USER MOD reduce.3.24.130724 H: found=0, std=0, add=929, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 930 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 34 TYR OH : rot 83:sc= 1.2 USER MOD Set 1.2: A 53 HIS : no HE2:sc= -0.0407 K(o=1.2,f=-4.5!) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=-0.059) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= -0.603 K(o=-0.6,f=-1.4) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -2.89 K(o=-2.9,f=-7.9!) USER MOD Single : A 16 TYR OH : rot 180:sc= -0.045 USER MOD Single : A 17 ASN : amide:sc= -0.267 X(o=-0.27,f=-0.029) USER MOD Single : A 25 MET CE :methyl -151:sc= -1.22 (180deg=-3.37!) USER MOD Single : A 32 CYS SG : rot -133:sc= -1.75! USER MOD Single : A 33 GLN : amide:sc= -0.161 X(o=-0.16,f=-0.063) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -0.723 K(o=-0.72,f=-4.3!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0.232 K(o=0.23,f=-4.7!) USER MOD Single : A 79 HIS : no HE2:sc= -1.18! C(o=-1.2!,f=-2.9!) USER MOD Single : A 81 THR OG1 : rot -95:sc= -1.06 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 ASN :FLIP amide:sc= 0 F(o=-0.57,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 CYS SG : rot 85:sc= 0.0437 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 ASN :FLIP amide:sc= -1.3 F(o=-2.7!,f=-1.3) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N ASN A 2 1.831 -2.392 -0.522 1.00 0.00 N ATOM 21 CA ASN A 2 2.075 -3.725 -1.109 1.00 0.00 C ATOM 22 C ASN A 2 0.785 -4.553 -0.964 1.00 0.00 C ATOM 23 O ASN A 2 0.810 -5.738 -0.618 1.00 0.00 O ATOM 24 CB ASN A 2 3.299 -4.390 -0.422 1.00 0.00 C ATOM 25 CG ASN A 2 4.590 -3.576 -0.565 1.00 0.00 C ATOM 26 OD1 ASN A 2 5.324 -3.715 -1.546 1.00 0.00 O ATOM 27 ND2 ASN A 2 4.857 -2.700 0.401 1.00 0.00 N ATOM 0 HA ASN A 2 2.319 -3.653 -2.169 1.00 0.00 H new ATOM 0 HB2 ASN A 2 3.081 -4.530 0.637 1.00 0.00 H new ATOM 0 HB3 ASN A 2 3.453 -5.381 -0.849 1.00 0.00 H new ATOM 0 HD21 ASN A 2 5.692 -2.117 0.344 1.00 0.00 H new ATOM 0 HD22 ASN A 2 4.227 -2.612 1.198 1.00 0.00 H new ATOM 34 N SER A 3 -0.341 -3.891 -1.292 1.00 0.00 N ATOM 35 CA SER A 3 -1.702 -4.409 -1.095 1.00 0.00 C ATOM 36 C SER A 3 -1.979 -5.633 -1.981 1.00 0.00 C ATOM 37 O SER A 3 -2.523 -6.626 -1.511 1.00 0.00 O ATOM 38 CB SER A 3 -2.716 -3.279 -1.383 1.00 0.00 C ATOM 39 OG SER A 3 -2.512 -2.719 -2.675 1.00 0.00 O ATOM 0 H SER A 3 -0.326 -2.961 -1.710 1.00 0.00 H new ATOM 0 HA SER A 3 -1.805 -4.740 -0.061 1.00 0.00 H new ATOM 0 HB2 SER A 3 -3.731 -3.670 -1.310 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.620 -2.500 -0.627 1.00 0.00 H new ATOM 0 HG SER A 3 -3.168 -2.008 -2.831 1.00 0.00 H new ATOM 45 N GLU A 4 -1.554 -5.549 -3.257 1.00 0.00 N ATOM 46 CA GLU A 4 -1.720 -6.638 -4.252 1.00 0.00 C ATOM 47 C GLU A 4 -0.837 -7.869 -3.943 1.00 0.00 C ATOM 48 O GLU A 4 -0.931 -8.886 -4.637 1.00 0.00 O ATOM 49 CB GLU A 4 -1.434 -6.132 -5.697 1.00 0.00 C ATOM 50 CG GLU A 4 0.018 -5.661 -5.984 1.00 0.00 C ATOM 51 CD GLU A 4 0.366 -4.277 -5.399 1.00 0.00 C ATOM 52 OE1 GLU A 4 0.009 -3.255 -6.022 1.00 0.00 O ATOM 53 OE2 GLU A 4 0.991 -4.208 -4.319 1.00 0.00 O ATOM 0 H GLU A 4 -1.085 -4.725 -3.632 1.00 0.00 H new ATOM 0 HA GLU A 4 -2.761 -6.953 -4.183 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -1.679 -6.933 -6.395 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -2.111 -5.305 -5.911 1.00 0.00 H new ATOM 0 HG2 GLU A 4 0.713 -6.398 -5.580 1.00 0.00 H new ATOM 0 HG3 GLU A 4 0.172 -5.635 -7.063 1.00 0.00 H new ATOM 60 N ILE A 5 0.041 -7.744 -2.937 1.00 0.00 N ATOM 61 CA ILE A 5 0.867 -8.854 -2.432 1.00 0.00 C ATOM 62 C ILE A 5 0.167 -9.486 -1.207 1.00 0.00 C ATOM 63 O ILE A 5 0.309 -10.683 -0.936 1.00 0.00 O ATOM 64 CB ILE A 5 2.303 -8.347 -2.025 1.00 0.00 C ATOM 65 CG1 ILE A 5 2.896 -7.353 -3.082 1.00 0.00 C ATOM 66 CG2 ILE A 5 3.271 -9.523 -1.775 1.00 0.00 C ATOM 67 CD1 ILE A 5 3.082 -7.904 -4.488 1.00 0.00 C ATOM 0 H ILE A 5 0.200 -6.864 -2.446 1.00 0.00 H new ATOM 0 HA ILE A 5 0.981 -9.597 -3.221 1.00 0.00 H new ATOM 0 HB ILE A 5 2.188 -7.801 -1.089 1.00 0.00 H new ATOM 0 HG12 ILE A 5 2.243 -6.482 -3.138 1.00 0.00 H new ATOM 0 HG13 ILE A 5 3.863 -7.003 -2.720 1.00 0.00 H new ATOM 0 HG21 ILE A 5 4.251 -9.135 -1.497 1.00 0.00 H new ATOM 0 HG22 ILE A 5 2.885 -10.147 -0.969 1.00 0.00 H new ATOM 0 HG23 ILE A 5 3.361 -10.119 -2.683 1.00 0.00 H new ATOM 0 HD11 ILE A 5 3.498 -7.128 -5.131 1.00 0.00 H new ATOM 0 HD12 ILE A 5 3.763 -8.754 -4.458 1.00 0.00 H new ATOM 0 HD13 ILE A 5 2.118 -8.225 -4.883 1.00 0.00 H new ATOM 79 N GLU A 6 -0.598 -8.649 -0.477 1.00 0.00 N ATOM 80 CA GLU A 6 -1.393 -9.075 0.691 1.00 0.00 C ATOM 81 C GLU A 6 -2.691 -9.790 0.261 1.00 0.00 C ATOM 82 O GLU A 6 -3.153 -10.698 0.961 1.00 0.00 O ATOM 83 CB GLU A 6 -1.739 -7.844 1.574 1.00 0.00 C ATOM 84 CG GLU A 6 -0.519 -7.120 2.167 1.00 0.00 C ATOM 85 CD GLU A 6 -0.894 -5.858 2.968 1.00 0.00 C ATOM 86 OE1 GLU A 6 -1.101 -4.793 2.350 1.00 0.00 O ATOM 87 OE2 GLU A 6 -1.011 -5.932 4.215 1.00 0.00 O ATOM 0 H GLU A 6 -0.681 -7.654 -0.683 1.00 0.00 H new ATOM 0 HA GLU A 6 -0.793 -9.781 1.265 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -2.312 -7.134 0.977 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -2.385 -8.168 2.390 1.00 0.00 H new ATOM 0 HG2 GLU A 6 0.023 -7.807 2.816 1.00 0.00 H new ATOM 0 HG3 GLU A 6 0.159 -6.842 1.360 1.00 0.00 H new ATOM 94 N LEU A 7 -3.271 -9.367 -0.887 1.00 0.00 N ATOM 95 CA LEU A 7 -4.562 -9.911 -1.391 1.00 0.00 C ATOM 96 C LEU A 7 -4.504 -11.450 -1.632 1.00 0.00 C ATOM 97 O LEU A 7 -5.411 -12.157 -1.175 1.00 0.00 O ATOM 98 CB LEU A 7 -5.054 -9.182 -2.681 1.00 0.00 C ATOM 99 CG LEU A 7 -5.325 -7.651 -2.562 1.00 0.00 C ATOM 100 CD1 LEU A 7 -5.756 -7.043 -3.913 1.00 0.00 C ATOM 101 CD2 LEU A 7 -6.353 -7.346 -1.453 1.00 0.00 C ATOM 0 H LEU A 7 -2.866 -8.648 -1.486 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.287 -9.720 -0.600 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -4.310 -9.336 -3.463 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.972 -9.665 -3.015 1.00 0.00 H new ATOM 0 HG LEU A 7 -4.386 -7.176 -2.278 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -5.936 -5.975 -3.790 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -4.967 -7.196 -4.649 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -6.670 -7.528 -4.255 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.519 -6.270 -1.397 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.294 -7.847 -1.681 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -5.974 -7.705 -0.496 1.00 0.00 H new ATOM 113 N PRO A 8 -3.462 -12.011 -2.364 1.00 0.00 N ATOM 114 CA PRO A 8 -3.309 -13.478 -2.527 1.00 0.00 C ATOM 115 C PRO A 8 -3.231 -14.208 -1.181 1.00 0.00 C ATOM 116 O PRO A 8 -4.115 -14.994 -0.842 1.00 0.00 O ATOM 117 CB PRO A 8 -1.994 -13.649 -3.366 1.00 0.00 C ATOM 118 CG PRO A 8 -1.308 -12.325 -3.298 1.00 0.00 C ATOM 119 CD PRO A 8 -2.402 -11.297 -3.131 1.00 0.00 C ATOM 0 HA PRO A 8 -4.172 -13.921 -3.024 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -1.365 -14.439 -2.955 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.218 -13.923 -4.397 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -0.609 -12.290 -2.462 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -0.731 -12.137 -4.204 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -2.044 -10.419 -2.593 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -2.773 -10.951 -4.095 1.00 0.00 H new ATOM 127 N VAL A 9 -2.209 -13.860 -0.401 1.00 0.00 N ATOM 128 CA VAL A 9 -1.812 -14.612 0.800 1.00 0.00 C ATOM 129 C VAL A 9 -2.901 -14.601 1.905 1.00 0.00 C ATOM 130 O VAL A 9 -3.020 -15.564 2.666 1.00 0.00 O ATOM 131 CB VAL A 9 -0.455 -14.070 1.348 1.00 0.00 C ATOM 132 CG1 VAL A 9 0.641 -14.156 0.254 1.00 0.00 C ATOM 133 CG2 VAL A 9 -0.593 -12.627 1.896 1.00 0.00 C ATOM 0 H VAL A 9 -1.625 -13.043 -0.581 1.00 0.00 H new ATOM 0 HA VAL A 9 -1.689 -15.653 0.502 1.00 0.00 H new ATOM 0 HB VAL A 9 -0.155 -14.700 2.186 1.00 0.00 H new ATOM 0 HG11 VAL A 9 1.582 -13.774 0.651 1.00 0.00 H new ATOM 0 HG12 VAL A 9 0.770 -15.195 -0.051 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.342 -13.559 -0.608 1.00 0.00 H new ATOM 0 HG21 VAL A 9 0.373 -12.285 2.268 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -0.929 -11.965 1.098 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -1.320 -12.614 2.708 1.00 0.00 H new ATOM 143 N GLN A 10 -3.705 -13.515 1.950 1.00 0.00 N ATOM 144 CA GLN A 10 -4.839 -13.376 2.888 1.00 0.00 C ATOM 145 C GLN A 10 -5.951 -14.368 2.514 1.00 0.00 C ATOM 146 O GLN A 10 -6.354 -15.200 3.335 1.00 0.00 O ATOM 147 CB GLN A 10 -5.375 -11.914 2.859 1.00 0.00 C ATOM 148 CG GLN A 10 -6.630 -11.627 3.718 1.00 0.00 C ATOM 149 CD GLN A 10 -6.435 -11.892 5.211 1.00 0.00 C ATOM 150 OE1 GLN A 10 -6.001 -11.016 5.954 1.00 0.00 O ATOM 151 NE2 GLN A 10 -6.762 -13.097 5.655 1.00 0.00 N ATOM 0 H GLN A 10 -3.585 -12.710 1.336 1.00 0.00 H new ATOM 0 HA GLN A 10 -4.500 -13.600 3.899 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -4.576 -11.250 3.188 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -5.601 -11.653 1.825 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -6.922 -10.586 3.579 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -7.454 -12.241 3.355 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -7.120 -13.799 5.008 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -6.656 -13.322 6.644 1.00 0.00 H new ATOM 160 N LYS A 11 -6.395 -14.286 1.244 1.00 0.00 N ATOM 161 CA LYS A 11 -7.508 -15.103 0.710 1.00 0.00 C ATOM 162 C LYS A 11 -7.180 -16.603 0.734 1.00 0.00 C ATOM 163 O LYS A 11 -8.057 -17.429 0.977 1.00 0.00 O ATOM 164 CB LYS A 11 -7.846 -14.648 -0.732 1.00 0.00 C ATOM 165 CG LYS A 11 -8.439 -13.225 -0.830 1.00 0.00 C ATOM 166 CD LYS A 11 -9.782 -13.097 -0.085 1.00 0.00 C ATOM 167 CE LYS A 11 -10.403 -11.699 -0.200 1.00 0.00 C ATOM 168 NZ LYS A 11 -11.702 -11.633 0.510 1.00 0.00 N ATOM 0 H LYS A 11 -5.992 -13.650 0.556 1.00 0.00 H new ATOM 0 HA LYS A 11 -8.375 -14.951 1.353 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.940 -14.693 -1.336 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -8.554 -15.354 -1.166 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -7.728 -12.509 -0.418 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -8.582 -12.965 -1.879 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -10.482 -13.833 -0.481 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -9.631 -13.335 0.968 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -9.720 -10.959 0.216 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -10.546 -11.446 -1.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -12.100 -10.677 0.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -12.360 -12.324 0.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -11.559 -11.852 1.517 1.00 0.00 H new ATOM 182 N GLN A 12 -5.904 -16.925 0.497 1.00 0.00 N ATOM 183 CA GLN A 12 -5.412 -18.308 0.438 1.00 0.00 C ATOM 184 C GLN A 12 -5.310 -18.928 1.840 1.00 0.00 C ATOM 185 O GLN A 12 -5.658 -20.085 2.024 1.00 0.00 O ATOM 186 CB GLN A 12 -4.038 -18.347 -0.253 1.00 0.00 C ATOM 187 CG GLN A 12 -4.076 -18.013 -1.754 1.00 0.00 C ATOM 188 CD GLN A 12 -2.692 -17.850 -2.370 1.00 0.00 C ATOM 189 OE1 GLN A 12 -2.513 -17.092 -3.318 1.00 0.00 O ATOM 190 NE2 GLN A 12 -1.704 -18.584 -1.862 1.00 0.00 N ATOM 0 H GLN A 12 -5.176 -16.228 0.339 1.00 0.00 H new ATOM 0 HA GLN A 12 -6.127 -18.895 -0.139 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -3.372 -17.644 0.247 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -3.607 -19.340 -0.124 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -4.610 -18.803 -2.282 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -4.642 -17.093 -1.900 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -1.884 -19.205 -1.073 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -0.767 -18.525 -2.262 1.00 0.00 H new ATOM 199 N LEU A 13 -4.802 -18.148 2.810 1.00 0.00 N ATOM 200 CA LEU A 13 -4.660 -18.600 4.211 1.00 0.00 C ATOM 201 C LEU A 13 -6.039 -18.958 4.803 1.00 0.00 C ATOM 202 O LEU A 13 -6.199 -20.004 5.451 1.00 0.00 O ATOM 203 CB LEU A 13 -4.000 -17.499 5.062 1.00 0.00 C ATOM 204 CG LEU A 13 -3.869 -17.811 6.587 1.00 0.00 C ATOM 205 CD1 LEU A 13 -2.741 -18.824 6.881 1.00 0.00 C ATOM 206 CD2 LEU A 13 -3.726 -16.522 7.391 1.00 0.00 C ATOM 0 H LEU A 13 -4.480 -17.194 2.650 1.00 0.00 H new ATOM 0 HA LEU A 13 -4.028 -19.488 4.223 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -3.005 -17.304 4.663 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -4.576 -16.581 4.946 1.00 0.00 H new ATOM 0 HG LEU A 13 -4.791 -18.295 6.910 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.689 -19.009 7.954 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.947 -19.759 6.361 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.790 -18.419 6.536 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -3.636 -16.762 8.450 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -2.835 -15.986 7.064 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -4.604 -15.896 7.234 1.00 0.00 H new ATOM 218 N GLU A 14 -7.012 -18.054 4.579 1.00 0.00 N ATOM 219 CA GLU A 14 -8.427 -18.274 4.938 1.00 0.00 C ATOM 220 C GLU A 14 -8.950 -19.548 4.253 1.00 0.00 C ATOM 221 O GLU A 14 -9.468 -20.433 4.916 1.00 0.00 O ATOM 222 CB GLU A 14 -9.279 -17.045 4.529 1.00 0.00 C ATOM 223 CG GLU A 14 -8.896 -15.744 5.249 1.00 0.00 C ATOM 224 CD GLU A 14 -9.693 -14.526 4.750 1.00 0.00 C ATOM 225 OE1 GLU A 14 -9.272 -13.890 3.756 1.00 0.00 O ATOM 226 OE2 GLU A 14 -10.749 -14.201 5.342 1.00 0.00 O ATOM 0 H GLU A 14 -6.839 -17.148 4.143 1.00 0.00 H new ATOM 0 HA GLU A 14 -8.505 -18.403 6.018 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -9.184 -16.893 3.454 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -10.328 -17.262 4.729 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -9.060 -15.865 6.320 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -7.831 -15.557 5.109 1.00 0.00 H new ATOM 233 N ALA A 15 -8.711 -19.634 2.933 1.00 0.00 N ATOM 234 CA ALA A 15 -9.156 -20.758 2.076 1.00 0.00 C ATOM 235 C ALA A 15 -8.495 -22.102 2.478 1.00 0.00 C ATOM 236 O ALA A 15 -9.058 -23.168 2.217 1.00 0.00 O ATOM 237 CB ALA A 15 -8.862 -20.438 0.601 1.00 0.00 C ATOM 0 H ALA A 15 -8.197 -18.918 2.420 1.00 0.00 H new ATOM 0 HA ALA A 15 -10.230 -20.875 2.218 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -9.191 -21.268 -0.024 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.395 -19.532 0.312 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -7.791 -20.287 0.468 1.00 0.00 H new ATOM 243 N TYR A 16 -7.294 -22.028 3.098 1.00 0.00 N ATOM 244 CA TYR A 16 -6.514 -23.215 3.518 1.00 0.00 C ATOM 245 C TYR A 16 -7.276 -24.016 4.589 1.00 0.00 C ATOM 246 O TYR A 16 -7.355 -25.252 4.525 1.00 0.00 O ATOM 247 CB TYR A 16 -5.116 -22.780 4.043 1.00 0.00 C ATOM 248 CG TYR A 16 -4.166 -23.936 4.432 1.00 0.00 C ATOM 249 CD1 TYR A 16 -3.752 -24.875 3.481 1.00 0.00 C ATOM 250 CD2 TYR A 16 -3.688 -24.087 5.742 1.00 0.00 C ATOM 251 CE1 TYR A 16 -2.904 -25.913 3.816 1.00 0.00 C ATOM 252 CE2 TYR A 16 -2.836 -25.128 6.080 1.00 0.00 C ATOM 253 CZ TYR A 16 -2.448 -26.037 5.113 1.00 0.00 C ATOM 254 OH TYR A 16 -1.602 -27.080 5.440 1.00 0.00 O ATOM 0 H TYR A 16 -6.839 -21.143 3.321 1.00 0.00 H new ATOM 0 HA TYR A 16 -6.372 -23.862 2.653 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -4.631 -22.175 3.277 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -5.257 -22.139 4.913 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -4.103 -24.787 2.463 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -3.989 -23.380 6.501 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -2.598 -26.626 3.065 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -2.477 -25.228 7.094 1.00 0.00 H new ATOM 0 HH TYR A 16 -1.370 -27.027 6.391 1.00 0.00 H new ATOM 264 N ASN A 17 -7.845 -23.289 5.560 1.00 0.00 N ATOM 265 CA ASN A 17 -8.637 -23.887 6.651 1.00 0.00 C ATOM 266 C ASN A 17 -10.139 -23.952 6.270 1.00 0.00 C ATOM 267 O ASN A 17 -10.847 -24.858 6.711 1.00 0.00 O ATOM 268 CB ASN A 17 -8.405 -23.104 7.979 1.00 0.00 C ATOM 269 CG ASN A 17 -8.859 -21.642 7.940 1.00 0.00 C ATOM 270 OD1 ASN A 17 -9.998 -21.326 8.280 1.00 0.00 O ATOM 271 ND2 ASN A 17 -7.969 -20.740 7.540 1.00 0.00 N ATOM 0 H ASN A 17 -7.772 -22.273 5.614 1.00 0.00 H new ATOM 0 HA ASN A 17 -8.302 -24.912 6.809 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -8.933 -23.614 8.784 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -7.343 -23.135 8.224 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -8.223 -19.753 7.508 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -7.032 -21.035 7.265 1.00 0.00 H new ATOM 278 N ALA A 18 -10.592 -23.015 5.405 1.00 0.00 N ATOM 279 CA ALA A 18 -12.017 -22.899 4.977 1.00 0.00 C ATOM 280 C ALA A 18 -12.372 -23.904 3.864 1.00 0.00 C ATOM 281 O ALA A 18 -13.549 -24.058 3.525 1.00 0.00 O ATOM 282 CB ALA A 18 -12.330 -21.469 4.502 1.00 0.00 C ATOM 0 H ALA A 18 -9.984 -22.315 4.980 1.00 0.00 H new ATOM 0 HA ALA A 18 -12.628 -23.133 5.849 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -13.374 -21.408 4.195 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -12.150 -20.767 5.316 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -11.688 -21.217 3.658 1.00 0.00 H new ATOM 288 N ARG A 19 -11.335 -24.564 3.304 1.00 0.00 N ATOM 289 CA ARG A 19 -11.463 -25.664 2.322 1.00 0.00 C ATOM 290 C ARG A 19 -11.996 -25.167 0.958 1.00 0.00 C ATOM 291 O ARG A 19 -12.864 -25.800 0.338 1.00 0.00 O ATOM 292 CB ARG A 19 -12.324 -26.837 2.881 1.00 0.00 C ATOM 293 CG ARG A 19 -11.926 -27.336 4.286 1.00 0.00 C ATOM 294 CD ARG A 19 -10.443 -27.704 4.416 1.00 0.00 C ATOM 295 NE ARG A 19 -10.151 -28.205 5.768 1.00 0.00 N ATOM 296 CZ ARG A 19 -10.113 -29.498 6.120 1.00 0.00 C ATOM 297 NH1 ARG A 19 -10.315 -30.461 5.228 1.00 0.00 N ATOM 298 NH2 ARG A 19 -9.892 -29.827 7.378 1.00 0.00 N ATOM 0 H ARG A 19 -10.365 -24.342 3.527 1.00 0.00 H new ATOM 0 HA ARG A 19 -10.459 -26.051 2.148 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -13.367 -26.520 2.908 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -12.263 -27.674 2.185 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -12.164 -26.563 5.017 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -12.530 -28.208 4.536 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -10.185 -28.463 3.677 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -9.826 -26.831 4.205 1.00 0.00 H new ATOM 0 HE ARG A 19 -9.963 -27.514 6.495 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -10.503 -30.223 4.254 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -10.282 -31.439 5.517 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -9.751 -29.099 8.078 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -9.862 -30.809 7.651 1.00 0.00 H new ATOM 312 N ASP A 20 -11.443 -24.037 0.485 1.00 0.00 N ATOM 313 CA ASP A 20 -11.769 -23.468 -0.838 1.00 0.00 C ATOM 314 C ASP A 20 -10.514 -23.492 -1.734 1.00 0.00 C ATOM 315 O ASP A 20 -9.717 -22.558 -1.696 1.00 0.00 O ATOM 316 CB ASP A 20 -12.309 -22.010 -0.689 1.00 0.00 C ATOM 317 CG ASP A 20 -13.689 -21.930 -0.008 1.00 0.00 C ATOM 318 OD1 ASP A 20 -13.750 -21.843 1.238 1.00 0.00 O ATOM 319 OD2 ASP A 20 -14.720 -21.948 -0.721 1.00 0.00 O ATOM 0 H ASP A 20 -10.758 -23.491 1.007 1.00 0.00 H new ATOM 0 HA ASP A 20 -12.549 -24.071 -1.303 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -11.594 -21.424 -0.112 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -12.373 -21.553 -1.676 1.00 0.00 H new ATOM 324 N ILE A 21 -10.357 -24.561 -2.547 1.00 0.00 N ATOM 325 CA ILE A 21 -9.181 -24.730 -3.438 1.00 0.00 C ATOM 326 C ILE A 21 -9.226 -23.742 -4.620 1.00 0.00 C ATOM 327 O ILE A 21 -8.175 -23.315 -5.100 1.00 0.00 O ATOM 328 CB ILE A 21 -9.016 -26.233 -3.930 1.00 0.00 C ATOM 329 CG1 ILE A 21 -8.453 -27.132 -2.779 1.00 0.00 C ATOM 330 CG2 ILE A 21 -8.127 -26.369 -5.205 1.00 0.00 C ATOM 331 CD1 ILE A 21 -6.996 -26.864 -2.418 1.00 0.00 C ATOM 0 H ILE A 21 -11.032 -25.324 -2.606 1.00 0.00 H new ATOM 0 HA ILE A 21 -8.294 -24.495 -2.849 1.00 0.00 H new ATOM 0 HB ILE A 21 -10.013 -26.576 -4.205 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -9.066 -26.987 -1.890 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -8.555 -28.178 -3.070 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -8.055 -27.419 -5.488 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -8.574 -25.803 -6.022 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -7.130 -25.980 -4.997 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -6.692 -27.532 -1.612 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -6.367 -27.038 -3.291 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -6.886 -25.830 -2.093 1.00 0.00 H new ATOM 343 N ASP A 22 -10.438 -23.351 -5.061 1.00 0.00 N ATOM 344 CA ASP A 22 -10.607 -22.411 -6.196 1.00 0.00 C ATOM 345 C ASP A 22 -9.928 -21.047 -5.907 1.00 0.00 C ATOM 346 O ASP A 22 -9.220 -20.518 -6.762 1.00 0.00 O ATOM 347 CB ASP A 22 -12.108 -22.225 -6.538 1.00 0.00 C ATOM 348 CG ASP A 22 -12.355 -21.231 -7.695 1.00 0.00 C ATOM 349 OD1 ASP A 22 -12.135 -21.609 -8.867 1.00 0.00 O ATOM 350 OD2 ASP A 22 -12.735 -20.066 -7.435 1.00 0.00 O ATOM 0 H ASP A 22 -11.316 -23.669 -4.651 1.00 0.00 H new ATOM 0 HA ASP A 22 -10.112 -22.846 -7.065 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -12.535 -23.192 -6.802 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -12.635 -21.876 -5.650 1.00 0.00 H new ATOM 355 N ALA A 23 -10.136 -20.511 -4.691 1.00 0.00 N ATOM 356 CA ALA A 23 -9.486 -19.252 -4.239 1.00 0.00 C ATOM 357 C ALA A 23 -8.040 -19.511 -3.791 1.00 0.00 C ATOM 358 O ALA A 23 -7.160 -18.659 -3.967 1.00 0.00 O ATOM 359 CB ALA A 23 -10.297 -18.602 -3.105 1.00 0.00 C ATOM 0 H ALA A 23 -10.753 -20.928 -3.994 1.00 0.00 H new ATOM 0 HA ALA A 23 -9.460 -18.562 -5.083 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -9.806 -17.682 -2.787 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -11.301 -18.373 -3.461 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -10.359 -19.290 -2.262 1.00 0.00 H new ATOM 365 N PHE A 24 -7.810 -20.712 -3.236 1.00 0.00 N ATOM 366 CA PHE A 24 -6.473 -21.176 -2.830 1.00 0.00 C ATOM 367 C PHE A 24 -5.585 -21.459 -4.071 1.00 0.00 C ATOM 368 O PHE A 24 -4.392 -21.704 -3.933 1.00 0.00 O ATOM 369 CB PHE A 24 -6.615 -22.440 -1.934 1.00 0.00 C ATOM 370 CG PHE A 24 -5.339 -22.878 -1.225 1.00 0.00 C ATOM 371 CD1 PHE A 24 -4.940 -22.263 -0.047 1.00 0.00 C ATOM 372 CD2 PHE A 24 -4.521 -23.871 -1.754 1.00 0.00 C ATOM 373 CE1 PHE A 24 -3.775 -22.635 0.590 1.00 0.00 C ATOM 374 CE2 PHE A 24 -3.356 -24.232 -1.120 1.00 0.00 C ATOM 375 CZ PHE A 24 -2.979 -23.615 0.050 1.00 0.00 C ATOM 0 H PHE A 24 -8.549 -21.391 -3.055 1.00 0.00 H new ATOM 0 HA PHE A 24 -5.980 -20.392 -2.254 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -7.382 -22.250 -1.183 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -6.971 -23.265 -2.551 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -5.551 -21.481 0.378 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -4.804 -24.364 -2.672 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -3.488 -22.155 1.514 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -2.732 -25.005 -1.543 1.00 0.00 H new ATOM 0 HZ PHE A 24 -2.061 -23.900 0.542 1.00 0.00 H new ATOM 385 N MET A 25 -6.184 -21.461 -5.282 1.00 0.00 N ATOM 386 CA MET A 25 -5.445 -21.605 -6.559 1.00 0.00 C ATOM 387 C MET A 25 -5.483 -20.303 -7.374 1.00 0.00 C ATOM 388 O MET A 25 -4.536 -20.015 -8.120 1.00 0.00 O ATOM 389 CB MET A 25 -6.016 -22.776 -7.413 1.00 0.00 C ATOM 390 CG MET A 25 -5.310 -23.025 -8.775 1.00 0.00 C ATOM 391 SD MET A 25 -3.840 -24.101 -8.708 1.00 0.00 S ATOM 392 CE MET A 25 -2.690 -23.286 -7.583 1.00 0.00 C ATOM 0 H MET A 25 -7.192 -21.363 -5.403 1.00 0.00 H new ATOM 0 HA MET A 25 -4.409 -21.830 -6.306 1.00 0.00 H new ATOM 0 HB2 MET A 25 -5.961 -23.691 -6.824 1.00 0.00 H new ATOM 0 HB3 MET A 25 -7.072 -22.582 -7.602 1.00 0.00 H new ATOM 0 HG2 MET A 25 -6.031 -23.466 -9.464 1.00 0.00 H new ATOM 0 HG3 MET A 25 -5.016 -22.063 -9.194 1.00 0.00 H new ATOM 0 HE1 MET A 25 -1.667 -23.538 -7.863 1.00 0.00 H new ATOM 0 HE2 MET A 25 -2.827 -22.206 -7.642 1.00 0.00 H new ATOM 0 HE3 MET A 25 -2.880 -23.620 -6.563 1.00 0.00 H new ATOM 402 N ALA A 26 -6.576 -19.524 -7.206 1.00 0.00 N ATOM 403 CA ALA A 26 -6.870 -18.324 -8.030 1.00 0.00 C ATOM 404 C ALA A 26 -5.690 -17.354 -8.081 1.00 0.00 C ATOM 405 O ALA A 26 -5.165 -17.037 -9.147 1.00 0.00 O ATOM 406 CB ALA A 26 -8.111 -17.596 -7.486 1.00 0.00 C ATOM 0 H ALA A 26 -7.282 -19.709 -6.494 1.00 0.00 H new ATOM 0 HA ALA A 26 -7.059 -18.672 -9.045 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -8.316 -16.718 -8.099 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -8.969 -18.268 -7.516 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -7.929 -17.286 -6.457 1.00 0.00 H new ATOM 412 N TRP A 27 -5.237 -16.978 -6.894 1.00 0.00 N ATOM 413 CA TRP A 27 -4.272 -15.899 -6.699 1.00 0.00 C ATOM 414 C TRP A 27 -2.813 -16.314 -7.008 1.00 0.00 C ATOM 415 O TRP A 27 -1.888 -15.520 -6.805 1.00 0.00 O ATOM 416 CB TRP A 27 -4.404 -15.411 -5.253 1.00 0.00 C ATOM 417 CG TRP A 27 -5.746 -14.806 -4.899 1.00 0.00 C ATOM 418 CD1 TRP A 27 -6.813 -15.425 -4.298 1.00 0.00 C ATOM 419 CD2 TRP A 27 -6.140 -13.442 -5.103 1.00 0.00 C ATOM 420 NE1 TRP A 27 -7.838 -14.529 -4.128 1.00 0.00 N ATOM 421 CE2 TRP A 27 -7.451 -13.309 -4.615 1.00 0.00 C ATOM 422 CE3 TRP A 27 -5.497 -12.321 -5.646 1.00 0.00 C ATOM 423 CZ2 TRP A 27 -8.137 -12.102 -4.667 1.00 0.00 C ATOM 424 CZ3 TRP A 27 -6.182 -11.125 -5.699 1.00 0.00 C ATOM 425 CH2 TRP A 27 -7.489 -11.021 -5.207 1.00 0.00 C ATOM 0 H TRP A 27 -5.533 -17.420 -6.023 1.00 0.00 H new ATOM 0 HA TRP A 27 -4.499 -15.102 -7.407 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -4.213 -16.250 -4.584 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -3.628 -14.670 -5.064 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -6.842 -16.463 -4.003 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -8.743 -14.738 -3.707 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -4.485 -12.392 -6.016 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -9.147 -12.018 -4.294 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.703 -10.256 -6.126 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -7.997 -10.069 -5.254 1.00 0.00 H new ATOM 436 N TRP A 28 -2.618 -17.549 -7.499 1.00 0.00 N ATOM 437 CA TRP A 28 -1.309 -18.047 -7.951 1.00 0.00 C ATOM 438 C TRP A 28 -1.162 -17.807 -9.463 1.00 0.00 C ATOM 439 O TRP A 28 -2.148 -17.552 -10.168 1.00 0.00 O ATOM 440 CB TRP A 28 -1.163 -19.564 -7.650 1.00 0.00 C ATOM 441 CG TRP A 28 -1.297 -19.941 -6.191 1.00 0.00 C ATOM 442 CD1 TRP A 28 -2.412 -19.826 -5.411 1.00 0.00 C ATOM 443 CD2 TRP A 28 -0.291 -20.536 -5.349 1.00 0.00 C ATOM 444 NE1 TRP A 28 -2.155 -20.305 -4.159 1.00 0.00 N ATOM 445 CE2 TRP A 28 -0.869 -20.737 -4.089 1.00 0.00 C ATOM 446 CE3 TRP A 28 1.037 -20.908 -5.540 1.00 0.00 C ATOM 447 CZ2 TRP A 28 -0.174 -21.298 -3.021 1.00 0.00 C ATOM 448 CZ3 TRP A 28 1.731 -21.467 -4.485 1.00 0.00 C ATOM 449 CH2 TRP A 28 1.127 -21.653 -3.235 1.00 0.00 C ATOM 0 H TRP A 28 -3.368 -18.233 -7.594 1.00 0.00 H new ATOM 0 HA TRP A 28 -0.528 -17.509 -7.413 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -1.916 -20.107 -8.221 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -0.189 -19.898 -8.008 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -3.357 -19.417 -5.736 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -2.827 -20.334 -3.392 1.00 0.00 H new ATOM 0 HE3 TRP A 28 1.516 -20.762 -6.497 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -0.645 -21.447 -2.061 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 2.759 -21.766 -4.626 1.00 0.00 H new ATOM 0 HH2 TRP A 28 1.700 -22.084 -2.427 1.00 0.00 H new ATOM 460 N ALA A 29 0.084 -17.865 -9.940 1.00 0.00 N ATOM 461 CA ALA A 29 0.402 -17.858 -11.384 1.00 0.00 C ATOM 462 C ALA A 29 0.186 -19.261 -11.971 1.00 0.00 C ATOM 463 O ALA A 29 0.322 -20.257 -11.255 1.00 0.00 O ATOM 464 CB ALA A 29 1.851 -17.391 -11.618 1.00 0.00 C ATOM 0 H ALA A 29 0.908 -17.918 -9.341 1.00 0.00 H new ATOM 0 HA ALA A 29 -0.264 -17.158 -11.888 1.00 0.00 H new ATOM 0 HB1 ALA A 29 2.066 -17.393 -12.687 1.00 0.00 H new ATOM 0 HB2 ALA A 29 1.976 -16.382 -11.224 1.00 0.00 H new ATOM 0 HB3 ALA A 29 2.538 -18.067 -11.109 1.00 0.00 H new ATOM 470 N ASP A 30 -0.136 -19.337 -13.276 1.00 0.00 N ATOM 471 CA ASP A 30 -0.360 -20.632 -13.968 1.00 0.00 C ATOM 472 C ASP A 30 0.946 -21.444 -14.073 1.00 0.00 C ATOM 473 O ASP A 30 0.921 -22.672 -14.123 1.00 0.00 O ATOM 474 CB ASP A 30 -0.975 -20.409 -15.375 1.00 0.00 C ATOM 475 CG ASP A 30 -1.287 -21.721 -16.139 1.00 0.00 C ATOM 476 OD1 ASP A 30 -2.136 -22.508 -15.671 1.00 0.00 O ATOM 477 OD2 ASP A 30 -0.682 -21.975 -17.205 1.00 0.00 O ATOM 0 H ASP A 30 -0.248 -18.520 -13.877 1.00 0.00 H new ATOM 0 HA ASP A 30 -1.067 -21.207 -13.370 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -1.894 -19.833 -15.272 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -0.287 -19.808 -15.970 1.00 0.00 H new ATOM 482 N ASP A 31 2.086 -20.743 -14.091 1.00 0.00 N ATOM 483 CA ASP A 31 3.425 -21.361 -14.163 1.00 0.00 C ATOM 484 C ASP A 31 4.145 -21.271 -12.798 1.00 0.00 C ATOM 485 O ASP A 31 5.368 -21.436 -12.735 1.00 0.00 O ATOM 486 CB ASP A 31 4.258 -20.668 -15.283 1.00 0.00 C ATOM 487 CG ASP A 31 4.679 -19.220 -14.947 1.00 0.00 C ATOM 488 OD1 ASP A 31 3.794 -18.390 -14.651 1.00 0.00 O ATOM 489 OD2 ASP A 31 5.893 -18.910 -14.968 1.00 0.00 O ATOM 0 H ASP A 31 2.111 -19.724 -14.056 1.00 0.00 H new ATOM 0 HA ASP A 31 3.318 -22.418 -14.407 1.00 0.00 H new ATOM 0 HB2 ASP A 31 5.153 -21.260 -15.476 1.00 0.00 H new ATOM 0 HB3 ASP A 31 3.675 -20.662 -16.204 1.00 0.00 H new ATOM 494 N CYS A 32 3.372 -21.042 -11.708 1.00 0.00 N ATOM 495 CA CYS A 32 3.929 -20.815 -10.357 1.00 0.00 C ATOM 496 C CYS A 32 4.746 -22.018 -9.858 1.00 0.00 C ATOM 497 O CYS A 32 4.315 -23.164 -9.982 1.00 0.00 O ATOM 498 CB CYS A 32 2.822 -20.500 -9.334 1.00 0.00 C ATOM 499 SG CYS A 32 3.442 -20.205 -7.661 1.00 0.00 S ATOM 0 H CYS A 32 2.353 -21.010 -11.742 1.00 0.00 H new ATOM 0 HA CYS A 32 4.592 -19.955 -10.446 1.00 0.00 H new ATOM 0 HB2 CYS A 32 2.270 -19.621 -9.668 1.00 0.00 H new ATOM 0 HB3 CYS A 32 2.115 -21.330 -9.309 1.00 0.00 H new ATOM 0 HG CYS A 32 2.733 -20.884 -6.809 1.00 0.00 H new ATOM 505 N GLN A 33 5.931 -21.735 -9.310 1.00 0.00 N ATOM 506 CA GLN A 33 6.820 -22.757 -8.747 1.00 0.00 C ATOM 507 C GLN A 33 6.458 -22.984 -7.273 1.00 0.00 C ATOM 508 O GLN A 33 6.003 -22.058 -6.590 1.00 0.00 O ATOM 509 CB GLN A 33 8.293 -22.308 -8.888 1.00 0.00 C ATOM 510 CG GLN A 33 8.708 -21.948 -10.324 1.00 0.00 C ATOM 511 CD GLN A 33 8.666 -23.115 -11.312 1.00 0.00 C ATOM 512 OE1 GLN A 33 9.627 -23.873 -11.448 1.00 0.00 O ATOM 513 NE2 GLN A 33 7.557 -23.249 -12.021 1.00 0.00 N ATOM 0 H GLN A 33 6.303 -20.787 -9.244 1.00 0.00 H new ATOM 0 HA GLN A 33 6.696 -23.694 -9.289 1.00 0.00 H new ATOM 0 HB2 GLN A 33 8.460 -21.443 -8.246 1.00 0.00 H new ATOM 0 HB3 GLN A 33 8.941 -23.106 -8.524 1.00 0.00 H new ATOM 0 HG2 GLN A 33 8.054 -21.156 -10.689 1.00 0.00 H new ATOM 0 HG3 GLN A 33 9.719 -21.542 -10.305 1.00 0.00 H new ATOM 0 HE21 GLN A 33 6.781 -22.602 -11.881 1.00 0.00 H new ATOM 0 HE22 GLN A 33 7.478 -23.999 -12.707 1.00 0.00 H new ATOM 522 N TYR A 34 6.660 -24.215 -6.795 1.00 0.00 N ATOM 523 CA TYR A 34 6.366 -24.598 -5.412 1.00 0.00 C ATOM 524 C TYR A 34 7.470 -25.531 -4.911 1.00 0.00 C ATOM 525 O TYR A 34 7.623 -26.639 -5.427 1.00 0.00 O ATOM 526 CB TYR A 34 4.974 -25.271 -5.320 1.00 0.00 C ATOM 527 CG TYR A 34 4.468 -25.493 -3.889 1.00 0.00 C ATOM 528 CD1 TYR A 34 3.989 -24.416 -3.132 1.00 0.00 C ATOM 529 CD2 TYR A 34 4.474 -26.760 -3.296 1.00 0.00 C ATOM 530 CE1 TYR A 34 3.532 -24.598 -1.845 1.00 0.00 C ATOM 531 CE2 TYR A 34 4.013 -26.943 -2.007 1.00 0.00 C ATOM 532 CZ TYR A 34 3.548 -25.860 -1.285 1.00 0.00 C ATOM 533 OH TYR A 34 3.076 -26.040 -0.005 1.00 0.00 O ATOM 0 H TYR A 34 7.034 -24.978 -7.360 1.00 0.00 H new ATOM 0 HA TYR A 34 6.339 -23.710 -4.780 1.00 0.00 H new ATOM 0 HB2 TYR A 34 4.251 -24.656 -5.856 1.00 0.00 H new ATOM 0 HB3 TYR A 34 5.015 -26.233 -5.831 1.00 0.00 H new ATOM 0 HD1 TYR A 34 3.978 -23.426 -3.564 1.00 0.00 H new ATOM 0 HD2 TYR A 34 4.844 -27.607 -3.854 1.00 0.00 H new ATOM 0 HE1 TYR A 34 3.163 -23.757 -1.277 1.00 0.00 H new ATOM 0 HE2 TYR A 34 4.016 -27.928 -1.565 1.00 0.00 H new ATOM 0 HH TYR A 34 2.101 -26.133 -0.026 1.00 0.00 H new ATOM 543 N TYR A 35 8.258 -25.050 -3.939 1.00 0.00 N ATOM 544 CA TYR A 35 9.360 -25.806 -3.322 1.00 0.00 C ATOM 545 C TYR A 35 9.000 -26.224 -1.887 1.00 0.00 C ATOM 546 O TYR A 35 8.172 -25.588 -1.222 1.00 0.00 O ATOM 547 CB TYR A 35 10.675 -24.980 -3.310 1.00 0.00 C ATOM 548 CG TYR A 35 11.248 -24.622 -4.699 1.00 0.00 C ATOM 549 CD1 TYR A 35 10.630 -23.674 -5.519 1.00 0.00 C ATOM 550 CD2 TYR A 35 12.419 -25.220 -5.176 1.00 0.00 C ATOM 551 CE1 TYR A 35 11.150 -23.347 -6.756 1.00 0.00 C ATOM 552 CE2 TYR A 35 12.942 -24.893 -6.412 1.00 0.00 C ATOM 553 CZ TYR A 35 12.306 -23.952 -7.197 1.00 0.00 C ATOM 554 OH TYR A 35 12.820 -23.623 -8.433 1.00 0.00 O ATOM 0 H TYR A 35 8.147 -24.112 -3.553 1.00 0.00 H new ATOM 0 HA TYR A 35 9.517 -26.700 -3.925 1.00 0.00 H new ATOM 0 HB2 TYR A 35 10.498 -24.056 -2.760 1.00 0.00 H new ATOM 0 HB3 TYR A 35 11.430 -25.540 -2.758 1.00 0.00 H new ATOM 0 HD1 TYR A 35 9.728 -23.187 -5.179 1.00 0.00 H new ATOM 0 HD2 TYR A 35 12.925 -25.953 -4.565 1.00 0.00 H new ATOM 0 HE1 TYR A 35 10.651 -22.618 -7.377 1.00 0.00 H new ATOM 0 HE2 TYR A 35 13.845 -25.371 -6.763 1.00 0.00 H new ATOM 0 HH TYR A 35 13.639 -24.137 -8.594 1.00 0.00 H new ATOM 564 N ALA A 36 9.647 -27.307 -1.441 1.00 0.00 N ATOM 565 CA ALA A 36 9.560 -27.833 -0.072 1.00 0.00 C ATOM 566 C ALA A 36 10.919 -27.677 0.619 1.00 0.00 C ATOM 567 O ALA A 36 11.950 -27.634 -0.064 1.00 0.00 O ATOM 568 CB ALA A 36 9.131 -29.308 -0.103 1.00 0.00 C ATOM 0 H ALA A 36 10.263 -27.858 -2.039 1.00 0.00 H new ATOM 0 HA ALA A 36 8.813 -27.272 0.490 1.00 0.00 H new ATOM 0 HB1 ALA A 36 9.069 -29.690 0.916 1.00 0.00 H new ATOM 0 HB2 ALA A 36 8.156 -29.393 -0.583 1.00 0.00 H new ATOM 0 HB3 ALA A 36 9.863 -29.888 -0.664 1.00 0.00 H new ATOM 574 N PHE A 37 10.898 -27.616 1.965 1.00 0.00 N ATOM 575 CA PHE A 37 12.100 -27.441 2.814 1.00 0.00 C ATOM 576 C PHE A 37 13.194 -28.502 2.500 1.00 0.00 C ATOM 577 O PHE A 37 12.892 -29.697 2.556 1.00 0.00 O ATOM 578 CB PHE A 37 11.685 -27.538 4.308 1.00 0.00 C ATOM 579 CG PHE A 37 12.829 -27.390 5.318 1.00 0.00 C ATOM 580 CD1 PHE A 37 13.502 -26.179 5.459 1.00 0.00 C ATOM 581 CD2 PHE A 37 13.216 -28.454 6.136 1.00 0.00 C ATOM 582 CE1 PHE A 37 14.520 -26.033 6.380 1.00 0.00 C ATOM 583 CE2 PHE A 37 14.239 -28.307 7.056 1.00 0.00 C ATOM 584 CZ PHE A 37 14.888 -27.095 7.179 1.00 0.00 C ATOM 0 H PHE A 37 10.035 -27.688 2.504 1.00 0.00 H new ATOM 0 HA PHE A 37 12.526 -26.461 2.601 1.00 0.00 H new ATOM 0 HB2 PHE A 37 10.941 -26.768 4.512 1.00 0.00 H new ATOM 0 HB3 PHE A 37 11.201 -28.501 4.471 1.00 0.00 H new ATOM 0 HD1 PHE A 37 13.223 -25.341 4.838 1.00 0.00 H new ATOM 0 HD2 PHE A 37 12.710 -29.404 6.049 1.00 0.00 H new ATOM 0 HE1 PHE A 37 15.029 -25.085 6.475 1.00 0.00 H new ATOM 0 HE2 PHE A 37 14.530 -29.141 7.678 1.00 0.00 H new ATOM 0 HZ PHE A 37 15.683 -26.979 7.900 1.00 0.00 H new ATOM 594 N PRO A 38 14.479 -28.106 2.177 1.00 0.00 N ATOM 595 CA PRO A 38 14.924 -26.691 2.008 1.00 0.00 C ATOM 596 C PRO A 38 14.491 -26.046 0.650 1.00 0.00 C ATOM 597 O PRO A 38 13.769 -25.041 0.647 1.00 0.00 O ATOM 598 CB PRO A 38 16.467 -26.797 2.147 1.00 0.00 C ATOM 599 CG PRO A 38 16.797 -28.171 1.643 1.00 0.00 C ATOM 600 CD PRO A 38 15.623 -29.050 2.037 1.00 0.00 C ATOM 0 HA PRO A 38 14.463 -26.027 2.740 1.00 0.00 H new ATOM 0 HB2 PRO A 38 16.972 -26.028 1.562 1.00 0.00 H new ATOM 0 HB3 PRO A 38 16.782 -26.668 3.183 1.00 0.00 H new ATOM 0 HG2 PRO A 38 16.937 -28.168 0.562 1.00 0.00 H new ATOM 0 HG3 PRO A 38 17.724 -28.537 2.084 1.00 0.00 H new ATOM 0 HD2 PRO A 38 15.422 -29.807 1.279 1.00 0.00 H new ATOM 0 HD3 PRO A 38 15.818 -29.578 2.970 1.00 0.00 H new ATOM 608 N ALA A 39 14.901 -26.646 -0.492 1.00 0.00 N ATOM 609 CA ALA A 39 14.593 -26.127 -1.842 1.00 0.00 C ATOM 610 C ALA A 39 14.388 -27.300 -2.818 1.00 0.00 C ATOM 611 O ALA A 39 15.294 -27.665 -3.577 1.00 0.00 O ATOM 612 CB ALA A 39 15.713 -25.178 -2.326 1.00 0.00 C ATOM 0 H ALA A 39 15.454 -27.503 -0.502 1.00 0.00 H new ATOM 0 HA ALA A 39 13.669 -25.550 -1.803 1.00 0.00 H new ATOM 0 HB1 ALA A 39 15.470 -24.806 -3.321 1.00 0.00 H new ATOM 0 HB2 ALA A 39 15.802 -24.339 -1.636 1.00 0.00 H new ATOM 0 HB3 ALA A 39 16.658 -25.720 -2.362 1.00 0.00 H new ATOM 618 N THR A 40 13.197 -27.913 -2.761 1.00 0.00 N ATOM 619 CA THR A 40 12.851 -29.096 -3.572 1.00 0.00 C ATOM 620 C THR A 40 11.555 -28.827 -4.355 1.00 0.00 C ATOM 621 O THR A 40 10.466 -28.807 -3.771 1.00 0.00 O ATOM 622 CB THR A 40 12.707 -30.356 -2.654 1.00 0.00 C ATOM 623 OG1 THR A 40 13.957 -30.590 -1.979 1.00 0.00 O ATOM 624 CG2 THR A 40 12.296 -31.623 -3.435 1.00 0.00 C ATOM 0 H THR A 40 12.442 -27.603 -2.150 1.00 0.00 H new ATOM 0 HA THR A 40 13.650 -29.292 -4.287 1.00 0.00 H new ATOM 0 HB THR A 40 11.910 -30.151 -1.939 1.00 0.00 H new ATOM 0 HG1 THR A 40 13.874 -31.377 -1.401 1.00 0.00 H new ATOM 0 HG21 THR A 40 12.212 -32.464 -2.746 1.00 0.00 H new ATOM 0 HG22 THR A 40 11.335 -31.455 -3.921 1.00 0.00 H new ATOM 0 HG23 THR A 40 13.050 -31.846 -4.189 1.00 0.00 H new ATOM 632 N LEU A 41 11.690 -28.604 -5.676 1.00 0.00 N ATOM 633 CA LEU A 41 10.568 -28.232 -6.559 1.00 0.00 C ATOM 634 C LEU A 41 9.549 -29.387 -6.673 1.00 0.00 C ATOM 635 O LEU A 41 9.794 -30.377 -7.366 1.00 0.00 O ATOM 636 CB LEU A 41 11.113 -27.835 -7.964 1.00 0.00 C ATOM 637 CG LEU A 41 10.063 -27.304 -8.992 1.00 0.00 C ATOM 638 CD1 LEU A 41 9.414 -25.991 -8.514 1.00 0.00 C ATOM 639 CD2 LEU A 41 10.680 -27.145 -10.400 1.00 0.00 C ATOM 0 H LEU A 41 12.583 -28.677 -6.163 1.00 0.00 H new ATOM 0 HA LEU A 41 10.051 -27.376 -6.126 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.877 -27.070 -7.830 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.606 -28.705 -8.398 1.00 0.00 H new ATOM 0 HG LEU A 41 9.273 -28.052 -9.061 1.00 0.00 H new ATOM 0 HD11 LEU A 41 8.690 -25.652 -9.255 1.00 0.00 H new ATOM 0 HD12 LEU A 41 8.909 -26.160 -7.563 1.00 0.00 H new ATOM 0 HD13 LEU A 41 10.184 -25.230 -8.385 1.00 0.00 H new ATOM 0 HD21 LEU A 41 9.922 -26.774 -11.090 1.00 0.00 H new ATOM 0 HD22 LEU A 41 11.508 -26.438 -10.357 1.00 0.00 H new ATOM 0 HD23 LEU A 41 11.046 -28.111 -10.748 1.00 0.00 H new ATOM 651 N LEU A 42 8.424 -29.257 -5.947 1.00 0.00 N ATOM 652 CA LEU A 42 7.306 -30.217 -6.004 1.00 0.00 C ATOM 653 C LEU A 42 6.434 -29.958 -7.246 1.00 0.00 C ATOM 654 O LEU A 42 5.915 -30.902 -7.860 1.00 0.00 O ATOM 655 CB LEU A 42 6.422 -30.119 -4.726 1.00 0.00 C ATOM 656 CG LEU A 42 7.155 -30.235 -3.352 1.00 0.00 C ATOM 657 CD1 LEU A 42 6.145 -30.250 -2.183 1.00 0.00 C ATOM 658 CD2 LEU A 42 8.099 -31.459 -3.304 1.00 0.00 C ATOM 0 H LEU A 42 8.264 -28.482 -5.303 1.00 0.00 H new ATOM 0 HA LEU A 42 7.733 -31.218 -6.064 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.895 -29.165 -4.750 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.666 -30.903 -4.775 1.00 0.00 H new ATOM 0 HG LEU A 42 7.780 -29.349 -3.240 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.683 -30.332 -1.238 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.565 -29.327 -2.192 1.00 0.00 H new ATOM 0 HD13 LEU A 42 5.474 -31.102 -2.293 1.00 0.00 H new ATOM 0 HD21 LEU A 42 8.589 -31.503 -2.331 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.522 -32.370 -3.461 1.00 0.00 H new ATOM 0 HD23 LEU A 42 8.853 -31.368 -4.086 1.00 0.00 H new ATOM 670 N ALA A 43 6.281 -28.670 -7.605 1.00 0.00 N ATOM 671 CA ALA A 43 5.338 -28.239 -8.656 1.00 0.00 C ATOM 672 C ALA A 43 5.919 -27.088 -9.495 1.00 0.00 C ATOM 673 O ALA A 43 6.235 -26.030 -8.953 1.00 0.00 O ATOM 674 CB ALA A 43 4.025 -27.815 -7.996 1.00 0.00 C ATOM 0 H ALA A 43 6.802 -27.904 -7.179 1.00 0.00 H new ATOM 0 HA ALA A 43 5.159 -29.072 -9.335 1.00 0.00 H new ATOM 0 HB1 ALA A 43 3.320 -27.494 -8.762 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.605 -28.658 -7.446 1.00 0.00 H new ATOM 0 HB3 ALA A 43 4.213 -26.991 -7.308 1.00 0.00 H new ATOM 680 N GLY A 44 6.037 -27.307 -10.819 1.00 0.00 N ATOM 681 CA GLY A 44 6.553 -26.303 -11.758 1.00 0.00 C ATOM 682 C GLY A 44 5.441 -25.590 -12.533 1.00 0.00 C ATOM 683 O GLY A 44 5.641 -25.190 -13.688 1.00 0.00 O ATOM 0 H GLY A 44 5.776 -28.187 -11.264 1.00 0.00 H new ATOM 0 HA2 GLY A 44 7.138 -25.565 -11.209 1.00 0.00 H new ATOM 0 HA3 GLY A 44 7.230 -26.785 -12.463 1.00 0.00 H new ATOM 687 N ASN A 45 4.307 -25.374 -11.842 1.00 0.00 N ATOM 688 CA ASN A 45 3.029 -24.853 -12.409 1.00 0.00 C ATOM 689 C ASN A 45 1.893 -25.018 -11.376 1.00 0.00 C ATOM 690 O ASN A 45 1.989 -25.849 -10.466 1.00 0.00 O ATOM 691 CB ASN A 45 2.606 -25.511 -13.767 1.00 0.00 C ATOM 692 CG ASN A 45 2.271 -27.002 -13.667 1.00 0.00 C ATOM 693 OD1 ASN A 45 1.137 -27.384 -13.375 1.00 0.00 O ATOM 694 ND2 ASN A 45 3.246 -27.850 -13.945 1.00 0.00 N ATOM 0 H ASN A 45 4.243 -25.560 -10.841 1.00 0.00 H new ATOM 0 HA ASN A 45 3.208 -23.800 -12.628 1.00 0.00 H new ATOM 0 HB2 ASN A 45 1.738 -24.981 -14.159 1.00 0.00 H new ATOM 0 HB3 ASN A 45 3.413 -25.379 -14.488 1.00 0.00 H new ATOM 0 HD21 ASN A 45 3.070 -28.854 -13.921 1.00 0.00 H new ATOM 0 HD22 ASN A 45 4.174 -27.500 -14.183 1.00 0.00 H new ATOM 701 N ALA A 46 0.798 -24.256 -11.582 1.00 0.00 N ATOM 702 CA ALA A 46 -0.338 -24.151 -10.638 1.00 0.00 C ATOM 703 C ALA A 46 -1.103 -25.482 -10.467 1.00 0.00 C ATOM 704 O ALA A 46 -1.540 -25.816 -9.361 1.00 0.00 O ATOM 705 CB ALA A 46 -1.298 -23.046 -11.110 1.00 0.00 C ATOM 0 H ALA A 46 0.675 -23.688 -12.420 1.00 0.00 H new ATOM 0 HA ALA A 46 0.075 -23.900 -9.661 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -2.134 -22.969 -10.415 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.768 -22.094 -11.147 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.674 -23.290 -12.104 1.00 0.00 H new ATOM 711 N ALA A 47 -1.235 -26.238 -11.569 1.00 0.00 N ATOM 712 CA ALA A 47 -2.052 -27.468 -11.611 1.00 0.00 C ATOM 713 C ALA A 47 -1.556 -28.516 -10.610 1.00 0.00 C ATOM 714 O ALA A 47 -2.352 -29.223 -9.997 1.00 0.00 O ATOM 715 CB ALA A 47 -2.072 -28.062 -13.023 1.00 0.00 C ATOM 0 H ALA A 47 -0.781 -26.017 -12.455 1.00 0.00 H new ATOM 0 HA ALA A 47 -3.067 -27.187 -11.329 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.680 -28.967 -13.029 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -2.496 -27.336 -13.717 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.055 -28.306 -13.329 1.00 0.00 H new ATOM 721 N GLU A 48 -0.233 -28.614 -10.469 1.00 0.00 N ATOM 722 CA GLU A 48 0.402 -29.568 -9.545 1.00 0.00 C ATOM 723 C GLU A 48 0.311 -29.068 -8.083 1.00 0.00 C ATOM 724 O GLU A 48 0.176 -29.872 -7.152 1.00 0.00 O ATOM 725 CB GLU A 48 1.867 -29.812 -9.970 1.00 0.00 C ATOM 726 CG GLU A 48 2.051 -30.115 -11.465 1.00 0.00 C ATOM 727 CD GLU A 48 3.504 -30.470 -11.823 1.00 0.00 C ATOM 728 OE1 GLU A 48 4.355 -29.560 -11.862 1.00 0.00 O ATOM 729 OE2 GLU A 48 3.797 -31.653 -12.083 1.00 0.00 O ATOM 0 H GLU A 48 0.430 -28.039 -10.988 1.00 0.00 H new ATOM 0 HA GLU A 48 -0.133 -30.517 -9.594 1.00 0.00 H new ATOM 0 HB2 GLU A 48 2.458 -28.933 -9.714 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.267 -30.644 -9.391 1.00 0.00 H new ATOM 0 HG2 GLU A 48 1.399 -30.942 -11.747 1.00 0.00 H new ATOM 0 HG3 GLU A 48 1.738 -29.249 -12.048 1.00 0.00 H new ATOM 736 N ILE A 49 0.366 -27.724 -7.907 1.00 0.00 N ATOM 737 CA ILE A 49 0.289 -27.064 -6.580 1.00 0.00 C ATOM 738 C ILE A 49 -1.055 -27.367 -5.898 1.00 0.00 C ATOM 739 O ILE A 49 -1.088 -27.781 -4.727 1.00 0.00 O ATOM 740 CB ILE A 49 0.469 -25.495 -6.690 1.00 0.00 C ATOM 741 CG1 ILE A 49 1.846 -25.144 -7.321 1.00 0.00 C ATOM 742 CG2 ILE A 49 0.297 -24.792 -5.316 1.00 0.00 C ATOM 743 CD1 ILE A 49 2.103 -23.670 -7.561 1.00 0.00 C ATOM 0 H ILE A 49 0.465 -27.068 -8.681 1.00 0.00 H new ATOM 0 HA ILE A 49 1.106 -27.466 -5.981 1.00 0.00 H new ATOM 0 HB ILE A 49 -0.319 -25.122 -7.344 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.632 -25.530 -6.671 1.00 0.00 H new ATOM 0 HG13 ILE A 49 1.933 -25.669 -8.272 1.00 0.00 H new ATOM 0 HG21 ILE A 49 0.429 -23.717 -5.438 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -0.701 -24.993 -4.927 1.00 0.00 H new ATOM 0 HG23 ILE A 49 1.042 -25.172 -4.617 1.00 0.00 H new ATOM 0 HD11 ILE A 49 3.091 -23.540 -8.003 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.347 -23.275 -8.239 1.00 0.00 H new ATOM 0 HD13 ILE A 49 2.056 -23.133 -6.613 1.00 0.00 H new ATOM 755 N ARG A 50 -2.158 -27.149 -6.646 1.00 0.00 N ATOM 756 CA ARG A 50 -3.520 -27.338 -6.116 1.00 0.00 C ATOM 757 C ARG A 50 -3.740 -28.803 -5.705 1.00 0.00 C ATOM 758 O ARG A 50 -4.128 -29.045 -4.574 1.00 0.00 O ATOM 759 CB ARG A 50 -4.611 -26.869 -7.122 1.00 0.00 C ATOM 760 CG ARG A 50 -4.592 -27.580 -8.493 1.00 0.00 C ATOM 761 CD ARG A 50 -5.596 -27.004 -9.492 1.00 0.00 C ATOM 762 NE ARG A 50 -5.558 -27.703 -10.798 1.00 0.00 N ATOM 763 CZ ARG A 50 -5.793 -27.131 -11.995 1.00 0.00 C ATOM 764 NH1 ARG A 50 -6.067 -25.835 -12.087 1.00 0.00 N ATOM 765 NH2 ARG A 50 -5.749 -27.866 -13.097 1.00 0.00 N ATOM 0 H ARG A 50 -2.129 -26.842 -7.618 1.00 0.00 H new ATOM 0 HA ARG A 50 -3.616 -26.710 -5.230 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -5.590 -27.018 -6.667 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -4.495 -25.797 -7.285 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -3.590 -27.510 -8.916 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -4.803 -28.639 -8.347 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -6.601 -27.074 -9.075 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -5.387 -25.945 -9.644 1.00 0.00 H new ATOM 0 HE ARG A 50 -5.336 -28.698 -10.790 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -6.101 -25.260 -11.245 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -6.243 -25.414 -12.999 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -5.538 -28.862 -13.038 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -5.927 -27.436 -14.005 1.00 0.00 H new ATOM 779 N VAL A 51 -3.408 -29.760 -6.610 1.00 0.00 N ATOM 780 CA VAL A 51 -3.637 -31.211 -6.391 1.00 0.00 C ATOM 781 C VAL A 51 -2.891 -31.695 -5.136 1.00 0.00 C ATOM 782 O VAL A 51 -3.461 -32.419 -4.314 1.00 0.00 O ATOM 783 CB VAL A 51 -3.214 -32.066 -7.648 1.00 0.00 C ATOM 784 CG1 VAL A 51 -3.369 -33.593 -7.393 1.00 0.00 C ATOM 785 CG2 VAL A 51 -4.019 -31.637 -8.900 1.00 0.00 C ATOM 0 H VAL A 51 -2.975 -29.548 -7.509 1.00 0.00 H new ATOM 0 HA VAL A 51 -4.707 -31.353 -6.240 1.00 0.00 H new ATOM 0 HB VAL A 51 -2.157 -31.872 -7.829 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.067 -34.143 -8.284 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -2.739 -33.888 -6.554 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -4.410 -33.820 -7.162 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.711 -32.239 -9.755 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -5.083 -31.785 -8.716 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -3.830 -30.584 -9.111 1.00 0.00 H new ATOM 795 N ARG A 52 -1.635 -31.228 -4.987 1.00 0.00 N ATOM 796 CA ARG A 52 -0.787 -31.528 -3.816 1.00 0.00 C ATOM 797 C ARG A 52 -1.503 -31.133 -2.509 1.00 0.00 C ATOM 798 O ARG A 52 -1.497 -31.883 -1.526 1.00 0.00 O ATOM 799 CB ARG A 52 0.581 -30.793 -3.923 1.00 0.00 C ATOM 800 CG ARG A 52 1.589 -31.090 -2.777 1.00 0.00 C ATOM 801 CD ARG A 52 2.462 -32.347 -3.023 1.00 0.00 C ATOM 802 NE ARG A 52 1.695 -33.613 -3.138 1.00 0.00 N ATOM 803 CZ ARG A 52 2.234 -34.846 -3.134 1.00 0.00 C ATOM 804 NH1 ARG A 52 3.523 -35.031 -2.888 1.00 0.00 N ATOM 805 NH2 ARG A 52 1.462 -35.896 -3.349 1.00 0.00 N ATOM 0 H ARG A 52 -1.179 -30.631 -5.677 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.603 -32.602 -3.800 1.00 0.00 H new ATOM 0 HB2 ARG A 52 1.046 -31.062 -4.872 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.396 -29.719 -3.952 1.00 0.00 H new ATOM 0 HG2 ARG A 52 2.241 -30.226 -2.646 1.00 0.00 H new ATOM 0 HG3 ARG A 52 1.038 -31.218 -1.845 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.038 -32.201 -3.937 1.00 0.00 H new ATOM 0 HD3 ARG A 52 3.178 -32.443 -2.207 1.00 0.00 H new ATOM 0 HE ARG A 52 0.681 -33.543 -3.227 1.00 0.00 H new ATOM 0 HH11 ARG A 52 4.126 -34.231 -2.697 1.00 0.00 H new ATOM 0 HH12 ARG A 52 3.912 -35.974 -2.890 1.00 0.00 H new ATOM 0 HH21 ARG A 52 0.464 -35.769 -3.517 1.00 0.00 H new ATOM 0 HH22 ARG A 52 1.864 -36.833 -3.347 1.00 0.00 H new ATOM 819 N HIS A 53 -2.128 -29.944 -2.525 1.00 0.00 N ATOM 820 CA HIS A 53 -2.855 -29.406 -1.362 1.00 0.00 C ATOM 821 C HIS A 53 -4.242 -30.048 -1.190 1.00 0.00 C ATOM 822 O HIS A 53 -4.702 -30.155 -0.073 1.00 0.00 O ATOM 823 CB HIS A 53 -2.965 -27.871 -1.457 1.00 0.00 C ATOM 824 CG HIS A 53 -1.648 -27.161 -1.283 1.00 0.00 C ATOM 825 ND1 HIS A 53 -1.079 -26.368 -2.258 1.00 0.00 N ATOM 826 CD2 HIS A 53 -0.817 -27.093 -0.214 1.00 0.00 C ATOM 827 CE1 HIS A 53 0.038 -25.842 -1.797 1.00 0.00 C ATOM 828 NE2 HIS A 53 0.216 -26.263 -0.560 1.00 0.00 N ATOM 0 H HIS A 53 -2.144 -29.331 -3.340 1.00 0.00 H new ATOM 0 HA HIS A 53 -2.278 -29.662 -0.473 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -3.387 -27.604 -2.426 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -3.662 -27.517 -0.698 1.00 0.00 H new ATOM 0 HD1 HIS A 53 -1.463 -26.213 -3.190 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -0.945 -27.598 0.732 1.00 0.00 H new ATOM 0 HE1 HIS A 53 0.696 -25.179 -2.340 1.00 0.00 H new ATOM 837 N ILE A 54 -4.888 -30.480 -2.288 1.00 0.00 N ATOM 838 CA ILE A 54 -6.223 -31.128 -2.237 1.00 0.00 C ATOM 839 C ILE A 54 -6.139 -32.425 -1.408 1.00 0.00 C ATOM 840 O ILE A 54 -7.042 -32.737 -0.627 1.00 0.00 O ATOM 841 CB ILE A 54 -6.754 -31.421 -3.692 1.00 0.00 C ATOM 842 CG1 ILE A 54 -7.043 -30.094 -4.455 1.00 0.00 C ATOM 843 CG2 ILE A 54 -8.005 -32.322 -3.689 1.00 0.00 C ATOM 844 CD1 ILE A 54 -7.383 -30.256 -5.923 1.00 0.00 C ATOM 0 H ILE A 54 -4.508 -30.394 -3.231 1.00 0.00 H new ATOM 0 HA ILE A 54 -6.929 -30.451 -1.756 1.00 0.00 H new ATOM 0 HB ILE A 54 -5.965 -31.963 -4.212 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -7.869 -29.582 -3.961 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -6.170 -29.447 -4.370 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -8.332 -32.494 -4.714 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -7.765 -33.276 -3.219 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -8.804 -31.834 -3.131 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -7.567 -29.276 -6.364 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -6.551 -30.736 -6.438 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -8.276 -30.873 -6.024 1.00 0.00 H new ATOM 856 N GLU A 55 -5.011 -33.137 -1.584 1.00 0.00 N ATOM 857 CA GLU A 55 -4.661 -34.337 -0.799 1.00 0.00 C ATOM 858 C GLU A 55 -4.589 -34.001 0.707 1.00 0.00 C ATOM 859 O GLU A 55 -5.053 -34.776 1.547 1.00 0.00 O ATOM 860 CB GLU A 55 -3.309 -34.900 -1.311 1.00 0.00 C ATOM 861 CG GLU A 55 -3.303 -35.260 -2.811 1.00 0.00 C ATOM 862 CD GLU A 55 -1.912 -35.671 -3.321 1.00 0.00 C ATOM 863 OE1 GLU A 55 -1.504 -36.835 -3.108 1.00 0.00 O ATOM 864 OE2 GLU A 55 -1.201 -34.826 -3.908 1.00 0.00 O ATOM 0 H GLU A 55 -4.309 -32.893 -2.283 1.00 0.00 H new ATOM 0 HA GLU A 55 -5.434 -35.095 -0.927 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.527 -34.165 -1.122 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.057 -35.790 -0.734 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -4.005 -36.075 -2.987 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -3.658 -34.405 -3.386 1.00 0.00 H new ATOM 871 N ARG A 56 -4.022 -32.822 1.019 1.00 0.00 N ATOM 872 CA ARG A 56 -3.933 -32.309 2.403 1.00 0.00 C ATOM 873 C ARG A 56 -5.334 -31.891 2.936 1.00 0.00 C ATOM 874 O ARG A 56 -5.620 -32.033 4.128 1.00 0.00 O ATOM 875 CB ARG A 56 -2.925 -31.123 2.465 1.00 0.00 C ATOM 876 CG ARG A 56 -2.610 -30.595 3.886 1.00 0.00 C ATOM 877 CD ARG A 56 -2.065 -31.690 4.833 1.00 0.00 C ATOM 878 NE ARG A 56 -0.838 -32.328 4.315 1.00 0.00 N ATOM 879 CZ ARG A 56 -0.454 -33.590 4.565 1.00 0.00 C ATOM 880 NH1 ARG A 56 -1.223 -34.418 5.262 1.00 0.00 N ATOM 881 NH2 ARG A 56 0.694 -34.032 4.076 1.00 0.00 N ATOM 0 H ARG A 56 -3.613 -32.198 0.323 1.00 0.00 H new ATOM 0 HA ARG A 56 -3.567 -33.107 3.050 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -1.992 -31.436 1.997 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -3.320 -30.300 1.869 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -1.880 -29.789 3.814 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -3.515 -30.168 4.317 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -1.858 -31.251 5.809 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -2.831 -32.451 4.982 1.00 0.00 H new ATOM 0 HE ARG A 56 -0.233 -31.764 3.719 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -2.124 -34.099 5.618 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -0.913 -35.373 5.441 1.00 0.00 H new ATOM 0 HH21 ARG A 56 1.280 -33.415 3.514 1.00 0.00 H new ATOM 0 HH22 ARG A 56 0.992 -34.990 4.262 1.00 0.00 H new ATOM 895 N PHE A 57 -6.204 -31.392 2.029 1.00 0.00 N ATOM 896 CA PHE A 57 -7.585 -30.948 2.363 1.00 0.00 C ATOM 897 C PHE A 57 -8.536 -32.152 2.606 1.00 0.00 C ATOM 898 O PHE A 57 -9.682 -31.953 3.023 1.00 0.00 O ATOM 899 CB PHE A 57 -8.155 -30.015 1.240 1.00 0.00 C ATOM 900 CG PHE A 57 -7.661 -28.555 1.239 1.00 0.00 C ATOM 901 CD1 PHE A 57 -6.323 -28.234 1.443 1.00 0.00 C ATOM 902 CD2 PHE A 57 -8.549 -27.500 0.998 1.00 0.00 C ATOM 903 CE1 PHE A 57 -5.887 -26.925 1.408 1.00 0.00 C ATOM 904 CE2 PHE A 57 -8.111 -26.188 0.969 1.00 0.00 C ATOM 905 CZ PHE A 57 -6.779 -25.904 1.172 1.00 0.00 C ATOM 0 H PHE A 57 -5.972 -31.284 1.042 1.00 0.00 H new ATOM 0 HA PHE A 57 -7.528 -30.382 3.292 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.912 -30.457 0.274 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -9.242 -30.007 1.323 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -5.612 -29.024 1.632 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -9.594 -27.714 0.832 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -4.842 -26.701 1.566 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -8.813 -25.388 0.787 1.00 0.00 H new ATOM 0 HZ PHE A 57 -6.435 -24.881 1.146 1.00 0.00 H new ATOM 915 N LYS A 58 -8.074 -33.393 2.318 1.00 0.00 N ATOM 916 CA LYS A 58 -8.839 -34.627 2.627 1.00 0.00 C ATOM 917 C LYS A 58 -8.880 -34.902 4.139 1.00 0.00 C ATOM 918 O LYS A 58 -9.810 -35.558 4.624 1.00 0.00 O ATOM 919 CB LYS A 58 -8.243 -35.850 1.885 1.00 0.00 C ATOM 920 CG LYS A 58 -8.181 -35.689 0.356 1.00 0.00 C ATOM 921 CD LYS A 58 -9.552 -35.346 -0.276 1.00 0.00 C ATOM 922 CE LYS A 58 -9.426 -34.987 -1.757 1.00 0.00 C ATOM 923 NZ LYS A 58 -10.715 -34.548 -2.334 1.00 0.00 N ATOM 0 H LYS A 58 -7.174 -33.567 1.871 1.00 0.00 H new ATOM 0 HA LYS A 58 -9.860 -34.467 2.280 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -7.237 -36.034 2.261 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -8.839 -36.731 2.123 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -7.467 -34.904 0.108 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -7.805 -36.612 -0.085 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -10.225 -36.196 -0.165 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -10.001 -34.511 0.263 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -8.687 -34.194 -1.876 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -9.058 -35.852 -2.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -10.584 -34.315 -3.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -11.414 -35.313 -2.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -11.055 -33.707 -1.825 1.00 0.00 H new ATOM 937 N GLU A 59 -7.848 -34.424 4.866 1.00 0.00 N ATOM 938 CA GLU A 59 -7.802 -34.505 6.334 1.00 0.00 C ATOM 939 C GLU A 59 -8.893 -33.597 6.933 1.00 0.00 C ATOM 940 O GLU A 59 -8.849 -32.384 6.724 1.00 0.00 O ATOM 941 CB GLU A 59 -6.395 -34.117 6.888 1.00 0.00 C ATOM 942 CG GLU A 59 -5.294 -35.190 6.700 1.00 0.00 C ATOM 943 CD GLU A 59 -4.917 -35.468 5.229 1.00 0.00 C ATOM 944 OE1 GLU A 59 -4.030 -34.772 4.698 1.00 0.00 O ATOM 945 OE2 GLU A 59 -5.500 -36.392 4.608 1.00 0.00 O ATOM 0 H GLU A 59 -7.031 -33.975 4.452 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.989 -35.538 6.628 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -6.071 -33.198 6.400 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -6.489 -33.898 7.952 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -4.400 -34.874 7.238 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -5.629 -36.121 7.158 1.00 0.00 H new ATOM 952 N PRO A 60 -9.906 -34.161 7.674 1.00 0.00 N ATOM 953 CA PRO A 60 -10.942 -33.342 8.356 1.00 0.00 C ATOM 954 C PRO A 60 -10.324 -32.526 9.518 1.00 0.00 C ATOM 955 O PRO A 60 -10.854 -31.489 9.933 1.00 0.00 O ATOM 956 CB PRO A 60 -11.959 -34.398 8.862 1.00 0.00 C ATOM 957 CG PRO A 60 -11.148 -35.653 9.029 1.00 0.00 C ATOM 958 CD PRO A 60 -10.112 -35.619 7.924 1.00 0.00 C ATOM 0 HA PRO A 60 -11.405 -32.600 7.706 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -12.414 -34.091 9.804 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -12.770 -34.542 8.148 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -10.674 -35.686 10.010 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -11.777 -36.540 8.949 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -9.186 -36.107 8.228 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -10.464 -36.133 7.029 1.00 0.00 H new ATOM 966 N ASP A 61 -9.169 -33.022 9.991 1.00 0.00 N ATOM 967 CA ASP A 61 -8.383 -32.455 11.093 1.00 0.00 C ATOM 968 C ASP A 61 -7.413 -31.352 10.623 1.00 0.00 C ATOM 969 O ASP A 61 -6.754 -30.720 11.462 1.00 0.00 O ATOM 970 CB ASP A 61 -7.609 -33.601 11.794 1.00 0.00 C ATOM 971 CG ASP A 61 -6.756 -34.455 10.824 1.00 0.00 C ATOM 972 OD1 ASP A 61 -7.305 -35.406 10.215 1.00 0.00 O ATOM 973 OD2 ASP A 61 -5.547 -34.192 10.674 1.00 0.00 O ATOM 0 H ASP A 61 -8.743 -33.862 9.599 1.00 0.00 H new ATOM 0 HA ASP A 61 -9.070 -31.979 11.793 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -6.959 -33.175 12.558 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.320 -34.249 12.306 1.00 0.00 H new ATOM 978 N LEU A 62 -7.318 -31.129 9.291 1.00 0.00 N ATOM 979 CA LEU A 62 -6.494 -30.040 8.727 1.00 0.00 C ATOM 980 C LEU A 62 -7.024 -28.673 9.193 1.00 0.00 C ATOM 981 O LEU A 62 -8.181 -28.332 8.930 1.00 0.00 O ATOM 982 CB LEU A 62 -6.475 -30.062 7.168 1.00 0.00 C ATOM 983 CG LEU A 62 -5.719 -28.856 6.503 1.00 0.00 C ATOM 984 CD1 LEU A 62 -4.214 -28.898 6.824 1.00 0.00 C ATOM 985 CD2 LEU A 62 -5.976 -28.767 4.987 1.00 0.00 C ATOM 0 H LEU A 62 -7.802 -31.690 8.590 1.00 0.00 H new ATOM 0 HA LEU A 62 -5.477 -30.197 9.087 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -6.011 -30.991 6.837 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -7.503 -30.073 6.806 1.00 0.00 H new ATOM 0 HG LEU A 62 -6.127 -27.944 6.939 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -3.717 -28.051 6.350 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -4.071 -28.846 7.903 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.787 -29.827 6.446 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.431 -27.917 4.575 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.636 -29.684 4.506 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.043 -28.636 4.806 1.00 0.00 H new ATOM 997 N TYR A 63 -6.169 -27.902 9.876 1.00 0.00 N ATOM 998 CA TYR A 63 -6.484 -26.522 10.257 1.00 0.00 C ATOM 999 C TYR A 63 -5.186 -25.702 10.342 1.00 0.00 C ATOM 1000 O TYR A 63 -4.316 -26.004 11.162 1.00 0.00 O ATOM 1001 CB TYR A 63 -7.248 -26.497 11.610 1.00 0.00 C ATOM 1002 CG TYR A 63 -7.756 -25.106 12.011 1.00 0.00 C ATOM 1003 CD1 TYR A 63 -8.895 -24.564 11.412 1.00 0.00 C ATOM 1004 CD2 TYR A 63 -7.089 -24.331 12.963 1.00 0.00 C ATOM 1005 CE1 TYR A 63 -9.355 -23.305 11.754 1.00 0.00 C ATOM 1006 CE2 TYR A 63 -7.548 -23.074 13.309 1.00 0.00 C ATOM 1007 CZ TYR A 63 -8.674 -22.562 12.699 1.00 0.00 C ATOM 1008 OH TYR A 63 -9.124 -21.307 13.039 1.00 0.00 O ATOM 0 H TYR A 63 -5.246 -28.215 10.178 1.00 0.00 H new ATOM 0 HA TYR A 63 -7.129 -26.076 9.500 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -8.096 -27.179 11.550 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.591 -26.873 12.394 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -9.427 -25.138 10.668 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -6.200 -24.721 13.436 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -10.242 -22.905 11.285 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -7.026 -22.494 14.056 1.00 0.00 H new ATOM 0 HH TYR A 63 -8.533 -20.920 13.718 1.00 0.00 H new ATOM 1018 N GLY A 64 -5.066 -24.667 9.493 1.00 0.00 N ATOM 1019 CA GLY A 64 -3.939 -23.738 9.559 1.00 0.00 C ATOM 1020 C GLY A 64 -4.286 -22.551 10.439 1.00 0.00 C ATOM 1021 O GLY A 64 -5.040 -21.668 10.015 1.00 0.00 O ATOM 0 H GLY A 64 -5.739 -24.458 8.755 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -3.061 -24.248 9.955 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -3.683 -23.394 8.557 1.00 0.00 H new ATOM 1025 N GLU A 65 -3.767 -22.554 11.678 1.00 0.00 N ATOM 1026 CA GLU A 65 -3.981 -21.460 12.641 1.00 0.00 C ATOM 1027 C GLU A 65 -2.805 -20.484 12.573 1.00 0.00 C ATOM 1028 O GLU A 65 -1.716 -20.782 13.081 1.00 0.00 O ATOM 1029 CB GLU A 65 -4.157 -22.022 14.079 1.00 0.00 C ATOM 1030 CG GLU A 65 -4.365 -20.940 15.164 1.00 0.00 C ATOM 1031 CD GLU A 65 -4.810 -21.501 16.529 1.00 0.00 C ATOM 1032 OE1 GLU A 65 -3.973 -22.103 17.236 1.00 0.00 O ATOM 1033 OE2 GLU A 65 -5.989 -21.319 16.912 1.00 0.00 O ATOM 0 H GLU A 65 -3.189 -23.312 12.040 1.00 0.00 H new ATOM 0 HA GLU A 65 -4.896 -20.927 12.381 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -5.011 -22.700 14.090 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -3.278 -22.613 14.336 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -3.435 -20.388 15.295 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -5.112 -20.228 14.814 1.00 0.00 H new ATOM 1040 N LEU A 66 -3.025 -19.335 11.914 1.00 0.00 N ATOM 1041 CA LEU A 66 -1.977 -18.329 11.725 1.00 0.00 C ATOM 1042 C LEU A 66 -1.596 -17.678 13.066 1.00 0.00 C ATOM 1043 O LEU A 66 -2.457 -17.389 13.903 1.00 0.00 O ATOM 1044 CB LEU A 66 -2.394 -17.227 10.735 1.00 0.00 C ATOM 1045 CG LEU A 66 -1.236 -16.235 10.348 1.00 0.00 C ATOM 1046 CD1 LEU A 66 -0.385 -16.773 9.174 1.00 0.00 C ATOM 1047 CD2 LEU A 66 -1.774 -14.828 10.053 1.00 0.00 C ATOM 0 H LEU A 66 -3.924 -19.083 11.503 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.118 -18.855 11.309 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.775 -17.695 9.827 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.216 -16.657 11.168 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.578 -16.159 11.214 1.00 0.00 H new ATOM 0 HD11 LEU A 66 0.403 -16.058 8.938 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.062 -17.726 9.456 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.020 -16.914 8.299 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.946 -14.170 9.789 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.479 -14.875 9.223 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.279 -14.439 10.937 1.00 0.00 H new ATOM 1059 N LEU A 67 -0.296 -17.458 13.229 1.00 0.00 N ATOM 1060 CA LEU A 67 0.300 -16.857 14.426 1.00 0.00 C ATOM 1061 C LEU A 67 0.747 -15.437 14.081 1.00 0.00 C ATOM 1062 O LEU A 67 0.355 -14.454 14.717 1.00 0.00 O ATOM 1063 CB LEU A 67 1.533 -17.710 14.815 1.00 0.00 C ATOM 1064 CG LEU A 67 1.325 -19.248 14.715 1.00 0.00 C ATOM 1065 CD1 LEU A 67 2.662 -19.982 14.639 1.00 0.00 C ATOM 1066 CD2 LEU A 67 0.450 -19.774 15.865 1.00 0.00 C ATOM 0 H LEU A 67 0.394 -17.697 12.517 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.411 -16.824 15.251 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.368 -17.429 14.173 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.819 -17.463 15.837 1.00 0.00 H new ATOM 0 HG LEU A 67 0.789 -19.450 13.787 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.484 -21.055 14.570 1.00 0.00 H new ATOM 0 HD12 LEU A 67 3.211 -19.648 13.759 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.246 -19.768 15.534 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.325 -20.852 15.764 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.930 -19.552 16.818 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.526 -19.291 15.829 1.00 0.00 H new ATOM 1078 N THR A 68 1.537 -15.371 13.005 1.00 0.00 N ATOM 1079 CA THR A 68 2.230 -14.158 12.560 1.00 0.00 C ATOM 1080 C THR A 68 2.355 -14.164 11.029 1.00 0.00 C ATOM 1081 O THR A 68 2.523 -15.218 10.420 1.00 0.00 O ATOM 1082 CB THR A 68 3.651 -14.075 13.235 1.00 0.00 C ATOM 1083 OG1 THR A 68 3.499 -13.930 14.661 1.00 0.00 O ATOM 1084 CG2 THR A 68 4.528 -12.927 12.695 1.00 0.00 C ATOM 0 H THR A 68 1.716 -16.177 12.406 1.00 0.00 H new ATOM 0 HA THR A 68 1.655 -13.281 12.858 1.00 0.00 H new ATOM 0 HB THR A 68 4.165 -15.004 12.988 1.00 0.00 H new ATOM 0 HG1 THR A 68 4.383 -13.880 15.081 1.00 0.00 H new ATOM 0 HG21 THR A 68 5.491 -12.933 13.206 1.00 0.00 H new ATOM 0 HG22 THR A 68 4.685 -13.061 11.625 1.00 0.00 H new ATOM 0 HG23 THR A 68 4.029 -11.974 12.872 1.00 0.00 H new ATOM 1092 N ARG A 69 2.257 -12.973 10.430 1.00 0.00 N ATOM 1093 CA ARG A 69 2.482 -12.752 9.001 1.00 0.00 C ATOM 1094 C ARG A 69 3.235 -11.423 8.819 1.00 0.00 C ATOM 1095 O ARG A 69 2.846 -10.392 9.386 1.00 0.00 O ATOM 1096 CB ARG A 69 1.137 -12.746 8.221 1.00 0.00 C ATOM 1097 CG ARG A 69 0.092 -11.782 8.808 1.00 0.00 C ATOM 1098 CD ARG A 69 -1.205 -11.704 8.003 1.00 0.00 C ATOM 1099 NE ARG A 69 -2.195 -10.844 8.682 1.00 0.00 N ATOM 1100 CZ ARG A 69 -3.204 -10.199 8.083 1.00 0.00 C ATOM 1101 NH1 ARG A 69 -3.389 -10.298 6.771 1.00 0.00 N ATOM 1102 NH2 ARG A 69 -4.023 -9.449 8.808 1.00 0.00 N ATOM 0 H ARG A 69 2.015 -12.121 10.935 1.00 0.00 H new ATOM 0 HA ARG A 69 3.083 -13.566 8.596 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.329 -12.473 7.183 1.00 0.00 H new ATOM 0 HB3 ARG A 69 0.725 -13.755 8.214 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -0.143 -12.093 9.826 1.00 0.00 H new ATOM 0 HG3 ARG A 69 0.528 -10.785 8.872 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -0.997 -11.311 7.008 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -1.616 -12.705 7.871 1.00 0.00 H new ATOM 0 HE ARG A 69 -2.102 -10.732 9.692 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -2.759 -10.870 6.209 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -4.161 -9.802 6.326 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -3.882 -9.366 9.815 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -4.794 -8.955 8.359 1.00 0.00 H new ATOM 1116 N VAL A 70 4.342 -11.464 8.066 1.00 0.00 N ATOM 1117 CA VAL A 70 5.139 -10.268 7.727 1.00 0.00 C ATOM 1118 C VAL A 70 5.254 -10.159 6.205 1.00 0.00 C ATOM 1119 O VAL A 70 5.202 -11.171 5.510 1.00 0.00 O ATOM 1120 CB VAL A 70 6.573 -10.288 8.399 1.00 0.00 C ATOM 1121 CG1 VAL A 70 6.464 -10.341 9.939 1.00 0.00 C ATOM 1122 CG2 VAL A 70 7.456 -11.443 7.878 1.00 0.00 C ATOM 0 H VAL A 70 4.715 -12.328 7.672 1.00 0.00 H new ATOM 0 HA VAL A 70 4.625 -9.392 8.124 1.00 0.00 H new ATOM 0 HB VAL A 70 7.062 -9.357 8.114 1.00 0.00 H new ATOM 0 HG11 VAL A 70 7.463 -10.354 10.374 1.00 0.00 H new ATOM 0 HG12 VAL A 70 5.924 -9.464 10.296 1.00 0.00 H new ATOM 0 HG13 VAL A 70 5.928 -11.243 10.235 1.00 0.00 H new ATOM 0 HG21 VAL A 70 8.427 -11.410 8.372 1.00 0.00 H new ATOM 0 HG22 VAL A 70 6.972 -12.396 8.093 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.592 -11.340 6.802 1.00 0.00 H new ATOM 1132 N ILE A 71 5.408 -8.934 5.688 1.00 0.00 N ATOM 1133 CA ILE A 71 5.504 -8.694 4.237 1.00 0.00 C ATOM 1134 C ILE A 71 6.677 -7.743 3.926 1.00 0.00 C ATOM 1135 O ILE A 71 6.729 -6.606 4.414 1.00 0.00 O ATOM 1136 CB ILE A 71 4.140 -8.162 3.640 1.00 0.00 C ATOM 1137 CG1 ILE A 71 4.286 -7.810 2.124 1.00 0.00 C ATOM 1138 CG2 ILE A 71 3.573 -6.976 4.453 1.00 0.00 C ATOM 1139 CD1 ILE A 71 2.987 -7.439 1.443 1.00 0.00 C ATOM 0 H ILE A 71 5.469 -8.087 6.254 1.00 0.00 H new ATOM 0 HA ILE A 71 5.705 -9.647 3.748 1.00 0.00 H new ATOM 0 HB ILE A 71 3.414 -8.971 3.722 1.00 0.00 H new ATOM 0 HG12 ILE A 71 4.986 -6.981 2.021 1.00 0.00 H new ATOM 0 HG13 ILE A 71 4.724 -8.663 1.605 1.00 0.00 H new ATOM 0 HG21 ILE A 71 2.636 -6.644 4.006 1.00 0.00 H new ATOM 0 HG22 ILE A 71 3.393 -7.292 5.481 1.00 0.00 H new ATOM 0 HG23 ILE A 71 4.290 -6.155 4.446 1.00 0.00 H new ATOM 0 HD11 ILE A 71 3.178 -7.210 0.395 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.289 -8.274 1.510 1.00 0.00 H new ATOM 0 HD13 ILE A 71 2.556 -6.566 1.933 1.00 0.00 H new ATOM 1151 N VAL A 72 7.647 -8.257 3.143 1.00 0.00 N ATOM 1152 CA VAL A 72 8.823 -7.508 2.680 1.00 0.00 C ATOM 1153 C VAL A 72 8.709 -7.316 1.152 1.00 0.00 C ATOM 1154 O VAL A 72 9.061 -8.215 0.377 1.00 0.00 O ATOM 1155 CB VAL A 72 10.159 -8.271 3.052 1.00 0.00 C ATOM 1156 CG1 VAL A 72 11.412 -7.431 2.695 1.00 0.00 C ATOM 1157 CG2 VAL A 72 10.166 -8.680 4.549 1.00 0.00 C ATOM 0 H VAL A 72 7.631 -9.221 2.811 1.00 0.00 H new ATOM 0 HA VAL A 72 8.857 -6.536 3.172 1.00 0.00 H new ATOM 0 HB VAL A 72 10.196 -9.182 2.454 1.00 0.00 H new ATOM 0 HG11 VAL A 72 12.311 -7.986 2.964 1.00 0.00 H new ATOM 0 HG12 VAL A 72 11.419 -7.225 1.625 1.00 0.00 H new ATOM 0 HG13 VAL A 72 11.388 -6.490 3.245 1.00 0.00 H new ATOM 0 HG21 VAL A 72 11.094 -9.203 4.779 1.00 0.00 H new ATOM 0 HG22 VAL A 72 10.088 -7.788 5.170 1.00 0.00 H new ATOM 0 HG23 VAL A 72 9.320 -9.337 4.751 1.00 0.00 H new ATOM 1167 N GLY A 73 8.172 -6.154 0.742 1.00 0.00 N ATOM 1168 CA GLY A 73 7.972 -5.828 -0.676 1.00 0.00 C ATOM 1169 C GLY A 73 6.996 -6.771 -1.386 1.00 0.00 C ATOM 1170 O GLY A 73 5.793 -6.767 -1.097 1.00 0.00 O ATOM 0 H GLY A 73 7.867 -5.420 1.381 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.602 -4.806 -0.757 1.00 0.00 H new ATOM 0 HA3 GLY A 73 8.934 -5.860 -1.188 1.00 0.00 H new ATOM 1174 N ASN A 74 7.526 -7.594 -2.308 1.00 0.00 N ATOM 1175 CA ASN A 74 6.729 -8.548 -3.117 1.00 0.00 C ATOM 1176 C ASN A 74 6.680 -9.946 -2.463 1.00 0.00 C ATOM 1177 O ASN A 74 6.224 -10.908 -3.082 1.00 0.00 O ATOM 1178 CB ASN A 74 7.314 -8.665 -4.555 1.00 0.00 C ATOM 1179 CG ASN A 74 8.750 -9.214 -4.594 1.00 0.00 C ATOM 1180 OD1 ASN A 74 9.585 -8.891 -3.742 1.00 0.00 O ATOM 1181 ND2 ASN A 74 9.037 -10.074 -5.557 1.00 0.00 N ATOM 0 H ASN A 74 8.524 -7.620 -2.518 1.00 0.00 H new ATOM 0 HA ASN A 74 5.712 -8.159 -3.169 1.00 0.00 H new ATOM 0 HB2 ASN A 74 6.670 -9.314 -5.148 1.00 0.00 H new ATOM 0 HB3 ASN A 74 7.297 -7.682 -5.026 1.00 0.00 H new ATOM 0 HD21 ASN A 74 9.967 -10.489 -5.610 1.00 0.00 H new ATOM 0 HD22 ASN A 74 8.328 -10.322 -6.247 1.00 0.00 H new ATOM 1188 N VAL A 75 7.108 -10.034 -1.201 1.00 0.00 N ATOM 1189 CA VAL A 75 7.309 -11.315 -0.489 1.00 0.00 C ATOM 1190 C VAL A 75 6.515 -11.301 0.828 1.00 0.00 C ATOM 1191 O VAL A 75 6.544 -10.301 1.540 1.00 0.00 O ATOM 1192 CB VAL A 75 8.848 -11.555 -0.195 1.00 0.00 C ATOM 1193 CG1 VAL A 75 9.087 -12.801 0.696 1.00 0.00 C ATOM 1194 CG2 VAL A 75 9.662 -11.661 -1.510 1.00 0.00 C ATOM 0 H VAL A 75 7.329 -9.216 -0.633 1.00 0.00 H new ATOM 0 HA VAL A 75 6.951 -12.129 -1.119 1.00 0.00 H new ATOM 0 HB VAL A 75 9.200 -10.685 0.359 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.156 -12.924 0.870 1.00 0.00 H new ATOM 0 HG12 VAL A 75 8.577 -12.669 1.650 1.00 0.00 H new ATOM 0 HG13 VAL A 75 8.696 -13.687 0.195 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.714 -11.825 -1.275 1.00 0.00 H new ATOM 0 HG22 VAL A 75 9.288 -12.496 -2.103 1.00 0.00 H new ATOM 0 HG23 VAL A 75 9.558 -10.737 -2.078 1.00 0.00 H new ATOM 1204 N VAL A 76 5.783 -12.395 1.139 1.00 0.00 N ATOM 1205 CA VAL A 76 5.064 -12.541 2.428 1.00 0.00 C ATOM 1206 C VAL A 76 5.475 -13.854 3.126 1.00 0.00 C ATOM 1207 O VAL A 76 5.559 -14.898 2.492 1.00 0.00 O ATOM 1208 CB VAL A 76 3.493 -12.528 2.262 1.00 0.00 C ATOM 1209 CG1 VAL A 76 2.783 -12.508 3.646 1.00 0.00 C ATOM 1210 CG2 VAL A 76 3.019 -11.344 1.389 1.00 0.00 C ATOM 0 H VAL A 76 5.674 -13.193 0.513 1.00 0.00 H new ATOM 0 HA VAL A 76 5.346 -11.679 3.032 1.00 0.00 H new ATOM 0 HB VAL A 76 3.217 -13.449 1.748 1.00 0.00 H new ATOM 0 HG11 VAL A 76 1.703 -12.499 3.501 1.00 0.00 H new ATOM 0 HG12 VAL A 76 3.066 -13.395 4.213 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.082 -11.616 4.196 1.00 0.00 H new ATOM 0 HG21 VAL A 76 1.933 -11.370 1.299 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.322 -10.405 1.853 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.467 -11.420 0.398 1.00 0.00 H new ATOM 1220 N ILE A 77 5.734 -13.766 4.433 1.00 0.00 N ATOM 1221 CA ILE A 77 5.916 -14.910 5.337 1.00 0.00 C ATOM 1222 C ILE A 77 4.599 -15.127 6.100 1.00 0.00 C ATOM 1223 O ILE A 77 4.265 -14.325 6.974 1.00 0.00 O ATOM 1224 CB ILE A 77 7.073 -14.588 6.362 1.00 0.00 C ATOM 1225 CG1 ILE A 77 8.463 -14.486 5.659 1.00 0.00 C ATOM 1226 CG2 ILE A 77 7.119 -15.560 7.574 1.00 0.00 C ATOM 1227 CD1 ILE A 77 9.122 -15.813 5.355 1.00 0.00 C ATOM 0 H ILE A 77 5.826 -12.869 4.909 1.00 0.00 H new ATOM 0 HA ILE A 77 6.179 -15.805 4.773 1.00 0.00 H new ATOM 0 HB ILE A 77 6.833 -13.607 6.772 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.343 -13.935 4.726 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.131 -13.901 6.291 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.938 -15.278 8.236 1.00 0.00 H new ATOM 0 HG22 ILE A 77 6.177 -15.506 8.120 1.00 0.00 H new ATOM 0 HG23 ILE A 77 7.274 -16.578 7.218 1.00 0.00 H new ATOM 0 HD11 ILE A 77 10.081 -15.640 4.868 1.00 0.00 H new ATOM 0 HD12 ILE A 77 9.281 -16.362 6.283 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.480 -16.395 4.695 1.00 0.00 H new ATOM 1239 N ASP A 78 3.831 -16.161 5.735 1.00 0.00 N ATOM 1240 CA ASP A 78 2.693 -16.628 6.545 1.00 0.00 C ATOM 1241 C ASP A 78 3.178 -17.755 7.453 1.00 0.00 C ATOM 1242 O ASP A 78 3.447 -18.863 6.993 1.00 0.00 O ATOM 1243 CB ASP A 78 1.495 -17.090 5.663 1.00 0.00 C ATOM 1244 CG ASP A 78 0.722 -15.907 5.051 1.00 0.00 C ATOM 1245 OD1 ASP A 78 1.123 -15.426 3.972 1.00 0.00 O ATOM 1246 OD2 ASP A 78 -0.279 -15.444 5.664 1.00 0.00 O ATOM 0 H ASP A 78 3.977 -16.695 4.878 1.00 0.00 H new ATOM 0 HA ASP A 78 2.322 -15.799 7.147 1.00 0.00 H new ATOM 0 HB2 ASP A 78 1.864 -17.732 4.863 1.00 0.00 H new ATOM 0 HB3 ASP A 78 0.815 -17.691 6.266 1.00 0.00 H new ATOM 1251 N HIS A 79 3.324 -17.435 8.743 1.00 0.00 N ATOM 1252 CA HIS A 79 3.748 -18.381 9.770 1.00 0.00 C ATOM 1253 C HIS A 79 2.505 -18.858 10.529 1.00 0.00 C ATOM 1254 O HIS A 79 1.921 -18.112 11.330 1.00 0.00 O ATOM 1255 CB HIS A 79 4.778 -17.711 10.721 1.00 0.00 C ATOM 1256 CG HIS A 79 5.266 -18.576 11.867 1.00 0.00 C ATOM 1257 ND1 HIS A 79 5.141 -19.954 11.901 1.00 0.00 N ATOM 1258 CD2 HIS A 79 5.881 -18.238 13.023 1.00 0.00 C ATOM 1259 CE1 HIS A 79 5.651 -20.417 13.021 1.00 0.00 C ATOM 1260 NE2 HIS A 79 6.108 -19.397 13.721 1.00 0.00 N ATOM 0 H HIS A 79 3.147 -16.497 9.104 1.00 0.00 H new ATOM 0 HA HIS A 79 4.240 -19.242 9.318 1.00 0.00 H new ATOM 0 HB2 HIS A 79 5.640 -17.398 10.132 1.00 0.00 H new ATOM 0 HB3 HIS A 79 4.330 -16.808 11.135 1.00 0.00 H new ATOM 0 HD1 HIS A 79 4.718 -20.524 11.169 1.00 0.00 H new ATOM 0 HD2 HIS A 79 6.145 -17.239 13.339 1.00 0.00 H new ATOM 0 HE1 HIS A 79 5.689 -21.455 13.317 1.00 0.00 H new ATOM 1269 N GLU A 80 2.124 -20.108 10.258 1.00 0.00 N ATOM 1270 CA GLU A 80 0.924 -20.760 10.804 1.00 0.00 C ATOM 1271 C GLU A 80 1.303 -22.088 11.480 1.00 0.00 C ATOM 1272 O GLU A 80 2.444 -22.541 11.390 1.00 0.00 O ATOM 1273 CB GLU A 80 -0.175 -20.959 9.682 1.00 0.00 C ATOM 1274 CG GLU A 80 0.335 -20.987 8.215 1.00 0.00 C ATOM 1275 CD GLU A 80 1.327 -22.123 7.905 1.00 0.00 C ATOM 1276 OE1 GLU A 80 0.900 -23.297 7.853 1.00 0.00 O ATOM 1277 OE2 GLU A 80 2.529 -21.843 7.704 1.00 0.00 O ATOM 0 H GLU A 80 2.655 -20.716 9.634 1.00 0.00 H new ATOM 0 HA GLU A 80 0.487 -20.112 11.564 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -0.700 -21.894 9.879 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.907 -20.157 9.774 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -0.522 -21.078 7.548 1.00 0.00 H new ATOM 0 HG3 GLU A 80 0.813 -20.033 7.992 1.00 0.00 H new ATOM 1284 N THR A 81 0.341 -22.666 12.209 1.00 0.00 N ATOM 1285 CA THR A 81 0.474 -23.983 12.842 1.00 0.00 C ATOM 1286 C THR A 81 -0.563 -24.926 12.218 1.00 0.00 C ATOM 1287 O THR A 81 -1.772 -24.750 12.420 1.00 0.00 O ATOM 1288 CB THR A 81 0.261 -23.908 14.389 1.00 0.00 C ATOM 1289 OG1 THR A 81 1.039 -22.837 14.930 1.00 0.00 O ATOM 1290 CG2 THR A 81 0.660 -25.216 15.097 1.00 0.00 C ATOM 0 H THR A 81 -0.564 -22.226 12.378 1.00 0.00 H new ATOM 0 HA THR A 81 1.485 -24.354 12.672 1.00 0.00 H new ATOM 0 HB THR A 81 -0.802 -23.740 14.560 1.00 0.00 H new ATOM 0 HG1 THR A 81 1.896 -23.186 15.254 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.494 -25.114 16.169 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.055 -26.037 14.712 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.714 -25.424 14.911 1.00 0.00 H new ATOM 1298 N VAL A 82 -0.083 -25.896 11.437 1.00 0.00 N ATOM 1299 CA VAL A 82 -0.929 -26.888 10.775 1.00 0.00 C ATOM 1300 C VAL A 82 -1.296 -28.010 11.758 1.00 0.00 C ATOM 1301 O VAL A 82 -0.461 -28.864 12.069 1.00 0.00 O ATOM 1302 CB VAL A 82 -0.208 -27.516 9.527 1.00 0.00 C ATOM 1303 CG1 VAL A 82 -1.137 -28.498 8.783 1.00 0.00 C ATOM 1304 CG2 VAL A 82 0.337 -26.425 8.585 1.00 0.00 C ATOM 0 H VAL A 82 0.912 -26.015 11.245 1.00 0.00 H new ATOM 0 HA VAL A 82 -1.831 -26.378 10.437 1.00 0.00 H new ATOM 0 HB VAL A 82 0.647 -28.086 9.890 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -0.611 -28.917 7.925 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.430 -29.303 9.457 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -2.027 -27.969 8.441 1.00 0.00 H new ATOM 0 HG21 VAL A 82 0.829 -26.893 7.733 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -0.487 -25.804 8.232 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.054 -25.805 9.123 1.00 0.00 H new ATOM 1314 N THR A 83 -2.536 -27.975 12.262 1.00 0.00 N ATOM 1315 CA THR A 83 -3.105 -29.082 13.035 1.00 0.00 C ATOM 1316 C THR A 83 -3.273 -30.305 12.114 1.00 0.00 C ATOM 1317 O THR A 83 -3.958 -30.228 11.087 1.00 0.00 O ATOM 1318 CB THR A 83 -4.481 -28.685 13.668 1.00 0.00 C ATOM 1319 OG1 THR A 83 -4.309 -27.544 14.529 1.00 0.00 O ATOM 1320 CG2 THR A 83 -5.123 -29.845 14.468 1.00 0.00 C ATOM 0 H THR A 83 -3.168 -27.183 12.146 1.00 0.00 H new ATOM 0 HA THR A 83 -2.426 -29.326 13.852 1.00 0.00 H new ATOM 0 HB THR A 83 -5.156 -28.442 12.847 1.00 0.00 H new ATOM 0 HG1 THR A 83 -5.172 -27.298 14.922 1.00 0.00 H new ATOM 0 HG21 THR A 83 -6.075 -29.516 14.885 1.00 0.00 H new ATOM 0 HG22 THR A 83 -5.291 -30.694 13.806 1.00 0.00 H new ATOM 0 HG23 THR A 83 -4.455 -30.142 15.277 1.00 0.00 H new ATOM 1328 N ARG A 84 -2.578 -31.394 12.467 1.00 0.00 N ATOM 1329 CA ARG A 84 -2.657 -32.694 11.781 1.00 0.00 C ATOM 1330 C ARG A 84 -3.039 -33.762 12.825 1.00 0.00 C ATOM 1331 O ARG A 84 -3.453 -33.417 13.938 1.00 0.00 O ATOM 1332 CB ARG A 84 -1.281 -33.031 11.121 1.00 0.00 C ATOM 1333 CG ARG A 84 -0.732 -31.946 10.157 1.00 0.00 C ATOM 1334 CD ARG A 84 0.658 -32.295 9.587 1.00 0.00 C ATOM 1335 NE ARG A 84 1.205 -31.246 8.692 1.00 0.00 N ATOM 1336 CZ ARG A 84 2.180 -31.435 7.775 1.00 0.00 C ATOM 1337 NH1 ARG A 84 2.668 -32.650 7.536 1.00 0.00 N ATOM 1338 NH2 ARG A 84 2.654 -30.397 7.089 1.00 0.00 N ATOM 0 H ARG A 84 -1.930 -31.398 13.255 1.00 0.00 H new ATOM 0 HA ARG A 84 -3.408 -32.666 10.992 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -0.548 -33.199 11.910 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -1.378 -33.968 10.572 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -1.433 -31.811 9.333 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -0.674 -30.994 10.685 1.00 0.00 H new ATOM 0 HD2 ARG A 84 1.351 -32.457 10.412 1.00 0.00 H new ATOM 0 HD3 ARG A 84 0.592 -33.234 9.037 1.00 0.00 H new ATOM 0 HE ARG A 84 0.814 -30.307 8.775 1.00 0.00 H new ATOM 0 HH11 ARG A 84 2.306 -33.455 8.048 1.00 0.00 H new ATOM 0 HH12 ARG A 84 3.404 -32.776 6.841 1.00 0.00 H new ATOM 0 HH21 ARG A 84 2.281 -29.462 7.256 1.00 0.00 H new ATOM 0 HH22 ARG A 84 3.390 -30.537 6.396 1.00 0.00 H new ATOM 1352 N ASN A 85 -2.949 -35.050 12.453 1.00 0.00 N ATOM 1353 CA ASN A 85 -3.068 -36.183 13.401 1.00 0.00 C ATOM 1354 C ASN A 85 -1.755 -36.982 13.410 1.00 0.00 C ATOM 1355 O ASN A 85 -1.404 -37.632 12.418 1.00 0.00 O ATOM 1356 CB ASN A 85 -4.278 -37.105 13.042 1.00 0.00 C ATOM 1357 CG ASN A 85 -5.617 -36.685 13.664 1.00 0.00 C ATOM 1358 OD1 ASN A 85 -5.859 -35.394 13.817 1.00 0.00 O flip ATOM 1359 ND2 ASN A 85 -6.453 -37.533 13.983 1.00 0.00 N flip ATOM 0 H ASN A 85 -2.792 -35.340 11.488 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.253 -35.784 14.398 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -4.389 -37.129 11.958 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -4.049 -38.122 13.361 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -6.248 -38.524 13.857 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -7.350 -37.243 14.373 1.00 0.00 H new ATOM 1366 N PHE A 86 -1.007 -36.881 14.523 1.00 0.00 N ATOM 1367 CA PHE A 86 0.217 -37.682 14.766 1.00 0.00 C ATOM 1368 C PHE A 86 -0.083 -38.813 15.772 1.00 0.00 C ATOM 1369 O PHE A 86 -0.908 -38.631 16.671 1.00 0.00 O ATOM 1370 CB PHE A 86 1.375 -36.779 15.290 1.00 0.00 C ATOM 1371 CG PHE A 86 2.077 -35.904 14.242 1.00 0.00 C ATOM 1372 CD1 PHE A 86 1.674 -35.879 12.903 1.00 0.00 C ATOM 1373 CD2 PHE A 86 3.156 -35.097 14.611 1.00 0.00 C ATOM 1374 CE1 PHE A 86 2.321 -35.081 11.980 1.00 0.00 C ATOM 1375 CE2 PHE A 86 3.798 -34.301 13.681 1.00 0.00 C ATOM 1376 CZ PHE A 86 3.381 -34.297 12.368 1.00 0.00 C ATOM 0 H PHE A 86 -1.231 -36.241 15.285 1.00 0.00 H new ATOM 0 HA PHE A 86 0.534 -38.125 13.822 1.00 0.00 H new ATOM 0 HB2 PHE A 86 0.977 -36.129 16.069 1.00 0.00 H new ATOM 0 HB3 PHE A 86 2.123 -37.418 15.760 1.00 0.00 H new ATOM 0 HD1 PHE A 86 0.844 -36.493 12.586 1.00 0.00 H new ATOM 0 HD2 PHE A 86 3.493 -35.095 15.637 1.00 0.00 H new ATOM 0 HE1 PHE A 86 1.993 -35.073 10.951 1.00 0.00 H new ATOM 0 HE2 PHE A 86 4.628 -33.681 13.984 1.00 0.00 H new ATOM 0 HZ PHE A 86 3.888 -33.677 11.643 1.00 0.00 H new ATOM 1386 N PRO A 87 0.586 -40.007 15.644 1.00 0.00 N ATOM 1387 CA PRO A 87 0.304 -41.188 16.506 1.00 0.00 C ATOM 1388 C PRO A 87 0.735 -41.013 17.986 1.00 0.00 C ATOM 1389 O PRO A 87 0.406 -41.861 18.826 1.00 0.00 O ATOM 1390 CB PRO A 87 1.090 -42.324 15.810 1.00 0.00 C ATOM 1391 CG PRO A 87 2.225 -41.625 15.135 1.00 0.00 C ATOM 1392 CD PRO A 87 1.650 -40.316 14.643 1.00 0.00 C ATOM 0 HA PRO A 87 -0.766 -41.376 16.588 1.00 0.00 H new ATOM 0 HB2 PRO A 87 1.447 -43.060 16.530 1.00 0.00 H new ATOM 0 HB3 PRO A 87 0.467 -42.857 15.092 1.00 0.00 H new ATOM 0 HG2 PRO A 87 3.051 -41.457 15.826 1.00 0.00 H new ATOM 0 HG3 PRO A 87 2.617 -42.218 14.309 1.00 0.00 H new ATOM 0 HD2 PRO A 87 2.407 -39.533 14.607 1.00 0.00 H new ATOM 0 HD3 PRO A 87 1.240 -40.410 13.637 1.00 0.00 H new ATOM 1400 N GLU A 88 1.487 -39.932 18.296 1.00 0.00 N ATOM 1401 CA GLU A 88 1.846 -39.587 19.694 1.00 0.00 C ATOM 1402 C GLU A 88 0.823 -38.610 20.322 1.00 0.00 C ATOM 1403 O GLU A 88 0.815 -38.439 21.545 1.00 0.00 O ATOM 1404 CB GLU A 88 3.298 -39.019 19.810 1.00 0.00 C ATOM 1405 CG GLU A 88 3.637 -37.816 18.889 1.00 0.00 C ATOM 1406 CD GLU A 88 4.401 -38.201 17.607 1.00 0.00 C ATOM 1407 OE1 GLU A 88 3.776 -38.731 16.671 1.00 0.00 O ATOM 1408 OE2 GLU A 88 5.635 -37.981 17.541 1.00 0.00 O ATOM 0 H GLU A 88 1.857 -39.284 17.600 1.00 0.00 H new ATOM 0 HA GLU A 88 1.814 -40.519 20.259 1.00 0.00 H new ATOM 0 HB2 GLU A 88 3.467 -38.718 20.844 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.000 -39.825 19.594 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.711 -37.313 18.610 1.00 0.00 H new ATOM 0 HG3 GLU A 88 4.233 -37.097 19.452 1.00 0.00 H new ATOM 1415 N GLY A 89 -0.036 -37.962 19.498 1.00 0.00 N ATOM 1416 CA GLY A 89 -1.120 -37.115 20.036 1.00 0.00 C ATOM 1417 C GLY A 89 -1.738 -36.173 19.008 1.00 0.00 C ATOM 1418 O GLY A 89 -2.265 -36.634 17.995 1.00 0.00 O ATOM 0 H GLY A 89 0.001 -38.009 18.480 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -1.902 -37.757 20.442 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.729 -36.526 20.865 1.00 0.00 H new ATOM 1422 N LYS A 90 -1.688 -34.849 19.296 1.00 0.00 N ATOM 1423 CA LYS A 90 -2.228 -33.784 18.429 1.00 0.00 C ATOM 1424 C LYS A 90 -1.669 -33.871 16.986 1.00 0.00 C ATOM 1425 O LYS A 90 -2.296 -34.497 16.132 1.00 0.00 O ATOM 1426 CB LYS A 90 -1.953 -32.399 19.091 1.00 0.00 C ATOM 1427 CG LYS A 90 -2.358 -31.147 18.270 1.00 0.00 C ATOM 1428 CD LYS A 90 -3.857 -31.081 17.883 1.00 0.00 C ATOM 1429 CE LYS A 90 -4.812 -31.157 19.088 1.00 0.00 C ATOM 1430 NZ LYS A 90 -6.199 -30.777 18.717 1.00 0.00 N ATOM 0 H LYS A 90 -1.264 -34.490 20.152 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.306 -33.916 18.332 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.479 -32.366 20.045 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -0.888 -32.332 19.312 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.106 -30.256 18.845 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -1.760 -31.118 17.359 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -4.043 -30.153 17.342 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -4.083 -31.900 17.200 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -4.808 -32.170 19.492 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -4.453 -30.497 19.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -6.812 -30.841 19.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -6.207 -29.802 18.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.551 -31.422 17.981 1.00 0.00 H new ATOM 1444 N GLY A 91 -0.478 -33.289 16.736 1.00 0.00 N ATOM 1445 CA GLY A 91 0.113 -33.291 15.396 1.00 0.00 C ATOM 1446 C GLY A 91 0.249 -31.907 14.791 1.00 0.00 C ATOM 1447 O GLY A 91 0.259 -31.760 13.567 1.00 0.00 O ATOM 0 H GLY A 91 0.085 -32.817 17.444 1.00 0.00 H new ATOM 0 HA2 GLY A 91 1.098 -33.756 15.443 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -0.500 -33.907 14.738 1.00 0.00 H new ATOM 1451 N GLU A 92 0.402 -30.891 15.643 1.00 0.00 N ATOM 1452 CA GLU A 92 0.411 -29.488 15.201 1.00 0.00 C ATOM 1453 C GLU A 92 1.855 -29.069 14.862 1.00 0.00 C ATOM 1454 O GLU A 92 2.758 -29.163 15.701 1.00 0.00 O ATOM 1455 CB GLU A 92 -0.210 -28.587 16.309 1.00 0.00 C ATOM 1456 CG GLU A 92 0.511 -28.654 17.679 1.00 0.00 C ATOM 1457 CD GLU A 92 -0.076 -27.730 18.754 1.00 0.00 C ATOM 1458 OE1 GLU A 92 0.010 -26.494 18.591 1.00 0.00 O ATOM 1459 OE2 GLU A 92 -0.596 -28.231 19.775 1.00 0.00 O ATOM 0 H GLU A 92 0.522 -31.011 16.649 1.00 0.00 H new ATOM 0 HA GLU A 92 -0.193 -29.371 14.301 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -0.206 -27.554 15.962 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -1.253 -28.873 16.448 1.00 0.00 H new ATOM 0 HG2 GLU A 92 0.477 -29.681 18.043 1.00 0.00 H new ATOM 0 HG3 GLU A 92 1.561 -28.401 17.535 1.00 0.00 H new ATOM 1466 N VAL A 93 2.091 -28.670 13.592 1.00 0.00 N ATOM 1467 CA VAL A 93 3.437 -28.330 13.109 1.00 0.00 C ATOM 1468 C VAL A 93 3.493 -26.853 12.707 1.00 0.00 C ATOM 1469 O VAL A 93 2.693 -26.383 11.896 1.00 0.00 O ATOM 1470 CB VAL A 93 3.893 -29.287 11.940 1.00 0.00 C ATOM 1471 CG1 VAL A 93 3.922 -30.751 12.432 1.00 0.00 C ATOM 1472 CG2 VAL A 93 3.006 -29.154 10.680 1.00 0.00 C ATOM 0 H VAL A 93 1.361 -28.577 12.886 1.00 0.00 H new ATOM 0 HA VAL A 93 4.148 -28.482 13.921 1.00 0.00 H new ATOM 0 HB VAL A 93 4.898 -28.983 11.649 1.00 0.00 H new ATOM 0 HG11 VAL A 93 4.238 -31.402 11.617 1.00 0.00 H new ATOM 0 HG12 VAL A 93 4.623 -30.842 13.262 1.00 0.00 H new ATOM 0 HG13 VAL A 93 2.926 -31.043 12.764 1.00 0.00 H new ATOM 0 HG21 VAL A 93 3.365 -29.835 9.908 1.00 0.00 H new ATOM 0 HG22 VAL A 93 1.975 -29.403 10.933 1.00 0.00 H new ATOM 0 HG23 VAL A 93 3.051 -28.130 10.310 1.00 0.00 H new ATOM 1482 N ASP A 94 4.421 -26.119 13.325 1.00 0.00 N ATOM 1483 CA ASP A 94 4.590 -24.676 13.099 1.00 0.00 C ATOM 1484 C ASP A 94 5.467 -24.462 11.857 1.00 0.00 C ATOM 1485 O ASP A 94 6.667 -24.705 11.899 1.00 0.00 O ATOM 1486 CB ASP A 94 5.220 -24.007 14.345 1.00 0.00 C ATOM 1487 CG ASP A 94 4.342 -24.122 15.607 1.00 0.00 C ATOM 1488 OD1 ASP A 94 4.199 -25.244 16.141 1.00 0.00 O ATOM 1489 OD2 ASP A 94 3.815 -23.093 16.083 1.00 0.00 O ATOM 0 H ASP A 94 5.080 -26.507 13.999 1.00 0.00 H new ATOM 0 HA ASP A 94 3.617 -24.214 12.930 1.00 0.00 H new ATOM 0 HB2 ASP A 94 6.190 -24.463 14.543 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.401 -22.954 14.131 1.00 0.00 H new ATOM 1494 N VAL A 95 4.844 -24.006 10.764 1.00 0.00 N ATOM 1495 CA VAL A 95 5.474 -23.850 9.440 1.00 0.00 C ATOM 1496 C VAL A 95 5.557 -22.353 9.085 1.00 0.00 C ATOM 1497 O VAL A 95 4.736 -21.559 9.544 1.00 0.00 O ATOM 1498 CB VAL A 95 4.616 -24.600 8.339 1.00 0.00 C ATOM 1499 CG1 VAL A 95 5.309 -24.625 6.956 1.00 0.00 C ATOM 1500 CG2 VAL A 95 4.215 -26.020 8.799 1.00 0.00 C ATOM 0 H VAL A 95 3.863 -23.727 10.772 1.00 0.00 H new ATOM 0 HA VAL A 95 6.475 -24.280 9.470 1.00 0.00 H new ATOM 0 HB VAL A 95 3.701 -24.021 8.215 1.00 0.00 H new ATOM 0 HG11 VAL A 95 4.676 -25.151 6.241 1.00 0.00 H new ATOM 0 HG12 VAL A 95 5.473 -23.604 6.613 1.00 0.00 H new ATOM 0 HG13 VAL A 95 6.267 -25.138 7.038 1.00 0.00 H new ATOM 0 HG21 VAL A 95 3.628 -26.503 8.018 1.00 0.00 H new ATOM 0 HG22 VAL A 95 5.113 -26.607 8.993 1.00 0.00 H new ATOM 0 HG23 VAL A 95 3.621 -25.953 9.711 1.00 0.00 H new ATOM 1510 N ALA A 96 6.583 -21.973 8.314 1.00 0.00 N ATOM 1511 CA ALA A 96 6.671 -20.654 7.672 1.00 0.00 C ATOM 1512 C ALA A 96 6.565 -20.844 6.153 1.00 0.00 C ATOM 1513 O ALA A 96 7.519 -21.300 5.508 1.00 0.00 O ATOM 1514 CB ALA A 96 7.980 -19.942 8.058 1.00 0.00 C ATOM 0 H ALA A 96 7.382 -22.576 8.116 1.00 0.00 H new ATOM 0 HA ALA A 96 5.853 -20.020 8.015 1.00 0.00 H new ATOM 0 HB1 ALA A 96 8.022 -18.968 7.570 1.00 0.00 H new ATOM 0 HB2 ALA A 96 8.016 -19.808 9.139 1.00 0.00 H new ATOM 0 HB3 ALA A 96 8.830 -20.545 7.738 1.00 0.00 H new ATOM 1520 N CYS A 97 5.387 -20.537 5.597 1.00 0.00 N ATOM 1521 CA CYS A 97 5.136 -20.600 4.158 1.00 0.00 C ATOM 1522 C CYS A 97 5.387 -19.209 3.562 1.00 0.00 C ATOM 1523 O CYS A 97 4.641 -18.262 3.822 1.00 0.00 O ATOM 1524 CB CYS A 97 3.695 -21.078 3.890 1.00 0.00 C ATOM 1525 SG CYS A 97 3.345 -22.732 4.533 1.00 0.00 S ATOM 0 H CYS A 97 4.577 -20.236 6.140 1.00 0.00 H new ATOM 0 HA CYS A 97 5.808 -21.317 3.685 1.00 0.00 H new ATOM 0 HB2 CYS A 97 2.998 -20.369 4.337 1.00 0.00 H new ATOM 0 HB3 CYS A 97 3.513 -21.070 2.815 1.00 0.00 H new ATOM 0 HG CYS A 97 2.999 -22.647 5.783 1.00 0.00 H new ATOM 1531 N ILE A 98 6.480 -19.101 2.804 1.00 0.00 N ATOM 1532 CA ILE A 98 6.934 -17.849 2.180 1.00 0.00 C ATOM 1533 C ILE A 98 6.500 -17.817 0.702 1.00 0.00 C ATOM 1534 O ILE A 98 6.639 -18.801 -0.012 1.00 0.00 O ATOM 1535 CB ILE A 98 8.501 -17.678 2.336 1.00 0.00 C ATOM 1536 CG1 ILE A 98 9.025 -16.440 1.527 1.00 0.00 C ATOM 1537 CG2 ILE A 98 9.270 -18.977 1.998 1.00 0.00 C ATOM 1538 CD1 ILE A 98 10.530 -16.210 1.574 1.00 0.00 C ATOM 0 H ILE A 98 7.088 -19.894 2.601 1.00 0.00 H new ATOM 0 HA ILE A 98 6.468 -17.005 2.690 1.00 0.00 H new ATOM 0 HB ILE A 98 8.701 -17.477 3.389 1.00 0.00 H new ATOM 0 HG12 ILE A 98 8.726 -16.557 0.485 1.00 0.00 H new ATOM 0 HG13 ILE A 98 8.527 -15.546 1.903 1.00 0.00 H new ATOM 0 HG21 ILE A 98 10.340 -18.809 2.120 1.00 0.00 H new ATOM 0 HG22 ILE A 98 8.949 -19.774 2.668 1.00 0.00 H new ATOM 0 HG23 ILE A 98 9.063 -19.264 0.967 1.00 0.00 H new ATOM 0 HD11 ILE A 98 10.782 -15.330 0.982 1.00 0.00 H new ATOM 0 HD12 ILE A 98 10.842 -16.054 2.607 1.00 0.00 H new ATOM 0 HD13 ILE A 98 11.044 -17.081 1.167 1.00 0.00 H new ATOM 1550 N TYR A 99 5.959 -16.675 0.255 1.00 0.00 N ATOM 1551 CA TYR A 99 5.429 -16.498 -1.110 1.00 0.00 C ATOM 1552 C TYR A 99 6.133 -15.323 -1.793 1.00 0.00 C ATOM 1553 O TYR A 99 6.636 -14.416 -1.131 1.00 0.00 O ATOM 1554 CB TYR A 99 3.895 -16.233 -1.087 1.00 0.00 C ATOM 1555 CG TYR A 99 3.089 -17.221 -0.227 1.00 0.00 C ATOM 1556 CD1 TYR A 99 2.606 -18.425 -0.749 1.00 0.00 C ATOM 1557 CD2 TYR A 99 2.826 -16.947 1.118 1.00 0.00 C ATOM 1558 CE1 TYR A 99 1.893 -19.310 0.036 1.00 0.00 C ATOM 1559 CE2 TYR A 99 2.112 -17.830 1.902 1.00 0.00 C ATOM 1560 CZ TYR A 99 1.647 -19.007 1.361 1.00 0.00 C ATOM 1561 OH TYR A 99 0.941 -19.891 2.150 1.00 0.00 O ATOM 0 H TYR A 99 5.875 -15.839 0.834 1.00 0.00 H new ATOM 0 HA TYR A 99 5.616 -17.417 -1.665 1.00 0.00 H new ATOM 0 HB2 TYR A 99 3.719 -15.223 -0.718 1.00 0.00 H new ATOM 0 HB3 TYR A 99 3.518 -16.269 -2.109 1.00 0.00 H new ATOM 0 HD1 TYR A 99 2.794 -18.667 -1.785 1.00 0.00 H new ATOM 0 HD2 TYR A 99 3.188 -16.027 1.552 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.529 -20.236 -0.385 1.00 0.00 H new ATOM 0 HE2 TYR A 99 1.918 -17.598 2.939 1.00 0.00 H new ATOM 0 HH TYR A 99 0.857 -19.526 3.056 1.00 0.00 H new ATOM 1571 N GLU A 100 6.140 -15.362 -3.120 1.00 0.00 N ATOM 1572 CA GLU A 100 6.635 -14.292 -3.986 1.00 0.00 C ATOM 1573 C GLU A 100 5.548 -13.992 -5.020 1.00 0.00 C ATOM 1574 O GLU A 100 5.161 -14.879 -5.779 1.00 0.00 O ATOM 1575 CB GLU A 100 7.924 -14.756 -4.689 1.00 0.00 C ATOM 1576 CG GLU A 100 8.539 -13.747 -5.672 1.00 0.00 C ATOM 1577 CD GLU A 100 9.573 -14.401 -6.605 1.00 0.00 C ATOM 1578 OE1 GLU A 100 9.166 -14.934 -7.661 1.00 0.00 O ATOM 1579 OE2 GLU A 100 10.791 -14.386 -6.294 1.00 0.00 O ATOM 0 H GLU A 100 5.790 -16.165 -3.643 1.00 0.00 H new ATOM 0 HA GLU A 100 6.862 -13.396 -3.408 1.00 0.00 H new ATOM 0 HB2 GLU A 100 8.667 -14.995 -3.928 1.00 0.00 H new ATOM 0 HB3 GLU A 100 7.711 -15.679 -5.228 1.00 0.00 H new ATOM 0 HG2 GLU A 100 7.747 -13.296 -6.270 1.00 0.00 H new ATOM 0 HG3 GLU A 100 9.015 -12.941 -5.113 1.00 0.00 H new ATOM 1586 N VAL A 101 5.052 -12.755 -5.023 1.00 0.00 N ATOM 1587 CA VAL A 101 3.972 -12.303 -5.902 1.00 0.00 C ATOM 1588 C VAL A 101 4.542 -11.376 -6.989 1.00 0.00 C ATOM 1589 O VAL A 101 5.094 -10.313 -6.680 1.00 0.00 O ATOM 1590 CB VAL A 101 2.862 -11.562 -5.069 1.00 0.00 C ATOM 1591 CG1 VAL A 101 1.715 -11.036 -5.970 1.00 0.00 C ATOM 1592 CG2 VAL A 101 2.309 -12.478 -3.948 1.00 0.00 C ATOM 0 H VAL A 101 5.397 -12.023 -4.402 1.00 0.00 H new ATOM 0 HA VAL A 101 3.516 -13.169 -6.381 1.00 0.00 H new ATOM 0 HB VAL A 101 3.331 -10.695 -4.604 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.971 -10.531 -5.354 1.00 0.00 H new ATOM 0 HG12 VAL A 101 2.118 -10.334 -6.700 1.00 0.00 H new ATOM 0 HG13 VAL A 101 1.248 -11.872 -6.490 1.00 0.00 H new ATOM 0 HG21 VAL A 101 1.543 -11.943 -3.386 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.875 -13.374 -4.391 1.00 0.00 H new ATOM 0 HG23 VAL A 101 3.120 -12.762 -3.277 1.00 0.00 H new ATOM 1602 N GLU A 102 4.414 -11.797 -8.255 1.00 0.00 N ATOM 1603 CA GLU A 102 4.833 -11.014 -9.426 1.00 0.00 C ATOM 1604 C GLU A 102 3.654 -10.904 -10.411 1.00 0.00 C ATOM 1605 O GLU A 102 2.986 -11.901 -10.698 1.00 0.00 O ATOM 1606 CB GLU A 102 6.062 -11.670 -10.097 1.00 0.00 C ATOM 1607 CG GLU A 102 6.631 -10.893 -11.295 1.00 0.00 C ATOM 1608 CD GLU A 102 7.921 -11.503 -11.871 1.00 0.00 C ATOM 1609 OE1 GLU A 102 7.840 -12.466 -12.663 1.00 0.00 O ATOM 1610 OE2 GLU A 102 9.026 -11.036 -11.517 1.00 0.00 O ATOM 0 H GLU A 102 4.012 -12.702 -8.498 1.00 0.00 H new ATOM 0 HA GLU A 102 5.123 -10.011 -9.113 1.00 0.00 H new ATOM 0 HB2 GLU A 102 6.848 -11.786 -9.350 1.00 0.00 H new ATOM 0 HB3 GLU A 102 5.787 -12.671 -10.428 1.00 0.00 H new ATOM 0 HG2 GLU A 102 5.877 -10.851 -12.081 1.00 0.00 H new ATOM 0 HG3 GLU A 102 6.830 -9.866 -10.989 1.00 0.00 H new ATOM 1617 N ASN A 103 3.415 -9.671 -10.900 1.00 0.00 N ATOM 1618 CA ASN A 103 2.282 -9.312 -11.789 1.00 0.00 C ATOM 1619 C ASN A 103 0.907 -9.560 -11.102 1.00 0.00 C ATOM 1620 O ASN A 103 -0.110 -9.771 -11.776 1.00 0.00 O ATOM 1621 CB ASN A 103 2.369 -10.049 -13.169 1.00 0.00 C ATOM 1622 CG ASN A 103 3.638 -9.702 -13.971 1.00 0.00 C ATOM 1623 OD1 ASN A 103 4.669 -10.528 -13.866 1.00 0.00 O flip ATOM 1624 ND2 ASN A 103 3.676 -8.714 -14.704 1.00 0.00 N flip ATOM 0 H ASN A 103 4.016 -8.875 -10.685 1.00 0.00 H new ATOM 0 HA ASN A 103 2.361 -8.243 -11.985 1.00 0.00 H new ATOM 0 HB2 ASN A 103 2.338 -11.125 -13.000 1.00 0.00 H new ATOM 0 HB3 ASN A 103 1.492 -9.795 -13.764 1.00 0.00 H new ATOM 0 HD21 ASN A 103 2.868 -8.094 -14.767 1.00 0.00 H new ATOM 0 HD22 ASN A 103 4.515 -8.515 -15.249 1.00 0.00 H new ATOM 1631 N GLY A 104 0.884 -9.459 -9.754 1.00 0.00 N ATOM 1632 CA GLY A 104 -0.350 -9.611 -8.961 1.00 0.00 C ATOM 1633 C GLY A 104 -0.682 -11.057 -8.573 1.00 0.00 C ATOM 1634 O GLY A 104 -1.597 -11.294 -7.775 1.00 0.00 O ATOM 0 H GLY A 104 1.714 -9.271 -9.192 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -0.259 -9.016 -8.052 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -1.185 -9.200 -9.529 1.00 0.00 H new ATOM 1638 N ARG A 105 0.078 -12.022 -9.117 1.00 0.00 N ATOM 1639 CA ARG A 105 -0.132 -13.466 -8.876 1.00 0.00 C ATOM 1640 C ARG A 105 1.146 -14.039 -8.272 1.00 0.00 C ATOM 1641 O ARG A 105 2.232 -13.543 -8.565 1.00 0.00 O ATOM 1642 CB ARG A 105 -0.469 -14.204 -10.201 1.00 0.00 C ATOM 1643 CG ARG A 105 -1.723 -13.684 -10.940 1.00 0.00 C ATOM 1644 CD ARG A 105 -3.043 -13.942 -10.190 1.00 0.00 C ATOM 1645 NE ARG A 105 -4.156 -13.215 -10.838 1.00 0.00 N ATOM 1646 CZ ARG A 105 -5.432 -13.615 -10.931 1.00 0.00 C ATOM 1647 NH1 ARG A 105 -5.830 -14.779 -10.457 1.00 0.00 N ATOM 1648 NH2 ARG A 105 -6.311 -12.827 -11.526 1.00 0.00 N ATOM 0 H ARG A 105 0.861 -11.825 -9.740 1.00 0.00 H new ATOM 0 HA ARG A 105 -0.971 -13.604 -8.194 1.00 0.00 H new ATOM 0 HB2 ARG A 105 0.387 -14.125 -10.871 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -0.607 -15.263 -9.984 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -1.615 -12.612 -11.107 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -1.776 -14.156 -11.921 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -3.258 -15.011 -10.176 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -2.947 -13.623 -9.152 1.00 0.00 H new ATOM 0 HE ARG A 105 -3.929 -12.314 -11.259 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -5.160 -15.402 -10.005 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -6.808 -15.057 -10.542 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -6.015 -11.928 -11.907 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -7.286 -13.118 -11.604 1.00 0.00 H new ATOM 1662 N ILE A 106 1.022 -15.070 -7.430 1.00 0.00 N ATOM 1663 CA ILE A 106 2.186 -15.718 -6.820 1.00 0.00 C ATOM 1664 C ILE A 106 3.015 -16.423 -7.904 1.00 0.00 C ATOM 1665 O ILE A 106 2.582 -17.414 -8.479 1.00 0.00 O ATOM 1666 CB ILE A 106 1.775 -16.720 -5.683 1.00 0.00 C ATOM 1667 CG1 ILE A 106 1.012 -15.962 -4.557 1.00 0.00 C ATOM 1668 CG2 ILE A 106 3.001 -17.477 -5.105 1.00 0.00 C ATOM 1669 CD1 ILE A 106 0.637 -16.813 -3.369 1.00 0.00 C ATOM 0 H ILE A 106 0.126 -15.473 -7.156 1.00 0.00 H new ATOM 0 HA ILE A 106 2.795 -14.946 -6.351 1.00 0.00 H new ATOM 0 HB ILE A 106 1.115 -17.469 -6.120 1.00 0.00 H new ATOM 0 HG12 ILE A 106 1.630 -15.133 -4.213 1.00 0.00 H new ATOM 0 HG13 ILE A 106 0.104 -15.530 -4.979 1.00 0.00 H new ATOM 0 HG21 ILE A 106 2.671 -18.159 -4.322 1.00 0.00 H new ATOM 0 HG22 ILE A 106 3.486 -18.044 -5.899 1.00 0.00 H new ATOM 0 HG23 ILE A 106 3.708 -16.760 -4.688 1.00 0.00 H new ATOM 0 HD11 ILE A 106 0.110 -16.202 -2.636 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.009 -17.628 -3.695 1.00 0.00 H new ATOM 0 HD13 ILE A 106 1.539 -17.224 -2.917 1.00 0.00 H new ATOM 1681 N ALA A 107 4.199 -15.862 -8.177 1.00 0.00 N ATOM 1682 CA ALA A 107 5.130 -16.371 -9.187 1.00 0.00 C ATOM 1683 C ALA A 107 5.851 -17.624 -8.674 1.00 0.00 C ATOM 1684 O ALA A 107 6.074 -18.580 -9.430 1.00 0.00 O ATOM 1685 CB ALA A 107 6.154 -15.279 -9.543 1.00 0.00 C ATOM 0 H ALA A 107 4.541 -15.030 -7.695 1.00 0.00 H new ATOM 0 HA ALA A 107 4.567 -16.642 -10.080 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.846 -15.660 -10.294 1.00 0.00 H new ATOM 0 HB2 ALA A 107 5.633 -14.407 -9.938 1.00 0.00 H new ATOM 0 HB3 ALA A 107 6.710 -14.996 -8.649 1.00 0.00 H new ATOM 1691 N LYS A 108 6.194 -17.607 -7.375 1.00 0.00 N ATOM 1692 CA LYS A 108 6.942 -18.685 -6.701 1.00 0.00 C ATOM 1693 C LYS A 108 6.513 -18.750 -5.239 1.00 0.00 C ATOM 1694 O LYS A 108 6.220 -17.721 -4.642 1.00 0.00 O ATOM 1695 CB LYS A 108 8.472 -18.426 -6.773 1.00 0.00 C ATOM 1696 CG LYS A 108 9.079 -18.538 -8.184 1.00 0.00 C ATOM 1697 CD LYS A 108 10.537 -18.048 -8.262 1.00 0.00 C ATOM 1698 CE LYS A 108 11.059 -18.041 -9.707 1.00 0.00 C ATOM 1699 NZ LYS A 108 12.447 -17.533 -9.804 1.00 0.00 N ATOM 0 H LYS A 108 5.957 -16.834 -6.754 1.00 0.00 H new ATOM 0 HA LYS A 108 6.725 -19.628 -7.203 1.00 0.00 H new ATOM 0 HB2 LYS A 108 8.677 -17.429 -6.383 1.00 0.00 H new ATOM 0 HB3 LYS A 108 8.978 -19.135 -6.118 1.00 0.00 H new ATOM 0 HG2 LYS A 108 9.035 -19.577 -8.509 1.00 0.00 H new ATOM 0 HG3 LYS A 108 8.471 -17.960 -8.880 1.00 0.00 H new ATOM 0 HD2 LYS A 108 10.606 -17.043 -7.846 1.00 0.00 H new ATOM 0 HD3 LYS A 108 11.170 -18.691 -7.650 1.00 0.00 H new ATOM 0 HE2 LYS A 108 11.016 -19.053 -10.111 1.00 0.00 H new ATOM 0 HE3 LYS A 108 10.405 -17.424 -10.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 12.753 -17.548 -10.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 12.486 -16.558 -9.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 13.078 -18.136 -9.238 1.00 0.00 H new ATOM 1713 N ALA A 109 6.502 -19.953 -4.665 1.00 0.00 N ATOM 1714 CA ALA A 109 6.172 -20.164 -3.255 1.00 0.00 C ATOM 1715 C ALA A 109 6.998 -21.320 -2.707 1.00 0.00 C ATOM 1716 O ALA A 109 7.227 -22.318 -3.385 1.00 0.00 O ATOM 1717 CB ALA A 109 4.675 -20.420 -3.061 1.00 0.00 C ATOM 0 H ALA A 109 6.723 -20.813 -5.167 1.00 0.00 H new ATOM 0 HA ALA A 109 6.415 -19.257 -2.702 1.00 0.00 H new ATOM 0 HB1 ALA A 109 4.466 -20.572 -2.002 1.00 0.00 H new ATOM 0 HB2 ALA A 109 4.109 -19.561 -3.423 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.382 -21.309 -3.620 1.00 0.00 H new ATOM 1723 N TRP A 110 7.465 -21.142 -1.486 1.00 0.00 N ATOM 1724 CA TRP A 110 8.314 -22.088 -0.766 1.00 0.00 C ATOM 1725 C TRP A 110 7.708 -22.259 0.635 1.00 0.00 C ATOM 1726 O TRP A 110 6.983 -21.371 1.105 1.00 0.00 O ATOM 1727 CB TRP A 110 9.773 -21.523 -0.680 1.00 0.00 C ATOM 1728 CG TRP A 110 10.254 -20.819 -1.942 1.00 0.00 C ATOM 1729 CD1 TRP A 110 10.829 -21.392 -3.027 1.00 0.00 C ATOM 1730 CD2 TRP A 110 10.173 -19.414 -2.249 1.00 0.00 C ATOM 1731 NE1 TRP A 110 11.114 -20.458 -3.978 1.00 0.00 N ATOM 1732 CE2 TRP A 110 10.722 -19.236 -3.527 1.00 0.00 C ATOM 1733 CE3 TRP A 110 9.684 -18.298 -1.572 1.00 0.00 C ATOM 1734 CZ2 TRP A 110 10.812 -17.991 -4.134 1.00 0.00 C ATOM 1735 CZ3 TRP A 110 9.770 -17.060 -2.173 1.00 0.00 C ATOM 1736 CH2 TRP A 110 10.328 -16.917 -3.446 1.00 0.00 C ATOM 0 H TRP A 110 7.259 -20.304 -0.942 1.00 0.00 H new ATOM 0 HA TRP A 110 8.362 -23.051 -1.275 1.00 0.00 H new ATOM 0 HB2 TRP A 110 9.830 -20.824 0.155 1.00 0.00 H new ATOM 0 HB3 TRP A 110 10.454 -22.344 -0.455 1.00 0.00 H new ATOM 0 HD1 TRP A 110 11.034 -22.448 -3.125 1.00 0.00 H new ATOM 0 HE1 TRP A 110 11.550 -20.645 -4.881 1.00 0.00 H new ATOM 0 HE3 TRP A 110 9.244 -18.401 -0.591 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 11.249 -17.877 -5.115 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 9.401 -16.189 -1.652 1.00 0.00 H new ATOM 0 HH2 TRP A 110 10.377 -15.936 -3.895 1.00 0.00 H new ATOM 1747 N PHE A 111 7.969 -23.381 1.302 1.00 0.00 N ATOM 1748 CA PHE A 111 7.574 -23.541 2.713 1.00 0.00 C ATOM 1749 C PHE A 111 8.658 -24.311 3.463 1.00 0.00 C ATOM 1750 O PHE A 111 9.311 -25.203 2.897 1.00 0.00 O ATOM 1751 CB PHE A 111 6.172 -24.216 2.858 1.00 0.00 C ATOM 1752 CG PHE A 111 6.127 -25.733 2.651 1.00 0.00 C ATOM 1753 CD1 PHE A 111 6.102 -26.292 1.375 1.00 0.00 C ATOM 1754 CD2 PHE A 111 6.113 -26.601 3.748 1.00 0.00 C ATOM 1755 CE1 PHE A 111 6.058 -27.666 1.203 1.00 0.00 C ATOM 1756 CE2 PHE A 111 6.072 -27.967 3.576 1.00 0.00 C ATOM 1757 CZ PHE A 111 6.044 -28.503 2.302 1.00 0.00 C ATOM 0 H PHE A 111 8.446 -24.188 0.900 1.00 0.00 H new ATOM 0 HA PHE A 111 7.477 -22.551 3.159 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.786 -23.994 3.853 1.00 0.00 H new ATOM 0 HB3 PHE A 111 5.493 -23.752 2.143 1.00 0.00 H new ATOM 0 HD1 PHE A 111 6.117 -25.646 0.509 1.00 0.00 H new ATOM 0 HD2 PHE A 111 6.135 -26.193 4.748 1.00 0.00 H new ATOM 0 HE1 PHE A 111 6.035 -28.084 0.207 1.00 0.00 H new ATOM 0 HE2 PHE A 111 6.062 -28.619 4.437 1.00 0.00 H new ATOM 0 HZ PHE A 111 6.011 -29.574 2.166 1.00 0.00 H new ATOM 1767 N LYS A 112 8.853 -23.944 4.733 1.00 0.00 N ATOM 1768 CA LYS A 112 9.775 -24.624 5.639 1.00 0.00 C ATOM 1769 C LYS A 112 9.041 -24.961 6.939 1.00 0.00 C ATOM 1770 O LYS A 112 8.473 -24.080 7.585 1.00 0.00 O ATOM 1771 CB LYS A 112 11.048 -23.763 5.904 1.00 0.00 C ATOM 1772 CG LYS A 112 10.812 -22.366 6.527 1.00 0.00 C ATOM 1773 CD LYS A 112 12.137 -21.673 6.926 1.00 0.00 C ATOM 1774 CE LYS A 112 11.934 -20.306 7.597 1.00 0.00 C ATOM 1775 NZ LYS A 112 13.224 -19.721 8.052 1.00 0.00 N ATOM 0 H LYS A 112 8.368 -23.157 5.163 1.00 0.00 H new ATOM 0 HA LYS A 112 10.117 -25.550 5.176 1.00 0.00 H new ATOM 0 HB2 LYS A 112 11.710 -24.324 6.563 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.575 -23.632 4.959 1.00 0.00 H new ATOM 0 HG2 LYS A 112 10.276 -21.738 5.815 1.00 0.00 H new ATOM 0 HG3 LYS A 112 10.176 -22.465 7.407 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.689 -22.324 7.604 1.00 0.00 H new ATOM 0 HD3 LYS A 112 12.753 -21.544 6.036 1.00 0.00 H new ATOM 0 HE2 LYS A 112 11.452 -19.624 6.896 1.00 0.00 H new ATOM 0 HE3 LYS A 112 11.263 -20.415 8.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 13.048 -18.799 8.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 13.672 -20.360 8.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.855 -19.594 7.235 1.00 0.00 H new ATOM 1789 N ILE A 113 9.040 -26.250 7.322 1.00 0.00 N ATOM 1790 CA ILE A 113 8.370 -26.703 8.547 1.00 0.00 C ATOM 1791 C ILE A 113 9.363 -26.597 9.707 1.00 0.00 C ATOM 1792 O ILE A 113 10.473 -27.147 9.642 1.00 0.00 O ATOM 1793 CB ILE A 113 7.816 -28.165 8.418 1.00 0.00 C ATOM 1794 CG1 ILE A 113 6.712 -28.224 7.318 1.00 0.00 C ATOM 1795 CG2 ILE A 113 7.259 -28.692 9.777 1.00 0.00 C ATOM 1796 CD1 ILE A 113 6.289 -29.624 6.937 1.00 0.00 C ATOM 0 H ILE A 113 9.498 -26.995 6.797 1.00 0.00 H new ATOM 0 HA ILE A 113 7.505 -26.066 8.730 1.00 0.00 H new ATOM 0 HB ILE A 113 8.644 -28.812 8.130 1.00 0.00 H new ATOM 0 HG12 ILE A 113 5.838 -27.675 7.667 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.075 -27.711 6.427 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.884 -29.707 9.647 1.00 0.00 H new ATOM 0 HG22 ILE A 113 8.055 -28.691 10.521 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.448 -28.046 10.113 1.00 0.00 H new ATOM 0 HD11 ILE A 113 5.519 -29.575 6.167 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.150 -30.173 6.555 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.893 -30.136 7.814 1.00 0.00 H new ATOM 1808 N GLY A 114 8.949 -25.855 10.735 1.00 0.00 N ATOM 1809 CA GLY A 114 9.788 -25.579 11.902 1.00 0.00 C ATOM 1810 C GLY A 114 10.096 -26.827 12.718 1.00 0.00 C ATOM 1811 O GLY A 114 11.252 -27.278 12.764 1.00 0.00 O ATOM 0 H GLY A 114 8.024 -25.429 10.782 1.00 0.00 H new ATOM 0 HA2 GLY A 114 10.723 -25.127 11.572 1.00 0.00 H new ATOM 0 HA3 GLY A 114 9.288 -24.849 12.538 1.00 0.00 H new ATOM 1815 N GLU A 115 9.053 -27.397 13.343 1.00 0.00 N ATOM 1816 CA GLU A 115 9.172 -28.619 14.151 1.00 0.00 C ATOM 1817 C GLU A 115 7.789 -29.299 14.272 1.00 0.00 C ATOM 1818 O GLU A 115 6.761 -28.666 13.976 1.00 0.00 O ATOM 1819 CB GLU A 115 9.728 -28.287 15.575 1.00 0.00 C ATOM 1820 CG GLU A 115 8.686 -27.683 16.540 1.00 0.00 C ATOM 1821 CD GLU A 115 9.222 -27.446 17.960 1.00 0.00 C ATOM 1822 OE1 GLU A 115 9.196 -28.387 18.779 1.00 0.00 O ATOM 1823 OE2 GLU A 115 9.645 -26.314 18.276 1.00 0.00 O ATOM 0 H GLU A 115 8.105 -27.023 13.302 1.00 0.00 H new ATOM 0 HA GLU A 115 9.869 -29.297 13.658 1.00 0.00 H new ATOM 0 HB2 GLU A 115 10.129 -29.199 16.017 1.00 0.00 H new ATOM 0 HB3 GLU A 115 10.559 -27.589 15.474 1.00 0.00 H new ATOM 0 HG2 GLU A 115 8.332 -26.736 16.132 1.00 0.00 H new ATOM 0 HG3 GLU A 115 7.825 -28.349 16.593 1.00 0.00 H new ATOM 1830 N PRO A 116 7.741 -30.602 14.687 1.00 0.00 N ATOM 1831 CA PRO A 116 6.494 -31.239 15.173 1.00 0.00 C ATOM 1832 C PRO A 116 6.206 -30.918 16.661 1.00 0.00 C ATOM 1833 O PRO A 116 7.129 -30.919 17.488 1.00 0.00 O ATOM 1834 CB PRO A 116 6.790 -32.733 14.950 1.00 0.00 C ATOM 1835 CG PRO A 116 8.272 -32.873 15.146 1.00 0.00 C ATOM 1836 CD PRO A 116 8.876 -31.579 14.638 1.00 0.00 C ATOM 0 HA PRO A 116 5.600 -30.887 14.659 1.00 0.00 H new ATOM 0 HB2 PRO A 116 6.239 -33.354 15.657 1.00 0.00 H new ATOM 0 HB3 PRO A 116 6.493 -33.048 13.950 1.00 0.00 H new ATOM 0 HG2 PRO A 116 8.515 -33.033 16.197 1.00 0.00 H new ATOM 0 HG3 PRO A 116 8.661 -33.730 14.595 1.00 0.00 H new ATOM 0 HD2 PRO A 116 9.708 -31.255 15.263 1.00 0.00 H new ATOM 0 HD3 PRO A 116 9.263 -31.690 13.625 1.00 0.00 H new ATOM 1844 N ARG A 117 4.924 -30.616 16.993 1.00 0.00 N ATOM 1845 CA ARG A 117 4.478 -30.391 18.393 1.00 0.00 C ATOM 1846 C ARG A 117 3.185 -31.163 18.716 1.00 0.00 C ATOM 1847 O ARG A 117 2.409 -31.535 17.826 1.00 0.00 O ATOM 1848 CB ARG A 117 4.276 -28.879 18.700 1.00 0.00 C ATOM 1849 CG ARG A 117 5.565 -28.041 18.664 1.00 0.00 C ATOM 1850 CD ARG A 117 5.337 -26.586 19.081 1.00 0.00 C ATOM 1851 NE ARG A 117 6.581 -25.804 19.027 1.00 0.00 N ATOM 1852 CZ ARG A 117 6.657 -24.493 18.783 1.00 0.00 C ATOM 1853 NH1 ARG A 117 5.561 -23.791 18.512 1.00 0.00 N ATOM 1854 NH2 ARG A 117 7.837 -23.897 18.772 1.00 0.00 N ATOM 0 H ARG A 117 4.177 -30.522 16.305 1.00 0.00 H new ATOM 0 HA ARG A 117 5.276 -30.771 19.031 1.00 0.00 H new ATOM 0 HB2 ARG A 117 3.570 -28.467 17.979 1.00 0.00 H new ATOM 0 HB3 ARG A 117 3.821 -28.779 19.685 1.00 0.00 H new ATOM 0 HG2 ARG A 117 6.305 -28.492 19.325 1.00 0.00 H new ATOM 0 HG3 ARG A 117 5.981 -28.065 17.657 1.00 0.00 H new ATOM 0 HD2 ARG A 117 4.593 -26.132 18.426 1.00 0.00 H new ATOM 0 HD3 ARG A 117 4.932 -26.556 20.093 1.00 0.00 H new ATOM 0 HE ARG A 117 7.456 -26.303 19.189 1.00 0.00 H new ATOM 0 HH11 ARG A 117 4.652 -24.253 18.489 1.00 0.00 H new ATOM 0 HH12 ARG A 117 5.629 -22.790 18.327 1.00 0.00 H new ATOM 0 HH21 ARG A 117 8.683 -24.438 18.949 1.00 0.00 H new ATOM 0 HH22 ARG A 117 7.901 -22.896 18.586 1.00 0.00 H new ATOM 1868 N ILE A 118 2.974 -31.375 20.032 1.00 0.00 N ATOM 1869 CA ILE A 118 1.835 -32.123 20.603 1.00 0.00 C ATOM 1870 C ILE A 118 1.334 -31.368 21.850 1.00 0.00 C ATOM 1871 O ILE A 118 2.152 -30.899 22.641 1.00 0.00 O ATOM 1872 CB ILE A 118 2.265 -33.596 21.008 1.00 0.00 C ATOM 1873 CG1 ILE A 118 2.754 -34.407 19.770 1.00 0.00 C ATOM 1874 CG2 ILE A 118 1.130 -34.358 21.729 1.00 0.00 C ATOM 1875 CD1 ILE A 118 1.695 -34.665 18.720 1.00 0.00 C ATOM 0 H ILE A 118 3.610 -31.020 20.747 1.00 0.00 H new ATOM 0 HA ILE A 118 1.045 -32.198 19.856 1.00 0.00 H new ATOM 0 HB ILE A 118 3.095 -33.494 21.707 1.00 0.00 H new ATOM 0 HG12 ILE A 118 3.582 -33.871 19.306 1.00 0.00 H new ATOM 0 HG13 ILE A 118 3.146 -35.364 20.113 1.00 0.00 H new ATOM 0 HG21 ILE A 118 1.471 -35.361 21.986 1.00 0.00 H new ATOM 0 HG22 ILE A 118 0.854 -33.824 22.638 1.00 0.00 H new ATOM 0 HG23 ILE A 118 0.263 -34.427 21.071 1.00 0.00 H new ATOM 0 HD11 ILE A 118 2.129 -35.235 17.898 1.00 0.00 H new ATOM 0 HD12 ILE A 118 0.875 -35.231 19.162 1.00 0.00 H new ATOM 0 HD13 ILE A 118 1.318 -33.715 18.343 1.00 0.00 H new ATOM 1887 N VAL A 119 -0.002 -31.298 22.026 1.00 0.00 N ATOM 1888 CA VAL A 119 -0.658 -30.596 23.169 1.00 0.00 C ATOM 1889 C VAL A 119 -0.235 -31.195 24.531 1.00 0.00 C ATOM 1890 O VAL A 119 -0.005 -30.458 25.495 1.00 0.00 O ATOM 1891 CB VAL A 119 -2.237 -30.623 23.013 1.00 0.00 C ATOM 1892 CG1 VAL A 119 -2.990 -30.194 24.306 1.00 0.00 C ATOM 1893 CG2 VAL A 119 -2.676 -29.737 21.823 1.00 0.00 C ATOM 0 H VAL A 119 -0.666 -31.726 21.381 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.323 -29.559 23.149 1.00 0.00 H new ATOM 0 HB VAL A 119 -2.510 -31.661 22.821 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -4.065 -30.234 24.131 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -2.729 -30.870 25.120 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -2.704 -29.177 24.573 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -3.762 -29.766 21.729 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.354 -28.710 21.996 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -2.222 -30.110 20.905 1.00 0.00 H new