USER MOD reduce.3.24.130724 H: found=0, std=0, add=1112, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1112 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 12 MET CE :methyl 173:sc= -2.03 (180deg=-2.15) USER MOD Set 1.2: A 118 CYS SG : rot 180:sc= -0.648 USER MOD Set 2.1: A 83 HIS : no HD1:sc= 0.649 K(o=-1.3,f=-5.7!) USER MOD Set 2.2: A 86 THR OG1 : rot 160:sc= -1.94! USER MOD Set 3.1: A 25 CYS SG : rot 176:sc= -0.323 USER MOD Set 3.2: A 79 ASN : amide:sc= -0.022 K(o=-0.53,f=-2.6) USER MOD Set 3.3: A 81 HIS : +bothHN:sc= -0.188 K(o=-0.53,f=-9.2!) USER MOD Set 4.1: A 57 MET CE :methyl -117:sc= -0.399 (180deg=-0.64) USER MOD Set 4.2: A 62 GLN : amide:sc= -1.36 K(o=-1.8,f=-2.9!) USER MOD Set 5.1: A 1 MET CE :methyl -154:sc= 0 (180deg=-0.612) USER MOD Set 5.2: A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET N :NH3+ -122:sc= 1.68 (180deg=1.38) USER MOD Single : A 5 THR OG1 : rot -170:sc= -3.06! USER MOD Single : A 6 LYS NZ :NH3+ 173:sc= 1.19 (180deg=1.07) USER MOD Single : A 7 LYS NZ :NH3+ 149:sc= 1.18 (180deg=-0.661!) USER MOD Single : A 8 GLN : amide:sc= -2.28! X(o=-2.3!,f=-1.9) USER MOD Single : A 9 MET CE :methyl -162:sc= -0.195 (180deg=-0.971) USER MOD Single : A 15 HIS : no HD1:sc= -0.591 K(o=-0.59,f=-4.9!) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN : amide:sc= -0.414 K(o=-0.41,f=-3.2!) USER MOD Single : A 43 TYR OH : rot -170:sc= 1.28 USER MOD Single : A 46 ASN : amide:sc= -0.889 K(o=-0.89,f=-3.4!) USER MOD Single : A 47 ASN : amide:sc= 0.834 K(o=0.83,f=-7.7!) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 SER OG : rot 93:sc= 1.24 USER MOD Single : A 54 HIS :FLIP no HE2:sc= 0.111 F(o=-1.5,f=0.11) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 78:sc= 1.2 USER MOD Single : A 67 LYS NZ :NH3+ -166:sc= -0.024 (180deg=-0.189) USER MOD Single : A 69 MET CE :methyl -118:sc= 0 (180deg=-2.06!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= 0 X(o=0,f=0.35) USER MOD Single : A 76 MET CE :methyl 143:sc= -0.187 (180deg=-1.86) USER MOD Single : A 82 SER OG : rot -64:sc= 0.463 USER MOD Single : A 91 SER OG : rot 180:sc= 0.735 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 43:sc= 2.05 USER MOD Single : A 109 SER OG : rot -170:sc= -2.7! USER MOD Single : A 114 GLN : amide:sc= -0.0813 K(o=-0.081,f=-0.88) USER MOD Single : A 115 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00516) USER MOD Single : A 119 LYS NZ :NH3+ -153:sc= 1.32 (180deg=0.868) USER MOD Single : A 120 SER OG : rot 180:sc= -0.171 USER MOD Single : A 124 LYS NZ :NH3+ 167:sc= 1.03 (180deg=0.921) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.656 -2.735 5.010 1.00 0.00 N ATOM 2 CA MET A 1 -12.721 -3.172 3.950 1.00 0.00 C ATOM 3 C MET A 1 -11.733 -2.058 3.636 1.00 0.00 C ATOM 4 O MET A 1 -11.555 -1.138 4.436 1.00 0.00 O ATOM 5 CB MET A 1 -13.479 -3.586 2.679 1.00 0.00 C ATOM 6 CG MET A 1 -14.222 -2.460 1.971 1.00 0.00 C ATOM 7 SD MET A 1 -15.677 -1.884 2.866 1.00 0.00 S ATOM 8 CE MET A 1 -16.261 -0.617 1.744 1.00 0.00 C ATOM 0 H1 MET A 1 -13.597 -3.389 5.816 1.00 0.00 H new ATOM 0 H2 MET A 1 -13.403 -1.776 5.323 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.627 -2.732 4.637 1.00 0.00 H new ATOM 0 HA MET A 1 -12.175 -4.042 4.314 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.769 -4.027 1.979 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.196 -4.365 2.940 1.00 0.00 H new ATOM 0 HG2 MET A 1 -13.541 -1.622 1.824 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.526 -2.802 0.981 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.830 0.128 2.301 1.00 0.00 H new ATOM 0 HE2 MET A 1 -15.409 -0.137 1.262 1.00 0.00 H new ATOM 0 HE3 MET A 1 -16.900 -1.069 0.985 1.00 0.00 H new ATOM 20 N ILE A 2 -11.062 -2.156 2.498 1.00 0.00 N ATOM 21 CA ILE A 2 -10.190 -1.089 2.044 1.00 0.00 C ATOM 22 C ILE A 2 -10.713 -0.509 0.739 1.00 0.00 C ATOM 23 O ILE A 2 -11.042 -1.243 -0.196 1.00 0.00 O ATOM 24 CB ILE A 2 -8.725 -1.563 1.881 1.00 0.00 C ATOM 25 CG1 ILE A 2 -7.858 -0.441 1.295 1.00 0.00 C ATOM 26 CG2 ILE A 2 -8.655 -2.808 1.013 1.00 0.00 C ATOM 27 CD1 ILE A 2 -6.383 -0.771 1.247 1.00 0.00 C ATOM 0 H ILE A 2 -11.106 -2.962 1.875 1.00 0.00 H new ATOM 0 HA ILE A 2 -10.191 -0.313 2.809 1.00 0.00 H new ATOM 0 HB ILE A 2 -8.335 -1.816 2.867 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -8.204 -0.217 0.286 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -8.000 0.462 1.888 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -7.616 -3.123 0.912 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -9.233 -3.607 1.476 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -9.065 -2.588 0.027 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -5.836 0.070 0.821 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -6.021 -0.966 2.256 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -6.228 -1.655 0.629 1.00 0.00 H new ATOM 39 N THR A 3 -10.830 0.805 0.696 1.00 0.00 N ATOM 40 CA THR A 3 -11.344 1.482 -0.477 1.00 0.00 C ATOM 41 C THR A 3 -10.242 2.300 -1.154 1.00 0.00 C ATOM 42 O THR A 3 -9.607 3.139 -0.515 1.00 0.00 O ATOM 43 CB THR A 3 -12.511 2.414 -0.091 1.00 0.00 C ATOM 44 OG1 THR A 3 -13.430 1.716 0.770 1.00 0.00 O ATOM 45 CG2 THR A 3 -13.249 2.899 -1.328 1.00 0.00 C ATOM 0 H THR A 3 -10.575 1.426 1.464 1.00 0.00 H new ATOM 0 HA THR A 3 -11.703 0.725 -1.174 1.00 0.00 H new ATOM 0 HB THR A 3 -12.099 3.277 0.432 1.00 0.00 H new ATOM 0 HG1 THR A 3 -14.168 2.313 1.013 1.00 0.00 H new ATOM 0 HG21 THR A 3 -14.067 3.554 -1.030 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.560 3.448 -1.971 1.00 0.00 H new ATOM 0 HG23 THR A 3 -13.649 2.043 -1.872 1.00 0.00 H new ATOM 53 N LEU A 4 -10.000 2.042 -2.433 1.00 0.00 N ATOM 54 CA LEU A 4 -9.025 2.815 -3.193 1.00 0.00 C ATOM 55 C LEU A 4 -9.463 2.937 -4.642 1.00 0.00 C ATOM 56 O LEU A 4 -10.360 2.224 -5.093 1.00 0.00 O ATOM 57 CB LEU A 4 -7.614 2.214 -3.080 1.00 0.00 C ATOM 58 CG LEU A 4 -7.472 0.729 -3.426 1.00 0.00 C ATOM 59 CD1 LEU A 4 -7.262 0.533 -4.919 1.00 0.00 C ATOM 60 CD2 LEU A 4 -6.320 0.114 -2.646 1.00 0.00 C ATOM 0 H LEU A 4 -10.464 1.306 -2.965 1.00 0.00 H new ATOM 0 HA LEU A 4 -8.978 3.816 -2.765 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -6.949 2.781 -3.732 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -7.262 2.361 -2.059 1.00 0.00 H new ATOM 0 HG LEU A 4 -8.397 0.226 -3.146 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -7.164 -0.531 -5.136 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -8.116 0.937 -5.463 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -6.355 1.052 -5.230 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -6.230 -0.942 -2.901 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.393 0.629 -2.899 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -6.510 0.214 -1.577 1.00 0.00 H new ATOM 72 N THR A 5 -8.845 3.847 -5.367 1.00 0.00 N ATOM 73 CA THR A 5 -9.272 4.132 -6.724 1.00 0.00 C ATOM 74 C THR A 5 -8.408 3.391 -7.738 1.00 0.00 C ATOM 75 O THR A 5 -7.326 2.890 -7.408 1.00 0.00 O ATOM 76 CB THR A 5 -9.214 5.644 -7.026 1.00 0.00 C ATOM 77 OG1 THR A 5 -7.858 6.067 -7.178 1.00 0.00 O ATOM 78 CG2 THR A 5 -9.859 6.441 -5.904 1.00 0.00 C ATOM 0 H THR A 5 -8.051 4.399 -5.043 1.00 0.00 H new ATOM 0 HA THR A 5 -10.304 3.791 -6.809 1.00 0.00 H new ATOM 0 HB THR A 5 -9.760 5.823 -7.953 1.00 0.00 H new ATOM 0 HG1 THR A 5 -7.822 7.046 -7.211 1.00 0.00 H new ATOM 0 HG21 THR A 5 -9.807 7.505 -6.137 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.902 6.143 -5.799 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.331 6.248 -4.970 1.00 0.00 H new ATOM 86 N LYS A 6 -8.895 3.322 -8.970 1.00 0.00 N ATOM 87 CA LYS A 6 -8.131 2.761 -10.071 1.00 0.00 C ATOM 88 C LYS A 6 -6.836 3.536 -10.265 1.00 0.00 C ATOM 89 O LYS A 6 -5.797 2.954 -10.559 1.00 0.00 O ATOM 90 CB LYS A 6 -8.957 2.792 -11.359 1.00 0.00 C ATOM 91 CG LYS A 6 -9.550 1.444 -11.739 1.00 0.00 C ATOM 92 CD LYS A 6 -8.805 0.816 -12.910 1.00 0.00 C ATOM 93 CE LYS A 6 -7.339 0.572 -12.588 1.00 0.00 C ATOM 94 NZ LYS A 6 -6.582 0.104 -13.777 1.00 0.00 N ATOM 0 H LYS A 6 -9.824 3.651 -9.231 1.00 0.00 H new ATOM 0 HA LYS A 6 -7.888 1.726 -9.832 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -9.765 3.515 -11.245 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.327 3.145 -12.176 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -9.512 0.774 -10.880 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -10.601 1.568 -12.000 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -9.279 -0.128 -13.177 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -8.881 1.468 -13.780 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -6.892 1.492 -12.212 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -7.260 -0.169 -11.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -5.568 0.063 -13.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -6.914 -0.843 -14.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -6.733 0.764 -14.566 1.00 0.00 H new ATOM 108 N LYS A 7 -6.915 4.849 -10.085 1.00 0.00 N ATOM 109 CA LYS A 7 -5.765 5.725 -10.199 1.00 0.00 C ATOM 110 C LYS A 7 -4.693 5.348 -9.177 1.00 0.00 C ATOM 111 O LYS A 7 -3.508 5.304 -9.506 1.00 0.00 O ATOM 112 CB LYS A 7 -6.243 7.166 -10.003 1.00 0.00 C ATOM 113 CG LYS A 7 -5.212 8.224 -10.324 1.00 0.00 C ATOM 114 CD LYS A 7 -4.493 8.700 -9.074 1.00 0.00 C ATOM 115 CE LYS A 7 -3.442 9.750 -9.388 1.00 0.00 C ATOM 116 NZ LYS A 7 -2.787 10.256 -8.155 1.00 0.00 N ATOM 0 H LYS A 7 -7.783 5.333 -9.855 1.00 0.00 H new ATOM 0 HA LYS A 7 -5.310 5.623 -11.184 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.120 7.331 -10.629 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -6.562 7.291 -8.968 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -4.486 7.823 -11.032 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -5.697 9.070 -10.810 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -5.219 9.112 -8.373 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -4.021 7.850 -8.581 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -2.689 9.325 -10.052 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -3.905 10.580 -9.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -1.805 10.524 -8.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -3.304 11.087 -7.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -2.793 9.512 -7.429 1.00 0.00 H new ATOM 130 N GLN A 8 -5.115 5.064 -7.943 1.00 0.00 N ATOM 131 CA GLN A 8 -4.190 4.625 -6.898 1.00 0.00 C ATOM 132 C GLN A 8 -3.553 3.294 -7.279 1.00 0.00 C ATOM 133 O GLN A 8 -2.352 3.093 -7.099 1.00 0.00 O ATOM 134 CB GLN A 8 -4.915 4.468 -5.555 1.00 0.00 C ATOM 135 CG GLN A 8 -5.742 5.670 -5.134 1.00 0.00 C ATOM 136 CD GLN A 8 -5.000 6.983 -5.259 1.00 0.00 C ATOM 137 OE1 GLN A 8 -5.103 7.669 -6.270 1.00 0.00 O ATOM 138 NE2 GLN A 8 -4.236 7.331 -4.244 1.00 0.00 N ATOM 0 H GLN A 8 -6.088 5.130 -7.644 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.416 5.386 -6.798 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.568 3.597 -5.610 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -4.176 4.264 -4.781 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.645 5.712 -5.743 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.061 5.538 -4.100 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -4.178 6.732 -3.421 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -3.703 8.200 -4.281 1.00 0.00 H new ATOM 147 N MET A 9 -4.366 2.383 -7.800 1.00 0.00 N ATOM 148 CA MET A 9 -3.868 1.098 -8.265 1.00 0.00 C ATOM 149 C MET A 9 -2.854 1.293 -9.383 1.00 0.00 C ATOM 150 O MET A 9 -1.798 0.671 -9.385 1.00 0.00 O ATOM 151 CB MET A 9 -5.026 0.219 -8.738 1.00 0.00 C ATOM 152 CG MET A 9 -4.590 -1.138 -9.265 1.00 0.00 C ATOM 153 SD MET A 9 -5.987 -2.198 -9.677 1.00 0.00 S ATOM 154 CE MET A 9 -6.757 -2.379 -8.070 1.00 0.00 C ATOM 0 H MET A 9 -5.372 2.512 -7.910 1.00 0.00 H new ATOM 0 HA MET A 9 -3.371 0.597 -7.434 1.00 0.00 H new ATOM 0 HB2 MET A 9 -5.719 0.071 -7.910 1.00 0.00 H new ATOM 0 HB3 MET A 9 -5.572 0.744 -9.521 1.00 0.00 H new ATOM 0 HG2 MET A 9 -3.970 -0.998 -10.151 1.00 0.00 H new ATOM 0 HG3 MET A 9 -3.970 -1.633 -8.517 1.00 0.00 H new ATOM 0 HE1 MET A 9 -7.426 -3.239 -8.082 1.00 0.00 H new ATOM 0 HE2 MET A 9 -5.988 -2.529 -7.313 1.00 0.00 H new ATOM 0 HE3 MET A 9 -7.326 -1.479 -7.836 1.00 0.00 H new ATOM 164 N GLU A 10 -3.180 2.175 -10.318 1.00 0.00 N ATOM 165 CA GLU A 10 -2.292 2.523 -11.406 1.00 0.00 C ATOM 166 C GLU A 10 -0.988 3.119 -10.886 1.00 0.00 C ATOM 167 O GLU A 10 0.087 2.818 -11.399 1.00 0.00 O ATOM 168 CB GLU A 10 -3.007 3.513 -12.318 1.00 0.00 C ATOM 169 CG GLU A 10 -4.068 2.875 -13.191 1.00 0.00 C ATOM 170 CD GLU A 10 -3.527 1.723 -14.008 1.00 0.00 C ATOM 171 OE1 GLU A 10 -2.661 1.956 -14.883 1.00 0.00 O ATOM 172 OE2 GLU A 10 -3.969 0.576 -13.789 1.00 0.00 O ATOM 0 H GLU A 10 -4.073 2.668 -10.338 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.035 1.622 -11.963 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.469 4.289 -11.707 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.271 4.004 -12.955 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.885 2.519 -12.563 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.484 3.628 -13.861 1.00 0.00 H new ATOM 179 N GLU A 11 -1.094 3.956 -9.863 1.00 0.00 N ATOM 180 CA GLU A 11 0.067 4.548 -9.228 1.00 0.00 C ATOM 181 C GLU A 11 1.000 3.467 -8.686 1.00 0.00 C ATOM 182 O GLU A 11 2.218 3.531 -8.870 1.00 0.00 O ATOM 183 CB GLU A 11 -0.386 5.480 -8.106 1.00 0.00 C ATOM 184 CG GLU A 11 -0.706 6.889 -8.577 1.00 0.00 C ATOM 185 CD GLU A 11 -0.832 7.877 -7.435 1.00 0.00 C ATOM 186 OE1 GLU A 11 0.191 8.485 -7.061 1.00 0.00 O ATOM 187 OE2 GLU A 11 -1.954 8.072 -6.926 1.00 0.00 O ATOM 0 H GLU A 11 -1.984 4.240 -9.454 1.00 0.00 H new ATOM 0 HA GLU A 11 0.621 5.124 -9.969 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -1.269 5.057 -7.628 1.00 0.00 H new ATOM 0 HB3 GLU A 11 0.395 5.528 -7.347 1.00 0.00 H new ATOM 0 HG2 GLU A 11 0.076 7.226 -9.258 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -1.637 6.875 -9.143 1.00 0.00 H new ATOM 194 N MET A 12 0.419 2.471 -8.036 1.00 0.00 N ATOM 195 CA MET A 12 1.190 1.358 -7.502 1.00 0.00 C ATOM 196 C MET A 12 1.725 0.480 -8.630 1.00 0.00 C ATOM 197 O MET A 12 2.903 0.127 -8.644 1.00 0.00 O ATOM 198 CB MET A 12 0.335 0.520 -6.546 1.00 0.00 C ATOM 199 CG MET A 12 -0.150 1.289 -5.330 1.00 0.00 C ATOM 200 SD MET A 12 -1.059 0.257 -4.165 1.00 0.00 S ATOM 201 CE MET A 12 -2.423 -0.296 -5.185 1.00 0.00 C ATOM 0 H MET A 12 -0.585 2.410 -7.865 1.00 0.00 H new ATOM 0 HA MET A 12 2.035 1.768 -6.949 1.00 0.00 H new ATOM 0 HB2 MET A 12 -0.528 0.133 -7.088 1.00 0.00 H new ATOM 0 HB3 MET A 12 0.915 -0.341 -6.213 1.00 0.00 H new ATOM 0 HG2 MET A 12 0.706 1.734 -4.823 1.00 0.00 H new ATOM 0 HG3 MET A 12 -0.789 2.110 -5.656 1.00 0.00 H new ATOM 0 HE1 MET A 12 -3.005 -1.041 -4.642 1.00 0.00 H new ATOM 0 HE2 MET A 12 -3.061 0.553 -5.431 1.00 0.00 H new ATOM 0 HE3 MET A 12 -2.035 -0.737 -6.103 1.00 0.00 H new ATOM 211 N LEU A 13 0.851 0.148 -9.577 1.00 0.00 N ATOM 212 CA LEU A 13 1.203 -0.710 -10.707 1.00 0.00 C ATOM 213 C LEU A 13 2.335 -0.118 -11.535 1.00 0.00 C ATOM 214 O LEU A 13 3.308 -0.806 -11.853 1.00 0.00 O ATOM 215 CB LEU A 13 -0.022 -0.942 -11.597 1.00 0.00 C ATOM 216 CG LEU A 13 -1.099 -1.846 -10.999 1.00 0.00 C ATOM 217 CD1 LEU A 13 -2.242 -2.024 -11.982 1.00 0.00 C ATOM 218 CD2 LEU A 13 -0.513 -3.197 -10.610 1.00 0.00 C ATOM 0 H LEU A 13 -0.119 0.465 -9.584 1.00 0.00 H new ATOM 0 HA LEU A 13 1.546 -1.662 -10.301 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.470 0.024 -11.830 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.311 -1.375 -12.540 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.486 -1.371 -10.098 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.002 -2.670 -11.543 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.680 -1.052 -12.211 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.866 -2.477 -12.899 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.297 -3.825 -10.186 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.098 -3.681 -11.494 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.275 -3.053 -9.871 1.00 0.00 H new ATOM 230 N ALA A 14 2.210 1.159 -11.872 1.00 0.00 N ATOM 231 CA ALA A 14 3.218 1.841 -12.674 1.00 0.00 C ATOM 232 C ALA A 14 4.560 1.850 -11.965 1.00 0.00 C ATOM 233 O ALA A 14 5.599 1.653 -12.589 1.00 0.00 O ATOM 234 CB ALA A 14 2.777 3.263 -12.990 1.00 0.00 C ATOM 0 H ALA A 14 1.419 1.744 -11.602 1.00 0.00 H new ATOM 0 HA ALA A 14 3.330 1.295 -13.611 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.542 3.757 -13.589 1.00 0.00 H new ATOM 0 HB2 ALA A 14 1.840 3.238 -13.546 1.00 0.00 H new ATOM 0 HB3 ALA A 14 2.633 3.814 -12.061 1.00 0.00 H new ATOM 240 N HIS A 15 4.534 2.065 -10.660 1.00 0.00 N ATOM 241 CA HIS A 15 5.761 2.084 -9.883 1.00 0.00 C ATOM 242 C HIS A 15 6.351 0.681 -9.769 1.00 0.00 C ATOM 243 O HIS A 15 7.567 0.506 -9.811 1.00 0.00 O ATOM 244 CB HIS A 15 5.513 2.656 -8.491 1.00 0.00 C ATOM 245 CG HIS A 15 6.780 3.019 -7.780 1.00 0.00 C ATOM 246 ND1 HIS A 15 7.381 4.249 -7.904 1.00 0.00 N ATOM 247 CD2 HIS A 15 7.569 2.301 -6.945 1.00 0.00 C ATOM 248 CE1 HIS A 15 8.482 4.273 -7.183 1.00 0.00 C ATOM 249 NE2 HIS A 15 8.621 3.103 -6.587 1.00 0.00 N ATOM 0 H HIS A 15 3.684 2.228 -10.120 1.00 0.00 H new ATOM 0 HA HIS A 15 6.474 2.724 -10.403 1.00 0.00 H new ATOM 0 HB2 HIS A 15 4.882 3.541 -8.574 1.00 0.00 H new ATOM 0 HB3 HIS A 15 4.964 1.927 -7.896 1.00 0.00 H new ATOM 0 HD2 HIS A 15 7.400 1.285 -6.621 1.00 0.00 H new ATOM 0 HE1 HIS A 15 9.159 5.110 -7.094 1.00 0.00 H new ATOM 0 HE2 HIS A 15 9.384 2.840 -5.964 1.00 0.00 H new ATOM 258 N ALA A 16 5.482 -0.310 -9.613 1.00 0.00 N ATOM 259 CA ALA A 16 5.911 -1.700 -9.494 1.00 0.00 C ATOM 260 C ALA A 16 6.608 -2.167 -10.767 1.00 0.00 C ATOM 261 O ALA A 16 7.704 -2.721 -10.715 1.00 0.00 O ATOM 262 CB ALA A 16 4.723 -2.603 -9.179 1.00 0.00 C ATOM 0 H ALA A 16 4.472 -0.177 -9.566 1.00 0.00 H new ATOM 0 HA ALA A 16 6.624 -1.762 -8.672 1.00 0.00 H new ATOM 0 HB1 ALA A 16 5.063 -3.635 -9.094 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.269 -2.292 -8.238 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.987 -2.528 -9.979 1.00 0.00 H new ATOM 268 N ARG A 17 5.974 -1.922 -11.908 1.00 0.00 N ATOM 269 CA ARG A 17 6.535 -2.313 -13.196 1.00 0.00 C ATOM 270 C ARG A 17 7.829 -1.542 -13.471 1.00 0.00 C ATOM 271 O ARG A 17 8.744 -2.051 -14.117 1.00 0.00 O ATOM 272 CB ARG A 17 5.506 -2.105 -14.313 1.00 0.00 C ATOM 273 CG ARG A 17 5.269 -0.654 -14.667 1.00 0.00 C ATOM 274 CD ARG A 17 3.967 -0.456 -15.434 1.00 0.00 C ATOM 275 NE ARG A 17 3.872 -1.318 -16.613 1.00 0.00 N ATOM 276 CZ ARG A 17 2.718 -1.784 -17.104 1.00 0.00 C ATOM 277 NH1 ARG A 17 1.565 -1.452 -16.535 1.00 0.00 N ATOM 278 NH2 ARG A 17 2.710 -2.571 -18.172 1.00 0.00 N ATOM 0 H ARG A 17 5.070 -1.454 -11.967 1.00 0.00 H new ATOM 0 HA ARG A 17 6.782 -3.374 -13.167 1.00 0.00 H new ATOM 0 HB2 ARG A 17 5.840 -2.636 -15.204 1.00 0.00 H new ATOM 0 HB3 ARG A 17 4.560 -2.554 -14.010 1.00 0.00 H new ATOM 0 HG2 ARG A 17 5.246 -0.058 -13.755 1.00 0.00 H new ATOM 0 HG3 ARG A 17 6.102 -0.287 -15.267 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.125 -0.658 -14.772 1.00 0.00 H new ATOM 0 HD3 ARG A 17 3.886 0.586 -15.743 1.00 0.00 H new ATOM 0 HE ARG A 17 4.736 -1.579 -17.088 1.00 0.00 H new ATOM 0 HH11 ARG A 17 1.556 -0.839 -15.720 1.00 0.00 H new ATOM 0 HH12 ARG A 17 0.688 -1.810 -16.913 1.00 0.00 H new ATOM 0 HH21 ARG A 17 3.588 -2.825 -18.625 1.00 0.00 H new ATOM 0 HH22 ARG A 17 1.826 -2.922 -18.540 1.00 0.00 H new ATOM 292 N GLN A 18 7.889 -0.314 -12.967 1.00 0.00 N ATOM 293 CA GLN A 18 9.075 0.523 -13.082 1.00 0.00 C ATOM 294 C GLN A 18 10.247 -0.052 -12.290 1.00 0.00 C ATOM 295 O GLN A 18 11.375 -0.111 -12.777 1.00 0.00 O ATOM 296 CB GLN A 18 8.753 1.923 -12.563 1.00 0.00 C ATOM 297 CG GLN A 18 9.942 2.867 -12.543 1.00 0.00 C ATOM 298 CD GLN A 18 9.609 4.197 -11.896 1.00 0.00 C ATOM 299 OE1 GLN A 18 9.742 4.362 -10.682 1.00 0.00 O ATOM 300 NE2 GLN A 18 9.179 5.154 -12.700 1.00 0.00 N ATOM 0 H GLN A 18 7.117 0.128 -12.468 1.00 0.00 H new ATOM 0 HA GLN A 18 9.364 0.562 -14.132 1.00 0.00 H new ATOM 0 HB2 GLN A 18 7.969 2.357 -13.183 1.00 0.00 H new ATOM 0 HB3 GLN A 18 8.351 1.841 -11.553 1.00 0.00 H new ATOM 0 HG2 GLN A 18 10.766 2.399 -12.004 1.00 0.00 H new ATOM 0 HG3 GLN A 18 10.285 3.038 -13.563 1.00 0.00 H new ATOM 0 HE21 GLN A 18 9.083 4.975 -13.700 1.00 0.00 H new ATOM 0 HE22 GLN A 18 8.943 6.071 -12.321 1.00 0.00 H new ATOM 309 N ALA A 19 9.965 -0.477 -11.070 1.00 0.00 N ATOM 310 CA ALA A 19 11.010 -0.888 -10.136 1.00 0.00 C ATOM 311 C ALA A 19 11.458 -2.334 -10.343 1.00 0.00 C ATOM 312 O ALA A 19 12.320 -2.826 -9.616 1.00 0.00 O ATOM 313 CB ALA A 19 10.541 -0.686 -8.704 1.00 0.00 C ATOM 0 H ALA A 19 9.018 -0.548 -10.698 1.00 0.00 H new ATOM 0 HA ALA A 19 11.876 -0.257 -10.334 1.00 0.00 H new ATOM 0 HB1 ALA A 19 11.328 -0.996 -8.016 1.00 0.00 H new ATOM 0 HB2 ALA A 19 10.311 0.367 -8.542 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.647 -1.284 -8.526 1.00 0.00 H new ATOM 319 N LEU A 20 10.886 -3.008 -11.334 1.00 0.00 N ATOM 320 CA LEU A 20 11.263 -4.385 -11.637 1.00 0.00 C ATOM 321 C LEU A 20 12.756 -4.482 -11.966 1.00 0.00 C ATOM 322 O LEU A 20 13.336 -3.557 -12.541 1.00 0.00 O ATOM 323 CB LEU A 20 10.430 -4.921 -12.805 1.00 0.00 C ATOM 324 CG LEU A 20 8.937 -5.104 -12.515 1.00 0.00 C ATOM 325 CD1 LEU A 20 8.217 -5.636 -13.744 1.00 0.00 C ATOM 326 CD2 LEU A 20 8.733 -6.042 -11.333 1.00 0.00 C ATOM 0 H LEU A 20 10.161 -2.625 -11.941 1.00 0.00 H new ATOM 0 HA LEU A 20 11.065 -4.993 -10.754 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.538 -4.240 -13.649 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.844 -5.881 -13.114 1.00 0.00 H new ATOM 0 HG LEU A 20 8.515 -4.132 -12.261 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.158 -5.760 -13.520 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.334 -4.931 -14.567 1.00 0.00 H new ATOM 0 HD13 LEU A 20 8.643 -6.599 -14.027 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.666 -6.160 -11.142 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.171 -7.014 -11.560 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.216 -5.624 -10.450 1.00 0.00 H new ATOM 338 N PRO A 21 13.407 -5.604 -11.610 1.00 0.00 N ATOM 339 CA PRO A 21 12.765 -6.749 -10.966 1.00 0.00 C ATOM 340 C PRO A 21 12.849 -6.709 -9.442 1.00 0.00 C ATOM 341 O PRO A 21 12.744 -7.740 -8.777 1.00 0.00 O ATOM 342 CB PRO A 21 13.593 -7.906 -11.507 1.00 0.00 C ATOM 343 CG PRO A 21 14.975 -7.356 -11.643 1.00 0.00 C ATOM 344 CD PRO A 21 14.840 -5.860 -11.827 1.00 0.00 C ATOM 0 HA PRO A 21 11.696 -6.800 -11.174 1.00 0.00 H new ATOM 0 HB2 PRO A 21 13.572 -8.759 -10.828 1.00 0.00 H new ATOM 0 HB3 PRO A 21 13.209 -8.252 -12.466 1.00 0.00 H new ATOM 0 HG2 PRO A 21 15.569 -7.584 -10.758 1.00 0.00 H new ATOM 0 HG3 PRO A 21 15.486 -7.805 -12.495 1.00 0.00 H new ATOM 0 HD2 PRO A 21 15.456 -5.313 -11.114 1.00 0.00 H new ATOM 0 HD3 PRO A 21 15.155 -5.550 -12.824 1.00 0.00 H new ATOM 352 N ASN A 22 13.034 -5.518 -8.890 1.00 0.00 N ATOM 353 CA ASN A 22 13.145 -5.358 -7.448 1.00 0.00 C ATOM 354 C ASN A 22 11.762 -5.377 -6.815 1.00 0.00 C ATOM 355 O ASN A 22 10.807 -4.849 -7.386 1.00 0.00 O ATOM 356 CB ASN A 22 13.852 -4.041 -7.096 1.00 0.00 C ATOM 357 CG ASN A 22 15.245 -3.930 -7.690 1.00 0.00 C ATOM 358 OD1 ASN A 22 15.932 -4.929 -7.892 1.00 0.00 O ATOM 359 ND2 ASN A 22 15.673 -2.706 -7.970 1.00 0.00 N ATOM 0 H ASN A 22 13.110 -4.649 -9.419 1.00 0.00 H new ATOM 0 HA ASN A 22 13.737 -6.186 -7.059 1.00 0.00 H new ATOM 0 HB2 ASN A 22 13.247 -3.206 -7.449 1.00 0.00 H new ATOM 0 HB3 ASN A 22 13.919 -3.951 -6.012 1.00 0.00 H new ATOM 0 HD21 ASN A 22 16.602 -2.569 -8.368 1.00 0.00 H new ATOM 0 HD22 ASN A 22 15.073 -1.902 -7.788 1.00 0.00 H new ATOM 366 N GLU A 23 11.652 -6.002 -5.650 1.00 0.00 N ATOM 367 CA GLU A 23 10.400 -5.998 -4.903 1.00 0.00 C ATOM 368 C GLU A 23 10.062 -4.578 -4.455 1.00 0.00 C ATOM 369 O GLU A 23 10.609 -4.072 -3.473 1.00 0.00 O ATOM 370 CB GLU A 23 10.489 -6.946 -3.701 1.00 0.00 C ATOM 371 CG GLU A 23 10.633 -8.407 -4.100 1.00 0.00 C ATOM 372 CD GLU A 23 10.783 -9.339 -2.914 1.00 0.00 C ATOM 373 OE1 GLU A 23 9.880 -9.368 -2.051 1.00 0.00 O ATOM 374 OE2 GLU A 23 11.788 -10.076 -2.863 1.00 0.00 O ATOM 0 H GLU A 23 12.411 -6.516 -5.203 1.00 0.00 H new ATOM 0 HA GLU A 23 9.600 -6.353 -5.553 1.00 0.00 H new ATOM 0 HB2 GLU A 23 11.340 -6.659 -3.083 1.00 0.00 H new ATOM 0 HB3 GLU A 23 9.595 -6.830 -3.088 1.00 0.00 H new ATOM 0 HG2 GLU A 23 9.760 -8.706 -4.680 1.00 0.00 H new ATOM 0 HG3 GLU A 23 11.501 -8.515 -4.751 1.00 0.00 H new ATOM 381 N ALA A 24 9.175 -3.932 -5.199 1.00 0.00 N ATOM 382 CA ALA A 24 8.837 -2.541 -4.953 1.00 0.00 C ATOM 383 C ALA A 24 7.845 -2.409 -3.811 1.00 0.00 C ATOM 384 O ALA A 24 6.896 -3.189 -3.700 1.00 0.00 O ATOM 385 CB ALA A 24 8.281 -1.899 -6.214 1.00 0.00 C ATOM 0 H ALA A 24 8.675 -4.354 -5.982 1.00 0.00 H new ATOM 0 HA ALA A 24 9.751 -2.020 -4.666 1.00 0.00 H new ATOM 0 HB1 ALA A 24 8.033 -0.857 -6.013 1.00 0.00 H new ATOM 0 HB2 ALA A 24 9.028 -1.948 -7.007 1.00 0.00 H new ATOM 0 HB3 ALA A 24 7.383 -2.432 -6.528 1.00 0.00 H new ATOM 391 N CYS A 25 8.078 -1.420 -2.966 1.00 0.00 N ATOM 392 CA CYS A 25 7.202 -1.142 -1.847 1.00 0.00 C ATOM 393 C CYS A 25 6.981 0.360 -1.723 1.00 0.00 C ATOM 394 O CYS A 25 7.668 1.153 -2.367 1.00 0.00 O ATOM 395 CB CYS A 25 7.795 -1.701 -0.552 1.00 0.00 C ATOM 396 SG CYS A 25 8.021 -3.494 -0.565 1.00 0.00 S ATOM 0 H CYS A 25 8.877 -0.790 -3.038 1.00 0.00 H new ATOM 0 HA CYS A 25 6.242 -1.628 -2.023 1.00 0.00 H new ATOM 0 HB2 CYS A 25 8.758 -1.224 -0.369 1.00 0.00 H new ATOM 0 HB3 CYS A 25 7.144 -1.433 0.280 1.00 0.00 H new ATOM 0 HG CYS A 25 8.604 -3.866 0.536 1.00 0.00 H new ATOM 402 N GLY A 26 6.011 0.740 -0.914 1.00 0.00 N ATOM 403 CA GLY A 26 5.719 2.140 -0.698 1.00 0.00 C ATOM 404 C GLY A 26 4.710 2.312 0.407 1.00 0.00 C ATOM 405 O GLY A 26 4.452 1.368 1.149 1.00 0.00 O ATOM 0 H GLY A 26 5.412 0.097 -0.396 1.00 0.00 H new ATOM 0 HA2 GLY A 26 6.636 2.673 -0.445 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.337 2.582 -1.618 1.00 0.00 H new ATOM 409 N LEU A 27 4.118 3.487 0.503 1.00 0.00 N ATOM 410 CA LEU A 27 3.131 3.752 1.536 1.00 0.00 C ATOM 411 C LEU A 27 1.818 4.208 0.920 1.00 0.00 C ATOM 412 O LEU A 27 1.790 4.766 -0.179 1.00 0.00 O ATOM 413 CB LEU A 27 3.640 4.824 2.507 1.00 0.00 C ATOM 414 CG LEU A 27 4.879 4.453 3.322 1.00 0.00 C ATOM 415 CD1 LEU A 27 5.305 5.627 4.189 1.00 0.00 C ATOM 416 CD2 LEU A 27 4.607 3.226 4.183 1.00 0.00 C ATOM 0 H LEU A 27 4.302 4.273 -0.120 1.00 0.00 H new ATOM 0 HA LEU A 27 2.963 2.825 2.084 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.860 5.727 1.938 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.835 5.072 3.199 1.00 0.00 H new ATOM 0 HG LEU A 27 5.689 4.214 2.633 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.188 5.352 4.765 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.537 6.482 3.555 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.495 5.890 4.870 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.501 2.978 4.755 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.785 3.436 4.867 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.341 2.385 3.543 1.00 0.00 H new ATOM 428 N LEU A 28 0.737 3.965 1.636 1.00 0.00 N ATOM 429 CA LEU A 28 -0.580 4.380 1.197 1.00 0.00 C ATOM 430 C LEU A 28 -1.159 5.382 2.180 1.00 0.00 C ATOM 431 O LEU A 28 -1.172 5.140 3.390 1.00 0.00 O ATOM 432 CB LEU A 28 -1.505 3.167 1.069 1.00 0.00 C ATOM 433 CG LEU A 28 -1.083 2.135 0.022 1.00 0.00 C ATOM 434 CD1 LEU A 28 -2.032 0.949 0.037 1.00 0.00 C ATOM 435 CD2 LEU A 28 -1.042 2.771 -1.359 1.00 0.00 C ATOM 0 H LEU A 28 0.747 3.478 2.532 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.493 4.853 0.219 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.567 2.673 2.039 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.508 3.519 0.826 1.00 0.00 H new ATOM 0 HG LEU A 28 -0.083 1.778 0.267 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.719 0.223 -0.713 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -2.016 0.483 1.022 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.043 1.289 -0.187 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.740 2.025 -2.094 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.031 3.152 -1.614 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.325 3.592 -1.360 1.00 0.00 H new ATOM 447 N GLY A 29 -1.625 6.504 1.664 1.00 0.00 N ATOM 448 CA GLY A 29 -2.171 7.536 2.510 1.00 0.00 C ATOM 449 C GLY A 29 -3.591 7.881 2.130 1.00 0.00 C ATOM 450 O GLY A 29 -4.032 7.605 1.011 1.00 0.00 O ATOM 0 H GLY A 29 -1.634 6.719 0.667 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.143 7.207 3.549 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.549 8.429 2.441 1.00 0.00 H new ATOM 454 N GLY A 30 -4.310 8.473 3.056 1.00 0.00 N ATOM 455 CA GLY A 30 -5.670 8.867 2.787 1.00 0.00 C ATOM 456 C GLY A 30 -6.448 9.098 4.055 1.00 0.00 C ATOM 457 O GLY A 30 -5.916 9.624 5.031 1.00 0.00 O ATOM 0 H GLY A 30 -3.977 8.690 3.995 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -5.673 9.778 2.188 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.161 8.095 2.195 1.00 0.00 H new ATOM 461 N ARG A 31 -7.694 8.686 4.050 1.00 0.00 N ATOM 462 CA ARG A 31 -8.568 8.875 5.189 1.00 0.00 C ATOM 463 C ARG A 31 -8.875 7.538 5.840 1.00 0.00 C ATOM 464 O ARG A 31 -8.976 6.518 5.160 1.00 0.00 O ATOM 465 CB ARG A 31 -9.866 9.541 4.741 1.00 0.00 C ATOM 466 CG ARG A 31 -9.707 10.997 4.330 1.00 0.00 C ATOM 467 CD ARG A 31 -10.882 11.458 3.482 1.00 0.00 C ATOM 468 NE ARG A 31 -12.160 10.989 4.014 1.00 0.00 N ATOM 469 CZ ARG A 31 -13.082 10.358 3.280 1.00 0.00 C ATOM 470 NH1 ARG A 31 -12.885 10.159 1.977 1.00 0.00 N ATOM 471 NH2 ARG A 31 -14.197 9.918 3.855 1.00 0.00 N ATOM 0 H ARG A 31 -8.131 8.212 3.260 1.00 0.00 H new ATOM 0 HA ARG A 31 -8.067 9.516 5.915 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -10.279 8.981 3.902 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -10.592 9.481 5.552 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -9.629 11.623 5.219 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -8.780 11.121 3.770 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -10.888 12.547 3.432 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -10.758 11.093 2.462 1.00 0.00 H new ATOM 0 HE ARG A 31 -12.360 11.152 5.001 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -12.027 10.489 1.535 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -13.592 9.677 1.422 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -14.347 10.062 4.854 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -14.902 9.436 3.298 1.00 0.00 H new ATOM 485 N ARG A 32 -8.992 7.531 7.154 1.00 0.00 N ATOM 486 CA ARG A 32 -9.438 6.347 7.859 1.00 0.00 C ATOM 487 C ARG A 32 -10.402 6.745 8.966 1.00 0.00 C ATOM 488 O ARG A 32 -10.151 7.688 9.718 1.00 0.00 O ATOM 489 CB ARG A 32 -8.254 5.545 8.417 1.00 0.00 C ATOM 490 CG ARG A 32 -7.548 6.183 9.604 1.00 0.00 C ATOM 491 CD ARG A 32 -6.336 5.366 10.025 1.00 0.00 C ATOM 492 NE ARG A 32 -5.831 5.760 11.339 1.00 0.00 N ATOM 493 CZ ARG A 32 -4.808 5.166 11.955 1.00 0.00 C ATOM 494 NH1 ARG A 32 -4.129 4.195 11.356 1.00 0.00 N ATOM 495 NH2 ARG A 32 -4.468 5.549 13.175 1.00 0.00 N ATOM 0 H ARG A 32 -8.785 8.330 7.753 1.00 0.00 H new ATOM 0 HA ARG A 32 -9.957 5.698 7.154 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -8.610 4.558 8.713 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -7.527 5.396 7.619 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -7.236 7.195 9.345 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -8.241 6.268 10.441 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -6.601 4.309 10.042 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -5.546 5.484 9.284 1.00 0.00 H new ATOM 0 HE ARG A 32 -6.289 6.537 11.814 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -4.388 3.897 10.416 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -3.348 3.747 11.836 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -4.987 6.294 13.639 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -3.687 5.099 13.652 1.00 0.00 H new ATOM 509 N ASP A 33 -11.519 6.046 9.047 1.00 0.00 N ATOM 510 CA ASP A 33 -12.540 6.379 10.032 1.00 0.00 C ATOM 511 C ASP A 33 -12.405 5.475 11.250 1.00 0.00 C ATOM 512 O ASP A 33 -13.127 5.608 12.240 1.00 0.00 O ATOM 513 CB ASP A 33 -13.930 6.259 9.403 1.00 0.00 C ATOM 514 CG ASP A 33 -15.041 6.722 10.318 1.00 0.00 C ATOM 515 OD1 ASP A 33 -15.218 7.949 10.470 1.00 0.00 O ATOM 516 OD2 ASP A 33 -15.762 5.862 10.868 1.00 0.00 O ATOM 0 H ASP A 33 -11.744 5.250 8.450 1.00 0.00 H new ATOM 0 HA ASP A 33 -12.404 7.409 10.360 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -13.957 6.845 8.484 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -14.107 5.220 9.124 1.00 0.00 H new ATOM 521 N GLY A 34 -11.449 4.571 11.170 1.00 0.00 N ATOM 522 CA GLY A 34 -11.199 3.649 12.257 1.00 0.00 C ATOM 523 C GLY A 34 -11.514 2.229 11.868 1.00 0.00 C ATOM 524 O GLY A 34 -10.693 1.327 12.029 1.00 0.00 O ATOM 0 H GLY A 34 -10.834 4.456 10.364 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -10.155 3.720 12.561 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -11.802 3.932 13.120 1.00 0.00 H new ATOM 528 N ASP A 35 -12.704 2.040 11.336 1.00 0.00 N ATOM 529 CA ASP A 35 -13.147 0.727 10.895 1.00 0.00 C ATOM 530 C ASP A 35 -12.822 0.535 9.421 1.00 0.00 C ATOM 531 O ASP A 35 -12.457 -0.563 8.993 1.00 0.00 O ATOM 532 CB ASP A 35 -14.651 0.551 11.132 1.00 0.00 C ATOM 533 CG ASP A 35 -15.146 -0.832 10.752 1.00 0.00 C ATOM 534 OD1 ASP A 35 -14.896 -1.784 11.519 1.00 0.00 O ATOM 535 OD2 ASP A 35 -15.804 -0.970 9.696 1.00 0.00 O ATOM 0 H ASP A 35 -13.389 2.783 11.196 1.00 0.00 H new ATOM 0 HA ASP A 35 -12.619 -0.028 11.478 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -14.873 0.736 12.183 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -15.195 1.298 10.555 1.00 0.00 H new ATOM 540 N ASP A 36 -12.941 1.609 8.648 1.00 0.00 N ATOM 541 CA ASP A 36 -12.641 1.550 7.223 1.00 0.00 C ATOM 542 C ASP A 36 -11.613 2.595 6.839 1.00 0.00 C ATOM 543 O ASP A 36 -11.357 3.552 7.578 1.00 0.00 O ATOM 544 CB ASP A 36 -13.901 1.753 6.387 1.00 0.00 C ATOM 545 CG ASP A 36 -13.870 0.988 5.081 1.00 0.00 C ATOM 546 OD1 ASP A 36 -13.371 1.535 4.078 1.00 0.00 O ATOM 547 OD2 ASP A 36 -14.359 -0.161 5.056 1.00 0.00 O ATOM 0 H ASP A 36 -13.241 2.525 8.982 1.00 0.00 H new ATOM 0 HA ASP A 36 -12.235 0.559 7.020 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.770 1.439 6.966 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -14.025 2.815 6.177 1.00 0.00 H new ATOM 552 N ARG A 37 -11.025 2.383 5.682 1.00 0.00 N ATOM 553 CA ARG A 37 -9.977 3.259 5.159 1.00 0.00 C ATOM 554 C ARG A 37 -10.225 3.615 3.691 1.00 0.00 C ATOM 555 O ARG A 37 -10.689 2.781 2.909 1.00 0.00 O ATOM 556 CB ARG A 37 -8.577 2.643 5.327 1.00 0.00 C ATOM 557 CG ARG A 37 -8.301 1.419 4.463 1.00 0.00 C ATOM 558 CD ARG A 37 -8.913 0.158 5.047 1.00 0.00 C ATOM 559 NE ARG A 37 -8.322 -0.192 6.340 1.00 0.00 N ATOM 560 CZ ARG A 37 -9.004 -0.743 7.344 1.00 0.00 C ATOM 561 NH1 ARG A 37 -10.285 -1.045 7.186 1.00 0.00 N ATOM 562 NH2 ARG A 37 -8.397 -1.009 8.497 1.00 0.00 N ATOM 0 H ARG A 37 -11.254 1.600 5.070 1.00 0.00 H new ATOM 0 HA ARG A 37 -10.014 4.176 5.748 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -7.832 3.405 5.098 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -8.441 2.368 6.373 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -8.700 1.585 3.462 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -7.224 1.284 4.359 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -9.987 0.298 5.166 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -8.775 -0.668 4.350 1.00 0.00 H new ATOM 0 HE ARG A 37 -7.330 -0.003 6.481 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -10.748 -0.856 6.297 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -10.808 -1.467 7.954 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -7.407 -0.791 8.614 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -8.921 -1.431 9.264 1.00 0.00 H new ATOM 576 N TRP A 38 -9.889 4.841 3.322 1.00 0.00 N ATOM 577 CA TRP A 38 -10.013 5.300 1.946 1.00 0.00 C ATOM 578 C TRP A 38 -8.674 5.844 1.458 1.00 0.00 C ATOM 579 O TRP A 38 -8.195 6.870 1.948 1.00 0.00 O ATOM 580 CB TRP A 38 -11.090 6.386 1.843 1.00 0.00 C ATOM 581 CG TRP A 38 -12.421 5.950 2.371 1.00 0.00 C ATOM 582 CD1 TRP A 38 -13.423 5.347 1.671 1.00 0.00 C ATOM 583 CD2 TRP A 38 -12.889 6.074 3.719 1.00 0.00 C ATOM 584 NE1 TRP A 38 -14.487 5.088 2.500 1.00 0.00 N ATOM 585 CE2 TRP A 38 -14.181 5.522 3.762 1.00 0.00 C ATOM 586 CE3 TRP A 38 -12.339 6.598 4.892 1.00 0.00 C ATOM 587 CZ2 TRP A 38 -14.932 5.480 4.933 1.00 0.00 C ATOM 588 CZ3 TRP A 38 -13.084 6.550 6.053 1.00 0.00 C ATOM 589 CH2 TRP A 38 -14.368 5.996 6.066 1.00 0.00 C ATOM 0 H TRP A 38 -9.524 5.544 3.964 1.00 0.00 H new ATOM 0 HA TRP A 38 -10.306 4.458 1.319 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -10.760 7.268 2.392 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -11.200 6.682 0.800 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -13.386 5.108 0.618 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -15.362 4.645 2.221 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -11.350 7.032 4.890 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -15.925 5.055 4.946 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -12.668 6.947 6.967 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -14.926 5.975 6.991 1.00 0.00 H new ATOM 600 N VAL A 39 -8.068 5.147 0.507 1.00 0.00 N ATOM 601 CA VAL A 39 -6.769 5.545 -0.022 1.00 0.00 C ATOM 602 C VAL A 39 -6.930 6.649 -1.057 1.00 0.00 C ATOM 603 O VAL A 39 -7.401 6.405 -2.170 1.00 0.00 O ATOM 604 CB VAL A 39 -6.016 4.356 -0.665 1.00 0.00 C ATOM 605 CG1 VAL A 39 -4.619 4.773 -1.093 1.00 0.00 C ATOM 606 CG2 VAL A 39 -5.954 3.171 0.285 1.00 0.00 C ATOM 0 H VAL A 39 -8.455 4.303 0.085 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.182 5.909 0.821 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.570 4.048 -1.552 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.107 3.922 -1.543 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -4.688 5.581 -1.821 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.059 5.115 -0.223 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.420 2.350 -0.192 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.432 3.462 1.197 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.966 2.850 0.533 1.00 0.00 H new ATOM 616 N GLU A 40 -6.555 7.862 -0.685 1.00 0.00 N ATOM 617 CA GLU A 40 -6.677 9.003 -1.581 1.00 0.00 C ATOM 618 C GLU A 40 -5.310 9.470 -2.082 1.00 0.00 C ATOM 619 O GLU A 40 -5.226 10.331 -2.959 1.00 0.00 O ATOM 620 CB GLU A 40 -7.395 10.159 -0.882 1.00 0.00 C ATOM 621 CG GLU A 40 -8.821 9.837 -0.452 1.00 0.00 C ATOM 622 CD GLU A 40 -9.537 11.045 0.125 1.00 0.00 C ATOM 623 OE1 GLU A 40 -8.915 12.126 0.201 1.00 0.00 O ATOM 624 OE2 GLU A 40 -10.723 10.922 0.499 1.00 0.00 O ATOM 0 H GLU A 40 -6.164 8.083 0.231 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.265 8.683 -2.441 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.820 10.452 -0.004 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -7.414 11.019 -1.552 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -9.380 9.461 -1.309 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.803 9.040 0.291 1.00 0.00 H new ATOM 631 N ARG A 41 -4.238 8.908 -1.532 1.00 0.00 N ATOM 632 CA ARG A 41 -2.895 9.306 -1.934 1.00 0.00 C ATOM 633 C ARG A 41 -1.930 8.123 -1.863 1.00 0.00 C ATOM 634 O ARG A 41 -1.991 7.320 -0.934 1.00 0.00 O ATOM 635 CB ARG A 41 -2.399 10.439 -1.034 1.00 0.00 C ATOM 636 CG ARG A 41 -1.314 11.285 -1.672 1.00 0.00 C ATOM 637 CD ARG A 41 -1.836 11.984 -2.914 1.00 0.00 C ATOM 638 NE ARG A 41 -0.806 12.772 -3.584 1.00 0.00 N ATOM 639 CZ ARG A 41 -1.000 13.437 -4.719 1.00 0.00 C ATOM 640 NH1 ARG A 41 -2.194 13.436 -5.298 1.00 0.00 N ATOM 641 NH2 ARG A 41 -0.002 14.121 -5.270 1.00 0.00 N ATOM 0 H ARG A 41 -4.272 8.184 -0.815 1.00 0.00 H new ATOM 0 HA ARG A 41 -2.934 9.653 -2.966 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.241 11.079 -0.771 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.019 10.015 -0.105 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -0.956 12.025 -0.956 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -0.463 10.656 -1.934 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -2.229 11.241 -3.607 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -2.666 12.635 -2.639 1.00 0.00 H new ATOM 0 HE ARG A 41 0.119 12.815 -3.156 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -2.967 12.924 -4.872 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -2.339 13.947 -6.169 1.00 0.00 H new ATOM 0 HH21 ARG A 41 0.914 14.136 -4.822 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -0.153 14.631 -6.141 1.00 0.00 H new ATOM 655 N VAL A 42 -1.051 8.014 -2.851 1.00 0.00 N ATOM 656 CA VAL A 42 -0.052 6.953 -2.872 1.00 0.00 C ATOM 657 C VAL A 42 1.350 7.545 -2.771 1.00 0.00 C ATOM 658 O VAL A 42 1.695 8.476 -3.499 1.00 0.00 O ATOM 659 CB VAL A 42 -0.154 6.092 -4.155 1.00 0.00 C ATOM 660 CG1 VAL A 42 0.922 5.014 -4.185 1.00 0.00 C ATOM 661 CG2 VAL A 42 -1.532 5.461 -4.269 1.00 0.00 C ATOM 0 H VAL A 42 -1.010 8.648 -3.649 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.245 6.310 -2.013 1.00 0.00 H new ATOM 0 HB VAL A 42 0.002 6.751 -5.009 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.823 4.427 -5.098 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.906 5.482 -4.159 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.807 4.361 -3.320 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -1.583 4.860 -5.177 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -1.714 4.825 -3.403 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.289 6.244 -4.309 1.00 0.00 H new ATOM 671 N TYR A 43 2.142 7.014 -1.854 1.00 0.00 N ATOM 672 CA TYR A 43 3.521 7.454 -1.671 1.00 0.00 C ATOM 673 C TYR A 43 4.477 6.308 -1.992 1.00 0.00 C ATOM 674 O TYR A 43 4.858 5.543 -1.108 1.00 0.00 O ATOM 675 CB TYR A 43 3.764 7.940 -0.235 1.00 0.00 C ATOM 676 CG TYR A 43 3.047 9.226 0.140 1.00 0.00 C ATOM 677 CD1 TYR A 43 1.674 9.251 0.356 1.00 0.00 C ATOM 678 CD2 TYR A 43 3.753 10.413 0.303 1.00 0.00 C ATOM 679 CE1 TYR A 43 1.028 10.417 0.724 1.00 0.00 C ATOM 680 CE2 TYR A 43 3.114 11.585 0.667 1.00 0.00 C ATOM 681 CZ TYR A 43 1.751 11.583 0.875 1.00 0.00 C ATOM 682 OH TYR A 43 1.111 12.742 1.256 1.00 0.00 O ATOM 0 H TYR A 43 1.853 6.271 -1.218 1.00 0.00 H new ATOM 0 HA TYR A 43 3.703 8.287 -2.350 1.00 0.00 H new ATOM 0 HB2 TYR A 43 3.454 7.155 0.455 1.00 0.00 H new ATOM 0 HB3 TYR A 43 4.835 8.085 -0.093 1.00 0.00 H new ATOM 0 HD1 TYR A 43 1.101 8.343 0.234 1.00 0.00 H new ATOM 0 HD2 TYR A 43 4.821 10.420 0.142 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -0.039 10.415 0.893 1.00 0.00 H new ATOM 0 HE2 TYR A 43 3.680 12.497 0.788 1.00 0.00 H new ATOM 0 HH TYR A 43 1.725 13.500 1.164 1.00 0.00 H new ATOM 692 N PRO A 44 4.849 6.146 -3.265 1.00 0.00 N ATOM 693 CA PRO A 44 5.673 5.035 -3.708 1.00 0.00 C ATOM 694 C PRO A 44 7.169 5.329 -3.615 1.00 0.00 C ATOM 695 O PRO A 44 7.702 6.154 -4.360 1.00 0.00 O ATOM 696 CB PRO A 44 5.246 4.846 -5.169 1.00 0.00 C ATOM 697 CG PRO A 44 4.490 6.086 -5.561 1.00 0.00 C ATOM 698 CD PRO A 44 4.508 7.028 -4.383 1.00 0.00 C ATOM 0 HA PRO A 44 5.531 4.151 -3.086 1.00 0.00 H new ATOM 0 HB2 PRO A 44 6.115 4.703 -5.811 1.00 0.00 H new ATOM 0 HB3 PRO A 44 4.620 3.960 -5.278 1.00 0.00 H new ATOM 0 HG2 PRO A 44 4.949 6.554 -6.432 1.00 0.00 H new ATOM 0 HG3 PRO A 44 3.465 5.838 -5.836 1.00 0.00 H new ATOM 0 HD2 PRO A 44 5.245 7.821 -4.511 1.00 0.00 H new ATOM 0 HD3 PRO A 44 3.542 7.511 -4.237 1.00 0.00 H new ATOM 706 N LEU A 45 7.843 4.652 -2.695 1.00 0.00 N ATOM 707 CA LEU A 45 9.281 4.801 -2.533 1.00 0.00 C ATOM 708 C LEU A 45 10.009 3.818 -3.440 1.00 0.00 C ATOM 709 O LEU A 45 9.384 2.968 -4.077 1.00 0.00 O ATOM 710 CB LEU A 45 9.701 4.565 -1.072 1.00 0.00 C ATOM 711 CG LEU A 45 9.358 5.686 -0.079 1.00 0.00 C ATOM 712 CD1 LEU A 45 7.861 5.754 0.190 1.00 0.00 C ATOM 713 CD2 LEU A 45 10.117 5.487 1.223 1.00 0.00 C ATOM 0 H LEU A 45 7.413 3.992 -2.047 1.00 0.00 H new ATOM 0 HA LEU A 45 9.550 5.821 -2.808 1.00 0.00 H new ATOM 0 HB2 LEU A 45 9.232 3.644 -0.725 1.00 0.00 H new ATOM 0 HB3 LEU A 45 10.779 4.403 -1.047 1.00 0.00 H new ATOM 0 HG LEU A 45 9.660 6.632 -0.528 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.654 6.558 0.897 1.00 0.00 H new ATOM 0 HD12 LEU A 45 7.332 5.946 -0.743 1.00 0.00 H new ATOM 0 HD13 LEU A 45 7.523 4.806 0.610 1.00 0.00 H new ATOM 0 HD21 LEU A 45 9.865 6.288 1.917 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.843 4.527 1.661 1.00 0.00 H new ATOM 0 HD23 LEU A 45 11.189 5.502 1.025 1.00 0.00 H new ATOM 725 N ASN A 46 11.318 3.940 -3.516 1.00 0.00 N ATOM 726 CA ASN A 46 12.120 2.994 -4.274 1.00 0.00 C ATOM 727 C ASN A 46 12.587 1.887 -3.333 1.00 0.00 C ATOM 728 O ASN A 46 12.282 1.921 -2.145 1.00 0.00 O ATOM 729 CB ASN A 46 13.323 3.700 -4.913 1.00 0.00 C ATOM 730 CG ASN A 46 14.082 2.810 -5.879 1.00 0.00 C ATOM 731 OD1 ASN A 46 13.497 1.958 -6.546 1.00 0.00 O ATOM 732 ND2 ASN A 46 15.393 2.975 -5.937 1.00 0.00 N ATOM 0 H ASN A 46 11.851 4.683 -3.064 1.00 0.00 H new ATOM 0 HA ASN A 46 11.521 2.565 -5.077 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.978 4.590 -5.440 1.00 0.00 H new ATOM 0 HB3 ASN A 46 14.000 4.037 -4.128 1.00 0.00 H new ATOM 0 HD21 ASN A 46 15.955 2.385 -6.550 1.00 0.00 H new ATOM 0 HD22 ASN A 46 15.842 3.693 -5.368 1.00 0.00 H new ATOM 739 N ASN A 47 13.297 0.902 -3.855 1.00 0.00 N ATOM 740 CA ASN A 47 13.875 -0.128 -3.008 1.00 0.00 C ATOM 741 C ASN A 47 15.221 0.357 -2.479 1.00 0.00 C ATOM 742 O ASN A 47 16.184 0.483 -3.232 1.00 0.00 O ATOM 743 CB ASN A 47 14.047 -1.437 -3.782 1.00 0.00 C ATOM 744 CG ASN A 47 14.305 -2.623 -2.871 1.00 0.00 C ATOM 745 OD1 ASN A 47 14.845 -2.483 -1.770 1.00 0.00 O ATOM 746 ND2 ASN A 47 13.907 -3.799 -3.323 1.00 0.00 N ATOM 0 H ASN A 47 13.486 0.793 -4.851 1.00 0.00 H new ATOM 0 HA ASN A 47 13.202 -0.321 -2.172 1.00 0.00 H new ATOM 0 HB2 ASN A 47 13.151 -1.626 -4.373 1.00 0.00 H new ATOM 0 HB3 ASN A 47 14.876 -1.335 -4.483 1.00 0.00 H new ATOM 0 HD21 ASN A 47 14.042 -4.636 -2.756 1.00 0.00 H new ATOM 0 HD22 ASN A 47 13.465 -3.870 -4.239 1.00 0.00 H new ATOM 753 N LEU A 48 15.267 0.666 -1.190 1.00 0.00 N ATOM 754 CA LEU A 48 16.462 1.211 -0.565 1.00 0.00 C ATOM 755 C LEU A 48 17.548 0.156 -0.333 1.00 0.00 C ATOM 756 O LEU A 48 18.640 0.490 0.132 1.00 0.00 O ATOM 757 CB LEU A 48 16.102 1.876 0.766 1.00 0.00 C ATOM 758 CG LEU A 48 15.336 3.200 0.676 1.00 0.00 C ATOM 759 CD1 LEU A 48 16.069 4.193 -0.210 1.00 0.00 C ATOM 760 CD2 LEU A 48 13.911 2.996 0.186 1.00 0.00 C ATOM 0 H LEU A 48 14.480 0.546 -0.552 1.00 0.00 H new ATOM 0 HA LEU A 48 16.869 1.948 -1.257 1.00 0.00 H new ATOM 0 HB2 LEU A 48 15.506 1.174 1.349 1.00 0.00 H new ATOM 0 HB3 LEU A 48 17.023 2.050 1.322 1.00 0.00 H new ATOM 0 HG LEU A 48 15.282 3.610 1.684 1.00 0.00 H new ATOM 0 HD11 LEU A 48 15.505 5.124 -0.257 1.00 0.00 H new ATOM 0 HD12 LEU A 48 17.058 4.389 0.204 1.00 0.00 H new ATOM 0 HD13 LEU A 48 16.171 3.779 -1.213 1.00 0.00 H new ATOM 0 HD21 LEU A 48 13.402 3.959 0.136 1.00 0.00 H new ATOM 0 HD22 LEU A 48 13.928 2.543 -0.805 1.00 0.00 H new ATOM 0 HD23 LEU A 48 13.380 2.340 0.875 1.00 0.00 H new ATOM 772 N ASP A 49 17.257 -1.107 -0.635 1.00 0.00 N ATOM 773 CA ASP A 49 18.235 -2.171 -0.421 1.00 0.00 C ATOM 774 C ASP A 49 19.144 -2.303 -1.634 1.00 0.00 C ATOM 775 O ASP A 49 18.929 -1.664 -2.663 1.00 0.00 O ATOM 776 CB ASP A 49 17.553 -3.521 -0.148 1.00 0.00 C ATOM 777 CG ASP A 49 18.420 -4.455 0.682 1.00 0.00 C ATOM 778 OD1 ASP A 49 19.250 -5.188 0.100 1.00 0.00 O ATOM 779 OD2 ASP A 49 18.275 -4.465 1.921 1.00 0.00 O ATOM 0 H ASP A 49 16.366 -1.416 -1.023 1.00 0.00 H new ATOM 0 HA ASP A 49 18.825 -1.900 0.455 1.00 0.00 H new ATOM 0 HB2 ASP A 49 16.610 -3.349 0.371 1.00 0.00 H new ATOM 0 HB3 ASP A 49 17.312 -4.001 -1.097 1.00 0.00 H new ATOM 784 N GLN A 50 20.150 -3.144 -1.504 1.00 0.00 N ATOM 785 CA GLN A 50 21.065 -3.430 -2.594 1.00 0.00 C ATOM 786 C GLN A 50 20.659 -4.732 -3.263 1.00 0.00 C ATOM 787 O GLN A 50 21.365 -5.253 -4.129 1.00 0.00 O ATOM 788 CB GLN A 50 22.494 -3.547 -2.065 1.00 0.00 C ATOM 789 CG GLN A 50 23.026 -2.267 -1.439 1.00 0.00 C ATOM 790 CD GLN A 50 24.390 -2.457 -0.809 1.00 0.00 C ATOM 791 OE1 GLN A 50 25.422 -2.301 -1.467 1.00 0.00 O ATOM 792 NE2 GLN A 50 24.406 -2.786 0.473 1.00 0.00 N ATOM 0 H GLN A 50 20.357 -3.648 -0.642 1.00 0.00 H new ATOM 0 HA GLN A 50 21.024 -2.617 -3.319 1.00 0.00 H new ATOM 0 HB2 GLN A 50 22.532 -4.345 -1.324 1.00 0.00 H new ATOM 0 HB3 GLN A 50 23.151 -3.840 -2.884 1.00 0.00 H new ATOM 0 HG2 GLN A 50 23.086 -1.490 -2.201 1.00 0.00 H new ATOM 0 HG3 GLN A 50 22.324 -1.917 -0.682 1.00 0.00 H new ATOM 0 HE21 GLN A 50 23.529 -2.905 0.980 1.00 0.00 H new ATOM 0 HE22 GLN A 50 25.295 -2.920 0.954 1.00 0.00 H new ATOM 801 N SER A 51 19.515 -5.251 -2.845 1.00 0.00 N ATOM 802 CA SER A 51 19.049 -6.550 -3.285 1.00 0.00 C ATOM 803 C SER A 51 17.708 -6.440 -4.004 1.00 0.00 C ATOM 804 O SER A 51 16.854 -5.650 -3.614 1.00 0.00 O ATOM 805 CB SER A 51 18.889 -7.445 -2.061 1.00 0.00 C ATOM 806 OG SER A 51 20.041 -7.392 -1.240 1.00 0.00 O ATOM 0 H SER A 51 18.887 -4.782 -2.192 1.00 0.00 H new ATOM 0 HA SER A 51 19.775 -6.969 -3.982 1.00 0.00 H new ATOM 0 HB2 SER A 51 18.016 -7.132 -1.489 1.00 0.00 H new ATOM 0 HB3 SER A 51 18.711 -8.473 -2.378 1.00 0.00 H new ATOM 0 HG SER A 51 19.920 -6.706 -0.551 1.00 0.00 H new ATOM 812 N PRO A 52 17.499 -7.248 -5.053 1.00 0.00 N ATOM 813 CA PRO A 52 16.202 -7.344 -5.721 1.00 0.00 C ATOM 814 C PRO A 52 15.256 -8.276 -4.970 1.00 0.00 C ATOM 815 O PRO A 52 14.039 -8.226 -5.146 1.00 0.00 O ATOM 816 CB PRO A 52 16.558 -7.927 -7.087 1.00 0.00 C ATOM 817 CG PRO A 52 17.785 -8.743 -6.847 1.00 0.00 C ATOM 818 CD PRO A 52 18.521 -8.094 -5.702 1.00 0.00 C ATOM 0 HA PRO A 52 15.685 -6.386 -5.778 1.00 0.00 H new ATOM 0 HB2 PRO A 52 15.746 -8.540 -7.479 1.00 0.00 H new ATOM 0 HB3 PRO A 52 16.744 -7.139 -7.817 1.00 0.00 H new ATOM 0 HG2 PRO A 52 17.523 -9.773 -6.604 1.00 0.00 H new ATOM 0 HG3 PRO A 52 18.409 -8.775 -7.740 1.00 0.00 H new ATOM 0 HD2 PRO A 52 18.921 -8.837 -5.012 1.00 0.00 H new ATOM 0 HD3 PRO A 52 19.365 -7.501 -6.055 1.00 0.00 H new ATOM 826 N GLU A 53 15.842 -9.120 -4.124 1.00 0.00 N ATOM 827 CA GLU A 53 15.101 -10.124 -3.369 1.00 0.00 C ATOM 828 C GLU A 53 14.782 -9.620 -1.969 1.00 0.00 C ATOM 829 O GLU A 53 14.202 -10.335 -1.152 1.00 0.00 O ATOM 830 CB GLU A 53 15.939 -11.396 -3.270 1.00 0.00 C ATOM 831 CG GLU A 53 16.387 -11.926 -4.620 1.00 0.00 C ATOM 832 CD GLU A 53 17.514 -12.920 -4.500 1.00 0.00 C ATOM 833 OE1 GLU A 53 17.234 -14.120 -4.306 1.00 0.00 O ATOM 834 OE2 GLU A 53 18.684 -12.503 -4.606 1.00 0.00 O ATOM 0 H GLU A 53 16.846 -9.126 -3.943 1.00 0.00 H new ATOM 0 HA GLU A 53 14.164 -10.330 -3.886 1.00 0.00 H new ATOM 0 HB2 GLU A 53 16.817 -11.197 -2.656 1.00 0.00 H new ATOM 0 HB3 GLU A 53 15.360 -12.165 -2.759 1.00 0.00 H new ATOM 0 HG2 GLU A 53 15.542 -12.398 -5.121 1.00 0.00 H new ATOM 0 HG3 GLU A 53 16.705 -11.093 -5.247 1.00 0.00 H new ATOM 841 N HIS A 54 15.207 -8.400 -1.685 1.00 0.00 N ATOM 842 CA HIS A 54 14.945 -7.771 -0.401 1.00 0.00 C ATOM 843 C HIS A 54 14.275 -6.436 -0.645 1.00 0.00 C ATOM 844 O HIS A 54 14.591 -5.760 -1.617 1.00 0.00 O ATOM 845 CB HIS A 54 16.240 -7.548 0.398 1.00 0.00 C ATOM 846 CG HIS A 54 16.984 -8.804 0.771 1.00 0.00 C ATOM 847 ND1 HIS A 54 16.668 -10.110 0.603 1.00 0.00 N flip ATOM 848 CD2 HIS A 54 18.211 -8.793 1.404 1.00 0.00 C flip ATOM 849 CE1 HIS A 54 17.693 -10.853 1.130 1.00 0.00 C flip ATOM 850 NE2 HIS A 54 18.612 -10.036 1.608 1.00 0.00 N flip ATOM 0 H HIS A 54 15.740 -7.821 -2.334 1.00 0.00 H new ATOM 0 HA HIS A 54 14.302 -8.431 0.182 1.00 0.00 H new ATOM 0 HB2 HIS A 54 16.904 -6.911 -0.186 1.00 0.00 H new ATOM 0 HB3 HIS A 54 15.997 -7.004 1.310 1.00 0.00 H new ATOM 0 HD1 HIS A 54 15.822 -10.474 0.165 1.00 0.00 H new ATOM 0 HD2 HIS A 54 18.758 -7.906 1.688 1.00 0.00 H new ATOM 0 HE1 HIS A 54 17.740 -11.932 1.150 1.00 0.00 H new ATOM 859 N PHE A 55 13.353 -6.065 0.213 1.00 0.00 N ATOM 860 CA PHE A 55 12.668 -4.792 0.077 1.00 0.00 C ATOM 861 C PHE A 55 12.941 -3.914 1.288 1.00 0.00 C ATOM 862 O PHE A 55 12.496 -4.204 2.401 1.00 0.00 O ATOM 863 CB PHE A 55 11.160 -4.993 -0.147 1.00 0.00 C ATOM 864 CG PHE A 55 10.501 -5.975 0.788 1.00 0.00 C ATOM 865 CD1 PHE A 55 10.540 -7.334 0.525 1.00 0.00 C ATOM 866 CD2 PHE A 55 9.828 -5.535 1.916 1.00 0.00 C ATOM 867 CE1 PHE A 55 9.925 -8.236 1.370 1.00 0.00 C ATOM 868 CE2 PHE A 55 9.213 -6.433 2.767 1.00 0.00 C ATOM 869 CZ PHE A 55 9.262 -7.785 2.493 1.00 0.00 C ATOM 0 H PHE A 55 13.057 -6.623 1.014 1.00 0.00 H new ATOM 0 HA PHE A 55 13.058 -4.283 -0.804 1.00 0.00 H new ATOM 0 HB2 PHE A 55 10.662 -4.029 -0.047 1.00 0.00 H new ATOM 0 HB3 PHE A 55 11.002 -5.328 -1.172 1.00 0.00 H new ATOM 0 HD1 PHE A 55 11.058 -7.693 -0.352 1.00 0.00 H new ATOM 0 HD2 PHE A 55 9.784 -4.478 2.133 1.00 0.00 H new ATOM 0 HE1 PHE A 55 9.963 -9.293 1.152 1.00 0.00 H new ATOM 0 HE2 PHE A 55 8.695 -6.078 3.645 1.00 0.00 H new ATOM 0 HZ PHE A 55 8.782 -8.489 3.157 1.00 0.00 H new ATOM 879 N SER A 56 13.704 -2.857 1.073 1.00 0.00 N ATOM 880 CA SER A 56 14.065 -1.952 2.145 1.00 0.00 C ATOM 881 C SER A 56 13.385 -0.606 1.956 1.00 0.00 C ATOM 882 O SER A 56 13.282 -0.097 0.838 1.00 0.00 O ATOM 883 CB SER A 56 15.583 -1.779 2.207 1.00 0.00 C ATOM 884 OG SER A 56 15.973 -0.943 3.288 1.00 0.00 O ATOM 0 H SER A 56 14.086 -2.605 0.161 1.00 0.00 H new ATOM 0 HA SER A 56 13.726 -2.380 3.088 1.00 0.00 H new ATOM 0 HB2 SER A 56 16.056 -2.755 2.313 1.00 0.00 H new ATOM 0 HB3 SER A 56 15.939 -1.352 1.270 1.00 0.00 H new ATOM 0 HG SER A 56 16.949 -0.856 3.298 1.00 0.00 H new ATOM 890 N MET A 57 12.924 -0.052 3.060 1.00 0.00 N ATOM 891 CA MET A 57 12.265 1.245 3.074 1.00 0.00 C ATOM 892 C MET A 57 13.113 2.215 3.882 1.00 0.00 C ATOM 893 O MET A 57 13.794 1.801 4.824 1.00 0.00 O ATOM 894 CB MET A 57 10.870 1.119 3.703 1.00 0.00 C ATOM 895 CG MET A 57 9.926 0.191 2.950 1.00 0.00 C ATOM 896 SD MET A 57 9.110 0.988 1.555 1.00 0.00 S ATOM 897 CE MET A 57 8.017 2.121 2.412 1.00 0.00 C ATOM 0 H MET A 57 12.995 -0.489 3.979 1.00 0.00 H new ATOM 0 HA MET A 57 12.153 1.613 2.054 1.00 0.00 H new ATOM 0 HB2 MET A 57 10.977 0.758 4.726 1.00 0.00 H new ATOM 0 HB3 MET A 57 10.419 2.110 3.760 1.00 0.00 H new ATOM 0 HG2 MET A 57 10.486 -0.672 2.590 1.00 0.00 H new ATOM 0 HG3 MET A 57 9.169 -0.184 3.639 1.00 0.00 H new ATOM 0 HE1 MET A 57 6.981 1.864 2.192 1.00 0.00 H new ATOM 0 HE2 MET A 57 8.188 2.049 3.486 1.00 0.00 H new ATOM 0 HE3 MET A 57 8.216 3.140 2.080 1.00 0.00 H new ATOM 907 N ASP A 58 13.105 3.491 3.518 1.00 0.00 N ATOM 908 CA ASP A 58 13.874 4.473 4.273 1.00 0.00 C ATOM 909 C ASP A 58 12.986 5.104 5.342 1.00 0.00 C ATOM 910 O ASP A 58 11.831 5.439 5.077 1.00 0.00 O ATOM 911 CB ASP A 58 14.423 5.551 3.326 1.00 0.00 C ATOM 912 CG ASP A 58 15.491 6.419 3.965 1.00 0.00 C ATOM 913 OD1 ASP A 58 15.144 7.425 4.624 1.00 0.00 O ATOM 914 OD2 ASP A 58 16.689 6.102 3.803 1.00 0.00 O ATOM 0 H ASP A 58 12.587 3.865 2.723 1.00 0.00 H new ATOM 0 HA ASP A 58 14.716 3.979 4.759 1.00 0.00 H new ATOM 0 HB2 ASP A 58 14.837 5.070 2.439 1.00 0.00 H new ATOM 0 HB3 ASP A 58 13.601 6.184 2.991 1.00 0.00 H new ATOM 919 N PRO A 59 13.516 5.304 6.554 1.00 0.00 N ATOM 920 CA PRO A 59 12.745 5.859 7.665 1.00 0.00 C ATOM 921 C PRO A 59 12.548 7.365 7.544 1.00 0.00 C ATOM 922 O PRO A 59 11.542 7.910 7.996 1.00 0.00 O ATOM 923 CB PRO A 59 13.593 5.530 8.905 1.00 0.00 C ATOM 924 CG PRO A 59 14.683 4.629 8.423 1.00 0.00 C ATOM 925 CD PRO A 59 14.877 4.952 6.971 1.00 0.00 C ATOM 0 HA PRO A 59 11.739 5.441 7.700 1.00 0.00 H new ATOM 0 HB2 PRO A 59 14.003 6.436 9.351 1.00 0.00 H new ATOM 0 HB3 PRO A 59 12.992 5.042 9.672 1.00 0.00 H new ATOM 0 HG2 PRO A 59 15.602 4.794 8.985 1.00 0.00 H new ATOM 0 HG3 PRO A 59 14.411 3.582 8.557 1.00 0.00 H new ATOM 0 HD2 PRO A 59 15.575 5.777 6.826 1.00 0.00 H new ATOM 0 HD3 PRO A 59 15.268 4.102 6.412 1.00 0.00 H new ATOM 933 N ARG A 60 13.505 8.027 6.910 1.00 0.00 N ATOM 934 CA ARG A 60 13.484 9.477 6.790 1.00 0.00 C ATOM 935 C ARG A 60 12.467 9.913 5.748 1.00 0.00 C ATOM 936 O ARG A 60 11.761 10.909 5.933 1.00 0.00 O ATOM 937 CB ARG A 60 14.875 9.987 6.432 1.00 0.00 C ATOM 938 CG ARG A 60 15.915 9.662 7.487 1.00 0.00 C ATOM 939 CD ARG A 60 17.315 9.747 6.919 1.00 0.00 C ATOM 940 NE ARG A 60 17.533 8.767 5.856 1.00 0.00 N ATOM 941 CZ ARG A 60 18.713 8.555 5.282 1.00 0.00 C ATOM 942 NH1 ARG A 60 19.785 9.226 5.688 1.00 0.00 N ATOM 943 NH2 ARG A 60 18.827 7.656 4.318 1.00 0.00 N ATOM 0 H ARG A 60 14.309 7.580 6.469 1.00 0.00 H new ATOM 0 HA ARG A 60 13.189 9.906 7.748 1.00 0.00 H new ATOM 0 HB2 ARG A 60 15.182 9.552 5.481 1.00 0.00 H new ATOM 0 HB3 ARG A 60 14.835 11.067 6.290 1.00 0.00 H new ATOM 0 HG2 ARG A 60 15.817 10.354 8.324 1.00 0.00 H new ATOM 0 HG3 ARG A 60 15.739 8.660 7.879 1.00 0.00 H new ATOM 0 HD2 ARG A 60 17.488 10.750 6.529 1.00 0.00 H new ATOM 0 HD3 ARG A 60 18.041 9.585 7.716 1.00 0.00 H new ATOM 0 HE ARG A 60 16.736 8.216 5.537 1.00 0.00 H new ATOM 0 HH11 ARG A 60 19.705 9.907 6.443 1.00 0.00 H new ATOM 0 HH12 ARG A 60 20.689 9.060 5.245 1.00 0.00 H new ATOM 0 HH21 ARG A 60 18.010 7.126 4.016 1.00 0.00 H new ATOM 0 HH22 ARG A 60 19.732 7.493 3.877 1.00 0.00 H new ATOM 957 N GLU A 61 12.375 9.159 4.659 1.00 0.00 N ATOM 958 CA GLU A 61 11.395 9.456 3.627 1.00 0.00 C ATOM 959 C GLU A 61 9.990 9.185 4.139 1.00 0.00 C ATOM 960 O GLU A 61 9.060 9.919 3.818 1.00 0.00 O ATOM 961 CB GLU A 61 11.657 8.658 2.351 1.00 0.00 C ATOM 962 CG GLU A 61 12.887 9.124 1.592 1.00 0.00 C ATOM 963 CD GLU A 61 12.849 8.729 0.130 1.00 0.00 C ATOM 964 OE1 GLU A 61 13.318 7.624 -0.207 1.00 0.00 O ATOM 965 OE2 GLU A 61 12.346 9.528 -0.692 1.00 0.00 O ATOM 0 H GLU A 61 12.961 8.346 4.471 1.00 0.00 H new ATOM 0 HA GLU A 61 11.487 10.514 3.380 1.00 0.00 H new ATOM 0 HB2 GLU A 61 11.774 7.605 2.607 1.00 0.00 H new ATOM 0 HB3 GLU A 61 10.787 8.733 1.699 1.00 0.00 H new ATOM 0 HG2 GLU A 61 12.970 10.208 1.670 1.00 0.00 H new ATOM 0 HG3 GLU A 61 13.778 8.702 2.056 1.00 0.00 H new ATOM 972 N GLN A 62 9.841 8.143 4.950 1.00 0.00 N ATOM 973 CA GLN A 62 8.555 7.846 5.566 1.00 0.00 C ATOM 974 C GLN A 62 8.157 8.954 6.531 1.00 0.00 C ATOM 975 O GLN A 62 7.012 9.398 6.531 1.00 0.00 O ATOM 976 CB GLN A 62 8.586 6.503 6.298 1.00 0.00 C ATOM 977 CG GLN A 62 8.723 5.305 5.373 1.00 0.00 C ATOM 978 CD GLN A 62 8.614 3.976 6.100 1.00 0.00 C ATOM 979 OE1 GLN A 62 9.220 2.990 5.697 1.00 0.00 O ATOM 980 NE2 GLN A 62 7.829 3.934 7.168 1.00 0.00 N ATOM 0 H GLN A 62 10.590 7.495 5.194 1.00 0.00 H new ATOM 0 HA GLN A 62 7.814 7.784 4.769 1.00 0.00 H new ATOM 0 HB2 GLN A 62 9.417 6.503 7.003 1.00 0.00 H new ATOM 0 HB3 GLN A 62 7.672 6.397 6.882 1.00 0.00 H new ATOM 0 HG2 GLN A 62 7.951 5.357 4.605 1.00 0.00 H new ATOM 0 HG3 GLN A 62 9.685 5.356 4.863 1.00 0.00 H new ATOM 0 HE21 GLN A 62 7.340 4.775 7.475 1.00 0.00 H new ATOM 0 HE22 GLN A 62 7.714 3.061 7.683 1.00 0.00 H new ATOM 989 N LEU A 63 9.110 9.404 7.340 1.00 0.00 N ATOM 990 CA LEU A 63 8.873 10.499 8.275 1.00 0.00 C ATOM 991 C LEU A 63 8.411 11.750 7.532 1.00 0.00 C ATOM 992 O LEU A 63 7.448 12.405 7.932 1.00 0.00 O ATOM 993 CB LEU A 63 10.146 10.801 9.071 1.00 0.00 C ATOM 994 CG LEU A 63 10.019 11.911 10.115 1.00 0.00 C ATOM 995 CD1 LEU A 63 9.012 11.529 11.190 1.00 0.00 C ATOM 996 CD2 LEU A 63 11.374 12.209 10.735 1.00 0.00 C ATOM 0 H LEU A 63 10.057 9.026 7.367 1.00 0.00 H new ATOM 0 HA LEU A 63 8.087 10.196 8.966 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.465 9.888 9.573 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.936 11.073 8.371 1.00 0.00 H new ATOM 0 HG LEU A 63 9.658 12.811 9.617 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.938 12.333 11.922 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.036 11.364 10.733 1.00 0.00 H new ATOM 0 HD13 LEU A 63 9.339 10.616 11.687 1.00 0.00 H new ATOM 0 HD21 LEU A 63 11.269 13.001 11.476 1.00 0.00 H new ATOM 0 HD22 LEU A 63 11.759 11.310 11.216 1.00 0.00 H new ATOM 0 HD23 LEU A 63 12.067 12.530 9.957 1.00 0.00 H new ATOM 1008 N THR A 64 9.093 12.061 6.440 1.00 0.00 N ATOM 1009 CA THR A 64 8.754 13.221 5.635 1.00 0.00 C ATOM 1010 C THR A 64 7.412 13.012 4.924 1.00 0.00 C ATOM 1011 O THR A 64 6.641 13.954 4.743 1.00 0.00 O ATOM 1012 CB THR A 64 9.858 13.504 4.598 1.00 0.00 C ATOM 1013 OG1 THR A 64 11.141 13.509 5.242 1.00 0.00 O ATOM 1014 CG2 THR A 64 9.636 14.844 3.911 1.00 0.00 C ATOM 0 H THR A 64 9.887 11.523 6.092 1.00 0.00 H new ATOM 0 HA THR A 64 8.669 14.080 6.301 1.00 0.00 H new ATOM 0 HB THR A 64 9.823 12.717 3.845 1.00 0.00 H new ATOM 0 HG1 THR A 64 11.432 12.586 5.398 1.00 0.00 H new ATOM 0 HG21 THR A 64 10.430 15.017 3.185 1.00 0.00 H new ATOM 0 HG22 THR A 64 8.673 14.836 3.400 1.00 0.00 H new ATOM 0 HG23 THR A 64 9.645 15.640 4.655 1.00 0.00 H new ATOM 1022 N ALA A 65 7.132 11.768 4.540 1.00 0.00 N ATOM 1023 CA ALA A 65 5.870 11.433 3.892 1.00 0.00 C ATOM 1024 C ALA A 65 4.709 11.600 4.859 1.00 0.00 C ATOM 1025 O ALA A 65 3.688 12.186 4.510 1.00 0.00 O ATOM 1026 CB ALA A 65 5.905 10.014 3.346 1.00 0.00 C ATOM 0 H ALA A 65 7.763 10.977 4.667 1.00 0.00 H new ATOM 0 HA ALA A 65 5.725 12.119 3.058 1.00 0.00 H new ATOM 0 HB1 ALA A 65 4.953 9.785 2.867 1.00 0.00 H new ATOM 0 HB2 ALA A 65 6.710 9.925 2.616 1.00 0.00 H new ATOM 0 HB3 ALA A 65 6.077 9.314 4.163 1.00 0.00 H new ATOM 1032 N VAL A 66 4.876 11.098 6.079 1.00 0.00 N ATOM 1033 CA VAL A 66 3.852 11.228 7.109 1.00 0.00 C ATOM 1034 C VAL A 66 3.642 12.698 7.465 1.00 0.00 C ATOM 1035 O VAL A 66 2.517 13.133 7.707 1.00 0.00 O ATOM 1036 CB VAL A 66 4.213 10.427 8.383 1.00 0.00 C ATOM 1037 CG1 VAL A 66 3.177 10.635 9.480 1.00 0.00 C ATOM 1038 CG2 VAL A 66 4.346 8.949 8.059 1.00 0.00 C ATOM 0 H VAL A 66 5.712 10.597 6.378 1.00 0.00 H new ATOM 0 HA VAL A 66 2.928 10.816 6.704 1.00 0.00 H new ATOM 0 HB VAL A 66 5.171 10.797 8.750 1.00 0.00 H new ATOM 0 HG11 VAL A 66 3.460 10.059 10.361 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.128 11.693 9.738 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.201 10.302 9.127 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.600 8.399 8.965 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.401 8.577 7.662 1.00 0.00 H new ATOM 0 HG23 VAL A 66 5.132 8.808 7.317 1.00 0.00 H new ATOM 1048 N LYS A 67 4.732 13.460 7.476 1.00 0.00 N ATOM 1049 CA LYS A 67 4.661 14.899 7.707 1.00 0.00 C ATOM 1050 C LYS A 67 3.812 15.579 6.637 1.00 0.00 C ATOM 1051 O LYS A 67 3.066 16.517 6.926 1.00 0.00 O ATOM 1052 CB LYS A 67 6.065 15.510 7.722 1.00 0.00 C ATOM 1053 CG LYS A 67 6.553 15.895 9.109 1.00 0.00 C ATOM 1054 CD LYS A 67 7.949 16.496 9.056 1.00 0.00 C ATOM 1055 CE LYS A 67 8.394 17.007 10.418 1.00 0.00 C ATOM 1056 NZ LYS A 67 7.583 18.171 10.867 1.00 0.00 N ATOM 0 H LYS A 67 5.676 13.104 7.327 1.00 0.00 H new ATOM 0 HA LYS A 67 4.193 15.061 8.678 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.765 14.798 7.286 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.072 16.395 7.086 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.863 16.612 9.554 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.558 15.015 9.753 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.655 15.745 8.701 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.966 17.315 8.337 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.313 16.204 11.151 1.00 0.00 H new ATOM 0 HE3 LYS A 67 9.445 17.293 10.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 8.056 18.635 11.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 7.485 18.848 10.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 6.641 17.844 11.162 1.00 0.00 H new ATOM 1070 N ASP A 68 3.927 15.097 5.405 1.00 0.00 N ATOM 1071 CA ASP A 68 3.152 15.641 4.295 1.00 0.00 C ATOM 1072 C ASP A 68 1.689 15.242 4.420 1.00 0.00 C ATOM 1073 O ASP A 68 0.800 16.079 4.293 1.00 0.00 O ATOM 1074 CB ASP A 68 3.706 15.155 2.957 1.00 0.00 C ATOM 1075 CG ASP A 68 3.038 15.834 1.775 1.00 0.00 C ATOM 1076 OD1 ASP A 68 3.172 17.072 1.640 1.00 0.00 O ATOM 1077 OD2 ASP A 68 2.382 15.134 0.977 1.00 0.00 O ATOM 0 H ASP A 68 4.549 14.330 5.149 1.00 0.00 H new ATOM 0 HA ASP A 68 3.229 16.728 4.333 1.00 0.00 H new ATOM 0 HB2 ASP A 68 4.779 15.342 2.921 1.00 0.00 H new ATOM 0 HB3 ASP A 68 3.568 14.077 2.879 1.00 0.00 H new ATOM 1082 N MET A 69 1.453 13.957 4.688 1.00 0.00 N ATOM 1083 CA MET A 69 0.093 13.443 4.875 1.00 0.00 C ATOM 1084 C MET A 69 -0.612 14.222 5.973 1.00 0.00 C ATOM 1085 O MET A 69 -1.731 14.702 5.795 1.00 0.00 O ATOM 1086 CB MET A 69 0.111 11.963 5.272 1.00 0.00 C ATOM 1087 CG MET A 69 0.875 11.064 4.325 1.00 0.00 C ATOM 1088 SD MET A 69 1.003 9.376 4.949 1.00 0.00 S ATOM 1089 CE MET A 69 2.209 8.683 3.826 1.00 0.00 C ATOM 0 H MET A 69 2.185 13.252 4.781 1.00 0.00 H new ATOM 0 HA MET A 69 -0.434 13.557 3.928 1.00 0.00 H new ATOM 0 HB2 MET A 69 0.546 11.873 6.267 1.00 0.00 H new ATOM 0 HB3 MET A 69 -0.917 11.607 5.340 1.00 0.00 H new ATOM 0 HG2 MET A 69 0.379 11.055 3.355 1.00 0.00 H new ATOM 0 HG3 MET A 69 1.875 11.469 4.168 1.00 0.00 H new ATOM 0 HE1 MET A 69 1.758 7.862 3.269 1.00 0.00 H new ATOM 0 HE2 MET A 69 2.543 9.453 3.131 1.00 0.00 H new ATOM 0 HE3 MET A 69 3.062 8.311 4.393 1.00 0.00 H new ATOM 1099 N ARG A 70 0.085 14.376 7.092 1.00 0.00 N ATOM 1100 CA ARG A 70 -0.449 15.045 8.267 1.00 0.00 C ATOM 1101 C ARG A 70 -0.827 16.483 7.937 1.00 0.00 C ATOM 1102 O ARG A 70 -1.875 16.980 8.346 1.00 0.00 O ATOM 1103 CB ARG A 70 0.608 15.024 9.373 1.00 0.00 C ATOM 1104 CG ARG A 70 0.102 15.470 10.730 1.00 0.00 C ATOM 1105 CD ARG A 70 -0.973 14.536 11.248 1.00 0.00 C ATOM 1106 NE ARG A 70 -1.200 14.714 12.676 1.00 0.00 N ATOM 1107 CZ ARG A 70 -2.300 14.315 13.307 1.00 0.00 C ATOM 1108 NH1 ARG A 70 -3.317 13.804 12.621 1.00 0.00 N ATOM 1109 NH2 ARG A 70 -2.395 14.446 14.622 1.00 0.00 N ATOM 0 H ARG A 70 1.040 14.038 7.208 1.00 0.00 H new ATOM 0 HA ARG A 70 -1.346 14.524 8.602 1.00 0.00 H new ATOM 0 HB2 ARG A 70 1.004 14.012 9.461 1.00 0.00 H new ATOM 0 HB3 ARG A 70 1.437 15.667 9.079 1.00 0.00 H new ATOM 0 HG2 ARG A 70 0.931 15.503 11.437 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -0.296 16.482 10.658 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -1.902 14.715 10.707 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -0.684 13.504 11.052 1.00 0.00 H new ATOM 0 HE ARG A 70 -0.472 15.172 13.224 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -3.255 13.717 11.607 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -4.159 13.499 13.109 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -1.624 14.853 15.151 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -3.239 14.140 15.105 1.00 0.00 H new ATOM 1123 N LYS A 71 0.035 17.127 7.172 1.00 0.00 N ATOM 1124 CA LYS A 71 -0.141 18.520 6.800 1.00 0.00 C ATOM 1125 C LYS A 71 -1.252 18.673 5.767 1.00 0.00 C ATOM 1126 O LYS A 71 -2.018 19.639 5.794 1.00 0.00 O ATOM 1127 CB LYS A 71 1.177 19.044 6.240 1.00 0.00 C ATOM 1128 CG LYS A 71 1.220 20.541 6.015 1.00 0.00 C ATOM 1129 CD LYS A 71 2.600 20.952 5.547 1.00 0.00 C ATOM 1130 CE LYS A 71 2.709 22.443 5.314 1.00 0.00 C ATOM 1131 NZ LYS A 71 4.077 22.818 4.879 1.00 0.00 N ATOM 0 H LYS A 71 0.878 16.699 6.790 1.00 0.00 H new ATOM 0 HA LYS A 71 -0.428 19.095 7.680 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.981 18.770 6.924 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.379 18.542 5.294 1.00 0.00 H new ATOM 0 HG2 LYS A 71 0.475 20.828 5.273 1.00 0.00 H new ATOM 0 HG3 LYS A 71 0.969 21.064 6.938 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.338 20.648 6.289 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.840 20.424 4.624 1.00 0.00 H new ATOM 0 HE2 LYS A 71 1.987 22.750 4.557 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.457 22.977 6.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 4.123 23.846 4.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 4.762 22.546 5.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 4.306 22.326 3.992 1.00 0.00 H new ATOM 1145 N ASN A 72 -1.336 17.708 4.861 1.00 0.00 N ATOM 1146 CA ASN A 72 -2.297 17.754 3.765 1.00 0.00 C ATOM 1147 C ASN A 72 -3.700 17.378 4.248 1.00 0.00 C ATOM 1148 O ASN A 72 -4.701 17.717 3.612 1.00 0.00 O ATOM 1149 CB ASN A 72 -1.847 16.801 2.658 1.00 0.00 C ATOM 1150 CG ASN A 72 -2.271 17.250 1.271 1.00 0.00 C ATOM 1151 OD1 ASN A 72 -3.307 17.893 1.094 1.00 0.00 O ATOM 1152 ND2 ASN A 72 -1.463 16.918 0.276 1.00 0.00 N ATOM 0 H ASN A 72 -0.745 16.877 4.864 1.00 0.00 H new ATOM 0 HA ASN A 72 -2.339 18.772 3.378 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -0.761 16.709 2.687 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -2.256 15.810 2.853 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -1.689 17.196 -0.679 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -0.614 16.385 0.465 1.00 0.00 H new ATOM 1159 N GLY A 73 -3.770 16.688 5.382 1.00 0.00 N ATOM 1160 CA GLY A 73 -5.055 16.343 5.966 1.00 0.00 C ATOM 1161 C GLY A 73 -5.353 14.858 5.900 1.00 0.00 C ATOM 1162 O GLY A 73 -6.456 14.422 6.234 1.00 0.00 O ATOM 0 H GLY A 73 -2.960 16.361 5.908 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -5.074 16.666 7.007 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -5.843 16.890 5.448 1.00 0.00 H new ATOM 1166 N TRP A 74 -4.366 14.079 5.488 1.00 0.00 N ATOM 1167 CA TRP A 74 -4.519 12.634 5.377 1.00 0.00 C ATOM 1168 C TRP A 74 -3.750 11.917 6.484 1.00 0.00 C ATOM 1169 O TRP A 74 -3.097 12.550 7.317 1.00 0.00 O ATOM 1170 CB TRP A 74 -4.022 12.138 4.013 1.00 0.00 C ATOM 1171 CG TRP A 74 -4.912 12.501 2.865 1.00 0.00 C ATOM 1172 CD1 TRP A 74 -6.253 12.266 2.762 1.00 0.00 C ATOM 1173 CD2 TRP A 74 -4.523 13.136 1.641 1.00 0.00 C ATOM 1174 NE1 TRP A 74 -6.719 12.717 1.553 1.00 0.00 N ATOM 1175 CE2 TRP A 74 -5.678 13.261 0.850 1.00 0.00 C ATOM 1176 CE3 TRP A 74 -3.312 13.619 1.143 1.00 0.00 C ATOM 1177 CZ2 TRP A 74 -5.659 13.844 -0.415 1.00 0.00 C ATOM 1178 CZ3 TRP A 74 -3.291 14.195 -0.113 1.00 0.00 C ATOM 1179 CH2 TRP A 74 -4.457 14.307 -0.878 1.00 0.00 C ATOM 0 H TRP A 74 -3.444 14.424 5.223 1.00 0.00 H new ATOM 0 HA TRP A 74 -5.581 12.408 5.477 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.028 12.547 3.831 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -3.919 11.053 4.049 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -6.859 11.794 3.521 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -7.685 12.657 1.230 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -2.408 13.544 1.729 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -6.558 13.927 -1.008 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -2.358 14.565 -0.511 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -4.408 14.768 -1.853 1.00 0.00 H new ATOM 1190 N VAL A 75 -3.850 10.595 6.492 1.00 0.00 N ATOM 1191 CA VAL A 75 -3.091 9.751 7.408 1.00 0.00 C ATOM 1192 C VAL A 75 -2.542 8.540 6.659 1.00 0.00 C ATOM 1193 O VAL A 75 -2.932 8.282 5.518 1.00 0.00 O ATOM 1194 CB VAL A 75 -3.949 9.258 8.600 1.00 0.00 C ATOM 1195 CG1 VAL A 75 -4.353 10.412 9.505 1.00 0.00 C ATOM 1196 CG2 VAL A 75 -5.180 8.519 8.103 1.00 0.00 C ATOM 0 H VAL A 75 -4.461 10.075 5.862 1.00 0.00 H new ATOM 0 HA VAL A 75 -2.278 10.358 7.806 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.340 8.569 9.185 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -4.954 10.033 10.332 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -3.459 10.896 9.898 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -4.936 11.135 8.934 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -5.770 8.181 8.955 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -5.782 9.188 7.488 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -4.873 7.658 7.510 1.00 0.00 H new ATOM 1206 N MET A 76 -1.643 7.802 7.297 1.00 0.00 N ATOM 1207 CA MET A 76 -1.056 6.615 6.684 1.00 0.00 C ATOM 1208 C MET A 76 -1.936 5.394 6.950 1.00 0.00 C ATOM 1209 O MET A 76 -2.301 5.117 8.096 1.00 0.00 O ATOM 1210 CB MET A 76 0.364 6.383 7.214 1.00 0.00 C ATOM 1211 CG MET A 76 1.058 5.175 6.598 1.00 0.00 C ATOM 1212 SD MET A 76 2.758 4.977 7.176 1.00 0.00 S ATOM 1213 CE MET A 76 2.503 4.807 8.940 1.00 0.00 C ATOM 0 H MET A 76 -1.304 8.003 8.238 1.00 0.00 H new ATOM 0 HA MET A 76 -0.996 6.772 5.607 1.00 0.00 H new ATOM 0 HB2 MET A 76 0.964 7.273 7.022 1.00 0.00 H new ATOM 0 HB3 MET A 76 0.322 6.254 8.296 1.00 0.00 H new ATOM 0 HG2 MET A 76 0.491 4.275 6.836 1.00 0.00 H new ATOM 0 HG3 MET A 76 1.057 5.275 5.513 1.00 0.00 H new ATOM 0 HE1 MET A 76 3.212 4.083 9.342 1.00 0.00 H new ATOM 0 HE2 MET A 76 2.655 5.772 9.424 1.00 0.00 H new ATOM 0 HE3 MET A 76 1.486 4.463 9.129 1.00 0.00 H new ATOM 1223 N LEU A 77 -2.278 4.674 5.889 1.00 0.00 N ATOM 1224 CA LEU A 77 -3.198 3.547 5.992 1.00 0.00 C ATOM 1225 C LEU A 77 -2.452 2.213 5.988 1.00 0.00 C ATOM 1226 O LEU A 77 -2.931 1.223 6.547 1.00 0.00 O ATOM 1227 CB LEU A 77 -4.199 3.589 4.835 1.00 0.00 C ATOM 1228 CG LEU A 77 -4.962 4.907 4.689 1.00 0.00 C ATOM 1229 CD1 LEU A 77 -5.930 4.839 3.522 1.00 0.00 C ATOM 1230 CD2 LEU A 77 -5.704 5.247 5.970 1.00 0.00 C ATOM 0 H LEU A 77 -1.932 4.850 4.946 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.729 3.630 6.940 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -3.666 3.390 3.905 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -4.920 2.782 4.968 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.236 5.696 4.493 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.463 5.786 3.435 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -5.378 4.648 2.602 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.646 4.034 3.689 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.239 6.188 5.842 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.415 4.454 6.200 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -4.991 5.344 6.789 1.00 0.00 H new ATOM 1242 N GLY A 78 -1.286 2.189 5.356 1.00 0.00 N ATOM 1243 CA GLY A 78 -0.499 0.973 5.301 1.00 0.00 C ATOM 1244 C GLY A 78 0.545 1.013 4.206 1.00 0.00 C ATOM 1245 O GLY A 78 0.941 2.093 3.760 1.00 0.00 O ATOM 0 H GLY A 78 -0.871 2.990 4.880 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -0.009 0.817 6.262 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.160 0.122 5.138 1.00 0.00 H new ATOM 1249 N ASN A 79 0.990 -0.156 3.765 1.00 0.00 N ATOM 1250 CA ASN A 79 2.001 -0.240 2.723 1.00 0.00 C ATOM 1251 C ASN A 79 1.722 -1.406 1.788 1.00 0.00 C ATOM 1252 O ASN A 79 1.000 -2.342 2.138 1.00 0.00 O ATOM 1253 CB ASN A 79 3.415 -0.361 3.309 1.00 0.00 C ATOM 1254 CG ASN A 79 3.587 -1.513 4.283 1.00 0.00 C ATOM 1255 OD1 ASN A 79 3.890 -2.638 3.886 1.00 0.00 O ATOM 1256 ND2 ASN A 79 3.425 -1.233 5.568 1.00 0.00 N ATOM 0 H ASN A 79 0.666 -1.058 4.113 1.00 0.00 H new ATOM 0 HA ASN A 79 1.951 0.688 2.154 1.00 0.00 H new ATOM 0 HB2 ASN A 79 4.126 -0.481 2.492 1.00 0.00 H new ATOM 0 HB3 ASN A 79 3.667 0.570 3.816 1.00 0.00 H new ATOM 0 HD21 ASN A 79 3.552 -1.963 6.269 1.00 0.00 H new ATOM 0 HD22 ASN A 79 3.174 -0.287 5.856 1.00 0.00 H new ATOM 1263 N PHE A 80 2.300 -1.340 0.604 1.00 0.00 N ATOM 1264 CA PHE A 80 2.073 -2.353 -0.418 1.00 0.00 C ATOM 1265 C PHE A 80 3.387 -2.998 -0.843 1.00 0.00 C ATOM 1266 O PHE A 80 4.425 -2.336 -0.903 1.00 0.00 O ATOM 1267 CB PHE A 80 1.352 -1.749 -1.636 1.00 0.00 C ATOM 1268 CG PHE A 80 2.114 -0.649 -2.334 1.00 0.00 C ATOM 1269 CD1 PHE A 80 2.005 0.668 -1.914 1.00 0.00 C ATOM 1270 CD2 PHE A 80 2.932 -0.937 -3.418 1.00 0.00 C ATOM 1271 CE1 PHE A 80 2.698 1.676 -2.563 1.00 0.00 C ATOM 1272 CE2 PHE A 80 3.626 0.066 -4.067 1.00 0.00 C ATOM 1273 CZ PHE A 80 3.508 1.373 -3.638 1.00 0.00 C ATOM 0 H PHE A 80 2.934 -0.593 0.322 1.00 0.00 H new ATOM 0 HA PHE A 80 1.435 -3.126 0.011 1.00 0.00 H new ATOM 0 HB2 PHE A 80 1.149 -2.544 -2.353 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.387 -1.357 -1.313 1.00 0.00 H new ATOM 0 HD1 PHE A 80 1.373 0.910 -1.072 1.00 0.00 H new ATOM 0 HD2 PHE A 80 3.027 -1.958 -3.758 1.00 0.00 H new ATOM 0 HE1 PHE A 80 2.605 2.698 -2.228 1.00 0.00 H new ATOM 0 HE2 PHE A 80 4.260 -0.172 -4.909 1.00 0.00 H new ATOM 0 HZ PHE A 80 4.050 2.158 -4.144 1.00 0.00 H new ATOM 1283 N HIS A 81 3.336 -4.300 -1.096 1.00 0.00 N ATOM 1284 CA HIS A 81 4.498 -5.055 -1.558 1.00 0.00 C ATOM 1285 C HIS A 81 4.166 -5.706 -2.896 1.00 0.00 C ATOM 1286 O HIS A 81 3.090 -6.283 -3.059 1.00 0.00 O ATOM 1287 CB HIS A 81 4.892 -6.149 -0.549 1.00 0.00 C ATOM 1288 CG HIS A 81 5.210 -5.659 0.837 1.00 0.00 C ATOM 1289 ND1 HIS A 81 5.506 -6.508 1.878 1.00 0.00 N ATOM 1290 CD2 HIS A 81 5.255 -4.409 1.358 1.00 0.00 C ATOM 1291 CE1 HIS A 81 5.711 -5.807 2.975 1.00 0.00 C ATOM 1292 NE2 HIS A 81 5.564 -4.526 2.691 1.00 0.00 N ATOM 0 H HIS A 81 2.492 -4.862 -0.988 1.00 0.00 H new ATOM 0 HA HIS A 81 5.337 -4.367 -1.662 1.00 0.00 H new ATOM 0 HB2 HIS A 81 4.078 -6.871 -0.484 1.00 0.00 H new ATOM 0 HB3 HIS A 81 5.760 -6.682 -0.936 1.00 0.00 H new ATOM 0 HD1 HIS A 81 5.559 -7.524 1.811 1.00 0.00 H new ATOM 0 HD2 HIS A 81 5.080 -3.488 0.822 1.00 0.00 H new ATOM 0 HE1 HIS A 81 5.958 -6.213 3.945 1.00 0.00 H new ATOM 0 HE2 HIS A 81 5.663 -3.754 3.350 1.00 0.00 H new ATOM 1301 N SER A 82 5.075 -5.618 -3.850 1.00 0.00 N ATOM 1302 CA SER A 82 4.831 -6.174 -5.175 1.00 0.00 C ATOM 1303 C SER A 82 5.791 -7.323 -5.474 1.00 0.00 C ATOM 1304 O SER A 82 6.928 -7.334 -5.000 1.00 0.00 O ATOM 1305 CB SER A 82 4.960 -5.075 -6.230 1.00 0.00 C ATOM 1306 OG SER A 82 6.184 -4.373 -6.090 1.00 0.00 O ATOM 0 H SER A 82 5.985 -5.170 -3.737 1.00 0.00 H new ATOM 0 HA SER A 82 3.818 -6.574 -5.202 1.00 0.00 H new ATOM 0 HB2 SER A 82 4.901 -5.514 -7.226 1.00 0.00 H new ATOM 0 HB3 SER A 82 4.126 -4.379 -6.139 1.00 0.00 H new ATOM 0 HG SER A 82 6.196 -3.905 -5.229 1.00 0.00 H new ATOM 1312 N HIS A 83 5.324 -8.304 -6.242 1.00 0.00 N ATOM 1313 CA HIS A 83 6.164 -9.427 -6.641 1.00 0.00 C ATOM 1314 C HIS A 83 5.968 -9.733 -8.124 1.00 0.00 C ATOM 1315 O HIS A 83 4.846 -9.666 -8.624 1.00 0.00 O ATOM 1316 CB HIS A 83 5.836 -10.663 -5.797 1.00 0.00 C ATOM 1317 CG HIS A 83 6.371 -10.589 -4.403 1.00 0.00 C ATOM 1318 ND1 HIS A 83 5.575 -10.527 -3.278 1.00 0.00 N ATOM 1319 CD2 HIS A 83 7.644 -10.561 -3.961 1.00 0.00 C ATOM 1320 CE1 HIS A 83 6.346 -10.457 -2.204 1.00 0.00 C ATOM 1321 NE2 HIS A 83 7.605 -10.477 -2.594 1.00 0.00 N ATOM 0 H HIS A 83 4.369 -8.343 -6.599 1.00 0.00 H new ATOM 0 HA HIS A 83 7.207 -9.158 -6.474 1.00 0.00 H new ATOM 0 HB2 HIS A 83 4.754 -10.790 -5.757 1.00 0.00 H new ATOM 0 HB3 HIS A 83 6.242 -11.547 -6.288 1.00 0.00 H new ATOM 0 HD2 HIS A 83 8.533 -10.598 -4.573 1.00 0.00 H new ATOM 0 HE1 HIS A 83 6.002 -10.394 -1.182 1.00 0.00 H new ATOM 0 HE2 HIS A 83 8.417 -10.437 -1.979 1.00 0.00 H new ATOM 1330 N PRO A 84 7.051 -10.090 -8.844 1.00 0.00 N ATOM 1331 CA PRO A 84 7.006 -10.296 -10.293 1.00 0.00 C ATOM 1332 C PRO A 84 6.571 -11.706 -10.703 1.00 0.00 C ATOM 1333 O PRO A 84 5.591 -11.873 -11.424 1.00 0.00 O ATOM 1334 CB PRO A 84 8.460 -10.046 -10.736 1.00 0.00 C ATOM 1335 CG PRO A 84 9.253 -9.802 -9.485 1.00 0.00 C ATOM 1336 CD PRO A 84 8.409 -10.277 -8.333 1.00 0.00 C ATOM 0 HA PRO A 84 6.270 -9.638 -10.756 1.00 0.00 H new ATOM 0 HB2 PRO A 84 8.852 -10.904 -11.282 1.00 0.00 H new ATOM 0 HB3 PRO A 84 8.519 -9.188 -11.406 1.00 0.00 H new ATOM 0 HG2 PRO A 84 10.200 -10.340 -9.517 1.00 0.00 H new ATOM 0 HG3 PRO A 84 9.491 -8.744 -9.379 1.00 0.00 H new ATOM 0 HD2 PRO A 84 8.610 -11.319 -8.084 1.00 0.00 H new ATOM 0 HD3 PRO A 84 8.588 -9.693 -7.430 1.00 0.00 H new ATOM 1344 N ALA A 85 7.291 -12.721 -10.229 1.00 0.00 N ATOM 1345 CA ALA A 85 7.021 -14.100 -10.630 1.00 0.00 C ATOM 1346 C ALA A 85 6.238 -14.847 -9.555 1.00 0.00 C ATOM 1347 O ALA A 85 6.274 -16.077 -9.479 1.00 0.00 O ATOM 1348 CB ALA A 85 8.323 -14.821 -10.933 1.00 0.00 C ATOM 0 H ALA A 85 8.062 -12.615 -9.570 1.00 0.00 H new ATOM 0 HA ALA A 85 6.409 -14.076 -11.532 1.00 0.00 H new ATOM 0 HB1 ALA A 85 8.110 -15.848 -11.231 1.00 0.00 H new ATOM 0 HB2 ALA A 85 8.843 -14.309 -11.743 1.00 0.00 H new ATOM 0 HB3 ALA A 85 8.952 -14.825 -10.043 1.00 0.00 H new ATOM 1354 N THR A 86 5.518 -14.100 -8.738 1.00 0.00 N ATOM 1355 CA THR A 86 4.726 -14.685 -7.667 1.00 0.00 C ATOM 1356 C THR A 86 3.386 -13.964 -7.532 1.00 0.00 C ATOM 1357 O THR A 86 3.268 -12.791 -7.891 1.00 0.00 O ATOM 1358 CB THR A 86 5.492 -14.640 -6.326 1.00 0.00 C ATOM 1359 OG1 THR A 86 6.500 -13.619 -6.376 1.00 0.00 O ATOM 1360 CG2 THR A 86 6.138 -15.983 -6.020 1.00 0.00 C ATOM 0 H THR A 86 5.464 -13.083 -8.795 1.00 0.00 H new ATOM 0 HA THR A 86 4.538 -15.728 -7.921 1.00 0.00 H new ATOM 0 HB THR A 86 4.779 -14.413 -5.533 1.00 0.00 H new ATOM 0 HG1 THR A 86 6.759 -13.370 -5.464 1.00 0.00 H new ATOM 0 HG21 THR A 86 6.670 -15.923 -5.071 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.367 -16.751 -5.956 1.00 0.00 H new ATOM 0 HG23 THR A 86 6.840 -16.239 -6.814 1.00 0.00 H new ATOM 1368 N PRO A 87 2.363 -14.663 -7.019 1.00 0.00 N ATOM 1369 CA PRO A 87 1.023 -14.111 -6.874 1.00 0.00 C ATOM 1370 C PRO A 87 0.826 -13.383 -5.546 1.00 0.00 C ATOM 1371 O PRO A 87 1.777 -13.162 -4.792 1.00 0.00 O ATOM 1372 CB PRO A 87 0.145 -15.360 -6.947 1.00 0.00 C ATOM 1373 CG PRO A 87 0.976 -16.446 -6.349 1.00 0.00 C ATOM 1374 CD PRO A 87 2.422 -16.060 -6.554 1.00 0.00 C ATOM 0 HA PRO A 87 0.796 -13.359 -7.629 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -0.784 -15.223 -6.394 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -0.128 -15.592 -7.976 1.00 0.00 H new ATOM 0 HG2 PRO A 87 0.754 -16.561 -5.288 1.00 0.00 H new ATOM 0 HG3 PRO A 87 0.761 -17.403 -6.825 1.00 0.00 H new ATOM 0 HD2 PRO A 87 2.992 -16.148 -5.629 1.00 0.00 H new ATOM 0 HD3 PRO A 87 2.905 -16.704 -7.289 1.00 0.00 H new ATOM 1382 N ALA A 88 -0.418 -13.011 -5.268 1.00 0.00 N ATOM 1383 CA ALA A 88 -0.754 -12.343 -4.023 1.00 0.00 C ATOM 1384 C ALA A 88 -0.784 -13.355 -2.886 1.00 0.00 C ATOM 1385 O ALA A 88 -1.818 -13.958 -2.593 1.00 0.00 O ATOM 1386 CB ALA A 88 -2.089 -11.617 -4.148 1.00 0.00 C ATOM 0 H ALA A 88 -1.211 -13.163 -5.892 1.00 0.00 H new ATOM 0 HA ALA A 88 0.009 -11.597 -3.802 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -2.324 -11.123 -3.205 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -2.026 -10.873 -4.942 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -2.873 -12.336 -4.386 1.00 0.00 H new ATOM 1392 N ARG A 89 0.371 -13.566 -2.279 1.00 0.00 N ATOM 1393 CA ARG A 89 0.516 -14.552 -1.224 1.00 0.00 C ATOM 1394 C ARG A 89 1.326 -13.975 -0.073 1.00 0.00 C ATOM 1395 O ARG A 89 2.189 -13.118 -0.285 1.00 0.00 O ATOM 1396 CB ARG A 89 1.240 -15.793 -1.751 1.00 0.00 C ATOM 1397 CG ARG A 89 2.708 -15.530 -2.048 1.00 0.00 C ATOM 1398 CD ARG A 89 3.529 -16.803 -2.088 1.00 0.00 C ATOM 1399 NE ARG A 89 4.961 -16.519 -1.960 1.00 0.00 N ATOM 1400 CZ ARG A 89 5.924 -17.437 -2.078 1.00 0.00 C ATOM 1401 NH1 ARG A 89 5.618 -18.704 -2.328 1.00 0.00 N ATOM 1402 NH2 ARG A 89 7.196 -17.084 -1.931 1.00 0.00 N ATOM 0 H ARG A 89 1.229 -13.062 -2.502 1.00 0.00 H new ATOM 0 HA ARG A 89 -0.481 -14.825 -0.878 1.00 0.00 H new ATOM 0 HB2 ARG A 89 1.159 -16.595 -1.018 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.746 -16.140 -2.658 1.00 0.00 H new ATOM 0 HG2 ARG A 89 2.795 -15.015 -3.005 1.00 0.00 H new ATOM 0 HG3 ARG A 89 3.115 -14.863 -1.288 1.00 0.00 H new ATOM 0 HD2 ARG A 89 3.214 -17.466 -1.282 1.00 0.00 H new ATOM 0 HD3 ARG A 89 3.343 -17.329 -3.025 1.00 0.00 H new ATOM 0 HE ARG A 89 5.241 -15.557 -1.768 1.00 0.00 H new ATOM 0 HH11 ARG A 89 4.642 -18.982 -2.431 1.00 0.00 H new ATOM 0 HH12 ARG A 89 6.359 -19.400 -2.417 1.00 0.00 H new ATOM 0 HH21 ARG A 89 7.436 -16.114 -1.728 1.00 0.00 H new ATOM 0 HH22 ARG A 89 7.933 -17.783 -2.021 1.00 0.00 H new ATOM 1416 N PRO A 90 1.061 -14.424 1.157 1.00 0.00 N ATOM 1417 CA PRO A 90 1.931 -14.142 2.289 1.00 0.00 C ATOM 1418 C PRO A 90 3.236 -14.922 2.158 1.00 0.00 C ATOM 1419 O PRO A 90 3.298 -16.110 2.481 1.00 0.00 O ATOM 1420 CB PRO A 90 1.126 -14.617 3.510 1.00 0.00 C ATOM 1421 CG PRO A 90 -0.256 -14.877 3.003 1.00 0.00 C ATOM 1422 CD PRO A 90 -0.106 -15.220 1.550 1.00 0.00 C ATOM 0 HA PRO A 90 2.207 -13.090 2.361 1.00 0.00 H new ATOM 0 HB2 PRO A 90 1.562 -15.519 3.940 1.00 0.00 H new ATOM 0 HB3 PRO A 90 1.120 -13.860 4.294 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -0.725 -15.695 3.550 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -0.891 -14.001 3.133 1.00 0.00 H new ATOM 0 HD2 PRO A 90 0.061 -16.287 1.400 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -0.993 -14.952 0.976 1.00 0.00 H new ATOM 1430 N SER A 91 4.257 -14.269 1.626 1.00 0.00 N ATOM 1431 CA SER A 91 5.536 -14.917 1.384 1.00 0.00 C ATOM 1432 C SER A 91 6.320 -15.061 2.685 1.00 0.00 C ATOM 1433 O SER A 91 5.953 -14.471 3.699 1.00 0.00 O ATOM 1434 CB SER A 91 6.332 -14.117 0.354 1.00 0.00 C ATOM 1435 OG SER A 91 5.583 -13.938 -0.840 1.00 0.00 O ATOM 0 H SER A 91 4.224 -13.287 1.353 1.00 0.00 H new ATOM 0 HA SER A 91 5.359 -15.917 0.989 1.00 0.00 H new ATOM 0 HB2 SER A 91 6.598 -13.145 0.770 1.00 0.00 H new ATOM 0 HB3 SER A 91 7.265 -14.634 0.129 1.00 0.00 H new ATOM 0 HG SER A 91 6.112 -13.422 -1.484 1.00 0.00 H new ATOM 1441 N ALA A 92 7.406 -15.829 2.644 1.00 0.00 N ATOM 1442 CA ALA A 92 8.185 -16.132 3.840 1.00 0.00 C ATOM 1443 C ALA A 92 8.660 -14.864 4.538 1.00 0.00 C ATOM 1444 O ALA A 92 8.588 -14.753 5.763 1.00 0.00 O ATOM 1445 CB ALA A 92 9.375 -17.012 3.485 1.00 0.00 C ATOM 0 H ALA A 92 7.767 -16.254 1.790 1.00 0.00 H new ATOM 0 HA ALA A 92 7.535 -16.669 4.531 1.00 0.00 H new ATOM 0 HB1 ALA A 92 9.948 -17.230 4.386 1.00 0.00 H new ATOM 0 HB2 ALA A 92 9.020 -17.944 3.046 1.00 0.00 H new ATOM 0 HB3 ALA A 92 10.011 -16.492 2.768 1.00 0.00 H new ATOM 1451 N GLU A 93 9.133 -13.903 3.758 1.00 0.00 N ATOM 1452 CA GLU A 93 9.654 -12.670 4.325 1.00 0.00 C ATOM 1453 C GLU A 93 8.517 -11.804 4.852 1.00 0.00 C ATOM 1454 O GLU A 93 8.572 -11.315 5.979 1.00 0.00 O ATOM 1455 CB GLU A 93 10.471 -11.904 3.283 1.00 0.00 C ATOM 1456 CG GLU A 93 11.486 -10.954 3.896 1.00 0.00 C ATOM 1457 CD GLU A 93 12.505 -11.680 4.752 1.00 0.00 C ATOM 1458 OE1 GLU A 93 12.189 -12.007 5.914 1.00 0.00 O ATOM 1459 OE2 GLU A 93 13.623 -11.943 4.260 1.00 0.00 O ATOM 0 H GLU A 93 9.167 -13.953 2.740 1.00 0.00 H new ATOM 0 HA GLU A 93 10.310 -12.924 5.158 1.00 0.00 H new ATOM 0 HB2 GLU A 93 10.991 -12.617 2.643 1.00 0.00 H new ATOM 0 HB3 GLU A 93 9.793 -11.338 2.644 1.00 0.00 H new ATOM 0 HG2 GLU A 93 12.000 -10.413 3.102 1.00 0.00 H new ATOM 0 HG3 GLU A 93 10.967 -10.212 4.503 1.00 0.00 H new ATOM 1466 N ASP A 94 7.470 -11.643 4.041 1.00 0.00 N ATOM 1467 CA ASP A 94 6.307 -10.842 4.425 1.00 0.00 C ATOM 1468 C ASP A 94 5.670 -11.390 5.699 1.00 0.00 C ATOM 1469 O ASP A 94 5.242 -10.635 6.572 1.00 0.00 O ATOM 1470 CB ASP A 94 5.256 -10.840 3.307 1.00 0.00 C ATOM 1471 CG ASP A 94 5.776 -10.293 1.995 1.00 0.00 C ATOM 1472 OD1 ASP A 94 5.695 -9.065 1.783 1.00 0.00 O ATOM 1473 OD2 ASP A 94 6.249 -11.096 1.162 1.00 0.00 O ATOM 0 H ASP A 94 7.404 -12.058 3.112 1.00 0.00 H new ATOM 0 HA ASP A 94 6.653 -9.823 4.601 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.899 -11.858 3.152 1.00 0.00 H new ATOM 0 HB3 ASP A 94 4.399 -10.247 3.625 1.00 0.00 H new ATOM 1478 N LYS A 95 5.620 -12.713 5.784 1.00 0.00 N ATOM 1479 CA LYS A 95 5.047 -13.409 6.929 1.00 0.00 C ATOM 1480 C LYS A 95 5.787 -13.038 8.214 1.00 0.00 C ATOM 1481 O LYS A 95 5.172 -12.840 9.264 1.00 0.00 O ATOM 1482 CB LYS A 95 5.125 -14.922 6.689 1.00 0.00 C ATOM 1483 CG LYS A 95 3.818 -15.668 6.916 1.00 0.00 C ATOM 1484 CD LYS A 95 3.484 -15.800 8.393 1.00 0.00 C ATOM 1485 CE LYS A 95 2.229 -16.633 8.602 1.00 0.00 C ATOM 1486 NZ LYS A 95 1.944 -16.873 10.042 1.00 0.00 N ATOM 0 H LYS A 95 5.977 -13.335 5.059 1.00 0.00 H new ATOM 0 HA LYS A 95 4.005 -13.110 7.043 1.00 0.00 H new ATOM 0 HB2 LYS A 95 5.455 -15.098 5.665 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.887 -15.342 7.346 1.00 0.00 H new ATOM 0 HG2 LYS A 95 3.009 -15.144 6.407 1.00 0.00 H new ATOM 0 HG3 LYS A 95 3.885 -16.660 6.470 1.00 0.00 H new ATOM 0 HD2 LYS A 95 4.321 -16.261 8.918 1.00 0.00 H new ATOM 0 HD3 LYS A 95 3.343 -14.810 8.826 1.00 0.00 H new ATOM 0 HE2 LYS A 95 1.379 -16.126 8.145 1.00 0.00 H new ATOM 0 HE3 LYS A 95 2.341 -17.590 8.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 1.080 -17.445 10.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 2.743 -17.380 10.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 1.810 -15.962 10.526 1.00 0.00 H new ATOM 1500 N ARG A 96 7.109 -12.951 8.126 1.00 0.00 N ATOM 1501 CA ARG A 96 7.934 -12.633 9.286 1.00 0.00 C ATOM 1502 C ARG A 96 7.881 -11.147 9.627 1.00 0.00 C ATOM 1503 O ARG A 96 7.893 -10.774 10.798 1.00 0.00 O ATOM 1504 CB ARG A 96 9.388 -13.052 9.056 1.00 0.00 C ATOM 1505 CG ARG A 96 9.560 -14.537 8.808 1.00 0.00 C ATOM 1506 CD ARG A 96 11.024 -14.943 8.879 1.00 0.00 C ATOM 1507 NE ARG A 96 11.855 -14.278 7.873 1.00 0.00 N ATOM 1508 CZ ARG A 96 13.072 -14.698 7.527 1.00 0.00 C ATOM 1509 NH1 ARG A 96 13.613 -15.753 8.129 1.00 0.00 N ATOM 1510 NH2 ARG A 96 13.752 -14.054 6.588 1.00 0.00 N ATOM 0 H ARG A 96 7.633 -13.096 7.263 1.00 0.00 H new ATOM 0 HA ARG A 96 7.527 -13.195 10.127 1.00 0.00 H new ATOM 0 HB2 ARG A 96 9.785 -12.501 8.203 1.00 0.00 H new ATOM 0 HB3 ARG A 96 9.981 -12.766 9.925 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.988 -15.100 9.546 1.00 0.00 H new ATOM 0 HG3 ARG A 96 9.156 -14.794 7.829 1.00 0.00 H new ATOM 0 HD2 ARG A 96 11.411 -14.712 9.871 1.00 0.00 H new ATOM 0 HD3 ARG A 96 11.102 -16.023 8.750 1.00 0.00 H new ATOM 0 HE ARG A 96 11.482 -13.448 7.412 1.00 0.00 H new ATOM 0 HH11 ARG A 96 13.097 -16.244 8.859 1.00 0.00 H new ATOM 0 HH12 ARG A 96 14.544 -16.071 7.861 1.00 0.00 H new ATOM 0 HH21 ARG A 96 13.344 -13.238 6.131 1.00 0.00 H new ATOM 0 HH22 ARG A 96 14.683 -14.374 6.322 1.00 0.00 H new ATOM 1524 N LEU A 97 7.803 -10.306 8.602 1.00 0.00 N ATOM 1525 CA LEU A 97 7.916 -8.863 8.782 1.00 0.00 C ATOM 1526 C LEU A 97 6.582 -8.212 9.148 1.00 0.00 C ATOM 1527 O LEU A 97 6.428 -6.996 9.030 1.00 0.00 O ATOM 1528 CB LEU A 97 8.474 -8.223 7.510 1.00 0.00 C ATOM 1529 CG LEU A 97 9.857 -8.721 7.081 1.00 0.00 C ATOM 1530 CD1 LEU A 97 10.364 -7.923 5.893 1.00 0.00 C ATOM 1531 CD2 LEU A 97 10.843 -8.645 8.239 1.00 0.00 C ATOM 0 H LEU A 97 7.662 -10.599 7.635 1.00 0.00 H new ATOM 0 HA LEU A 97 8.598 -8.694 9.616 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.773 -8.402 6.695 1.00 0.00 H new ATOM 0 HB3 LEU A 97 8.524 -7.144 7.657 1.00 0.00 H new ATOM 0 HG LEU A 97 9.766 -9.765 6.782 1.00 0.00 H new ATOM 0 HD11 LEU A 97 11.348 -8.290 5.601 1.00 0.00 H new ATOM 0 HD12 LEU A 97 9.673 -8.035 5.058 1.00 0.00 H new ATOM 0 HD13 LEU A 97 10.436 -6.870 6.166 1.00 0.00 H new ATOM 0 HD21 LEU A 97 11.818 -9.004 7.911 1.00 0.00 H new ATOM 0 HD22 LEU A 97 10.931 -7.612 8.575 1.00 0.00 H new ATOM 0 HD23 LEU A 97 10.487 -9.265 9.062 1.00 0.00 H new ATOM 1543 N ALA A 98 5.633 -9.013 9.609 1.00 0.00 N ATOM 1544 CA ALA A 98 4.351 -8.491 10.057 1.00 0.00 C ATOM 1545 C ALA A 98 4.479 -7.901 11.457 1.00 0.00 C ATOM 1546 O ALA A 98 4.297 -8.595 12.459 1.00 0.00 O ATOM 1547 CB ALA A 98 3.290 -9.583 10.027 1.00 0.00 C ATOM 0 H ALA A 98 5.726 -10.026 9.683 1.00 0.00 H new ATOM 0 HA ALA A 98 4.042 -7.697 9.377 1.00 0.00 H new ATOM 0 HB1 ALA A 98 2.338 -9.174 10.365 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.183 -9.958 9.009 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.589 -10.399 10.685 1.00 0.00 H new ATOM 1553 N PHE A 99 4.828 -6.625 11.519 1.00 0.00 N ATOM 1554 CA PHE A 99 5.050 -5.962 12.798 1.00 0.00 C ATOM 1555 C PHE A 99 4.128 -4.762 12.983 1.00 0.00 C ATOM 1556 O PHE A 99 4.039 -4.208 14.080 1.00 0.00 O ATOM 1557 CB PHE A 99 6.507 -5.506 12.927 1.00 0.00 C ATOM 1558 CG PHE A 99 7.504 -6.630 12.953 1.00 0.00 C ATOM 1559 CD1 PHE A 99 7.545 -7.515 14.021 1.00 0.00 C ATOM 1560 CD2 PHE A 99 8.410 -6.795 11.919 1.00 0.00 C ATOM 1561 CE1 PHE A 99 8.469 -8.542 14.052 1.00 0.00 C ATOM 1562 CE2 PHE A 99 9.334 -7.822 11.943 1.00 0.00 C ATOM 1563 CZ PHE A 99 9.364 -8.696 13.012 1.00 0.00 C ATOM 0 H PHE A 99 4.964 -6.028 10.703 1.00 0.00 H new ATOM 0 HA PHE A 99 4.825 -6.691 13.576 1.00 0.00 H new ATOM 0 HB2 PHE A 99 6.744 -4.844 12.094 1.00 0.00 H new ATOM 0 HB3 PHE A 99 6.613 -4.920 13.840 1.00 0.00 H new ATOM 0 HD1 PHE A 99 6.847 -7.400 14.837 1.00 0.00 H new ATOM 0 HD2 PHE A 99 8.394 -6.112 11.083 1.00 0.00 H new ATOM 0 HE1 PHE A 99 8.491 -9.224 14.889 1.00 0.00 H new ATOM 0 HE2 PHE A 99 10.032 -7.941 11.127 1.00 0.00 H new ATOM 0 HZ PHE A 99 10.086 -9.499 13.034 1.00 0.00 H new ATOM 1573 N ASP A 100 3.437 -4.360 11.924 1.00 0.00 N ATOM 1574 CA ASP A 100 2.583 -3.178 11.990 1.00 0.00 C ATOM 1575 C ASP A 100 1.304 -3.482 12.760 1.00 0.00 C ATOM 1576 O ASP A 100 0.776 -4.590 12.683 1.00 0.00 O ATOM 1577 CB ASP A 100 2.251 -2.657 10.589 1.00 0.00 C ATOM 1578 CG ASP A 100 3.464 -2.080 9.890 1.00 0.00 C ATOM 1579 OD1 ASP A 100 3.927 -0.995 10.296 1.00 0.00 O ATOM 1580 OD2 ASP A 100 3.972 -2.719 8.945 1.00 0.00 O ATOM 0 H ASP A 100 3.449 -4.828 11.018 1.00 0.00 H new ATOM 0 HA ASP A 100 3.132 -2.399 12.519 1.00 0.00 H new ATOM 0 HB2 ASP A 100 1.841 -3.469 9.989 1.00 0.00 H new ATOM 0 HB3 ASP A 100 1.478 -1.892 10.662 1.00 0.00 H new ATOM 1585 N PRO A 101 0.798 -2.508 13.533 1.00 0.00 N ATOM 1586 CA PRO A 101 -0.374 -2.701 14.384 1.00 0.00 C ATOM 1587 C PRO A 101 -1.700 -2.587 13.630 1.00 0.00 C ATOM 1588 O PRO A 101 -2.518 -3.506 13.655 1.00 0.00 O ATOM 1589 CB PRO A 101 -0.261 -1.572 15.423 1.00 0.00 C ATOM 1590 CG PRO A 101 0.985 -0.808 15.089 1.00 0.00 C ATOM 1591 CD PRO A 101 1.340 -1.153 13.672 1.00 0.00 C ATOM 0 HA PRO A 101 -0.383 -3.704 14.811 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -1.136 -0.922 15.387 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -0.208 -1.978 16.433 1.00 0.00 H new ATOM 0 HG2 PRO A 101 0.821 0.264 15.196 1.00 0.00 H new ATOM 0 HG3 PRO A 101 1.796 -1.076 15.767 1.00 0.00 H new ATOM 0 HD2 PRO A 101 0.890 -0.461 12.960 1.00 0.00 H new ATOM 0 HD3 PRO A 101 2.417 -1.127 13.505 1.00 0.00 H new ATOM 1599 N SER A 102 -1.907 -1.463 12.956 1.00 0.00 N ATOM 1600 CA SER A 102 -3.192 -1.186 12.328 1.00 0.00 C ATOM 1601 C SER A 102 -3.034 -0.896 10.840 1.00 0.00 C ATOM 1602 O SER A 102 -3.970 -0.441 10.183 1.00 0.00 O ATOM 1603 CB SER A 102 -3.845 0.007 13.024 1.00 0.00 C ATOM 1604 OG SER A 102 -3.780 -0.134 14.434 1.00 0.00 O ATOM 0 H SER A 102 -1.206 -0.733 12.831 1.00 0.00 H new ATOM 0 HA SER A 102 -3.823 -2.069 12.429 1.00 0.00 H new ATOM 0 HB2 SER A 102 -3.345 0.928 12.723 1.00 0.00 H new ATOM 0 HB3 SER A 102 -4.885 0.092 12.710 1.00 0.00 H new ATOM 0 HG SER A 102 -4.202 0.641 14.860 1.00 0.00 H new ATOM 1610 N LEU A 103 -1.853 -1.167 10.305 1.00 0.00 N ATOM 1611 CA LEU A 103 -1.586 -0.885 8.905 1.00 0.00 C ATOM 1612 C LEU A 103 -1.923 -2.094 8.049 1.00 0.00 C ATOM 1613 O LEU A 103 -1.658 -3.232 8.435 1.00 0.00 O ATOM 1614 CB LEU A 103 -0.126 -0.481 8.699 1.00 0.00 C ATOM 1615 CG LEU A 103 0.311 0.780 9.452 1.00 0.00 C ATOM 1616 CD1 LEU A 103 1.736 1.152 9.084 1.00 0.00 C ATOM 1617 CD2 LEU A 103 -0.633 1.939 9.161 1.00 0.00 C ATOM 0 H LEU A 103 -1.071 -1.578 10.815 1.00 0.00 H new ATOM 0 HA LEU A 103 -2.218 -0.051 8.600 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.511 -1.309 9.008 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.046 -0.327 7.634 1.00 0.00 H new ATOM 0 HG LEU A 103 0.272 0.568 10.521 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.030 2.050 9.628 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.405 0.333 9.347 1.00 0.00 H new ATOM 0 HD13 LEU A 103 1.798 1.341 8.012 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.303 2.823 9.706 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.631 2.150 8.092 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.642 1.674 9.476 1.00 0.00 H new ATOM 1629 N SER A 104 -2.522 -1.845 6.897 1.00 0.00 N ATOM 1630 CA SER A 104 -2.911 -2.917 5.997 1.00 0.00 C ATOM 1631 C SER A 104 -1.751 -3.295 5.078 1.00 0.00 C ATOM 1632 O SER A 104 -1.082 -2.422 4.518 1.00 0.00 O ATOM 1633 CB SER A 104 -4.128 -2.482 5.179 1.00 0.00 C ATOM 1634 OG SER A 104 -5.161 -2.011 6.033 1.00 0.00 O ATOM 0 H SER A 104 -2.750 -0.909 6.563 1.00 0.00 H new ATOM 0 HA SER A 104 -3.174 -3.797 6.584 1.00 0.00 H new ATOM 0 HB2 SER A 104 -3.841 -1.697 4.479 1.00 0.00 H new ATOM 0 HB3 SER A 104 -4.493 -3.320 4.586 1.00 0.00 H new ATOM 0 HG SER A 104 -5.931 -1.735 5.493 1.00 0.00 H new ATOM 1640 N TYR A 105 -1.497 -4.593 4.952 1.00 0.00 N ATOM 1641 CA TYR A 105 -0.456 -5.088 4.064 1.00 0.00 C ATOM 1642 C TYR A 105 -1.052 -5.466 2.715 1.00 0.00 C ATOM 1643 O TYR A 105 -1.725 -6.484 2.593 1.00 0.00 O ATOM 1644 CB TYR A 105 0.243 -6.315 4.663 1.00 0.00 C ATOM 1645 CG TYR A 105 1.101 -6.024 5.874 1.00 0.00 C ATOM 1646 CD1 TYR A 105 2.398 -5.552 5.725 1.00 0.00 C ATOM 1647 CD2 TYR A 105 0.625 -6.236 7.162 1.00 0.00 C ATOM 1648 CE1 TYR A 105 3.197 -5.301 6.821 1.00 0.00 C ATOM 1649 CE2 TYR A 105 1.420 -5.987 8.267 1.00 0.00 C ATOM 1650 CZ TYR A 105 2.705 -5.518 8.090 1.00 0.00 C ATOM 1651 OH TYR A 105 3.503 -5.268 9.181 1.00 0.00 O ATOM 0 H TYR A 105 -2.001 -5.322 5.456 1.00 0.00 H new ATOM 0 HA TYR A 105 0.277 -4.291 3.935 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -0.514 -7.049 4.939 1.00 0.00 H new ATOM 0 HB3 TYR A 105 0.866 -6.773 3.895 1.00 0.00 H new ATOM 0 HD1 TYR A 105 2.788 -5.378 4.733 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -0.382 -6.601 7.303 1.00 0.00 H new ATOM 0 HE1 TYR A 105 4.204 -4.936 6.685 1.00 0.00 H new ATOM 0 HE2 TYR A 105 1.037 -6.159 9.262 1.00 0.00 H new ATOM 0 HH TYR A 105 3.978 -4.420 9.052 1.00 0.00 H new ATOM 1661 N LEU A 106 -0.826 -4.642 1.709 1.00 0.00 N ATOM 1662 CA LEU A 106 -1.317 -4.946 0.373 1.00 0.00 C ATOM 1663 C LEU A 106 -0.243 -5.653 -0.435 1.00 0.00 C ATOM 1664 O LEU A 106 0.902 -5.208 -0.485 1.00 0.00 O ATOM 1665 CB LEU A 106 -1.779 -3.682 -0.364 1.00 0.00 C ATOM 1666 CG LEU A 106 -3.120 -3.098 0.094 1.00 0.00 C ATOM 1667 CD1 LEU A 106 -2.992 -2.416 1.448 1.00 0.00 C ATOM 1668 CD2 LEU A 106 -3.657 -2.133 -0.952 1.00 0.00 C ATOM 0 H LEU A 106 -0.311 -3.765 1.787 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.179 -5.604 0.483 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -1.012 -2.916 -0.249 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.847 -3.908 -1.428 1.00 0.00 H new ATOM 0 HG LEU A 106 -3.829 -3.918 0.207 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -3.960 -2.012 1.745 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.658 -3.141 2.190 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.266 -1.606 1.380 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.610 -1.725 -0.615 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.945 -1.320 -1.097 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.801 -2.661 -1.894 1.00 0.00 H new ATOM 1680 N ILE A 107 -0.606 -6.765 -1.049 1.00 0.00 N ATOM 1681 CA ILE A 107 0.323 -7.511 -1.878 1.00 0.00 C ATOM 1682 C ILE A 107 -0.167 -7.539 -3.322 1.00 0.00 C ATOM 1683 O ILE A 107 -1.316 -7.901 -3.591 1.00 0.00 O ATOM 1684 CB ILE A 107 0.519 -8.950 -1.348 1.00 0.00 C ATOM 1685 CG1 ILE A 107 1.073 -8.908 0.082 1.00 0.00 C ATOM 1686 CG2 ILE A 107 1.450 -9.734 -2.264 1.00 0.00 C ATOM 1687 CD1 ILE A 107 1.226 -10.270 0.727 1.00 0.00 C ATOM 0 H ILE A 107 -1.539 -7.172 -0.989 1.00 0.00 H new ATOM 0 HA ILE A 107 1.289 -7.007 -1.840 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.446 -9.456 -1.334 1.00 0.00 H new ATOM 0 HG12 ILE A 107 2.044 -8.413 0.069 1.00 0.00 H new ATOM 0 HG13 ILE A 107 0.412 -8.298 0.698 1.00 0.00 H new ATOM 0 HG21 ILE A 107 1.577 -10.745 -1.876 1.00 0.00 H new ATOM 0 HG22 ILE A 107 1.021 -9.781 -3.265 1.00 0.00 H new ATOM 0 HG23 ILE A 107 2.420 -9.238 -2.308 1.00 0.00 H new ATOM 0 HD11 ILE A 107 1.623 -10.153 1.735 1.00 0.00 H new ATOM 0 HD12 ILE A 107 0.254 -10.761 0.774 1.00 0.00 H new ATOM 0 HD13 ILE A 107 1.911 -10.878 0.136 1.00 0.00 H new ATOM 1699 N ILE A 108 0.699 -7.128 -4.241 1.00 0.00 N ATOM 1700 CA ILE A 108 0.346 -7.038 -5.653 1.00 0.00 C ATOM 1701 C ILE A 108 0.993 -8.168 -6.452 1.00 0.00 C ATOM 1702 O ILE A 108 2.202 -8.406 -6.352 1.00 0.00 O ATOM 1703 CB ILE A 108 0.776 -5.681 -6.253 1.00 0.00 C ATOM 1704 CG1 ILE A 108 0.229 -4.528 -5.404 1.00 0.00 C ATOM 1705 CG2 ILE A 108 0.291 -5.557 -7.692 1.00 0.00 C ATOM 1706 CD1 ILE A 108 0.715 -3.164 -5.842 1.00 0.00 C ATOM 0 H ILE A 108 1.658 -6.850 -4.031 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.738 -7.127 -5.718 1.00 0.00 H new ATOM 0 HB ILE A 108 1.865 -5.630 -6.251 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -0.860 -4.545 -5.443 1.00 0.00 H new ATOM 0 HG13 ILE A 108 0.513 -4.688 -4.364 1.00 0.00 H new ATOM 0 HG21 ILE A 108 0.603 -4.595 -8.099 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.719 -6.361 -8.291 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.797 -5.626 -7.717 1.00 0.00 H new ATOM 0 HD11 ILE A 108 0.286 -2.400 -5.194 1.00 0.00 H new ATOM 0 HD12 ILE A 108 1.802 -3.127 -5.776 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.408 -2.982 -6.872 1.00 0.00 H new ATOM 1718 N SER A 109 0.177 -8.854 -7.239 1.00 0.00 N ATOM 1719 CA SER A 109 0.640 -9.943 -8.084 1.00 0.00 C ATOM 1720 C SER A 109 0.893 -9.453 -9.507 1.00 0.00 C ATOM 1721 O SER A 109 -0.031 -9.018 -10.194 1.00 0.00 O ATOM 1722 CB SER A 109 -0.402 -11.067 -8.099 1.00 0.00 C ATOM 1723 OG SER A 109 -0.016 -12.126 -8.962 1.00 0.00 O ATOM 0 H SER A 109 -0.824 -8.671 -7.309 1.00 0.00 H new ATOM 0 HA SER A 109 1.578 -10.322 -7.677 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.538 -11.452 -7.088 1.00 0.00 H new ATOM 0 HB3 SER A 109 -1.364 -10.668 -8.420 1.00 0.00 H new ATOM 0 HG SER A 109 -0.765 -12.748 -9.072 1.00 0.00 H new ATOM 1729 N LEU A 110 2.144 -9.520 -9.943 1.00 0.00 N ATOM 1730 CA LEU A 110 2.491 -9.166 -11.314 1.00 0.00 C ATOM 1731 C LEU A 110 2.646 -10.425 -12.160 1.00 0.00 C ATOM 1732 O LEU A 110 2.950 -10.354 -13.350 1.00 0.00 O ATOM 1733 CB LEU A 110 3.780 -8.333 -11.369 1.00 0.00 C ATOM 1734 CG LEU A 110 3.661 -6.875 -10.896 1.00 0.00 C ATOM 1735 CD1 LEU A 110 2.516 -6.168 -11.603 1.00 0.00 C ATOM 1736 CD2 LEU A 110 3.491 -6.789 -9.384 1.00 0.00 C ATOM 0 H LEU A 110 2.934 -9.815 -9.369 1.00 0.00 H new ATOM 0 HA LEU A 110 1.680 -8.559 -11.717 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.537 -8.830 -10.762 1.00 0.00 H new ATOM 0 HB3 LEU A 110 4.145 -8.332 -12.396 1.00 0.00 H new ATOM 0 HG LEU A 110 4.592 -6.370 -11.155 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.452 -5.138 -11.252 1.00 0.00 H new ATOM 0 HD12 LEU A 110 2.693 -6.174 -12.678 1.00 0.00 H new ATOM 0 HD13 LEU A 110 1.581 -6.684 -11.386 1.00 0.00 H new ATOM 0 HD21 LEU A 110 3.410 -5.744 -9.086 1.00 0.00 H new ATOM 0 HD22 LEU A 110 2.587 -7.322 -9.089 1.00 0.00 H new ATOM 0 HD23 LEU A 110 4.354 -7.240 -8.895 1.00 0.00 H new ATOM 1748 N ALA A 111 2.422 -11.578 -11.532 1.00 0.00 N ATOM 1749 CA ALA A 111 2.528 -12.864 -12.215 1.00 0.00 C ATOM 1750 C ALA A 111 1.459 -12.988 -13.299 1.00 0.00 C ATOM 1751 O ALA A 111 1.677 -13.604 -14.345 1.00 0.00 O ATOM 1752 CB ALA A 111 2.401 -14.003 -11.217 1.00 0.00 C ATOM 0 H ALA A 111 2.165 -11.647 -10.547 1.00 0.00 H new ATOM 0 HA ALA A 111 3.508 -12.921 -12.690 1.00 0.00 H new ATOM 0 HB1 ALA A 111 2.482 -14.956 -11.740 1.00 0.00 H new ATOM 0 HB2 ALA A 111 3.196 -13.927 -10.476 1.00 0.00 H new ATOM 0 HB3 ALA A 111 1.433 -13.944 -10.718 1.00 0.00 H new ATOM 1758 N GLU A 112 0.303 -12.392 -13.036 1.00 0.00 N ATOM 1759 CA GLU A 112 -0.804 -12.384 -13.985 1.00 0.00 C ATOM 1760 C GLU A 112 -1.043 -10.959 -14.482 1.00 0.00 C ATOM 1761 O GLU A 112 -1.841 -10.221 -13.906 1.00 0.00 O ATOM 1762 CB GLU A 112 -2.075 -12.947 -13.332 1.00 0.00 C ATOM 1763 CG GLU A 112 -3.261 -13.080 -14.282 1.00 0.00 C ATOM 1764 CD GLU A 112 -3.074 -14.185 -15.300 1.00 0.00 C ATOM 1765 OE1 GLU A 112 -2.353 -13.970 -16.297 1.00 0.00 O ATOM 1766 OE2 GLU A 112 -3.644 -15.280 -15.106 1.00 0.00 O ATOM 0 H GLU A 112 0.106 -11.902 -12.163 1.00 0.00 H new ATOM 0 HA GLU A 112 -0.550 -13.018 -14.834 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -1.850 -13.927 -12.911 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -2.360 -12.301 -12.502 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -4.164 -13.274 -13.704 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -3.412 -12.134 -14.802 1.00 0.00 H new ATOM 1773 N PRO A 113 -0.330 -10.537 -15.539 1.00 0.00 N ATOM 1774 CA PRO A 113 -0.376 -9.154 -16.029 1.00 0.00 C ATOM 1775 C PRO A 113 -1.704 -8.803 -16.689 1.00 0.00 C ATOM 1776 O PRO A 113 -1.992 -7.632 -16.946 1.00 0.00 O ATOM 1777 CB PRO A 113 0.767 -9.081 -17.054 1.00 0.00 C ATOM 1778 CG PRO A 113 1.542 -10.347 -16.887 1.00 0.00 C ATOM 1779 CD PRO A 113 0.577 -11.360 -16.346 1.00 0.00 C ATOM 0 HA PRO A 113 -0.273 -8.443 -15.209 1.00 0.00 H new ATOM 0 HB2 PRO A 113 0.378 -8.991 -18.068 1.00 0.00 H new ATOM 0 HB3 PRO A 113 1.397 -8.210 -16.876 1.00 0.00 H new ATOM 0 HG2 PRO A 113 1.959 -10.676 -17.839 1.00 0.00 H new ATOM 0 HG3 PRO A 113 2.379 -10.204 -16.204 1.00 0.00 H new ATOM 0 HD2 PRO A 113 0.049 -11.883 -17.143 1.00 0.00 H new ATOM 0 HD3 PRO A 113 1.079 -12.118 -15.745 1.00 0.00 H new ATOM 1787 N GLN A 114 -2.505 -9.818 -16.956 1.00 0.00 N ATOM 1788 CA GLN A 114 -3.810 -9.615 -17.566 1.00 0.00 C ATOM 1789 C GLN A 114 -4.741 -8.932 -16.571 1.00 0.00 C ATOM 1790 O GLN A 114 -5.598 -8.127 -16.943 1.00 0.00 O ATOM 1791 CB GLN A 114 -4.406 -10.953 -18.008 1.00 0.00 C ATOM 1792 CG GLN A 114 -3.488 -11.771 -18.908 1.00 0.00 C ATOM 1793 CD GLN A 114 -3.036 -11.017 -20.148 1.00 0.00 C ATOM 1794 OE1 GLN A 114 -3.737 -10.139 -20.648 1.00 0.00 O ATOM 1795 NE2 GLN A 114 -1.865 -11.364 -20.658 1.00 0.00 N ATOM 0 H GLN A 114 -2.276 -10.793 -16.761 1.00 0.00 H new ATOM 0 HA GLN A 114 -3.694 -8.980 -18.444 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -4.649 -11.541 -17.123 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -5.342 -10.766 -18.534 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -2.611 -12.078 -18.338 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -4.005 -12.681 -19.213 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -1.313 -12.098 -20.214 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -1.515 -10.898 -21.495 1.00 0.00 H new ATOM 1804 N LYS A 115 -4.539 -9.259 -15.304 1.00 0.00 N ATOM 1805 CA LYS A 115 -5.290 -8.680 -14.199 1.00 0.00 C ATOM 1806 C LYS A 115 -4.470 -8.795 -12.918 1.00 0.00 C ATOM 1807 O LYS A 115 -4.590 -9.779 -12.188 1.00 0.00 O ATOM 1808 CB LYS A 115 -6.646 -9.373 -14.016 1.00 0.00 C ATOM 1809 CG LYS A 115 -7.804 -8.667 -14.710 1.00 0.00 C ATOM 1810 CD LYS A 115 -8.035 -7.277 -14.131 1.00 0.00 C ATOM 1811 CE LYS A 115 -9.344 -6.667 -14.618 1.00 0.00 C ATOM 1812 NZ LYS A 115 -9.362 -6.457 -16.089 1.00 0.00 N ATOM 0 H LYS A 115 -3.841 -9.942 -15.010 1.00 0.00 H new ATOM 0 HA LYS A 115 -5.482 -7.631 -14.426 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -6.575 -10.392 -14.396 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -6.864 -9.445 -12.951 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -7.597 -8.588 -15.777 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -8.711 -9.262 -14.604 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -8.044 -7.334 -13.043 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -7.206 -6.626 -14.409 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -10.171 -7.319 -14.337 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -9.505 -5.713 -14.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -10.259 -6.009 -16.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -8.570 -5.841 -16.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -9.270 -7.374 -16.572 1.00 0.00 H new ATOM 1826 N PRO A 116 -3.583 -7.818 -12.663 1.00 0.00 N ATOM 1827 CA PRO A 116 -2.708 -7.837 -11.489 1.00 0.00 C ATOM 1828 C PRO A 116 -3.504 -7.841 -10.193 1.00 0.00 C ATOM 1829 O PRO A 116 -4.090 -6.829 -9.802 1.00 0.00 O ATOM 1830 CB PRO A 116 -1.885 -6.555 -11.609 1.00 0.00 C ATOM 1831 CG PRO A 116 -2.026 -6.126 -13.031 1.00 0.00 C ATOM 1832 CD PRO A 116 -3.370 -6.619 -13.486 1.00 0.00 C ATOM 0 HA PRO A 116 -2.092 -8.736 -11.459 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -2.253 -5.787 -10.929 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -0.840 -6.733 -11.354 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -1.959 -5.042 -13.119 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -1.229 -6.546 -13.645 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -4.149 -5.874 -13.322 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -3.373 -6.855 -14.550 1.00 0.00 H new ATOM 1840 N VAL A 117 -3.534 -8.990 -9.542 1.00 0.00 N ATOM 1841 CA VAL A 117 -4.330 -9.158 -8.341 1.00 0.00 C ATOM 1842 C VAL A 117 -3.673 -8.465 -7.159 1.00 0.00 C ATOM 1843 O VAL A 117 -2.532 -8.763 -6.806 1.00 0.00 O ATOM 1844 CB VAL A 117 -4.527 -10.654 -8.001 1.00 0.00 C ATOM 1845 CG1 VAL A 117 -5.409 -10.818 -6.771 1.00 0.00 C ATOM 1846 CG2 VAL A 117 -5.108 -11.406 -9.192 1.00 0.00 C ATOM 0 H VAL A 117 -3.015 -9.821 -9.826 1.00 0.00 H new ATOM 0 HA VAL A 117 -5.303 -8.707 -8.535 1.00 0.00 H new ATOM 0 HB VAL A 117 -3.551 -11.083 -7.774 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.533 -11.878 -6.551 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -4.942 -10.323 -5.920 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.384 -10.370 -6.960 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -5.238 -12.456 -8.931 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -6.073 -10.976 -9.458 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -4.428 -11.325 -10.040 1.00 0.00 H new ATOM 1856 N CYS A 118 -4.393 -7.536 -6.562 1.00 0.00 N ATOM 1857 CA CYS A 118 -3.952 -6.884 -5.344 1.00 0.00 C ATOM 1858 C CYS A 118 -4.909 -7.233 -4.219 1.00 0.00 C ATOM 1859 O CYS A 118 -6.121 -7.066 -4.362 1.00 0.00 O ATOM 1860 CB CYS A 118 -3.888 -5.365 -5.537 1.00 0.00 C ATOM 1861 SG CYS A 118 -3.236 -4.458 -4.115 1.00 0.00 S ATOM 0 H CYS A 118 -5.297 -7.212 -6.906 1.00 0.00 H new ATOM 0 HA CYS A 118 -2.951 -7.233 -5.092 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -3.268 -5.147 -6.407 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -4.890 -4.997 -5.759 1.00 0.00 H new ATOM 0 HG CYS A 118 -3.222 -3.186 -4.381 1.00 0.00 H new ATOM 1867 N LYS A 119 -4.385 -7.747 -3.120 1.00 0.00 N ATOM 1868 CA LYS A 119 -5.214 -8.045 -1.964 1.00 0.00 C ATOM 1869 C LYS A 119 -4.683 -7.322 -0.743 1.00 0.00 C ATOM 1870 O LYS A 119 -3.506 -6.961 -0.686 1.00 0.00 O ATOM 1871 CB LYS A 119 -5.259 -9.548 -1.673 1.00 0.00 C ATOM 1872 CG LYS A 119 -5.625 -10.408 -2.874 1.00 0.00 C ATOM 1873 CD LYS A 119 -5.740 -11.880 -2.499 1.00 0.00 C ATOM 1874 CE LYS A 119 -6.952 -12.141 -1.614 1.00 0.00 C ATOM 1875 NZ LYS A 119 -7.089 -13.578 -1.253 1.00 0.00 N ATOM 0 H LYS A 119 -3.396 -7.966 -3.003 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.225 -7.706 -2.191 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -4.285 -9.863 -1.299 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.981 -9.731 -0.877 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -6.571 -10.064 -3.293 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -4.870 -10.288 -3.651 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -5.814 -12.482 -3.405 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -4.835 -12.195 -1.980 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -6.869 -11.546 -0.704 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -7.854 -11.811 -2.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -8.089 -13.796 -1.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -6.745 -14.167 -2.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -6.529 -13.776 -0.399 1.00 0.00 H new ATOM 1889 N SER A 120 -5.551 -7.120 0.225 1.00 0.00 N ATOM 1890 CA SER A 120 -5.169 -6.506 1.482 1.00 0.00 C ATOM 1891 C SER A 120 -5.128 -7.579 2.556 1.00 0.00 C ATOM 1892 O SER A 120 -6.037 -8.401 2.649 1.00 0.00 O ATOM 1893 CB SER A 120 -6.164 -5.405 1.869 1.00 0.00 C ATOM 1894 OG SER A 120 -5.750 -4.720 3.040 1.00 0.00 O ATOM 0 H SER A 120 -6.537 -7.375 0.165 1.00 0.00 H new ATOM 0 HA SER A 120 -4.185 -6.048 1.379 1.00 0.00 H new ATOM 0 HB2 SER A 120 -6.262 -4.696 1.047 1.00 0.00 H new ATOM 0 HB3 SER A 120 -7.149 -5.843 2.031 1.00 0.00 H new ATOM 0 HG SER A 120 -6.404 -4.024 3.260 1.00 0.00 H new ATOM 1900 N PHE A 121 -4.067 -7.601 3.337 1.00 0.00 N ATOM 1901 CA PHE A 121 -3.938 -8.591 4.386 1.00 0.00 C ATOM 1902 C PHE A 121 -3.737 -7.926 5.739 1.00 0.00 C ATOM 1903 O PHE A 121 -2.897 -7.036 5.894 1.00 0.00 O ATOM 1904 CB PHE A 121 -2.771 -9.539 4.092 1.00 0.00 C ATOM 1905 CG PHE A 121 -2.893 -10.270 2.784 1.00 0.00 C ATOM 1906 CD1 PHE A 121 -3.612 -11.450 2.702 1.00 0.00 C ATOM 1907 CD2 PHE A 121 -2.287 -9.781 1.638 1.00 0.00 C ATOM 1908 CE1 PHE A 121 -3.720 -12.130 1.504 1.00 0.00 C ATOM 1909 CE2 PHE A 121 -2.394 -10.456 0.437 1.00 0.00 C ATOM 1910 CZ PHE A 121 -3.112 -11.631 0.370 1.00 0.00 C ATOM 0 H PHE A 121 -3.286 -6.949 3.266 1.00 0.00 H new ATOM 0 HA PHE A 121 -4.862 -9.168 4.417 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -1.843 -8.967 4.092 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -2.696 -10.268 4.899 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -4.094 -11.844 3.585 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -1.724 -8.861 1.684 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -4.280 -13.052 1.455 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -1.916 -10.064 -0.448 1.00 0.00 H new ATOM 0 HZ PHE A 121 -3.198 -12.160 -0.568 1.00 0.00 H new ATOM 1920 N LEU A 122 -4.529 -8.348 6.703 1.00 0.00 N ATOM 1921 CA LEU A 122 -4.342 -7.943 8.084 1.00 0.00 C ATOM 1922 C LEU A 122 -3.693 -9.095 8.821 1.00 0.00 C ATOM 1923 O LEU A 122 -4.324 -10.126 9.049 1.00 0.00 O ATOM 1924 CB LEU A 122 -5.683 -7.585 8.728 1.00 0.00 C ATOM 1925 CG LEU A 122 -6.433 -6.427 8.065 1.00 0.00 C ATOM 1926 CD1 LEU A 122 -7.790 -6.224 8.722 1.00 0.00 C ATOM 1927 CD2 LEU A 122 -5.610 -5.148 8.138 1.00 0.00 C ATOM 0 H LEU A 122 -5.317 -8.978 6.554 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.709 -7.057 8.132 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -6.323 -8.468 8.713 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -5.510 -7.334 9.775 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.592 -6.676 7.016 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -8.309 -5.397 8.238 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -8.383 -7.133 8.621 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -7.652 -5.997 9.779 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.158 -4.335 7.662 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.421 -4.896 9.181 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.661 -5.296 7.623 1.00 0.00 H new ATOM 1939 N ILE A 123 -2.431 -8.944 9.167 1.00 0.00 N ATOM 1940 CA ILE A 123 -1.669 -10.063 9.687 1.00 0.00 C ATOM 1941 C ILE A 123 -1.534 -9.996 11.203 1.00 0.00 C ATOM 1942 O ILE A 123 -1.023 -9.023 11.756 1.00 0.00 O ATOM 1943 CB ILE A 123 -0.267 -10.142 9.042 1.00 0.00 C ATOM 1944 CG1 ILE A 123 -0.380 -10.019 7.518 1.00 0.00 C ATOM 1945 CG2 ILE A 123 0.411 -11.454 9.420 1.00 0.00 C ATOM 1946 CD1 ILE A 123 0.956 -10.034 6.804 1.00 0.00 C ATOM 0 H ILE A 123 -1.914 -8.067 9.099 1.00 0.00 H new ATOM 0 HA ILE A 123 -2.224 -10.965 9.428 1.00 0.00 H new ATOM 0 HB ILE A 123 0.340 -9.317 9.414 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -0.992 -10.838 7.141 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.901 -9.093 7.275 1.00 0.00 H new ATOM 0 HG21 ILE A 123 1.398 -11.499 8.960 1.00 0.00 H new ATOM 0 HG22 ILE A 123 0.513 -11.512 10.504 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -0.192 -12.290 9.067 1.00 0.00 H new ATOM 0 HD11 ILE A 123 0.795 -9.943 5.730 1.00 0.00 H new ATOM 0 HD12 ILE A 123 1.564 -9.199 7.152 1.00 0.00 H new ATOM 0 HD13 ILE A 123 1.471 -10.971 7.016 1.00 0.00 H new ATOM 1958 N LYS A 124 -2.026 -11.034 11.858 1.00 0.00 N ATOM 1959 CA LYS A 124 -1.840 -11.212 13.285 1.00 0.00 C ATOM 1960 C LYS A 124 -0.468 -11.830 13.540 1.00 0.00 C ATOM 1961 O LYS A 124 0.299 -12.051 12.598 1.00 0.00 O ATOM 1962 CB LYS A 124 -2.930 -12.129 13.852 1.00 0.00 C ATOM 1963 CG LYS A 124 -4.341 -11.562 13.764 1.00 0.00 C ATOM 1964 CD LYS A 124 -5.318 -12.388 14.588 1.00 0.00 C ATOM 1965 CE LYS A 124 -6.748 -11.884 14.461 1.00 0.00 C ATOM 1966 NZ LYS A 124 -7.347 -12.217 13.143 1.00 0.00 N ATOM 0 H LYS A 124 -2.566 -11.777 11.414 1.00 0.00 H new ATOM 0 HA LYS A 124 -1.906 -10.242 13.778 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -2.900 -13.080 13.320 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -2.702 -12.341 14.897 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -4.344 -10.531 14.117 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -4.664 -11.543 12.723 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -5.272 -13.429 14.267 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -5.018 -12.364 15.636 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -7.356 -12.319 15.254 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -6.764 -10.803 14.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -8.374 -12.056 13.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -6.926 -11.613 12.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -7.161 -13.215 12.919 1.00 0.00 H new ATOM 1980 N LYS A 125 -0.166 -12.117 14.803 1.00 0.00 N ATOM 1981 CA LYS A 125 1.102 -12.750 15.157 1.00 0.00 C ATOM 1982 C LYS A 125 1.295 -14.027 14.358 1.00 0.00 C ATOM 1983 O LYS A 125 2.300 -14.198 13.669 1.00 0.00 O ATOM 1984 CB LYS A 125 1.162 -13.067 16.648 1.00 0.00 C ATOM 1985 CG LYS A 125 2.550 -13.488 17.108 1.00 0.00 C ATOM 1986 CD LYS A 125 2.584 -13.781 18.594 1.00 0.00 C ATOM 1987 CE LYS A 125 3.988 -14.131 19.058 1.00 0.00 C ATOM 1988 NZ LYS A 125 4.044 -14.341 20.525 1.00 0.00 N ATOM 0 H LYS A 125 -0.778 -11.923 15.595 1.00 0.00 H new ATOM 0 HA LYS A 125 1.902 -12.049 14.919 1.00 0.00 H new ATOM 0 HB2 LYS A 125 0.848 -12.190 17.214 1.00 0.00 H new ATOM 0 HB3 LYS A 125 0.453 -13.863 16.874 1.00 0.00 H new ATOM 0 HG2 LYS A 125 2.863 -14.374 16.555 1.00 0.00 H new ATOM 0 HG3 LYS A 125 3.265 -12.698 16.876 1.00 0.00 H new ATOM 0 HD2 LYS A 125 2.223 -12.913 19.146 1.00 0.00 H new ATOM 0 HD3 LYS A 125 1.908 -14.606 18.819 1.00 0.00 H new ATOM 0 HE2 LYS A 125 4.326 -15.033 18.548 1.00 0.00 H new ATOM 0 HE3 LYS A 125 4.674 -13.331 18.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 5.017 -14.578 20.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 3.746 -13.472 21.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 3.408 -15.121 20.789 1.00 0.00 H new ATOM 2002 N ASP A 126 0.328 -14.920 14.453 1.00 0.00 N ATOM 2003 CA ASP A 126 0.332 -16.122 13.635 1.00 0.00 C ATOM 2004 C ASP A 126 -1.039 -16.331 13.002 1.00 0.00 C ATOM 2005 O ASP A 126 -1.818 -17.184 13.423 1.00 0.00 O ATOM 2006 CB ASP A 126 0.737 -17.349 14.455 1.00 0.00 C ATOM 2007 CG ASP A 126 1.173 -18.515 13.583 1.00 0.00 C ATOM 2008 OD1 ASP A 126 0.310 -19.153 12.949 1.00 0.00 O ATOM 2009 OD2 ASP A 126 2.394 -18.788 13.522 1.00 0.00 O ATOM 0 H ASP A 126 -0.468 -14.838 15.085 1.00 0.00 H new ATOM 0 HA ASP A 126 1.070 -15.992 12.844 1.00 0.00 H new ATOM 0 HB2 ASP A 126 1.551 -17.079 15.128 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -0.102 -17.659 15.077 1.00 0.00 H new ATOM 2014 N GLY A 127 -1.353 -15.485 12.036 1.00 0.00 N ATOM 2015 CA GLY A 127 -2.555 -15.662 11.247 1.00 0.00 C ATOM 2016 C GLY A 127 -2.804 -14.471 10.359 1.00 0.00 C ATOM 2017 O GLY A 127 -2.596 -13.340 10.776 1.00 0.00 O ATOM 0 H GLY A 127 -0.793 -14.672 11.781 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -2.464 -16.561 10.637 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -3.409 -15.811 11.908 1.00 0.00 H new ATOM 2021 N VAL A 128 -3.230 -14.713 9.135 1.00 0.00 N ATOM 2022 CA VAL A 128 -3.465 -13.622 8.198 1.00 0.00 C ATOM 2023 C VAL A 128 -4.941 -13.515 7.817 1.00 0.00 C ATOM 2024 O VAL A 128 -5.588 -14.507 7.474 1.00 0.00 O ATOM 2025 CB VAL A 128 -2.594 -13.764 6.926 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -2.916 -15.041 6.167 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -2.762 -12.558 6.018 1.00 0.00 C ATOM 0 H VAL A 128 -3.420 -15.644 8.765 1.00 0.00 H new ATOM 0 HA VAL A 128 -3.176 -12.703 8.708 1.00 0.00 H new ATOM 0 HB VAL A 128 -1.555 -13.818 7.250 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -2.285 -15.106 5.280 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -2.730 -15.902 6.809 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -3.964 -15.031 5.867 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -2.140 -12.681 5.131 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -3.807 -12.470 5.720 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -2.460 -11.656 6.551 1.00 0.00 H new ATOM 2037 N ASP A 129 -5.477 -12.308 7.919 1.00 0.00 N ATOM 2038 CA ASP A 129 -6.851 -12.036 7.524 1.00 0.00 C ATOM 2039 C ASP A 129 -6.880 -11.382 6.158 1.00 0.00 C ATOM 2040 O ASP A 129 -6.370 -10.273 5.978 1.00 0.00 O ATOM 2041 CB ASP A 129 -7.542 -11.117 8.531 1.00 0.00 C ATOM 2042 CG ASP A 129 -7.630 -11.722 9.912 1.00 0.00 C ATOM 2043 OD1 ASP A 129 -8.547 -12.539 10.150 1.00 0.00 O ATOM 2044 OD2 ASP A 129 -6.796 -11.379 10.769 1.00 0.00 O ATOM 0 H ASP A 129 -4.976 -11.494 8.275 1.00 0.00 H new ATOM 0 HA ASP A 129 -7.383 -12.987 7.492 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -6.999 -10.173 8.587 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -8.546 -10.886 8.176 1.00 0.00 H new ATOM 2049 N GLU A 130 -7.462 -12.068 5.194 1.00 0.00 N ATOM 2050 CA GLU A 130 -7.565 -11.545 3.848 1.00 0.00 C ATOM 2051 C GLU A 130 -8.744 -10.581 3.735 1.00 0.00 C ATOM 2052 O GLU A 130 -9.884 -10.928 4.058 1.00 0.00 O ATOM 2053 CB GLU A 130 -7.702 -12.700 2.857 1.00 0.00 C ATOM 2054 CG GLU A 130 -6.551 -13.694 2.931 1.00 0.00 C ATOM 2055 CD GLU A 130 -6.623 -14.769 1.866 1.00 0.00 C ATOM 2056 OE1 GLU A 130 -7.389 -15.741 2.043 1.00 0.00 O ATOM 2057 OE2 GLU A 130 -5.908 -14.650 0.849 1.00 0.00 O ATOM 0 H GLU A 130 -7.872 -12.993 5.320 1.00 0.00 H new ATOM 0 HA GLU A 130 -6.659 -10.988 3.610 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.639 -13.224 3.047 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.761 -12.297 1.846 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -5.608 -13.156 2.833 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -6.548 -14.165 3.914 1.00 0.00 H new ATOM 2064 N GLU A 131 -8.450 -9.369 3.285 1.00 0.00 N ATOM 2065 CA GLU A 131 -9.448 -8.317 3.156 1.00 0.00 C ATOM 2066 C GLU A 131 -9.702 -8.009 1.681 1.00 0.00 C ATOM 2067 O GLU A 131 -8.798 -8.117 0.845 1.00 0.00 O ATOM 2068 CB GLU A 131 -8.973 -7.052 3.893 1.00 0.00 C ATOM 2069 CG GLU A 131 -9.976 -5.906 3.879 1.00 0.00 C ATOM 2070 CD GLU A 131 -11.299 -6.272 4.522 1.00 0.00 C ATOM 2071 OE1 GLU A 131 -11.441 -6.088 5.748 1.00 0.00 O ATOM 2072 OE2 GLU A 131 -12.210 -6.727 3.800 1.00 0.00 O ATOM 0 H GLU A 131 -7.512 -9.088 2.999 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.382 -8.656 3.605 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -8.749 -7.311 4.928 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -8.042 -6.710 3.441 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -9.549 -5.050 4.401 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -10.152 -5.596 2.849 1.00 0.00 H new ATOM 2079 N GLU A 132 -10.933 -7.629 1.366 1.00 0.00 N ATOM 2080 CA GLU A 132 -11.315 -7.316 0.005 1.00 0.00 C ATOM 2081 C GLU A 132 -11.141 -5.831 -0.273 1.00 0.00 C ATOM 2082 O GLU A 132 -11.118 -5.012 0.650 1.00 0.00 O ATOM 2083 CB GLU A 132 -12.762 -7.731 -0.235 1.00 0.00 C ATOM 2084 CG GLU A 132 -13.002 -9.221 -0.064 1.00 0.00 C ATOM 2085 CD GLU A 132 -14.451 -9.607 -0.265 1.00 0.00 C ATOM 2086 OE1 GLU A 132 -15.298 -9.213 0.563 1.00 0.00 O ATOM 2087 OE2 GLU A 132 -14.758 -10.311 -1.251 1.00 0.00 O ATOM 0 H GLU A 132 -11.687 -7.531 2.046 1.00 0.00 H new ATOM 0 HA GLU A 132 -10.668 -7.869 -0.675 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -13.407 -7.186 0.454 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.053 -7.438 -1.244 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.383 -9.768 -0.775 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -12.685 -9.524 0.934 1.00 0.00 H new ATOM 2094 N ILE A 133 -11.025 -5.488 -1.546 1.00 0.00 N ATOM 2095 CA ILE A 133 -10.777 -4.109 -1.945 1.00 0.00 C ATOM 2096 C ILE A 133 -11.917 -3.573 -2.803 1.00 0.00 C ATOM 2097 O ILE A 133 -12.349 -4.221 -3.757 1.00 0.00 O ATOM 2098 CB ILE A 133 -9.447 -3.975 -2.724 1.00 0.00 C ATOM 2099 CG1 ILE A 133 -8.284 -4.555 -1.908 1.00 0.00 C ATOM 2100 CG2 ILE A 133 -9.184 -2.515 -3.068 1.00 0.00 C ATOM 2101 CD1 ILE A 133 -6.934 -4.422 -2.583 1.00 0.00 C ATOM 0 H ILE A 133 -11.098 -6.145 -2.323 1.00 0.00 H new ATOM 0 HA ILE A 133 -10.709 -3.522 -1.029 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.528 -4.541 -3.652 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -8.246 -4.054 -0.941 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -8.480 -5.610 -1.714 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -8.245 -2.434 -3.616 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -9.998 -2.134 -3.684 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -9.120 -1.931 -2.150 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -6.164 -4.855 -1.945 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -6.951 -4.947 -3.538 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -6.714 -3.368 -2.753 1.00 0.00 H new ATOM 2113 N ILE A 134 -12.405 -2.394 -2.451 1.00 0.00 N ATOM 2114 CA ILE A 134 -13.445 -1.727 -3.222 1.00 0.00 C ATOM 2115 C ILE A 134 -12.806 -0.649 -4.093 1.00 0.00 C ATOM 2116 O ILE A 134 -12.012 0.160 -3.605 1.00 0.00 O ATOM 2117 CB ILE A 134 -14.541 -1.114 -2.299 1.00 0.00 C ATOM 2118 CG1 ILE A 134 -15.613 -2.155 -1.932 1.00 0.00 C ATOM 2119 CG2 ILE A 134 -15.204 0.092 -2.955 1.00 0.00 C ATOM 2120 CD1 ILE A 134 -15.075 -3.480 -1.441 1.00 0.00 C ATOM 0 H ILE A 134 -12.095 -1.875 -1.630 1.00 0.00 H new ATOM 0 HA ILE A 134 -13.939 -2.464 -3.855 1.00 0.00 H new ATOM 0 HB ILE A 134 -14.042 -0.789 -1.386 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -16.258 -1.734 -1.161 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -16.238 -2.335 -2.807 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -15.964 0.498 -2.287 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -14.453 0.856 -3.156 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -15.670 -0.214 -3.892 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -15.906 -4.146 -1.208 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -14.455 -3.931 -2.216 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -14.476 -3.320 -0.545 1.00 0.00 H new ATOM 2132 N LEU A 135 -13.139 -0.654 -5.378 1.00 0.00 N ATOM 2133 CA LEU A 135 -12.489 0.226 -6.332 1.00 0.00 C ATOM 2134 C LEU A 135 -13.405 1.361 -6.768 1.00 0.00 C ATOM 2135 O LEU A 135 -14.609 1.175 -6.953 1.00 0.00 O ATOM 2136 CB LEU A 135 -12.039 -0.564 -7.565 1.00 0.00 C ATOM 2137 CG LEU A 135 -11.040 -1.688 -7.297 1.00 0.00 C ATOM 2138 CD1 LEU A 135 -10.583 -2.307 -8.606 1.00 0.00 C ATOM 2139 CD2 LEU A 135 -9.848 -1.168 -6.512 1.00 0.00 C ATOM 0 H LEU A 135 -13.855 -1.259 -5.780 1.00 0.00 H new ATOM 0 HA LEU A 135 -11.621 0.658 -5.834 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -12.921 -0.991 -8.043 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -11.595 0.131 -8.278 1.00 0.00 H new ATOM 0 HG LEU A 135 -11.534 -2.455 -6.701 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -9.871 -3.107 -8.401 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.444 -2.714 -9.136 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -10.105 -1.545 -9.222 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -9.148 -1.983 -6.331 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -9.351 -0.383 -7.082 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -10.188 -0.764 -5.559 1.00 0.00 H new ATOM 2151 N LYS A 136 -12.824 2.539 -6.918 1.00 0.00 N ATOM 2152 CA LYS A 136 -13.522 3.674 -7.497 1.00 0.00 C ATOM 2153 C LYS A 136 -12.725 4.218 -8.674 1.00 0.00 C ATOM 2154 O LYS A 136 -11.497 4.131 -8.691 1.00 0.00 O ATOM 2155 CB LYS A 136 -13.749 4.773 -6.455 1.00 0.00 C ATOM 2156 CG LYS A 136 -14.753 4.390 -5.378 1.00 0.00 C ATOM 2157 CD LYS A 136 -15.182 5.590 -4.547 1.00 0.00 C ATOM 2158 CE LYS A 136 -16.192 5.187 -3.484 1.00 0.00 C ATOM 2159 NZ LYS A 136 -16.777 6.364 -2.789 1.00 0.00 N ATOM 0 H LYS A 136 -11.861 2.735 -6.644 1.00 0.00 H new ATOM 0 HA LYS A 136 -14.499 3.339 -7.846 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -12.797 5.017 -5.983 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -14.096 5.675 -6.959 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -15.630 3.939 -5.843 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -14.315 3.635 -4.725 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -14.309 6.038 -4.072 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -15.617 6.350 -5.197 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -16.990 4.606 -3.946 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -15.708 4.539 -2.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -17.459 6.041 -2.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -16.020 6.905 -2.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -17.262 6.970 -3.481 1.00 0.00 H new ATOM 2173 N GLU A 137 -13.417 4.767 -9.660 1.00 0.00 N ATOM 2174 CA GLU A 137 -12.759 5.259 -10.861 1.00 0.00 C ATOM 2175 C GLU A 137 -12.193 6.658 -10.647 1.00 0.00 C ATOM 2176 O GLU A 137 -11.218 7.056 -11.288 1.00 0.00 O ATOM 2177 CB GLU A 137 -13.735 5.260 -12.040 1.00 0.00 C ATOM 2178 CG GLU A 137 -13.992 3.886 -12.648 1.00 0.00 C ATOM 2179 CD GLU A 137 -14.796 2.972 -11.744 1.00 0.00 C ATOM 2180 OE1 GLU A 137 -16.034 3.150 -11.657 1.00 0.00 O ATOM 2181 OE2 GLU A 137 -14.202 2.073 -11.116 1.00 0.00 O ATOM 0 H GLU A 137 -14.430 4.883 -9.653 1.00 0.00 H new ATOM 0 HA GLU A 137 -11.929 4.589 -11.087 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -14.685 5.680 -11.709 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -13.347 5.920 -12.816 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -14.521 4.008 -13.593 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -13.037 3.412 -12.876 1.00 0.00 H new ATOM 2188 N GLU A 138 -12.800 7.380 -9.730 1.00 0.00 N ATOM 2189 CA GLU A 138 -12.368 8.728 -9.386 1.00 0.00 C ATOM 2190 C GLU A 138 -12.023 8.783 -7.897 1.00 0.00 C ATOM 2191 O GLU A 138 -12.360 7.861 -7.150 1.00 0.00 O ATOM 2192 CB GLU A 138 -13.466 9.743 -9.730 1.00 0.00 C ATOM 2193 CG GLU A 138 -13.022 11.192 -9.607 1.00 0.00 C ATOM 2194 CD GLU A 138 -14.112 12.171 -9.972 1.00 0.00 C ATOM 2195 OE1 GLU A 138 -15.058 12.336 -9.176 1.00 0.00 O ATOM 2196 OE2 GLU A 138 -14.020 12.794 -11.049 1.00 0.00 O ATOM 0 H GLU A 138 -13.607 7.054 -9.199 1.00 0.00 H new ATOM 0 HA GLU A 138 -11.481 8.985 -9.965 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -13.808 9.563 -10.749 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -14.320 9.577 -9.073 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -12.697 11.382 -8.584 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -12.159 11.359 -10.252 1.00 0.00 H new ATOM 2203 N LEU A 139 -11.348 9.850 -7.475 1.00 0.00 N ATOM 2204 CA LEU A 139 -10.940 10.013 -6.082 1.00 0.00 C ATOM 2205 C LEU A 139 -12.147 10.069 -5.150 1.00 0.00 C ATOM 2206 O LEU A 139 -13.276 10.303 -5.586 1.00 0.00 O ATOM 2207 CB LEU A 139 -10.100 11.281 -5.920 1.00 0.00 C ATOM 2208 CG LEU A 139 -8.774 11.290 -6.682 1.00 0.00 C ATOM 2209 CD1 LEU A 139 -8.063 12.619 -6.488 1.00 0.00 C ATOM 2210 CD2 LEU A 139 -7.885 10.138 -6.230 1.00 0.00 C ATOM 0 H LEU A 139 -11.070 10.620 -8.084 1.00 0.00 H new ATOM 0 HA LEU A 139 -10.340 9.145 -5.809 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -10.694 12.134 -6.248 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -9.892 11.426 -4.860 1.00 0.00 H new ATOM 0 HG LEU A 139 -8.986 11.160 -7.743 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -7.121 12.611 -7.036 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -8.693 13.427 -6.861 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -7.865 12.774 -5.427 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -6.947 10.163 -6.785 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -7.679 10.234 -5.164 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -8.392 9.192 -6.418 1.00 0.00 H new