USER MOD reduce.3.24.130724 H: found=0, std=0, add=654, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 656 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 9 MET CE :methyl -110:sc= -0.427 (180deg=-3.21!) USER MOD Single : A 11 THR OG1 : rot 170:sc= -0.576 USER MOD Single : A 12 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0151) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 THR OG1 : rot 52:sc= 0.174 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 CYS SG : rot 36:sc= 0.306 USER MOD Single : A 29 CYS SG : rot -110:sc= 0.0787 USER MOD Single : A 32 SER OG : rot 180:sc= 0.0633 USER MOD Single : A 37 ASN : amide:sc= -1.62! C(o=-1.6!,f=-6.2!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -7.43! C(o=-7.4!,f=-14!) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -4.78! C(o=-4.8!,f=-5.7!) USER MOD Single : A 72 THR OG1 : rot 9:sc= 0.188 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot -13:sc= 0.546 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl -146:sc= -0.0476 (180deg=-0.355) USER MOD Single : A 83 THR OG1 : rot 132:sc= -0.435 USER MOD Single : A 84 THR OG1 : rot 120:sc= -0.131 USER MOD Single : A 87 GLN : amide:sc= -0.0349 K(o=-0.035,f=-1.5!) USER MOD Single : A 88 SER OG : rot 50:sc= 0.279 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 7 -20.425 -3.605 -2.541 1.00 0.00 N ATOM 60 CA GLY A 7 -18.978 -3.491 -2.532 1.00 0.00 C ATOM 61 C GLY A 7 -18.462 -2.748 -1.316 1.00 0.00 C ATOM 62 O GLY A 7 -19.218 -2.466 -0.386 1.00 0.00 O ATOM 0 HA2 GLY A 7 -18.538 -4.488 -2.558 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -18.652 -2.975 -3.435 1.00 0.00 H new ATOM 66 N ILE A 8 -17.172 -2.431 -1.322 1.00 0.00 N ATOM 67 CA ILE A 8 -16.556 -1.717 -0.210 1.00 0.00 C ATOM 68 C ILE A 8 -15.961 -0.391 -0.671 1.00 0.00 C ATOM 69 O ILE A 8 -15.218 -0.340 -1.651 1.00 0.00 O ATOM 70 CB ILE A 8 -15.452 -2.559 0.458 1.00 0.00 C ATOM 71 CG1 ILE A 8 -16.063 -3.766 1.173 1.00 0.00 C ATOM 72 CG2 ILE A 8 -14.654 -1.707 1.432 1.00 0.00 C ATOM 73 CD1 ILE A 8 -15.036 -4.765 1.656 1.00 0.00 C ATOM 0 H ILE A 8 -16.533 -2.657 -2.084 1.00 0.00 H new ATOM 0 HA ILE A 8 -17.345 -1.525 0.518 1.00 0.00 H new ATOM 0 HB ILE A 8 -14.775 -2.923 -0.315 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -16.647 -3.416 2.025 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -16.755 -4.267 0.496 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -13.878 -2.315 1.896 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -14.193 -0.877 0.896 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -15.318 -1.317 2.203 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -15.540 -5.594 2.153 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -14.468 -5.143 0.806 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -14.358 -4.279 2.358 1.00 0.00 H new ATOM 85 N MET A 9 -16.291 0.680 0.044 1.00 0.00 N ATOM 86 CA MET A 9 -15.785 2.006 -0.290 1.00 0.00 C ATOM 87 C MET A 9 -14.647 2.405 0.643 1.00 0.00 C ATOM 88 O MET A 9 -14.654 2.067 1.827 1.00 0.00 O ATOM 89 CB MET A 9 -16.911 3.039 -0.211 1.00 0.00 C ATOM 90 CG MET A 9 -18.247 2.521 -0.719 1.00 0.00 C ATOM 91 SD MET A 9 -18.218 2.132 -2.479 1.00 0.00 S ATOM 92 CE MET A 9 -18.725 0.414 -2.454 1.00 0.00 C ATOM 0 H MET A 9 -16.906 0.655 0.857 1.00 0.00 H new ATOM 0 HA MET A 9 -15.401 1.975 -1.309 1.00 0.00 H new ATOM 0 HB2 MET A 9 -17.025 3.362 0.824 1.00 0.00 H new ATOM 0 HB3 MET A 9 -16.628 3.918 -0.789 1.00 0.00 H new ATOM 0 HG2 MET A 9 -18.523 1.628 -0.158 1.00 0.00 H new ATOM 0 HG3 MET A 9 -19.018 3.268 -0.529 1.00 0.00 H new ATOM 0 HE1 MET A 9 -17.880 -0.219 -2.724 1.00 0.00 H new ATOM 0 HE2 MET A 9 -19.070 0.151 -1.454 1.00 0.00 H new ATOM 0 HE3 MET A 9 -19.534 0.263 -3.169 1.00 0.00 H new ATOM 102 N VAL A 10 -13.670 3.127 0.103 1.00 0.00 N ATOM 103 CA VAL A 10 -12.525 3.572 0.888 1.00 0.00 C ATOM 104 C VAL A 10 -12.816 4.899 1.580 1.00 0.00 C ATOM 105 O VAL A 10 -12.795 5.958 0.951 1.00 0.00 O ATOM 106 CB VAL A 10 -11.269 3.728 0.010 1.00 0.00 C ATOM 107 CG1 VAL A 10 -10.129 4.337 0.812 1.00 0.00 C ATOM 108 CG2 VAL A 10 -10.860 2.386 -0.578 1.00 0.00 C ATOM 0 H VAL A 10 -13.649 3.416 -0.875 1.00 0.00 H new ATOM 0 HA VAL A 10 -12.340 2.806 1.641 1.00 0.00 H new ATOM 0 HB VAL A 10 -11.504 4.403 -0.813 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -9.250 4.440 0.175 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -10.427 5.319 1.180 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -9.892 3.690 1.656 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -9.971 2.515 -1.195 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -10.643 1.686 0.229 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -11.673 1.994 -1.190 1.00 0.00 H new ATOM 118 N THR A 11 -13.087 4.836 2.880 1.00 0.00 N ATOM 119 CA THR A 11 -13.383 6.032 3.658 1.00 0.00 C ATOM 120 C THR A 11 -12.160 6.934 3.766 1.00 0.00 C ATOM 121 O THR A 11 -12.256 8.151 3.604 1.00 0.00 O ATOM 122 CB THR A 11 -13.870 5.674 5.075 1.00 0.00 C ATOM 123 OG1 THR A 11 -12.827 5.011 5.798 1.00 0.00 O ATOM 124 CG2 THR A 11 -15.100 4.781 5.015 1.00 0.00 C ATOM 0 H THR A 11 -13.108 3.969 3.416 1.00 0.00 H new ATOM 0 HA THR A 11 -14.177 6.563 3.132 1.00 0.00 H new ATOM 0 HB THR A 11 -14.137 6.598 5.588 1.00 0.00 H new ATOM 0 HG1 THR A 11 -13.082 4.931 6.741 1.00 0.00 H new ATOM 0 HG21 THR A 11 -15.425 4.542 6.027 1.00 0.00 H new ATOM 0 HG22 THR A 11 -15.901 5.300 4.489 1.00 0.00 H new ATOM 0 HG23 THR A 11 -14.856 3.860 4.485 1.00 0.00 H new ATOM 132 N LYS A 12 -11.008 6.331 4.041 1.00 0.00 N ATOM 133 CA LYS A 12 -9.763 7.080 4.169 1.00 0.00 C ATOM 134 C LYS A 12 -8.806 6.743 3.030 1.00 0.00 C ATOM 135 O LYS A 12 -8.305 5.623 2.940 1.00 0.00 O ATOM 136 CB LYS A 12 -9.099 6.777 5.514 1.00 0.00 C ATOM 137 CG LYS A 12 -7.945 7.708 5.845 1.00 0.00 C ATOM 138 CD LYS A 12 -7.096 7.162 6.981 1.00 0.00 C ATOM 139 CE LYS A 12 -5.894 8.052 7.257 1.00 0.00 C ATOM 140 NZ LYS A 12 -6.295 9.357 7.851 1.00 0.00 N ATOM 0 H LYS A 12 -10.911 5.325 4.180 1.00 0.00 H new ATOM 0 HA LYS A 12 -10.000 8.143 4.118 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -9.848 6.845 6.303 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -8.736 5.749 5.507 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -7.324 7.848 4.960 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -8.334 8.688 6.119 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -7.703 7.079 7.883 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -6.756 6.157 6.732 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -5.211 7.540 7.934 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -5.351 8.227 6.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -5.444 9.900 8.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -6.857 9.894 7.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -6.864 9.189 8.705 1.00 0.00 H new ATOM 154 N GLN A 13 -8.557 7.720 2.164 1.00 0.00 N ATOM 155 CA GLN A 13 -7.659 7.526 1.032 1.00 0.00 C ATOM 156 C GLN A 13 -6.207 7.738 1.447 1.00 0.00 C ATOM 157 O GLN A 13 -5.918 8.497 2.373 1.00 0.00 O ATOM 158 CB GLN A 13 -8.022 8.484 -0.104 1.00 0.00 C ATOM 159 CG GLN A 13 -9.498 8.464 -0.469 1.00 0.00 C ATOM 160 CD GLN A 13 -9.742 8.776 -1.932 1.00 0.00 C ATOM 161 OE1 GLN A 13 -9.313 9.814 -2.437 1.00 0.00 O ATOM 162 NE2 GLN A 13 -10.433 7.877 -2.622 1.00 0.00 N ATOM 0 H GLN A 13 -8.964 8.653 2.225 1.00 0.00 H new ATOM 0 HA GLN A 13 -7.772 6.500 0.682 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -7.741 9.497 0.183 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -7.435 8.228 -0.986 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -9.912 7.483 -0.237 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -10.030 9.189 0.147 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -10.770 7.030 -2.163 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -10.627 8.033 -3.611 1.00 0.00 H new ATOM 171 N LEU A 14 -5.295 7.062 0.756 1.00 0.00 N ATOM 172 CA LEU A 14 -3.871 7.175 1.052 1.00 0.00 C ATOM 173 C LEU A 14 -3.381 8.603 0.832 1.00 0.00 C ATOM 174 O LEU A 14 -3.883 9.314 -0.038 1.00 0.00 O ATOM 175 CB LEU A 14 -3.070 6.208 0.179 1.00 0.00 C ATOM 176 CG LEU A 14 -3.543 4.754 0.180 1.00 0.00 C ATOM 177 CD1 LEU A 14 -3.148 4.064 -1.117 1.00 0.00 C ATOM 178 CD2 LEU A 14 -2.973 4.009 1.378 1.00 0.00 C ATOM 0 H LEU A 14 -5.517 6.430 -0.013 1.00 0.00 H new ATOM 0 HA LEU A 14 -3.721 6.917 2.100 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -3.090 6.575 -0.847 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -2.030 6.231 0.506 1.00 0.00 H new ATOM 0 HG LEU A 14 -4.630 4.745 0.256 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -3.493 3.030 -1.099 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -3.604 4.584 -1.959 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -2.063 4.083 -1.224 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -3.320 2.976 1.363 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -1.884 4.027 1.333 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -3.306 4.490 2.298 1.00 0.00 H new ATOM 190 N GLU A 15 -2.396 9.014 1.625 1.00 0.00 N ATOM 191 CA GLU A 15 -1.838 10.357 1.514 1.00 0.00 C ATOM 192 C GLU A 15 -0.367 10.303 1.112 1.00 0.00 C ATOM 193 O GLU A 15 0.399 9.488 1.627 1.00 0.00 O ATOM 194 CB GLU A 15 -1.989 11.106 2.840 1.00 0.00 C ATOM 195 CG GLU A 15 -3.357 11.740 3.028 1.00 0.00 C ATOM 196 CD GLU A 15 -3.337 12.888 4.018 1.00 0.00 C ATOM 197 OE1 GLU A 15 -3.380 12.623 5.237 1.00 0.00 O ATOM 198 OE2 GLU A 15 -3.277 14.054 3.572 1.00 0.00 O ATOM 0 H GLU A 15 -1.969 8.437 2.350 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.389 10.890 0.739 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -1.802 10.414 3.662 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -1.227 11.883 2.898 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -3.721 12.101 2.066 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -4.061 10.982 3.371 1.00 0.00 H new ATOM 205 N ASP A 16 0.020 11.176 0.189 1.00 0.00 N ATOM 206 CA ASP A 16 1.399 11.229 -0.282 1.00 0.00 C ATOM 207 C ASP A 16 2.377 11.140 0.885 1.00 0.00 C ATOM 208 O ASP A 16 2.258 11.876 1.866 1.00 0.00 O ATOM 209 CB ASP A 16 1.642 12.517 -1.070 1.00 0.00 C ATOM 210 CG ASP A 16 3.087 12.972 -1.005 1.00 0.00 C ATOM 211 OD1 ASP A 16 3.980 12.102 -0.943 1.00 0.00 O ATOM 212 OD2 ASP A 16 3.324 14.198 -1.015 1.00 0.00 O ATOM 0 H ASP A 16 -0.601 11.857 -0.248 1.00 0.00 H new ATOM 0 HA ASP A 16 1.566 10.374 -0.937 1.00 0.00 H new ATOM 0 HB2 ASP A 16 1.360 12.361 -2.111 1.00 0.00 H new ATOM 0 HB3 ASP A 16 0.998 13.305 -0.680 1.00 0.00 H new ATOM 217 N THR A 17 3.343 10.234 0.774 1.00 0.00 N ATOM 218 CA THR A 17 4.340 10.047 1.821 1.00 0.00 C ATOM 219 C THR A 17 5.753 10.146 1.259 1.00 0.00 C ATOM 220 O THR A 17 5.999 9.798 0.103 1.00 0.00 O ATOM 221 CB THR A 17 4.171 8.686 2.521 1.00 0.00 C ATOM 222 OG1 THR A 17 2.951 8.667 3.270 1.00 0.00 O ATOM 223 CG2 THR A 17 5.345 8.404 3.447 1.00 0.00 C ATOM 0 H THR A 17 3.456 9.618 -0.031 1.00 0.00 H new ATOM 0 HA THR A 17 4.186 10.843 2.550 1.00 0.00 H new ATOM 0 HB THR A 17 4.138 7.911 1.755 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.207 8.935 2.691 1.00 0.00 H new ATOM 0 HG21 THR A 17 5.203 7.437 3.930 1.00 0.00 H new ATOM 0 HG22 THR A 17 6.269 8.389 2.869 1.00 0.00 H new ATOM 0 HG23 THR A 17 5.405 9.184 4.206 1.00 0.00 H new ATOM 231 N THR A 18 6.682 10.621 2.083 1.00 0.00 N ATOM 232 CA THR A 18 8.071 10.766 1.668 1.00 0.00 C ATOM 233 C THR A 18 9.018 10.149 2.691 1.00 0.00 C ATOM 234 O THR A 18 9.199 10.684 3.784 1.00 0.00 O ATOM 235 CB THR A 18 8.446 12.246 1.465 1.00 0.00 C ATOM 236 OG1 THR A 18 7.618 12.826 0.451 1.00 0.00 O ATOM 237 CG2 THR A 18 9.909 12.384 1.072 1.00 0.00 C ATOM 0 H THR A 18 6.497 10.912 3.043 1.00 0.00 H new ATOM 0 HA THR A 18 8.173 10.240 0.719 1.00 0.00 H new ATOM 0 HB THR A 18 8.288 12.771 2.407 1.00 0.00 H new ATOM 0 HG1 THR A 18 7.861 13.767 0.329 1.00 0.00 H new ATOM 0 HG21 THR A 18 10.151 13.438 0.934 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.538 11.967 1.859 1.00 0.00 H new ATOM 0 HG23 THR A 18 10.088 11.846 0.141 1.00 0.00 H new ATOM 245 N ALA A 19 9.620 9.021 2.329 1.00 0.00 N ATOM 246 CA ALA A 19 10.551 8.333 3.215 1.00 0.00 C ATOM 247 C ALA A 19 11.989 8.497 2.735 1.00 0.00 C ATOM 248 O ALA A 19 12.246 9.160 1.730 1.00 0.00 O ATOM 249 CB ALA A 19 10.191 6.858 3.316 1.00 0.00 C ATOM 0 H ALA A 19 9.480 8.564 1.428 1.00 0.00 H new ATOM 0 HA ALA A 19 10.473 8.784 4.204 1.00 0.00 H new ATOM 0 HB1 ALA A 19 10.894 6.356 3.981 1.00 0.00 H new ATOM 0 HB2 ALA A 19 9.181 6.756 3.713 1.00 0.00 H new ATOM 0 HB3 ALA A 19 10.239 6.403 2.327 1.00 0.00 H new ATOM 255 N TYR A 20 12.922 7.891 3.460 1.00 0.00 N ATOM 256 CA TYR A 20 14.335 7.973 3.109 1.00 0.00 C ATOM 257 C TYR A 20 14.826 6.656 2.514 1.00 0.00 C ATOM 258 O TYR A 20 14.145 5.633 2.595 1.00 0.00 O ATOM 259 CB TYR A 20 15.168 8.330 4.341 1.00 0.00 C ATOM 260 CG TYR A 20 15.064 9.785 4.741 1.00 0.00 C ATOM 261 CD1 TYR A 20 15.442 10.795 3.866 1.00 0.00 C ATOM 262 CD2 TYR A 20 14.586 10.148 5.995 1.00 0.00 C ATOM 263 CE1 TYR A 20 15.349 12.125 4.228 1.00 0.00 C ATOM 264 CE2 TYR A 20 14.489 11.476 6.365 1.00 0.00 C ATOM 265 CZ TYR A 20 14.872 12.460 5.478 1.00 0.00 C ATOM 266 OH TYR A 20 14.777 13.784 5.842 1.00 0.00 O ATOM 0 H TYR A 20 12.726 7.338 4.294 1.00 0.00 H new ATOM 0 HA TYR A 20 14.452 8.756 2.360 1.00 0.00 H new ATOM 0 HB2 TYR A 20 14.849 7.708 5.178 1.00 0.00 H new ATOM 0 HB3 TYR A 20 16.213 8.089 4.145 1.00 0.00 H new ATOM 0 HD1 TYR A 20 15.815 10.536 2.886 1.00 0.00 H new ATOM 0 HD2 TYR A 20 14.285 9.379 6.692 1.00 0.00 H new ATOM 0 HE1 TYR A 20 15.648 12.898 3.536 1.00 0.00 H new ATOM 0 HE2 TYR A 20 14.115 11.742 7.343 1.00 0.00 H new ATOM 0 HH TYR A 20 14.422 13.848 6.753 1.00 0.00 H new ATOM 276 N CYS A 21 16.012 6.691 1.917 1.00 0.00 N ATOM 277 CA CYS A 21 16.596 5.501 1.307 1.00 0.00 C ATOM 278 C CYS A 21 17.012 4.493 2.373 1.00 0.00 C ATOM 279 O CYS A 21 17.985 4.704 3.095 1.00 0.00 O ATOM 280 CB CYS A 21 17.803 5.883 0.449 1.00 0.00 C ATOM 281 SG CYS A 21 19.152 6.654 1.374 1.00 0.00 S ATOM 0 H CYS A 21 16.588 7.529 1.842 1.00 0.00 H new ATOM 0 HA CYS A 21 15.840 5.039 0.672 1.00 0.00 H new ATOM 0 HB2 CYS A 21 18.181 4.988 -0.046 1.00 0.00 H new ATOM 0 HB3 CYS A 21 17.477 6.567 -0.334 1.00 0.00 H new ATOM 0 HG CYS A 21 19.239 6.108 2.550 1.00 0.00 H new ATOM 287 N GLY A 22 16.267 3.396 2.466 1.00 0.00 N ATOM 288 CA GLY A 22 16.573 2.372 3.447 1.00 0.00 C ATOM 289 C GLY A 22 15.597 2.370 4.607 1.00 0.00 C ATOM 290 O GLY A 22 15.649 1.492 5.468 1.00 0.00 O ATOM 0 H GLY A 22 15.457 3.198 1.879 1.00 0.00 H new ATOM 0 HA2 GLY A 22 16.560 1.395 2.964 1.00 0.00 H new ATOM 0 HA3 GLY A 22 17.583 2.527 3.826 1.00 0.00 H new ATOM 294 N GLU A 23 14.706 3.356 4.630 1.00 0.00 N ATOM 295 CA GLU A 23 13.716 3.466 5.696 1.00 0.00 C ATOM 296 C GLU A 23 12.504 2.586 5.404 1.00 0.00 C ATOM 297 O GLU A 23 12.363 2.049 4.305 1.00 0.00 O ATOM 298 CB GLU A 23 13.275 4.921 5.865 1.00 0.00 C ATOM 299 CG GLU A 23 14.235 5.755 6.696 1.00 0.00 C ATOM 300 CD GLU A 23 13.623 7.064 7.156 1.00 0.00 C ATOM 301 OE1 GLU A 23 12.857 7.667 6.375 1.00 0.00 O ATOM 302 OE2 GLU A 23 13.909 7.485 8.297 1.00 0.00 O ATOM 0 H GLU A 23 14.649 4.090 3.924 1.00 0.00 H new ATOM 0 HA GLU A 23 14.177 3.124 6.623 1.00 0.00 H new ATOM 0 HB2 GLU A 23 13.170 5.377 4.880 1.00 0.00 H new ATOM 0 HB3 GLU A 23 12.291 4.942 6.333 1.00 0.00 H new ATOM 0 HG2 GLU A 23 14.550 5.180 7.567 1.00 0.00 H new ATOM 0 HG3 GLU A 23 15.130 5.963 6.110 1.00 0.00 H new ATOM 309 N ARG A 24 11.632 2.443 6.396 1.00 0.00 N ATOM 310 CA ARG A 24 10.432 1.627 6.248 1.00 0.00 C ATOM 311 C ARG A 24 9.202 2.504 6.033 1.00 0.00 C ATOM 312 O ARG A 24 8.884 3.360 6.859 1.00 0.00 O ATOM 313 CB ARG A 24 10.234 0.745 7.482 1.00 0.00 C ATOM 314 CG ARG A 24 8.852 0.116 7.565 1.00 0.00 C ATOM 315 CD ARG A 24 8.420 -0.090 9.008 1.00 0.00 C ATOM 316 NE ARG A 24 8.765 -1.421 9.498 1.00 0.00 N ATOM 317 CZ ARG A 24 8.282 -1.939 10.622 1.00 0.00 C ATOM 318 NH1 ARG A 24 7.437 -1.241 11.368 1.00 0.00 N ATOM 319 NH2 ARG A 24 8.644 -3.158 11.002 1.00 0.00 N ATOM 0 H ARG A 24 11.733 2.881 7.311 1.00 0.00 H new ATOM 0 HA ARG A 24 10.561 0.991 5.372 1.00 0.00 H new ATOM 0 HB2 ARG A 24 10.984 -0.046 7.477 1.00 0.00 H new ATOM 0 HB3 ARG A 24 10.406 1.343 8.377 1.00 0.00 H new ATOM 0 HG2 ARG A 24 8.130 0.753 7.055 1.00 0.00 H new ATOM 0 HG3 ARG A 24 8.855 -0.842 7.045 1.00 0.00 H new ATOM 0 HD2 ARG A 24 8.893 0.662 9.639 1.00 0.00 H new ATOM 0 HD3 ARG A 24 7.343 0.058 9.089 1.00 0.00 H new ATOM 0 HE ARG A 24 9.413 -1.984 8.947 1.00 0.00 H new ATOM 0 HH11 ARG A 24 7.156 -0.304 11.079 1.00 0.00 H new ATOM 0 HH12 ARG A 24 7.068 -1.641 12.230 1.00 0.00 H new ATOM 0 HH21 ARG A 24 9.294 -3.698 10.431 1.00 0.00 H new ATOM 0 HH22 ARG A 24 8.272 -3.555 11.865 1.00 0.00 H new ATOM 333 N VAL A 25 8.513 2.285 4.917 1.00 0.00 N ATOM 334 CA VAL A 25 7.318 3.054 4.593 1.00 0.00 C ATOM 335 C VAL A 25 6.058 2.338 5.069 1.00 0.00 C ATOM 336 O VAL A 25 5.942 1.120 4.945 1.00 0.00 O ATOM 337 CB VAL A 25 7.208 3.310 3.078 1.00 0.00 C ATOM 338 CG1 VAL A 25 6.004 4.187 2.771 1.00 0.00 C ATOM 339 CG2 VAL A 25 8.488 3.942 2.552 1.00 0.00 C ATOM 0 H VAL A 25 8.763 1.581 4.222 1.00 0.00 H new ATOM 0 HA VAL A 25 7.407 4.010 5.110 1.00 0.00 H new ATOM 0 HB VAL A 25 7.068 2.354 2.573 1.00 0.00 H new ATOM 0 HG11 VAL A 25 5.942 4.357 1.696 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.096 3.690 3.112 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.110 5.143 3.284 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.394 4.116 1.480 1.00 0.00 H new ATOM 0 HG22 VAL A 25 8.661 4.891 3.060 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.328 3.272 2.738 1.00 0.00 H new ATOM 349 N GLU A 26 5.118 3.105 5.613 1.00 0.00 N ATOM 350 CA GLU A 26 3.867 2.543 6.107 1.00 0.00 C ATOM 351 C GLU A 26 2.672 3.343 5.598 1.00 0.00 C ATOM 352 O GLU A 26 2.515 4.521 5.922 1.00 0.00 O ATOM 353 CB GLU A 26 3.863 2.517 7.637 1.00 0.00 C ATOM 354 CG GLU A 26 4.667 1.372 8.229 1.00 0.00 C ATOM 355 CD GLU A 26 4.255 1.044 9.651 1.00 0.00 C ATOM 356 OE1 GLU A 26 3.204 0.394 9.830 1.00 0.00 O ATOM 357 OE2 GLU A 26 4.985 1.438 10.585 1.00 0.00 O ATOM 0 H GLU A 26 5.199 4.116 5.722 1.00 0.00 H new ATOM 0 HA GLU A 26 3.784 1.523 5.733 1.00 0.00 H new ATOM 0 HB2 GLU A 26 4.262 3.461 8.009 1.00 0.00 H new ATOM 0 HB3 GLU A 26 2.833 2.446 7.988 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.544 0.486 7.606 1.00 0.00 H new ATOM 0 HG3 GLU A 26 5.726 1.630 8.212 1.00 0.00 H new ATOM 364 N LEU A 27 1.832 2.696 4.798 1.00 0.00 N ATOM 365 CA LEU A 27 0.650 3.346 4.242 1.00 0.00 C ATOM 366 C LEU A 27 -0.619 2.848 4.926 1.00 0.00 C ATOM 367 O LEU A 27 -0.978 1.677 4.810 1.00 0.00 O ATOM 368 CB LEU A 27 0.564 3.092 2.736 1.00 0.00 C ATOM 369 CG LEU A 27 1.815 3.433 1.925 1.00 0.00 C ATOM 370 CD1 LEU A 27 1.615 3.078 0.460 1.00 0.00 C ATOM 371 CD2 LEU A 27 2.163 4.907 2.076 1.00 0.00 C ATOM 0 H LEU A 27 1.947 1.722 4.520 1.00 0.00 H new ATOM 0 HA LEU A 27 0.739 4.418 4.419 1.00 0.00 H new ATOM 0 HB2 LEU A 27 0.329 2.039 2.578 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -0.271 3.668 2.338 1.00 0.00 H new ATOM 0 HG LEU A 27 2.646 2.843 2.310 1.00 0.00 H new ATOM 0 HD11 LEU A 27 2.515 3.328 -0.101 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.415 2.010 0.368 1.00 0.00 H new ATOM 0 HD13 LEU A 27 0.771 3.641 0.061 1.00 0.00 H new ATOM 0 HD21 LEU A 27 3.056 5.132 1.492 1.00 0.00 H new ATOM 0 HD22 LEU A 27 1.333 5.515 1.718 1.00 0.00 H new ATOM 0 HD23 LEU A 27 2.350 5.131 3.126 1.00 0.00 H new ATOM 383 N GLU A 28 -1.293 3.746 5.638 1.00 0.00 N ATOM 384 CA GLU A 28 -2.523 3.397 6.339 1.00 0.00 C ATOM 385 C GLU A 28 -3.747 3.857 5.553 1.00 0.00 C ATOM 386 O GLU A 28 -3.687 4.834 4.806 1.00 0.00 O ATOM 387 CB GLU A 28 -2.535 4.023 7.735 1.00 0.00 C ATOM 388 CG GLU A 28 -3.617 3.464 8.644 1.00 0.00 C ATOM 389 CD GLU A 28 -4.103 4.476 9.663 1.00 0.00 C ATOM 390 OE1 GLU A 28 -5.041 5.237 9.345 1.00 0.00 O ATOM 391 OE2 GLU A 28 -3.544 4.507 10.780 1.00 0.00 O ATOM 0 H GLU A 28 -1.008 4.720 5.744 1.00 0.00 H new ATOM 0 HA GLU A 28 -2.561 2.312 6.434 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -1.563 3.866 8.203 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -2.673 5.100 7.640 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -4.459 3.131 8.038 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -3.232 2.587 9.164 1.00 0.00 H new ATOM 398 N CYS A 29 -4.855 3.146 5.727 1.00 0.00 N ATOM 399 CA CYS A 29 -6.094 3.479 5.033 1.00 0.00 C ATOM 400 C CYS A 29 -7.290 2.811 5.704 1.00 0.00 C ATOM 401 O CYS A 29 -7.130 1.885 6.498 1.00 0.00 O ATOM 402 CB CYS A 29 -6.013 3.053 3.567 1.00 0.00 C ATOM 403 SG CYS A 29 -5.933 1.263 3.322 1.00 0.00 S ATOM 0 H CYS A 29 -4.921 2.335 6.343 1.00 0.00 H new ATOM 0 HA CYS A 29 -6.229 4.559 5.082 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -6.883 3.443 3.038 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -5.133 3.511 3.115 1.00 0.00 H new ATOM 0 HG CYS A 29 -4.751 0.937 2.889 1.00 0.00 H new ATOM 409 N GLU A 30 -8.487 3.290 5.380 1.00 0.00 N ATOM 410 CA GLU A 30 -9.710 2.740 5.954 1.00 0.00 C ATOM 411 C GLU A 30 -10.741 2.453 4.867 1.00 0.00 C ATOM 412 O GLU A 30 -10.728 3.074 3.804 1.00 0.00 O ATOM 413 CB GLU A 30 -10.296 3.707 6.985 1.00 0.00 C ATOM 414 CG GLU A 30 -9.785 3.475 8.397 1.00 0.00 C ATOM 415 CD GLU A 30 -10.509 4.321 9.426 1.00 0.00 C ATOM 416 OE1 GLU A 30 -10.805 5.496 9.126 1.00 0.00 O ATOM 417 OE2 GLU A 30 -10.780 3.807 10.532 1.00 0.00 O ATOM 0 H GLU A 30 -8.636 4.057 4.724 1.00 0.00 H new ATOM 0 HA GLU A 30 -9.458 1.802 6.448 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -10.062 4.729 6.686 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -11.382 3.615 6.981 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -9.900 2.422 8.652 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -8.719 3.698 8.435 1.00 0.00 H new ATOM 424 N VAL A 31 -11.633 1.506 5.140 1.00 0.00 N ATOM 425 CA VAL A 31 -12.671 1.136 4.186 1.00 0.00 C ATOM 426 C VAL A 31 -14.059 1.284 4.799 1.00 0.00 C ATOM 427 O VAL A 31 -14.203 1.745 5.932 1.00 0.00 O ATOM 428 CB VAL A 31 -12.492 -0.313 3.695 1.00 0.00 C ATOM 429 CG1 VAL A 31 -11.348 -0.400 2.695 1.00 0.00 C ATOM 430 CG2 VAL A 31 -12.255 -1.249 4.871 1.00 0.00 C ATOM 0 H VAL A 31 -11.657 0.981 6.014 1.00 0.00 H new ATOM 0 HA VAL A 31 -12.577 1.814 3.338 1.00 0.00 H new ATOM 0 HB VAL A 31 -13.408 -0.624 3.192 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -11.236 -1.431 2.359 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -11.564 0.239 1.839 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -10.424 -0.071 3.170 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -12.131 -2.268 4.505 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -11.355 -0.943 5.404 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -13.109 -1.208 5.547 1.00 0.00 H new ATOM 440 N SER A 32 -15.079 0.891 4.043 1.00 0.00 N ATOM 441 CA SER A 32 -16.458 0.983 4.511 1.00 0.00 C ATOM 442 C SER A 32 -16.840 -0.252 5.321 1.00 0.00 C ATOM 443 O SER A 32 -17.833 -0.246 6.048 1.00 0.00 O ATOM 444 CB SER A 32 -17.411 1.145 3.326 1.00 0.00 C ATOM 445 OG SER A 32 -17.780 -0.115 2.792 1.00 0.00 O ATOM 0 H SER A 32 -14.977 0.506 3.104 1.00 0.00 H new ATOM 0 HA SER A 32 -16.540 1.858 5.156 1.00 0.00 H new ATOM 0 HB2 SER A 32 -18.303 1.684 3.644 1.00 0.00 H new ATOM 0 HB3 SER A 32 -16.934 1.746 2.552 1.00 0.00 H new ATOM 0 HG SER A 32 -18.391 0.016 2.037 1.00 0.00 H new ATOM 451 N GLU A 33 -16.044 -1.308 5.189 1.00 0.00 N ATOM 452 CA GLU A 33 -16.300 -2.551 5.908 1.00 0.00 C ATOM 453 C GLU A 33 -15.200 -2.824 6.930 1.00 0.00 C ATOM 454 O GLU A 33 -14.278 -2.025 7.094 1.00 0.00 O ATOM 455 CB GLU A 33 -16.403 -3.721 4.928 1.00 0.00 C ATOM 456 CG GLU A 33 -17.728 -3.778 4.185 1.00 0.00 C ATOM 457 CD GLU A 33 -18.902 -4.049 5.105 1.00 0.00 C ATOM 458 OE1 GLU A 33 -18.939 -5.137 5.716 1.00 0.00 O ATOM 459 OE2 GLU A 33 -19.784 -3.171 5.215 1.00 0.00 O ATOM 0 H GLU A 33 -15.217 -1.328 4.592 1.00 0.00 H new ATOM 0 HA GLU A 33 -17.247 -2.446 6.438 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -15.592 -3.649 4.203 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -16.261 -4.654 5.473 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -17.889 -2.834 3.665 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -17.680 -4.557 3.424 1.00 0.00 H new ATOM 466 N ASP A 34 -15.305 -3.958 7.614 1.00 0.00 N ATOM 467 CA ASP A 34 -14.320 -4.339 8.619 1.00 0.00 C ATOM 468 C ASP A 34 -13.605 -5.627 8.220 1.00 0.00 C ATOM 469 O ASP A 34 -14.130 -6.424 7.443 1.00 0.00 O ATOM 470 CB ASP A 34 -14.992 -4.515 9.982 1.00 0.00 C ATOM 471 CG ASP A 34 -16.225 -5.394 9.909 1.00 0.00 C ATOM 472 OD1 ASP A 34 -17.286 -4.893 9.481 1.00 0.00 O ATOM 473 OD2 ASP A 34 -16.129 -6.582 10.280 1.00 0.00 O ATOM 0 H ASP A 34 -16.063 -4.630 7.491 1.00 0.00 H new ATOM 0 HA ASP A 34 -13.581 -3.541 8.687 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -14.279 -4.951 10.682 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -15.269 -3.537 10.377 1.00 0.00 H new ATOM 478 N ASP A 35 -12.406 -5.822 8.756 1.00 0.00 N ATOM 479 CA ASP A 35 -11.619 -7.013 8.457 1.00 0.00 C ATOM 480 C ASP A 35 -11.782 -7.418 6.995 1.00 0.00 C ATOM 481 O ASP A 35 -11.839 -8.604 6.672 1.00 0.00 O ATOM 482 CB ASP A 35 -12.035 -8.168 9.368 1.00 0.00 C ATOM 483 CG ASP A 35 -12.133 -7.752 10.823 1.00 0.00 C ATOM 484 OD1 ASP A 35 -11.430 -6.797 11.215 1.00 0.00 O ATOM 485 OD2 ASP A 35 -12.913 -8.380 11.568 1.00 0.00 O ATOM 0 H ASP A 35 -11.957 -5.171 9.400 1.00 0.00 H new ATOM 0 HA ASP A 35 -10.570 -6.779 8.637 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -12.998 -8.558 9.039 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -11.314 -8.980 9.273 1.00 0.00 H new ATOM 490 N ALA A 36 -11.858 -6.424 6.116 1.00 0.00 N ATOM 491 CA ALA A 36 -12.014 -6.677 4.689 1.00 0.00 C ATOM 492 C ALA A 36 -10.701 -7.141 4.067 1.00 0.00 C ATOM 493 O ALA A 36 -9.705 -7.329 4.765 1.00 0.00 O ATOM 494 CB ALA A 36 -12.521 -5.428 3.984 1.00 0.00 C ATOM 0 H ALA A 36 -11.814 -5.436 6.367 1.00 0.00 H new ATOM 0 HA ALA A 36 -12.747 -7.474 4.565 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -12.633 -5.631 2.919 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.486 -5.141 4.402 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -11.808 -4.616 4.125 1.00 0.00 H new ATOM 500 N ASN A 37 -10.707 -7.325 2.751 1.00 0.00 N ATOM 501 CA ASN A 37 -9.516 -7.768 2.035 1.00 0.00 C ATOM 502 C ASN A 37 -9.219 -6.851 0.852 1.00 0.00 C ATOM 503 O ASN A 37 -9.728 -7.057 -0.250 1.00 0.00 O ATOM 504 CB ASN A 37 -9.695 -9.207 1.547 1.00 0.00 C ATOM 505 CG ASN A 37 -8.564 -9.656 0.643 1.00 0.00 C ATOM 506 OD1 ASN A 37 -7.673 -8.874 0.309 1.00 0.00 O ATOM 507 ND2 ASN A 37 -8.595 -10.922 0.241 1.00 0.00 N ATOM 0 H ASN A 37 -11.523 -7.174 2.158 1.00 0.00 H new ATOM 0 HA ASN A 37 -8.672 -7.727 2.724 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -9.756 -9.874 2.407 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -10.640 -9.291 1.011 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -7.861 -11.281 -0.369 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -9.353 -11.534 0.543 1.00 0.00 H new ATOM 514 N VAL A 38 -8.391 -5.839 1.089 1.00 0.00 N ATOM 515 CA VAL A 38 -8.024 -4.891 0.043 1.00 0.00 C ATOM 516 C VAL A 38 -6.873 -5.425 -0.803 1.00 0.00 C ATOM 517 O VAL A 38 -6.112 -6.287 -0.363 1.00 0.00 O ATOM 518 CB VAL A 38 -7.621 -3.528 0.637 1.00 0.00 C ATOM 519 CG1 VAL A 38 -8.619 -3.094 1.700 1.00 0.00 C ATOM 520 CG2 VAL A 38 -6.213 -3.592 1.209 1.00 0.00 C ATOM 0 H VAL A 38 -7.962 -5.654 1.996 1.00 0.00 H new ATOM 0 HA VAL A 38 -8.903 -4.758 -0.587 1.00 0.00 H new ATOM 0 HB VAL A 38 -7.630 -2.785 -0.161 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -8.319 -2.129 2.109 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -9.610 -3.007 1.255 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -8.644 -3.835 2.499 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -5.945 -2.621 1.624 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -6.173 -4.346 1.995 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -5.511 -3.855 0.418 1.00 0.00 H new ATOM 530 N LYS A 39 -6.751 -4.905 -2.020 1.00 0.00 N ATOM 531 CA LYS A 39 -5.691 -5.327 -2.929 1.00 0.00 C ATOM 532 C LYS A 39 -4.761 -4.163 -3.257 1.00 0.00 C ATOM 533 O LYS A 39 -5.178 -3.174 -3.858 1.00 0.00 O ATOM 534 CB LYS A 39 -6.292 -5.892 -4.217 1.00 0.00 C ATOM 535 CG LYS A 39 -7.012 -7.215 -4.024 1.00 0.00 C ATOM 536 CD LYS A 39 -7.321 -7.882 -5.353 1.00 0.00 C ATOM 537 CE LYS A 39 -8.578 -8.736 -5.271 1.00 0.00 C ATOM 538 NZ LYS A 39 -8.280 -10.117 -4.800 1.00 0.00 N ATOM 0 H LYS A 39 -7.373 -4.191 -2.400 1.00 0.00 H new ATOM 0 HA LYS A 39 -5.110 -6.105 -2.434 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -6.991 -5.165 -4.631 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.497 -6.024 -4.951 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.397 -7.879 -3.417 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.939 -7.049 -3.475 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -7.447 -7.120 -6.123 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -6.477 -8.503 -5.654 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -9.292 -8.267 -4.594 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -9.051 -8.781 -6.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -9.162 -10.667 -4.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -7.618 -10.574 -5.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -7.852 -10.076 -3.853 1.00 0.00 H new ATOM 552 N TRP A 40 -3.500 -4.290 -2.859 1.00 0.00 N ATOM 553 CA TRP A 40 -2.511 -3.249 -3.113 1.00 0.00 C ATOM 554 C TRP A 40 -1.782 -3.500 -4.428 1.00 0.00 C ATOM 555 O TRP A 40 -1.445 -4.638 -4.756 1.00 0.00 O ATOM 556 CB TRP A 40 -1.504 -3.182 -1.963 1.00 0.00 C ATOM 557 CG TRP A 40 -2.146 -2.980 -0.623 1.00 0.00 C ATOM 558 CD1 TRP A 40 -2.825 -3.911 0.110 1.00 0.00 C ATOM 559 CD2 TRP A 40 -2.170 -1.769 0.141 1.00 0.00 C ATOM 560 NE1 TRP A 40 -3.269 -3.352 1.284 1.00 0.00 N ATOM 561 CE2 TRP A 40 -2.880 -2.039 1.327 1.00 0.00 C ATOM 562 CE3 TRP A 40 -1.659 -0.484 -0.060 1.00 0.00 C ATOM 563 CZ2 TRP A 40 -3.091 -1.071 2.305 1.00 0.00 C ATOM 564 CZ3 TRP A 40 -1.870 0.476 0.911 1.00 0.00 C ATOM 565 CH2 TRP A 40 -2.580 0.179 2.082 1.00 0.00 C ATOM 0 H TRP A 40 -3.139 -5.103 -2.360 1.00 0.00 H new ATOM 0 HA TRP A 40 -3.034 -2.296 -3.185 1.00 0.00 H new ATOM 0 HB2 TRP A 40 -0.923 -4.104 -1.944 1.00 0.00 H new ATOM 0 HB3 TRP A 40 -0.804 -2.367 -2.149 1.00 0.00 H new ATOM 0 HD1 TRP A 40 -2.989 -4.936 -0.189 1.00 0.00 H new ATOM 0 HE1 TRP A 40 -3.802 -3.836 2.007 1.00 0.00 H new ATOM 0 HE3 TRP A 40 -1.109 -0.246 -0.958 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 -3.639 -1.298 3.208 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 -1.481 1.473 0.765 1.00 0.00 H new ATOM 0 HH2 TRP A 40 -2.727 0.951 2.823 1.00 0.00 H new ATOM 576 N PHE A 41 -1.541 -2.430 -5.180 1.00 0.00 N ATOM 577 CA PHE A 41 -0.852 -2.535 -6.461 1.00 0.00 C ATOM 578 C PHE A 41 0.215 -1.453 -6.594 1.00 0.00 C ATOM 579 O PHE A 41 -0.040 -0.277 -6.335 1.00 0.00 O ATOM 580 CB PHE A 41 -1.854 -2.424 -7.612 1.00 0.00 C ATOM 581 CG PHE A 41 -2.966 -3.431 -7.539 1.00 0.00 C ATOM 582 CD1 PHE A 41 -4.005 -3.270 -6.636 1.00 0.00 C ATOM 583 CD2 PHE A 41 -2.973 -4.537 -8.372 1.00 0.00 C ATOM 584 CE1 PHE A 41 -5.029 -4.195 -6.566 1.00 0.00 C ATOM 585 CE2 PHE A 41 -3.995 -5.466 -8.307 1.00 0.00 C ATOM 586 CZ PHE A 41 -5.025 -5.294 -7.403 1.00 0.00 C ATOM 0 H PHE A 41 -1.813 -1.481 -4.924 1.00 0.00 H new ATOM 0 HA PHE A 41 -0.364 -3.509 -6.505 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -2.282 -1.422 -7.615 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -1.325 -2.547 -8.557 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -4.014 -2.412 -5.980 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -2.170 -4.676 -9.081 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -5.832 -4.059 -5.857 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -3.988 -6.325 -8.962 1.00 0.00 H new ATOM 0 HZ PHE A 41 -5.825 -6.017 -7.351 1.00 0.00 H new ATOM 596 N LYS A 42 1.414 -1.860 -7.000 1.00 0.00 N ATOM 597 CA LYS A 42 2.522 -0.928 -7.169 1.00 0.00 C ATOM 598 C LYS A 42 2.722 -0.583 -8.641 1.00 0.00 C ATOM 599 O LYS A 42 3.193 -1.407 -9.423 1.00 0.00 O ATOM 600 CB LYS A 42 3.809 -1.524 -6.594 1.00 0.00 C ATOM 601 CG LYS A 42 5.072 -0.864 -7.120 1.00 0.00 C ATOM 602 CD LYS A 42 6.309 -1.373 -6.398 1.00 0.00 C ATOM 603 CE LYS A 42 7.557 -0.620 -6.831 1.00 0.00 C ATOM 604 NZ LYS A 42 8.157 -1.202 -8.063 1.00 0.00 N ATOM 0 H LYS A 42 1.642 -2.830 -7.218 1.00 0.00 H new ATOM 0 HA LYS A 42 2.280 -0.013 -6.629 1.00 0.00 H new ATOM 0 HB2 LYS A 42 3.787 -1.435 -5.508 1.00 0.00 H new ATOM 0 HB3 LYS A 42 3.842 -2.589 -6.826 1.00 0.00 H new ATOM 0 HG2 LYS A 42 5.167 -1.058 -8.188 1.00 0.00 H new ATOM 0 HG3 LYS A 42 4.997 0.217 -6.998 1.00 0.00 H new ATOM 0 HD2 LYS A 42 6.173 -1.266 -5.322 1.00 0.00 H new ATOM 0 HD3 LYS A 42 6.437 -2.437 -6.599 1.00 0.00 H new ATOM 0 HE2 LYS A 42 7.307 0.426 -7.008 1.00 0.00 H new ATOM 0 HE3 LYS A 42 8.291 -0.640 -6.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 9.005 -0.661 -8.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 8.419 -2.193 -7.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 7.466 -1.160 -8.839 1.00 0.00 H new ATOM 618 N ASN A 43 2.363 0.642 -9.011 1.00 0.00 N ATOM 619 CA ASN A 43 2.504 1.097 -10.390 1.00 0.00 C ATOM 620 C ASN A 43 1.615 0.283 -11.325 1.00 0.00 C ATOM 621 O ASN A 43 1.913 0.134 -12.509 1.00 0.00 O ATOM 622 CB ASN A 43 3.964 0.992 -10.836 1.00 0.00 C ATOM 623 CG ASN A 43 4.892 1.833 -9.981 1.00 0.00 C ATOM 624 OD1 ASN A 43 5.711 1.305 -9.230 1.00 0.00 O ATOM 625 ND2 ASN A 43 4.767 3.151 -10.093 1.00 0.00 N ATOM 0 H ASN A 43 1.972 1.338 -8.375 1.00 0.00 H new ATOM 0 HA ASN A 43 2.191 2.140 -10.437 1.00 0.00 H new ATOM 0 HB2 ASN A 43 4.280 -0.050 -10.793 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.047 1.308 -11.876 1.00 0.00 H new ATOM 0 HD21 ASN A 43 5.364 3.768 -9.543 1.00 0.00 H new ATOM 0 HD22 ASN A 43 4.074 3.545 -10.729 1.00 0.00 H new ATOM 632 N GLY A 44 0.520 -0.243 -10.783 1.00 0.00 N ATOM 633 CA GLY A 44 -0.396 -1.035 -11.583 1.00 0.00 C ATOM 634 C GLY A 44 -0.229 -2.523 -11.352 1.00 0.00 C ATOM 635 O GLY A 44 -1.159 -3.299 -11.568 1.00 0.00 O ATOM 0 H GLY A 44 0.251 -0.135 -9.805 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -1.421 -0.747 -11.349 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -0.236 -0.814 -12.638 1.00 0.00 H new ATOM 639 N GLU A 45 0.961 -2.923 -10.913 1.00 0.00 N ATOM 640 CA GLU A 45 1.246 -4.330 -10.656 1.00 0.00 C ATOM 641 C GLU A 45 0.717 -4.751 -9.288 1.00 0.00 C ATOM 642 O GLU A 45 0.773 -3.984 -8.327 1.00 0.00 O ATOM 643 CB GLU A 45 2.752 -4.590 -10.734 1.00 0.00 C ATOM 644 CG GLU A 45 3.291 -4.623 -12.154 1.00 0.00 C ATOM 645 CD GLU A 45 4.806 -4.660 -12.203 1.00 0.00 C ATOM 646 OE1 GLU A 45 5.406 -5.439 -11.432 1.00 0.00 O ATOM 647 OE2 GLU A 45 5.392 -3.910 -13.011 1.00 0.00 O ATOM 0 H GLU A 45 1.742 -2.293 -10.728 1.00 0.00 H new ATOM 0 HA GLU A 45 0.742 -4.922 -11.420 1.00 0.00 H new ATOM 0 HB2 GLU A 45 3.275 -3.815 -10.174 1.00 0.00 H new ATOM 0 HB3 GLU A 45 2.974 -5.540 -10.248 1.00 0.00 H new ATOM 0 HG2 GLU A 45 2.893 -5.497 -12.669 1.00 0.00 H new ATOM 0 HG3 GLU A 45 2.935 -3.746 -12.694 1.00 0.00 H new ATOM 654 N GLU A 46 0.202 -5.974 -9.210 1.00 0.00 N ATOM 655 CA GLU A 46 -0.339 -6.497 -7.961 1.00 0.00 C ATOM 656 C GLU A 46 0.782 -6.962 -7.035 1.00 0.00 C ATOM 657 O GLU A 46 1.761 -7.561 -7.481 1.00 0.00 O ATOM 658 CB GLU A 46 -1.299 -7.655 -8.240 1.00 0.00 C ATOM 659 CG GLU A 46 -1.797 -8.349 -6.983 1.00 0.00 C ATOM 660 CD GLU A 46 -3.101 -9.090 -7.204 1.00 0.00 C ATOM 661 OE1 GLU A 46 -3.985 -8.541 -7.895 1.00 0.00 O ATOM 662 OE2 GLU A 46 -3.238 -10.218 -6.686 1.00 0.00 O ATOM 0 H GLU A 46 0.148 -6.621 -9.997 1.00 0.00 H new ATOM 0 HA GLU A 46 -0.885 -5.694 -7.467 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -2.155 -7.279 -8.801 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -0.798 -8.386 -8.875 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -1.039 -9.051 -6.635 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -1.933 -7.610 -6.194 1.00 0.00 H new ATOM 669 N ILE A 47 0.630 -6.681 -5.745 1.00 0.00 N ATOM 670 CA ILE A 47 1.628 -7.071 -4.757 1.00 0.00 C ATOM 671 C ILE A 47 1.289 -8.422 -4.137 1.00 0.00 C ATOM 672 O ILE A 47 0.118 -8.756 -3.954 1.00 0.00 O ATOM 673 CB ILE A 47 1.752 -6.021 -3.637 1.00 0.00 C ATOM 674 CG1 ILE A 47 2.155 -4.666 -4.221 1.00 0.00 C ATOM 675 CG2 ILE A 47 2.761 -6.476 -2.594 1.00 0.00 C ATOM 676 CD1 ILE A 47 2.414 -3.609 -3.171 1.00 0.00 C ATOM 0 H ILE A 47 -0.174 -6.185 -5.360 1.00 0.00 H new ATOM 0 HA ILE A 47 2.580 -7.144 -5.282 1.00 0.00 H new ATOM 0 HB ILE A 47 0.782 -5.912 -3.152 1.00 0.00 H new ATOM 0 HG12 ILE A 47 3.052 -4.793 -4.826 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.367 -4.318 -4.889 1.00 0.00 H new ATOM 0 HG21 ILE A 47 2.837 -5.723 -1.809 1.00 0.00 H new ATOM 0 HG22 ILE A 47 2.435 -7.421 -2.160 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.735 -6.610 -3.064 1.00 0.00 H new ATOM 0 HD11 ILE A 47 2.695 -2.675 -3.657 1.00 0.00 H new ATOM 0 HD12 ILE A 47 1.511 -3.454 -2.581 1.00 0.00 H new ATOM 0 HD13 ILE A 47 3.223 -3.936 -2.518 1.00 0.00 H new ATOM 688 N ILE A 48 2.321 -9.195 -3.813 1.00 0.00 N ATOM 689 CA ILE A 48 2.132 -10.508 -3.211 1.00 0.00 C ATOM 690 C ILE A 48 3.052 -10.699 -2.010 1.00 0.00 C ATOM 691 O ILE A 48 4.178 -11.184 -2.130 1.00 0.00 O ATOM 692 CB ILE A 48 2.391 -11.636 -4.226 1.00 0.00 C ATOM 693 CG1 ILE A 48 1.503 -11.456 -5.459 1.00 0.00 C ATOM 694 CG2 ILE A 48 2.146 -12.994 -3.585 1.00 0.00 C ATOM 695 CD1 ILE A 48 2.079 -10.504 -6.485 1.00 0.00 C ATOM 0 H ILE A 48 3.296 -8.934 -3.958 1.00 0.00 H new ATOM 0 HA ILE A 48 1.094 -10.558 -2.883 1.00 0.00 H new ATOM 0 HB ILE A 48 3.433 -11.588 -4.541 1.00 0.00 H new ATOM 0 HG12 ILE A 48 1.343 -12.428 -5.926 1.00 0.00 H new ATOM 0 HG13 ILE A 48 0.526 -11.089 -5.143 1.00 0.00 H new ATOM 0 HG21 ILE A 48 2.334 -13.781 -4.316 1.00 0.00 H new ATOM 0 HG22 ILE A 48 2.816 -13.121 -2.735 1.00 0.00 H new ATOM 0 HG23 ILE A 48 1.112 -13.054 -3.244 1.00 0.00 H new ATOM 0 HD11 ILE A 48 1.397 -10.425 -7.331 1.00 0.00 H new ATOM 0 HD12 ILE A 48 2.213 -9.521 -6.034 1.00 0.00 H new ATOM 0 HD13 ILE A 48 3.042 -10.880 -6.830 1.00 0.00 H new ATOM 707 N PRO A 49 2.564 -10.312 -0.822 1.00 0.00 N ATOM 708 CA PRO A 49 3.325 -10.433 0.424 1.00 0.00 C ATOM 709 C PRO A 49 3.498 -11.884 0.859 1.00 0.00 C ATOM 710 O PRO A 49 3.119 -12.807 0.140 1.00 0.00 O ATOM 711 CB PRO A 49 2.469 -9.669 1.438 1.00 0.00 C ATOM 712 CG PRO A 49 1.085 -9.735 0.891 1.00 0.00 C ATOM 713 CD PRO A 49 1.231 -9.725 -0.605 1.00 0.00 C ATOM 0 HA PRO A 49 4.338 -10.044 0.322 1.00 0.00 H new ATOM 0 HB2 PRO A 49 2.526 -10.124 2.427 1.00 0.00 H new ATOM 0 HB3 PRO A 49 2.805 -8.637 1.542 1.00 0.00 H new ATOM 0 HG2 PRO A 49 0.575 -10.638 1.227 1.00 0.00 H new ATOM 0 HG3 PRO A 49 0.490 -8.887 1.231 1.00 0.00 H new ATOM 0 HD2 PRO A 49 0.450 -10.312 -1.089 1.00 0.00 H new ATOM 0 HD3 PRO A 49 1.167 -8.714 -1.008 1.00 0.00 H new ATOM 721 N GLY A 50 4.073 -12.078 2.042 1.00 0.00 N ATOM 722 CA GLY A 50 4.286 -13.420 2.553 1.00 0.00 C ATOM 723 C GLY A 50 5.404 -13.481 3.574 1.00 0.00 C ATOM 724 O GLY A 50 5.981 -12.463 3.957 1.00 0.00 O ATOM 0 H GLY A 50 4.395 -11.330 2.656 1.00 0.00 H new ATOM 0 HA2 GLY A 50 3.364 -13.783 3.007 1.00 0.00 H new ATOM 0 HA3 GLY A 50 4.518 -14.088 1.724 1.00 0.00 H new ATOM 775 N ARG A 54 9.034 -8.810 0.733 1.00 0.00 N ATOM 776 CA ARG A 54 9.362 -7.490 1.258 1.00 0.00 C ATOM 777 C ARG A 54 8.105 -6.765 1.730 1.00 0.00 C ATOM 778 O ARG A 54 8.099 -6.137 2.789 1.00 0.00 O ATOM 779 CB ARG A 54 10.074 -6.656 0.191 1.00 0.00 C ATOM 780 CG ARG A 54 11.536 -7.025 0.006 1.00 0.00 C ATOM 781 CD ARG A 54 12.162 -6.261 -1.150 1.00 0.00 C ATOM 782 NE ARG A 54 11.982 -6.951 -2.425 1.00 0.00 N ATOM 783 CZ ARG A 54 12.304 -6.422 -3.599 1.00 0.00 C ATOM 784 NH1 ARG A 54 12.820 -5.202 -3.662 1.00 0.00 N ATOM 785 NH2 ARG A 54 12.110 -7.113 -4.716 1.00 0.00 N ATOM 0 HA ARG A 54 10.027 -7.621 2.111 1.00 0.00 H new ATOM 0 HB2 ARG A 54 9.554 -6.777 -0.759 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.005 -5.602 0.460 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.085 -6.812 0.923 1.00 0.00 H new ATOM 0 HG3 ARG A 54 11.622 -8.096 -0.176 1.00 0.00 H new ATOM 0 HD2 ARG A 54 11.718 -5.267 -1.210 1.00 0.00 H new ATOM 0 HD3 ARG A 54 13.226 -6.124 -0.959 1.00 0.00 H new ATOM 0 HE ARG A 54 11.587 -7.891 -2.412 1.00 0.00 H new ATOM 0 HH11 ARG A 54 12.971 -4.667 -2.807 1.00 0.00 H new ATOM 0 HH12 ARG A 54 13.066 -4.799 -4.566 1.00 0.00 H new ATOM 0 HH21 ARG A 54 11.713 -8.052 -4.673 1.00 0.00 H new ATOM 0 HH22 ARG A 54 12.358 -6.705 -5.617 1.00 0.00 H new ATOM 799 N TYR A 55 7.042 -6.857 0.938 1.00 0.00 N ATOM 800 CA TYR A 55 5.781 -6.208 1.273 1.00 0.00 C ATOM 801 C TYR A 55 4.987 -7.042 2.274 1.00 0.00 C ATOM 802 O TYR A 55 4.891 -8.263 2.143 1.00 0.00 O ATOM 803 CB TYR A 55 4.949 -5.980 0.010 1.00 0.00 C ATOM 804 CG TYR A 55 5.691 -5.238 -1.079 1.00 0.00 C ATOM 805 CD1 TYR A 55 5.829 -3.856 -1.035 1.00 0.00 C ATOM 806 CD2 TYR A 55 6.255 -5.919 -2.151 1.00 0.00 C ATOM 807 CE1 TYR A 55 6.506 -3.174 -2.027 1.00 0.00 C ATOM 808 CE2 TYR A 55 6.935 -5.245 -3.147 1.00 0.00 C ATOM 809 CZ TYR A 55 7.057 -3.872 -3.081 1.00 0.00 C ATOM 810 OH TYR A 55 7.732 -3.197 -4.072 1.00 0.00 O ATOM 0 H TYR A 55 7.029 -7.375 0.059 1.00 0.00 H new ATOM 0 HA TYR A 55 6.008 -5.245 1.730 1.00 0.00 H new ATOM 0 HB2 TYR A 55 4.621 -6.944 -0.378 1.00 0.00 H new ATOM 0 HB3 TYR A 55 4.051 -5.420 0.273 1.00 0.00 H new ATOM 0 HD1 TYR A 55 5.399 -3.306 -0.211 1.00 0.00 H new ATOM 0 HD2 TYR A 55 6.160 -6.993 -2.206 1.00 0.00 H new ATOM 0 HE1 TYR A 55 6.603 -2.100 -1.978 1.00 0.00 H new ATOM 0 HE2 TYR A 55 7.369 -5.790 -3.973 1.00 0.00 H new ATOM 0 HH TYR A 55 8.059 -3.836 -4.739 1.00 0.00 H new ATOM 820 N ARG A 56 4.421 -6.375 3.273 1.00 0.00 N ATOM 821 CA ARG A 56 3.636 -7.053 4.298 1.00 0.00 C ATOM 822 C ARG A 56 2.322 -6.320 4.551 1.00 0.00 C ATOM 823 O ARG A 56 2.309 -5.234 5.132 1.00 0.00 O ATOM 824 CB ARG A 56 4.435 -7.155 5.598 1.00 0.00 C ATOM 825 CG ARG A 56 5.871 -7.610 5.397 1.00 0.00 C ATOM 826 CD ARG A 56 6.778 -7.097 6.504 1.00 0.00 C ATOM 827 NE ARG A 56 6.516 -7.761 7.778 1.00 0.00 N ATOM 828 CZ ARG A 56 7.148 -7.461 8.908 1.00 0.00 C ATOM 829 NH1 ARG A 56 8.074 -6.513 8.921 1.00 0.00 N ATOM 830 NH2 ARG A 56 6.853 -8.110 10.027 1.00 0.00 N ATOM 0 H ARG A 56 4.491 -5.365 3.395 1.00 0.00 H new ATOM 0 HA ARG A 56 3.408 -8.057 3.940 1.00 0.00 H new ATOM 0 HB2 ARG A 56 4.437 -6.183 6.091 1.00 0.00 H new ATOM 0 HB3 ARG A 56 3.933 -7.852 6.269 1.00 0.00 H new ATOM 0 HG2 ARG A 56 5.908 -8.699 5.370 1.00 0.00 H new ATOM 0 HG3 ARG A 56 6.235 -7.255 4.433 1.00 0.00 H new ATOM 0 HD2 ARG A 56 7.819 -7.253 6.221 1.00 0.00 H new ATOM 0 HD3 ARG A 56 6.637 -6.022 6.620 1.00 0.00 H new ATOM 0 HE ARG A 56 5.809 -8.496 7.802 1.00 0.00 H new ATOM 0 HH11 ARG A 56 8.303 -6.012 8.063 1.00 0.00 H new ATOM 0 HH12 ARG A 56 8.558 -6.284 9.789 1.00 0.00 H new ATOM 0 HH21 ARG A 56 6.141 -8.840 10.021 1.00 0.00 H new ATOM 0 HH22 ARG A 56 7.339 -7.879 10.894 1.00 0.00 H new ATOM 844 N ILE A 57 1.221 -6.920 4.112 1.00 0.00 N ATOM 845 CA ILE A 57 -0.097 -6.324 4.293 1.00 0.00 C ATOM 846 C ILE A 57 -0.720 -6.757 5.615 1.00 0.00 C ATOM 847 O ILE A 57 -0.931 -7.947 5.853 1.00 0.00 O ATOM 848 CB ILE A 57 -1.048 -6.701 3.141 1.00 0.00 C ATOM 849 CG1 ILE A 57 -0.482 -6.218 1.804 1.00 0.00 C ATOM 850 CG2 ILE A 57 -2.430 -6.113 3.382 1.00 0.00 C ATOM 851 CD1 ILE A 57 -0.976 -7.014 0.616 1.00 0.00 C ATOM 0 H ILE A 57 1.215 -7.818 3.629 1.00 0.00 H new ATOM 0 HA ILE A 57 0.044 -5.243 4.298 1.00 0.00 H new ATOM 0 HB ILE A 57 -1.138 -7.787 3.104 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -0.746 -5.170 1.664 1.00 0.00 H new ATOM 0 HG13 ILE A 57 0.606 -6.270 1.839 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -3.091 -6.388 2.560 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -2.833 -6.502 4.317 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -2.358 -5.027 3.442 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.534 -6.616 -0.298 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.688 -8.059 0.733 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -2.062 -6.941 0.555 1.00 0.00 H new ATOM 863 N ARG A 58 -1.014 -5.784 6.471 1.00 0.00 N ATOM 864 CA ARG A 58 -1.615 -6.065 7.770 1.00 0.00 C ATOM 865 C ARG A 58 -3.007 -5.448 7.870 1.00 0.00 C ATOM 866 O ARG A 58 -3.237 -4.331 7.408 1.00 0.00 O ATOM 867 CB ARG A 58 -0.725 -5.529 8.893 1.00 0.00 C ATOM 868 CG ARG A 58 -1.388 -5.557 10.261 1.00 0.00 C ATOM 869 CD ARG A 58 -0.712 -4.598 11.227 1.00 0.00 C ATOM 870 NE ARG A 58 0.698 -4.923 11.424 1.00 0.00 N ATOM 871 CZ ARG A 58 1.120 -6.000 12.078 1.00 0.00 C ATOM 872 NH1 ARG A 58 0.244 -6.851 12.595 1.00 0.00 N ATOM 873 NH2 ARG A 58 2.420 -6.227 12.216 1.00 0.00 N ATOM 0 H ARG A 58 -0.846 -4.795 6.289 1.00 0.00 H new ATOM 0 HA ARG A 58 -1.708 -7.146 7.874 1.00 0.00 H new ATOM 0 HB2 ARG A 58 0.192 -6.117 8.931 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -0.437 -4.504 8.659 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -2.441 -5.293 10.162 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -1.350 -6.569 10.664 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -0.800 -3.580 10.848 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -1.228 -4.626 12.187 1.00 0.00 H new ATOM 0 HE ARG A 58 1.397 -4.288 11.038 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -0.756 -6.679 12.491 1.00 0.00 H new ATOM 0 HH12 ARG A 58 0.570 -7.677 13.097 1.00 0.00 H new ATOM 0 HH21 ARG A 58 3.097 -5.574 11.820 1.00 0.00 H new ATOM 0 HH22 ARG A 58 2.743 -7.054 12.718 1.00 0.00 H new ATOM 887 N VAL A 59 -3.932 -6.184 8.477 1.00 0.00 N ATOM 888 CA VAL A 59 -5.301 -5.709 8.639 1.00 0.00 C ATOM 889 C VAL A 59 -5.632 -5.475 10.109 1.00 0.00 C ATOM 890 O VAL A 59 -5.579 -6.398 10.921 1.00 0.00 O ATOM 891 CB VAL A 59 -6.315 -6.708 8.049 1.00 0.00 C ATOM 892 CG1 VAL A 59 -7.737 -6.208 8.253 1.00 0.00 C ATOM 893 CG2 VAL A 59 -6.031 -6.945 6.573 1.00 0.00 C ATOM 0 H VAL A 59 -3.759 -7.111 8.865 1.00 0.00 H new ATOM 0 HA VAL A 59 -5.374 -4.765 8.099 1.00 0.00 H new ATOM 0 HB VAL A 59 -6.211 -7.658 8.573 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -8.439 -6.926 7.830 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -7.933 -6.093 9.319 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -7.859 -5.246 7.756 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -6.756 -7.653 6.172 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -6.107 -6.002 6.032 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -5.026 -7.350 6.456 1.00 0.00 H new ATOM 903 N GLU A 60 -5.973 -4.235 10.443 1.00 0.00 N ATOM 904 CA GLU A 60 -6.312 -3.880 11.816 1.00 0.00 C ATOM 905 C GLU A 60 -7.681 -3.208 11.882 1.00 0.00 C ATOM 906 O GLU A 60 -7.816 -2.020 11.593 1.00 0.00 O ATOM 907 CB GLU A 60 -5.247 -2.952 12.404 1.00 0.00 C ATOM 908 CG GLU A 60 -4.098 -3.689 13.070 1.00 0.00 C ATOM 909 CD GLU A 60 -3.451 -2.881 14.179 1.00 0.00 C ATOM 910 OE1 GLU A 60 -2.617 -2.007 13.866 1.00 0.00 O ATOM 911 OE2 GLU A 60 -3.780 -3.124 15.359 1.00 0.00 O ATOM 0 H GLU A 60 -6.022 -3.460 9.782 1.00 0.00 H new ATOM 0 HA GLU A 60 -6.348 -4.798 12.403 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -4.850 -2.319 11.610 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -5.715 -2.292 13.134 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -4.464 -4.631 13.478 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -3.347 -3.936 12.320 1.00 0.00 H new ATOM 918 N GLY A 61 -8.694 -3.979 12.265 1.00 0.00 N ATOM 919 CA GLY A 61 -10.039 -3.443 12.362 1.00 0.00 C ATOM 920 C GLY A 61 -10.614 -3.072 11.010 1.00 0.00 C ATOM 921 O GLY A 61 -10.811 -3.933 10.152 1.00 0.00 O ATOM 0 H GLY A 61 -8.607 -4.965 12.510 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -10.686 -4.179 12.839 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -10.030 -2.562 13.004 1.00 0.00 H new ATOM 925 N LYS A 62 -10.886 -1.785 10.817 1.00 0.00 N ATOM 926 CA LYS A 62 -11.443 -1.300 9.560 1.00 0.00 C ATOM 927 C LYS A 62 -10.413 -0.481 8.789 1.00 0.00 C ATOM 928 O LYS A 62 -10.756 0.257 7.865 1.00 0.00 O ATOM 929 CB LYS A 62 -12.690 -0.454 9.823 1.00 0.00 C ATOM 930 CG LYS A 62 -13.814 -1.221 10.498 1.00 0.00 C ATOM 931 CD LYS A 62 -14.949 -0.299 10.910 1.00 0.00 C ATOM 932 CE LYS A 62 -15.960 -0.123 9.787 1.00 0.00 C ATOM 933 NZ LYS A 62 -17.312 0.222 10.307 1.00 0.00 N ATOM 0 H LYS A 62 -10.729 -1.059 11.516 1.00 0.00 H new ATOM 0 HA LYS A 62 -11.719 -2.165 8.957 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -12.417 0.397 10.447 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -13.053 -0.052 8.877 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -14.193 -1.985 9.819 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -13.427 -1.738 11.376 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -15.448 -0.705 11.790 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -14.545 0.673 11.193 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -15.620 0.662 9.112 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -16.019 -1.042 9.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -17.972 0.333 9.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -17.648 -0.539 10.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -17.261 1.112 10.842 1.00 0.00 H new ATOM 947 N LYS A 63 -9.148 -0.616 9.173 1.00 0.00 N ATOM 948 CA LYS A 63 -8.067 0.109 8.517 1.00 0.00 C ATOM 949 C LYS A 63 -6.884 -0.813 8.238 1.00 0.00 C ATOM 950 O LYS A 63 -6.450 -1.564 9.111 1.00 0.00 O ATOM 951 CB LYS A 63 -7.615 1.287 9.384 1.00 0.00 C ATOM 952 CG LYS A 63 -6.576 0.912 10.426 1.00 0.00 C ATOM 953 CD LYS A 63 -6.657 1.816 11.645 1.00 0.00 C ATOM 954 CE LYS A 63 -7.676 1.304 12.651 1.00 0.00 C ATOM 955 NZ LYS A 63 -7.852 2.247 13.790 1.00 0.00 N ATOM 0 H LYS A 63 -8.846 -1.222 9.936 1.00 0.00 H new ATOM 0 HA LYS A 63 -8.442 0.488 7.566 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -7.207 2.066 8.740 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -8.484 1.712 9.886 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -6.722 -0.124 10.730 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -5.580 0.978 9.988 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -5.677 1.879 12.118 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.927 2.825 11.334 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -8.634 1.153 12.153 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -7.357 0.333 13.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -8.554 1.862 14.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -6.944 2.372 14.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -8.181 3.166 13.432 1.00 0.00 H new ATOM 969 N HIS A 64 -6.365 -0.749 7.015 1.00 0.00 N ATOM 970 CA HIS A 64 -5.231 -1.577 6.622 1.00 0.00 C ATOM 971 C HIS A 64 -3.924 -0.797 6.736 1.00 0.00 C ATOM 972 O HIS A 64 -3.930 0.428 6.865 1.00 0.00 O ATOM 973 CB HIS A 64 -5.413 -2.083 5.191 1.00 0.00 C ATOM 974 CG HIS A 64 -6.604 -2.976 5.019 1.00 0.00 C ATOM 975 ND1 HIS A 64 -6.523 -4.242 4.480 1.00 0.00 N ATOM 976 CD2 HIS A 64 -7.909 -2.779 5.319 1.00 0.00 C ATOM 977 CE1 HIS A 64 -7.727 -4.785 4.455 1.00 0.00 C ATOM 978 NE2 HIS A 64 -8.586 -3.918 4.960 1.00 0.00 N ATOM 0 H HIS A 64 -6.712 -0.133 6.280 1.00 0.00 H new ATOM 0 HA HIS A 64 -5.185 -2.431 7.298 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -5.510 -1.228 4.522 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -4.516 -2.624 4.889 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -8.338 -1.891 5.759 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -7.968 -5.770 4.085 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -9.589 -4.070 5.066 1.00 0.00 H new ATOM 987 N ILE A 65 -2.807 -1.514 6.687 1.00 0.00 N ATOM 988 CA ILE A 65 -1.493 -0.889 6.784 1.00 0.00 C ATOM 989 C ILE A 65 -0.463 -1.643 5.950 1.00 0.00 C ATOM 990 O ILE A 65 -0.164 -2.808 6.217 1.00 0.00 O ATOM 991 CB ILE A 65 -1.008 -0.824 8.244 1.00 0.00 C ATOM 992 CG1 ILE A 65 -1.947 0.049 9.078 1.00 0.00 C ATOM 993 CG2 ILE A 65 0.415 -0.288 8.305 1.00 0.00 C ATOM 994 CD1 ILE A 65 -3.094 -0.719 9.698 1.00 0.00 C ATOM 0 H ILE A 65 -2.785 -2.528 6.581 1.00 0.00 H new ATOM 0 HA ILE A 65 -1.596 0.125 6.399 1.00 0.00 H new ATOM 0 HB ILE A 65 -1.015 -1.832 8.659 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -1.374 0.532 9.869 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -2.350 0.841 8.447 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.744 -0.248 9.343 1.00 0.00 H new ATOM 0 HG22 ILE A 65 1.076 -0.945 7.740 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.445 0.713 7.876 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -3.719 -0.037 10.275 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -3.691 -1.180 8.911 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -2.700 -1.494 10.355 1.00 0.00 H new ATOM 1006 N LEU A 66 0.079 -0.971 4.941 1.00 0.00 N ATOM 1007 CA LEU A 66 1.079 -1.577 4.068 1.00 0.00 C ATOM 1008 C LEU A 66 2.482 -1.109 4.441 1.00 0.00 C ATOM 1009 O LEU A 66 2.831 0.056 4.247 1.00 0.00 O ATOM 1010 CB LEU A 66 0.785 -1.231 2.607 1.00 0.00 C ATOM 1011 CG LEU A 66 1.761 -1.798 1.574 1.00 0.00 C ATOM 1012 CD1 LEU A 66 1.634 -3.311 1.494 1.00 0.00 C ATOM 1013 CD2 LEU A 66 1.519 -1.167 0.211 1.00 0.00 C ATOM 0 H LEU A 66 -0.157 -0.007 4.707 1.00 0.00 H new ATOM 0 HA LEU A 66 1.031 -2.658 4.196 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.217 -1.586 2.365 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.771 -0.146 2.507 1.00 0.00 H new ATOM 0 HG LEU A 66 2.776 -1.556 1.889 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.336 -3.696 0.754 1.00 0.00 H new ATOM 0 HD12 LEU A 66 1.857 -3.747 2.468 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.618 -3.576 1.203 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.222 -1.582 -0.512 1.00 0.00 H new ATOM 0 HD22 LEU A 66 0.500 -1.378 -0.112 1.00 0.00 H new ATOM 0 HD23 LEU A 66 1.662 -0.089 0.279 1.00 0.00 H new ATOM 1025 N ILE A 67 3.283 -2.025 4.974 1.00 0.00 N ATOM 1026 CA ILE A 67 4.649 -1.707 5.371 1.00 0.00 C ATOM 1027 C ILE A 67 5.649 -2.167 4.316 1.00 0.00 C ATOM 1028 O ILE A 67 5.520 -3.257 3.757 1.00 0.00 O ATOM 1029 CB ILE A 67 5.009 -2.354 6.721 1.00 0.00 C ATOM 1030 CG1 ILE A 67 6.473 -2.078 7.070 1.00 0.00 C ATOM 1031 CG2 ILE A 67 4.743 -3.852 6.678 1.00 0.00 C ATOM 1032 CD1 ILE A 67 7.443 -3.032 6.407 1.00 0.00 C ATOM 0 H ILE A 67 3.010 -2.993 5.141 1.00 0.00 H new ATOM 0 HA ILE A 67 4.704 -0.623 5.472 1.00 0.00 H new ATOM 0 HB ILE A 67 4.381 -1.915 7.496 1.00 0.00 H new ATOM 0 HG12 ILE A 67 6.722 -1.058 6.777 1.00 0.00 H new ATOM 0 HG13 ILE A 67 6.598 -2.139 8.151 1.00 0.00 H new ATOM 0 HG21 ILE A 67 5.002 -4.295 7.639 1.00 0.00 H new ATOM 0 HG22 ILE A 67 3.688 -4.028 6.470 1.00 0.00 H new ATOM 0 HG23 ILE A 67 5.348 -4.307 5.894 1.00 0.00 H new ATOM 0 HD11 ILE A 67 8.462 -2.777 6.699 1.00 0.00 H new ATOM 0 HD12 ILE A 67 7.221 -4.052 6.719 1.00 0.00 H new ATOM 0 HD13 ILE A 67 7.346 -2.955 5.324 1.00 0.00 H new ATOM 1044 N ILE A 68 6.647 -1.332 4.049 1.00 0.00 N ATOM 1045 CA ILE A 68 7.671 -1.655 3.064 1.00 0.00 C ATOM 1046 C ILE A 68 9.061 -1.647 3.692 1.00 0.00 C ATOM 1047 O ILE A 68 9.627 -0.587 3.955 1.00 0.00 O ATOM 1048 CB ILE A 68 7.649 -0.666 1.883 1.00 0.00 C ATOM 1049 CG1 ILE A 68 6.211 -0.433 1.412 1.00 0.00 C ATOM 1050 CG2 ILE A 68 8.508 -1.185 0.740 1.00 0.00 C ATOM 1051 CD1 ILE A 68 6.085 0.658 0.372 1.00 0.00 C ATOM 0 H ILE A 68 6.768 -0.426 4.502 1.00 0.00 H new ATOM 0 HA ILE A 68 7.447 -2.656 2.694 1.00 0.00 H new ATOM 0 HB ILE A 68 8.062 0.286 2.218 1.00 0.00 H new ATOM 0 HG12 ILE A 68 5.817 -1.363 1.001 1.00 0.00 H new ATOM 0 HG13 ILE A 68 5.593 -0.177 2.272 1.00 0.00 H new ATOM 0 HG21 ILE A 68 8.482 -0.475 -0.086 1.00 0.00 H new ATOM 0 HG22 ILE A 68 9.536 -1.305 1.083 1.00 0.00 H new ATOM 0 HG23 ILE A 68 8.123 -2.148 0.403 1.00 0.00 H new ATOM 0 HD11 ILE A 68 5.039 0.768 0.085 1.00 0.00 H new ATOM 0 HD12 ILE A 68 6.449 1.599 0.786 1.00 0.00 H new ATOM 0 HD13 ILE A 68 6.676 0.395 -0.505 1.00 0.00 H new ATOM 1063 N GLU A 69 9.605 -2.837 3.927 1.00 0.00 N ATOM 1064 CA GLU A 69 10.929 -2.966 4.523 1.00 0.00 C ATOM 1065 C GLU A 69 12.011 -2.507 3.550 1.00 0.00 C ATOM 1066 O GLU A 69 12.305 -3.185 2.566 1.00 0.00 O ATOM 1067 CB GLU A 69 11.185 -4.416 4.941 1.00 0.00 C ATOM 1068 CG GLU A 69 10.717 -4.735 6.351 1.00 0.00 C ATOM 1069 CD GLU A 69 10.711 -6.223 6.641 1.00 0.00 C ATOM 1070 OE1 GLU A 69 10.581 -7.014 5.684 1.00 0.00 O ATOM 1071 OE2 GLU A 69 10.835 -6.596 7.827 1.00 0.00 O ATOM 0 H GLU A 69 9.150 -3.724 3.714 1.00 0.00 H new ATOM 0 HA GLU A 69 10.965 -2.329 5.406 1.00 0.00 H new ATOM 0 HB2 GLU A 69 10.681 -5.082 4.241 1.00 0.00 H new ATOM 0 HB3 GLU A 69 12.252 -4.624 4.866 1.00 0.00 H new ATOM 0 HG2 GLU A 69 11.366 -4.232 7.068 1.00 0.00 H new ATOM 0 HG3 GLU A 69 9.713 -4.336 6.495 1.00 0.00 H new ATOM 1078 N GLY A 70 12.601 -1.350 3.833 1.00 0.00 N ATOM 1079 CA GLY A 70 13.643 -0.819 2.974 1.00 0.00 C ATOM 1080 C GLY A 70 13.086 -0.121 1.749 1.00 0.00 C ATOM 1081 O GLY A 70 12.850 -0.754 0.720 1.00 0.00 O ATOM 0 H GLY A 70 12.376 -0.771 4.642 1.00 0.00 H new ATOM 0 HA2 GLY A 70 14.255 -0.117 3.541 1.00 0.00 H new ATOM 0 HA3 GLY A 70 14.299 -1.631 2.659 1.00 0.00 H new ATOM 1085 N ALA A 71 12.872 1.186 1.860 1.00 0.00 N ATOM 1086 CA ALA A 71 12.339 1.969 0.753 1.00 0.00 C ATOM 1087 C ALA A 71 13.462 2.559 -0.093 1.00 0.00 C ATOM 1088 O ALA A 71 14.048 3.583 0.261 1.00 0.00 O ATOM 1089 CB ALA A 71 11.433 3.074 1.276 1.00 0.00 C ATOM 0 H ALA A 71 13.060 1.724 2.706 1.00 0.00 H new ATOM 0 HA ALA A 71 11.753 1.304 0.119 1.00 0.00 H new ATOM 0 HB1 ALA A 71 11.042 3.651 0.438 1.00 0.00 H new ATOM 0 HB2 ALA A 71 10.605 2.633 1.831 1.00 0.00 H new ATOM 0 HB3 ALA A 71 12.002 3.730 1.934 1.00 0.00 H new ATOM 1095 N THR A 72 13.758 1.908 -1.213 1.00 0.00 N ATOM 1096 CA THR A 72 14.812 2.367 -2.108 1.00 0.00 C ATOM 1097 C THR A 72 14.245 3.235 -3.226 1.00 0.00 C ATOM 1098 O THR A 72 13.036 3.448 -3.307 1.00 0.00 O ATOM 1099 CB THR A 72 15.576 1.183 -2.731 1.00 0.00 C ATOM 1100 OG1 THR A 72 14.650 0.200 -3.210 1.00 0.00 O ATOM 1101 CG2 THR A 72 16.515 0.550 -1.716 1.00 0.00 C ATOM 0 H THR A 72 13.282 1.060 -1.522 1.00 0.00 H new ATOM 0 HA THR A 72 15.502 2.959 -1.506 1.00 0.00 H new ATOM 0 HB THR A 72 16.169 1.560 -3.564 1.00 0.00 H new ATOM 0 HG1 THR A 72 13.739 0.559 -3.165 1.00 0.00 H new ATOM 0 HG21 THR A 72 17.043 -0.283 -2.179 1.00 0.00 H new ATOM 0 HG22 THR A 72 17.237 1.293 -1.375 1.00 0.00 H new ATOM 0 HG23 THR A 72 15.939 0.187 -0.865 1.00 0.00 H new ATOM 1109 N LYS A 73 15.127 3.734 -4.086 1.00 0.00 N ATOM 1110 CA LYS A 73 14.714 4.579 -5.200 1.00 0.00 C ATOM 1111 C LYS A 73 13.572 3.934 -5.978 1.00 0.00 C ATOM 1112 O LYS A 73 12.588 4.592 -6.314 1.00 0.00 O ATOM 1113 CB LYS A 73 15.898 4.839 -6.135 1.00 0.00 C ATOM 1114 CG LYS A 73 16.708 6.069 -5.762 1.00 0.00 C ATOM 1115 CD LYS A 73 17.706 5.766 -4.657 1.00 0.00 C ATOM 1116 CE LYS A 73 18.532 6.992 -4.300 1.00 0.00 C ATOM 1117 NZ LYS A 73 19.724 7.133 -5.181 1.00 0.00 N ATOM 0 H LYS A 73 16.132 3.568 -4.033 1.00 0.00 H new ATOM 0 HA LYS A 73 14.363 5.528 -4.793 1.00 0.00 H new ATOM 0 HB2 LYS A 73 16.553 3.968 -6.130 1.00 0.00 H new ATOM 0 HB3 LYS A 73 15.528 4.953 -7.154 1.00 0.00 H new ATOM 0 HG2 LYS A 73 17.238 6.437 -6.641 1.00 0.00 H new ATOM 0 HG3 LYS A 73 16.036 6.864 -5.439 1.00 0.00 H new ATOM 0 HD2 LYS A 73 17.175 5.414 -3.773 1.00 0.00 H new ATOM 0 HD3 LYS A 73 18.368 4.960 -4.974 1.00 0.00 H new ATOM 0 HE2 LYS A 73 17.912 7.884 -4.383 1.00 0.00 H new ATOM 0 HE3 LYS A 73 18.854 6.923 -3.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 20.261 7.980 -4.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 20.329 6.293 -5.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 19.416 7.225 -6.170 1.00 0.00 H new ATOM 1131 N ALA A 74 13.709 2.642 -6.260 1.00 0.00 N ATOM 1132 CA ALA A 74 12.686 1.908 -6.994 1.00 0.00 C ATOM 1133 C ALA A 74 11.394 1.812 -6.190 1.00 0.00 C ATOM 1134 O ALA A 74 10.299 1.921 -6.741 1.00 0.00 O ATOM 1135 CB ALA A 74 13.190 0.519 -7.355 1.00 0.00 C ATOM 0 H ALA A 74 14.518 2.083 -5.991 1.00 0.00 H new ATOM 0 HA ALA A 74 12.471 2.455 -7.912 1.00 0.00 H new ATOM 0 HB1 ALA A 74 12.416 -0.018 -7.903 1.00 0.00 H new ATOM 0 HB2 ALA A 74 14.081 0.605 -7.977 1.00 0.00 H new ATOM 0 HB3 ALA A 74 13.435 -0.027 -6.444 1.00 0.00 H new ATOM 1141 N ASP A 75 11.530 1.606 -4.884 1.00 0.00 N ATOM 1142 CA ASP A 75 10.373 1.495 -4.003 1.00 0.00 C ATOM 1143 C ASP A 75 9.460 2.708 -4.150 1.00 0.00 C ATOM 1144 O ASP A 75 8.245 2.606 -3.986 1.00 0.00 O ATOM 1145 CB ASP A 75 10.825 1.355 -2.549 1.00 0.00 C ATOM 1146 CG ASP A 75 11.345 -0.034 -2.235 1.00 0.00 C ATOM 1147 OD1 ASP A 75 12.128 -0.572 -3.046 1.00 0.00 O ATOM 1148 OD2 ASP A 75 10.970 -0.583 -1.178 1.00 0.00 O ATOM 0 H ASP A 75 12.430 1.513 -4.412 1.00 0.00 H new ATOM 0 HA ASP A 75 9.813 0.605 -4.289 1.00 0.00 H new ATOM 0 HB2 ASP A 75 11.606 2.087 -2.342 1.00 0.00 H new ATOM 0 HB3 ASP A 75 9.989 1.585 -1.888 1.00 0.00 H new ATOM 1153 N ALA A 76 10.054 3.856 -4.460 1.00 0.00 N ATOM 1154 CA ALA A 76 9.294 5.088 -4.631 1.00 0.00 C ATOM 1155 C ALA A 76 8.407 5.019 -5.869 1.00 0.00 C ATOM 1156 O ALA A 76 8.834 5.363 -6.970 1.00 0.00 O ATOM 1157 CB ALA A 76 10.235 6.280 -4.719 1.00 0.00 C ATOM 0 H ALA A 76 11.059 3.958 -4.598 1.00 0.00 H new ATOM 0 HA ALA A 76 8.649 5.212 -3.761 1.00 0.00 H new ATOM 0 HB1 ALA A 76 9.654 7.193 -4.847 1.00 0.00 H new ATOM 0 HB2 ALA A 76 10.822 6.348 -3.803 1.00 0.00 H new ATOM 0 HB3 ALA A 76 10.904 6.153 -5.570 1.00 0.00 H new ATOM 1163 N ALA A 77 7.170 4.571 -5.680 1.00 0.00 N ATOM 1164 CA ALA A 77 6.222 4.458 -6.782 1.00 0.00 C ATOM 1165 C ALA A 77 4.803 4.768 -6.319 1.00 0.00 C ATOM 1166 O ALA A 77 4.549 4.915 -5.124 1.00 0.00 O ATOM 1167 CB ALA A 77 6.288 3.067 -7.394 1.00 0.00 C ATOM 0 H ALA A 77 6.801 4.281 -4.775 1.00 0.00 H new ATOM 0 HA ALA A 77 6.496 5.190 -7.541 1.00 0.00 H new ATOM 0 HB1 ALA A 77 5.575 2.997 -8.215 1.00 0.00 H new ATOM 0 HB2 ALA A 77 7.294 2.882 -7.770 1.00 0.00 H new ATOM 0 HB3 ALA A 77 6.042 2.324 -6.636 1.00 0.00 H new ATOM 1173 N GLU A 78 3.882 4.867 -7.273 1.00 0.00 N ATOM 1174 CA GLU A 78 2.488 5.161 -6.961 1.00 0.00 C ATOM 1175 C GLU A 78 1.769 3.914 -6.455 1.00 0.00 C ATOM 1176 O GLU A 78 1.390 3.042 -7.238 1.00 0.00 O ATOM 1177 CB GLU A 78 1.772 5.711 -8.196 1.00 0.00 C ATOM 1178 CG GLU A 78 0.284 5.940 -7.985 1.00 0.00 C ATOM 1179 CD GLU A 78 -0.389 6.553 -9.197 1.00 0.00 C ATOM 1180 OE1 GLU A 78 0.149 7.540 -9.740 1.00 0.00 O ATOM 1181 OE2 GLU A 78 -1.456 6.045 -9.603 1.00 0.00 O ATOM 0 H GLU A 78 4.076 4.748 -8.267 1.00 0.00 H new ATOM 0 HA GLU A 78 2.469 5.914 -6.173 1.00 0.00 H new ATOM 0 HB2 GLU A 78 2.238 6.652 -8.487 1.00 0.00 H new ATOM 0 HB3 GLU A 78 1.910 5.017 -9.025 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.196 4.990 -7.749 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.139 6.593 -7.124 1.00 0.00 H new ATOM 1188 N TYR A 79 1.585 3.836 -5.142 1.00 0.00 N ATOM 1189 CA TYR A 79 0.915 2.695 -4.530 1.00 0.00 C ATOM 1190 C TYR A 79 -0.596 2.906 -4.495 1.00 0.00 C ATOM 1191 O TYR A 79 -1.095 3.793 -3.803 1.00 0.00 O ATOM 1192 CB TYR A 79 1.441 2.467 -3.112 1.00 0.00 C ATOM 1193 CG TYR A 79 2.845 1.907 -3.071 1.00 0.00 C ATOM 1194 CD1 TYR A 79 3.951 2.739 -3.196 1.00 0.00 C ATOM 1195 CD2 TYR A 79 3.066 0.545 -2.908 1.00 0.00 C ATOM 1196 CE1 TYR A 79 5.235 2.231 -3.159 1.00 0.00 C ATOM 1197 CE2 TYR A 79 4.346 0.028 -2.869 1.00 0.00 C ATOM 1198 CZ TYR A 79 5.428 0.875 -2.995 1.00 0.00 C ATOM 1199 OH TYR A 79 6.705 0.364 -2.958 1.00 0.00 O ATOM 0 H TYR A 79 1.891 4.550 -4.481 1.00 0.00 H new ATOM 0 HA TYR A 79 1.128 1.814 -5.135 1.00 0.00 H new ATOM 0 HB2 TYR A 79 1.419 3.412 -2.569 1.00 0.00 H new ATOM 0 HB3 TYR A 79 0.771 1.784 -2.590 1.00 0.00 H new ATOM 0 HD1 TYR A 79 3.804 3.801 -3.324 1.00 0.00 H new ATOM 0 HD2 TYR A 79 2.222 -0.121 -2.810 1.00 0.00 H new ATOM 0 HE1 TYR A 79 6.083 2.892 -3.258 1.00 0.00 H new ATOM 0 HE2 TYR A 79 4.499 -1.033 -2.741 1.00 0.00 H new ATOM 0 HH TYR A 79 7.338 1.042 -3.273 1.00 0.00 H new ATOM 1209 N SER A 80 -1.319 2.083 -5.248 1.00 0.00 N ATOM 1210 CA SER A 80 -2.773 2.179 -5.307 1.00 0.00 C ATOM 1211 C SER A 80 -3.423 0.869 -4.872 1.00 0.00 C ATOM 1212 O SER A 80 -2.983 -0.214 -5.259 1.00 0.00 O ATOM 1213 CB SER A 80 -3.224 2.540 -6.723 1.00 0.00 C ATOM 1214 OG SER A 80 -2.540 3.685 -7.200 1.00 0.00 O ATOM 0 H SER A 80 -0.922 1.342 -5.826 1.00 0.00 H new ATOM 0 HA SER A 80 -3.088 2.965 -4.621 1.00 0.00 H new ATOM 0 HB2 SER A 80 -3.041 1.699 -7.392 1.00 0.00 H new ATOM 0 HB3 SER A 80 -4.298 2.725 -6.730 1.00 0.00 H new ATOM 0 HG SER A 80 -2.845 3.894 -8.108 1.00 0.00 H new ATOM 1220 N VAL A 81 -4.472 0.976 -4.063 1.00 0.00 N ATOM 1221 CA VAL A 81 -5.184 -0.199 -3.576 1.00 0.00 C ATOM 1222 C VAL A 81 -6.456 -0.445 -4.380 1.00 0.00 C ATOM 1223 O VAL A 81 -6.872 0.398 -5.174 1.00 0.00 O ATOM 1224 CB VAL A 81 -5.552 -0.055 -2.087 1.00 0.00 C ATOM 1225 CG1 VAL A 81 -4.418 0.606 -1.318 1.00 0.00 C ATOM 1226 CG2 VAL A 81 -6.843 0.734 -1.932 1.00 0.00 C ATOM 0 H VAL A 81 -4.847 1.864 -3.731 1.00 0.00 H new ATOM 0 HA VAL A 81 -4.511 -1.048 -3.697 1.00 0.00 H new ATOM 0 HB VAL A 81 -5.709 -1.050 -1.671 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -4.696 0.699 -0.268 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -3.518 -0.003 -1.402 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -4.226 1.596 -1.732 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -7.088 0.826 -0.874 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -6.716 1.727 -2.363 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -7.651 0.215 -2.448 1.00 0.00 H new ATOM 1236 N MET A 82 -7.068 -1.605 -4.169 1.00 0.00 N ATOM 1237 CA MET A 82 -8.294 -1.961 -4.874 1.00 0.00 C ATOM 1238 C MET A 82 -9.158 -2.891 -4.028 1.00 0.00 C ATOM 1239 O MET A 82 -8.804 -4.049 -3.802 1.00 0.00 O ATOM 1240 CB MET A 82 -7.964 -2.628 -6.211 1.00 0.00 C ATOM 1241 CG MET A 82 -9.025 -2.410 -7.277 1.00 0.00 C ATOM 1242 SD MET A 82 -10.315 -3.670 -7.241 1.00 0.00 S ATOM 1243 CE MET A 82 -9.426 -5.083 -7.893 1.00 0.00 C ATOM 0 H MET A 82 -6.736 -2.314 -3.516 1.00 0.00 H new ATOM 0 HA MET A 82 -8.854 -1.045 -5.062 1.00 0.00 H new ATOM 0 HB2 MET A 82 -7.011 -2.243 -6.574 1.00 0.00 H new ATOM 0 HB3 MET A 82 -7.835 -3.699 -6.052 1.00 0.00 H new ATOM 0 HG2 MET A 82 -9.478 -1.428 -7.138 1.00 0.00 H new ATOM 0 HG3 MET A 82 -8.552 -2.407 -8.259 1.00 0.00 H new ATOM 0 HE1 MET A 82 -10.105 -5.700 -8.481 1.00 0.00 H new ATOM 0 HE2 MET A 82 -8.609 -4.738 -8.526 1.00 0.00 H new ATOM 0 HE3 MET A 82 -9.023 -5.671 -7.069 1.00 0.00 H new ATOM 1253 N THR A 83 -10.292 -2.378 -3.562 1.00 0.00 N ATOM 1254 CA THR A 83 -11.205 -3.162 -2.740 1.00 0.00 C ATOM 1255 C THR A 83 -12.330 -3.755 -3.580 1.00 0.00 C ATOM 1256 O THR A 83 -12.352 -3.605 -4.802 1.00 0.00 O ATOM 1257 CB THR A 83 -11.816 -2.311 -1.611 1.00 0.00 C ATOM 1258 OG1 THR A 83 -12.660 -1.295 -2.165 1.00 0.00 O ATOM 1259 CG2 THR A 83 -10.726 -1.667 -0.767 1.00 0.00 C ATOM 0 H THR A 83 -10.600 -1.422 -3.740 1.00 0.00 H new ATOM 0 HA THR A 83 -10.620 -3.969 -2.300 1.00 0.00 H new ATOM 0 HB THR A 83 -12.408 -2.967 -0.972 1.00 0.00 H new ATOM 0 HG1 THR A 83 -13.519 -1.290 -1.694 1.00 0.00 H new ATOM 0 HG21 THR A 83 -11.182 -1.071 0.024 1.00 0.00 H new ATOM 0 HG22 THR A 83 -10.103 -2.444 -0.323 1.00 0.00 H new ATOM 0 HG23 THR A 83 -10.111 -1.024 -1.396 1.00 0.00 H new ATOM 1267 N THR A 84 -13.265 -4.429 -2.917 1.00 0.00 N ATOM 1268 CA THR A 84 -14.394 -5.045 -3.603 1.00 0.00 C ATOM 1269 C THR A 84 -15.300 -3.991 -4.228 1.00 0.00 C ATOM 1270 O THR A 84 -16.233 -4.315 -4.960 1.00 0.00 O ATOM 1271 CB THR A 84 -15.226 -5.917 -2.644 1.00 0.00 C ATOM 1272 OG1 THR A 84 -15.687 -5.130 -1.540 1.00 0.00 O ATOM 1273 CG2 THR A 84 -14.405 -7.090 -2.129 1.00 0.00 C ATOM 0 H THR A 84 -13.262 -4.562 -1.906 1.00 0.00 H new ATOM 0 HA THR A 84 -13.979 -5.676 -4.389 1.00 0.00 H new ATOM 0 HB THR A 84 -16.082 -6.307 -3.194 1.00 0.00 H new ATOM 0 HG1 THR A 84 -16.667 -5.136 -1.521 1.00 0.00 H new ATOM 0 HG21 THR A 84 -15.014 -7.691 -1.454 1.00 0.00 H new ATOM 0 HG22 THR A 84 -14.081 -7.704 -2.969 1.00 0.00 H new ATOM 0 HG23 THR A 84 -13.532 -6.716 -1.595 1.00 0.00 H new ATOM 1281 N GLY A 85 -15.018 -2.725 -3.933 1.00 0.00 N ATOM 1282 CA GLY A 85 -15.817 -1.641 -4.475 1.00 0.00 C ATOM 1283 C GLY A 85 -15.192 -0.282 -4.232 1.00 0.00 C ATOM 1284 O GLY A 85 -15.897 0.708 -4.039 1.00 0.00 O ATOM 0 H GLY A 85 -14.251 -2.431 -3.329 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -15.948 -1.791 -5.547 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -16.810 -1.666 -4.026 1.00 0.00 H new ATOM 1288 N GLY A 86 -13.863 -0.233 -4.238 1.00 0.00 N ATOM 1289 CA GLY A 86 -13.165 1.019 -4.013 1.00 0.00 C ATOM 1290 C GLY A 86 -11.749 0.999 -4.552 1.00 0.00 C ATOM 1291 O GLY A 86 -11.206 -0.065 -4.848 1.00 0.00 O ATOM 0 H GLY A 86 -13.257 -1.039 -4.395 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -13.719 1.830 -4.486 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -13.140 1.231 -2.944 1.00 0.00 H new ATOM 1295 N GLN A 87 -11.150 2.178 -4.682 1.00 0.00 N ATOM 1296 CA GLN A 87 -9.789 2.291 -5.192 1.00 0.00 C ATOM 1297 C GLN A 87 -9.122 3.566 -4.687 1.00 0.00 C ATOM 1298 O GLN A 87 -9.748 4.624 -4.626 1.00 0.00 O ATOM 1299 CB GLN A 87 -9.792 2.275 -6.722 1.00 0.00 C ATOM 1300 CG GLN A 87 -10.580 3.417 -7.341 1.00 0.00 C ATOM 1301 CD GLN A 87 -10.177 3.695 -8.775 1.00 0.00 C ATOM 1302 OE1 GLN A 87 -9.303 3.026 -9.327 1.00 0.00 O ATOM 1303 NE2 GLN A 87 -10.813 4.686 -9.388 1.00 0.00 N ATOM 0 H GLN A 87 -11.586 3.068 -4.441 1.00 0.00 H new ATOM 0 HA GLN A 87 -9.220 1.436 -4.827 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -8.763 2.319 -7.079 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -10.209 1.329 -7.066 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -11.643 3.180 -7.306 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -10.434 4.318 -6.746 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -11.531 5.215 -8.893 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -10.584 4.919 -10.354 1.00 0.00 H new ATOM 1312 N SER A 88 -7.848 3.458 -4.324 1.00 0.00 N ATOM 1313 CA SER A 88 -7.097 4.602 -3.820 1.00 0.00 C ATOM 1314 C SER A 88 -5.696 4.642 -4.424 1.00 0.00 C ATOM 1315 O SER A 88 -5.191 3.632 -4.914 1.00 0.00 O ATOM 1316 CB SER A 88 -7.005 4.545 -2.293 1.00 0.00 C ATOM 1317 OG SER A 88 -6.357 5.696 -1.779 1.00 0.00 O ATOM 0 H SER A 88 -7.314 2.590 -4.369 1.00 0.00 H new ATOM 0 HA SER A 88 -7.625 5.510 -4.112 1.00 0.00 H new ATOM 0 HB2 SER A 88 -8.006 4.466 -1.868 1.00 0.00 H new ATOM 0 HB3 SER A 88 -6.459 3.651 -1.991 1.00 0.00 H new ATOM 0 HG SER A 88 -6.765 6.500 -2.164 1.00 0.00 H new ATOM 1323 N SER A 89 -5.075 5.816 -4.384 1.00 0.00 N ATOM 1324 CA SER A 89 -3.734 5.990 -4.931 1.00 0.00 C ATOM 1325 C SER A 89 -2.902 6.912 -4.046 1.00 0.00 C ATOM 1326 O SER A 89 -3.435 7.806 -3.388 1.00 0.00 O ATOM 1327 CB SER A 89 -3.809 6.557 -6.350 1.00 0.00 C ATOM 1328 OG SER A 89 -4.662 7.687 -6.403 1.00 0.00 O ATOM 0 H SER A 89 -5.478 6.661 -3.979 1.00 0.00 H new ATOM 0 HA SER A 89 -3.252 5.013 -4.963 1.00 0.00 H new ATOM 0 HB2 SER A 89 -2.810 6.835 -6.687 1.00 0.00 H new ATOM 0 HB3 SER A 89 -4.174 5.790 -7.033 1.00 0.00 H new ATOM 0 HG SER A 89 -4.692 8.032 -7.320 1.00 0.00 H new ATOM 1334 N ALA A 90 -1.592 6.688 -4.035 1.00 0.00 N ATOM 1335 CA ALA A 90 -0.685 7.500 -3.233 1.00 0.00 C ATOM 1336 C ALA A 90 0.714 7.521 -3.838 1.00 0.00 C ATOM 1337 O ALA A 90 1.202 6.506 -4.335 1.00 0.00 O ATOM 1338 CB ALA A 90 -0.636 6.980 -1.804 1.00 0.00 C ATOM 0 H ALA A 90 -1.135 5.951 -4.572 1.00 0.00 H new ATOM 0 HA ALA A 90 -1.064 8.522 -3.224 1.00 0.00 H new ATOM 0 HB1 ALA A 90 0.045 7.595 -1.216 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -1.633 7.023 -1.367 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -0.284 5.948 -1.804 1.00 0.00 H new ATOM 1344 N LYS A 91 1.355 8.684 -3.795 1.00 0.00 N ATOM 1345 CA LYS A 91 2.699 8.838 -4.339 1.00 0.00 C ATOM 1346 C LYS A 91 3.746 8.765 -3.232 1.00 0.00 C ATOM 1347 O LYS A 91 3.692 9.522 -2.262 1.00 0.00 O ATOM 1348 CB LYS A 91 2.820 10.170 -5.084 1.00 0.00 C ATOM 1349 CG LYS A 91 2.343 10.107 -6.524 1.00 0.00 C ATOM 1350 CD LYS A 91 2.706 11.369 -7.288 1.00 0.00 C ATOM 1351 CE LYS A 91 1.658 12.455 -7.101 1.00 0.00 C ATOM 1352 NZ LYS A 91 2.035 13.716 -7.798 1.00 0.00 N ATOM 0 H LYS A 91 0.965 9.534 -3.389 1.00 0.00 H new ATOM 0 HA LYS A 91 2.877 8.020 -5.037 1.00 0.00 H new ATOM 0 HB2 LYS A 91 2.244 10.928 -4.552 1.00 0.00 H new ATOM 0 HB3 LYS A 91 3.861 10.492 -5.069 1.00 0.00 H new ATOM 0 HG2 LYS A 91 2.786 9.242 -7.017 1.00 0.00 H new ATOM 0 HG3 LYS A 91 1.262 9.967 -6.544 1.00 0.00 H new ATOM 0 HD2 LYS A 91 3.675 11.735 -6.949 1.00 0.00 H new ATOM 0 HD3 LYS A 91 2.806 11.137 -8.348 1.00 0.00 H new ATOM 0 HE2 LYS A 91 0.699 12.103 -7.481 1.00 0.00 H new ATOM 0 HE3 LYS A 91 1.526 12.653 -6.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 1.295 14.431 -7.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 2.938 14.066 -7.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 2.136 13.533 -8.817 1.00 0.00 H new ATOM 1366 N LEU A 92 4.698 7.852 -3.384 1.00 0.00 N ATOM 1367 CA LEU A 92 5.759 7.681 -2.397 1.00 0.00 C ATOM 1368 C LEU A 92 7.107 8.113 -2.966 1.00 0.00 C ATOM 1369 O LEU A 92 7.622 7.501 -3.902 1.00 0.00 O ATOM 1370 CB LEU A 92 5.829 6.223 -1.941 1.00 0.00 C ATOM 1371 CG LEU A 92 6.889 5.899 -0.887 1.00 0.00 C ATOM 1372 CD1 LEU A 92 6.451 6.398 0.481 1.00 0.00 C ATOM 1373 CD2 LEU A 92 7.164 4.403 -0.850 1.00 0.00 C ATOM 0 H LEU A 92 4.758 7.218 -4.181 1.00 0.00 H new ATOM 0 HA LEU A 92 5.528 8.313 -1.539 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.854 5.940 -1.545 1.00 0.00 H new ATOM 0 HB3 LEU A 92 6.012 5.598 -2.815 1.00 0.00 H new ATOM 0 HG LEU A 92 7.813 6.411 -1.158 1.00 0.00 H new ATOM 0 HD11 LEU A 92 7.217 6.159 1.218 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.306 7.478 0.445 1.00 0.00 H new ATOM 0 HD13 LEU A 92 5.515 5.916 0.762 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.921 4.191 -0.095 1.00 0.00 H new ATOM 0 HD22 LEU A 92 6.246 3.870 -0.604 1.00 0.00 H new ATOM 0 HD23 LEU A 92 7.523 4.075 -1.825 1.00 0.00 H new ATOM 1385 N SER A 93 7.674 9.171 -2.395 1.00 0.00 N ATOM 1386 CA SER A 93 8.961 9.686 -2.846 1.00 0.00 C ATOM 1387 C SER A 93 10.078 9.264 -1.897 1.00 0.00 C ATOM 1388 O SER A 93 9.971 9.427 -0.681 1.00 0.00 O ATOM 1389 CB SER A 93 8.915 11.211 -2.952 1.00 0.00 C ATOM 1390 OG SER A 93 8.476 11.620 -4.236 1.00 0.00 O ATOM 0 H SER A 93 7.262 9.688 -1.619 1.00 0.00 H new ATOM 0 HA SER A 93 9.167 9.267 -3.831 1.00 0.00 H new ATOM 0 HB2 SER A 93 8.246 11.612 -2.191 1.00 0.00 H new ATOM 0 HB3 SER A 93 9.905 11.622 -2.755 1.00 0.00 H new ATOM 0 HG SER A 93 8.454 12.599 -4.278 1.00 0.00 H new ATOM 1396 N VAL A 94 11.152 8.719 -2.461 1.00 0.00 N ATOM 1397 CA VAL A 94 12.290 8.274 -1.666 1.00 0.00 C ATOM 1398 C VAL A 94 13.497 9.181 -1.880 1.00 0.00 C ATOM 1399 O VAL A 94 13.862 9.489 -3.014 1.00 0.00 O ATOM 1400 CB VAL A 94 12.683 6.825 -2.010 1.00 0.00 C ATOM 1401 CG1 VAL A 94 13.768 6.327 -1.068 1.00 0.00 C ATOM 1402 CG2 VAL A 94 11.463 5.917 -1.960 1.00 0.00 C ATOM 0 H VAL A 94 11.257 8.575 -3.465 1.00 0.00 H new ATOM 0 HA VAL A 94 11.984 8.321 -0.621 1.00 0.00 H new ATOM 0 HB VAL A 94 13.081 6.806 -3.025 1.00 0.00 H new ATOM 0 HG11 VAL A 94 14.032 5.302 -1.327 1.00 0.00 H new ATOM 0 HG12 VAL A 94 14.649 6.963 -1.159 1.00 0.00 H new ATOM 0 HG13 VAL A 94 13.402 6.359 -0.042 1.00 0.00 H new ATOM 0 HG21 VAL A 94 11.758 4.897 -2.206 1.00 0.00 H new ATOM 0 HG22 VAL A 94 11.034 5.939 -0.958 1.00 0.00 H new ATOM 0 HG23 VAL A 94 10.722 6.263 -2.680 1.00 0.00 H new ATOM 1412 N ASP A 95 14.114 9.603 -0.782 1.00 0.00 N ATOM 1413 CA ASP A 95 15.282 10.474 -0.848 1.00 0.00 C ATOM 1414 C ASP A 95 16.370 9.997 0.109 1.00 0.00 C ATOM 1415 O ASP A 95 16.118 9.178 0.994 1.00 0.00 O ATOM 1416 CB ASP A 95 14.891 11.915 -0.518 1.00 0.00 C ATOM 1417 CG ASP A 95 14.490 12.703 -1.749 1.00 0.00 C ATOM 1418 OD1 ASP A 95 15.197 12.604 -2.774 1.00 0.00 O ATOM 1419 OD2 ASP A 95 13.469 13.419 -1.689 1.00 0.00 O ATOM 0 H ASP A 95 13.825 9.356 0.165 1.00 0.00 H new ATOM 0 HA ASP A 95 15.675 10.437 -1.864 1.00 0.00 H new ATOM 0 HB2 ASP A 95 14.064 11.910 0.192 1.00 0.00 H new ATOM 0 HB3 ASP A 95 15.728 12.412 -0.029 1.00 0.00 H new