU A 36 -9.292 -11.641 -2.907 1.00 0.00 C ATOM 519 CD2 LEU A 36 -7.340 -13.093 -2.324 1.00 0.00 C ATOM 0 H LEU A 36 -4.764 -8.969 -3.836 1.00 0.00 H new ATOM 0 HA LEU A 36 -5.222 -11.546 -2.642 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -7.418 -10.071 -3.969 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -7.135 -11.670 -4.628 1.00 0.00 H new ATOM 0 HG LEU A 36 -7.632 -11.075 -1.694 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -9.847 -12.083 -2.080 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -9.615 -10.610 -3.051 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -9.482 -12.211 -3.817 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -7.921 -13.517 -1.505 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -7.483 -13.697 -3.220 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -6.284 -13.087 -2.055 1.00 0.00 H new ATOM 531 N ALA A 37 -4.636 -12.621 -4.940 1.00 0.00 N ATOM 532 CA ALA A 37 -3.904 -13.150 -6.084 1.00 0.00 C ATOM 533 C ALA A 37 -4.716 -14.220 -6.807 1.00 0.00 C ATOM 534 O ALA A 37 -5.066 -15.247 -6.225 1.00 0.00 O ATOM 535 CB ALA A 37 -2.564 -13.714 -5.637 1.00 0.00 C ATOM 0 H ALA A 37 -5.078 -13.331 -4.356 1.00 0.00 H new ATOM 0 HA ALA A 37 -3.727 -12.332 -6.782 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -2.028 -14.106 -6.501 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -1.974 -12.925 -5.171 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -2.729 -14.516 -4.918 1.00 0.00 H new ATOM 541 N GLU A 38 -5.011 -13.973 -8.079 1.00 0.00 N ATOM 542 CA GLU A 38 -5.780 -14.916 -8.882 1.00 0.00 C ATOM 543 C GLU A 38 -5.088 -15.188 -10.213 1.00 0.00 C ATOM 544 O GLU A 38 -4.598 -16.292 -10.454 1.00 0.00 O ATOM 545 CB GLU A 38 -7.191 -14.376 -9.128 1.00 0.00 C ATOM 546 CG GLU A 38 -7.929 -13.999 -7.852 1.00 0.00 C ATOM 547 CD GLU A 38 -9.183 -14.822 -7.638 1.00 0.00 C ATOM 548 OE1 GLU A 38 -9.061 -16.049 -7.435 1.00 0.00 O ATOM 549 OE2 GLU A 38 -10.288 -14.241 -7.671 1.00 0.00 O ATOM 0 H GLU A 38 -4.729 -13.128 -8.576 1.00 0.00 H new ATOM 0 HA GLU A 38 -5.848 -15.854 -8.331 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -7.129 -13.500 -9.774 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -7.770 -15.127 -9.665 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -7.263 -14.131 -6.999 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.194 -12.942 -7.889 1.00 0.00 H new ATOM 556 N ARG A 39 -5.051 -14.177 -11.074 1.00 0.00 N ATOM 557 CA ARG A 39 -4.417 -14.309 -12.381 1.00 0.00 C ATOM 558 C ARG A 39 -3.281 -13.304 -12.541 1.00 0.00 C ATOM 559 O ARG A 39 -2.227 -13.625 -13.092 1.00 0.00 O ATOM 560 CB ARG A 39 -5.449 -14.110 -13.493 1.00 0.00 C ATOM 561 CG ARG A 39 -6.534 -15.174 -13.514 1.00 0.00 C ATOM 562 CD ARG A 39 -7.699 -14.764 -14.400 1.00 0.00 C ATOM 563 NE ARG A 39 -7.273 -14.482 -15.769 1.00 0.00 N ATOM 564 CZ ARG A 39 -8.100 -14.446 -16.810 1.00 0.00 C ATOM 565 NH1 ARG A 39 -9.398 -14.672 -16.644 1.00 0.00 N ATOM 566 NH2 ARG A 39 -7.631 -14.181 -18.021 1.00 0.00 N ATOM 0 H ARG A 39 -5.452 -13.257 -10.891 1.00 0.00 H new ATOM 0 HA ARG A 39 -4.001 -15.314 -12.455 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -5.914 -13.131 -13.375 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -4.937 -14.106 -14.455 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -6.116 -16.114 -13.873 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -6.892 -15.351 -12.500 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -8.445 -15.559 -14.409 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -8.180 -13.880 -13.981 1.00 0.00 H new ATOM 0 HE ARG A 39 -6.283 -14.302 -15.936 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -9.766 -14.875 -15.714 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -10.027 -14.643 -17.446 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -6.635 -14.005 -18.155 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -8.266 -14.154 -18.819 1.00 0.00 H new ATOM 580 N THR A 40 -3.503 -12.089 -12.057 1.00 0.00 N ATOM 581 CA THR A 40 -2.499 -11.034 -12.145 1.00 0.00 C ATOM 582 C THR A 40 -1.284 -11.367 -11.285 1.00 0.00 C ATOM 583 O THR A 40 -1.290 -12.345 -10.537 1.00 0.00 O ATOM 584 CB THR A 40 -3.097 -9.695 -11.709 1.00 0.00 C ATOM 585 OG1 THR A 40 -2.143 -8.656 -11.842 1.00 0.00 O ATOM 586 CG2 THR A 40 -3.581 -9.694 -10.275 1.00 0.00 C ATOM 0 H THR A 40 -4.370 -11.808 -11.599 1.00 0.00 H new ATOM 0 HA THR A 40 -2.176 -10.958 -13.183 1.00 0.00 H new ATOM 0 HB THR A 40 -3.954 -9.533 -12.363 1.00 0.00 H new ATOM 0 HG1 THR A 40 -2.543 -7.807 -11.560 1.00 0.00 H new ATOM 0 HG21 THR A 40 -3.993 -8.715 -10.031 1.00 0.00 H new ATOM 0 HG22 THR A 40 -4.353 -10.454 -10.151 1.00 0.00 H new ATOM 0 HG23 THR A 40 -2.746 -9.913 -9.609 1.00 0.00 H new ATOM 594 N VAL A 41 -0.245 -10.548 -11.397 1.00 0.00 N ATOM 595 CA VAL A 41 0.978 -10.754 -10.631 1.00 0.00 C ATOM 596 C VAL A 41 0.730 -10.557 -9.138 1.00 0.00 C ATOM 597 O VAL A 41 -0.232 -9.899 -8.741 1.00 0.00 O ATOM 598 CB VAL A 41 2.097 -9.797 -11.090 1.00 0.00 C ATOM 599 CG1 VAL A 41 1.685 -8.348 -10.877 1.00 0.00 C ATOM 600 CG2 VAL A 41 3.398 -10.104 -10.363 1.00 0.00 C ATOM 0 H VAL A 41 -0.225 -9.734 -12.012 1.00 0.00 H new ATOM 0 HA VAL A 41 1.296 -11.781 -10.810 1.00 0.00 H new ATOM 0 HB VAL A 41 2.262 -9.949 -12.157 1.00 0.00 H new ATOM 0 HG11 VAL A 41 2.488 -7.689 -11.207 1.00 0.00 H new ATOM 0 HG12 VAL A 41 0.783 -8.138 -11.452 1.00 0.00 H new ATOM 0 HG13 VAL A 41 1.488 -8.178 -9.819 1.00 0.00 H new ATOM 0 HG21 VAL A 41 4.174 -9.418 -10.701 1.00 0.00 H new ATOM 0 HG22 VAL A 41 3.252 -9.986 -9.289 1.00 0.00 H new ATOM 0 HG23 VAL A 41 3.701 -11.129 -10.577 1.00 0.00 H new ATOM 610 N SER A 42 1.602 -11.131 -8.318 1.00 0.00 N ATOM 611 CA SER A 42 1.478 -11.018 -6.869 1.00 0.00 C ATOM 612 C SER A 42 2.286 -9.837 -6.342 1.00 0.00 C ATOM 613 O SER A 42 3.488 -9.950 -6.105 1.00 0.00 O ATOM 614 CB SER A 42 1.944 -12.310 -6.194 1.00 0.00 C ATOM 615 OG SER A 42 1.897 -12.193 -4.782 1.00 0.00 O ATOM 0 H SER A 42 2.403 -11.680 -8.631 1.00 0.00 H new ATOM 0 HA SER A 42 0.427 -10.850 -6.633 1.00 0.00 H new ATOM 0 HB2 SER A 42 1.314 -13.139 -6.515 1.00 0.00 H new ATOM 0 HB3 SER A 42 2.961 -12.542 -6.509 1.00 0.00 H new ATOM 0 HG SER A 42 2.198 -13.032 -4.374 1.00 0.00 H new ATOM 621 N GLY A 43 1.617 -8.702 -6.163 1.00 0.00 N ATOM 622 CA GLY A 43 2.288 -7.516 -5.665 1.00 0.00 C ATOM 623 C GLY A 43 1.904 -7.188 -4.235 1.00 0.00 C ATOM 624 O GLY A 43 1.260 -7.990 -3.559 1.00 0.00 O ATOM 0 H GLY A 43 0.622 -8.583 -6.354 1.00 0.00 H new ATOM 0 HA2 GLY A 43 3.367 -7.661 -5.724 1.00 0.00 H new ATOM 0 HA3 GLY A 43 2.045 -6.669 -6.306 1.00 0.00 H new ATOM 628 N ILE A 44 2.300 -6.007 -3.774 1.00 0.00 N ATOM 629 CA ILE A 44 1.994 -5.574 -2.416 1.00 0.00 C ATOM 630 C ILE A 44 1.369 -4.184 -2.410 1.00 0.00 C ATOM 631 O ILE A 44 1.589 -3.390 -3.323 1.00 0.00 O ATOM 632 CB ILE A 44 3.256 -5.562 -1.532 1.00 0.00 C ATOM 633 CG1 ILE A 44 4.018 -6.880 -1.674 1.00 0.00 C ATOM 634 CG2 ILE A 44 2.883 -5.312 -0.078 1.00 0.00 C ATOM 635 CD1 ILE A 44 5.431 -6.822 -1.136 1.00 0.00 C ATOM 0 H ILE A 44 2.834 -5.332 -4.321 1.00 0.00 H new ATOM 0 HA ILE A 44 1.281 -6.291 -2.009 1.00 0.00 H new ATOM 0 HB ILE A 44 3.906 -4.752 -1.864 1.00 0.00 H new ATOM 0 HG12 ILE A 44 3.471 -7.665 -1.152 1.00 0.00 H new ATOM 0 HG13 ILE A 44 4.050 -7.160 -2.727 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.785 -5.307 0.533 1.00 0.00 H new ATOM 0 HG22 ILE A 44 2.380 -4.349 0.008 1.00 0.00 H new ATOM 0 HG23 ILE A 44 2.216 -6.102 0.267 1.00 0.00 H new ATOM 0 HD11 ILE A 44 5.911 -7.791 -1.270 1.00 0.00 H new ATOM 0 HD12 ILE A 44 5.994 -6.060 -1.675 1.00 0.00 H new ATOM 0 HD13 ILE A 44 5.406 -6.573 -0.075 1.00 0.00 H new ATOM 647 N PHE A 45 0.588 -3.895 -1.373 1.00 0.00 N ATOM 648 CA PHE A 45 -0.069 -2.599 -1.248 1.00 0.00 C ATOM 649 C PHE A 45 0.289 -1.934 0.078 1.00 0.00 C ATOM 650 O PHE A 45 0.409 -2.601 1.106 1.00 0.00 O ATOM 651 CB PHE A 45 -1.585 -2.761 -1.357 1.00 0.00 C ATOM 652 CG PHE A 45 -2.052 -3.126 -2.738 1.00 0.00 C ATOM 653 CD1 PHE A 45 -2.247 -2.149 -3.700 1.00 0.00 C ATOM 654 CD2 PHE A 45 -2.295 -4.449 -3.073 1.00 0.00 C ATOM 655 CE1 PHE A 45 -2.676 -2.482 -4.970 1.00 0.00 C ATOM 656 CE2 PHE A 45 -2.724 -4.789 -4.342 1.00 0.00 C ATOM 657 CZ PHE A 45 -2.914 -3.804 -5.292 1.00 0.00 C ATOM 0 H PHE A 45 0.395 -4.541 -0.608 1.00 0.00 H new ATOM 0 HA PHE A 45 0.281 -1.962 -2.060 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -1.911 -3.530 -0.657 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -2.064 -1.830 -1.054 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -2.061 -1.114 -3.454 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -2.147 -5.223 -2.334 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -2.825 -1.710 -5.710 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.910 -5.823 -4.591 1.00 0.00 H new ATOM 0 HZ PHE A 45 -3.248 -4.067 -6.285 1.00 0.00 H new ATOM 667 N PHE A 46 0.455 -0.616 0.047 1.00 0.00 N ATOM 668 CA PHE A 46 0.799 0.140 1.246 1.00 0.00 C ATOM 669 C PHE A 46 -0.222 1.245 1.503 1.00 0.00 C ATOM 670 O PHE A 46 -0.299 2.219 0.753 1.00 0.00 O ATOM 671 CB PHE A 46 2.198 0.743 1.110 1.00 0.00 C ATOM 672 CG PHE A 46 3.304 -0.251 1.319 1.00 0.00 C ATOM 673 CD1 PHE A 46 3.427 -1.353 0.488 1.00 0.00 C ATOM 674 CD2 PHE A 46 4.219 -0.084 2.346 1.00 0.00 C ATOM 675 CE1 PHE A 46 4.444 -2.270 0.678 1.00 0.00 C ATOM 676 CE2 PHE A 46 5.237 -0.997 2.540 1.00 0.00 C ATOM 677 CZ PHE A 46 5.350 -2.092 1.705 1.00 0.00 C ATOM 0 H PHE A 46 0.357 -0.049 -0.795 1.00 0.00 H new ATOM 0 HA PHE A 46 0.788 -0.545 2.094 1.00 0.00 H new ATOM 0 HB2 PHE A 46 2.300 1.184 0.118 1.00 0.00 H new ATOM 0 HB3 PHE A 46 2.307 1.553 1.832 1.00 0.00 H new ATOM 0 HD1 PHE A 46 2.721 -1.497 -0.317 1.00 0.00 H new ATOM 0 HD2 PHE A 46 4.135 0.770 3.002 1.00 0.00 H new ATOM 0 HE1 PHE A 46 4.530 -3.125 0.024 1.00 0.00 H new ATOM 0 HE2 PHE A 46 5.944 -0.855 3.344 1.00 0.00 H new ATOM 0 HZ PHE A 46 6.145 -2.807 1.855 1.00 0.00 H new ATOM 687 N GLY A 47 -1.001 1.086 2.567 1.00 0.00 N ATOM 688 CA GLY A 47 -2.006 2.079 2.905 1.00 0.00 C ATOM 689 C GLY A 47 -1.404 3.322 3.530 1.00 0.00 C ATOM 690 O GLY A 47 -0.797 3.256 4.599 1.00 0.00 O ATOM 0 H GLY A 47 -0.955 0.289 3.201 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -2.555 2.357 2.005 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.727 1.641 3.595 1.00 0.00 H new ATOM 694 N VAL A 48 -1.572 4.459 2.861 1.00 0.00 N ATOM 695 CA VAL A 48 -1.040 5.722 3.356 1.00 0.00 C ATOM 696 C VAL A 48 -2.108 6.811 3.344 1.00 0.00 C ATOM 697 O VAL A 48 -2.749 7.054 2.322 1.00 0.00 O ATOM 698 CB VAL A 48 0.163 6.191 2.518 1.00 0.00 C ATOM 699 CG1 VAL A 48 0.830 7.395 3.167 1.00 0.00 C ATOM 700 CG2 VAL A 48 1.159 5.057 2.334 1.00 0.00 C ATOM 0 H VAL A 48 -2.072 4.530 1.975 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.714 5.547 4.381 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.198 6.491 1.534 1.00 0.00 H new ATOM 0 HG11 VAL A 48 1.678 7.712 2.560 1.00 0.00 H new ATOM 0 HG12 VAL A 48 0.112 8.212 3.242 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.178 7.125 4.164 1.00 0.00 H new ATOM 0 HG21 VAL A 48 2.003 5.407 1.739 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.515 4.724 3.309 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.674 4.226 1.822 1.00 0.00 H new ATOM 710 N GLU A 49 -2.295 7.462 4.488 1.00 0.00 N ATOM 711 CA GLU A 49 -3.285 8.526 4.609 1.00 0.00 C ATOM 712 C GLU A 49 -2.714 9.858 4.132 1.00 0.00 C ATOM 713 O GLU A 49 -1.736 10.359 4.687 1.00 0.00 O ATOM 714 CB GLU A 49 -3.754 8.649 6.060 1.00 0.00 C ATOM 715 CG GLU A 49 -4.930 9.595 6.241 1.00 0.00 C ATOM 716 CD GLU A 49 -5.139 9.996 7.688 1.00 0.00 C ATOM 717 OE1 GLU A 49 -4.346 10.815 8.198 1.00 0.00 O ATOM 718 OE2 GLU A 49 -6.096 9.490 8.311 1.00 0.00 O ATOM 0 H GLU A 49 -1.774 7.271 5.344 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.137 8.271 3.978 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -4.033 7.662 6.428 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -2.922 8.995 6.674 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -4.768 10.490 5.640 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -5.836 9.119 5.865 1.00 0.00 H new ATOM 725 N LEU A 50 -3.331 10.424 3.101 1.00 0.00 N ATOM 726 CA LEU A 50 -2.885 11.697 2.548 1.00 0.00 C ATOM 727 C LEU A 50 -2.917 12.796 3.605 1.00 0.00 C ATOM 728 O LEU A 50 -3.849 12.874 4.407 1.00 0.00 O ATOM 729 CB LEU A 50 -3.762 12.094 1.358 1.00 0.00 C ATOM 730 CG LEU A 50 -3.750 11.109 0.188 1.00 0.00 C ATOM 731 CD1 LEU A 50 -4.993 11.285 -0.670 1.00 0.00 C ATOM 732 CD2 LEU A 50 -2.492 11.290 -0.648 1.00 0.00 C ATOM 0 H LEU A 50 -4.142 10.021 2.631 1.00 0.00 H new ATOM 0 HA LEU A 50 -1.856 11.575 2.211 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.789 12.209 1.705 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.437 13.069 0.996 1.00 0.00 H new ATOM 0 HG LEU A 50 -3.752 10.096 0.590 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.967 10.576 -1.498 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -5.881 11.104 -0.065 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -5.023 12.301 -1.064 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.500 10.581 -1.476 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.459 12.306 -1.041 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.614 11.113 -0.027 1.00 0.00 H new ATOM 744 N LEU A 51 -1.892 13.643 3.601 1.00 0.00 N ATOM 745 CA LEU A 51 -1.801 14.739 4.559 1.00 0.00 C ATOM 746 C LEU A 51 -2.587 15.953 4.071 1.00 0.00 C ATOM 747 O LEU A 51 -3.192 15.924 3.000 1.00 0.00 O ATOM 748 CB LEU A 51 -0.337 15.120 4.793 1.00 0.00 C ATOM 749 CG LEU A 51 0.200 14.792 6.190 1.00 0.00 C ATOM 750 CD1 LEU A 51 1.354 13.803 6.103 1.00 0.00 C ATOM 751 CD2 LEU A 51 0.639 16.061 6.908 1.00 0.00 C ATOM 0 H LEU A 51 -1.113 13.591 2.945 1.00 0.00 H new ATOM 0 HA LEU A 51 -2.235 14.404 5.501 1.00 0.00 H new ATOM 0 HB2 LEU A 51 0.279 14.608 4.054 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -0.223 16.190 4.618 1.00 0.00 H new ATOM 0 HG LEU A 51 -0.604 14.332 6.765 1.00 0.00 H new ATOM 0 HD11 LEU A 51 1.721 13.583 7.105 1.00 0.00 H new ATOM 0 HD12 LEU A 51 1.009 12.882 5.633 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.159 14.235 5.508 1.00 0.00 H new ATOM 0 HD21 LEU A 51 1.017 15.807 7.898 1.00 0.00 H new ATOM 0 HD22 LEU A 51 1.426 16.550 6.334 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -0.211 16.736 7.007 1.00 0.00 H new ATOM 763 N GLU A 52 -2.573 17.020 4.866 1.00 0.00 N ATOM 764 CA GLU A 52 -3.284 18.247 4.518 1.00 0.00 C ATOM 765 C GLU A 52 -2.939 18.702 3.102 1.00 0.00 C ATOM 766 O GLU A 52 -3.750 19.340 2.430 1.00 0.00 O ATOM 767 CB GLU A 52 -2.945 19.356 5.516 1.00 0.00 C ATOM 768 CG GLU A 52 -1.451 19.580 5.692 1.00 0.00 C ATOM 769 CD GLU A 52 -1.071 21.046 5.643 1.00 0.00 C ATOM 770 OE1 GLU A 52 -1.326 21.691 4.603 1.00 0.00 O ATOM 771 OE2 GLU A 52 -0.519 21.552 6.643 1.00 0.00 O ATOM 0 H GLU A 52 -2.077 17.060 5.756 1.00 0.00 H new ATOM 0 HA GLU A 52 -4.353 18.038 4.560 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -3.407 20.286 5.184 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -3.384 19.110 6.483 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -1.134 19.158 6.646 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -0.913 19.043 4.911 1.00 0.00 H new ATOM 778 N GLU A 53 -1.733 18.368 2.654 1.00 0.00 N ATOM 779 CA GLU A 53 -1.284 18.742 1.318 1.00 0.00 C ATOM 780 C GLU A 53 -2.199 18.149 0.252 1.00 0.00 C ATOM 781 O GLU A 53 -2.830 18.877 -0.514 1.00 0.00 O ATOM 782 CB GLU A 53 0.155 18.272 1.091 1.00 0.00 C ATOM 783 CG GLU A 53 0.867 19.014 -0.029 1.00 0.00 C ATOM 784 CD GLU A 53 1.869 20.028 0.489 1.00 0.00 C ATOM 785 OE1 GLU A 53 1.438 21.108 0.942 1.00 0.00 O ATOM 786 OE2 GLU A 53 3.083 19.740 0.441 1.00 0.00 O ATOM 0 H GLU A 53 -1.050 17.839 3.196 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.321 19.829 1.239 1.00 0.00 H new ATOM 0 HB2 GLU A 53 0.719 18.397 2.015 1.00 0.00 H new ATOM 0 HB3 GLU A 53 0.149 17.206 0.863 1.00 0.00 H new ATOM 0 HG2 GLU A 53 1.380 18.295 -0.668 1.00 0.00 H new ATOM 0 HG3 GLU A 53 0.129 19.522 -0.650 1.00 0.00 H new ATOM 793 N GLY A 54 -2.267 16.821 0.209 1.00 0.00 N ATOM 794 CA GLY A 54 -3.108 16.153 -0.765 1.00 0.00 C ATOM 795 C GLY A 54 -4.330 15.514 -0.134 1.00 0.00 C ATOM 796 O GLY A 54 -4.843 14.512 -0.634 1.00 0.00 O ATOM 0 H GLY A 54 -1.754 16.197 0.832 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -3.427 16.872 -1.520 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -2.526 15.388 -1.279 1.00 0.00 H new ATOM 800 N ARG A 55 -4.794 16.093 0.968 1.00 0.00 N ATOM 801 CA ARG A 55 -5.962 15.574 1.670 1.00 0.00 C ATOM 802 C ARG A 55 -7.212 15.687 0.805 1.00 0.00 C ATOM 803 O ARG A 55 -7.541 16.765 0.308 1.00 0.00 O ATOM 804 CB ARG A 55 -6.166 16.328 2.987 1.00 0.00 C ATOM 805 CG ARG A 55 -6.363 15.414 4.186 1.00 0.00 C ATOM 806 CD ARG A 55 -5.736 15.998 5.442 1.00 0.00 C ATOM 807 NE ARG A 55 -6.344 15.465 6.658 1.00 0.00 N ATOM 808 CZ ARG A 55 -5.809 15.588 7.870 1.00 0.00 C ATOM 809 NH1 ARG A 55 -4.656 16.226 8.033 1.00 0.00 N ATOM 810 NH2 ARG A 55 -6.428 15.073 8.923 1.00 0.00 N ATOM 0 H ARG A 55 -4.379 16.922 1.394 1.00 0.00 H new ATOM 0 HA ARG A 55 -5.788 14.520 1.886 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -5.303 16.969 3.167 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -7.033 16.981 2.892 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -7.428 15.253 4.351 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -5.922 14.439 3.978 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -4.667 15.783 5.447 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -5.843 17.083 5.429 1.00 0.00 H new ATOM 0 HE ARG A 55 -7.231 14.969 6.573 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -4.176 16.625 7.227 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -4.251 16.317 8.965 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -7.314 14.582 8.804 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -6.018 15.167 9.852 1.00 0.00 H new ATOM 824 N GLY A 56 -7.906 14.567 0.628 1.00 0.00 N ATOM 825 CA GLY A 56 -9.113 14.563 -0.179 1.00 0.00 C ATOM 826 C GLY A 56 -8.871 14.040 -1.582 1.00 0.00 C ATOM 827 O GLY A 56 -9.469 14.523 -2.543 1.00 0.00 O ATOM 0 H GLY A 56 -7.655 13.663 1.028 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -9.870 13.949 0.309 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -9.512 15.576 -0.236 1.00 0.00 H new ATOM 831 N GLN A 57 -7.994 13.049 -1.699 1.00 0.00 N ATOM 832 CA GLN A 57 -7.674 12.460 -2.994 1.00 0.00 C ATOM 833 C GLN A 57 -7.504 10.949 -2.878 1.00 0.00 C ATOM 834 O GLN A 57 -6.706 10.347 -3.596 1.00 0.00 O ATOM 835 CB GLN A 57 -6.400 13.087 -3.563 1.00 0.00 C ATOM 836 CG GLN A 57 -6.491 14.594 -3.741 1.00 0.00 C ATOM 837 CD GLN A 57 -6.062 15.047 -5.123 1.00 0.00 C ATOM 838 OE1 GLN A 57 -5.137 14.487 -5.713 1.00 0.00 O ATOM 839 NE2 GLN A 57 -6.734 16.065 -5.647 1.00 0.00 N ATOM 0 H GLN A 57 -7.492 12.637 -0.913 1.00 0.00 H new ATOM 0 HA GLN A 57 -8.503 12.663 -3.672 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -5.565 12.857 -2.901 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -6.178 12.628 -4.527 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -7.516 14.916 -3.560 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -5.867 15.082 -2.993 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -7.493 16.499 -5.122 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -6.491 16.413 -6.574 1.00 0.00 H new ATOM 848 N GLY A 58 -8.258 10.342 -1.967 1.00 0.00 N ATOM 849 CA GLY A 58 -8.175 8.906 -1.773 1.00 0.00 C ATOM 850 C GLY A 58 -9.189 8.148 -2.609 1.00 0.00 C ATOM 851 O GLY A 58 -10.264 8.666 -2.913 1.00 0.00 O ATOM 0 H GLY A 58 -8.925 10.819 -1.360 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -7.171 8.565 -2.028 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -8.332 8.675 -0.719 1.00 0.00 H new ATOM 855 N PHE A 59 -8.844 6.921 -2.984 1.00 0.00 N ATOM 856 CA PHE A 59 -9.732 6.091 -3.790 1.00 0.00 C ATOM 857 C PHE A 59 -10.282 4.927 -2.972 1.00 0.00 C ATOM 858 O PHE A 59 -11.419 4.498 -3.173 1.00 0.00 O ATOM 859 CB PHE A 59 -8.991 5.560 -5.019 1.00 0.00 C ATOM 860 CG PHE A 59 -7.776 4.743 -4.681 1.00 0.00 C ATOM 861 CD1 PHE A 59 -6.554 5.355 -4.459 1.00 0.00 C ATOM 862 CD2 PHE A 59 -7.858 3.363 -4.587 1.00 0.00 C ATOM 863 CE1 PHE A 59 -5.435 4.606 -4.148 1.00 0.00 C ATOM 864 CE2 PHE A 59 -6.743 2.608 -4.277 1.00 0.00 C ATOM 865 CZ PHE A 59 -5.529 3.231 -4.058 1.00 0.00 C ATOM 0 H PHE A 59 -7.957 6.479 -2.743 1.00 0.00 H new ATOM 0 HA PHE A 59 -10.569 6.709 -4.116 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -9.675 4.951 -5.611 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -8.691 6.401 -5.644 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -6.474 6.430 -4.530 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -8.804 2.872 -4.758 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -4.488 5.095 -3.975 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -6.820 1.533 -4.206 1.00 0.00 H new ATOM 0 HZ PHE A 59 -4.655 2.644 -3.817 1.00 0.00 H new ATOM 875 N THR A 60 -9.471 4.422 -2.050 1.00 0.00 N ATOM 876 CA THR A 60 -9.877 3.308 -1.203 1.00 0.00 C ATOM 877 C THR A 60 -10.691 3.799 -0.009 1.00 0.00 C ATOM 878 O THR A 60 -11.722 3.220 0.333 1.00 0.00 O ATOM 879 CB THR A 60 -8.652 2.531 -0.716 1.00 0.00 C ATOM 880 OG1 THR A 60 -9.037 1.473 0.143 1.00 0.00 O ATOM 881 CG2 THR A 60 -7.654 3.388 0.033 1.00 0.00 C ATOM 0 H THR A 60 -8.528 4.767 -1.870 1.00 0.00 H new ATOM 0 HA THR A 60 -10.503 2.644 -1.799 1.00 0.00 H new ATOM 0 HB THR A 60 -8.175 2.154 -1.620 1.00 0.00 H new ATOM 0 HG1 THR A 60 -8.240 0.988 0.442 1.00 0.00 H new ATOM 0 HG21 THR A 60 -6.811 2.773 0.349 1.00 0.00 H new ATOM 0 HG22 THR A 60 -7.297 4.185 -0.619 1.00 0.00 H new ATOM 0 HG23 THR A 60 -8.134 3.824 0.909 1.00 0.00 H new ATOM 889 N ASP A 61 -10.223 4.873 0.619 1.00 0.00 N ATOM 890 CA ASP A 61 -10.907 5.446 1.774 1.00 0.00 C ATOM 891 C ASP A 61 -11.118 4.397 2.863 1.00 0.00 C ATOM 892 O ASP A 61 -12.085 4.461 3.622 1.00 0.00 O ATOM 893 CB ASP A 61 -12.253 6.037 1.353 1.00 0.00 C ATOM 894 CG ASP A 61 -12.872 6.898 2.437 1.00 0.00 C ATOM 895 OD1 ASP A 61 -12.111 7.539 3.192 1.00 0.00 O ATOM 896 OD2 ASP A 61 -14.117 6.931 2.530 1.00 0.00 O ATOM 0 H ASP A 61 -9.372 5.365 0.347 1.00 0.00 H new ATOM 0 HA ASP A 61 -10.278 6.239 2.178 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -12.118 6.634 0.451 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -12.938 5.228 1.100 1.00 0.00 H new ATOM 901 N GLY A 62 -10.207 3.432 2.933 1.00 0.00 N ATOM 902 CA GLY A 62 -10.313 2.383 3.931 1.00 0.00 C ATOM 903 C GLY A 62 -10.970 1.130 3.386 1.00 0.00 C ATOM 904 O GLY A 62 -10.704 0.025 3.861 1.00 0.00 O ATOM 0 H GLY A 62 -9.398 3.357 2.317 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -9.318 2.136 4.302 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -10.888 2.751 4.781 1.00 0.00 H new ATOM 908 N VAL A 63 -11.832 1.301 2.389 1.00 0.00 N ATOM 909 CA VAL A 63 -12.529 0.175 1.779 1.00 0.00 C ATOM 910 C VAL A 63 -12.115 -0.003 0.321 1.00 0.00 C ATOM 911 O VAL A 63 -12.243 0.918 -0.487 1.00 0.00 O ATOM 912 CB VAL A 63 -14.059 0.355 1.854 1.00 0.00 C ATOM 913 CG1 VAL A 63 -14.490 1.602 1.096 1.00 0.00 C ATOM 914 CG2 VAL A 63 -14.771 -0.878 1.318 1.00 0.00 C ATOM 0 H VAL A 63 -12.064 2.209 1.986 1.00 0.00 H new ATOM 0 HA VAL A 63 -12.249 -0.715 2.342 1.00 0.00 H new ATOM 0 HB VAL A 63 -14.339 0.480 2.900 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -15.573 1.711 1.161 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -14.010 2.478 1.533 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -14.196 1.512 0.050 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -15.849 -0.731 1.380 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -14.486 -1.040 0.279 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -14.489 -1.748 1.911 1.00 0.00 H new ATOM 924 N TYR A 64 -11.618 -1.190 -0.008 1.00 0.00 N ATOM 925 CA TYR A 64 -11.185 -1.487 -1.368 1.00 0.00 C ATOM 926 C TYR A 64 -12.155 -2.445 -2.052 1.00 0.00 C ATOM 927 O TYR A 64 -12.286 -3.602 -1.651 1.00 0.00 O ATOM 928 CB TYR A 64 -9.778 -2.087 -1.358 1.00 0.00 C ATOM 929 CG TYR A 64 -9.161 -2.206 -2.733 1.00 0.00 C ATOM 930 CD1 TYR A 64 -9.564 -3.205 -3.612 1.00 0.00 C ATOM 931 CD2 TYR A 64 -8.177 -1.320 -3.154 1.00 0.00 C ATOM 932 CE1 TYR A 64 -9.002 -3.317 -4.870 1.00 0.00 C ATOM 933 CE2 TYR A 64 -7.611 -1.426 -4.410 1.00 0.00 C ATOM 934 CZ TYR A 64 -8.026 -2.426 -5.263 1.00 0.00 C ATOM 935 OH TYR A 64 -7.465 -2.535 -6.516 1.00 0.00 O ATOM 0 H TYR A 64 -11.505 -1.962 0.649 1.00 0.00 H new ATOM 0 HA TYR A 64 -11.170 -0.553 -1.930 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -9.133 -1.470 -0.732 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -9.817 -3.075 -0.900 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -10.328 -3.905 -3.307 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -7.849 -0.535 -2.488 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -9.326 -4.098 -5.542 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -6.847 -0.729 -4.722 1.00 0.00 H new ATOM 0 HH TYR A 64 -6.794 -1.831 -6.637 1.00 0.00 H new ATOM 945 N GLN A 65 -12.831 -1.957 -3.086 1.00 0.00 N ATOM 946 CA GLN A 65 -13.788 -2.769 -3.828 1.00 0.00 C ATOM 947 C GLN A 65 -14.905 -3.271 -2.916 1.00 0.00 C ATOM 948 O GLN A 65 -15.517 -4.306 -3.181 1.00 0.00 O ATOM 949 CB GLN A 65 -13.080 -3.955 -4.486 1.00 0.00 C ATOM 950 CG GLN A 65 -12.554 -3.653 -5.879 1.00 0.00 C ATOM 951 CD GLN A 65 -11.951 -4.871 -6.551 1.00 0.00 C ATOM 952 OE1 GLN A 65 -11.570 -5.836 -5.888 1.00 0.00 O ATOM 953 NE2 GLN A 65 -11.862 -4.832 -7.876 1.00 0.00 N ATOM 0 H GLN A 65 -12.734 -1.002 -3.430 1.00 0.00 H new ATOM 0 HA GLN A 65 -14.232 -2.143 -4.602 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -12.250 -4.268 -3.853 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -13.772 -4.795 -4.542 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -13.367 -3.268 -6.495 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -11.801 -2.867 -5.817 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -12.190 -4.011 -8.385 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -11.465 -5.623 -8.384 1.00 0.00 H new ATOM 962 N GLY A 66 -15.165 -2.532 -1.842 1.00 0.00 N ATOM 963 CA GLY A 66 -16.208 -2.923 -0.911 1.00 0.00 C ATOM 964 C GLY A 66 -15.684 -3.778 0.225 1.00 0.00 C ATOM 965 O GLY A 66 -16.430 -4.554 0.821 1.00 0.00 O ATOM 0 H GLY A 66 -14.674 -1.672 -1.600 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -16.678 -2.029 -0.501 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -16.982 -3.472 -1.447 1.00 0.00 H new ATOM 969 N LYS A 67 -14.396 -3.636 0.526 1.00 0.00 N ATOM 970 CA LYS A 67 -13.776 -4.402 1.599 1.00 0.00 C ATOM 971 C LYS A 67 -12.913 -3.504 2.480 1.00 0.00 C ATOM 972 O LYS A 67 -11.859 -3.029 2.057 1.00 0.00 O ATOM 973 CB LYS A 67 -12.926 -5.535 1.019 1.00 0.00 C ATOM 974 CG LYS A 67 -12.576 -6.612 2.034 1.00 0.00 C ATOM 975 CD LYS A 67 -12.673 -8.002 1.428 1.00 0.00 C ATOM 976 CE LYS A 67 -11.714 -8.971 2.099 1.00 0.00 C ATOM 977 NZ LYS A 67 -11.957 -10.377 1.676 1.00 0.00 N ATOM 0 H LYS A 67 -13.764 -2.998 0.042 1.00 0.00 H new ATOM 0 HA LYS A 67 -14.569 -4.829 2.213 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -13.462 -5.992 0.187 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -12.005 -5.116 0.613 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -11.565 -6.447 2.407 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -13.248 -6.539 2.889 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -13.694 -8.372 1.526 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -12.453 -7.951 0.362 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -10.688 -8.692 1.858 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -11.819 -8.894 3.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -11.282 -11.006 2.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -12.927 -10.653 1.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -11.832 -10.456 0.647 1.00 0.00 H new ATOM 991 N GLN A 68 -13.370 -3.275 3.706 1.00 0.00 N ATOM 992 CA GLN A 68 -12.643 -2.434 4.649 1.00 0.00 C ATOM 993 C GLN A 68 -11.330 -3.091 5.063 1.00 0.00 C ATOM 994 O GLN A 68 -11.321 -4.198 5.600 1.00 0.00 O ATOM 995 CB GLN A 68 -13.500 -2.157 5.885 1.00 0.00 C ATOM 996 CG GLN A 68 -13.134 -0.869 6.603 1.00 0.00 C ATOM 997 CD GLN A 68 -13.991 0.305 6.169 1.00 0.00 C ATOM 998 OE1 GLN A 68 -15.202 0.172 5.994 1.00 0.00 O ATOM 999 NE2 GLN A 68 -13.364 1.462 5.993 1.00 0.00 N ATOM 0 H GLN A 68 -14.241 -3.660 4.070 1.00 0.00 H new ATOM 0 HA GLN A 68 -12.416 -1.489 4.154 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -14.548 -2.112 5.588 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -13.401 -2.991 6.580 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -13.240 -1.014 7.678 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -12.086 -0.638 6.415 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -12.358 1.526 6.150 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -13.888 2.287 5.701 1.00 0.00 H new ATOM 1008 N LEU A 69 -10.223 -2.400 4.811 1.00 0.00 N ATOM 1009 CA LEU A 69 -8.903 -2.917 5.159 1.00 0.00 C ATOM 1010 C LEU A 69 -8.307 -2.142 6.329 1.00 0.00 C ATOM 1011 O LEU A 69 -7.568 -2.699 7.142 1.00 0.00 O ATOM 1012 CB LEU A 69 -7.968 -2.838 3.951 1.00 0.00 C ATOM 1013 CG LEU A 69 -8.386 -3.691 2.751 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -7.412 -3.505 1.598 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -8.473 -5.158 3.146 1.00 0.00 C ATOM 0 H LEU A 69 -10.213 -1.481 4.368 1.00 0.00 H new ATOM 0 HA LEU A 69 -9.015 -3.960 5.456 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -7.899 -1.798 3.632 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -6.969 -3.142 4.263 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.372 -3.364 2.422 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.726 -4.119 0.754 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.398 -2.457 1.299 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -6.413 -3.805 1.914 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -8.771 -5.751 2.281 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -7.500 -5.498 3.500 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.210 -5.278 3.940 1.00 0.00 H new ATOM 1027 N PHE A 70 -8.633 -0.856 6.409 1.00 0.00 N ATOM 1028 CA PHE A 70 -8.128 -0.005 7.481 1.00 0.00 C ATOM 1029 C PHE A 70 -9.043 1.196 7.697 1.00 0.00 C ATOM 1030 O PHE A 70 -9.953 1.446 6.907 1.00 0.00 O ATOM 1031 CB PHE A 70 -6.709 0.468 7.161 1.00 0.00 C ATOM 1032 CG PHE A 70 -6.630 1.376 5.966 1.00 0.00 C ATOM 1033 CD1 PHE A 70 -7.010 0.926 4.712 1.00 0.00 C ATOM 1034 CD2 PHE A 70 -6.178 2.678 6.099 1.00 0.00 C ATOM 1035 CE1 PHE A 70 -6.939 1.759 3.612 1.00 0.00 C ATOM 1036 CE2 PHE A 70 -6.104 3.516 5.002 1.00 0.00 C ATOM 1037 CZ PHE A 70 -6.486 3.056 3.757 1.00 0.00 C ATOM 0 H PHE A 70 -9.244 -0.380 5.745 1.00 0.00 H new ATOM 0 HA PHE A 70 -8.107 -0.592 8.399 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -6.305 0.989 8.029 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.076 -0.402 6.988 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -7.366 -0.087 4.593 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -5.880 3.043 7.071 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -7.237 1.396 2.639 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -5.748 4.529 5.118 1.00 0.00 H new ATOM 0 HZ PHE A 70 -6.431 3.709 2.899 1.00 0.00 H new ATOM 1047 N GLN A 71 -8.795 1.936 8.773 1.00 0.00 N ATOM 1048 CA GLN A 71 -9.597 3.112 9.094 1.00 0.00 C ATOM 1049 C GLN A 71 -8.835 4.393 8.768 1.00 0.00 C ATOM 1050 O GLN A 71 -7.789 4.671 9.354 1.00 0.00 O ATOM 1051 CB GLN A 71 -9.994 3.097 10.572 1.00 0.00 C ATOM 1052 CG GLN A 71 -11.467 2.805 10.803 1.00 0.00 C ATOM 1053 CD GLN A 71 -12.258 4.048 11.163 1.00 0.00 C ATOM 1054 OE1 GLN A 71 -12.375 4.406 12.334 1.00 0.00 O ATOM 1055 NE2 GLN A 71 -12.806 4.714 10.152 1.00 0.00 N ATOM 0 H GLN A 71 -8.046 1.743 9.437 1.00 0.00 H new ATOM 0 HA GLN A 71 -10.501 3.085 8.485 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -9.398 2.347 11.092 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -9.750 4.062 11.015 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -11.890 2.357 9.904 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -11.567 2.071 11.602 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -12.683 4.381 9.196 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -13.349 5.558 10.332 1.00 0.00 H new ATOM 1064 N CYS A 72 -9.368 5.170 7.831 1.00 0.00 N ATOM 1065 CA CYS A 72 -8.739 6.422 7.428 1.00 0.00 C ATOM 1066 C CYS A 72 -9.785 7.511 7.212 1.00 0.00 C ATOM 1067 O CYS A 72 -10.988 7.256 7.294 1.00 0.00 O ATOM 1068 CB CYS A 72 -7.926 6.220 6.148 1.00 0.00 C ATOM 1069 SG CYS A 72 -8.799 5.304 4.856 1.00 0.00 S ATOM 0 H CYS A 72 -10.234 4.955 7.337 1.00 0.00 H new ATOM 0 HA CYS A 72 -8.071 6.738 8.229 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -7.638 7.195 5.756 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -7.005 5.691 6.395 1.00 0.00 H new ATOM 0 HG CYS A 72 -8.077 4.291 4.479 1.00 0.00 H new ATOM 1075 N ASP A 73 -9.321 8.725 6.935 1.00 0.00 N ATOM 1076 CA ASP A 73 -10.218 9.853 6.708 1.00 0.00 C ATOM 1077 C ASP A 73 -10.879 9.753 5.337 1.00 0.00 C ATOM 1078 O ASP A 73 -10.505 8.916 4.516 1.00 0.00 O ATOM 1079 CB ASP A 73 -9.453 11.172 6.824 1.00 0.00 C ATOM 1080 CG ASP A 73 -9.495 11.743 8.228 1.00 0.00 C ATOM 1081 OD1 ASP A 73 -10.561 12.255 8.628 1.00 0.00 O ATOM 1082 OD2 ASP A 73 -8.462 11.678 8.927 1.00 0.00 O ATOM 0 H ASP A 73 -8.330 8.953 6.862 1.00 0.00 H new ATOM 0 HA ASP A 73 -10.997 9.826 7.470 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -8.415 11.014 6.530 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -9.875 11.896 6.127 1.00 0.00 H new ATOM 1087 N GLU A 74 -11.863 10.614 5.097 1.00 0.00 N ATOM 1088 CA GLU A 74 -12.577 10.623 3.825 1.00 0.00 C ATOM 1089 C GLU A 74 -11.659 11.059 2.688 1.00 0.00 C ATOM 1090 O GLU A 74 -11.173 12.190 2.668 1.00 0.00 O ATOM 1091 CB GLU A 74 -13.789 11.554 3.903 1.00 0.00 C ATOM 1092 CG GLU A 74 -14.799 11.333 2.789 1.00 0.00 C ATOM 1093 CD GLU A 74 -16.229 11.524 3.254 1.00 0.00 C ATOM 1094 OE1 GLU A 74 -16.629 10.861 4.233 1.00 0.00 O ATOM 1095 OE2 GLU A 74 -16.949 12.338 2.638 1.00 0.00 O ATOM 0 H GLU A 74 -12.184 11.314 5.766 1.00 0.00 H new ATOM 0 HA GLU A 74 -12.919 9.608 3.622 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -14.284 11.413 4.864 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -13.445 12.588 3.870 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -14.591 12.024 1.972 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -14.681 10.325 2.391 1.00 0.00 H new ATOM 1102 N ASP A 75 -11.426 10.153 1.742 1.00 0.00 N ATOM 1103 CA ASP A 75 -10.567 10.445 0.601 1.00 0.00 C ATOM 1104 C ASP A 75 -9.151 10.784 1.058 1.00 0.00 C ATOM 1105 O ASP A 75 -8.550 11.752 0.592 1.00 0.00 O ATOM 1106 CB ASP A 75 -11.145 11.602 -0.216 1.00 0.00 C ATOM 1107 CG ASP A 75 -12.228 11.149 -1.174 1.00 0.00 C ATOM 1108 OD1 ASP A 75 -11.885 10.666 -2.274 1.00 0.00 O ATOM 1109 OD2 ASP A 75 -13.421 11.277 -0.826 1.00 0.00 O ATOM 0 H ASP A 75 -11.820 9.212 1.744 1.00 0.00 H new ATOM 0 HA ASP A 75 -10.522 9.555 -0.026 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -11.553 12.353 0.461 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -10.344 12.082 -0.778 1.00 0.00 H new ATOM 1114 N CYS A 76 -8.621 9.978 1.972 1.00 0.00 N ATOM 1115 CA CYS A 76 -7.275 10.190 2.494 1.00 0.00 C ATOM 1116 C CYS A 76 -6.425 8.933 2.334 1.00 0.00 C ATOM 1117 O CYS A 76 -5.277 9.001 1.896 1.00 0.00 O ATOM 1118 CB CYS A 76 -7.335 10.596 3.967 1.00 0.00 C ATOM 1119 SG CYS A 76 -7.927 12.281 4.245 1.00 0.00 S ATOM 0 H CYS A 76 -9.103 9.171 2.367 1.00 0.00 H new ATOM 0 HA CYS A 76 -6.813 10.994 1.922 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -7.986 9.901 4.498 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -6.340 10.496 4.401 1.00 0.00 H new ATOM 0 HG CYS A 76 -9.101 12.423 3.705 1.00 0.00 H new ATOM 1125 N GLY A 77 -6.998 7.789 2.693 1.00 0.00 N ATOM 1126 CA GLY A 77 -6.277 6.534 2.582 1.00 0.00 C ATOM 1127 C GLY A 77 -6.041 6.125 1.142 1.00 0.00 C ATOM 1128 O GLY A 77 -6.919 6.282 0.293 1.00 0.00 O ATOM 0 H GLY A 77 -7.947 7.708 3.058 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -5.318 6.623 3.093 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -6.838 5.750 3.092 1.00 0.00 H new ATOM 1132 N VAL A 78 -4.852 5.600 0.865 1.00 0.00 N ATOM 1133 CA VAL A 78 -4.501 5.168 -0.481 1.00 0.00 C ATOM 1134 C VAL A 78 -3.500 4.019 -0.447 1.00 0.00 C ATOM 1135 O VAL A 78 -2.491 4.083 0.255 1.00 0.00 O ATOM 1136 CB VAL A 78 -3.908 6.326 -1.306 1.00 0.00 C ATOM 1137 CG1 VAL A 78 -4.999 7.301 -1.721 1.00 0.00 C ATOM 1138 CG2 VAL A 78 -2.817 7.036 -0.520 1.00 0.00 C ATOM 0 H VAL A 78 -4.115 5.464 1.557 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.423 4.829 -0.954 1.00 0.00 H new ATOM 0 HB VAL A 78 -3.462 5.913 -2.210 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -4.560 8.112 -2.303 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -5.741 6.780 -2.326 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -5.478 7.711 -0.832 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -2.409 7.851 -1.118 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.236 7.437 0.403 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.023 6.329 -0.280 1.00 0.00 H new ATOM 1148 N PHE A 79 -3.785 2.970 -1.211 1.00 0.00 N ATOM 1149 CA PHE A 79 -2.908 1.805 -1.267 1.00 0.00 C ATOM 1150 C PHE A 79 -2.029 1.847 -2.513 1.00 0.00 C ATOM 1151 O PHE A 79 -2.528 1.862 -3.638 1.00 0.00 O ATOM 1152 CB PHE A 79 -3.734 0.517 -1.255 1.00 0.00 C ATOM 1153 CG PHE A 79 -4.067 0.031 0.126 1.00 0.00 C ATOM 1154 CD1 PHE A 79 -3.062 -0.339 1.005 1.00 0.00 C ATOM 1155 CD2 PHE A 79 -5.385 -0.055 0.547 1.00 0.00 C ATOM 1156 CE1 PHE A 79 -3.365 -0.787 2.278 1.00 0.00 C ATOM 1157 CE2 PHE A 79 -5.694 -0.502 1.817 1.00 0.00 C ATOM 1158 CZ PHE A 79 -4.682 -0.869 2.683 1.00 0.00 C ATOM 0 H PHE A 79 -4.615 2.902 -1.800 1.00 0.00 H new ATOM 0 HA PHE A 79 -2.264 1.823 -0.388 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.660 0.683 -1.806 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -3.185 -0.262 -1.783 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -2.030 -0.277 0.693 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -6.180 0.231 -0.126 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -2.572 -1.072 2.954 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -6.725 -0.564 2.132 1.00 0.00 H new ATOM 0 HZ PHE A 79 -4.921 -1.220 3.676 1.00 0.00 H new ATOM 1168 N VAL A 80 -0.716 1.867 -2.304 1.00 0.00 N ATOM 1169 CA VAL A 80 0.233 1.909 -3.408 1.00 0.00 C ATOM 1170 C VAL A 80 1.460 1.053 -3.111 1.00 0.00 C ATOM 1171 O VAL A 80 1.657 0.604 -1.982 1.00 0.00 O ATOM 1172 CB VAL A 80 0.685 3.350 -3.708 1.00 0.00 C ATOM 1173 CG1 VAL A 80 -0.485 4.187 -4.198 1.00 0.00 C ATOM 1174 CG2 VAL A 80 1.321 3.977 -2.475 1.00 0.00 C ATOM 0 H VAL A 80 -0.286 1.855 -1.379 1.00 0.00 H new ATOM 0 HA VAL A 80 -0.282 1.510 -4.282 1.00 0.00 H new ATOM 0 HB VAL A 80 1.434 3.319 -4.499 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -0.145 5.202 -4.404 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -0.890 3.748 -5.109 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -1.260 4.213 -3.432 1.00 0.00 H new ATOM 0 HG21 VAL A 80 1.635 4.995 -2.705 1.00 0.00 H new ATOM 0 HG22 VAL A 80 0.596 3.996 -1.661 1.00 0.00 H new ATOM 0 HG23 VAL A 80 2.189 3.389 -2.174 1.00 0.00 H new ATOM 1184 N ALA A 81 2.281 0.830 -4.132 1.00 0.00 N ATOM 1185 CA ALA A 81 3.489 0.028 -3.980 1.00 0.00 C ATOM 1186 C ALA A 81 4.628 0.853 -3.389 1.00 0.00 C ATOM 1187 O ALA A 81 4.609 2.083 -3.446 1.00 0.00 O ATOM 1188 CB ALA A 81 3.902 -0.562 -5.319 1.00 0.00 C ATOM 0 H ALA A 81 2.132 1.193 -5.073 1.00 0.00 H new ATOM 0 HA ALA A 81 3.269 -0.785 -3.288 1.00 0.00 H new ATOM 0 HB1 ALA A 81 4.805 -1.158 -5.191 1.00 0.00 H new ATOM 0 HB2 ALA A 81 3.101 -1.195 -5.701 1.00 0.00 H new ATOM 0 HB3 ALA A 81 4.097 0.244 -6.027 1.00 0.00 H new ATOM 1194 N LEU A 82 5.617 0.168 -2.823 1.00 0.00 N ATOM 1195 CA LEU A 82 6.767 0.835 -2.220 1.00 0.00 C ATOM 1196 C LEU A 82 7.365 1.861 -3.178 1.00 0.00 C ATOM 1197 O LEU A 82 7.702 2.976 -2.780 1.00 0.00 O ATOM 1198 CB LEU A 82 7.831 -0.190 -1.826 1.00 0.00 C ATOM 1199 CG LEU A 82 8.979 0.362 -0.979 1.00 0.00 C ATOM 1200 CD1 LEU A 82 8.638 0.282 0.500 1.00 0.00 C ATOM 1201 CD2 LEU A 82 10.268 -0.393 -1.272 1.00 0.00 C ATOM 0 H LEU A 82 5.645 -0.850 -2.769 1.00 0.00 H new ATOM 0 HA LEU A 82 6.424 1.355 -1.325 1.00 0.00 H new ATOM 0 HB2 LEU A 82 7.349 -0.998 -1.275 1.00 0.00 H new ATOM 0 HB3 LEU A 82 8.247 -0.627 -2.734 1.00 0.00 H new ATOM 0 HG LEU A 82 9.127 1.410 -1.240 1.00 0.00 H new ATOM 0 HD11 LEU A 82 9.467 0.679 1.086 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.740 0.867 0.698 1.00 0.00 H new ATOM 0 HD13 LEU A 82 8.463 -0.757 0.777 1.00 0.00 H new ATOM 0 HD21 LEU A 82 11.074 0.013 -0.661 1.00 0.00 H new ATOM 0 HD22 LEU A 82 10.132 -1.449 -1.039 1.00 0.00 H new ATOM 0 HD23 LEU A 82 10.522 -0.284 -2.326 1.00 0.00 H new ATOM 1213 N ASP A 83 7.484 1.478 -4.445 1.00 0.00 N ATOM 1214 CA ASP A 83 8.033 2.365 -5.463 1.00 0.00 C ATOM 1215 C ASP A 83 7.235 3.662 -5.531 1.00 0.00 C ATOM 1216 O ASP A 83 7.765 4.712 -5.898 1.00 0.00 O ATOM 1217 CB ASP A 83 8.030 1.676 -6.829 1.00 0.00 C ATOM 1218 CG ASP A 83 6.658 1.152 -7.209 1.00 0.00 C ATOM 1219 OD1 ASP A 83 5.887 1.909 -7.834 1.00 0.00 O ATOM 1220 OD2 ASP A 83 6.356 -0.014 -6.880 1.00 0.00 O ATOM 0 H ASP A 83 7.207 0.559 -4.791 1.00 0.00 H new ATOM 0 HA ASP A 83 9.061 2.602 -5.191 1.00 0.00 H new ATOM 0 HB2 ASP A 83 8.370 2.380 -7.589 1.00 0.00 H new ATOM 0 HB3 ASP A 83 8.741 0.850 -6.818 1.00 0.00 H new ATOM 1225 N LYS A 84 5.956 3.583 -5.172 1.00 0.00 N ATOM 1226 CA LYS A 84 5.086 4.751 -5.188 1.00 0.00 C ATOM 1227 C LYS A 84 5.275 5.585 -3.923 1.00 0.00 C ATOM 1228 O LYS A 84 5.052 6.795 -3.928 1.00 0.00 O ATOM 1229 CB LYS A 84 3.624 4.322 -5.316 1.00 0.00 C ATOM 1230 CG LYS A 84 3.307 3.623 -6.628 1.00 0.00 C ATOM 1231 CD LYS A 84 2.758 4.597 -7.659 1.00 0.00 C ATOM 1232 CE LYS A 84 1.263 4.810 -7.483 1.00 0.00 C ATOM 1233 NZ LYS A 84 0.471 3.689 -8.058 1.00 0.00 N ATOM 0 H LYS A 84 5.501 2.722 -4.867 1.00 0.00 H new ATOM 0 HA LYS A 84 5.354 5.362 -6.050 1.00 0.00 H new ATOM 0 HB2 LYS A 84 3.376 3.656 -4.490 1.00 0.00 H new ATOM 0 HB3 LYS A 84 2.986 5.201 -5.219 1.00 0.00 H new ATOM 0 HG2 LYS A 84 4.209 3.150 -7.017 1.00 0.00 H new ATOM 0 HG3 LYS A 84 2.581 2.829 -6.453 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.276 5.552 -7.571 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.957 4.218 -8.661 1.00 0.00 H new ATOM 0 HE2 LYS A 84 1.033 4.910 -6.422 1.00 0.00 H new ATOM 0 HE3 LYS A 84 0.971 5.744 -7.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -0.543 3.881 -7.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 0.684 3.598 -9.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 0.719 2.804 -7.572 1.00 0.00 H new ATOM 1247 N LEU A 85 5.687 4.928 -2.843 1.00 0.00 N ATOM 1248 CA LEU A 85 5.907 5.611 -1.572 1.00 0.00 C ATOM 1249 C LEU A 85 7.334 6.140 -1.478 1.00 0.00 C ATOM 1250 O LEU A 85 8.278 5.494 -1.934 1.00 0.00 O ATOM 1251 CB LEU A 85 5.624 4.663 -0.405 1.00 0.00 C ATOM 1252 CG LEU A 85 4.192 4.131 -0.337 1.00 0.00 C ATOM 1253 CD1 LEU A 85 4.030 3.183 0.843 1.00 0.00 C ATOM 1254 CD2 LEU A 85 3.201 5.280 -0.239 1.00 0.00 C ATOM 0 H LEU A 85 5.875 3.926 -2.822 1.00 0.00 H new ATOM 0 HA LEU A 85 5.222 6.457 -1.519 1.00 0.00 H new ATOM 0 HB2 LEU A 85 6.307 3.816 -0.470 1.00 0.00 H new ATOM 0 HB3 LEU A 85 5.848 5.182 0.527 1.00 0.00 H new ATOM 0 HG LEU A 85 3.987 3.577 -1.253 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.005 2.814 0.875 1.00 0.00 H new ATOM 0 HD12 LEU A 85 4.715 2.342 0.731 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.255 3.713 1.769 1.00 0.00 H new ATOM 0 HD21 LEU A 85 2.187 4.883 -0.192 1.00 0.00 H new ATOM 0 HD22 LEU A 85 3.406 5.861 0.660 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.299 5.921 -1.115 1.00 0.00 H new ATOM 1266 N GLU A 86 7.484 7.320 -0.883 1.00 0.00 N ATOM 1267 CA GLU A 86 8.796 7.935 -0.728 1.00 0.00 C ATOM 1268 C GLU A 86 8.988 8.456 0.693 1.00 0.00 C ATOM 1269 O GLU A 86 8.319 9.399 1.115 1.00 0.00 O ATOM 1270 CB GLU A 86 8.967 9.078 -1.730 1.00 0.00 C ATOM 1271 CG GLU A 86 10.375 9.651 -1.766 1.00 0.00 C ATOM 1272 CD GLU A 86 11.251 8.979 -2.804 1.00 0.00 C ATOM 1273 OE1 GLU A 86 11.054 9.240 -4.008 1.00 0.00 O ATOM 1274 OE2 GLU A 86 12.137 8.189 -2.411 1.00 0.00 O ATOM 0 H GLU A 86 6.713 7.868 -0.501 1.00 0.00 H new ATOM 0 HA GLU A 86 9.552 7.174 -0.922 1.00 0.00 H new ATOM 0 HB2 GLU A 86 8.704 8.720 -2.725 1.00 0.00 H new ATOM 0 HB3 GLU A 86 8.266 9.875 -1.482 1.00 0.00 H new ATOM 0 HG2 GLU A 86 10.323 10.719 -1.976 1.00 0.00 H new ATOM 0 HG3 GLU A 86 10.833 9.541 -0.783 1.00 0.00 H new ATOM 1281 N LEU A 87 9.907 7.835 1.426 1.00 0.00 N ATOM 1282 CA LEU A 87 10.187 8.234 2.801 1.00 0.00 C ATOM 1283 C LEU A 87 10.641 9.689 2.863 1.00 0.00 C ATOM 1284 O LEU A 87 11.400 10.150 2.011 1.00 0.00 O ATOM 1285 CB LEU A 87 11.258 7.327 3.409 1.00 0.00 C ATOM 1286 CG LEU A 87 11.255 7.256 4.936 1.00 0.00 C ATOM 1287 CD1 LEU A 87 10.118 6.374 5.428 1.00 0.00 C ATOM 1288 CD2 LEU A 87 12.591 6.740 5.448 1.00 0.00 C ATOM 0 H LEU A 87 10.470 7.054 1.091 1.00 0.00 H new ATOM 0 HA LEU A 87 9.267 8.134 3.377 1.00 0.00 H new ATOM 0 HB2 LEU A 87 11.127 6.320 3.013 1.00 0.00 H new ATOM 0 HB3 LEU A 87 12.237 7.674 3.079 1.00 0.00 H new ATOM 0 HG LEU A 87 11.102 8.262 5.327 1.00 0.00 H new ATOM 0 HD11 LEU A 87 10.132 6.336 6.517 1.00 0.00 H new ATOM 0 HD12 LEU A 87 9.166 6.786 5.092 1.00 0.00 H new ATOM 0 HD13 LEU A 87 10.239 5.367 5.028 1.00 0.00 H new ATOM 0 HD21 LEU A 87 12.571 6.696 6.537 1.00 0.00 H new ATOM 0 HD22 LEU A 87 12.773 5.743 5.048 1.00 0.00 H new ATOM 0 HD23 LEU A 87 13.388 7.411 5.127 1.00 0.00 H new ATOM 1300 N ILE A 88 10.172 10.406 3.879 1.00 0.00 N ATOM 1301 CA ILE A 88 10.531 11.808 4.055 1.00 0.00 C ATOM 1302 C ILE A 88 11.572 11.973 5.157 1.00 0.00 C ATOM 1303 O ILE A 88 11.602 11.202 6.117 1.00 0.00 O ATOM 1304 CB ILE A 88 9.298 12.667 4.396 1.00 0.00 C ATOM 1305 CG1 ILE A 88 8.175 12.413 3.387 1.00 0.00 C ATOM 1306 CG2 ILE A 88 9.668 14.143 4.421 1.00 0.00 C ATOM 1307 CD1 ILE A 88 6.792 12.450 4.000 1.00 0.00 C ATOM 0 H ILE A 88 9.543 10.039 4.593 1.00 0.00 H new ATOM 0 HA ILE A 88 10.949 12.149 3.108 1.00 0.00 H new ATOM 0 HB ILE A 88 8.943 12.384 5.387 1.00 0.00 H new ATOM 0 HG12 ILE A 88 8.233 13.160 2.595 1.00 0.00 H new ATOM 0 HG13 ILE A 88 8.331 11.441 2.920 1.00 0.00 H new ATOM 0 HG21 ILE A 88 8.786 14.735 4.663 1.00 0.00 H new ATOM 0 HG22 ILE A 88 10.437 14.313 5.175 1.00 0.00 H new ATOM 0 HG23 ILE A 88 10.047 14.440 3.443 1.00 0.00 H new ATOM 0 HD11 ILE A 88 6.046 12.262 3.227 1.00 0.00 H new ATOM 0 HD12 ILE A 88 6.716 11.684 4.772 1.00 0.00 H new ATOM 0 HD13 ILE A 88 6.616 13.430 4.443 1.00 0.00 H new ATOM 1319 N GLU A 89 12.424 12.983 5.013 1.00 0.00 N ATOM 1320 CA GLU A 89 13.467 13.249 5.997 1.00 0.00 C ATOM 1321 C GLU A 89 13.328 14.655 6.572 1.00 0.00 C ATOM 1322 O GLU A 89 12.980 14.827 7.739 1.00 0.00 O ATOM 1323 CB GLU A 89 14.850 13.079 5.365 1.00 0.00 C ATOM 1324 CG GLU A 89 15.269 11.627 5.199 1.00 0.00 C ATOM 1325 CD GLU A 89 16.521 11.474 4.358 1.00 0.00 C ATOM 1326 OE1 GLU A 89 16.780 12.355 3.512 1.00 0.00 O ATOM 1327 OE2 GLU A 89 17.244 10.473 4.548 1.00 0.00 O ATOM 0 H GLU A 89 12.413 13.630 4.225 1.00 0.00 H new ATOM 0 HA GLU A 89 13.355 12.531 6.809 1.00 0.00 H new ATOM 0 HB2 GLU A 89 14.856 13.564 4.389 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.588 13.593 5.981 1.00 0.00 H new ATOM 0 HG2 GLU A 89 15.440 11.187 6.182 1.00 0.00 H new ATOM 0 HG3 GLU A 89 14.455 11.068 4.737 1.00 0.00 H new ATOM 1334 N SER A 90 13.602 15.657 5.743 1.00 0.00 N ATOM 1335 CA SER A 90 13.508 17.048 6.168 1.00 0.00 C ATOM 1336 C SER A 90 13.799 17.993 5.007 1.00 0.00 C ATOM 1337 O SER A 90 13.142 19.023 4.852 1.00 0.00 O ATOM 1338 CB SER A 90 14.480 17.320 7.318 1.00 0.00 C ATOM 1339 OG SER A 90 14.581 18.708 7.584 1.00 0.00 O ATOM 0 H SER A 90 13.891 15.531 4.773 1.00 0.00 H new ATOM 0 HA SER A 90 12.490 17.227 6.513 1.00 0.00 H new ATOM 0 HB2 SER A 90 14.143 16.799 8.214 1.00 0.00 H new ATOM 0 HB3 SER A 90 15.464 16.922 7.069 1.00 0.00 H new ATOM 0 HG SER A 90 15.235 19.111 6.975 1.00 0.00 H new ATOM 1345 N GLY A 91 14.787 17.636 4.194 1.00 0.00 N ATOM 1346 CA GLY A 91 15.148 18.463 3.056 1.00 0.00 C ATOM 1347 C GLY A 91 16.499 19.130 3.229 1.00 0.00 C ATOM 1348 O GLY A 91 17.254 18.781 4.136 1.00 0.00 O ATOM 0 H GLY A 91 15.345 16.789 4.302 1.00 0.00 H new ATOM 0 HA2 GLY A 91 15.162 17.850 2.155 1.00 0.00 H new ATOM 0 HA3 GLY A 91 14.385 19.227 2.910 1.00 0.00 H new ATOM 1352 N PRO A 92 16.835 20.105 2.366 1.00 0.00 N ATOM 1353 CA PRO A 92 18.114 20.818 2.438 1.00 0.00 C ATOM 1354 C PRO A 92 18.386 21.381 3.829 1.00 0.00 C ATOM 1355 O PRO A 92 19.467 21.192 4.386 1.00 0.00 O ATOM 1356 CB PRO A 92 17.947 21.953 1.425 1.00 0.00 C ATOM 1357 CG PRO A 92 16.933 21.450 0.457 1.00 0.00 C ATOM 1358 CD PRO A 92 15.994 20.586 1.253 1.00 0.00 C ATOM 0 HA PRO A 92 18.958 20.162 2.227 1.00 0.00 H new ATOM 0 HB2 PRO A 92 17.611 22.870 1.909 1.00 0.00 H new ATOM 0 HB3 PRO A 92 18.890 22.182 0.928 1.00 0.00 H new ATOM 0 HG2 PRO A 92 16.399 22.276 -0.014 1.00 0.00 H new ATOM 0 HG3 PRO A 92 17.406 20.879 -0.342 1.00 0.00 H new ATOM 0 HD2 PRO A 92 15.135 21.152 1.614 1.00 0.00 H new ATOM 0 HD3 PRO A 92 15.605 19.760 0.657 1.00 0.00 H new ATOM 1366 N SER A 93 17.398 22.076 4.384 1.00 0.00 N ATOM 1367 CA SER A 93 17.530 22.668 5.710 1.00 0.00 C ATOM 1368 C SER A 93 17.107 21.680 6.792 1.00 0.00 C ATOM 1369 O SER A 93 16.059 21.043 6.689 1.00 0.00 O ATOM 1370 CB SER A 93 16.689 23.942 5.809 1.00 0.00 C ATOM 1371 OG SER A 93 15.574 23.886 4.936 1.00 0.00 O ATOM 0 H SER A 93 16.497 22.243 3.936 1.00 0.00 H new ATOM 0 HA SER A 93 18.579 22.921 5.865 1.00 0.00 H new ATOM 0 HB2 SER A 93 16.345 24.076 6.835 1.00 0.00 H new ATOM 0 HB3 SER A 93 17.304 24.808 5.563 1.00 0.00 H new ATOM 0 HG SER A 93 15.052 24.711 5.019 1.00 0.00 H new ATOM 1377 N SER A 94 17.929 21.559 7.830 1.00 0.00 N ATOM 1378 CA SER A 94 17.639 20.649 8.932 1.00 0.00 C ATOM 1379 C SER A 94 16.754 21.323 9.975 1.00 0.00 C ATOM 1380 O SER A 94 17.247 21.904 10.941 1.00 0.00 O ATOM 1381 CB SER A 94 18.940 20.172 9.582 1.00 0.00 C ATOM 1382 OG SER A 94 18.846 18.814 9.974 1.00 0.00 O ATOM 0 H SER A 94 18.800 22.079 7.931 1.00 0.00 H new ATOM 0 HA SER A 94 17.105 19.789 8.529 1.00 0.00 H new ATOM 0 HB2 SER A 94 19.766 20.295 8.882 1.00 0.00 H new ATOM 0 HB3 SER A 94 19.164 20.790 10.451 1.00 0.00 H new ATOM 0 HG SER A 94 19.690 18.533 10.385 1.00 0.00 H new ATOM 1388 N GLY A 95 15.443 21.242 9.771 1.00 0.00 N ATOM 1389 CA GLY A 95 14.510 21.848 10.702 1.00 0.00 C ATOM 1390 C GLY A 95 14.160 20.929 11.856 1.00 0.00 C ATOM 1391 O GLY A 95 13.193 20.150 11.722 1.00 0.00 O ATOM 1392 OXT GLY A 95 14.854 20.988 12.893 1.00 0.00 O ATOM 0 H GLY A 95 15.011 20.768 8.978 1.00 0.00 H new ATOM 0 HA2 GLY A 95 14.940 22.770 11.094 1.00 0.00 H new ATOM 0 HA3 GLY A 95 13.598 22.122 10.171 1.00 0.00 H new TER 1396 GLY A 95