USER MOD reduce.3.24.130724 H: found=0, std=0, add=781, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 778 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 38 THR OG1 : rot 180:sc= 0.726 USER MOD Set 1.2: A 41 ASN : amide:sc= 0.646 K(o=1.4,f=0.13) USER MOD Set 2.1: A 22 LYS NZ :NH3+ 165:sc= -1.08 (180deg=-1.67) USER MOD Set 2.2: A 26 GLN : amide:sc= -2.39 K(o=-3.5,f=-4.3) USER MOD Single : A 1 SER N :NH3+ -170:sc= 0 (180deg=-0.123) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 HIS : no HD1:sc= 0.216! C(o=0.22!,f=-5!) USER MOD Single : A 20 THR OG1 : rot 44:sc= 0.034 USER MOD Single : A 23 GLN : amide:sc= -0.642 X(o=-0.64,f=-0.52) USER MOD Single : A 30 LYS NZ :NH3+ 170:sc= 1.26 (180deg=0.943) USER MOD Single : A 33 ASN : amide:sc= 0.253 K(o=0.25,f=-0.71) USER MOD Single : A 36 SER OG : rot 180:sc= -1.13 USER MOD Single : A 39 LYS NZ :NH3+ 166:sc= -0.0199 (180deg=-0.229) USER MOD Single : A 52 THR OG1 : rot 180:sc= -0.651 USER MOD Single : A 53 LYS NZ :NH3+ 171:sc= -0.021 (180deg=-0.215) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 HIS : +bothHN:sc= -6.37! C(o=-6.4!,f=-15!) USER MOD Single : A 59 LYS NZ :NH3+ -154:sc= 1.15 (180deg=0.724) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ -177:sc= 0.351 (180deg=0.26) USER MOD Single : A 70 ASN : amide:sc= -0.0433 X(o=-0.043,f=0) USER MOD Single : A 75 MET CE :methyl 136:sc= -0.744 (180deg=-2.42!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 SER OG : rot 48:sc= 0.481 USER MOD Single : A 81 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0314) USER MOD Single : A 85 LYS NZ :NH3+ -147:sc= 1.23 (180deg=1.09) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -1.852 17.106 -3.065 1.00 0.00 N ATOM 2 CA SER A 1 -1.176 17.880 -2.006 1.00 0.00 C ATOM 3 C SER A 1 -1.944 17.775 -0.692 1.00 0.00 C ATOM 4 O SER A 1 -1.345 17.710 0.382 1.00 0.00 O ATOM 5 CB SER A 1 -1.040 19.345 -2.432 1.00 0.00 C ATOM 6 OG SER A 1 -0.329 20.105 -1.469 1.00 0.00 O ATOM 0 H1 SER A 1 -1.235 17.047 -3.900 1.00 0.00 H new ATOM 0 H2 SER A 1 -2.056 16.147 -2.718 1.00 0.00 H new ATOM 0 H3 SER A 1 -2.742 17.577 -3.325 1.00 0.00 H new ATOM 0 HA SER A 1 -0.180 17.465 -1.852 1.00 0.00 H new ATOM 0 HB2 SER A 1 -0.525 19.399 -3.391 1.00 0.00 H new ATOM 0 HB3 SER A 1 -2.031 19.776 -2.577 1.00 0.00 H new ATOM 0 HG SER A 1 -0.259 21.034 -1.772 1.00 0.00 H new ATOM 11 N ASN A 2 -3.271 17.750 -0.775 1.00 0.00 N ATOM 12 CA ASN A 2 -4.103 17.646 0.417 1.00 0.00 C ATOM 13 C ASN A 2 -4.221 16.186 0.838 1.00 0.00 C ATOM 14 O ASN A 2 -4.325 15.293 -0.008 1.00 0.00 O ATOM 15 CB ASN A 2 -5.490 18.245 0.159 1.00 0.00 C ATOM 16 CG ASN A 2 -6.337 18.321 1.418 1.00 0.00 C ATOM 17 OD1 ASN A 2 -5.815 18.432 2.528 1.00 0.00 O ATOM 18 ND2 ASN A 2 -7.649 18.272 1.250 1.00 0.00 N ATOM 0 H ASN A 2 -3.790 17.800 -1.651 1.00 0.00 H new ATOM 0 HA ASN A 2 -3.635 18.210 1.224 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -5.378 19.245 -0.260 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -6.008 17.643 -0.587 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -8.269 18.327 2.058 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -8.040 18.180 0.312 1.00 0.00 H new ATOM 25 N THR A 3 -4.191 15.949 2.139 1.00 0.00 N ATOM 26 CA THR A 3 -4.168 14.599 2.675 1.00 0.00 C ATOM 27 C THR A 3 -5.471 13.851 2.405 1.00 0.00 C ATOM 28 O THR A 3 -6.563 14.330 2.717 1.00 0.00 O ATOM 29 CB THR A 3 -3.878 14.616 4.188 1.00 0.00 C ATOM 30 OG1 THR A 3 -2.590 15.200 4.426 1.00 0.00 O ATOM 31 CG2 THR A 3 -3.924 13.211 4.771 1.00 0.00 C ATOM 0 H THR A 3 -4.182 16.682 2.849 1.00 0.00 H new ATOM 0 HA THR A 3 -3.366 14.069 2.161 1.00 0.00 H new ATOM 0 HB THR A 3 -4.647 15.213 4.678 1.00 0.00 H new ATOM 0 HG1 THR A 3 -2.409 15.211 5.389 1.00 0.00 H new ATOM 0 HG21 THR A 3 -3.716 13.254 5.840 1.00 0.00 H new ATOM 0 HG22 THR A 3 -4.914 12.783 4.611 1.00 0.00 H new ATOM 0 HG23 THR A 3 -3.176 12.589 4.280 1.00 0.00 H new ATOM 39 N ARG A 4 -5.331 12.685 1.790 1.00 0.00 N ATOM 40 CA ARG A 4 -6.465 11.814 1.548 1.00 0.00 C ATOM 41 C ARG A 4 -6.710 10.870 2.713 1.00 0.00 C ATOM 42 O ARG A 4 -5.794 10.292 3.295 1.00 0.00 O ATOM 43 CB ARG A 4 -6.266 10.979 0.283 1.00 0.00 C ATOM 44 CG ARG A 4 -6.034 11.776 -0.986 1.00 0.00 C ATOM 45 CD ARG A 4 -7.115 12.812 -1.202 1.00 0.00 C ATOM 46 NE ARG A 4 -8.465 12.244 -1.239 1.00 0.00 N ATOM 47 CZ ARG A 4 -9.486 12.811 -1.884 1.00 0.00 C ATOM 48 NH1 ARG A 4 -9.290 13.913 -2.602 1.00 0.00 N ATOM 49 NH2 ARG A 4 -10.700 12.276 -1.812 1.00 0.00 N ATOM 0 H ARG A 4 -4.440 12.323 1.450 1.00 0.00 H new ATOM 0 HA ARG A 4 -7.329 12.467 1.426 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -5.416 10.314 0.436 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -7.143 10.348 0.142 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -5.063 12.269 -0.934 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -6.003 11.099 -1.840 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -7.062 13.553 -0.405 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -6.924 13.337 -2.138 1.00 0.00 H new ATOM 0 HE ARG A 4 -8.633 11.368 -0.745 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -8.359 14.325 -2.660 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -10.071 14.346 -3.095 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -10.853 11.430 -1.263 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -11.479 12.711 -2.306 1.00 0.00 H new ATOM 63 N ASN A 5 -7.981 10.748 3.015 1.00 0.00 N ATOM 64 CA ASN A 5 -8.462 9.911 4.087 1.00 0.00 C ATOM 65 C ASN A 5 -9.080 8.649 3.528 1.00 0.00 C ATOM 66 O ASN A 5 -10.059 8.700 2.786 1.00 0.00 O ATOM 67 CB ASN A 5 -9.482 10.666 4.925 1.00 0.00 C ATOM 68 CG ASN A 5 -8.872 11.840 5.649 1.00 0.00 C ATOM 69 OD1 ASN A 5 -8.421 11.725 6.790 1.00 0.00 O ATOM 70 ND2 ASN A 5 -8.855 12.977 4.986 1.00 0.00 N ATOM 0 H ASN A 5 -8.723 11.237 2.513 1.00 0.00 H new ATOM 0 HA ASN A 5 -7.619 9.637 4.722 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -10.288 11.018 4.282 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -9.927 9.986 5.651 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -8.456 13.812 5.415 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -9.241 13.023 4.043 1.00 0.00 H new ATOM 77 N PHE A 6 -8.506 7.517 3.873 1.00 0.00 N ATOM 78 CA PHE A 6 -8.994 6.253 3.368 1.00 0.00 C ATOM 79 C PHE A 6 -9.453 5.341 4.493 1.00 0.00 C ATOM 80 O PHE A 6 -9.152 5.544 5.666 1.00 0.00 O ATOM 81 CB PHE A 6 -7.918 5.516 2.557 1.00 0.00 C ATOM 82 CG PHE A 6 -7.552 6.143 1.235 1.00 0.00 C ATOM 83 CD1 PHE A 6 -6.836 7.324 1.183 1.00 0.00 C ATOM 84 CD2 PHE A 6 -7.899 5.525 0.044 1.00 0.00 C ATOM 85 CE1 PHE A 6 -6.475 7.879 -0.029 1.00 0.00 C ATOM 86 CE2 PHE A 6 -7.541 6.079 -1.175 1.00 0.00 C ATOM 87 CZ PHE A 6 -6.825 7.261 -1.208 1.00 0.00 C ATOM 0 H PHE A 6 -7.704 7.446 4.499 1.00 0.00 H new ATOM 0 HA PHE A 6 -9.840 6.490 2.723 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -7.017 5.443 3.166 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -8.261 4.498 2.373 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -6.555 7.819 2.101 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -8.456 4.600 0.066 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -5.915 8.802 -0.052 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -7.820 5.589 -2.096 1.00 0.00 H new ATOM 0 HZ PHE A 6 -6.542 7.697 -2.154 1.00 0.00 H new ATOM 97 N VAL A 7 -10.178 4.335 4.078 1.00 0.00 N ATOM 98 CA VAL A 7 -10.555 3.241 4.947 1.00 0.00 C ATOM 99 C VAL A 7 -10.152 1.949 4.291 1.00 0.00 C ATOM 100 O VAL A 7 -10.445 1.716 3.123 1.00 0.00 O ATOM 101 CB VAL A 7 -12.058 3.186 5.273 1.00 0.00 C ATOM 102 CG1 VAL A 7 -12.312 2.273 6.467 1.00 0.00 C ATOM 103 CG2 VAL A 7 -12.618 4.576 5.529 1.00 0.00 C ATOM 0 H VAL A 7 -10.527 4.247 3.124 1.00 0.00 H new ATOM 0 HA VAL A 7 -10.040 3.400 5.894 1.00 0.00 H new ATOM 0 HB VAL A 7 -12.575 2.775 4.406 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -13.380 2.246 6.684 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -11.963 1.267 6.236 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -11.775 2.653 7.336 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -13.682 4.504 5.756 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -12.097 5.029 6.372 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -12.478 5.194 4.642 1.00 0.00 H new ATOM 113 N LEU A 8 -9.474 1.117 5.033 1.00 0.00 N ATOM 114 CA LEU A 8 -9.020 -0.151 4.500 1.00 0.00 C ATOM 115 C LEU A 8 -10.186 -1.127 4.559 1.00 0.00 C ATOM 116 O LEU A 8 -11.078 -0.974 5.398 1.00 0.00 O ATOM 117 CB LEU A 8 -7.830 -0.676 5.314 1.00 0.00 C ATOM 118 CG LEU A 8 -6.995 -1.783 4.654 1.00 0.00 C ATOM 119 CD1 LEU A 8 -6.143 -1.212 3.539 1.00 0.00 C ATOM 120 CD2 LEU A 8 -6.102 -2.469 5.674 1.00 0.00 C ATOM 0 H LEU A 8 -9.221 1.288 6.006 1.00 0.00 H new ATOM 0 HA LEU A 8 -8.686 -0.032 3.469 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.171 0.163 5.538 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -8.205 -1.051 6.267 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.685 -2.518 4.239 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.558 -2.011 3.083 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -6.786 -0.758 2.786 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.471 -0.456 3.945 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.521 -3.249 5.182 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.426 -1.737 6.117 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.718 -2.914 6.456 1.00 0.00 H new ATOM 132 N ARG A 9 -10.174 -2.147 3.722 1.00 0.00 N ATOM 133 CA ARG A 9 -11.260 -3.107 3.676 1.00 0.00 C ATOM 134 C ARG A 9 -10.631 -4.476 3.611 1.00 0.00 C ATOM 135 O ARG A 9 -9.578 -4.648 2.997 1.00 0.00 O ATOM 136 CB ARG A 9 -12.180 -2.908 2.461 1.00 0.00 C ATOM 137 CG ARG A 9 -13.152 -1.746 2.596 1.00 0.00 C ATOM 138 CD ARG A 9 -14.139 -1.694 1.439 1.00 0.00 C ATOM 139 NE ARG A 9 -15.212 -2.679 1.574 1.00 0.00 N ATOM 140 CZ ARG A 9 -15.741 -3.360 0.555 1.00 0.00 C ATOM 141 NH1 ARG A 9 -15.304 -3.166 -0.684 1.00 0.00 N ATOM 142 NH2 ARG A 9 -16.731 -4.212 0.782 1.00 0.00 N ATOM 0 H ARG A 9 -9.419 -2.332 3.061 1.00 0.00 H new ATOM 0 HA ARG A 9 -11.885 -2.979 4.560 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -11.564 -2.750 1.576 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -12.747 -3.824 2.296 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -13.698 -1.837 3.535 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -12.595 -0.810 2.640 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -14.572 -0.695 1.380 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -13.607 -1.867 0.504 1.00 0.00 H new ATOM 0 HE ARG A 9 -15.580 -2.857 2.508 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -14.559 -2.493 -0.862 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -15.713 -3.690 -1.457 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -17.083 -4.344 1.730 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -17.140 -4.736 0.009 1.00 0.00 H new ATOM 156 N ASP A 10 -11.238 -5.435 4.272 1.00 0.00 N ATOM 157 CA ASP A 10 -10.731 -6.793 4.255 1.00 0.00 C ATOM 158 C ASP A 10 -11.311 -7.516 3.053 1.00 0.00 C ATOM 159 O ASP A 10 -11.895 -6.878 2.177 1.00 0.00 O ATOM 160 CB ASP A 10 -11.096 -7.504 5.556 1.00 0.00 C ATOM 161 CG ASP A 10 -10.220 -8.698 5.847 1.00 0.00 C ATOM 162 OD1 ASP A 10 -9.171 -8.516 6.497 1.00 0.00 O ATOM 163 OD2 ASP A 10 -10.586 -9.815 5.438 1.00 0.00 O ATOM 0 H ASP A 10 -12.083 -5.303 4.828 1.00 0.00 H new ATOM 0 HA ASP A 10 -9.644 -6.787 4.175 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -11.021 -6.797 6.382 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -12.136 -7.828 5.506 1.00 0.00 H new ATOM 168 N GLU A 11 -11.217 -8.826 3.024 1.00 0.00 N ATOM 169 CA GLU A 11 -11.582 -9.558 1.829 1.00 0.00 C ATOM 170 C GLU A 11 -13.075 -9.812 1.766 1.00 0.00 C ATOM 171 O GLU A 11 -13.713 -9.483 0.767 1.00 0.00 O ATOM 172 CB GLU A 11 -10.789 -10.855 1.715 1.00 0.00 C ATOM 173 CG GLU A 11 -9.373 -10.618 1.222 1.00 0.00 C ATOM 174 CD GLU A 11 -9.343 -10.089 -0.204 1.00 0.00 C ATOM 175 OE1 GLU A 11 -9.800 -8.949 -0.436 1.00 0.00 O ATOM 176 OE2 GLU A 11 -8.881 -10.820 -1.107 1.00 0.00 O ATOM 0 H GLU A 11 -10.896 -9.402 3.802 1.00 0.00 H new ATOM 0 HA GLU A 11 -11.324 -8.937 0.971 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -10.756 -11.346 2.688 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -11.301 -11.534 1.033 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -8.874 -9.908 1.882 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -8.811 -11.550 1.274 1.00 0.00 H new ATOM 183 N ASP A 12 -13.647 -10.378 2.821 1.00 0.00 N ATOM 184 CA ASP A 12 -15.079 -10.655 2.875 1.00 0.00 C ATOM 185 C ASP A 12 -15.918 -9.388 3.121 1.00 0.00 C ATOM 186 O ASP A 12 -17.148 -9.442 3.150 1.00 0.00 O ATOM 187 CB ASP A 12 -15.308 -11.703 3.981 1.00 0.00 C ATOM 188 CG ASP A 12 -16.732 -11.779 4.505 1.00 0.00 C ATOM 189 OD1 ASP A 12 -17.592 -12.397 3.844 1.00 0.00 O ATOM 190 OD2 ASP A 12 -16.987 -11.229 5.598 1.00 0.00 O ATOM 0 H ASP A 12 -13.136 -10.657 3.659 1.00 0.00 H new ATOM 0 HA ASP A 12 -15.409 -11.037 1.909 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -15.025 -12.683 3.597 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -14.641 -11.482 4.814 1.00 0.00 H new ATOM 195 N GLY A 13 -15.283 -8.230 3.240 1.00 0.00 N ATOM 196 CA GLY A 13 -16.055 -7.043 3.552 1.00 0.00 C ATOM 197 C GLY A 13 -15.902 -6.575 4.981 1.00 0.00 C ATOM 198 O GLY A 13 -16.862 -6.108 5.592 1.00 0.00 O ATOM 0 H GLY A 13 -14.278 -8.091 3.130 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -15.754 -6.238 2.882 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -17.108 -7.244 3.356 1.00 0.00 H new ATOM 202 N ASN A 14 -14.711 -6.714 5.537 1.00 0.00 N ATOM 203 CA ASN A 14 -14.467 -6.208 6.876 1.00 0.00 C ATOM 204 C ASN A 14 -13.719 -4.908 6.764 1.00 0.00 C ATOM 205 O ASN A 14 -13.376 -4.476 5.663 1.00 0.00 O ATOM 206 CB ASN A 14 -13.666 -7.167 7.747 1.00 0.00 C ATOM 207 CG ASN A 14 -14.390 -8.470 8.012 1.00 0.00 C ATOM 208 OD1 ASN A 14 -15.230 -8.554 8.904 1.00 0.00 O ATOM 209 ND2 ASN A 14 -14.054 -9.500 7.251 1.00 0.00 N ATOM 0 H ASN A 14 -13.911 -7.164 5.092 1.00 0.00 H new ATOM 0 HA ASN A 14 -15.436 -6.079 7.357 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -12.713 -7.379 7.263 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -13.440 -6.683 8.697 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -14.498 -10.407 7.395 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -13.351 -9.387 6.521 1.00 0.00 H new ATOM 216 N GLU A 15 -13.439 -4.297 7.889 1.00 0.00 N ATOM 217 CA GLU A 15 -12.837 -2.991 7.882 1.00 0.00 C ATOM 218 C GLU A 15 -11.526 -2.960 8.638 1.00 0.00 C ATOM 219 O GLU A 15 -11.280 -3.754 9.541 1.00 0.00 O ATOM 220 CB GLU A 15 -13.808 -1.986 8.464 1.00 0.00 C ATOM 221 CG GLU A 15 -14.983 -1.695 7.544 1.00 0.00 C ATOM 222 CD GLU A 15 -15.975 -0.719 8.133 1.00 0.00 C ATOM 223 OE1 GLU A 15 -16.561 -1.026 9.191 1.00 0.00 O ATOM 224 OE2 GLU A 15 -16.194 0.350 7.528 1.00 0.00 O ATOM 0 H GLU A 15 -13.618 -4.683 8.816 1.00 0.00 H new ATOM 0 HA GLU A 15 -12.611 -2.731 6.848 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -14.183 -2.361 9.416 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -13.279 -1.057 8.674 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -14.608 -1.297 6.601 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -15.495 -2.629 7.314 1.00 0.00 H new ATOM 231 N HIS A 16 -10.688 -2.040 8.215 1.00 0.00 N ATOM 232 CA HIS A 16 -9.398 -1.786 8.820 1.00 0.00 C ATOM 233 C HIS A 16 -9.266 -0.305 9.026 1.00 0.00 C ATOM 234 O HIS A 16 -10.284 0.390 9.057 1.00 0.00 O ATOM 235 CB HIS A 16 -8.264 -2.391 8.004 1.00 0.00 C ATOM 236 CG HIS A 16 -8.299 -3.894 7.974 1.00 0.00 C ATOM 237 ND1 HIS A 16 -7.930 -4.675 9.046 1.00 0.00 N ATOM 238 CD2 HIS A 16 -8.678 -4.757 6.999 1.00 0.00 C ATOM 239 CE1 HIS A 16 -8.075 -5.949 8.735 1.00 0.00 C ATOM 240 NE2 HIS A 16 -8.527 -6.027 7.501 1.00 0.00 N ATOM 0 H HIS A 16 -10.889 -1.432 7.421 1.00 0.00 H new ATOM 0 HA HIS A 16 -9.328 -2.278 9.790 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -8.315 -2.011 6.984 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -7.311 -2.063 8.418 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -9.032 -4.495 6.013 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -7.859 -6.786 9.383 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -8.732 -6.891 6.999 1.00 0.00 H new ATOM 249 N GLY A 17 -8.069 0.213 9.161 1.00 0.00 N ATOM 250 CA GLY A 17 -7.959 1.491 9.817 1.00 0.00 C ATOM 251 C GLY A 17 -8.089 2.622 8.822 1.00 0.00 C ATOM 252 O GLY A 17 -8.403 2.391 7.649 1.00 0.00 O ATOM 0 H GLY A 17 -7.196 -0.207 8.842 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -8.733 1.581 10.579 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -6.999 1.560 10.329 1.00 0.00 H new ATOM 256 N VAL A 18 -7.857 3.838 9.276 1.00 0.00 N ATOM 257 CA VAL A 18 -7.918 4.994 8.388 1.00 0.00 C ATOM 258 C VAL A 18 -6.529 5.335 7.841 1.00 0.00 C ATOM 259 O VAL A 18 -5.645 5.799 8.563 1.00 0.00 O ATOM 260 CB VAL A 18 -8.510 6.231 9.105 1.00 0.00 C ATOM 261 CG1 VAL A 18 -8.545 7.440 8.179 1.00 0.00 C ATOM 262 CG2 VAL A 18 -9.902 5.925 9.635 1.00 0.00 C ATOM 0 H VAL A 18 -7.626 4.056 10.245 1.00 0.00 H new ATOM 0 HA VAL A 18 -8.574 4.728 7.560 1.00 0.00 H new ATOM 0 HB VAL A 18 -7.862 6.472 9.948 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -8.966 8.293 8.711 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -7.532 7.679 7.854 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -9.162 7.214 7.309 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -10.302 6.806 10.136 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -10.555 5.651 8.806 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -9.848 5.098 10.343 1.00 0.00 H new ATOM 272 N PHE A 19 -6.364 5.067 6.557 1.00 0.00 N ATOM 273 CA PHE A 19 -5.098 5.333 5.878 1.00 0.00 C ATOM 274 C PHE A 19 -5.061 6.674 5.181 1.00 0.00 C ATOM 275 O PHE A 19 -5.766 6.930 4.210 1.00 0.00 O ATOM 276 CB PHE A 19 -4.777 4.220 4.906 1.00 0.00 C ATOM 277 CG PHE A 19 -4.513 2.932 5.613 1.00 0.00 C ATOM 278 CD1 PHE A 19 -5.555 2.135 6.049 1.00 0.00 C ATOM 279 CD2 PHE A 19 -3.218 2.543 5.878 1.00 0.00 C ATOM 280 CE1 PHE A 19 -5.308 0.964 6.731 1.00 0.00 C ATOM 281 CE2 PHE A 19 -2.960 1.378 6.562 1.00 0.00 C ATOM 282 CZ PHE A 19 -4.008 0.583 6.991 1.00 0.00 C ATOM 0 H PHE A 19 -7.087 4.666 5.960 1.00 0.00 H new ATOM 0 HA PHE A 19 -4.333 5.371 6.654 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -5.608 4.091 4.212 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.905 4.495 4.312 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -6.574 2.434 5.853 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.396 3.160 5.545 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -6.130 0.346 7.061 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -1.941 1.084 6.764 1.00 0.00 H new ATOM 0 HZ PHE A 19 -3.809 -0.333 7.528 1.00 0.00 H new ATOM 292 N THR A 20 -4.232 7.526 5.728 1.00 0.00 N ATOM 293 CA THR A 20 -3.999 8.834 5.143 1.00 0.00 C ATOM 294 C THR A 20 -2.840 8.848 4.159 1.00 0.00 C ATOM 295 O THR A 20 -1.679 8.641 4.509 1.00 0.00 O ATOM 296 CB THR A 20 -3.789 9.919 6.194 1.00 0.00 C ATOM 297 OG1 THR A 20 -2.838 9.490 7.181 1.00 0.00 O ATOM 298 CG2 THR A 20 -5.111 10.276 6.845 1.00 0.00 C ATOM 0 H THR A 20 -3.703 7.342 6.580 1.00 0.00 H new ATOM 0 HA THR A 20 -4.913 9.057 4.593 1.00 0.00 H new ATOM 0 HB THR A 20 -3.391 10.807 5.704 1.00 0.00 H new ATOM 0 HG1 THR A 20 -2.078 9.060 6.737 1.00 0.00 H new ATOM 0 HG21 THR A 20 -4.950 11.052 7.594 1.00 0.00 H new ATOM 0 HG22 THR A 20 -5.803 10.642 6.086 1.00 0.00 H new ATOM 0 HG23 THR A 20 -5.532 9.391 7.323 1.00 0.00 H new ATOM 306 N GLY A 21 -3.203 9.086 2.920 1.00 0.00 N ATOM 307 CA GLY A 21 -2.219 9.162 1.849 1.00 0.00 C ATOM 308 C GLY A 21 -2.356 10.399 0.995 1.00 0.00 C ATOM 309 O GLY A 21 -3.355 11.099 1.066 1.00 0.00 O ATOM 0 H GLY A 21 -4.168 9.231 2.623 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -1.219 9.138 2.282 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -2.314 8.280 1.216 1.00 0.00 H new ATOM 313 N LYS A 22 -1.342 10.679 0.184 1.00 0.00 N ATOM 314 CA LYS A 22 -1.427 11.775 -0.771 1.00 0.00 C ATOM 315 C LYS A 22 -2.267 11.345 -1.969 1.00 0.00 C ATOM 316 O LYS A 22 -2.904 12.161 -2.634 1.00 0.00 O ATOM 317 CB LYS A 22 -0.037 12.224 -1.218 1.00 0.00 C ATOM 318 CG LYS A 22 0.657 11.268 -2.171 1.00 0.00 C ATOM 319 CD LYS A 22 1.900 11.914 -2.750 1.00 0.00 C ATOM 320 CE LYS A 22 2.961 12.205 -1.694 1.00 0.00 C ATOM 321 NZ LYS A 22 3.616 10.969 -1.185 1.00 0.00 N ATOM 0 H LYS A 22 -0.460 10.167 0.169 1.00 0.00 H new ATOM 0 HA LYS A 22 -1.906 12.625 -0.286 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -0.121 13.199 -1.698 1.00 0.00 H new ATOM 0 HB3 LYS A 22 0.589 12.356 -0.336 1.00 0.00 H new ATOM 0 HG2 LYS A 22 0.926 10.351 -1.646 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -0.023 10.987 -2.975 1.00 0.00 H new ATOM 0 HD2 LYS A 22 2.323 11.260 -3.512 1.00 0.00 H new ATOM 0 HD3 LYS A 22 1.623 12.844 -3.246 1.00 0.00 H new ATOM 0 HE2 LYS A 22 3.718 12.865 -2.117 1.00 0.00 H new ATOM 0 HE3 LYS A 22 2.503 12.738 -0.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 4.485 11.222 -0.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 2.967 10.472 -0.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 3.854 10.348 -1.984 1.00 0.00 H new ATOM 335 N GLN A 23 -2.267 10.046 -2.217 1.00 0.00 N ATOM 336 CA GLN A 23 -3.056 9.443 -3.273 1.00 0.00 C ATOM 337 C GLN A 23 -3.205 7.958 -2.975 1.00 0.00 C ATOM 338 O GLN A 23 -2.475 7.440 -2.132 1.00 0.00 O ATOM 339 CB GLN A 23 -2.400 9.657 -4.645 1.00 0.00 C ATOM 340 CG GLN A 23 -0.974 9.134 -4.748 1.00 0.00 C ATOM 341 CD GLN A 23 -0.422 9.244 -6.156 1.00 0.00 C ATOM 342 OE1 GLN A 23 -0.813 10.123 -6.923 1.00 0.00 O ATOM 343 NE2 GLN A 23 0.505 8.367 -6.501 1.00 0.00 N ATOM 0 H GLN A 23 -1.713 9.375 -1.684 1.00 0.00 H new ATOM 0 HA GLN A 23 -4.038 9.915 -3.308 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -3.009 9.169 -5.406 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -2.401 10.723 -4.872 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -0.334 9.692 -4.064 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -0.948 8.092 -4.430 1.00 0.00 H new ATOM 0 HE21 GLN A 23 0.803 7.652 -5.837 1.00 0.00 H new ATOM 0 HE22 GLN A 23 0.922 8.405 -7.431 1.00 0.00 H new ATOM 352 N PRO A 24 -4.155 7.266 -3.628 1.00 0.00 N ATOM 353 CA PRO A 24 -4.374 5.825 -3.450 1.00 0.00 C ATOM 354 C PRO A 24 -3.083 5.010 -3.330 1.00 0.00 C ATOM 355 O PRO A 24 -2.927 4.237 -2.391 1.00 0.00 O ATOM 356 CB PRO A 24 -5.129 5.455 -4.720 1.00 0.00 C ATOM 357 CG PRO A 24 -5.961 6.653 -4.999 1.00 0.00 C ATOM 358 CD PRO A 24 -5.130 7.841 -4.580 1.00 0.00 C ATOM 0 HA PRO A 24 -4.900 5.606 -2.521 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -4.447 5.241 -5.543 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -5.743 4.566 -4.576 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -6.220 6.711 -6.056 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -6.898 6.616 -4.443 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -4.633 8.303 -5.433 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -5.741 8.612 -4.111 1.00 0.00 H new ATOM 366 N ARG A 25 -2.187 5.168 -4.296 1.00 0.00 N ATOM 367 CA ARG A 25 -0.905 4.469 -4.285 1.00 0.00 C ATOM 368 C ARG A 25 -0.122 4.719 -2.987 1.00 0.00 C ATOM 369 O ARG A 25 0.491 3.803 -2.447 1.00 0.00 O ATOM 370 CB ARG A 25 -0.055 4.864 -5.494 1.00 0.00 C ATOM 371 CG ARG A 25 1.219 4.045 -5.616 1.00 0.00 C ATOM 372 CD ARG A 25 2.008 4.403 -6.863 1.00 0.00 C ATOM 373 NE ARG A 25 3.222 3.597 -6.980 1.00 0.00 N ATOM 374 CZ ARG A 25 4.052 3.641 -8.020 1.00 0.00 C ATOM 375 NH1 ARG A 25 3.813 4.461 -9.038 1.00 0.00 N ATOM 376 NH2 ARG A 25 5.127 2.865 -8.041 1.00 0.00 N ATOM 0 H ARG A 25 -2.324 5.778 -5.102 1.00 0.00 H new ATOM 0 HA ARG A 25 -1.127 3.403 -4.341 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -0.646 4.744 -6.402 1.00 0.00 H new ATOM 0 HB3 ARG A 25 0.204 5.920 -5.420 1.00 0.00 H new ATOM 0 HG2 ARG A 25 1.840 4.207 -4.735 1.00 0.00 H new ATOM 0 HG3 ARG A 25 0.968 2.985 -5.638 1.00 0.00 H new ATOM 0 HD2 ARG A 25 1.385 4.253 -7.744 1.00 0.00 H new ATOM 0 HD3 ARG A 25 2.273 5.460 -6.836 1.00 0.00 H new ATOM 0 HE ARG A 25 3.448 2.960 -6.216 1.00 0.00 H new ATOM 0 HH11 ARG A 25 2.989 5.062 -9.026 1.00 0.00 H new ATOM 0 HH12 ARG A 25 4.453 4.489 -9.831 1.00 0.00 H new ATOM 0 HH21 ARG A 25 5.317 2.236 -7.261 1.00 0.00 H new ATOM 0 HH22 ARG A 25 5.764 2.897 -8.837 1.00 0.00 H new ATOM 390 N GLN A 26 -0.144 5.951 -2.478 1.00 0.00 N ATOM 391 CA GLN A 26 0.566 6.263 -1.244 1.00 0.00 C ATOM 392 C GLN A 26 -0.210 5.792 -0.026 1.00 0.00 C ATOM 393 O GLN A 26 0.372 5.444 0.996 1.00 0.00 O ATOM 394 CB GLN A 26 0.838 7.757 -1.144 1.00 0.00 C ATOM 395 CG GLN A 26 1.983 8.209 -2.023 1.00 0.00 C ATOM 396 CD GLN A 26 3.285 7.527 -1.659 1.00 0.00 C ATOM 397 OE1 GLN A 26 4.049 8.023 -0.833 1.00 0.00 O ATOM 398 NE2 GLN A 26 3.540 6.380 -2.265 1.00 0.00 N ATOM 0 H GLN A 26 -0.640 6.738 -2.897 1.00 0.00 H new ATOM 0 HA GLN A 26 1.517 5.732 -1.268 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -0.063 8.304 -1.421 1.00 0.00 H new ATOM 0 HB3 GLN A 26 1.060 8.012 -0.108 1.00 0.00 H new ATOM 0 HG2 GLN A 26 1.744 7.999 -3.066 1.00 0.00 H new ATOM 0 HG3 GLN A 26 2.103 9.289 -1.934 1.00 0.00 H new ATOM 0 HE21 GLN A 26 2.878 6.004 -2.944 1.00 0.00 H new ATOM 0 HE22 GLN A 26 4.398 5.871 -2.053 1.00 0.00 H new ATOM 407 N ALA A 27 -1.523 5.807 -0.139 1.00 0.00 N ATOM 408 CA ALA A 27 -2.377 5.255 0.899 1.00 0.00 C ATOM 409 C ALA A 27 -2.162 3.755 0.977 1.00 0.00 C ATOM 410 O ALA A 27 -2.267 3.144 2.038 1.00 0.00 O ATOM 411 CB ALA A 27 -3.831 5.572 0.623 1.00 0.00 C ATOM 0 H ALA A 27 -2.024 6.195 -0.938 1.00 0.00 H new ATOM 0 HA ALA A 27 -2.115 5.707 1.856 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -4.452 5.149 1.413 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -3.968 6.653 0.593 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -4.121 5.143 -0.336 1.00 0.00 H new ATOM 417 N ALA A 28 -1.868 3.173 -0.176 1.00 0.00 N ATOM 418 CA ALA A 28 -1.531 1.770 -0.262 1.00 0.00 C ATOM 419 C ALA A 28 -0.167 1.507 0.354 1.00 0.00 C ATOM 420 O ALA A 28 0.036 0.495 1.016 1.00 0.00 O ATOM 421 CB ALA A 28 -1.582 1.305 -1.709 1.00 0.00 C ATOM 0 H ALA A 28 -1.858 3.662 -1.071 1.00 0.00 H new ATOM 0 HA ALA A 28 -2.265 1.198 0.304 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -1.326 0.247 -1.760 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -2.587 1.455 -2.104 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -0.870 1.880 -2.301 1.00 0.00 H new ATOM 427 N LEU A 29 0.765 2.424 0.133 1.00 0.00 N ATOM 428 CA LEU A 29 2.056 2.367 0.796 1.00 0.00 C ATOM 429 C LEU A 29 1.835 2.342 2.303 1.00 0.00 C ATOM 430 O LEU A 29 2.266 1.425 3.001 1.00 0.00 O ATOM 431 CB LEU A 29 2.898 3.590 0.419 1.00 0.00 C ATOM 432 CG LEU A 29 4.291 3.292 -0.120 1.00 0.00 C ATOM 433 CD1 LEU A 29 4.229 3.089 -1.622 1.00 0.00 C ATOM 434 CD2 LEU A 29 5.251 4.414 0.239 1.00 0.00 C ATOM 0 H LEU A 29 0.649 3.215 -0.500 1.00 0.00 H new ATOM 0 HA LEU A 29 2.586 1.468 0.482 1.00 0.00 H new ATOM 0 HB2 LEU A 29 2.354 4.166 -0.330 1.00 0.00 H new ATOM 0 HB3 LEU A 29 2.997 4.225 1.299 1.00 0.00 H new ATOM 0 HG LEU A 29 4.662 2.375 0.338 1.00 0.00 H new ATOM 0 HD11 LEU A 29 5.228 2.876 -2.002 1.00 0.00 H new ATOM 0 HD12 LEU A 29 3.569 2.252 -1.849 1.00 0.00 H new ATOM 0 HD13 LEU A 29 3.846 3.993 -2.096 1.00 0.00 H new ATOM 0 HD21 LEU A 29 6.242 4.185 -0.154 1.00 0.00 H new ATOM 0 HD22 LEU A 29 4.896 5.349 -0.194 1.00 0.00 H new ATOM 0 HD23 LEU A 29 5.305 4.514 1.323 1.00 0.00 H new ATOM 446 N LYS A 30 1.234 3.426 2.783 1.00 0.00 N ATOM 447 CA LYS A 30 0.707 3.499 4.150 1.00 0.00 C ATOM 448 C LYS A 30 0.144 2.159 4.624 1.00 0.00 C ATOM 449 O LYS A 30 0.470 1.706 5.713 1.00 0.00 O ATOM 450 CB LYS A 30 -0.374 4.571 4.280 1.00 0.00 C ATOM 451 CG LYS A 30 0.162 5.993 4.196 1.00 0.00 C ATOM 452 CD LYS A 30 1.260 6.232 5.221 1.00 0.00 C ATOM 453 CE LYS A 30 1.767 7.668 5.180 1.00 0.00 C ATOM 454 NZ LYS A 30 0.735 8.638 5.634 1.00 0.00 N ATOM 0 H LYS A 30 1.097 4.279 2.241 1.00 0.00 H new ATOM 0 HA LYS A 30 1.553 3.764 4.784 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -1.115 4.424 3.494 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -0.889 4.442 5.232 1.00 0.00 H new ATOM 0 HG2 LYS A 30 0.550 6.179 3.194 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -0.651 6.700 4.359 1.00 0.00 H new ATOM 0 HD2 LYS A 30 0.882 6.008 6.218 1.00 0.00 H new ATOM 0 HD3 LYS A 30 2.088 5.548 5.033 1.00 0.00 H new ATOM 0 HE2 LYS A 30 2.651 7.758 5.811 1.00 0.00 H new ATOM 0 HE3 LYS A 30 2.074 7.915 4.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 1.168 9.576 5.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -0.024 8.694 4.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 0.338 8.323 6.542 1.00 0.00 H new ATOM 468 N ALA A 31 -0.681 1.515 3.810 1.00 0.00 N ATOM 469 CA ALA A 31 -1.293 0.255 4.195 1.00 0.00 C ATOM 470 C ALA A 31 -0.258 -0.853 4.319 1.00 0.00 C ATOM 471 O ALA A 31 -0.407 -1.761 5.139 1.00 0.00 O ATOM 472 CB ALA A 31 -2.368 -0.133 3.194 1.00 0.00 C ATOM 0 H ALA A 31 -0.940 1.845 2.880 1.00 0.00 H new ATOM 0 HA ALA A 31 -1.751 0.390 5.175 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -2.819 -1.079 3.493 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -3.134 0.642 3.165 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -1.923 -0.240 2.205 1.00 0.00 H new ATOM 478 N ALA A 32 0.800 -0.759 3.531 1.00 0.00 N ATOM 479 CA ALA A 32 1.805 -1.804 3.480 1.00 0.00 C ATOM 480 C ALA A 32 2.847 -1.655 4.576 1.00 0.00 C ATOM 481 O ALA A 32 3.570 -2.598 4.886 1.00 0.00 O ATOM 482 CB ALA A 32 2.477 -1.835 2.117 1.00 0.00 C ATOM 0 H ALA A 32 0.984 0.034 2.916 1.00 0.00 H new ATOM 0 HA ALA A 32 1.289 -2.750 3.646 1.00 0.00 H new ATOM 0 HB1 ALA A 32 3.227 -2.625 2.099 1.00 0.00 H new ATOM 0 HB2 ALA A 32 1.730 -2.027 1.347 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.957 -0.875 1.926 1.00 0.00 H new ATOM 488 N ASN A 33 2.932 -0.467 5.148 1.00 0.00 N ATOM 489 CA ASN A 33 3.868 -0.198 6.238 1.00 0.00 C ATOM 490 C ASN A 33 3.774 -1.255 7.345 1.00 0.00 C ATOM 491 O ASN A 33 4.779 -1.622 7.951 1.00 0.00 O ATOM 492 CB ASN A 33 3.595 1.196 6.813 1.00 0.00 C ATOM 493 CG ASN A 33 2.763 1.159 8.082 1.00 0.00 C ATOM 494 OD1 ASN A 33 3.282 1.345 9.180 1.00 0.00 O ATOM 495 ND2 ASN A 33 1.478 0.862 7.943 1.00 0.00 N ATOM 0 H ASN A 33 2.363 0.335 4.877 1.00 0.00 H new ATOM 0 HA ASN A 33 4.880 -0.240 5.834 1.00 0.00 H new ATOM 0 HB2 ASN A 33 4.544 1.690 7.021 1.00 0.00 H new ATOM 0 HB3 ASN A 33 3.080 1.798 6.064 1.00 0.00 H new ATOM 0 HD21 ASN A 33 0.881 0.780 8.766 1.00 0.00 H new ATOM 0 HD22 ASN A 33 1.086 0.715 7.013 1.00 0.00 H new ATOM 502 N ARG A 34 2.567 -1.753 7.578 1.00 0.00 N ATOM 503 CA ARG A 34 2.310 -2.687 8.662 1.00 0.00 C ATOM 504 C ARG A 34 2.444 -4.123 8.173 1.00 0.00 C ATOM 505 O ARG A 34 2.660 -5.047 8.960 1.00 0.00 O ATOM 506 CB ARG A 34 0.894 -2.460 9.201 1.00 0.00 C ATOM 507 CG ARG A 34 -0.180 -2.745 8.164 1.00 0.00 C ATOM 508 CD ARG A 34 -1.584 -2.620 8.727 1.00 0.00 C ATOM 509 NE ARG A 34 -2.576 -3.133 7.784 1.00 0.00 N ATOM 510 CZ ARG A 34 -3.280 -4.250 7.982 1.00 0.00 C ATOM 511 NH1 ARG A 34 -3.169 -4.915 9.125 1.00 0.00 N ATOM 512 NH2 ARG A 34 -4.098 -4.701 7.039 1.00 0.00 N ATOM 0 H ARG A 34 1.743 -1.521 7.023 1.00 0.00 H new ATOM 0 HA ARG A 34 3.040 -2.518 9.454 1.00 0.00 H new ATOM 0 HB2 ARG A 34 0.733 -3.099 10.070 1.00 0.00 H new ATOM 0 HB3 ARG A 34 0.800 -1.429 9.542 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -0.065 -2.055 7.328 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -0.040 -3.751 7.768 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -1.653 -3.169 9.666 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -1.797 -1.575 8.952 1.00 0.00 H new ATOM 0 HE ARG A 34 -2.740 -2.607 6.925 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -2.544 -4.573 9.855 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -3.708 -5.768 9.273 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -4.191 -4.194 6.159 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -4.634 -5.555 7.194 1.00 0.00 H new ATOM 526 N GLY A 35 2.328 -4.294 6.867 1.00 0.00 N ATOM 527 CA GLY A 35 2.320 -5.612 6.284 1.00 0.00 C ATOM 528 C GLY A 35 3.416 -5.778 5.259 1.00 0.00 C ATOM 529 O GLY A 35 3.223 -5.496 4.079 1.00 0.00 O ATOM 0 H GLY A 35 2.238 -3.532 6.195 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.441 -6.358 7.070 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.353 -5.796 5.816 1.00 0.00 H new ATOM 533 N SER A 36 4.577 -6.218 5.718 1.00 0.00 N ATOM 534 CA SER A 36 5.730 -6.384 4.851 1.00 0.00 C ATOM 535 C SER A 36 5.514 -7.508 3.840 1.00 0.00 C ATOM 536 O SER A 36 6.216 -7.566 2.829 1.00 0.00 O ATOM 537 CB SER A 36 6.980 -6.665 5.692 1.00 0.00 C ATOM 538 OG SER A 36 8.142 -6.719 4.886 1.00 0.00 O ATOM 0 H SER A 36 4.745 -6.468 6.693 1.00 0.00 H new ATOM 0 HA SER A 36 5.868 -5.457 4.294 1.00 0.00 H new ATOM 0 HB2 SER A 36 7.095 -5.888 6.447 1.00 0.00 H new ATOM 0 HB3 SER A 36 6.859 -7.609 6.223 1.00 0.00 H new ATOM 0 HG SER A 36 8.923 -6.898 5.450 1.00 0.00 H new ATOM 544 N GLY A 37 4.519 -8.366 4.122 1.00 0.00 N ATOM 545 CA GLY A 37 4.259 -9.558 3.320 1.00 0.00 C ATOM 546 C GLY A 37 5.514 -10.145 2.718 1.00 0.00 C ATOM 547 O GLY A 37 6.528 -10.283 3.401 1.00 0.00 O ATOM 0 H GLY A 37 3.880 -8.248 4.908 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.774 -10.310 3.942 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.561 -9.307 2.521 1.00 0.00 H new ATOM 551 N THR A 38 5.430 -10.508 1.448 1.00 0.00 N ATOM 552 CA THR A 38 6.603 -10.770 0.630 1.00 0.00 C ATOM 553 C THR A 38 6.256 -10.409 -0.803 1.00 0.00 C ATOM 554 O THR A 38 5.089 -10.178 -1.103 1.00 0.00 O ATOM 555 CB THR A 38 7.074 -12.247 0.648 1.00 0.00 C ATOM 556 OG1 THR A 38 6.116 -13.077 -0.019 1.00 0.00 O ATOM 557 CG2 THR A 38 7.284 -12.773 2.059 1.00 0.00 C ATOM 0 H THR A 38 4.545 -10.629 0.955 1.00 0.00 H new ATOM 0 HA THR A 38 7.418 -10.175 1.042 1.00 0.00 H new ATOM 0 HB THR A 38 8.033 -12.278 0.130 1.00 0.00 H new ATOM 0 HG1 THR A 38 6.423 -14.008 -0.004 1.00 0.00 H new ATOM 0 HG21 THR A 38 7.613 -13.811 2.015 1.00 0.00 H new ATOM 0 HG22 THR A 38 8.042 -12.173 2.562 1.00 0.00 H new ATOM 0 HG23 THR A 38 6.347 -12.713 2.613 1.00 0.00 H new ATOM 565 N LYS A 39 7.237 -10.351 -1.681 1.00 0.00 N ATOM 566 CA LYS A 39 6.965 -10.136 -3.096 1.00 0.00 C ATOM 567 C LYS A 39 6.052 -11.225 -3.652 1.00 0.00 C ATOM 568 O LYS A 39 5.210 -10.977 -4.517 1.00 0.00 O ATOM 569 CB LYS A 39 8.266 -10.104 -3.887 1.00 0.00 C ATOM 570 CG LYS A 39 8.043 -10.237 -5.377 1.00 0.00 C ATOM 571 CD LYS A 39 9.355 -10.318 -6.136 1.00 0.00 C ATOM 572 CE LYS A 39 9.133 -10.411 -7.639 1.00 0.00 C ATOM 573 NZ LYS A 39 8.455 -9.202 -8.175 1.00 0.00 N ATOM 0 H LYS A 39 8.225 -10.448 -1.446 1.00 0.00 H new ATOM 0 HA LYS A 39 6.459 -9.176 -3.196 1.00 0.00 H new ATOM 0 HB2 LYS A 39 8.788 -9.169 -3.683 1.00 0.00 H new ATOM 0 HB3 LYS A 39 8.914 -10.912 -3.547 1.00 0.00 H new ATOM 0 HG2 LYS A 39 7.451 -11.130 -5.578 1.00 0.00 H new ATOM 0 HG3 LYS A 39 7.467 -9.384 -5.736 1.00 0.00 H new ATOM 0 HD2 LYS A 39 9.960 -9.439 -5.911 1.00 0.00 H new ATOM 0 HD3 LYS A 39 9.918 -11.188 -5.797 1.00 0.00 H new ATOM 0 HE2 LYS A 39 10.092 -10.542 -8.140 1.00 0.00 H new ATOM 0 HE3 LYS A 39 8.533 -11.293 -7.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 8.532 -9.192 -9.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 7.451 -9.217 -7.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 8.906 -8.350 -7.786 1.00 0.00 H new ATOM 587 N ALA A 40 6.208 -12.422 -3.125 1.00 0.00 N ATOM 588 CA ALA A 40 5.520 -13.584 -3.657 1.00 0.00 C ATOM 589 C ALA A 40 4.093 -13.659 -3.150 1.00 0.00 C ATOM 590 O ALA A 40 3.164 -13.956 -3.900 1.00 0.00 O ATOM 591 CB ALA A 40 6.268 -14.850 -3.285 1.00 0.00 C ATOM 0 H ALA A 40 6.808 -12.618 -2.324 1.00 0.00 H new ATOM 0 HA ALA A 40 5.490 -13.488 -4.742 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.743 -15.715 -3.689 1.00 0.00 H new ATOM 0 HB2 ALA A 40 7.276 -14.812 -3.698 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.324 -14.934 -2.200 1.00 0.00 H new ATOM 597 N ASN A 41 3.932 -13.380 -1.870 1.00 0.00 N ATOM 598 CA ASN A 41 2.626 -13.427 -1.229 1.00 0.00 C ATOM 599 C ASN A 41 2.347 -12.131 -0.470 1.00 0.00 C ATOM 600 O ASN A 41 2.203 -12.119 0.754 1.00 0.00 O ATOM 601 CB ASN A 41 2.524 -14.642 -0.301 1.00 0.00 C ATOM 602 CG ASN A 41 3.710 -14.798 0.638 1.00 0.00 C ATOM 603 OD1 ASN A 41 4.564 -15.663 0.440 1.00 0.00 O ATOM 604 ND2 ASN A 41 3.801 -13.933 1.631 1.00 0.00 N ATOM 0 H ASN A 41 4.695 -13.116 -1.247 1.00 0.00 H new ATOM 0 HA ASN A 41 1.867 -13.530 -2.005 1.00 0.00 H new ATOM 0 HB2 ASN A 41 1.612 -14.560 0.291 1.00 0.00 H new ATOM 0 HB3 ASN A 41 2.431 -15.543 -0.907 1.00 0.00 H new ATOM 0 HD21 ASN A 41 4.599 -13.967 2.266 1.00 0.00 H new ATOM 0 HD22 ASN A 41 3.074 -13.230 1.764 1.00 0.00 H new ATOM 611 N PRO A 42 2.225 -11.021 -1.198 1.00 0.00 N ATOM 612 CA PRO A 42 2.126 -9.692 -0.594 1.00 0.00 C ATOM 613 C PRO A 42 0.862 -9.522 0.240 1.00 0.00 C ATOM 614 O PRO A 42 -0.184 -10.089 -0.084 1.00 0.00 O ATOM 615 CB PRO A 42 2.092 -8.749 -1.805 1.00 0.00 C ATOM 616 CG PRO A 42 2.574 -9.560 -2.957 1.00 0.00 C ATOM 617 CD PRO A 42 2.148 -10.964 -2.665 1.00 0.00 C ATOM 0 HA PRO A 42 2.950 -9.500 0.094 1.00 0.00 H new ATOM 0 HB2 PRO A 42 1.084 -8.376 -1.983 1.00 0.00 H new ATOM 0 HB3 PRO A 42 2.730 -7.880 -1.643 1.00 0.00 H new ATOM 0 HG2 PRO A 42 2.143 -9.206 -3.893 1.00 0.00 H new ATOM 0 HG3 PRO A 42 3.657 -9.492 -3.059 1.00 0.00 H new ATOM 0 HD2 PRO A 42 1.140 -11.166 -3.027 1.00 0.00 H new ATOM 0 HD3 PRO A 42 2.807 -11.694 -3.135 1.00 0.00 H new ATOM 625 N ASP A 43 0.966 -8.747 1.317 1.00 0.00 N ATOM 626 CA ASP A 43 -0.189 -8.443 2.151 1.00 0.00 C ATOM 627 C ASP A 43 -1.216 -7.672 1.338 1.00 0.00 C ATOM 628 O ASP A 43 -0.981 -6.526 0.954 1.00 0.00 O ATOM 629 CB ASP A 43 0.208 -7.624 3.388 1.00 0.00 C ATOM 630 CG ASP A 43 0.527 -8.483 4.596 1.00 0.00 C ATOM 631 OD1 ASP A 43 -0.406 -8.817 5.360 1.00 0.00 O ATOM 632 OD2 ASP A 43 1.709 -8.823 4.799 1.00 0.00 O ATOM 0 H ASP A 43 1.838 -8.320 1.630 1.00 0.00 H new ATOM 0 HA ASP A 43 -0.615 -9.386 2.493 1.00 0.00 H new ATOM 0 HB2 ASP A 43 1.076 -7.011 3.147 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -0.604 -6.942 3.640 1.00 0.00 H new ATOM 637 N ILE A 44 -2.336 -8.314 1.051 1.00 0.00 N ATOM 638 CA ILE A 44 -3.376 -7.714 0.233 1.00 0.00 C ATOM 639 C ILE A 44 -3.979 -6.490 0.904 1.00 0.00 C ATOM 640 O ILE A 44 -4.485 -6.564 2.024 1.00 0.00 O ATOM 641 CB ILE A 44 -4.502 -8.727 -0.079 1.00 0.00 C ATOM 642 CG1 ILE A 44 -3.964 -9.819 -0.989 1.00 0.00 C ATOM 643 CG2 ILE A 44 -5.700 -8.041 -0.728 1.00 0.00 C ATOM 644 CD1 ILE A 44 -3.438 -9.269 -2.287 1.00 0.00 C ATOM 0 H ILE A 44 -2.549 -9.257 1.375 1.00 0.00 H new ATOM 0 HA ILE A 44 -2.901 -7.408 -0.699 1.00 0.00 H new ATOM 0 HB ILE A 44 -4.840 -9.167 0.859 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -3.168 -10.358 -0.476 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -4.755 -10.540 -1.196 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -6.474 -8.780 -0.935 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -6.094 -7.282 -0.053 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -5.389 -7.571 -1.661 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -3.064 -10.086 -2.904 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -4.240 -8.753 -2.815 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -2.628 -8.568 -2.084 1.00 0.00 H new ATOM 656 N ILE A 45 -3.919 -5.368 0.212 1.00 0.00 N ATOM 657 CA ILE A 45 -4.512 -4.145 0.729 1.00 0.00 C ATOM 658 C ILE A 45 -5.631 -3.637 -0.162 1.00 0.00 C ATOM 659 O ILE A 45 -5.506 -3.565 -1.383 1.00 0.00 O ATOM 660 CB ILE A 45 -3.476 -3.031 0.900 1.00 0.00 C ATOM 661 CG1 ILE A 45 -2.866 -2.678 -0.458 1.00 0.00 C ATOM 662 CG2 ILE A 45 -2.424 -3.459 1.904 1.00 0.00 C ATOM 663 CD1 ILE A 45 -1.659 -1.794 -0.384 1.00 0.00 C ATOM 0 H ILE A 45 -3.471 -5.276 -0.700 1.00 0.00 H new ATOM 0 HA ILE A 45 -4.920 -4.405 1.706 1.00 0.00 H new ATOM 0 HB ILE A 45 -3.956 -2.133 1.288 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -2.595 -3.600 -0.971 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -3.625 -2.186 -1.066 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -1.689 -2.663 2.022 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -2.898 -3.661 2.864 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -1.927 -4.362 1.548 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -1.292 -1.594 -1.391 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -1.926 -0.854 0.098 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -0.880 -2.290 0.195 1.00 0.00 H new ATOM 675 N ARG A 46 -6.735 -3.305 0.464 1.00 0.00 N ATOM 676 CA ARG A 46 -7.853 -2.696 -0.233 1.00 0.00 C ATOM 677 C ARG A 46 -8.186 -1.360 0.397 1.00 0.00 C ATOM 678 O ARG A 46 -8.577 -1.301 1.561 1.00 0.00 O ATOM 679 CB ARG A 46 -9.065 -3.619 -0.198 1.00 0.00 C ATOM 680 CG ARG A 46 -8.849 -4.905 -0.969 1.00 0.00 C ATOM 681 CD ARG A 46 -9.923 -5.926 -0.672 1.00 0.00 C ATOM 682 NE ARG A 46 -11.263 -5.477 -1.055 1.00 0.00 N ATOM 683 CZ ARG A 46 -12.329 -6.280 -0.991 1.00 0.00 C ATOM 684 NH1 ARG A 46 -12.166 -7.564 -0.700 1.00 0.00 N ATOM 685 NH2 ARG A 46 -13.546 -5.825 -1.250 1.00 0.00 N ATOM 0 H ARG A 46 -6.888 -3.446 1.463 1.00 0.00 H new ATOM 0 HA ARG A 46 -7.575 -2.534 -1.275 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -9.303 -3.858 0.838 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -9.927 -3.094 -0.610 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -8.837 -4.690 -2.038 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -7.873 -5.320 -0.717 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -9.692 -6.852 -1.199 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -9.914 -6.155 0.394 1.00 0.00 H new ATOM 0 HE ARG A 46 -11.387 -4.519 -1.382 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -11.231 -7.933 -0.527 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -12.976 -8.182 -0.650 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -13.681 -4.846 -1.503 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -14.348 -6.453 -1.196 1.00 0.00 H new ATOM 699 N LEU A 47 -8.033 -0.291 -0.365 1.00 0.00 N ATOM 700 CA LEU A 47 -8.247 1.034 0.174 1.00 0.00 C ATOM 701 C LEU A 47 -9.526 1.615 -0.381 1.00 0.00 C ATOM 702 O LEU A 47 -9.709 1.719 -1.596 1.00 0.00 O ATOM 703 CB LEU A 47 -7.079 1.978 -0.121 1.00 0.00 C ATOM 704 CG LEU A 47 -5.804 1.790 0.711 1.00 0.00 C ATOM 705 CD1 LEU A 47 -6.112 1.904 2.194 1.00 0.00 C ATOM 706 CD2 LEU A 47 -5.125 0.466 0.393 1.00 0.00 C ATOM 0 H LEU A 47 -7.764 -0.316 -1.349 1.00 0.00 H new ATOM 0 HA LEU A 47 -8.322 0.935 1.257 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -6.815 1.872 -1.173 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -7.427 3.001 0.019 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.109 2.586 0.445 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.195 1.768 2.768 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.529 2.889 2.404 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -6.834 1.137 2.476 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.225 0.364 0.999 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -5.807 -0.355 0.615 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.856 0.439 -0.663 1.00 0.00 H new ATOM 718 N ARG A 48 -10.398 1.976 0.521 1.00 0.00 N ATOM 719 CA ARG A 48 -11.654 2.593 0.185 1.00 0.00 C ATOM 720 C ARG A 48 -11.635 4.028 0.664 1.00 0.00 C ATOM 721 O ARG A 48 -11.851 4.282 1.848 1.00 0.00 O ATOM 722 CB ARG A 48 -12.803 1.840 0.864 1.00 0.00 C ATOM 723 CG ARG A 48 -14.155 2.502 0.655 1.00 0.00 C ATOM 724 CD ARG A 48 -15.289 1.714 1.290 1.00 0.00 C ATOM 725 NE ARG A 48 -15.105 1.503 2.729 1.00 0.00 N ATOM 726 CZ ARG A 48 -16.104 1.507 3.614 1.00 0.00 C ATOM 727 NH1 ARG A 48 -17.324 1.869 3.244 1.00 0.00 N ATOM 728 NH2 ARG A 48 -15.866 1.192 4.878 1.00 0.00 N ATOM 0 H ARG A 48 -10.255 1.849 1.523 1.00 0.00 H new ATOM 0 HA ARG A 48 -11.801 2.562 -0.895 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -12.840 0.821 0.478 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -12.601 1.769 1.933 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -14.134 3.507 1.077 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -14.343 2.608 -0.413 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -16.228 2.241 1.123 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -15.374 0.747 0.795 1.00 0.00 H new ATOM 0 HE ARG A 48 -14.158 1.344 3.074 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -17.503 2.146 2.279 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -18.084 1.870 3.924 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -14.921 0.947 5.173 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -16.628 1.194 5.556 1.00 0.00 H new ATOM 742 N GLU A 49 -11.327 4.971 -0.213 1.00 0.00 N ATOM 743 CA GLU A 49 -11.354 6.374 0.163 1.00 0.00 C ATOM 744 C GLU A 49 -12.761 6.768 0.567 1.00 0.00 C ATOM 745 O GLU A 49 -13.740 6.306 -0.025 1.00 0.00 O ATOM 746 CB GLU A 49 -10.870 7.220 -1.017 1.00 0.00 C ATOM 747 CG GLU A 49 -9.916 8.346 -0.651 1.00 0.00 C ATOM 748 CD GLU A 49 -10.614 9.602 -0.200 1.00 0.00 C ATOM 749 OE1 GLU A 49 -11.798 9.777 -0.531 1.00 0.00 O ATOM 750 OE2 GLU A 49 -9.970 10.441 0.460 1.00 0.00 O ATOM 0 H GLU A 49 -11.058 4.792 -1.181 1.00 0.00 H new ATOM 0 HA GLU A 49 -10.693 6.544 1.013 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -10.377 6.566 -1.736 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -11.738 7.648 -1.518 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -9.251 8.005 0.142 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -9.291 8.577 -1.514 1.00 0.00 H new ATOM 757 N ARG A 50 -12.859 7.640 1.550 1.00 0.00 N ATOM 758 CA ARG A 50 -14.156 7.970 2.132 1.00 0.00 C ATOM 759 C ARG A 50 -14.845 9.081 1.343 1.00 0.00 C ATOM 760 O ARG A 50 -15.801 9.694 1.821 1.00 0.00 O ATOM 761 CB ARG A 50 -14.030 8.370 3.604 1.00 0.00 C ATOM 762 CG ARG A 50 -12.623 8.271 4.171 1.00 0.00 C ATOM 763 CD ARG A 50 -12.597 8.631 5.638 1.00 0.00 C ATOM 764 NE ARG A 50 -13.253 9.903 5.866 1.00 0.00 N ATOM 765 CZ ARG A 50 -14.253 10.090 6.728 1.00 0.00 C ATOM 766 NH1 ARG A 50 -14.759 9.063 7.398 1.00 0.00 N ATOM 767 NH2 ARG A 50 -14.772 11.300 6.892 1.00 0.00 N ATOM 0 H ARG A 50 -12.067 8.132 1.964 1.00 0.00 H new ATOM 0 HA ARG A 50 -14.769 7.070 2.077 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -14.382 9.395 3.719 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -14.691 7.737 4.196 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -12.244 7.258 4.036 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -11.958 8.936 3.619 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -13.092 7.852 6.217 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -11.566 8.681 5.987 1.00 0.00 H new ATOM 0 HE ARG A 50 -12.928 10.709 5.332 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -14.383 8.126 7.255 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -15.524 9.211 8.056 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -14.406 12.088 6.358 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -15.537 11.442 7.552 1.00 0.00 H new ATOM 781 N GLY A 51 -14.333 9.357 0.153 1.00 0.00 N ATOM 782 CA GLY A 51 -14.969 10.303 -0.736 1.00 0.00 C ATOM 783 C GLY A 51 -15.104 9.767 -2.152 1.00 0.00 C ATOM 784 O GLY A 51 -15.766 10.377 -2.991 1.00 0.00 O ATOM 0 H GLY A 51 -13.479 8.937 -0.214 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -15.957 10.553 -0.349 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -14.390 11.227 -0.754 1.00 0.00 H new ATOM 788 N THR A 52 -14.466 8.631 -2.423 1.00 0.00 N ATOM 789 CA THR A 52 -14.532 8.012 -3.744 1.00 0.00 C ATOM 790 C THR A 52 -15.554 6.880 -3.757 1.00 0.00 C ATOM 791 O THR A 52 -16.082 6.504 -2.712 1.00 0.00 O ATOM 792 CB THR A 52 -13.159 7.455 -4.176 1.00 0.00 C ATOM 793 OG1 THR A 52 -12.711 6.459 -3.246 1.00 0.00 O ATOM 794 CG2 THR A 52 -12.124 8.568 -4.275 1.00 0.00 C ATOM 0 H THR A 52 -13.898 8.121 -1.746 1.00 0.00 H new ATOM 0 HA THR A 52 -14.834 8.788 -4.448 1.00 0.00 H new ATOM 0 HB THR A 52 -13.276 7.002 -5.160 1.00 0.00 H new ATOM 0 HG1 THR A 52 -11.840 6.113 -3.532 1.00 0.00 H new ATOM 0 HG21 THR A 52 -11.166 8.148 -4.581 1.00 0.00 H new ATOM 0 HG22 THR A 52 -12.450 9.303 -5.011 1.00 0.00 H new ATOM 0 HG23 THR A 52 -12.015 9.051 -3.304 1.00 0.00 H new ATOM 802 N LYS A 53 -15.818 6.331 -4.938 1.00 0.00 N ATOM 803 CA LYS A 53 -16.800 5.260 -5.084 1.00 0.00 C ATOM 804 C LYS A 53 -16.105 3.948 -5.453 1.00 0.00 C ATOM 805 O LYS A 53 -16.744 2.959 -5.818 1.00 0.00 O ATOM 806 CB LYS A 53 -17.840 5.643 -6.148 1.00 0.00 C ATOM 807 CG LYS A 53 -19.006 4.670 -6.265 1.00 0.00 C ATOM 808 CD LYS A 53 -20.003 5.116 -7.322 1.00 0.00 C ATOM 809 CE LYS A 53 -21.110 4.092 -7.523 1.00 0.00 C ATOM 810 NZ LYS A 53 -21.792 3.750 -6.246 1.00 0.00 N ATOM 0 H LYS A 53 -15.366 6.609 -5.809 1.00 0.00 H new ATOM 0 HA LYS A 53 -17.313 5.117 -4.133 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -18.231 6.634 -5.917 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -17.343 5.714 -7.116 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -18.629 3.678 -6.515 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -19.509 4.587 -5.302 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -20.440 6.071 -7.030 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -19.483 5.279 -8.266 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -21.841 4.483 -8.231 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -20.691 3.187 -7.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -22.632 3.171 -6.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -21.140 3.216 -5.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -22.081 4.624 -5.762 1.00 0.00 H new ATOM 824 N LYS A 54 -14.789 3.933 -5.339 1.00 0.00 N ATOM 825 CA LYS A 54 -14.024 2.749 -5.683 1.00 0.00 C ATOM 826 C LYS A 54 -13.206 2.251 -4.499 1.00 0.00 C ATOM 827 O LYS A 54 -12.683 3.039 -3.708 1.00 0.00 O ATOM 828 CB LYS A 54 -13.105 3.023 -6.871 1.00 0.00 C ATOM 829 CG LYS A 54 -12.185 4.202 -6.655 1.00 0.00 C ATOM 830 CD LYS A 54 -11.303 4.460 -7.868 1.00 0.00 C ATOM 831 CE LYS A 54 -12.119 4.857 -9.087 1.00 0.00 C ATOM 832 NZ LYS A 54 -11.264 5.036 -10.288 1.00 0.00 N ATOM 0 H LYS A 54 -14.231 4.722 -5.013 1.00 0.00 H new ATOM 0 HA LYS A 54 -14.736 1.971 -5.958 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -12.505 2.135 -7.070 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -13.713 3.203 -7.758 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -12.778 5.091 -6.441 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -11.558 4.019 -5.782 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -10.589 5.250 -7.636 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -10.725 3.564 -8.094 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -12.870 4.093 -9.286 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -12.654 5.784 -8.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -11.857 5.306 -11.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -10.563 5.783 -10.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -10.773 4.144 -10.500 1.00 0.00 H new ATOM 846 N VAL A 55 -13.111 0.941 -4.381 1.00 0.00 N ATOM 847 CA VAL A 55 -12.258 0.313 -3.391 1.00 0.00 C ATOM 848 C VAL A 55 -11.111 -0.373 -4.107 1.00 0.00 C ATOM 849 O VAL A 55 -11.269 -1.452 -4.671 1.00 0.00 O ATOM 850 CB VAL A 55 -13.037 -0.714 -2.545 1.00 0.00 C ATOM 851 CG1 VAL A 55 -12.116 -1.401 -1.545 1.00 0.00 C ATOM 852 CG2 VAL A 55 -14.193 -0.033 -1.831 1.00 0.00 C ATOM 0 H VAL A 55 -13.623 0.282 -4.968 1.00 0.00 H new ATOM 0 HA VAL A 55 -11.881 1.079 -2.713 1.00 0.00 H new ATOM 0 HB VAL A 55 -13.439 -1.478 -3.210 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.687 -2.121 -0.959 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -11.320 -1.919 -2.080 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -11.681 -0.656 -0.879 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -14.737 -0.767 -1.236 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -13.807 0.749 -1.177 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -14.866 0.408 -2.566 1.00 0.00 H new ATOM 862 N HIS A 56 -9.962 0.263 -4.106 1.00 0.00 N ATOM 863 CA HIS A 56 -8.833 -0.248 -4.861 1.00 0.00 C ATOM 864 C HIS A 56 -8.044 -1.250 -4.058 1.00 0.00 C ATOM 865 O HIS A 56 -7.807 -1.068 -2.870 1.00 0.00 O ATOM 866 CB HIS A 56 -7.934 0.887 -5.350 1.00 0.00 C ATOM 867 CG HIS A 56 -7.390 1.797 -4.291 1.00 0.00 C ATOM 868 ND1 HIS A 56 -6.145 1.633 -3.723 1.00 0.00 N ATOM 869 CD2 HIS A 56 -7.898 2.931 -3.753 1.00 0.00 C ATOM 870 CE1 HIS A 56 -5.910 2.624 -2.892 1.00 0.00 C ATOM 871 NE2 HIS A 56 -6.957 3.428 -2.889 1.00 0.00 N ATOM 0 H HIS A 56 -9.782 1.128 -3.597 1.00 0.00 H new ATOM 0 HA HIS A 56 -9.231 -0.761 -5.736 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -7.095 0.451 -5.893 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -8.497 1.488 -6.064 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -5.505 0.863 -3.917 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -8.865 3.363 -3.965 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -5.011 2.758 -2.309 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -7.050 4.279 -2.335 1.00 0.00 H new ATOM 880 N VAL A 57 -7.612 -2.287 -4.737 1.00 0.00 N ATOM 881 CA VAL A 57 -6.893 -3.361 -4.102 1.00 0.00 C ATOM 882 C VAL A 57 -5.564 -3.588 -4.799 1.00 0.00 C ATOM 883 O VAL A 57 -5.509 -3.928 -5.985 1.00 0.00 O ATOM 884 CB VAL A 57 -7.732 -4.666 -4.029 1.00 0.00 C ATOM 885 CG1 VAL A 57 -8.773 -4.726 -5.134 1.00 0.00 C ATOM 886 CG2 VAL A 57 -6.845 -5.909 -4.069 1.00 0.00 C ATOM 0 H VAL A 57 -7.749 -2.408 -5.740 1.00 0.00 H new ATOM 0 HA VAL A 57 -6.695 -3.066 -3.071 1.00 0.00 H new ATOM 0 HB VAL A 57 -8.253 -4.650 -3.072 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.340 -5.653 -5.050 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -9.450 -3.877 -5.042 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.277 -4.691 -6.104 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.468 -6.802 -4.016 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -6.274 -5.919 -4.998 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.159 -5.894 -3.222 1.00 0.00 H new ATOM 896 N PHE A 58 -4.491 -3.328 -4.073 1.00 0.00 N ATOM 897 CA PHE A 58 -3.167 -3.591 -4.573 1.00 0.00 C ATOM 898 C PHE A 58 -2.556 -4.657 -3.686 1.00 0.00 C ATOM 899 O PHE A 58 -2.896 -4.747 -2.509 1.00 0.00 O ATOM 900 CB PHE A 58 -2.231 -2.361 -4.519 1.00 0.00 C ATOM 901 CG PHE A 58 -2.720 -1.032 -5.045 1.00 0.00 C ATOM 902 CD1 PHE A 58 -4.046 -0.764 -5.330 1.00 0.00 C ATOM 903 CD2 PHE A 58 -1.788 -0.024 -5.229 1.00 0.00 C ATOM 904 CE1 PHE A 58 -4.424 0.485 -5.790 1.00 0.00 C ATOM 905 CE2 PHE A 58 -2.162 1.218 -5.678 1.00 0.00 C ATOM 906 CZ PHE A 58 -3.480 1.478 -5.960 1.00 0.00 C ATOM 0 H PHE A 58 -4.518 -2.934 -3.133 1.00 0.00 H new ATOM 0 HA PHE A 58 -3.263 -3.887 -5.618 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -1.943 -2.215 -3.478 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.324 -2.616 -5.067 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -4.791 -1.534 -5.193 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -0.747 -0.219 -5.015 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -5.461 0.684 -6.017 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.419 1.991 -5.809 1.00 0.00 H new ATOM 0 HZ PHE A 58 -3.777 2.454 -6.313 1.00 0.00 H new ATOM 916 N LYS A 59 -1.712 -5.502 -4.235 1.00 0.00 N ATOM 917 CA LYS A 59 -0.790 -6.237 -3.368 1.00 0.00 C ATOM 918 C LYS A 59 0.189 -5.250 -2.733 1.00 0.00 C ATOM 919 O LYS A 59 0.267 -4.106 -3.157 1.00 0.00 O ATOM 920 CB LYS A 59 -0.004 -7.275 -4.181 1.00 0.00 C ATOM 921 CG LYS A 59 -0.697 -7.725 -5.460 1.00 0.00 C ATOM 922 CD LYS A 59 -1.937 -8.562 -5.185 1.00 0.00 C ATOM 923 CE LYS A 59 -1.590 -10.011 -4.888 1.00 0.00 C ATOM 924 NZ LYS A 59 -1.052 -10.712 -6.086 1.00 0.00 N ATOM 0 H LYS A 59 -1.636 -5.699 -5.233 1.00 0.00 H new ATOM 0 HA LYS A 59 -1.361 -6.753 -2.596 1.00 0.00 H new ATOM 0 HB2 LYS A 59 0.970 -6.857 -4.437 1.00 0.00 H new ATOM 0 HB3 LYS A 59 0.178 -8.148 -3.554 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -0.976 -6.849 -6.046 1.00 0.00 H new ATOM 0 HG3 LYS A 59 0.002 -8.304 -6.064 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -2.480 -8.139 -4.340 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -2.603 -8.518 -6.047 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -0.855 -10.050 -4.084 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -2.479 -10.531 -4.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -1.237 -11.732 -6.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -1.516 -10.344 -6.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -0.027 -10.550 -6.152 1.00 0.00 H new ATOM 938 N ALA A 60 0.959 -5.705 -1.758 1.00 0.00 N ATOM 939 CA ALA A 60 1.831 -4.816 -0.980 1.00 0.00 C ATOM 940 C ALA A 60 2.858 -5.623 -0.186 1.00 0.00 C ATOM 941 O ALA A 60 2.515 -6.626 0.436 1.00 0.00 O ATOM 942 CB ALA A 60 1.004 -3.951 -0.052 1.00 0.00 C ATOM 0 H ALA A 60 1.004 -6.685 -1.480 1.00 0.00 H new ATOM 0 HA ALA A 60 2.369 -4.169 -1.673 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.663 -3.297 0.519 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.312 -3.347 -0.638 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.441 -4.586 0.632 1.00 0.00 H new ATOM 948 N TRP A 61 4.118 -5.199 -0.218 1.00 0.00 N ATOM 949 CA TRP A 61 5.187 -5.936 0.460 1.00 0.00 C ATOM 950 C TRP A 61 6.414 -5.051 0.679 1.00 0.00 C ATOM 951 O TRP A 61 6.466 -3.933 0.190 1.00 0.00 O ATOM 952 CB TRP A 61 5.568 -7.181 -0.353 1.00 0.00 C ATOM 953 CG TRP A 61 6.289 -6.885 -1.632 1.00 0.00 C ATOM 954 CD1 TRP A 61 7.634 -6.971 -1.851 1.00 0.00 C ATOM 955 CD2 TRP A 61 5.708 -6.467 -2.870 1.00 0.00 C ATOM 956 NE1 TRP A 61 7.921 -6.639 -3.151 1.00 0.00 N ATOM 957 CE2 TRP A 61 6.756 -6.322 -3.795 1.00 0.00 C ATOM 958 CE3 TRP A 61 4.402 -6.203 -3.285 1.00 0.00 C ATOM 959 CZ2 TRP A 61 6.538 -5.923 -5.108 1.00 0.00 C ATOM 960 CZ3 TRP A 61 4.185 -5.808 -4.588 1.00 0.00 C ATOM 961 CH2 TRP A 61 5.249 -5.671 -5.488 1.00 0.00 C ATOM 0 H TRP A 61 4.426 -4.355 -0.702 1.00 0.00 H new ATOM 0 HA TRP A 61 4.818 -6.248 1.437 1.00 0.00 H new ATOM 0 HB2 TRP A 61 6.195 -7.825 0.263 1.00 0.00 H new ATOM 0 HB3 TRP A 61 4.662 -7.742 -0.582 1.00 0.00 H new ATOM 0 HD1 TRP A 61 8.365 -7.258 -1.110 1.00 0.00 H new ATOM 0 HE1 TRP A 61 8.851 -6.630 -3.569 1.00 0.00 H new ATOM 0 HE3 TRP A 61 3.576 -6.306 -2.597 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 7.357 -5.816 -5.803 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 3.178 -5.601 -4.920 1.00 0.00 H new ATOM 0 HH2 TRP A 61 5.047 -5.360 -6.502 1.00 0.00 H new ATOM 972 N LYS A 62 7.398 -5.556 1.416 1.00 0.00 N ATOM 973 CA LYS A 62 8.632 -4.804 1.688 1.00 0.00 C ATOM 974 C LYS A 62 9.829 -5.734 1.727 1.00 0.00 C ATOM 975 O LYS A 62 9.846 -6.699 2.490 1.00 0.00 O ATOM 976 CB LYS A 62 8.571 -4.070 3.029 1.00 0.00 C ATOM 977 CG LYS A 62 7.485 -3.019 3.133 1.00 0.00 C ATOM 978 CD LYS A 62 7.611 -2.226 4.421 1.00 0.00 C ATOM 979 CE LYS A 62 7.723 -3.147 5.622 1.00 0.00 C ATOM 980 NZ LYS A 62 8.007 -2.403 6.879 1.00 0.00 N ATOM 0 H LYS A 62 7.371 -6.484 1.839 1.00 0.00 H new ATOM 0 HA LYS A 62 8.733 -4.078 0.881 1.00 0.00 H new ATOM 0 HB2 LYS A 62 8.423 -4.804 3.822 1.00 0.00 H new ATOM 0 HB3 LYS A 62 9.535 -3.594 3.210 1.00 0.00 H new ATOM 0 HG2 LYS A 62 7.546 -2.344 2.280 1.00 0.00 H new ATOM 0 HG3 LYS A 62 6.507 -3.498 3.092 1.00 0.00 H new ATOM 0 HD2 LYS A 62 8.489 -1.581 4.370 1.00 0.00 H new ATOM 0 HD3 LYS A 62 6.744 -1.576 4.537 1.00 0.00 H new ATOM 0 HE2 LYS A 62 6.795 -3.707 5.736 1.00 0.00 H new ATOM 0 HE3 LYS A 62 8.515 -3.875 5.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 8.075 -3.073 7.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 8.906 -1.889 6.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 7.239 -1.726 7.063 1.00 0.00 H new ATOM 994 N GLU A 63 10.816 -5.438 0.899 1.00 0.00 N ATOM 995 CA GLU A 63 12.045 -6.229 0.832 1.00 0.00 C ATOM 996 C GLU A 63 13.019 -5.540 -0.104 1.00 0.00 C ATOM 997 O GLU A 63 12.591 -4.774 -0.944 1.00 0.00 O ATOM 998 CB GLU A 63 11.759 -7.664 0.370 1.00 0.00 C ATOM 999 CG GLU A 63 10.865 -7.766 -0.854 1.00 0.00 C ATOM 1000 CD GLU A 63 10.535 -9.201 -1.208 1.00 0.00 C ATOM 1001 OE1 GLU A 63 9.649 -9.790 -0.555 1.00 0.00 O ATOM 1002 OE2 GLU A 63 11.168 -9.753 -2.131 1.00 0.00 O ATOM 0 H GLU A 63 10.794 -4.648 0.255 1.00 0.00 H new ATOM 0 HA GLU A 63 12.483 -6.297 1.828 1.00 0.00 H new ATOM 0 HB2 GLU A 63 12.706 -8.158 0.154 1.00 0.00 H new ATOM 0 HB3 GLU A 63 11.294 -8.210 1.190 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.941 -7.217 -0.673 1.00 0.00 H new ATOM 0 HG3 GLU A 63 11.358 -7.289 -1.701 1.00 0.00 H new ATOM 1009 N ILE A 64 14.316 -5.773 0.037 1.00 0.00 N ATOM 1010 CA ILE A 64 15.262 -5.246 -0.927 1.00 0.00 C ATOM 1011 C ILE A 64 15.117 -5.971 -2.261 1.00 0.00 C ATOM 1012 O ILE A 64 15.207 -7.199 -2.322 1.00 0.00 O ATOM 1013 CB ILE A 64 16.709 -5.336 -0.428 1.00 0.00 C ATOM 1014 CG1 ILE A 64 16.786 -6.090 0.899 1.00 0.00 C ATOM 1015 CG2 ILE A 64 17.277 -3.942 -0.271 1.00 0.00 C ATOM 1016 CD1 ILE A 64 18.197 -6.381 1.358 1.00 0.00 C ATOM 0 H ILE A 64 14.729 -6.314 0.797 1.00 0.00 H new ATOM 0 HA ILE A 64 15.031 -4.189 -1.063 1.00 0.00 H new ATOM 0 HB ILE A 64 17.297 -5.888 -1.162 1.00 0.00 H new ATOM 0 HG12 ILE A 64 16.278 -5.507 1.667 1.00 0.00 H new ATOM 0 HG13 ILE A 64 16.244 -7.031 0.803 1.00 0.00 H new ATOM 0 HG21 ILE A 64 18.306 -4.006 0.084 1.00 0.00 H new ATOM 0 HG22 ILE A 64 17.256 -3.430 -1.233 1.00 0.00 H new ATOM 0 HG23 ILE A 64 16.679 -3.384 0.450 1.00 0.00 H new ATOM 0 HD11 ILE A 64 18.168 -6.918 2.306 1.00 0.00 H new ATOM 0 HD12 ILE A 64 18.704 -6.991 0.611 1.00 0.00 H new ATOM 0 HD13 ILE A 64 18.738 -5.444 1.488 1.00 0.00 H new ATOM 1028 N VAL A 65 14.921 -5.201 -3.328 1.00 0.00 N ATOM 1029 CA VAL A 65 14.505 -5.727 -4.630 1.00 0.00 C ATOM 1030 C VAL A 65 15.046 -4.830 -5.732 1.00 0.00 C ATOM 1031 O VAL A 65 15.930 -4.008 -5.489 1.00 0.00 O ATOM 1032 CB VAL A 65 12.966 -5.783 -4.825 1.00 0.00 C ATOM 1033 CG1 VAL A 65 12.254 -6.409 -3.641 1.00 0.00 C ATOM 1034 CG2 VAL A 65 12.424 -4.395 -5.143 1.00 0.00 C ATOM 0 H VAL A 65 15.046 -4.189 -3.316 1.00 0.00 H new ATOM 0 HA VAL A 65 14.896 -6.743 -4.673 1.00 0.00 H new ATOM 0 HB VAL A 65 12.763 -6.434 -5.675 1.00 0.00 H new ATOM 0 HG11 VAL A 65 11.180 -6.424 -3.828 1.00 0.00 H new ATOM 0 HG12 VAL A 65 12.612 -7.429 -3.499 1.00 0.00 H new ATOM 0 HG13 VAL A 65 12.458 -5.825 -2.744 1.00 0.00 H new ATOM 0 HG21 VAL A 65 11.344 -4.448 -5.277 1.00 0.00 H new ATOM 0 HG22 VAL A 65 12.654 -3.717 -4.321 1.00 0.00 H new ATOM 0 HG23 VAL A 65 12.886 -4.025 -6.058 1.00 0.00 H new ATOM 1044 N ASP A 66 14.514 -5.061 -6.935 1.00 0.00 N ATOM 1045 CA ASP A 66 14.669 -4.195 -8.102 1.00 0.00 C ATOM 1046 C ASP A 66 15.703 -4.748 -9.037 1.00 0.00 C ATOM 1047 O ASP A 66 16.199 -5.860 -8.835 1.00 0.00 O ATOM 1048 CB ASP A 66 14.940 -2.729 -7.740 1.00 0.00 C ATOM 1049 CG ASP A 66 13.781 -1.830 -8.133 1.00 0.00 C ATOM 1050 OD1 ASP A 66 12.615 -2.271 -8.029 1.00 0.00 O ATOM 1051 OD2 ASP A 66 14.027 -0.701 -8.598 1.00 0.00 O ATOM 0 H ASP A 66 13.944 -5.885 -7.128 1.00 0.00 H new ATOM 0 HA ASP A 66 13.710 -4.188 -8.620 1.00 0.00 H new ATOM 0 HB2 ASP A 66 15.118 -2.646 -6.668 1.00 0.00 H new ATOM 0 HB3 ASP A 66 15.848 -2.392 -8.241 1.00 0.00 H new ATOM 1056 N ALA A 67 16.017 -4.009 -10.074 1.00 0.00 N ATOM 1057 CA ALA A 67 16.742 -4.581 -11.175 1.00 0.00 C ATOM 1058 C ALA A 67 18.066 -3.838 -11.419 1.00 0.00 C ATOM 1059 O ALA A 67 18.381 -2.912 -10.684 1.00 0.00 O ATOM 1060 CB ALA A 67 15.851 -4.562 -12.415 1.00 0.00 C ATOM 0 H ALA A 67 15.784 -3.021 -10.176 1.00 0.00 H new ATOM 0 HA ALA A 67 17.004 -5.612 -10.939 1.00 0.00 H new ATOM 0 HB1 ALA A 67 16.391 -4.994 -13.258 1.00 0.00 H new ATOM 0 HB2 ALA A 67 14.950 -5.145 -12.224 1.00 0.00 H new ATOM 0 HB3 ALA A 67 15.575 -3.534 -12.649 1.00 0.00 H new ATOM 1066 N PRO A 68 18.870 -4.261 -12.426 1.00 0.00 N ATOM 1067 CA PRO A 68 20.104 -3.552 -12.848 1.00 0.00 C ATOM 1068 C PRO A 68 19.931 -2.057 -13.120 1.00 0.00 C ATOM 1069 O PRO A 68 18.857 -1.490 -12.954 1.00 0.00 O ATOM 1070 CB PRO A 68 20.467 -4.259 -14.149 1.00 0.00 C ATOM 1071 CG PRO A 68 19.967 -5.645 -13.968 1.00 0.00 C ATOM 1072 CD PRO A 68 18.690 -5.513 -13.192 1.00 0.00 C ATOM 0 HA PRO A 68 20.852 -3.590 -12.057 1.00 0.00 H new ATOM 0 HB2 PRO A 68 19.999 -3.777 -15.007 1.00 0.00 H new ATOM 0 HB3 PRO A 68 21.543 -4.244 -14.322 1.00 0.00 H new ATOM 0 HG2 PRO A 68 19.794 -6.128 -14.930 1.00 0.00 H new ATOM 0 HG3 PRO A 68 20.692 -6.256 -13.430 1.00 0.00 H new ATOM 0 HD2 PRO A 68 17.825 -5.457 -13.852 1.00 0.00 H new ATOM 0 HD3 PRO A 68 18.533 -6.366 -12.532 1.00 0.00 H new ATOM 1080 N LYS A 69 21.024 -1.448 -13.595 1.00 0.00 N ATOM 1081 CA LYS A 69 21.187 0.012 -13.660 1.00 0.00 C ATOM 1082 C LYS A 69 20.091 0.710 -14.457 1.00 0.00 C ATOM 1083 O LYS A 69 19.963 1.934 -14.392 1.00 0.00 O ATOM 1084 CB LYS A 69 22.552 0.381 -14.260 1.00 0.00 C ATOM 1085 CG LYS A 69 23.742 0.119 -13.342 1.00 0.00 C ATOM 1086 CD LYS A 69 23.976 -1.366 -13.135 1.00 0.00 C ATOM 1087 CE LYS A 69 25.161 -1.633 -12.219 1.00 0.00 C ATOM 1088 NZ LYS A 69 24.946 -1.081 -10.859 1.00 0.00 N ATOM 0 H LYS A 69 21.831 -1.961 -13.950 1.00 0.00 H new ATOM 0 HA LYS A 69 21.117 0.361 -12.630 1.00 0.00 H new ATOM 0 HB2 LYS A 69 22.692 -0.181 -15.183 1.00 0.00 H new ATOM 0 HB3 LYS A 69 22.543 1.437 -14.528 1.00 0.00 H new ATOM 0 HG2 LYS A 69 24.637 0.572 -13.768 1.00 0.00 H new ATOM 0 HG3 LYS A 69 23.570 0.598 -12.378 1.00 0.00 H new ATOM 0 HD2 LYS A 69 23.080 -1.819 -12.710 1.00 0.00 H new ATOM 0 HD3 LYS A 69 24.148 -1.844 -14.099 1.00 0.00 H new ATOM 0 HE2 LYS A 69 25.333 -2.707 -12.152 1.00 0.00 H new ATOM 0 HE3 LYS A 69 26.060 -1.193 -12.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 25.796 -1.239 -10.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 24.757 -0.060 -10.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 24.133 -1.556 -10.416 1.00 0.00 H new ATOM 1102 N ASN A 70 19.306 -0.058 -15.199 1.00 0.00 N ATOM 1103 CA ASN A 70 18.208 0.489 -15.994 1.00 0.00 C ATOM 1104 C ASN A 70 17.003 0.856 -15.107 1.00 0.00 C ATOM 1105 O ASN A 70 15.850 0.738 -15.522 1.00 0.00 O ATOM 1106 CB ASN A 70 17.793 -0.509 -17.078 1.00 0.00 C ATOM 1107 CG ASN A 70 17.158 0.162 -18.286 1.00 0.00 C ATOM 1108 OD1 ASN A 70 17.855 0.578 -19.213 1.00 0.00 O ATOM 1109 ND2 ASN A 70 15.839 0.260 -18.294 1.00 0.00 N ATOM 0 H ASN A 70 19.408 -1.070 -15.269 1.00 0.00 H new ATOM 0 HA ASN A 70 18.559 1.404 -16.472 1.00 0.00 H new ATOM 0 HB2 ASN A 70 18.668 -1.073 -17.400 1.00 0.00 H new ATOM 0 HB3 ASN A 70 17.089 -1.226 -16.655 1.00 0.00 H new ATOM 0 HD21 ASN A 70 15.365 0.692 -19.087 1.00 0.00 H new ATOM 0 HD22 ASN A 70 15.296 -0.097 -17.507 1.00 0.00 H new ATOM 1116 N ARG A 71 17.283 1.279 -13.878 1.00 0.00 N ATOM 1117 CA ARG A 71 16.235 1.667 -12.934 1.00 0.00 C ATOM 1118 C ARG A 71 15.823 3.120 -13.159 1.00 0.00 C ATOM 1119 O ARG A 71 16.507 3.851 -13.877 1.00 0.00 O ATOM 1120 CB ARG A 71 16.716 1.498 -11.489 1.00 0.00 C ATOM 1121 CG ARG A 71 17.133 0.088 -11.144 1.00 0.00 C ATOM 1122 CD ARG A 71 16.154 -0.924 -11.702 1.00 0.00 C ATOM 1123 NE ARG A 71 14.848 -0.847 -11.064 1.00 0.00 N ATOM 1124 CZ ARG A 71 13.702 -1.124 -11.678 1.00 0.00 C ATOM 1125 NH1 ARG A 71 13.683 -1.389 -12.978 1.00 0.00 N ATOM 1126 NH2 ARG A 71 12.569 -1.121 -10.991 1.00 0.00 N ATOM 0 H ARG A 71 18.230 1.363 -13.509 1.00 0.00 H new ATOM 0 HA ARG A 71 15.377 1.017 -13.104 1.00 0.00 H new ATOM 0 HB2 ARG A 71 17.558 2.168 -11.316 1.00 0.00 H new ATOM 0 HB3 ARG A 71 15.919 1.807 -10.813 1.00 0.00 H new ATOM 0 HG2 ARG A 71 18.129 -0.107 -11.542 1.00 0.00 H new ATOM 0 HG3 ARG A 71 17.196 -0.021 -10.061 1.00 0.00 H new ATOM 0 HD2 ARG A 71 16.041 -0.763 -12.774 1.00 0.00 H new ATOM 0 HD3 ARG A 71 16.560 -1.927 -11.572 1.00 0.00 H new ATOM 0 HE ARG A 71 14.810 -0.563 -10.085 1.00 0.00 H new ATOM 0 HH11 ARG A 71 14.551 -1.381 -13.513 1.00 0.00 H new ATOM 0 HH12 ARG A 71 12.800 -1.601 -13.442 1.00 0.00 H new ATOM 0 HH21 ARG A 71 12.578 -0.907 -9.994 1.00 0.00 H new ATOM 0 HH22 ARG A 71 11.688 -1.333 -11.459 1.00 0.00 H new ATOM 1140 N PRO A 72 14.699 3.564 -12.564 1.00 0.00 N ATOM 1141 CA PRO A 72 14.286 4.967 -12.630 1.00 0.00 C ATOM 1142 C PRO A 72 15.287 5.870 -11.919 1.00 0.00 C ATOM 1143 O PRO A 72 16.099 5.412 -11.118 1.00 0.00 O ATOM 1144 CB PRO A 72 12.941 4.988 -11.895 1.00 0.00 C ATOM 1145 CG PRO A 72 12.485 3.571 -11.885 1.00 0.00 C ATOM 1146 CD PRO A 72 13.736 2.756 -11.790 1.00 0.00 C ATOM 0 HA PRO A 72 14.222 5.331 -13.655 1.00 0.00 H new ATOM 0 HB2 PRO A 72 13.051 5.374 -10.882 1.00 0.00 H new ATOM 0 HB3 PRO A 72 12.223 5.630 -12.405 1.00 0.00 H new ATOM 0 HG2 PRO A 72 11.823 3.376 -11.041 1.00 0.00 H new ATOM 0 HG3 PRO A 72 11.927 3.331 -12.790 1.00 0.00 H new ATOM 0 HD2 PRO A 72 14.056 2.622 -10.757 1.00 0.00 H new ATOM 0 HD3 PRO A 72 13.606 1.761 -12.215 1.00 0.00 H new ATOM 1154 N ALA A 73 15.215 7.158 -12.210 1.00 0.00 N ATOM 1155 CA ALA A 73 16.163 8.120 -11.665 1.00 0.00 C ATOM 1156 C ALA A 73 15.976 8.324 -10.169 1.00 0.00 C ATOM 1157 O ALA A 73 16.825 8.921 -9.512 1.00 0.00 O ATOM 1158 CB ALA A 73 16.021 9.446 -12.382 1.00 0.00 C ATOM 0 H ALA A 73 14.508 7.564 -12.823 1.00 0.00 H new ATOM 0 HA ALA A 73 17.164 7.717 -11.821 1.00 0.00 H new ATOM 0 HB1 ALA A 73 16.733 10.161 -11.969 1.00 0.00 H new ATOM 0 HB2 ALA A 73 16.220 9.308 -13.445 1.00 0.00 H new ATOM 0 HB3 ALA A 73 15.008 9.825 -12.249 1.00 0.00 H new ATOM 1164 N TRP A 74 14.863 7.843 -9.629 1.00 0.00 N ATOM 1165 CA TRP A 74 14.582 8.041 -8.217 1.00 0.00 C ATOM 1166 C TRP A 74 14.829 6.776 -7.406 1.00 0.00 C ATOM 1167 O TRP A 74 15.313 6.845 -6.275 1.00 0.00 O ATOM 1168 CB TRP A 74 13.130 8.509 -8.033 1.00 0.00 C ATOM 1169 CG TRP A 74 12.115 7.641 -8.726 1.00 0.00 C ATOM 1170 CD1 TRP A 74 11.694 7.751 -10.021 1.00 0.00 C ATOM 1171 CD2 TRP A 74 11.391 6.534 -8.166 1.00 0.00 C ATOM 1172 NE1 TRP A 74 10.765 6.783 -10.300 1.00 0.00 N ATOM 1173 CE2 TRP A 74 10.560 6.026 -9.183 1.00 0.00 C ATOM 1174 CE3 TRP A 74 11.360 5.919 -6.911 1.00 0.00 C ATOM 1175 CZ2 TRP A 74 9.717 4.942 -8.989 1.00 0.00 C ATOM 1176 CZ3 TRP A 74 10.517 4.837 -6.721 1.00 0.00 C ATOM 1177 CH2 TRP A 74 9.707 4.360 -7.756 1.00 0.00 C ATOM 0 H TRP A 74 14.151 7.321 -10.140 1.00 0.00 H new ATOM 0 HA TRP A 74 15.264 8.807 -7.848 1.00 0.00 H new ATOM 0 HB2 TRP A 74 12.901 8.539 -6.968 1.00 0.00 H new ATOM 0 HB3 TRP A 74 13.037 9.528 -8.407 1.00 0.00 H new ATOM 0 HD1 TRP A 74 12.043 8.494 -10.723 1.00 0.00 H new ATOM 0 HE1 TRP A 74 10.301 6.650 -11.199 1.00 0.00 H new ATOM 0 HE3 TRP A 74 11.981 6.281 -6.105 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 9.090 4.572 -9.787 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 10.485 4.353 -5.756 1.00 0.00 H new ATOM 0 HH2 TRP A 74 9.061 3.514 -7.575 1.00 0.00 H new ATOM 1188 N MET A 75 14.503 5.619 -7.968 1.00 0.00 N ATOM 1189 CA MET A 75 14.705 4.363 -7.265 1.00 0.00 C ATOM 1190 C MET A 75 15.910 3.625 -7.820 1.00 0.00 C ATOM 1191 O MET A 75 16.089 3.551 -9.030 1.00 0.00 O ATOM 1192 CB MET A 75 13.457 3.492 -7.384 1.00 0.00 C ATOM 1193 CG MET A 75 13.346 2.446 -6.292 1.00 0.00 C ATOM 1194 SD MET A 75 11.715 1.685 -6.213 1.00 0.00 S ATOM 1195 CE MET A 75 11.518 1.148 -7.907 1.00 0.00 C ATOM 0 H MET A 75 14.101 5.526 -8.901 1.00 0.00 H new ATOM 0 HA MET A 75 14.890 4.581 -6.213 1.00 0.00 H new ATOM 0 HB2 MET A 75 12.574 4.130 -7.357 1.00 0.00 H new ATOM 0 HB3 MET A 75 13.461 2.995 -8.354 1.00 0.00 H new ATOM 0 HG2 MET A 75 14.095 1.672 -6.460 1.00 0.00 H new ATOM 0 HG3 MET A 75 13.574 2.906 -5.331 1.00 0.00 H new ATOM 0 HE1 MET A 75 11.113 0.136 -7.923 1.00 0.00 H new ATOM 0 HE2 MET A 75 10.835 1.821 -8.425 1.00 0.00 H new ATOM 0 HE3 MET A 75 12.486 1.159 -8.407 1.00 0.00 H new ATOM 1205 N PRO A 76 16.752 3.068 -6.948 1.00 0.00 N ATOM 1206 CA PRO A 76 17.909 2.318 -7.356 1.00 0.00 C ATOM 1207 C PRO A 76 17.640 0.825 -7.481 1.00 0.00 C ATOM 1208 O PRO A 76 16.504 0.366 -7.488 1.00 0.00 O ATOM 1209 CB PRO A 76 18.898 2.570 -6.231 1.00 0.00 C ATOM 1210 CG PRO A 76 18.084 2.916 -5.040 1.00 0.00 C ATOM 1211 CD PRO A 76 16.659 3.124 -5.494 1.00 0.00 C ATOM 0 HA PRO A 76 18.255 2.625 -8.343 1.00 0.00 H new ATOM 0 HB2 PRO A 76 19.508 1.687 -6.043 1.00 0.00 H new ATOM 0 HB3 PRO A 76 19.581 3.381 -6.486 1.00 0.00 H new ATOM 0 HG2 PRO A 76 18.135 2.119 -4.299 1.00 0.00 H new ATOM 0 HG3 PRO A 76 18.468 3.819 -4.565 1.00 0.00 H new ATOM 0 HD2 PRO A 76 15.997 2.351 -5.104 1.00 0.00 H new ATOM 0 HD3 PRO A 76 16.265 4.082 -5.154 1.00 0.00 H new ATOM 1219 N GLU A 77 18.732 0.098 -7.537 1.00 0.00 N ATOM 1220 CA GLU A 77 18.748 -1.315 -7.899 1.00 0.00 C ATOM 1221 C GLU A 77 18.499 -2.217 -6.717 1.00 0.00 C ATOM 1222 O GLU A 77 18.446 -3.438 -6.863 1.00 0.00 O ATOM 1223 CB GLU A 77 20.108 -1.641 -8.474 1.00 0.00 C ATOM 1224 CG GLU A 77 20.500 -0.717 -9.602 1.00 0.00 C ATOM 1225 CD GLU A 77 21.968 -0.806 -9.930 1.00 0.00 C ATOM 1226 OE1 GLU A 77 22.410 -1.852 -10.443 1.00 0.00 O ATOM 1227 OE2 GLU A 77 22.694 0.170 -9.668 1.00 0.00 O ATOM 0 H GLU A 77 19.657 0.473 -7.329 1.00 0.00 H new ATOM 0 HA GLU A 77 17.948 -1.486 -8.620 1.00 0.00 H new ATOM 0 HB2 GLU A 77 20.856 -1.581 -7.684 1.00 0.00 H new ATOM 0 HB3 GLU A 77 20.108 -2.669 -8.835 1.00 0.00 H new ATOM 0 HG2 GLU A 77 19.916 -0.962 -10.489 1.00 0.00 H new ATOM 0 HG3 GLU A 77 20.252 0.309 -9.331 1.00 0.00 H new ATOM 1234 N LYS A 78 18.350 -1.616 -5.557 1.00 0.00 N ATOM 1235 CA LYS A 78 18.178 -2.334 -4.308 1.00 0.00 C ATOM 1236 C LYS A 78 17.452 -1.395 -3.368 1.00 0.00 C ATOM 1237 O LYS A 78 17.972 -0.318 -3.070 1.00 0.00 O ATOM 1238 CB LYS A 78 19.529 -2.711 -3.670 1.00 0.00 C ATOM 1239 CG LYS A 78 20.397 -3.646 -4.496 1.00 0.00 C ATOM 1240 CD LYS A 78 19.791 -5.036 -4.599 1.00 0.00 C ATOM 1241 CE LYS A 78 20.743 -6.011 -5.276 1.00 0.00 C ATOM 1242 NZ LYS A 78 20.078 -7.303 -5.597 1.00 0.00 N ATOM 0 H LYS A 78 18.344 -0.602 -5.451 1.00 0.00 H new ATOM 0 HA LYS A 78 17.630 -3.258 -4.493 1.00 0.00 H new ATOM 0 HB2 LYS A 78 20.089 -1.796 -3.478 1.00 0.00 H new ATOM 0 HB3 LYS A 78 19.338 -3.177 -2.703 1.00 0.00 H new ATOM 0 HG2 LYS A 78 20.528 -3.232 -5.496 1.00 0.00 H new ATOM 0 HG3 LYS A 78 21.388 -3.714 -4.047 1.00 0.00 H new ATOM 0 HD2 LYS A 78 19.543 -5.401 -3.602 1.00 0.00 H new ATOM 0 HD3 LYS A 78 18.859 -4.987 -5.161 1.00 0.00 H new ATOM 0 HE2 LYS A 78 21.130 -5.564 -6.192 1.00 0.00 H new ATOM 0 HE3 LYS A 78 21.598 -6.195 -4.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 20.760 -7.939 -6.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 19.731 -7.742 -4.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 19.277 -7.131 -6.238 1.00 0.00 H new ATOM 1256 N ILE A 79 16.270 -1.759 -2.899 1.00 0.00 N ATOM 1257 CA ILE A 79 15.547 -0.924 -1.957 1.00 0.00 C ATOM 1258 C ILE A 79 14.583 -1.770 -1.143 1.00 0.00 C ATOM 1259 O ILE A 79 14.031 -2.735 -1.641 1.00 0.00 O ATOM 1260 CB ILE A 79 14.753 0.221 -2.635 1.00 0.00 C ATOM 1261 CG1 ILE A 79 14.407 -0.110 -4.093 1.00 0.00 C ATOM 1262 CG2 ILE A 79 15.529 1.525 -2.562 1.00 0.00 C ATOM 1263 CD1 ILE A 79 13.555 -1.344 -4.258 1.00 0.00 C ATOM 0 H ILE A 79 15.793 -2.624 -3.154 1.00 0.00 H new ATOM 0 HA ILE A 79 16.302 -0.467 -1.317 1.00 0.00 H new ATOM 0 HB ILE A 79 13.816 0.334 -2.090 1.00 0.00 H new ATOM 0 HG12 ILE A 79 13.886 0.740 -4.534 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.332 -0.242 -4.654 1.00 0.00 H new ATOM 0 HG21 ILE A 79 14.955 2.317 -3.043 1.00 0.00 H new ATOM 0 HG22 ILE A 79 15.704 1.786 -1.518 1.00 0.00 H new ATOM 0 HG23 ILE A 79 16.485 1.408 -3.072 1.00 0.00 H new ATOM 0 HD11 ILE A 79 13.355 -1.509 -5.317 1.00 0.00 H new ATOM 0 HD12 ILE A 79 14.081 -2.207 -3.849 1.00 0.00 H new ATOM 0 HD13 ILE A 79 12.613 -1.209 -3.727 1.00 0.00 H new ATOM 1275 N SER A 80 14.425 -1.406 0.107 1.00 0.00 N ATOM 1276 CA SER A 80 13.450 -2.067 0.950 1.00 0.00 C ATOM 1277 C SER A 80 12.416 -1.087 1.486 1.00 0.00 C ATOM 1278 O SER A 80 12.494 -0.610 2.621 1.00 0.00 O ATOM 1279 CB SER A 80 14.179 -2.766 2.087 1.00 0.00 C ATOM 1280 OG SER A 80 14.953 -1.851 2.852 1.00 0.00 O ATOM 0 H SER A 80 14.953 -0.662 0.563 1.00 0.00 H new ATOM 0 HA SER A 80 12.907 -2.802 0.356 1.00 0.00 H new ATOM 0 HB2 SER A 80 13.455 -3.261 2.734 1.00 0.00 H new ATOM 0 HB3 SER A 80 14.828 -3.542 1.681 1.00 0.00 H new ATOM 0 HG SER A 80 14.409 -1.065 3.070 1.00 0.00 H new ATOM 1286 N LYS A 81 11.435 -0.791 0.646 1.00 0.00 N ATOM 1287 CA LYS A 81 10.338 0.075 1.079 1.00 0.00 C ATOM 1288 C LYS A 81 8.976 -0.581 0.886 1.00 0.00 C ATOM 1289 O LYS A 81 8.888 -1.648 0.287 1.00 0.00 O ATOM 1290 CB LYS A 81 10.490 1.399 0.301 1.00 0.00 C ATOM 1291 CG LYS A 81 9.854 1.456 -1.063 1.00 0.00 C ATOM 1292 CD LYS A 81 8.451 1.968 -0.972 1.00 0.00 C ATOM 1293 CE LYS A 81 7.857 2.193 -2.353 1.00 0.00 C ATOM 1294 NZ LYS A 81 8.394 3.425 -2.988 1.00 0.00 N ATOM 0 H LYS A 81 11.371 -1.125 -0.316 1.00 0.00 H new ATOM 0 HA LYS A 81 10.391 0.265 2.151 1.00 0.00 H new ATOM 0 HB2 LYS A 81 10.069 2.201 0.907 1.00 0.00 H new ATOM 0 HB3 LYS A 81 11.554 1.609 0.190 1.00 0.00 H new ATOM 0 HG2 LYS A 81 10.440 2.102 -1.716 1.00 0.00 H new ATOM 0 HG3 LYS A 81 9.855 0.463 -1.512 1.00 0.00 H new ATOM 0 HD2 LYS A 81 7.837 1.256 -0.421 1.00 0.00 H new ATOM 0 HD3 LYS A 81 8.438 2.902 -0.411 1.00 0.00 H new ATOM 0 HE2 LYS A 81 8.073 1.333 -2.987 1.00 0.00 H new ATOM 0 HE3 LYS A 81 6.772 2.267 -2.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 7.870 3.620 -3.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 8.287 4.227 -2.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 9.401 3.291 -3.209 1.00 0.00 H new ATOM 1308 N PRO A 82 7.903 0.011 1.466 1.00 0.00 N ATOM 1309 CA PRO A 82 6.529 -0.457 1.245 1.00 0.00 C ATOM 1310 C PRO A 82 6.162 -0.457 -0.226 1.00 0.00 C ATOM 1311 O PRO A 82 5.735 0.552 -0.778 1.00 0.00 O ATOM 1312 CB PRO A 82 5.670 0.557 2.007 1.00 0.00 C ATOM 1313 CG PRO A 82 6.580 1.135 3.032 1.00 0.00 C ATOM 1314 CD PRO A 82 7.949 1.146 2.408 1.00 0.00 C ATOM 0 HA PRO A 82 6.390 -1.484 1.583 1.00 0.00 H new ATOM 0 HB2 PRO A 82 5.285 1.329 1.340 1.00 0.00 H new ATOM 0 HB3 PRO A 82 4.808 0.076 2.470 1.00 0.00 H new ATOM 0 HG2 PRO A 82 6.268 2.142 3.308 1.00 0.00 H new ATOM 0 HG3 PRO A 82 6.571 0.538 3.944 1.00 0.00 H new ATOM 0 HD2 PRO A 82 8.149 2.087 1.895 1.00 0.00 H new ATOM 0 HD3 PRO A 82 8.732 1.017 3.155 1.00 0.00 H new ATOM 1322 N PHE A 83 6.331 -1.597 -0.855 1.00 0.00 N ATOM 1323 CA PHE A 83 5.978 -1.758 -2.239 1.00 0.00 C ATOM 1324 C PHE A 83 4.520 -2.135 -2.319 1.00 0.00 C ATOM 1325 O PHE A 83 3.882 -2.390 -1.299 1.00 0.00 O ATOM 1326 CB PHE A 83 6.843 -2.825 -2.904 1.00 0.00 C ATOM 1327 CG PHE A 83 8.320 -2.660 -2.675 1.00 0.00 C ATOM 1328 CD1 PHE A 83 8.943 -1.411 -2.684 1.00 0.00 C ATOM 1329 CD2 PHE A 83 9.097 -3.778 -2.456 1.00 0.00 C ATOM 1330 CE1 PHE A 83 10.302 -1.304 -2.477 1.00 0.00 C ATOM 1331 CE2 PHE A 83 10.446 -3.669 -2.256 1.00 0.00 C ATOM 1332 CZ PHE A 83 11.052 -2.434 -2.266 1.00 0.00 C ATOM 0 H PHE A 83 6.716 -2.435 -0.419 1.00 0.00 H new ATOM 0 HA PHE A 83 6.151 -0.822 -2.769 1.00 0.00 H new ATOM 0 HB2 PHE A 83 6.538 -3.804 -2.535 1.00 0.00 H new ATOM 0 HB3 PHE A 83 6.651 -2.814 -3.977 1.00 0.00 H new ATOM 0 HD1 PHE A 83 8.356 -0.521 -2.855 1.00 0.00 H new ATOM 0 HD2 PHE A 83 8.634 -4.754 -2.442 1.00 0.00 H new ATOM 0 HE1 PHE A 83 10.775 -0.333 -2.481 1.00 0.00 H new ATOM 0 HE2 PHE A 83 11.038 -4.557 -2.089 1.00 0.00 H new ATOM 0 HZ PHE A 83 12.117 -2.354 -2.108 1.00 0.00 H new ATOM 1342 N VAL A 84 4.016 -2.232 -3.527 1.00 0.00 N ATOM 1343 CA VAL A 84 2.581 -2.306 -3.763 1.00 0.00 C ATOM 1344 C VAL A 84 2.398 -2.753 -5.207 1.00 0.00 C ATOM 1345 O VAL A 84 3.378 -2.836 -5.951 1.00 0.00 O ATOM 1346 CB VAL A 84 1.808 -0.956 -3.535 1.00 0.00 C ATOM 1347 CG1 VAL A 84 0.381 -1.205 -3.111 1.00 0.00 C ATOM 1348 CG2 VAL A 84 2.459 -0.056 -2.502 1.00 0.00 C ATOM 0 H VAL A 84 4.581 -2.262 -4.376 1.00 0.00 H new ATOM 0 HA VAL A 84 2.159 -3.002 -3.038 1.00 0.00 H new ATOM 0 HB VAL A 84 1.837 -0.448 -4.499 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.126 -0.252 -2.962 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.135 -1.773 -3.885 1.00 0.00 H new ATOM 0 HG13 VAL A 84 0.372 -1.771 -2.179 1.00 0.00 H new ATOM 0 HG21 VAL A 84 1.874 0.857 -2.395 1.00 0.00 H new ATOM 0 HG22 VAL A 84 2.502 -0.574 -1.544 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.469 0.196 -2.824 1.00 0.00 H new ATOM 1358 N LYS A 85 1.168 -3.016 -5.604 1.00 0.00 N ATOM 1359 CA LYS A 85 0.864 -3.430 -6.971 1.00 0.00 C ATOM 1360 C LYS A 85 -0.638 -3.581 -7.166 1.00 0.00 C ATOM 1361 O LYS A 85 -1.232 -4.588 -6.779 1.00 0.00 O ATOM 1362 CB LYS A 85 1.573 -4.762 -7.288 1.00 0.00 C ATOM 1363 CG LYS A 85 0.994 -5.538 -8.469 1.00 0.00 C ATOM 1364 CD LYS A 85 1.206 -4.826 -9.795 1.00 0.00 C ATOM 1365 CE LYS A 85 0.388 -5.474 -10.906 1.00 0.00 C ATOM 1366 NZ LYS A 85 0.653 -6.929 -11.032 1.00 0.00 N ATOM 0 H LYS A 85 0.351 -2.951 -4.996 1.00 0.00 H new ATOM 0 HA LYS A 85 1.225 -2.660 -7.653 1.00 0.00 H new ATOM 0 HB2 LYS A 85 2.625 -4.557 -7.488 1.00 0.00 H new ATOM 0 HB3 LYS A 85 1.534 -5.396 -6.402 1.00 0.00 H new ATOM 0 HG2 LYS A 85 1.456 -6.525 -8.512 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -0.073 -5.692 -8.310 1.00 0.00 H new ATOM 0 HD2 LYS A 85 0.924 -3.778 -9.697 1.00 0.00 H new ATOM 0 HD3 LYS A 85 2.264 -4.849 -10.058 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -0.673 -5.317 -10.711 1.00 0.00 H new ATOM 0 HE3 LYS A 85 0.614 -4.983 -11.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 0.569 -7.212 -12.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 1.614 -7.138 -10.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -0.038 -7.458 -10.462 1.00 0.00 H new ATOM 1380 N LYS A 86 -1.256 -2.561 -7.746 1.00 0.00 N ATOM 1381 CA LYS A 86 -2.628 -2.678 -8.198 1.00 0.00 C ATOM 1382 C LYS A 86 -2.790 -3.821 -9.188 1.00 0.00 C ATOM 1383 O LYS A 86 -2.020 -3.952 -10.137 1.00 0.00 O ATOM 1384 CB LYS A 86 -3.111 -1.373 -8.836 1.00 0.00 C ATOM 1385 CG LYS A 86 -4.535 -1.470 -9.359 1.00 0.00 C ATOM 1386 CD LYS A 86 -4.982 -0.204 -10.067 1.00 0.00 C ATOM 1387 CE LYS A 86 -5.505 0.844 -9.099 1.00 0.00 C ATOM 1388 NZ LYS A 86 -5.906 2.089 -9.805 1.00 0.00 N ATOM 0 H LYS A 86 -0.829 -1.650 -7.912 1.00 0.00 H new ATOM 0 HA LYS A 86 -3.238 -2.889 -7.320 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -3.052 -0.570 -8.101 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -2.444 -1.105 -9.656 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -4.609 -2.312 -10.047 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -5.210 -1.676 -8.529 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -4.145 0.210 -10.630 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -5.761 -0.450 -10.789 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -6.359 0.443 -8.554 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -4.736 1.075 -8.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -6.258 2.782 -9.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -5.084 2.485 -10.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -6.657 1.872 -10.491 1.00 0.00 H new ATOM 1402 N GLU A 87 -3.833 -4.598 -8.965 1.00 0.00 N ATOM 1403 CA GLU A 87 -4.180 -5.683 -9.878 1.00 0.00 C ATOM 1404 C GLU A 87 -5.570 -6.240 -9.606 1.00 0.00 C ATOM 1405 O GLU A 87 -5.876 -7.379 -9.960 1.00 0.00 O ATOM 1406 CB GLU A 87 -3.112 -6.783 -9.881 1.00 0.00 C ATOM 1407 CG GLU A 87 -2.851 -7.414 -8.540 1.00 0.00 C ATOM 1408 CD GLU A 87 -1.834 -8.536 -8.624 1.00 0.00 C ATOM 1409 OE1 GLU A 87 -0.680 -8.276 -9.040 1.00 0.00 O ATOM 1410 OE2 GLU A 87 -2.173 -9.683 -8.271 1.00 0.00 O ATOM 0 H GLU A 87 -4.456 -4.503 -8.163 1.00 0.00 H new ATOM 0 HA GLU A 87 -4.206 -5.258 -10.881 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -3.415 -7.562 -10.580 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -2.179 -6.363 -10.257 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -2.494 -6.653 -7.846 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -3.785 -7.802 -8.135 1.00 0.00 H new ATOM 1417 N ARG A 88 -6.416 -5.418 -8.991 1.00 0.00 N ATOM 1418 CA ARG A 88 -7.817 -5.744 -8.817 1.00 0.00 C ATOM 1419 C ARG A 88 -8.534 -4.496 -8.356 1.00 0.00 C ATOM 1420 O ARG A 88 -7.910 -3.579 -7.810 1.00 0.00 O ATOM 1421 CB ARG A 88 -7.992 -6.883 -7.803 1.00 0.00 C ATOM 1422 CG ARG A 88 -9.227 -7.737 -8.042 1.00 0.00 C ATOM 1423 CD ARG A 88 -9.240 -8.965 -7.143 1.00 0.00 C ATOM 1424 NE ARG A 88 -9.551 -8.646 -5.751 1.00 0.00 N ATOM 1425 CZ ARG A 88 -9.062 -9.318 -4.704 1.00 0.00 C ATOM 1426 NH1 ARG A 88 -8.173 -10.287 -4.890 1.00 0.00 N ATOM 1427 NH2 ARG A 88 -9.465 -9.017 -3.472 1.00 0.00 N ATOM 0 H ARG A 88 -6.146 -4.514 -8.603 1.00 0.00 H new ATOM 0 HA ARG A 88 -8.240 -6.089 -9.761 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -7.109 -7.522 -7.833 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -8.044 -6.459 -6.800 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -10.122 -7.142 -7.860 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -9.258 -8.049 -9.086 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -9.974 -9.678 -7.520 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -8.267 -9.454 -7.190 1.00 0.00 H new ATOM 0 HE ARG A 88 -10.179 -7.863 -5.567 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -7.862 -10.520 -5.833 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -7.801 -10.798 -4.090 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -10.147 -8.273 -3.326 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -9.091 -9.530 -2.674 1.00 0.00 H new ATOM 1441 N ILE A 89 -9.827 -4.449 -8.587 1.00 0.00 N ATOM 1442 CA ILE A 89 -10.613 -3.279 -8.259 1.00 0.00 C ATOM 1443 C ILE A 89 -11.969 -3.687 -7.693 1.00 0.00 C ATOM 1444 O ILE A 89 -12.615 -4.608 -8.196 1.00 0.00 O ATOM 1445 CB ILE A 89 -10.801 -2.371 -9.496 1.00 0.00 C ATOM 1446 CG1 ILE A 89 -9.490 -1.667 -9.859 1.00 0.00 C ATOM 1447 CG2 ILE A 89 -11.888 -1.338 -9.247 1.00 0.00 C ATOM 1448 CD1 ILE A 89 -8.978 -0.739 -8.776 1.00 0.00 C ATOM 0 H ILE A 89 -10.360 -5.212 -9.003 1.00 0.00 H new ATOM 0 HA ILE A 89 -10.072 -2.714 -7.500 1.00 0.00 H new ATOM 0 HB ILE A 89 -11.102 -3.004 -10.330 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -8.730 -2.419 -10.070 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -9.636 -1.096 -10.776 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -12.003 -0.710 -10.131 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -12.830 -1.845 -9.037 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -11.612 -0.717 -8.395 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -8.047 -0.276 -9.104 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -9.719 0.036 -8.580 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -8.799 -1.308 -7.864 1.00 0.00 H new ATOM 1460 N GLU A 90 -12.373 -3.012 -6.635 1.00 0.00 N ATOM 1461 CA GLU A 90 -13.625 -3.283 -5.982 1.00 0.00 C ATOM 1462 C GLU A 90 -14.540 -2.066 -6.005 1.00 0.00 C ATOM 1463 O GLU A 90 -14.110 -0.944 -6.293 1.00 0.00 O ATOM 1464 CB GLU A 90 -13.342 -3.686 -4.557 1.00 0.00 C ATOM 1465 CG GLU A 90 -13.970 -4.994 -4.185 1.00 0.00 C ATOM 1466 CD GLU A 90 -15.452 -4.875 -3.919 1.00 0.00 C ATOM 1467 OE1 GLU A 90 -16.241 -4.954 -4.883 1.00 0.00 O ATOM 1468 OE2 GLU A 90 -15.832 -4.689 -2.745 1.00 0.00 O ATOM 0 H GLU A 90 -11.835 -2.258 -6.207 1.00 0.00 H new ATOM 0 HA GLU A 90 -14.135 -4.087 -6.513 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -12.264 -3.752 -4.411 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -13.708 -2.909 -3.886 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -13.806 -5.712 -4.988 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -13.476 -5.390 -3.297 1.00 0.00 H new ATOM 1475 N LYS A 91 -15.801 -2.302 -5.688 1.00 0.00 N ATOM 1476 CA LYS A 91 -16.788 -1.246 -5.594 1.00 0.00 C ATOM 1477 C LYS A 91 -16.931 -0.774 -4.176 1.00 0.00 C ATOM 1478 O LYS A 91 -16.421 -1.388 -3.242 1.00 0.00 O ATOM 1479 CB LYS A 91 -18.151 -1.681 -6.112 1.00 0.00 C ATOM 1480 CG LYS A 91 -18.602 -3.048 -5.626 1.00 0.00 C ATOM 1481 CD LYS A 91 -20.023 -3.362 -6.077 1.00 0.00 C ATOM 1482 CE LYS A 91 -20.153 -3.353 -7.594 1.00 0.00 C ATOM 1483 NZ LYS A 91 -21.544 -3.636 -8.033 1.00 0.00 N ATOM 0 H LYS A 91 -16.168 -3.233 -5.489 1.00 0.00 H new ATOM 0 HA LYS A 91 -16.428 -0.431 -6.221 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -18.893 -0.940 -5.813 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -18.127 -1.686 -7.202 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -17.922 -3.812 -6.004 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -18.548 -3.084 -4.538 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -20.318 -4.339 -5.693 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -20.709 -2.631 -5.650 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -19.841 -2.382 -7.979 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -19.479 -4.096 -8.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -21.590 -3.621 -9.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -21.833 -4.573 -7.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -22.184 -2.912 -7.648 1.00 0.00 H new ATOM 1497 N LEU A 92 -17.651 0.312 -4.036 1.00 0.00 N ATOM 1498 CA LEU A 92 -17.818 0.953 -2.755 1.00 0.00 C ATOM 1499 C LEU A 92 -18.742 0.106 -1.898 1.00 0.00 C ATOM 1500 O LEU A 92 -19.539 -0.677 -2.421 1.00 0.00 O ATOM 1501 CB LEU A 92 -18.400 2.352 -2.934 1.00 0.00 C ATOM 1502 CG LEU A 92 -18.128 3.317 -1.786 1.00 0.00 C ATOM 1503 CD1 LEU A 92 -16.631 3.509 -1.617 1.00 0.00 C ATOM 1504 CD2 LEU A 92 -18.813 4.650 -2.039 1.00 0.00 C ATOM 0 H LEU A 92 -18.136 0.775 -4.804 1.00 0.00 H new ATOM 0 HA LEU A 92 -16.849 1.048 -2.266 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -17.998 2.781 -3.852 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -19.478 2.266 -3.068 1.00 0.00 H new ATOM 0 HG LEU A 92 -18.534 2.896 -0.866 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -16.443 4.200 -0.795 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -16.163 2.549 -1.398 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -16.210 3.916 -2.536 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -18.609 5.327 -1.210 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -18.434 5.084 -2.964 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -19.889 4.496 -2.125 1.00 0.00 H new ATOM 1516 N GLU A 93 -18.653 0.271 -0.595 1.00 0.00 N ATOM 1517 CA GLU A 93 -19.402 -0.560 0.328 1.00 0.00 C ATOM 1518 C GLU A 93 -20.617 0.205 0.834 1.00 0.00 C ATOM 1519 O GLU A 93 -21.690 0.088 0.213 1.00 0.00 O ATOM 1520 CB GLU A 93 -18.500 -0.997 1.489 1.00 0.00 C ATOM 1521 CG GLU A 93 -19.140 -2.010 2.425 1.00 0.00 C ATOM 1522 CD GLU A 93 -18.166 -2.535 3.460 1.00 0.00 C ATOM 1523 OE1 GLU A 93 -17.956 -1.856 4.488 1.00 0.00 O ATOM 1524 OE2 GLU A 93 -17.599 -3.630 3.246 1.00 0.00 O ATOM 1525 OXT GLU A 93 -20.486 0.956 1.821 1.00 0.00 O ATOM 0 H GLU A 93 -18.067 0.976 -0.148 1.00 0.00 H new ATOM 0 HA GLU A 93 -19.749 -1.456 -0.186 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -17.583 -1.423 1.082 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -18.214 -0.116 2.064 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -19.989 -1.549 2.930 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -19.531 -2.844 1.842 1.00 0.00 H new TER 1532 GLU A 93