USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 761 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 138 THR OG1 : rot -105:sc= 0.00136! USER MOD Set 1.2: A 140 SER OG : rot 162:sc= -2.16! USER MOD Set 2.1: A 128 ASN : amide:sc= -4.54 K(o=-10,f=-6.9!) USER MOD Set 2.2: A 131 ASN : amide:sc= -2.14 K(o=-10,f=-24!) USER MOD Set 2.3: A 148 ASN : amide:sc= -3.79! C(o=-10!,f=-16!) USER MOD Set 3.1: A 102 THR OG1 : rot -52:sc= 0.122 USER MOD Set 3.2: A 106 ASN : amide:sc= -3.38 K(o=-3.3,f=-8!) USER MOD Set 4.1: A 101 SER OG : rot -130:sc= 0.68 USER MOD Set 4.2: A 107 LYS NZ :NH3+ -153:sc= 0.815 (180deg=0) USER MOD Set 5.1: A 56 TYR OH : rot 130:sc= -3.08 USER MOD Set 5.2: A 118 HIS : no HD1:sc= -5.71! C(o=-8.8!,f=-6.6!) USER MOD Single : A 41 GLN : amide:sc= -0.34 K(o=-0.34,f=-2.2!) USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.0676 USER MOD Single : A 44 LYS NZ :NH3+ 151:sc= -0.0586 (180deg=-0.627) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.487 USER MOD Single : A 51 SER OG : rot 92:sc= 1.19 USER MOD Single : A 55 ASN : amide:sc= -2.38 K(o=-2.4,f=-3.1) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -22:sc= 0.347 USER MOD Single : A 82 ASN : amide:sc= -2.32 X(o=-2.3,f=-1.9!) USER MOD Single : A 85 SER OG : rot -17:sc= -0.279 USER MOD Single : A 86 ASN : amide:sc= -2.06 K(o=-2.1,f=-6.1!) USER MOD Single : A 87 ASN : amide:sc= -0.408 X(o=-0.41,f=0) USER MOD Single : A 89 MET CE :methyl 163:sc= 0 (180deg=-0.135) USER MOD Single : A 90 MET CE :methyl 164:sc= -8.03! (180deg=-8.26!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HD1:sc= -1.58 K(o=-1.6,f=-4.1!) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= -2.71 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0.0447 USER MOD Single : A 125 GLN : amide:sc= -2.59 K(o=-2.6,f=-1.5) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 HIS : no HE2:sc= -2.01 K(o=-2,f=-0.58) USER MOD Single : A 146 SER OG : rot 130:sc= -0.214 USER MOD Single : A 150 HIS : no HD1:sc= -12! C(o=-12!,f=-12!) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 13 N PHE A 37 6.072 -9.851 7.581 1.00 0.00 N ATOM 14 CA PHE A 37 6.999 -9.255 6.627 1.00 0.00 C ATOM 15 C PHE A 37 8.443 -9.588 6.987 1.00 0.00 C ATOM 16 O PHE A 37 9.355 -8.801 6.730 1.00 0.00 O ATOM 17 CB PHE A 37 6.806 -7.738 6.583 1.00 0.00 C ATOM 18 CG PHE A 37 5.379 -7.321 6.364 1.00 0.00 C ATOM 19 CD1 PHE A 37 4.806 -6.327 7.139 1.00 0.00 C ATOM 20 CD2 PHE A 37 4.612 -7.925 5.381 1.00 0.00 C ATOM 21 CE1 PHE A 37 3.493 -5.941 6.937 1.00 0.00 C ATOM 22 CE2 PHE A 37 3.300 -7.544 5.175 1.00 0.00 C ATOM 23 CZ PHE A 37 2.739 -6.551 5.953 1.00 0.00 C ATOM 0 HA PHE A 37 6.788 -9.671 5.642 1.00 0.00 H new ATOM 0 HB2 PHE A 37 7.163 -7.307 7.519 1.00 0.00 H new ATOM 0 HB3 PHE A 37 7.423 -7.324 5.786 1.00 0.00 H new ATOM 0 HD1 PHE A 37 5.391 -5.848 7.910 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.045 -8.702 4.769 1.00 0.00 H new ATOM 0 HE1 PHE A 37 3.058 -5.164 7.548 1.00 0.00 H new ATOM 0 HE2 PHE A 37 2.713 -8.023 4.405 1.00 0.00 H new ATOM 0 HZ PHE A 37 1.714 -6.252 5.793 1.00 0.00 H new ATOM 33 N ALA A 38 8.645 -10.758 7.586 1.00 0.00 N ATOM 34 CA ALA A 38 9.979 -11.194 7.980 1.00 0.00 C ATOM 35 C ALA A 38 10.789 -11.648 6.772 1.00 0.00 C ATOM 36 O ALA A 38 11.961 -11.301 6.631 1.00 0.00 O ATOM 37 CB ALA A 38 9.885 -12.315 9.005 1.00 0.00 C ATOM 0 H ALA A 38 7.902 -11.420 7.809 1.00 0.00 H new ATOM 0 HA ALA A 38 10.493 -10.345 8.430 1.00 0.00 H new ATOM 0 HB1 ALA A 38 10.888 -12.632 9.291 1.00 0.00 H new ATOM 0 HB2 ALA A 38 9.352 -11.958 9.886 1.00 0.00 H new ATOM 0 HB3 ALA A 38 9.348 -13.159 8.573 1.00 0.00 H new ATOM 43 N ASP A 39 10.153 -12.422 5.902 1.00 0.00 N ATOM 44 CA ASP A 39 10.809 -12.926 4.700 1.00 0.00 C ATOM 45 C ASP A 39 10.640 -11.957 3.528 1.00 0.00 C ATOM 46 O ASP A 39 11.024 -12.266 2.399 1.00 0.00 O ATOM 47 CB ASP A 39 10.244 -14.296 4.326 1.00 0.00 C ATOM 48 CG ASP A 39 11.050 -15.436 4.918 1.00 0.00 C ATOM 49 OD1 ASP A 39 11.311 -15.406 6.138 1.00 0.00 O ATOM 50 OD2 ASP A 39 11.418 -16.358 4.161 1.00 0.00 O ATOM 0 H ASP A 39 9.182 -12.716 6.006 1.00 0.00 H new ATOM 0 HA ASP A 39 11.874 -13.020 4.914 1.00 0.00 H new ATOM 0 HB2 ASP A 39 9.212 -14.367 4.671 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.225 -14.394 3.241 1.00 0.00 H new ATOM 55 N ALA A 40 10.067 -10.789 3.801 1.00 0.00 N ATOM 56 CA ALA A 40 9.851 -9.784 2.768 1.00 0.00 C ATOM 57 C ALA A 40 11.150 -9.069 2.415 1.00 0.00 C ATOM 58 O ALA A 40 11.879 -8.614 3.296 1.00 0.00 O ATOM 59 CB ALA A 40 8.806 -8.779 3.225 1.00 0.00 C ATOM 0 H ALA A 40 9.744 -10.516 4.729 1.00 0.00 H new ATOM 0 HA ALA A 40 9.491 -10.291 1.873 1.00 0.00 H new ATOM 0 HB1 ALA A 40 8.653 -8.033 2.445 1.00 0.00 H new ATOM 0 HB2 ALA A 40 7.867 -9.295 3.423 1.00 0.00 H new ATOM 0 HB3 ALA A 40 9.148 -8.287 4.136 1.00 0.00 H new ATOM 65 N GLN A 41 11.431 -8.967 1.119 1.00 0.00 N ATOM 66 CA GLN A 41 12.639 -8.297 0.654 1.00 0.00 C ATOM 67 C GLN A 41 12.572 -6.810 0.969 1.00 0.00 C ATOM 68 O GLN A 41 11.550 -6.315 1.443 1.00 0.00 O ATOM 69 CB GLN A 41 12.824 -8.509 -0.850 1.00 0.00 C ATOM 70 CG GLN A 41 14.278 -8.646 -1.270 1.00 0.00 C ATOM 71 CD GLN A 41 14.696 -7.599 -2.284 1.00 0.00 C ATOM 72 OE1 GLN A 41 13.855 -6.993 -2.949 1.00 0.00 O ATOM 73 NE2 GLN A 41 16.000 -7.382 -2.409 1.00 0.00 N ATOM 0 H GLN A 41 10.840 -9.339 0.375 1.00 0.00 H new ATOM 0 HA GLN A 41 13.494 -8.728 1.174 1.00 0.00 H new ATOM 0 HB2 GLN A 41 12.281 -9.405 -1.152 1.00 0.00 H new ATOM 0 HB3 GLN A 41 12.377 -7.671 -1.384 1.00 0.00 H new ATOM 0 HG2 GLN A 41 14.915 -8.567 -0.389 1.00 0.00 H new ATOM 0 HG3 GLN A 41 14.438 -9.638 -1.692 1.00 0.00 H new ATOM 0 HE21 GLN A 41 16.662 -7.907 -1.837 1.00 0.00 H new ATOM 0 HE22 GLN A 41 16.340 -6.690 -3.077 1.00 0.00 H new ATOM 82 N THR A 42 13.661 -6.097 0.711 1.00 0.00 N ATOM 83 CA THR A 42 13.700 -4.667 0.982 1.00 0.00 C ATOM 84 C THR A 42 14.723 -3.955 0.101 1.00 0.00 C ATOM 85 O THR A 42 15.720 -4.542 -0.320 1.00 0.00 O ATOM 86 CB THR A 42 14.020 -4.412 2.459 1.00 0.00 C ATOM 87 OG1 THR A 42 14.200 -5.635 3.154 1.00 0.00 O ATOM 88 CG2 THR A 42 12.941 -3.632 3.179 1.00 0.00 C ATOM 0 H THR A 42 14.521 -6.481 0.318 1.00 0.00 H new ATOM 0 HA THR A 42 12.714 -4.263 0.750 1.00 0.00 H new ATOM 0 HB THR A 42 14.936 -3.820 2.457 1.00 0.00 H new ATOM 0 HG1 THR A 42 14.405 -5.450 4.094 1.00 0.00 H new ATOM 0 HG21 THR A 42 13.230 -3.486 4.220 1.00 0.00 H new ATOM 0 HG22 THR A 42 12.812 -2.662 2.699 1.00 0.00 H new ATOM 0 HG23 THR A 42 12.003 -4.185 3.137 1.00 0.00 H new ATOM 96 N ARG A 43 14.464 -2.680 -0.159 1.00 0.00 N ATOM 97 CA ARG A 43 15.347 -1.857 -0.974 1.00 0.00 C ATOM 98 C ARG A 43 15.018 -0.383 -0.772 1.00 0.00 C ATOM 99 O ARG A 43 13.985 -0.047 -0.192 1.00 0.00 O ATOM 100 CB ARG A 43 15.227 -2.234 -2.455 1.00 0.00 C ATOM 101 CG ARG A 43 13.887 -1.869 -3.078 1.00 0.00 C ATOM 102 CD ARG A 43 14.046 -1.442 -4.529 1.00 0.00 C ATOM 103 NE ARG A 43 13.318 -0.210 -4.820 1.00 0.00 N ATOM 104 CZ ARG A 43 13.557 0.560 -5.880 1.00 0.00 C ATOM 105 NH1 ARG A 43 14.503 0.228 -6.751 1.00 0.00 N ATOM 106 NH2 ARG A 43 12.848 1.664 -6.071 1.00 0.00 N ATOM 0 H ARG A 43 13.640 -2.189 0.188 1.00 0.00 H new ATOM 0 HA ARG A 43 16.376 -2.036 -0.661 1.00 0.00 H new ATOM 0 HB2 ARG A 43 16.022 -1.738 -3.012 1.00 0.00 H new ATOM 0 HB3 ARG A 43 15.385 -3.307 -2.561 1.00 0.00 H new ATOM 0 HG2 ARG A 43 13.213 -2.724 -3.021 1.00 0.00 H new ATOM 0 HG3 ARG A 43 13.427 -1.062 -2.508 1.00 0.00 H new ATOM 0 HD2 ARG A 43 15.104 -1.299 -4.751 1.00 0.00 H new ATOM 0 HD3 ARG A 43 13.688 -2.238 -5.182 1.00 0.00 H new ATOM 0 HE ARG A 43 12.583 0.078 -4.173 1.00 0.00 H new ATOM 0 HH11 ARG A 43 15.051 -0.621 -6.610 1.00 0.00 H new ATOM 0 HH12 ARG A 43 14.682 0.822 -7.561 1.00 0.00 H new ATOM 0 HH21 ARG A 43 12.119 1.924 -5.406 1.00 0.00 H new ATOM 0 HH22 ARG A 43 13.031 2.254 -6.883 1.00 0.00 H new ATOM 120 N LYS A 44 15.897 0.496 -1.236 1.00 0.00 N ATOM 121 CA LYS A 44 15.679 1.925 -1.081 1.00 0.00 C ATOM 122 C LYS A 44 14.746 2.471 -2.155 1.00 0.00 C ATOM 123 O LYS A 44 14.851 2.120 -3.330 1.00 0.00 O ATOM 124 CB LYS A 44 17.008 2.675 -1.104 1.00 0.00 C ATOM 125 CG LYS A 44 17.278 3.428 0.184 1.00 0.00 C ATOM 126 CD LYS A 44 18.358 4.483 0.004 1.00 0.00 C ATOM 127 CE LYS A 44 19.478 4.315 1.018 1.00 0.00 C ATOM 128 NZ LYS A 44 20.111 2.970 0.929 1.00 0.00 N ATOM 0 H LYS A 44 16.760 0.246 -1.719 1.00 0.00 H new ATOM 0 HA LYS A 44 15.201 2.081 -0.114 1.00 0.00 H new ATOM 0 HB2 LYS A 44 17.817 1.967 -1.282 1.00 0.00 H new ATOM 0 HB3 LYS A 44 17.010 3.377 -1.938 1.00 0.00 H new ATOM 0 HG2 LYS A 44 16.359 3.903 0.527 1.00 0.00 H new ATOM 0 HG3 LYS A 44 17.582 2.725 0.959 1.00 0.00 H new ATOM 0 HD2 LYS A 44 18.767 4.418 -1.004 1.00 0.00 H new ATOM 0 HD3 LYS A 44 17.919 5.475 0.107 1.00 0.00 H new ATOM 0 HE2 LYS A 44 20.234 5.083 0.855 1.00 0.00 H new ATOM 0 HE3 LYS A 44 19.083 4.465 2.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 21.105 3.034 1.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 19.604 2.306 1.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 20.066 2.630 -0.053 1.00 0.00 H new ATOM 142 N LEU A 45 13.832 3.334 -1.728 1.00 0.00 N ATOM 143 CA LEU A 45 12.863 3.946 -2.627 1.00 0.00 C ATOM 144 C LEU A 45 13.462 5.150 -3.345 1.00 0.00 C ATOM 145 O LEU A 45 14.285 5.873 -2.784 1.00 0.00 O ATOM 146 CB LEU A 45 11.623 4.379 -1.839 1.00 0.00 C ATOM 147 CG LEU A 45 10.393 4.716 -2.685 1.00 0.00 C ATOM 148 CD1 LEU A 45 10.146 3.640 -3.730 1.00 0.00 C ATOM 149 CD2 LEU A 45 9.171 4.888 -1.797 1.00 0.00 C ATOM 0 H LEU A 45 13.742 3.627 -0.755 1.00 0.00 H new ATOM 0 HA LEU A 45 12.581 3.206 -3.376 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.358 3.582 -1.144 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.881 5.252 -1.239 1.00 0.00 H new ATOM 0 HG LEU A 45 10.581 5.656 -3.204 1.00 0.00 H new ATOM 0 HD11 LEU A 45 9.267 3.900 -4.320 1.00 0.00 H new ATOM 0 HD12 LEU A 45 11.013 3.564 -4.386 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.980 2.683 -3.235 1.00 0.00 H new ATOM 0 HD21 LEU A 45 8.304 5.127 -2.413 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.984 3.963 -1.252 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.347 5.697 -1.088 1.00 0.00 H new ATOM 161 N THR A 46 13.037 5.367 -4.587 1.00 0.00 N ATOM 162 CA THR A 46 13.526 6.490 -5.376 1.00 0.00 C ATOM 163 C THR A 46 12.696 7.739 -5.100 1.00 0.00 C ATOM 164 O THR A 46 11.529 7.645 -4.720 1.00 0.00 O ATOM 165 CB THR A 46 13.479 6.158 -6.868 1.00 0.00 C ATOM 166 OG1 THR A 46 12.152 6.249 -7.360 1.00 0.00 O ATOM 167 CG2 THR A 46 13.999 4.774 -7.193 1.00 0.00 C ATOM 0 H THR A 46 12.355 4.779 -5.067 1.00 0.00 H new ATOM 0 HA THR A 46 14.560 6.682 -5.089 1.00 0.00 H new ATOM 0 HB THR A 46 14.129 6.890 -7.347 1.00 0.00 H new ATOM 0 HG1 THR A 46 12.142 6.034 -8.316 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.937 4.605 -8.268 1.00 0.00 H new ATOM 0 HG22 THR A 46 15.037 4.691 -6.872 1.00 0.00 H new ATOM 0 HG23 THR A 46 13.398 4.028 -6.673 1.00 0.00 H new ATOM 175 N PRO A 47 13.282 8.932 -5.293 1.00 0.00 N ATOM 176 CA PRO A 47 12.581 10.197 -5.065 1.00 0.00 C ATOM 177 C PRO A 47 11.355 10.335 -5.958 1.00 0.00 C ATOM 178 O PRO A 47 10.368 10.968 -5.583 1.00 0.00 O ATOM 179 CB PRO A 47 13.625 11.266 -5.412 1.00 0.00 C ATOM 180 CG PRO A 47 14.644 10.560 -6.241 1.00 0.00 C ATOM 181 CD PRO A 47 14.665 9.141 -5.750 1.00 0.00 C ATOM 0 HA PRO A 47 12.207 10.278 -4.044 1.00 0.00 H new ATOM 0 HB2 PRO A 47 13.175 12.093 -5.961 1.00 0.00 H new ATOM 0 HB3 PRO A 47 14.072 11.687 -4.512 1.00 0.00 H new ATOM 0 HG2 PRO A 47 14.385 10.603 -7.299 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.624 11.025 -6.134 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.939 8.443 -6.542 1.00 0.00 H new ATOM 0 HD3 PRO A 47 15.383 9.004 -4.941 1.00 0.00 H new ATOM 189 N GLU A 48 11.419 9.727 -7.138 1.00 0.00 N ATOM 190 CA GLU A 48 10.308 9.774 -8.077 1.00 0.00 C ATOM 191 C GLU A 48 9.150 8.925 -7.568 1.00 0.00 C ATOM 192 O GLU A 48 7.996 9.354 -7.584 1.00 0.00 O ATOM 193 CB GLU A 48 10.753 9.284 -9.456 1.00 0.00 C ATOM 194 CG GLU A 48 9.994 9.928 -10.605 1.00 0.00 C ATOM 195 CD GLU A 48 10.339 9.315 -11.948 1.00 0.00 C ATOM 196 OE1 GLU A 48 11.216 9.866 -12.645 1.00 0.00 O ATOM 197 OE2 GLU A 48 9.732 8.283 -12.303 1.00 0.00 O ATOM 0 H GLU A 48 12.227 9.197 -7.465 1.00 0.00 H new ATOM 0 HA GLU A 48 9.974 10.808 -8.165 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.818 9.484 -9.577 1.00 0.00 H new ATOM 0 HB3 GLU A 48 10.624 8.203 -9.507 1.00 0.00 H new ATOM 0 HG2 GLU A 48 8.923 9.829 -10.429 1.00 0.00 H new ATOM 0 HG3 GLU A 48 10.216 10.995 -10.629 1.00 0.00 H new ATOM 204 N GLU A 49 9.469 7.720 -7.104 1.00 0.00 N ATOM 205 CA GLU A 49 8.456 6.815 -6.579 1.00 0.00 C ATOM 206 C GLU A 49 7.921 7.329 -5.247 1.00 0.00 C ATOM 207 O GLU A 49 6.725 7.233 -4.967 1.00 0.00 O ATOM 208 CB GLU A 49 9.034 5.410 -6.404 1.00 0.00 C ATOM 209 CG GLU A 49 9.485 4.771 -7.706 1.00 0.00 C ATOM 210 CD GLU A 49 10.531 3.696 -7.495 1.00 0.00 C ATOM 211 OE1 GLU A 49 11.461 3.920 -6.691 1.00 0.00 O ATOM 212 OE2 GLU A 49 10.422 2.628 -8.134 1.00 0.00 O ATOM 0 H GLU A 49 10.419 7.350 -7.082 1.00 0.00 H new ATOM 0 HA GLU A 49 7.634 6.770 -7.293 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.881 5.457 -5.720 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.283 4.773 -5.937 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.622 4.339 -8.212 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.888 5.541 -8.364 1.00 0.00 H new ATOM 219 N ARG A 50 8.813 7.883 -4.433 1.00 0.00 N ATOM 220 CA ARG A 50 8.428 8.417 -3.134 1.00 0.00 C ATOM 221 C ARG A 50 7.615 9.695 -3.302 1.00 0.00 C ATOM 222 O ARG A 50 6.750 10.006 -2.483 1.00 0.00 O ATOM 223 CB ARG A 50 9.668 8.688 -2.276 1.00 0.00 C ATOM 224 CG ARG A 50 9.512 8.236 -0.832 1.00 0.00 C ATOM 225 CD ARG A 50 10.726 8.602 0.006 1.00 0.00 C ATOM 226 NE ARG A 50 11.971 8.112 -0.584 1.00 0.00 N ATOM 227 CZ ARG A 50 12.764 8.842 -1.368 1.00 0.00 C ATOM 228 NH1 ARG A 50 12.444 10.094 -1.675 1.00 0.00 N ATOM 229 NH2 ARG A 50 13.881 8.316 -1.851 1.00 0.00 N ATOM 0 H ARG A 50 9.806 7.973 -4.650 1.00 0.00 H new ATOM 0 HA ARG A 50 7.810 7.675 -2.628 1.00 0.00 H new ATOM 0 HB2 ARG A 50 10.525 8.180 -2.718 1.00 0.00 H new ATOM 0 HB3 ARG A 50 9.887 9.756 -2.293 1.00 0.00 H new ATOM 0 HG2 ARG A 50 8.621 8.694 -0.402 1.00 0.00 H new ATOM 0 HG3 ARG A 50 9.362 7.157 -0.803 1.00 0.00 H new ATOM 0 HD2 ARG A 50 10.778 9.685 0.113 1.00 0.00 H new ATOM 0 HD3 ARG A 50 10.613 8.188 1.008 1.00 0.00 H new ATOM 0 HE ARG A 50 12.250 7.152 -0.383 1.00 0.00 H new ATOM 0 HH11 ARG A 50 11.585 10.505 -1.310 1.00 0.00 H new ATOM 0 HH12 ARG A 50 13.058 10.645 -2.276 1.00 0.00 H new ATOM 0 HH21 ARG A 50 14.132 7.354 -1.622 1.00 0.00 H new ATOM 0 HH22 ARG A 50 14.489 8.873 -2.451 1.00 0.00 H new ATOM 243 N SER A 51 7.895 10.432 -4.374 1.00 0.00 N ATOM 244 CA SER A 51 7.182 11.671 -4.653 1.00 0.00 C ATOM 245 C SER A 51 5.769 11.378 -5.140 1.00 0.00 C ATOM 246 O SER A 51 4.813 12.044 -4.748 1.00 0.00 O ATOM 247 CB SER A 51 7.937 12.496 -5.697 1.00 0.00 C ATOM 248 OG SER A 51 9.029 13.184 -5.112 1.00 0.00 O ATOM 0 H SER A 51 8.609 10.192 -5.061 1.00 0.00 H new ATOM 0 HA SER A 51 7.119 12.245 -3.729 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.299 11.841 -6.490 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.258 13.212 -6.160 1.00 0.00 H new ATOM 0 HG SER A 51 9.837 12.633 -5.179 1.00 0.00 H new ATOM 254 N ALA A 52 5.644 10.370 -5.993 1.00 0.00 N ATOM 255 CA ALA A 52 4.346 9.984 -6.526 1.00 0.00 C ATOM 256 C ALA A 52 3.449 9.466 -5.417 1.00 0.00 C ATOM 257 O ALA A 52 2.284 9.852 -5.310 1.00 0.00 O ATOM 258 CB ALA A 52 4.508 8.937 -7.616 1.00 0.00 C ATOM 0 H ALA A 52 6.425 9.806 -6.330 1.00 0.00 H new ATOM 0 HA ALA A 52 3.877 10.865 -6.964 1.00 0.00 H new ATOM 0 HB1 ALA A 52 3.527 8.660 -8.003 1.00 0.00 H new ATOM 0 HB2 ALA A 52 5.115 9.344 -8.424 1.00 0.00 H new ATOM 0 HB3 ALA A 52 4.997 8.055 -7.203 1.00 0.00 H new ATOM 264 N VAL A 53 4.007 8.601 -4.582 1.00 0.00 N ATOM 265 CA VAL A 53 3.270 8.039 -3.464 1.00 0.00 C ATOM 266 C VAL A 53 2.790 9.150 -2.545 1.00 0.00 C ATOM 267 O VAL A 53 1.593 9.300 -2.306 1.00 0.00 O ATOM 268 CB VAL A 53 4.144 7.052 -2.664 1.00 0.00 C ATOM 269 CG1 VAL A 53 3.393 6.520 -1.451 1.00 0.00 C ATOM 270 CG2 VAL A 53 4.603 5.910 -3.555 1.00 0.00 C ATOM 0 H VAL A 53 4.970 8.274 -4.660 1.00 0.00 H new ATOM 0 HA VAL A 53 2.412 7.498 -3.864 1.00 0.00 H new ATOM 0 HB VAL A 53 5.024 7.587 -2.306 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.031 5.826 -0.904 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.118 7.350 -0.800 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.492 6.002 -1.779 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.219 5.222 -2.976 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.734 5.380 -3.944 1.00 0.00 H new ATOM 0 HG23 VAL A 53 5.186 6.308 -4.385 1.00 0.00 H new ATOM 280 N GLU A 54 3.735 9.938 -2.046 1.00 0.00 N ATOM 281 CA GLU A 54 3.412 11.050 -1.160 1.00 0.00 C ATOM 282 C GLU A 54 2.327 11.930 -1.777 1.00 0.00 C ATOM 283 O GLU A 54 1.472 12.463 -1.071 1.00 0.00 O ATOM 284 CB GLU A 54 4.672 11.869 -0.838 1.00 0.00 C ATOM 285 CG GLU A 54 4.943 13.017 -1.801 1.00 0.00 C ATOM 286 CD GLU A 54 4.366 14.335 -1.320 1.00 0.00 C ATOM 287 OE1 GLU A 54 4.387 15.311 -2.098 1.00 0.00 O ATOM 288 OE2 GLU A 54 3.893 14.390 -0.165 1.00 0.00 O ATOM 0 H GLU A 54 4.730 9.828 -2.240 1.00 0.00 H new ATOM 0 HA GLU A 54 3.026 10.646 -0.224 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.580 12.272 0.171 1.00 0.00 H new ATOM 0 HB3 GLU A 54 5.534 11.201 -0.837 1.00 0.00 H new ATOM 0 HG2 GLU A 54 6.019 13.125 -1.937 1.00 0.00 H new ATOM 0 HG3 GLU A 54 4.521 12.775 -2.776 1.00 0.00 H new ATOM 295 N ASN A 55 2.359 12.064 -3.101 1.00 0.00 N ATOM 296 CA ASN A 55 1.366 12.864 -3.806 1.00 0.00 C ATOM 297 C ASN A 55 0.007 12.176 -3.759 1.00 0.00 C ATOM 298 O ASN A 55 -1.033 12.828 -3.645 1.00 0.00 O ATOM 299 CB ASN A 55 1.786 13.077 -5.263 1.00 0.00 C ATOM 300 CG ASN A 55 3.008 13.964 -5.393 1.00 0.00 C ATOM 301 OD1 ASN A 55 3.234 14.855 -4.575 1.00 0.00 O ATOM 302 ND2 ASN A 55 3.803 13.721 -6.428 1.00 0.00 N ATOM 0 H ASN A 55 3.059 11.630 -3.703 1.00 0.00 H new ATOM 0 HA ASN A 55 1.294 13.834 -3.314 1.00 0.00 H new ATOM 0 HB2 ASN A 55 1.992 12.111 -5.723 1.00 0.00 H new ATOM 0 HB3 ASN A 55 0.958 13.522 -5.815 1.00 0.00 H new ATOM 0 HD21 ASN A 55 4.641 14.284 -6.570 1.00 0.00 H new ATOM 0 HD22 ASN A 55 3.575 12.971 -7.081 1.00 0.00 H new ATOM 309 N TYR A 56 0.030 10.851 -3.845 1.00 0.00 N ATOM 310 CA TYR A 56 -1.181 10.055 -3.814 1.00 0.00 C ATOM 311 C TYR A 56 -1.795 10.052 -2.414 1.00 0.00 C ATOM 312 O TYR A 56 -2.990 10.300 -2.252 1.00 0.00 O ATOM 313 CB TYR A 56 -0.855 8.630 -4.270 1.00 0.00 C ATOM 314 CG TYR A 56 -1.934 7.627 -3.961 1.00 0.00 C ATOM 315 CD1 TYR A 56 -1.707 6.601 -3.058 1.00 0.00 C ATOM 316 CD2 TYR A 56 -3.178 7.713 -4.565 1.00 0.00 C ATOM 317 CE1 TYR A 56 -2.692 5.684 -2.765 1.00 0.00 C ATOM 318 CE2 TYR A 56 -4.171 6.800 -4.279 1.00 0.00 C ATOM 319 CZ TYR A 56 -3.923 5.786 -3.377 1.00 0.00 C ATOM 320 OH TYR A 56 -4.911 4.875 -3.085 1.00 0.00 O ATOM 0 H TYR A 56 0.886 10.305 -3.938 1.00 0.00 H new ATOM 0 HA TYR A 56 -1.915 10.490 -4.492 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -0.675 8.636 -5.345 1.00 0.00 H new ATOM 0 HB3 TYR A 56 0.072 8.310 -3.794 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -0.744 6.519 -2.577 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -3.373 8.507 -5.271 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -2.501 4.889 -2.059 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -5.136 6.878 -4.758 1.00 0.00 H new ATOM 0 HH TYR A 56 -5.739 5.350 -2.865 1.00 0.00 H new ATOM 330 N LEU A 57 -0.973 9.776 -1.406 1.00 0.00 N ATOM 331 CA LEU A 57 -1.442 9.750 -0.024 1.00 0.00 C ATOM 332 C LEU A 57 -1.951 11.127 0.392 1.00 0.00 C ATOM 333 O LEU A 57 -2.913 11.243 1.151 1.00 0.00 O ATOM 334 CB LEU A 57 -0.316 9.315 0.918 1.00 0.00 C ATOM 335 CG LEU A 57 0.580 8.193 0.393 1.00 0.00 C ATOM 336 CD1 LEU A 57 1.495 7.681 1.493 1.00 0.00 C ATOM 337 CD2 LEU A 57 -0.261 7.062 -0.174 1.00 0.00 C ATOM 0 H LEU A 57 0.019 9.568 -1.519 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.259 9.031 0.043 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.307 10.182 1.137 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.758 8.993 1.861 1.00 0.00 H new ATOM 0 HG LEU A 57 1.201 8.594 -0.408 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.125 6.883 1.100 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.123 8.496 1.852 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.894 7.296 2.317 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.393 6.272 -0.543 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.908 6.662 0.607 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.873 7.439 -0.994 1.00 0.00 H new ATOM 349 N GLU A 58 -1.295 12.169 -0.112 1.00 0.00 N ATOM 350 CA GLU A 58 -1.679 13.540 0.206 1.00 0.00 C ATOM 351 C GLU A 58 -3.054 13.852 -0.367 1.00 0.00 C ATOM 352 O GLU A 58 -3.932 14.355 0.335 1.00 0.00 O ATOM 353 CB GLU A 58 -0.647 14.528 -0.341 1.00 0.00 C ATOM 354 CG GLU A 58 -0.734 15.910 0.288 1.00 0.00 C ATOM 355 CD GLU A 58 -0.903 17.011 -0.740 1.00 0.00 C ATOM 356 OE1 GLU A 58 -0.462 16.820 -1.893 1.00 0.00 O ATOM 357 OE2 GLU A 58 -1.477 18.064 -0.392 1.00 0.00 O ATOM 0 H GLU A 58 -0.496 12.090 -0.741 1.00 0.00 H new ATOM 0 HA GLU A 58 -1.718 13.641 1.291 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.352 14.125 -0.176 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -0.780 14.620 -1.419 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -1.573 15.936 0.983 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.168 16.097 0.870 1.00 0.00 H new ATOM 364 N SER A 59 -3.237 13.535 -1.640 1.00 0.00 N ATOM 365 CA SER A 59 -4.515 13.763 -2.305 1.00 0.00 C ATOM 366 C SER A 59 -5.587 12.861 -1.702 1.00 0.00 C ATOM 367 O SER A 59 -6.777 13.177 -1.738 1.00 0.00 O ATOM 368 CB SER A 59 -4.390 13.499 -3.806 1.00 0.00 C ATOM 369 OG SER A 59 -5.666 13.438 -4.421 1.00 0.00 O ATOM 0 H SER A 59 -2.519 13.120 -2.234 1.00 0.00 H new ATOM 0 HA SER A 59 -4.803 14.804 -2.158 1.00 0.00 H new ATOM 0 HB2 SER A 59 -3.797 14.288 -4.269 1.00 0.00 H new ATOM 0 HB3 SER A 59 -3.858 12.562 -3.971 1.00 0.00 H new ATOM 0 HG SER A 59 -5.559 13.270 -5.381 1.00 0.00 H new ATOM 623 N SER A 78 -5.851 6.813 6.505 1.00 0.00 N ATOM 624 CA SER A 78 -4.741 7.626 6.025 1.00 0.00 C ATOM 625 C SER A 78 -3.504 7.398 6.886 1.00 0.00 C ATOM 626 O SER A 78 -3.558 7.509 8.110 1.00 0.00 O ATOM 627 CB SER A 78 -5.122 9.107 6.030 1.00 0.00 C ATOM 628 OG SER A 78 -5.864 9.440 7.191 1.00 0.00 O ATOM 0 HA SER A 78 -4.514 7.328 5.001 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.220 9.718 5.984 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.709 9.337 5.141 1.00 0.00 H new ATOM 0 HG SER A 78 -6.279 8.631 7.557 1.00 0.00 H new ATOM 634 N LEU A 79 -2.395 7.064 6.238 1.00 0.00 N ATOM 635 CA LEU A 79 -1.146 6.804 6.948 1.00 0.00 C ATOM 636 C LEU A 79 -0.143 7.937 6.749 1.00 0.00 C ATOM 637 O LEU A 79 0.063 8.412 5.632 1.00 0.00 O ATOM 638 CB LEU A 79 -0.542 5.478 6.480 1.00 0.00 C ATOM 639 CG LEU A 79 -0.781 5.124 5.011 1.00 0.00 C ATOM 640 CD1 LEU A 79 -0.053 6.098 4.098 1.00 0.00 C ATOM 641 CD2 LEU A 79 -0.340 3.695 4.735 1.00 0.00 C ATOM 0 H LEU A 79 -2.333 6.967 5.225 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.373 6.742 8.012 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.533 5.506 6.658 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.947 4.677 7.099 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.849 5.202 4.805 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.236 5.828 3.058 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.417 7.109 4.280 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.017 6.056 4.301 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.516 3.456 3.686 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.722 3.593 4.958 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.910 3.011 5.363 1.00 0.00 H new ATOM 653 N ALA A 80 0.485 8.359 7.845 1.00 0.00 N ATOM 654 CA ALA A 80 1.477 9.429 7.801 1.00 0.00 C ATOM 655 C ALA A 80 2.858 8.868 7.483 1.00 0.00 C ATOM 656 O ALA A 80 3.309 7.914 8.115 1.00 0.00 O ATOM 657 CB ALA A 80 1.501 10.183 9.122 1.00 0.00 C ATOM 0 H ALA A 80 0.323 7.975 8.776 1.00 0.00 H new ATOM 0 HA ALA A 80 1.199 10.124 7.009 1.00 0.00 H new ATOM 0 HB1 ALA A 80 2.245 10.978 9.074 1.00 0.00 H new ATOM 0 HB2 ALA A 80 0.519 10.617 9.311 1.00 0.00 H new ATOM 0 HB3 ALA A 80 1.756 9.496 9.929 1.00 0.00 H new ATOM 663 N LEU A 81 3.520 9.455 6.492 1.00 0.00 N ATOM 664 CA LEU A 81 4.842 8.995 6.080 1.00 0.00 C ATOM 665 C LEU A 81 5.883 9.208 7.174 1.00 0.00 C ATOM 666 O LEU A 81 5.783 10.136 7.978 1.00 0.00 O ATOM 667 CB LEU A 81 5.278 9.718 4.804 1.00 0.00 C ATOM 668 CG LEU A 81 4.513 9.322 3.540 1.00 0.00 C ATOM 669 CD1 LEU A 81 3.118 9.927 3.549 1.00 0.00 C ATOM 670 CD2 LEU A 81 5.277 9.757 2.298 1.00 0.00 C ATOM 0 H LEU A 81 3.164 10.249 5.960 1.00 0.00 H new ATOM 0 HA LEU A 81 4.771 7.924 5.889 1.00 0.00 H new ATOM 0 HB2 LEU A 81 5.166 10.791 4.957 1.00 0.00 H new ATOM 0 HB3 LEU A 81 6.339 9.528 4.642 1.00 0.00 H new ATOM 0 HG LEU A 81 4.415 8.237 3.522 1.00 0.00 H new ATOM 0 HD11 LEU A 81 2.589 9.635 2.642 1.00 0.00 H new ATOM 0 HD12 LEU A 81 2.571 9.567 4.420 1.00 0.00 H new ATOM 0 HD13 LEU A 81 3.193 11.014 3.591 1.00 0.00 H new ATOM 0 HD21 LEU A 81 4.719 9.468 1.408 1.00 0.00 H new ATOM 0 HD22 LEU A 81 5.405 10.839 2.310 1.00 0.00 H new ATOM 0 HD23 LEU A 81 6.255 9.276 2.285 1.00 0.00 H new ATOM 682 N ASN A 82 6.885 8.333 7.189 1.00 0.00 N ATOM 683 CA ASN A 82 7.963 8.398 8.168 1.00 0.00 C ATOM 684 C ASN A 82 9.299 8.076 7.507 1.00 0.00 C ATOM 685 O ASN A 82 9.360 7.834 6.302 1.00 0.00 O ATOM 686 CB ASN A 82 7.707 7.414 9.309 1.00 0.00 C ATOM 687 CG ASN A 82 6.812 7.992 10.386 1.00 0.00 C ATOM 688 OD1 ASN A 82 6.442 9.165 10.341 1.00 0.00 O ATOM 689 ND2 ASN A 82 6.462 7.165 11.364 1.00 0.00 N ATOM 0 H ASN A 82 6.971 7.563 6.526 1.00 0.00 H new ATOM 0 HA ASN A 82 7.998 9.410 8.571 1.00 0.00 H new ATOM 0 HB2 ASN A 82 7.250 6.509 8.908 1.00 0.00 H new ATOM 0 HB3 ASN A 82 8.659 7.121 9.751 1.00 0.00 H new ATOM 0 HD21 ASN A 82 5.862 7.494 12.120 1.00 0.00 H new ATOM 0 HD22 ASN A 82 6.793 6.200 11.359 1.00 0.00 H new ATOM 696 N ALA A 83 10.369 8.070 8.297 1.00 0.00 N ATOM 697 CA ALA A 83 11.696 7.770 7.771 1.00 0.00 C ATOM 698 C ALA A 83 11.701 6.437 7.028 1.00 0.00 C ATOM 699 O ALA A 83 12.435 6.261 6.056 1.00 0.00 O ATOM 700 CB ALA A 83 12.725 7.756 8.890 1.00 0.00 C ATOM 0 H ALA A 83 10.343 8.268 9.297 1.00 0.00 H new ATOM 0 HA ALA A 83 11.962 8.555 7.064 1.00 0.00 H new ATOM 0 HB1 ALA A 83 13.708 7.530 8.477 1.00 0.00 H new ATOM 0 HB2 ALA A 83 12.750 8.732 9.374 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.456 6.995 9.622 1.00 0.00 H new ATOM 706 N GLU A 84 10.865 5.506 7.481 1.00 0.00 N ATOM 707 CA GLU A 84 10.768 4.199 6.845 1.00 0.00 C ATOM 708 C GLU A 84 10.190 4.339 5.440 1.00 0.00 C ATOM 709 O GLU A 84 10.368 3.462 4.595 1.00 0.00 O ATOM 710 CB GLU A 84 9.901 3.258 7.684 1.00 0.00 C ATOM 711 CG GLU A 84 10.513 1.879 7.877 1.00 0.00 C ATOM 712 CD GLU A 84 10.129 0.912 6.776 1.00 0.00 C ATOM 713 OE1 GLU A 84 9.098 1.147 6.111 1.00 0.00 O ATOM 714 OE2 GLU A 84 10.859 -0.083 6.577 1.00 0.00 O ATOM 0 H GLU A 84 10.248 5.633 8.283 1.00 0.00 H new ATOM 0 HA GLU A 84 11.769 3.773 6.772 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.728 3.710 8.661 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.927 3.151 7.206 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.599 1.969 7.914 1.00 0.00 H new ATOM 0 HG3 GLU A 84 10.194 1.475 8.838 1.00 0.00 H new ATOM 721 N SER A 85 9.507 5.460 5.196 1.00 0.00 N ATOM 722 CA SER A 85 8.906 5.739 3.893 1.00 0.00 C ATOM 723 C SER A 85 9.914 5.556 2.757 1.00 0.00 C ATOM 724 O SER A 85 9.531 5.456 1.592 1.00 0.00 O ATOM 725 CB SER A 85 8.350 7.164 3.862 1.00 0.00 C ATOM 726 OG SER A 85 7.327 7.333 4.829 1.00 0.00 O ATOM 0 H SER A 85 9.357 6.192 5.890 1.00 0.00 H new ATOM 0 HA SER A 85 8.095 5.026 3.745 1.00 0.00 H new ATOM 0 HB2 SER A 85 9.154 7.876 4.050 1.00 0.00 H new ATOM 0 HB3 SER A 85 7.956 7.383 2.869 1.00 0.00 H new ATOM 0 HG SER A 85 7.004 6.455 5.120 1.00 0.00 H new ATOM 732 N ASN A 86 11.200 5.519 3.096 1.00 0.00 N ATOM 733 CA ASN A 86 12.244 5.353 2.096 1.00 0.00 C ATOM 734 C ASN A 86 12.556 3.877 1.869 1.00 0.00 C ATOM 735 O ASN A 86 12.863 3.466 0.754 1.00 0.00 O ATOM 736 CB ASN A 86 13.515 6.089 2.526 1.00 0.00 C ATOM 737 CG ASN A 86 13.228 7.460 3.110 1.00 0.00 C ATOM 738 OD1 ASN A 86 12.362 7.614 3.972 1.00 0.00 O ATOM 739 ND2 ASN A 86 13.959 8.464 2.644 1.00 0.00 N ATOM 0 H ASN A 86 11.541 5.602 4.054 1.00 0.00 H new ATOM 0 HA ASN A 86 11.881 5.778 1.160 1.00 0.00 H new ATOM 0 HB2 ASN A 86 14.046 5.488 3.264 1.00 0.00 H new ATOM 0 HB3 ASN A 86 14.177 6.196 1.666 1.00 0.00 H new ATOM 0 HD21 ASN A 86 13.814 9.409 3.000 1.00 0.00 H new ATOM 0 HD22 ASN A 86 14.666 8.291 1.929 1.00 0.00 H new ATOM 746 N ASN A 87 12.480 3.085 2.933 1.00 0.00 N ATOM 747 CA ASN A 87 12.765 1.656 2.836 1.00 0.00 C ATOM 748 C ASN A 87 11.542 0.882 2.358 1.00 0.00 C ATOM 749 O ASN A 87 10.594 0.678 3.114 1.00 0.00 O ATOM 750 CB ASN A 87 13.207 1.113 4.196 1.00 0.00 C ATOM 751 CG ASN A 87 14.162 2.042 4.917 1.00 0.00 C ATOM 752 OD1 ASN A 87 15.137 2.524 4.340 1.00 0.00 O ATOM 753 ND2 ASN A 87 13.883 2.297 6.190 1.00 0.00 N ATOM 0 H ASN A 87 12.225 3.405 3.868 1.00 0.00 H new ATOM 0 HA ASN A 87 13.567 1.525 2.109 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.328 0.948 4.819 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.686 0.144 4.057 1.00 0.00 H new ATOM 0 HD21 ASN A 87 14.488 2.915 6.731 1.00 0.00 H new ATOM 0 HD22 ASN A 87 13.064 1.875 6.627 1.00 0.00 H new ATOM 760 N VAL A 88 11.577 0.437 1.107 1.00 0.00 N ATOM 761 CA VAL A 88 10.470 -0.328 0.537 1.00 0.00 C ATOM 762 C VAL A 88 10.588 -1.810 0.883 1.00 0.00 C ATOM 763 O VAL A 88 11.686 -2.364 0.914 1.00 0.00 O ATOM 764 CB VAL A 88 10.405 -0.170 -0.995 1.00 0.00 C ATOM 765 CG1 VAL A 88 9.202 -0.912 -1.562 1.00 0.00 C ATOM 766 CG2 VAL A 88 10.359 1.303 -1.380 1.00 0.00 C ATOM 0 H VAL A 88 12.357 0.591 0.468 1.00 0.00 H new ATOM 0 HA VAL A 88 9.554 0.071 0.973 1.00 0.00 H new ATOM 0 HB VAL A 88 11.307 -0.608 -1.423 1.00 0.00 H new ATOM 0 HG11 VAL A 88 9.175 -0.788 -2.645 1.00 0.00 H new ATOM 0 HG12 VAL A 88 9.281 -1.972 -1.320 1.00 0.00 H new ATOM 0 HG13 VAL A 88 8.288 -0.508 -1.127 1.00 0.00 H new ATOM 0 HG21 VAL A 88 10.313 1.394 -2.465 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.476 1.767 -0.939 1.00 0.00 H new ATOM 0 HG23 VAL A 88 11.254 1.804 -1.011 1.00 0.00 H new ATOM 776 N MET A 89 9.446 -2.442 1.138 1.00 0.00 N ATOM 777 CA MET A 89 9.409 -3.861 1.479 1.00 0.00 C ATOM 778 C MET A 89 8.653 -4.646 0.411 1.00 0.00 C ATOM 779 O MET A 89 7.518 -4.313 0.075 1.00 0.00 O ATOM 780 CB MET A 89 8.749 -4.060 2.847 1.00 0.00 C ATOM 781 CG MET A 89 9.744 -4.292 3.973 1.00 0.00 C ATOM 782 SD MET A 89 10.306 -2.754 4.729 1.00 0.00 S ATOM 783 CE MET A 89 10.752 -3.325 6.367 1.00 0.00 C ATOM 0 H MET A 89 8.531 -1.992 1.115 1.00 0.00 H new ATOM 0 HA MET A 89 10.432 -4.233 1.525 1.00 0.00 H new ATOM 0 HB2 MET A 89 8.145 -3.183 3.081 1.00 0.00 H new ATOM 0 HB3 MET A 89 8.069 -4.910 2.793 1.00 0.00 H new ATOM 0 HG2 MET A 89 9.284 -4.921 4.736 1.00 0.00 H new ATOM 0 HG3 MET A 89 10.604 -4.838 3.586 1.00 0.00 H new ATOM 0 HE1 MET A 89 11.387 -2.583 6.851 1.00 0.00 H new ATOM 0 HE2 MET A 89 9.849 -3.472 6.960 1.00 0.00 H new ATOM 0 HE3 MET A 89 11.292 -4.269 6.289 1.00 0.00 H new ATOM 793 N MET A 90 9.288 -5.682 -0.125 1.00 0.00 N ATOM 794 CA MET A 90 8.672 -6.502 -1.164 1.00 0.00 C ATOM 795 C MET A 90 8.297 -7.879 -0.627 1.00 0.00 C ATOM 796 O MET A 90 9.104 -8.540 0.026 1.00 0.00 O ATOM 797 CB MET A 90 9.625 -6.649 -2.350 1.00 0.00 C ATOM 798 CG MET A 90 9.831 -5.359 -3.127 1.00 0.00 C ATOM 799 SD MET A 90 11.526 -4.752 -3.033 1.00 0.00 S ATOM 800 CE MET A 90 11.411 -3.646 -1.629 1.00 0.00 C ATOM 0 H MET A 90 10.228 -5.975 0.142 1.00 0.00 H new ATOM 0 HA MET A 90 7.760 -6.003 -1.492 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.590 -7.004 -1.988 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.237 -7.412 -3.025 1.00 0.00 H new ATOM 0 HG2 MET A 90 9.566 -5.523 -4.171 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.154 -4.596 -2.742 1.00 0.00 H new ATOM 0 HE1 MET A 90 12.412 -3.413 -1.266 1.00 0.00 H new ATOM 0 HE2 MET A 90 10.911 -2.726 -1.931 1.00 0.00 H new ATOM 0 HE3 MET A 90 10.839 -4.125 -0.834 1.00 0.00 H new ATOM 810 N LEU A 91 7.068 -8.309 -0.903 1.00 0.00 N ATOM 811 CA LEU A 91 6.603 -9.613 -0.437 1.00 0.00 C ATOM 812 C LEU A 91 5.433 -10.133 -1.255 1.00 0.00 C ATOM 813 O LEU A 91 4.533 -9.380 -1.626 1.00 0.00 O ATOM 814 CB LEU A 91 6.159 -9.530 1.024 1.00 0.00 C ATOM 815 CG LEU A 91 4.984 -8.582 1.281 1.00 0.00 C ATOM 816 CD1 LEU A 91 3.889 -9.286 2.069 1.00 0.00 C ATOM 817 CD2 LEU A 91 5.451 -7.331 2.008 1.00 0.00 C ATOM 0 H LEU A 91 6.382 -7.780 -1.441 1.00 0.00 H new ATOM 0 HA LEU A 91 7.444 -10.298 -0.548 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.884 -10.529 1.364 1.00 0.00 H new ATOM 0 HB3 LEU A 91 7.007 -9.209 1.630 1.00 0.00 H new ATOM 0 HG LEU A 91 4.571 -8.281 0.318 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.063 -8.596 2.241 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.530 -10.147 1.504 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.288 -9.621 3.027 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.600 -6.671 2.180 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.894 -7.610 2.964 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.194 -6.814 1.401 1.00 0.00 H new ATOM 829 N THR A 92 5.419 -11.443 -1.473 1.00 0.00 N ATOM 830 CA THR A 92 4.320 -12.079 -2.176 1.00 0.00 C ATOM 831 C THR A 92 3.305 -12.496 -1.124 1.00 0.00 C ATOM 832 O THR A 92 3.601 -13.335 -0.273 1.00 0.00 O ATOM 833 CB THR A 92 4.806 -13.293 -2.972 1.00 0.00 C ATOM 834 OG1 THR A 92 3.747 -13.851 -3.730 1.00 0.00 O ATOM 835 CG2 THR A 92 5.376 -14.394 -2.102 1.00 0.00 C ATOM 0 H THR A 92 6.156 -12.081 -1.172 1.00 0.00 H new ATOM 0 HA THR A 92 3.875 -11.391 -2.894 1.00 0.00 H new ATOM 0 HB THR A 92 5.600 -12.915 -3.617 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.077 -14.624 -4.233 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.701 -15.223 -2.731 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.227 -14.010 -1.540 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.611 -14.743 -1.409 1.00 0.00 H new ATOM 843 N HIS A 93 2.136 -11.872 -1.135 1.00 0.00 N ATOM 844 CA HIS A 93 1.140 -12.164 -0.115 1.00 0.00 C ATOM 845 C HIS A 93 -0.275 -11.827 -0.572 1.00 0.00 C ATOM 846 O HIS A 93 -0.480 -10.964 -1.426 1.00 0.00 O ATOM 847 CB HIS A 93 1.493 -11.353 1.133 1.00 0.00 C ATOM 848 CG HIS A 93 1.344 -12.096 2.419 1.00 0.00 C ATOM 849 ND1 HIS A 93 0.134 -12.546 2.899 1.00 0.00 N ATOM 850 CD2 HIS A 93 2.270 -12.455 3.337 1.00 0.00 C ATOM 851 CE1 HIS A 93 0.320 -13.148 4.058 1.00 0.00 C ATOM 852 NE2 HIS A 93 1.609 -13.108 4.347 1.00 0.00 N ATOM 0 H HIS A 93 1.857 -11.174 -1.824 1.00 0.00 H new ATOM 0 HA HIS A 93 1.154 -13.234 0.093 1.00 0.00 H new ATOM 0 HB2 HIS A 93 2.523 -11.006 1.046 1.00 0.00 H new ATOM 0 HB3 HIS A 93 0.860 -10.466 1.165 1.00 0.00 H new ATOM 0 HD2 HIS A 93 3.332 -12.264 3.285 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.450 -13.597 4.667 1.00 0.00 H new ATOM 0 HE2 HIS A 93 2.042 -13.499 5.184 1.00 0.00 H new ATOM 861 N ALA A 94 -1.250 -12.509 0.026 1.00 0.00 N ATOM 862 CA ALA A 94 -2.653 -12.283 -0.289 1.00 0.00 C ATOM 863 C ALA A 94 -3.154 -11.022 0.405 1.00 0.00 C ATOM 864 O ALA A 94 -2.914 -10.824 1.596 1.00 0.00 O ATOM 865 CB ALA A 94 -3.487 -13.484 0.130 1.00 0.00 C ATOM 0 H ALA A 94 -1.089 -13.225 0.734 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.752 -12.149 -1.366 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.534 -13.302 -0.111 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.141 -14.370 -0.402 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -3.384 -13.642 1.204 1.00 0.00 H new ATOM 871 N ILE A 95 -3.839 -10.166 -0.343 1.00 0.00 N ATOM 872 CA ILE A 95 -4.354 -8.922 0.214 1.00 0.00 C ATOM 873 C ILE A 95 -5.834 -9.032 0.563 1.00 0.00 C ATOM 874 O ILE A 95 -6.604 -9.682 -0.145 1.00 0.00 O ATOM 875 CB ILE A 95 -4.147 -7.744 -0.757 1.00 0.00 C ATOM 876 CG1 ILE A 95 -2.794 -7.883 -1.470 1.00 0.00 C ATOM 877 CG2 ILE A 95 -4.241 -6.423 -0.004 1.00 0.00 C ATOM 878 CD1 ILE A 95 -2.288 -6.604 -2.100 1.00 0.00 C ATOM 0 H ILE A 95 -4.050 -10.309 -1.331 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.791 -8.734 1.128 1.00 0.00 H new ATOM 0 HB ILE A 95 -4.932 -7.758 -1.513 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -2.054 -8.239 -0.753 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.881 -8.646 -2.244 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.093 -5.597 -0.699 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -5.224 -6.337 0.458 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -3.473 -6.389 0.768 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -1.328 -6.791 -2.582 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -3.005 -6.256 -2.843 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -2.165 -5.843 -1.330 1.00 0.00 H new ATOM 890 N THR A 96 -6.223 -8.393 1.663 1.00 0.00 N ATOM 891 CA THR A 96 -7.609 -8.414 2.115 1.00 0.00 C ATOM 892 C THR A 96 -8.222 -7.020 2.053 1.00 0.00 C ATOM 893 O THR A 96 -7.516 -6.017 2.154 1.00 0.00 O ATOM 894 CB THR A 96 -7.694 -8.959 3.542 1.00 0.00 C ATOM 895 OG1 THR A 96 -6.557 -9.746 3.848 1.00 0.00 O ATOM 896 CG2 THR A 96 -8.921 -9.813 3.784 1.00 0.00 C ATOM 0 H THR A 96 -5.595 -7.853 2.259 1.00 0.00 H new ATOM 0 HA THR A 96 -8.172 -9.069 1.450 1.00 0.00 H new ATOM 0 HB THR A 96 -7.749 -8.080 4.184 1.00 0.00 H new ATOM 0 HG1 THR A 96 -6.630 -10.083 4.765 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.920 -10.168 4.815 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.818 -9.220 3.605 1.00 0.00 H new ATOM 0 HG23 THR A 96 -8.909 -10.667 3.107 1.00 0.00 H new ATOM 904 N ARG A 97 -9.539 -6.965 1.881 1.00 0.00 N ATOM 905 CA ARG A 97 -10.245 -5.691 1.802 1.00 0.00 C ATOM 906 C ARG A 97 -11.254 -5.554 2.937 1.00 0.00 C ATOM 907 O ARG A 97 -12.259 -6.264 2.980 1.00 0.00 O ATOM 908 CB ARG A 97 -10.956 -5.562 0.454 1.00 0.00 C ATOM 909 CG ARG A 97 -11.106 -4.126 -0.019 1.00 0.00 C ATOM 910 CD ARG A 97 -11.373 -4.056 -1.514 1.00 0.00 C ATOM 911 NE ARG A 97 -11.858 -2.740 -1.923 1.00 0.00 N ATOM 912 CZ ARG A 97 -12.501 -2.509 -3.065 1.00 0.00 C ATOM 913 NH1 ARG A 97 -12.736 -3.501 -3.915 1.00 0.00 N ATOM 914 NH2 ARG A 97 -12.911 -1.282 -3.359 1.00 0.00 N ATOM 0 H ARG A 97 -10.138 -7.786 1.794 1.00 0.00 H new ATOM 0 HA ARG A 97 -9.510 -4.891 1.897 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -10.401 -6.127 -0.295 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -11.944 -6.016 0.529 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -11.924 -3.648 0.520 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -10.200 -3.568 0.216 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -10.457 -4.290 -2.057 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -12.107 -4.814 -1.787 1.00 0.00 H new ATOM 0 HE ARG A 97 -11.694 -1.952 -1.296 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -12.423 -4.446 -3.694 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -13.229 -3.318 -4.789 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -12.733 -0.516 -2.710 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -13.404 -1.105 -4.234 1.00 0.00 H new ATOM 928 N TYR A 98 -10.980 -4.630 3.852 1.00 0.00 N ATOM 929 CA TYR A 98 -11.863 -4.389 4.986 1.00 0.00 C ATOM 930 C TYR A 98 -12.567 -3.044 4.846 1.00 0.00 C ATOM 931 O TYR A 98 -12.000 -2.000 5.168 1.00 0.00 O ATOM 932 CB TYR A 98 -11.066 -4.421 6.292 1.00 0.00 C ATOM 933 CG TYR A 98 -10.749 -5.818 6.777 1.00 0.00 C ATOM 934 CD1 TYR A 98 -11.533 -6.432 7.744 1.00 0.00 C ATOM 935 CD2 TYR A 98 -9.664 -6.520 6.266 1.00 0.00 C ATOM 936 CE1 TYR A 98 -11.246 -7.709 8.189 1.00 0.00 C ATOM 937 CE2 TYR A 98 -9.371 -7.797 6.706 1.00 0.00 C ATOM 938 CZ TYR A 98 -10.165 -8.387 7.668 1.00 0.00 C ATOM 939 OH TYR A 98 -9.876 -9.657 8.109 1.00 0.00 O ATOM 0 H TYR A 98 -10.152 -4.035 3.830 1.00 0.00 H new ATOM 0 HA TYR A 98 -12.616 -5.177 5.005 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -10.133 -3.874 6.152 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -11.629 -3.897 7.064 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -12.381 -5.904 8.155 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -9.040 -6.061 5.514 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -11.866 -8.173 8.942 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -8.525 -8.330 6.299 1.00 0.00 H new ATOM 0 HH TYR A 98 -9.084 -9.994 7.640 1.00 0.00 H new ATOM 949 N GLY A 99 -13.804 -3.075 4.362 1.00 0.00 N ATOM 950 CA GLY A 99 -14.559 -1.851 4.187 1.00 0.00 C ATOM 951 C GLY A 99 -15.175 -1.353 5.478 1.00 0.00 C ATOM 952 O GLY A 99 -15.843 -2.104 6.188 1.00 0.00 O ATOM 0 H GLY A 99 -14.296 -3.926 4.088 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -13.904 -1.080 3.781 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -15.348 -2.018 3.454 1.00 0.00 H new ATOM 956 N ILE A 100 -14.947 -0.079 5.782 1.00 0.00 N ATOM 957 CA ILE A 100 -15.484 0.524 6.994 1.00 0.00 C ATOM 958 C ILE A 100 -16.114 1.880 6.707 1.00 0.00 C ATOM 959 O ILE A 100 -17.185 2.202 7.223 1.00 0.00 O ATOM 960 CB ILE A 100 -14.398 0.693 8.074 1.00 0.00 C ATOM 961 CG1 ILE A 100 -13.188 1.436 7.506 1.00 0.00 C ATOM 962 CG2 ILE A 100 -13.985 -0.663 8.625 1.00 0.00 C ATOM 963 CD1 ILE A 100 -13.260 2.937 7.688 1.00 0.00 C ATOM 0 H ILE A 100 -14.394 0.555 5.205 1.00 0.00 H new ATOM 0 HA ILE A 100 -16.250 -0.157 7.365 1.00 0.00 H new ATOM 0 HB ILE A 100 -14.810 1.286 8.891 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -12.284 1.063 7.987 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -13.100 1.211 6.443 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -13.217 -0.528 9.387 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -14.851 -1.156 9.066 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -13.590 -1.279 7.817 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -12.369 3.398 7.262 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -14.146 3.323 7.183 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -13.317 3.172 8.751 1.00 0.00 H new ATOM 975 N SER A 101 -15.442 2.672 5.882 1.00 0.00 N ATOM 976 CA SER A 101 -15.932 3.997 5.523 1.00 0.00 C ATOM 977 C SER A 101 -17.328 3.920 4.913 1.00 0.00 C ATOM 978 O SER A 101 -18.143 4.826 5.088 1.00 0.00 O ATOM 979 CB SER A 101 -14.973 4.666 4.536 1.00 0.00 C ATOM 980 OG SER A 101 -14.857 6.054 4.797 1.00 0.00 O ATOM 0 H SER A 101 -14.554 2.420 5.448 1.00 0.00 H new ATOM 0 HA SER A 101 -15.986 4.593 6.434 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.991 4.197 4.604 1.00 0.00 H new ATOM 0 HB3 SER A 101 -15.330 4.513 3.517 1.00 0.00 H new ATOM 0 HG SER A 101 -14.989 6.555 3.965 1.00 0.00 H new ATOM 986 N THR A 102 -17.594 2.837 4.190 1.00 0.00 N ATOM 987 CA THR A 102 -18.890 2.648 3.547 1.00 0.00 C ATOM 988 C THR A 102 -19.072 1.202 3.094 1.00 0.00 C ATOM 989 O THR A 102 -18.140 0.400 3.154 1.00 0.00 O ATOM 990 CB THR A 102 -19.013 3.581 2.343 1.00 0.00 C ATOM 991 OG1 THR A 102 -18.420 4.839 2.616 1.00 0.00 O ATOM 992 CG2 THR A 102 -20.445 3.834 1.920 1.00 0.00 C ATOM 0 H THR A 102 -16.931 2.078 4.035 1.00 0.00 H new ATOM 0 HA THR A 102 -19.667 2.882 4.274 1.00 0.00 H new ATOM 0 HB THR A 102 -18.496 3.067 1.532 1.00 0.00 H new ATOM 0 HG1 THR A 102 -18.778 5.194 3.456 1.00 0.00 H new ATOM 0 HG21 THR A 102 -20.457 4.504 1.060 1.00 0.00 H new ATOM 0 HG22 THR A 102 -20.917 2.889 1.650 1.00 0.00 H new ATOM 0 HG23 THR A 102 -20.993 4.291 2.744 1.00 0.00 H new ATOM 1000 N ASP A 103 -20.278 0.878 2.635 1.00 0.00 N ATOM 1001 CA ASP A 103 -20.582 -0.468 2.164 1.00 0.00 C ATOM 1002 C ASP A 103 -20.592 -0.530 0.636 1.00 0.00 C ATOM 1003 O ASP A 103 -21.007 -1.531 0.052 1.00 0.00 O ATOM 1004 CB ASP A 103 -21.934 -0.928 2.714 1.00 0.00 C ATOM 1005 CG ASP A 103 -23.041 0.070 2.436 1.00 0.00 C ATOM 1006 OD1 ASP A 103 -23.774 0.423 3.384 1.00 0.00 O ATOM 1007 OD2 ASP A 103 -23.174 0.500 1.271 1.00 0.00 O ATOM 0 H ASP A 103 -21.060 1.530 2.580 1.00 0.00 H new ATOM 0 HA ASP A 103 -19.801 -1.135 2.527 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -22.195 -1.889 2.271 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -21.851 -1.085 3.790 1.00 0.00 H new ATOM 1012 N ASP A 104 -20.129 0.541 -0.009 1.00 0.00 N ATOM 1013 CA ASP A 104 -20.082 0.597 -1.467 1.00 0.00 C ATOM 1014 C ASP A 104 -18.635 0.649 -1.953 1.00 0.00 C ATOM 1015 O ASP A 104 -17.839 1.436 -1.442 1.00 0.00 O ATOM 1016 CB ASP A 104 -20.850 1.820 -1.976 1.00 0.00 C ATOM 1017 CG ASP A 104 -22.264 1.477 -2.402 1.00 0.00 C ATOM 1018 OD1 ASP A 104 -22.917 0.675 -1.703 1.00 0.00 O ATOM 1019 OD2 ASP A 104 -22.718 2.012 -3.435 1.00 0.00 O ATOM 0 H ASP A 104 -19.782 1.380 0.456 1.00 0.00 H new ATOM 0 HA ASP A 104 -20.551 -0.304 -1.862 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -20.883 2.577 -1.193 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -20.315 2.257 -2.819 1.00 0.00 H new ATOM 1024 N PRO A 105 -18.273 -0.190 -2.945 1.00 0.00 N ATOM 1025 CA PRO A 105 -16.916 -0.250 -3.499 1.00 0.00 C ATOM 1026 C PRO A 105 -16.211 1.101 -3.540 1.00 0.00 C ATOM 1027 O PRO A 105 -16.260 1.810 -4.545 1.00 0.00 O ATOM 1028 CB PRO A 105 -17.175 -0.774 -4.903 1.00 0.00 C ATOM 1029 CG PRO A 105 -18.296 -1.737 -4.714 1.00 0.00 C ATOM 1030 CD PRO A 105 -19.161 -1.165 -3.614 1.00 0.00 C ATOM 0 HA PRO A 105 -16.248 -0.865 -2.895 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -17.447 0.030 -5.587 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -16.293 -1.261 -5.319 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -18.866 -1.857 -5.635 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -17.920 -2.723 -4.441 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -20.054 -0.685 -4.015 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -19.498 -1.940 -2.925 1.00 0.00 H new ATOM 1038 N ASN A 106 -15.548 1.447 -2.438 1.00 0.00 N ATOM 1039 CA ASN A 106 -14.827 2.707 -2.351 1.00 0.00 C ATOM 1040 C ASN A 106 -13.753 2.666 -1.265 1.00 0.00 C ATOM 1041 O ASN A 106 -13.421 1.601 -0.743 1.00 0.00 O ATOM 1042 CB ASN A 106 -15.797 3.864 -2.107 1.00 0.00 C ATOM 1043 CG ASN A 106 -16.524 3.748 -0.785 1.00 0.00 C ATOM 1044 OD1 ASN A 106 -16.086 3.039 0.121 1.00 0.00 O ATOM 1045 ND2 ASN A 106 -17.646 4.447 -0.672 1.00 0.00 N ATOM 0 H ASN A 106 -15.498 0.872 -1.597 1.00 0.00 H new ATOM 0 HA ASN A 106 -14.324 2.868 -3.305 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -15.248 4.805 -2.133 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -16.526 3.898 -2.916 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.185 4.410 0.193 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.970 5.021 -1.450 1.00 0.00 H new ATOM 1052 N LYS A 107 -13.202 3.837 -0.952 1.00 0.00 N ATOM 1053 CA LYS A 107 -12.144 3.971 0.051 1.00 0.00 C ATOM 1054 C LYS A 107 -12.372 3.071 1.264 1.00 0.00 C ATOM 1055 O LYS A 107 -13.291 3.285 2.051 1.00 0.00 O ATOM 1056 CB LYS A 107 -12.031 5.442 0.483 1.00 0.00 C ATOM 1057 CG LYS A 107 -11.321 5.664 1.813 1.00 0.00 C ATOM 1058 CD LYS A 107 -12.073 6.661 2.681 1.00 0.00 C ATOM 1059 CE LYS A 107 -11.888 6.364 4.159 1.00 0.00 C ATOM 1060 NZ LYS A 107 -12.439 7.451 5.015 1.00 0.00 N ATOM 0 H LYS A 107 -13.475 4.719 -1.385 1.00 0.00 H new ATOM 0 HA LYS A 107 -11.209 3.647 -0.406 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -11.501 5.994 -0.293 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -13.033 5.865 0.547 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -11.229 4.715 2.342 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -10.309 6.027 1.632 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -11.722 7.670 2.465 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -13.134 6.633 2.433 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -12.380 5.423 4.405 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -10.827 6.235 4.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -11.929 7.471 5.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -12.324 8.365 4.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -13.449 7.277 5.190 1.00 0.00 H new ATOM 1074 N TRP A 108 -11.507 2.070 1.394 1.00 0.00 N ATOM 1075 CA TRP A 108 -11.567 1.114 2.492 1.00 0.00 C ATOM 1076 C TRP A 108 -10.161 0.747 2.962 1.00 0.00 C ATOM 1077 O TRP A 108 -9.168 1.208 2.401 1.00 0.00 O ATOM 1078 CB TRP A 108 -12.307 -0.140 2.054 1.00 0.00 C ATOM 1079 CG TRP A 108 -13.759 0.096 1.787 1.00 0.00 C ATOM 1080 CD1 TRP A 108 -14.577 0.997 2.403 1.00 0.00 C ATOM 1081 CD2 TRP A 108 -14.565 -0.595 0.839 1.00 0.00 C ATOM 1082 NE1 TRP A 108 -15.844 0.909 1.886 1.00 0.00 N ATOM 1083 CE2 TRP A 108 -15.864 -0.070 0.930 1.00 0.00 C ATOM 1084 CE3 TRP A 108 -14.308 -1.608 -0.078 1.00 0.00 C ATOM 1085 CZ2 TRP A 108 -16.908 -0.532 0.140 1.00 0.00 C ATOM 1086 CZ3 TRP A 108 -15.344 -2.069 -0.867 1.00 0.00 C ATOM 1087 CH2 TRP A 108 -16.632 -1.531 -0.752 1.00 0.00 C ATOM 0 H TRP A 108 -10.744 1.899 0.739 1.00 0.00 H new ATOM 0 HA TRP A 108 -12.104 1.576 3.321 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -11.838 -0.535 1.153 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -12.205 -0.902 2.826 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -14.272 1.679 3.183 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -16.641 1.480 2.168 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -13.317 -2.027 -0.172 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -17.902 -0.118 0.227 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -15.158 -2.856 -1.583 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -17.423 -1.913 -1.380 1.00 0.00 H new ATOM 1098 N ARG A 109 -10.087 -0.082 3.998 1.00 0.00 N ATOM 1099 CA ARG A 109 -8.805 -0.512 4.549 1.00 0.00 C ATOM 1100 C ARG A 109 -8.430 -1.882 4.004 1.00 0.00 C ATOM 1101 O ARG A 109 -9.291 -2.746 3.848 1.00 0.00 O ATOM 1102 CB ARG A 109 -8.895 -0.598 6.074 1.00 0.00 C ATOM 1103 CG ARG A 109 -8.410 0.642 6.799 1.00 0.00 C ATOM 1104 CD ARG A 109 -9.497 1.242 7.679 1.00 0.00 C ATOM 1105 NE ARG A 109 -9.521 0.634 9.008 1.00 0.00 N ATOM 1106 CZ ARG A 109 -10.304 -0.389 9.351 1.00 0.00 C ATOM 1107 NH1 ARG A 109 -11.160 -0.909 8.479 1.00 0.00 N ATOM 1108 NH2 ARG A 109 -10.237 -0.888 10.577 1.00 0.00 N ATOM 0 H ARG A 109 -10.901 -0.471 4.474 1.00 0.00 H new ATOM 0 HA ARG A 109 -8.046 0.216 4.262 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -9.931 -0.787 6.355 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -8.312 -1.454 6.413 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -7.544 0.390 7.411 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -8.081 1.384 6.071 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -9.335 2.316 7.774 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -10.467 1.107 7.201 1.00 0.00 H new ATOM 0 HE ARG A 109 -8.898 1.017 9.719 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -11.223 -0.526 7.536 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -11.754 -1.692 8.752 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -9.588 -0.489 11.255 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -10.835 -1.671 10.842 1.00 0.00 H new ATOM 1122 N TYR A 110 -7.147 -2.091 3.723 1.00 0.00 N ATOM 1123 CA TYR A 110 -6.695 -3.373 3.209 1.00 0.00 C ATOM 1124 C TYR A 110 -5.815 -4.058 4.237 1.00 0.00 C ATOM 1125 O TYR A 110 -5.369 -3.426 5.191 1.00 0.00 O ATOM 1126 CB TYR A 110 -5.957 -3.189 1.888 1.00 0.00 C ATOM 1127 CG TYR A 110 -6.883 -2.876 0.736 1.00 0.00 C ATOM 1128 CD1 TYR A 110 -7.285 -3.871 -0.146 1.00 0.00 C ATOM 1129 CD2 TYR A 110 -7.354 -1.584 0.529 1.00 0.00 C ATOM 1130 CE1 TYR A 110 -8.131 -3.587 -1.202 1.00 0.00 C ATOM 1131 CE2 TYR A 110 -8.200 -1.293 -0.524 1.00 0.00 C ATOM 1132 CZ TYR A 110 -8.585 -2.298 -1.386 1.00 0.00 C ATOM 1133 OH TYR A 110 -9.427 -2.012 -2.437 1.00 0.00 O ATOM 0 H TYR A 110 -6.411 -1.395 3.842 1.00 0.00 H new ATOM 0 HA TYR A 110 -7.561 -4.007 3.019 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -5.230 -2.383 1.993 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -5.397 -4.096 1.661 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -6.931 -4.882 -0.005 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -7.054 -0.795 1.202 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -8.435 -4.371 -1.880 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -8.558 -0.285 -0.671 1.00 0.00 H new ATOM 0 HH TYR A 110 -9.655 -1.059 -2.424 1.00 0.00 H new ATOM 1143 N TYR A 111 -5.589 -5.354 4.067 1.00 0.00 N ATOM 1144 CA TYR A 111 -4.782 -6.095 5.026 1.00 0.00 C ATOM 1145 C TYR A 111 -3.872 -7.113 4.361 1.00 0.00 C ATOM 1146 O TYR A 111 -4.256 -7.790 3.409 1.00 0.00 O ATOM 1147 CB TYR A 111 -5.686 -6.805 6.032 1.00 0.00 C ATOM 1148 CG TYR A 111 -6.198 -5.898 7.127 1.00 0.00 C ATOM 1149 CD1 TYR A 111 -5.793 -6.073 8.443 1.00 0.00 C ATOM 1150 CD2 TYR A 111 -7.082 -4.862 6.842 1.00 0.00 C ATOM 1151 CE1 TYR A 111 -6.252 -5.239 9.446 1.00 0.00 C ATOM 1152 CE2 TYR A 111 -7.545 -4.023 7.838 1.00 0.00 C ATOM 1153 CZ TYR A 111 -7.126 -4.216 9.138 1.00 0.00 C ATOM 1154 OH TYR A 111 -7.585 -3.385 10.134 1.00 0.00 O ATOM 0 H TYR A 111 -5.946 -5.906 3.287 1.00 0.00 H new ATOM 0 HA TYR A 111 -4.148 -5.369 5.534 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -6.535 -7.238 5.503 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -5.136 -7.631 6.483 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -5.109 -6.872 8.687 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -7.412 -4.711 5.825 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -5.928 -5.387 10.466 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -8.230 -3.222 7.600 1.00 0.00 H new ATOM 0 HH TYR A 111 -8.191 -2.717 9.750 1.00 0.00 H new ATOM 1164 N LEU A 112 -2.670 -7.234 4.908 1.00 0.00 N ATOM 1165 CA LEU A 112 -1.693 -8.191 4.421 1.00 0.00 C ATOM 1166 C LEU A 112 -1.308 -9.113 5.566 1.00 0.00 C ATOM 1167 O LEU A 112 -0.650 -8.692 6.518 1.00 0.00 O ATOM 1168 CB LEU A 112 -0.462 -7.476 3.866 1.00 0.00 C ATOM 1169 CG LEU A 112 0.034 -8.016 2.528 1.00 0.00 C ATOM 1170 CD1 LEU A 112 -1.050 -7.881 1.474 1.00 0.00 C ATOM 1171 CD2 LEU A 112 1.291 -7.287 2.090 1.00 0.00 C ATOM 0 H LEU A 112 -2.348 -6.674 5.697 1.00 0.00 H new ATOM 0 HA LEU A 112 -2.125 -8.774 3.608 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.693 -6.417 3.753 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.345 -7.550 4.595 1.00 0.00 H new ATOM 0 HG LEU A 112 0.275 -9.072 2.649 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -0.684 -8.270 0.524 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -1.930 -8.446 1.782 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -1.316 -6.830 1.358 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.629 -7.687 1.134 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.076 -6.224 1.983 1.00 0.00 H new ATOM 0 HD23 LEU A 112 2.072 -7.426 2.838 1.00 0.00 H new ATOM 1183 N ASP A 113 -1.753 -10.359 5.496 1.00 0.00 N ATOM 1184 CA ASP A 113 -1.482 -11.311 6.560 1.00 0.00 C ATOM 1185 C ASP A 113 -2.201 -10.854 7.837 1.00 0.00 C ATOM 1186 O ASP A 113 -3.407 -10.611 7.811 1.00 0.00 O ATOM 1187 CB ASP A 113 0.031 -11.445 6.778 1.00 0.00 C ATOM 1188 CG ASP A 113 0.399 -12.716 7.519 1.00 0.00 C ATOM 1189 OD1 ASP A 113 1.323 -13.423 7.061 1.00 0.00 O ATOM 1190 OD2 ASP A 113 -0.234 -13.005 8.555 1.00 0.00 O ATOM 0 H ASP A 113 -2.299 -10.731 4.719 1.00 0.00 H new ATOM 0 HA ASP A 113 -1.859 -12.296 6.285 1.00 0.00 H new ATOM 0 HB2 ASP A 113 0.537 -11.431 5.813 1.00 0.00 H new ATOM 0 HB3 ASP A 113 0.392 -10.583 7.339 1.00 0.00 H new ATOM 1195 N SER A 114 -1.475 -10.721 8.946 1.00 0.00 N ATOM 1196 CA SER A 114 -2.073 -10.276 10.198 1.00 0.00 C ATOM 1197 C SER A 114 -1.854 -8.778 10.412 1.00 0.00 C ATOM 1198 O SER A 114 -1.957 -8.288 11.536 1.00 0.00 O ATOM 1199 CB SER A 114 -1.489 -11.062 11.372 1.00 0.00 C ATOM 1200 OG SER A 114 -0.174 -11.508 11.085 1.00 0.00 O ATOM 0 H SER A 114 -0.475 -10.915 9.000 1.00 0.00 H new ATOM 0 HA SER A 114 -3.146 -10.460 10.142 1.00 0.00 H new ATOM 0 HB2 SER A 114 -1.477 -10.435 12.263 1.00 0.00 H new ATOM 0 HB3 SER A 114 -2.126 -11.918 11.593 1.00 0.00 H new ATOM 0 HG SER A 114 0.177 -12.006 11.852 1.00 0.00 H new ATOM 1206 N VAL A 115 -1.534 -8.055 9.338 1.00 0.00 N ATOM 1207 CA VAL A 115 -1.286 -6.620 9.438 1.00 0.00 C ATOM 1208 C VAL A 115 -2.202 -5.816 8.520 1.00 0.00 C ATOM 1209 O VAL A 115 -2.685 -6.321 7.506 1.00 0.00 O ATOM 1210 CB VAL A 115 0.177 -6.279 9.098 1.00 0.00 C ATOM 1211 CG1 VAL A 115 0.480 -4.825 9.426 1.00 0.00 C ATOM 1212 CG2 VAL A 115 1.129 -7.208 9.836 1.00 0.00 C ATOM 0 H VAL A 115 -1.441 -8.437 8.397 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.495 -6.347 10.473 1.00 0.00 H new ATOM 0 HB VAL A 115 0.322 -6.423 8.027 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.518 -4.605 9.178 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.177 -4.177 8.846 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.316 -4.650 10.489 1.00 0.00 H new ATOM 0 HG21 VAL A 115 2.158 -6.951 9.583 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.982 -7.100 10.911 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.930 -8.239 9.544 1.00 0.00 H new ATOM 1222 N GLU A 116 -2.431 -4.557 8.886 1.00 0.00 N ATOM 1223 CA GLU A 116 -3.280 -3.666 8.101 1.00 0.00 C ATOM 1224 C GLU A 116 -2.441 -2.847 7.125 1.00 0.00 C ATOM 1225 O GLU A 116 -1.440 -2.244 7.511 1.00 0.00 O ATOM 1226 CB GLU A 116 -4.061 -2.728 9.025 1.00 0.00 C ATOM 1227 CG GLU A 116 -3.182 -1.978 10.012 1.00 0.00 C ATOM 1228 CD GLU A 116 -3.876 -0.769 10.609 1.00 0.00 C ATOM 1229 OE1 GLU A 116 -5.078 -0.875 10.933 1.00 0.00 O ATOM 1230 OE2 GLU A 116 -3.218 0.282 10.753 1.00 0.00 O ATOM 0 H GLU A 116 -2.038 -4.130 9.725 1.00 0.00 H new ATOM 0 HA GLU A 116 -3.983 -4.276 7.534 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.609 -2.007 8.418 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.801 -3.308 9.577 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.884 -2.654 10.814 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -2.270 -1.657 9.509 1.00 0.00 H new ATOM 1237 N VAL A 117 -2.846 -2.837 5.859 1.00 0.00 N ATOM 1238 CA VAL A 117 -2.117 -2.097 4.838 1.00 0.00 C ATOM 1239 C VAL A 117 -3.035 -1.209 3.999 1.00 0.00 C ATOM 1240 O VAL A 117 -4.264 -1.379 3.978 1.00 0.00 O ATOM 1241 CB VAL A 117 -1.352 -3.051 3.900 1.00 0.00 C ATOM 1242 CG1 VAL A 117 -0.329 -3.861 4.680 1.00 0.00 C ATOM 1243 CG2 VAL A 117 -2.317 -3.969 3.163 1.00 0.00 C ATOM 0 H VAL A 117 -3.671 -3.331 5.518 1.00 0.00 H new ATOM 0 HA VAL A 117 -1.411 -1.460 5.371 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.821 -2.451 3.160 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.201 -4.529 4.001 1.00 0.00 H new ATOM 0 HG12 VAL A 117 0.383 -3.187 5.155 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -0.837 -4.449 5.444 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -1.756 -4.634 2.506 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -2.879 -4.561 3.885 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -3.007 -3.370 2.569 1.00 0.00 H new ATOM 1253 N HIS A 118 -2.412 -0.257 3.308 1.00 0.00 N ATOM 1254 CA HIS A 118 -3.126 0.682 2.452 1.00 0.00 C ATOM 1255 C HIS A 118 -2.951 0.319 0.980 1.00 0.00 C ATOM 1256 O HIS A 118 -1.903 0.579 0.388 1.00 0.00 O ATOM 1257 CB HIS A 118 -2.612 2.101 2.690 1.00 0.00 C ATOM 1258 CG HIS A 118 -3.350 3.153 1.915 1.00 0.00 C ATOM 1259 ND1 HIS A 118 -4.206 4.056 2.503 1.00 0.00 N ATOM 1260 CD2 HIS A 118 -3.352 3.447 0.591 1.00 0.00 C ATOM 1261 CE1 HIS A 118 -4.702 4.856 1.577 1.00 0.00 C ATOM 1262 NE2 HIS A 118 -4.203 4.506 0.407 1.00 0.00 N ATOM 0 H HIS A 118 -1.402 -0.117 3.327 1.00 0.00 H new ATOM 0 HA HIS A 118 -4.186 0.629 2.701 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -2.684 2.329 3.753 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -1.555 2.143 2.426 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -2.787 2.940 -0.177 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -5.400 5.662 1.749 1.00 0.00 H new ATOM 0 HE2 HIS A 118 -4.415 4.950 -0.487 1.00 0.00 H new ATOM 1271 N LEU A 119 -3.983 -0.275 0.396 1.00 0.00 N ATOM 1272 CA LEU A 119 -3.951 -0.666 -1.008 1.00 0.00 C ATOM 1273 C LEU A 119 -4.857 0.251 -1.831 1.00 0.00 C ATOM 1274 O LEU A 119 -6.068 0.286 -1.616 1.00 0.00 O ATOM 1275 CB LEU A 119 -4.399 -2.116 -1.157 1.00 0.00 C ATOM 1276 CG LEU A 119 -4.277 -2.683 -2.564 1.00 0.00 C ATOM 1277 CD1 LEU A 119 -4.178 -4.198 -2.525 1.00 0.00 C ATOM 1278 CD2 LEU A 119 -5.456 -2.240 -3.408 1.00 0.00 C ATOM 0 H LEU A 119 -4.856 -0.498 0.874 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.929 -0.573 -1.376 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.810 -2.734 -0.479 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.438 -2.194 -0.838 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.363 -2.299 -3.018 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -4.092 -4.583 -3.541 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -3.299 -4.491 -1.950 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -5.072 -4.609 -2.056 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -5.359 -2.651 -4.413 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.381 -2.598 -2.957 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.476 -1.152 -3.462 1.00 0.00 H new ATOM 1290 N PRO A 120 -4.286 1.019 -2.778 1.00 0.00 N ATOM 1291 CA PRO A 120 -5.061 1.942 -3.609 1.00 0.00 C ATOM 1292 C PRO A 120 -6.252 1.262 -4.288 1.00 0.00 C ATOM 1293 O PRO A 120 -6.150 0.137 -4.771 1.00 0.00 O ATOM 1294 CB PRO A 120 -4.057 2.448 -4.654 1.00 0.00 C ATOM 1295 CG PRO A 120 -2.853 1.580 -4.517 1.00 0.00 C ATOM 1296 CD PRO A 120 -2.855 1.065 -3.107 1.00 0.00 C ATOM 0 HA PRO A 120 -5.496 2.742 -3.011 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.473 2.383 -5.659 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -3.806 3.494 -4.480 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -2.886 0.757 -5.230 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -1.943 2.144 -4.722 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -2.392 0.081 -3.035 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.307 1.725 -2.435 1.00 0.00 H new ATOM 1304 N PRO A 121 -7.408 1.944 -4.321 1.00 0.00 N ATOM 1305 CA PRO A 121 -8.644 1.419 -4.924 1.00 0.00 C ATOM 1306 C PRO A 121 -8.493 0.913 -6.363 1.00 0.00 C ATOM 1307 O PRO A 121 -9.406 0.279 -6.890 1.00 0.00 O ATOM 1308 CB PRO A 121 -9.601 2.623 -4.890 1.00 0.00 C ATOM 1309 CG PRO A 121 -8.741 3.807 -4.603 1.00 0.00 C ATOM 1310 CD PRO A 121 -7.620 3.286 -3.759 1.00 0.00 C ATOM 0 HA PRO A 121 -8.987 0.542 -4.375 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -10.122 2.737 -5.841 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.364 2.496 -4.122 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.365 4.253 -5.524 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.301 4.582 -4.079 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -6.728 3.907 -3.839 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.889 3.248 -2.703 1.00 0.00 H new ATOM 1318 N PHE A 122 -7.365 1.199 -7.009 1.00 0.00 N ATOM 1319 CA PHE A 122 -7.169 0.762 -8.395 1.00 0.00 C ATOM 1320 C PHE A 122 -6.548 -0.632 -8.492 1.00 0.00 C ATOM 1321 O PHE A 122 -6.444 -1.186 -9.586 1.00 0.00 O ATOM 1322 CB PHE A 122 -6.327 1.765 -9.203 1.00 0.00 C ATOM 1323 CG PHE A 122 -5.586 2.787 -8.385 1.00 0.00 C ATOM 1324 CD1 PHE A 122 -6.272 3.743 -7.650 1.00 0.00 C ATOM 1325 CD2 PHE A 122 -4.202 2.797 -8.364 1.00 0.00 C ATOM 1326 CE1 PHE A 122 -5.588 4.687 -6.908 1.00 0.00 C ATOM 1327 CE2 PHE A 122 -3.513 3.737 -7.625 1.00 0.00 C ATOM 1328 CZ PHE A 122 -4.206 4.685 -6.895 1.00 0.00 C ATOM 0 H PHE A 122 -6.585 1.720 -6.608 1.00 0.00 H new ATOM 0 HA PHE A 122 -8.168 0.715 -8.829 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -5.605 1.209 -9.801 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -6.983 2.287 -9.899 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -7.352 3.749 -7.658 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -3.655 2.060 -8.933 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -6.133 5.426 -6.339 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -2.433 3.732 -7.617 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.669 5.422 -6.316 1.00 0.00 H new ATOM 1338 N TRP A 123 -6.144 -1.208 -7.364 1.00 0.00 N ATOM 1339 CA TRP A 123 -5.549 -2.542 -7.378 1.00 0.00 C ATOM 1340 C TRP A 123 -6.523 -3.591 -6.844 1.00 0.00 C ATOM 1341 O TRP A 123 -6.258 -4.791 -6.930 1.00 0.00 O ATOM 1342 CB TRP A 123 -4.263 -2.562 -6.558 1.00 0.00 C ATOM 1343 CG TRP A 123 -3.224 -1.615 -7.056 1.00 0.00 C ATOM 1344 CD1 TRP A 123 -3.134 -1.060 -8.299 1.00 0.00 C ATOM 1345 CD2 TRP A 123 -2.125 -1.110 -6.308 1.00 0.00 C ATOM 1346 NE1 TRP A 123 -2.040 -0.224 -8.360 1.00 0.00 N ATOM 1347 CE2 TRP A 123 -1.406 -0.240 -7.146 1.00 0.00 C ATOM 1348 CE3 TRP A 123 -1.685 -1.307 -5.002 1.00 0.00 C ATOM 1349 CZ2 TRP A 123 -0.268 0.432 -6.710 1.00 0.00 C ATOM 1350 CZ3 TRP A 123 -0.560 -0.642 -4.576 1.00 0.00 C ATOM 1351 CH2 TRP A 123 0.134 0.217 -5.424 1.00 0.00 C ATOM 0 H TRP A 123 -6.216 -0.780 -6.441 1.00 0.00 H new ATOM 0 HA TRP A 123 -5.316 -2.789 -8.414 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -4.498 -2.318 -5.522 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -3.854 -3.572 -6.563 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -3.818 -1.248 -9.114 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -1.750 0.317 -9.175 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -2.218 -1.970 -4.336 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 0.276 1.098 -7.364 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -0.208 -0.788 -3.565 1.00 0.00 H new ATOM 0 HH2 TRP A 123 1.012 0.726 -5.055 1.00 0.00 H new ATOM 1362 N GLU A 124 -7.653 -3.141 -6.298 1.00 0.00 N ATOM 1363 CA GLU A 124 -8.656 -4.058 -5.765 1.00 0.00 C ATOM 1364 C GLU A 124 -8.995 -5.135 -6.791 1.00 0.00 C ATOM 1365 O GLU A 124 -9.371 -6.253 -6.438 1.00 0.00 O ATOM 1366 CB GLU A 124 -9.921 -3.295 -5.367 1.00 0.00 C ATOM 1367 CG GLU A 124 -10.504 -2.453 -6.488 1.00 0.00 C ATOM 1368 CD GLU A 124 -11.267 -3.281 -7.504 1.00 0.00 C ATOM 1369 OE1 GLU A 124 -11.418 -2.818 -8.654 1.00 0.00 O ATOM 1370 OE2 GLU A 124 -11.714 -4.391 -7.149 1.00 0.00 O ATOM 0 H GLU A 124 -7.894 -2.153 -6.214 1.00 0.00 H new ATOM 0 HA GLU A 124 -8.243 -4.538 -4.878 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -10.674 -4.008 -5.031 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -9.693 -2.648 -4.520 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -11.170 -1.701 -6.064 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -9.699 -1.918 -6.992 1.00 0.00 H new ATOM 1377 N GLN A 125 -8.848 -4.788 -8.067 1.00 0.00 N ATOM 1378 CA GLN A 125 -9.122 -5.719 -9.152 1.00 0.00 C ATOM 1379 C GLN A 125 -7.845 -6.441 -9.572 1.00 0.00 C ATOM 1380 O GLN A 125 -7.890 -7.572 -10.056 1.00 0.00 O ATOM 1381 CB GLN A 125 -9.718 -4.975 -10.349 1.00 0.00 C ATOM 1382 CG GLN A 125 -8.874 -3.799 -10.814 1.00 0.00 C ATOM 1383 CD GLN A 125 -9.595 -2.472 -10.678 1.00 0.00 C ATOM 1384 OE1 GLN A 125 -10.463 -2.138 -11.486 1.00 0.00 O ATOM 1385 NE2 GLN A 125 -9.238 -1.707 -9.653 1.00 0.00 N ATOM 0 H GLN A 125 -8.540 -3.865 -8.373 1.00 0.00 H new ATOM 0 HA GLN A 125 -9.841 -6.458 -8.799 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -9.841 -5.674 -11.177 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -10.713 -4.616 -10.085 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -7.951 -3.768 -10.235 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.591 -3.949 -11.856 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -8.514 -2.024 -9.008 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -9.688 -0.803 -9.511 1.00 0.00 H new ATOM 1394 N TYR A 126 -6.708 -5.780 -9.376 1.00 0.00 N ATOM 1395 CA TYR A 126 -5.415 -6.358 -9.728 1.00 0.00 C ATOM 1396 C TYR A 126 -4.938 -7.341 -8.660 1.00 0.00 C ATOM 1397 O TYR A 126 -3.924 -8.017 -8.839 1.00 0.00 O ATOM 1398 CB TYR A 126 -4.367 -5.259 -9.913 1.00 0.00 C ATOM 1399 CG TYR A 126 -4.815 -4.110 -10.794 1.00 0.00 C ATOM 1400 CD1 TYR A 126 -4.121 -2.908 -10.795 1.00 0.00 C ATOM 1401 CD2 TYR A 126 -5.925 -4.225 -11.626 1.00 0.00 C ATOM 1402 CE1 TYR A 126 -4.517 -1.853 -11.595 1.00 0.00 C ATOM 1403 CE2 TYR A 126 -6.328 -3.174 -12.428 1.00 0.00 C ATOM 1404 CZ TYR A 126 -5.621 -1.991 -12.409 1.00 0.00 C ATOM 1405 OH TYR A 126 -6.018 -0.943 -13.207 1.00 0.00 O ATOM 0 H TYR A 126 -6.656 -4.843 -8.975 1.00 0.00 H new ATOM 0 HA TYR A 126 -5.542 -6.898 -10.666 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -4.094 -4.865 -8.934 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.467 -5.700 -10.341 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -3.256 -2.795 -10.159 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -6.481 -5.151 -11.645 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -3.964 -0.925 -11.583 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -7.193 -3.279 -13.066 1.00 0.00 H new ATOM 0 HH TYR A 126 -6.812 -1.204 -13.719 1.00 0.00 H new ATOM 1415 N ILE A 127 -5.657 -7.404 -7.541 1.00 0.00 N ATOM 1416 CA ILE A 127 -5.283 -8.290 -6.444 1.00 0.00 C ATOM 1417 C ILE A 127 -5.940 -9.664 -6.554 1.00 0.00 C ATOM 1418 O ILE A 127 -7.162 -9.793 -6.467 1.00 0.00 O ATOM 1419 CB ILE A 127 -5.648 -7.679 -5.079 1.00 0.00 C ATOM 1420 CG1 ILE A 127 -7.102 -7.201 -5.078 1.00 0.00 C ATOM 1421 CG2 ILE A 127 -4.707 -6.532 -4.742 1.00 0.00 C ATOM 1422 CD1 ILE A 127 -7.842 -7.528 -3.800 1.00 0.00 C ATOM 0 H ILE A 127 -6.499 -6.854 -7.372 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.202 -8.412 -6.517 1.00 0.00 H new ATOM 0 HB ILE A 127 -5.539 -8.449 -4.315 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -7.122 -6.123 -5.235 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -7.626 -7.655 -5.919 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -4.979 -6.111 -3.774 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -3.682 -6.902 -4.702 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -4.785 -5.760 -5.508 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -8.866 -7.161 -3.868 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -7.853 -8.608 -3.652 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -7.341 -7.052 -2.957 1.00 0.00 H new ATOM 1434 N ASN A 128 -5.109 -10.689 -6.719 1.00 0.00 N ATOM 1435 CA ASN A 128 -5.581 -12.068 -6.812 1.00 0.00 C ATOM 1436 C ASN A 128 -5.335 -12.796 -5.491 1.00 0.00 C ATOM 1437 O ASN A 128 -5.002 -12.168 -4.486 1.00 0.00 O ATOM 1438 CB ASN A 128 -4.875 -12.808 -7.954 1.00 0.00 C ATOM 1439 CG ASN A 128 -3.414 -12.430 -8.095 1.00 0.00 C ATOM 1440 OD1 ASN A 128 -2.529 -13.151 -7.639 1.00 0.00 O ATOM 1441 ND2 ASN A 128 -3.153 -11.296 -8.733 1.00 0.00 N ATOM 0 H ASN A 128 -4.096 -10.589 -6.792 1.00 0.00 H new ATOM 0 HA ASN A 128 -6.651 -12.051 -7.019 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -4.951 -13.882 -7.785 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.391 -12.595 -8.890 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -2.187 -10.993 -8.860 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -3.918 -10.727 -9.096 1.00 0.00 H new ATOM 1448 N ASP A 129 -5.492 -14.122 -5.493 1.00 0.00 N ATOM 1449 CA ASP A 129 -5.275 -14.921 -4.286 1.00 0.00 C ATOM 1450 C ASP A 129 -3.978 -14.510 -3.594 1.00 0.00 C ATOM 1451 O ASP A 129 -3.978 -14.128 -2.426 1.00 0.00 O ATOM 1452 CB ASP A 129 -5.233 -16.409 -4.633 1.00 0.00 C ATOM 1453 CG ASP A 129 -6.606 -16.970 -4.945 1.00 0.00 C ATOM 1454 OD1 ASP A 129 -6.720 -17.766 -5.902 1.00 0.00 O ATOM 1455 OD2 ASP A 129 -7.569 -16.613 -4.234 1.00 0.00 O ATOM 0 H ASP A 129 -5.767 -14.662 -6.313 1.00 0.00 H new ATOM 0 HA ASP A 129 -6.106 -14.740 -3.604 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -4.578 -16.561 -5.491 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -4.799 -16.961 -3.800 1.00 0.00 H new ATOM 1460 N GLU A 130 -2.877 -14.569 -4.336 1.00 0.00 N ATOM 1461 CA GLU A 130 -1.572 -14.180 -3.814 1.00 0.00 C ATOM 1462 C GLU A 130 -0.907 -13.212 -4.782 1.00 0.00 C ATOM 1463 O GLU A 130 -0.791 -13.500 -5.972 1.00 0.00 O ATOM 1464 CB GLU A 130 -0.688 -15.411 -3.604 1.00 0.00 C ATOM 1465 CG GLU A 130 0.200 -15.321 -2.375 1.00 0.00 C ATOM 1466 CD GLU A 130 -0.295 -16.186 -1.232 1.00 0.00 C ATOM 1467 OE1 GLU A 130 -1.419 -15.942 -0.746 1.00 0.00 O ATOM 1468 OE2 GLU A 130 0.443 -17.108 -0.824 1.00 0.00 O ATOM 0 H GLU A 130 -2.863 -14.884 -5.306 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.707 -13.690 -2.850 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -1.323 -16.293 -3.519 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -0.062 -15.552 -4.485 1.00 0.00 H new ATOM 0 HG2 GLU A 130 1.213 -15.622 -2.641 1.00 0.00 H new ATOM 0 HG3 GLU A 130 0.252 -14.284 -2.044 1.00 0.00 H new ATOM 1475 N ASN A 131 -0.495 -12.051 -4.282 1.00 0.00 N ATOM 1476 CA ASN A 131 0.121 -11.045 -5.135 1.00 0.00 C ATOM 1477 C ASN A 131 1.511 -10.646 -4.685 1.00 0.00 C ATOM 1478 O ASN A 131 1.884 -10.804 -3.524 1.00 0.00 O ATOM 1479 CB ASN A 131 -0.737 -9.786 -5.157 1.00 0.00 C ATOM 1480 CG ASN A 131 -2.166 -10.058 -5.541 1.00 0.00 C ATOM 1481 OD1 ASN A 131 -2.551 -9.862 -6.691 1.00 0.00 O ATOM 1482 ND2 ASN A 131 -2.961 -10.508 -4.575 1.00 0.00 N ATOM 0 H ASN A 131 -0.576 -11.787 -3.300 1.00 0.00 H new ATOM 0 HA ASN A 131 0.199 -11.498 -6.123 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -0.713 -9.319 -4.172 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -0.307 -9.072 -5.859 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -3.942 -10.708 -4.773 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -2.590 -10.654 -3.636 1.00 0.00 H new ATOM 1489 N THR A 132 2.237 -10.052 -5.622 1.00 0.00 N ATOM 1490 CA THR A 132 3.562 -9.528 -5.359 1.00 0.00 C ATOM 1491 C THR A 132 3.389 -8.070 -4.973 1.00 0.00 C ATOM 1492 O THR A 132 3.024 -7.237 -5.811 1.00 0.00 O ATOM 1493 CB THR A 132 4.458 -9.656 -6.593 1.00 0.00 C ATOM 1494 OG1 THR A 132 4.036 -10.735 -7.408 1.00 0.00 O ATOM 1495 CG2 THR A 132 5.916 -9.880 -6.253 1.00 0.00 C ATOM 0 H THR A 132 1.921 -9.922 -6.583 1.00 0.00 H new ATOM 0 HA THR A 132 4.045 -10.090 -4.559 1.00 0.00 H new ATOM 0 HB THR A 132 4.366 -8.705 -7.118 1.00 0.00 H new ATOM 0 HG1 THR A 132 4.620 -10.800 -8.193 1.00 0.00 H new ATOM 0 HG21 THR A 132 6.496 -9.962 -7.172 1.00 0.00 H new ATOM 0 HG22 THR A 132 6.286 -9.040 -5.665 1.00 0.00 H new ATOM 0 HG23 THR A 132 6.018 -10.799 -5.677 1.00 0.00 H new ATOM 1503 N VAL A 133 3.575 -7.774 -3.695 1.00 0.00 N ATOM 1504 CA VAL A 133 3.362 -6.421 -3.202 1.00 0.00 C ATOM 1505 C VAL A 133 4.623 -5.769 -2.658 1.00 0.00 C ATOM 1506 O VAL A 133 5.397 -6.379 -1.921 1.00 0.00 O ATOM 1507 CB VAL A 133 2.276 -6.389 -2.098 1.00 0.00 C ATOM 1508 CG1 VAL A 133 0.997 -5.763 -2.627 1.00 0.00 C ATOM 1509 CG2 VAL A 133 1.998 -7.784 -1.549 1.00 0.00 C ATOM 0 H VAL A 133 3.870 -8.445 -2.986 1.00 0.00 H new ATOM 0 HA VAL A 133 3.036 -5.851 -4.072 1.00 0.00 H new ATOM 0 HB VAL A 133 2.654 -5.777 -1.279 1.00 0.00 H new ATOM 0 HG11 VAL A 133 0.245 -5.749 -1.838 1.00 0.00 H new ATOM 0 HG12 VAL A 133 1.199 -4.743 -2.954 1.00 0.00 H new ATOM 0 HG13 VAL A 133 0.627 -6.347 -3.470 1.00 0.00 H new ATOM 0 HG21 VAL A 133 1.231 -7.725 -0.776 1.00 0.00 H new ATOM 0 HG22 VAL A 133 1.651 -8.430 -2.356 1.00 0.00 H new ATOM 0 HG23 VAL A 133 2.912 -8.196 -1.122 1.00 0.00 H new ATOM 1519 N GLU A 134 4.775 -4.495 -2.994 1.00 0.00 N ATOM 1520 CA GLU A 134 5.885 -3.691 -2.517 1.00 0.00 C ATOM 1521 C GLU A 134 5.304 -2.525 -1.743 1.00 0.00 C ATOM 1522 O GLU A 134 4.559 -1.712 -2.298 1.00 0.00 O ATOM 1523 CB GLU A 134 6.751 -3.187 -3.668 1.00 0.00 C ATOM 1524 CG GLU A 134 7.091 -4.257 -4.692 1.00 0.00 C ATOM 1525 CD GLU A 134 7.990 -3.742 -5.798 1.00 0.00 C ATOM 1526 OE1 GLU A 134 9.017 -3.105 -5.481 1.00 0.00 O ATOM 1527 OE2 GLU A 134 7.668 -3.974 -6.983 1.00 0.00 O ATOM 0 H GLU A 134 4.131 -3.993 -3.605 1.00 0.00 H new ATOM 0 HA GLU A 134 6.530 -4.297 -1.881 1.00 0.00 H new ATOM 0 HB2 GLU A 134 6.233 -2.369 -4.169 1.00 0.00 H new ATOM 0 HB3 GLU A 134 7.676 -2.778 -3.262 1.00 0.00 H new ATOM 0 HG2 GLU A 134 7.580 -5.092 -4.190 1.00 0.00 H new ATOM 0 HG3 GLU A 134 6.170 -4.643 -5.128 1.00 0.00 H new ATOM 1534 N LEU A 135 5.592 -2.471 -0.454 1.00 0.00 N ATOM 1535 CA LEU A 135 5.032 -1.426 0.387 1.00 0.00 C ATOM 1536 C LEU A 135 6.038 -0.864 1.378 1.00 0.00 C ATOM 1537 O LEU A 135 6.999 -1.529 1.764 1.00 0.00 O ATOM 1538 CB LEU A 135 3.833 -1.983 1.156 1.00 0.00 C ATOM 1539 CG LEU A 135 4.054 -3.363 1.786 1.00 0.00 C ATOM 1540 CD1 LEU A 135 4.509 -3.226 3.229 1.00 0.00 C ATOM 1541 CD2 LEU A 135 2.785 -4.202 1.701 1.00 0.00 C ATOM 0 H LEU A 135 6.203 -3.130 0.029 1.00 0.00 H new ATOM 0 HA LEU A 135 4.731 -0.611 -0.271 1.00 0.00 H new ATOM 0 HB2 LEU A 135 3.566 -1.279 1.944 1.00 0.00 H new ATOM 0 HB3 LEU A 135 2.981 -2.041 0.479 1.00 0.00 H new ATOM 0 HG LEU A 135 4.839 -3.872 1.227 1.00 0.00 H new ATOM 0 HD11 LEU A 135 4.660 -4.216 3.658 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.445 -2.668 3.264 1.00 0.00 H new ATOM 0 HD13 LEU A 135 3.749 -2.695 3.801 1.00 0.00 H new ATOM 0 HD21 LEU A 135 2.963 -5.178 2.154 1.00 0.00 H new ATOM 0 HD22 LEU A 135 1.979 -3.697 2.233 1.00 0.00 H new ATOM 0 HD23 LEU A 135 2.504 -4.333 0.656 1.00 0.00 H new ATOM 1553 N ILE A 136 5.768 0.357 1.814 1.00 0.00 N ATOM 1554 CA ILE A 136 6.598 1.032 2.797 1.00 0.00 C ATOM 1555 C ILE A 136 5.825 1.097 4.102 1.00 0.00 C ATOM 1556 O ILE A 136 4.608 0.989 4.088 1.00 0.00 O ATOM 1557 CB ILE A 136 6.988 2.461 2.362 1.00 0.00 C ATOM 1558 CG1 ILE A 136 6.882 2.630 0.842 1.00 0.00 C ATOM 1559 CG2 ILE A 136 8.396 2.771 2.826 1.00 0.00 C ATOM 1560 CD1 ILE A 136 6.816 4.077 0.401 1.00 0.00 C ATOM 0 H ILE A 136 4.969 0.906 1.497 1.00 0.00 H new ATOM 0 HA ILE A 136 7.524 0.468 2.908 1.00 0.00 H new ATOM 0 HB ILE A 136 6.292 3.161 2.824 1.00 0.00 H new ATOM 0 HG12 ILE A 136 7.741 2.153 0.370 1.00 0.00 H new ATOM 0 HG13 ILE A 136 5.993 2.109 0.487 1.00 0.00 H new ATOM 0 HG21 ILE A 136 8.667 3.780 2.517 1.00 0.00 H new ATOM 0 HG22 ILE A 136 8.445 2.699 3.912 1.00 0.00 H new ATOM 0 HG23 ILE A 136 9.091 2.057 2.383 1.00 0.00 H new ATOM 0 HD11 ILE A 136 6.742 4.123 -0.686 1.00 0.00 H new ATOM 0 HD12 ILE A 136 5.942 4.553 0.845 1.00 0.00 H new ATOM 0 HD13 ILE A 136 7.717 4.598 0.726 1.00 0.00 H new ATOM 1572 N HIS A 137 6.511 1.246 5.226 1.00 0.00 N ATOM 1573 CA HIS A 137 5.823 1.290 6.512 1.00 0.00 C ATOM 1574 C HIS A 137 5.730 2.707 7.058 1.00 0.00 C ATOM 1575 O HIS A 137 6.742 3.349 7.339 1.00 0.00 O ATOM 1576 CB HIS A 137 6.516 0.358 7.500 1.00 0.00 C ATOM 1577 CG HIS A 137 6.658 -1.029 6.959 1.00 0.00 C ATOM 1578 ND1 HIS A 137 6.199 -2.152 7.611 1.00 0.00 N ATOM 1579 CD2 HIS A 137 7.185 -1.466 5.790 1.00 0.00 C ATOM 1580 CE1 HIS A 137 6.436 -3.219 6.865 1.00 0.00 C ATOM 1581 NE2 HIS A 137 7.035 -2.828 5.758 1.00 0.00 N ATOM 0 H HIS A 137 7.526 1.337 5.277 1.00 0.00 H new ATOM 0 HA HIS A 137 4.799 0.947 6.363 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.502 0.755 7.742 1.00 0.00 H new ATOM 0 HB3 HIS A 137 5.947 0.328 8.429 1.00 0.00 H new ATOM 0 HD1 HIS A 137 5.747 -2.160 8.525 1.00 0.00 H new ATOM 0 HD2 HIS A 137 7.639 -0.854 5.025 1.00 0.00 H new ATOM 0 HE1 HIS A 137 6.182 -4.237 7.120 1.00 0.00 H new ATOM 1590 N THR A 138 4.498 3.189 7.196 1.00 0.00 N ATOM 1591 CA THR A 138 4.248 4.534 7.700 1.00 0.00 C ATOM 1592 C THR A 138 4.223 4.551 9.226 1.00 0.00 C ATOM 1593 O THR A 138 4.703 3.622 9.875 1.00 0.00 O ATOM 1594 CB THR A 138 2.913 5.044 7.161 1.00 0.00 C ATOM 1595 OG1 THR A 138 1.840 4.521 7.922 1.00 0.00 O ATOM 1596 CG2 THR A 138 2.670 4.681 5.714 1.00 0.00 C ATOM 0 H THR A 138 3.654 2.665 6.964 1.00 0.00 H new ATOM 0 HA THR A 138 5.056 5.183 7.362 1.00 0.00 H new ATOM 0 HB THR A 138 2.964 6.130 7.238 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.385 3.821 7.408 1.00 0.00 H new ATOM 0 HG21 THR A 138 1.704 5.075 5.397 1.00 0.00 H new ATOM 0 HG22 THR A 138 3.457 5.110 5.094 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.673 3.596 5.606 1.00 0.00 H new ATOM 1604 N ASP A 139 3.637 5.604 9.791 1.00 0.00 N ATOM 1605 CA ASP A 139 3.525 5.725 11.239 1.00 0.00 C ATOM 1606 C ASP A 139 2.301 4.958 11.733 1.00 0.00 C ATOM 1607 O ASP A 139 2.057 4.858 12.934 1.00 0.00 O ATOM 1608 CB ASP A 139 3.421 7.197 11.644 1.00 0.00 C ATOM 1609 CG ASP A 139 3.627 7.402 13.132 1.00 0.00 C ATOM 1610 OD1 ASP A 139 3.165 8.436 13.658 1.00 0.00 O ATOM 1611 OD2 ASP A 139 4.250 6.528 13.771 1.00 0.00 O ATOM 0 H ASP A 139 3.234 6.382 9.269 1.00 0.00 H new ATOM 0 HA ASP A 139 4.419 5.301 11.696 1.00 0.00 H new ATOM 0 HB2 ASP A 139 4.163 7.776 11.094 1.00 0.00 H new ATOM 0 HB3 ASP A 139 2.442 7.581 11.359 1.00 0.00 H new ATOM 1616 N SER A 140 1.537 4.420 10.785 1.00 0.00 N ATOM 1617 CA SER A 140 0.337 3.659 11.096 1.00 0.00 C ATOM 1618 C SER A 140 0.401 2.281 10.450 1.00 0.00 C ATOM 1619 O SER A 140 0.571 1.267 11.127 1.00 0.00 O ATOM 1620 CB SER A 140 -0.898 4.411 10.599 1.00 0.00 C ATOM 1621 OG SER A 140 -0.816 4.667 9.204 1.00 0.00 O ATOM 0 H SER A 140 1.733 4.500 9.787 1.00 0.00 H new ATOM 0 HA SER A 140 0.270 3.535 12.177 1.00 0.00 H new ATOM 0 HB2 SER A 140 -1.793 3.827 10.812 1.00 0.00 H new ATOM 0 HB3 SER A 140 -0.996 5.353 11.139 1.00 0.00 H new ATOM 0 HG SER A 140 -1.708 4.878 8.857 1.00 0.00 H new ATOM 1627 N LEU A 141 0.272 2.263 9.132 1.00 0.00 N ATOM 1628 CA LEU A 141 0.322 1.027 8.364 1.00 0.00 C ATOM 1629 C LEU A 141 1.186 1.215 7.124 1.00 0.00 C ATOM 1630 O LEU A 141 1.559 2.338 6.781 1.00 0.00 O ATOM 1631 CB LEU A 141 -1.089 0.591 7.959 1.00 0.00 C ATOM 1632 CG LEU A 141 -2.037 1.730 7.580 1.00 0.00 C ATOM 1633 CD1 LEU A 141 -2.945 1.311 6.434 1.00 0.00 C ATOM 1634 CD2 LEU A 141 -2.859 2.162 8.785 1.00 0.00 C ATOM 0 H LEU A 141 0.130 3.100 8.566 1.00 0.00 H new ATOM 0 HA LEU A 141 0.762 0.249 8.988 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -1.012 -0.093 7.114 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -1.530 0.031 8.784 1.00 0.00 H new ATOM 0 HG LEU A 141 -1.440 2.580 7.249 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -3.612 2.134 6.179 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -2.339 1.052 5.566 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -3.535 0.446 6.735 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.528 2.973 8.497 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -3.447 1.318 9.146 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -2.192 2.505 9.576 1.00 0.00 H new ATOM 1646 N PRO A 142 1.545 0.118 6.443 1.00 0.00 N ATOM 1647 CA PRO A 142 2.380 0.179 5.255 1.00 0.00 C ATOM 1648 C PRO A 142 1.599 0.558 4.004 1.00 0.00 C ATOM 1649 O PRO A 142 0.560 -0.030 3.699 1.00 0.00 O ATOM 1650 CB PRO A 142 2.939 -1.245 5.116 1.00 0.00 C ATOM 1651 CG PRO A 142 2.415 -2.009 6.288 1.00 0.00 C ATOM 1652 CD PRO A 142 1.205 -1.263 6.781 1.00 0.00 C ATOM 0 HA PRO A 142 3.149 0.945 5.356 1.00 0.00 H new ATOM 0 HB2 PRO A 142 2.619 -1.700 4.179 1.00 0.00 H new ATOM 0 HB3 PRO A 142 4.029 -1.238 5.111 1.00 0.00 H new ATOM 0 HG2 PRO A 142 2.152 -3.027 6.001 1.00 0.00 H new ATOM 0 HG3 PRO A 142 3.170 -2.084 7.071 1.00 0.00 H new ATOM 0 HD2 PRO A 142 0.292 -1.592 6.285 1.00 0.00 H new ATOM 0 HD3 PRO A 142 1.051 -1.396 7.852 1.00 0.00 H new ATOM 1660 N LEU A 143 2.124 1.530 3.273 1.00 0.00 N ATOM 1661 CA LEU A 143 1.500 1.984 2.035 1.00 0.00 C ATOM 1662 C LEU A 143 2.036 1.186 0.856 1.00 0.00 C ATOM 1663 O LEU A 143 3.235 1.201 0.575 1.00 0.00 O ATOM 1664 CB LEU A 143 1.764 3.475 1.807 1.00 0.00 C ATOM 1665 CG LEU A 143 0.860 4.157 0.771 1.00 0.00 C ATOM 1666 CD1 LEU A 143 1.058 3.568 -0.616 1.00 0.00 C ATOM 1667 CD2 LEU A 143 -0.594 4.038 1.172 1.00 0.00 C ATOM 0 H LEU A 143 2.984 2.022 3.515 1.00 0.00 H new ATOM 0 HA LEU A 143 0.425 1.828 2.120 1.00 0.00 H new ATOM 0 HB2 LEU A 143 1.653 3.995 2.758 1.00 0.00 H new ATOM 0 HB3 LEU A 143 2.801 3.599 1.495 1.00 0.00 H new ATOM 0 HG LEU A 143 1.140 5.210 0.739 1.00 0.00 H new ATOM 0 HD11 LEU A 143 0.402 4.075 -1.324 1.00 0.00 H new ATOM 0 HD12 LEU A 143 2.095 3.701 -0.923 1.00 0.00 H new ATOM 0 HD13 LEU A 143 0.819 2.505 -0.597 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -1.219 4.528 0.425 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.868 2.985 1.240 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -0.745 4.515 2.140 1.00 0.00 H new ATOM 1679 N VAL A 144 1.143 0.491 0.169 1.00 0.00 N ATOM 1680 CA VAL A 144 1.530 -0.313 -0.982 1.00 0.00 C ATOM 1681 C VAL A 144 1.788 0.577 -2.193 1.00 0.00 C ATOM 1682 O VAL A 144 0.855 1.032 -2.855 1.00 0.00 O ATOM 1683 CB VAL A 144 0.449 -1.362 -1.312 1.00 0.00 C ATOM 1684 CG1 VAL A 144 0.979 -2.385 -2.304 1.00 0.00 C ATOM 1685 CG2 VAL A 144 -0.040 -2.047 -0.041 1.00 0.00 C ATOM 0 H VAL A 144 0.147 0.467 0.387 1.00 0.00 H new ATOM 0 HA VAL A 144 2.451 -0.839 -0.730 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.397 -0.849 -1.771 1.00 0.00 H new ATOM 0 HG11 VAL A 144 0.201 -3.116 -2.523 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.273 -1.881 -3.224 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.844 -2.893 -1.876 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -0.802 -2.784 -0.295 1.00 0.00 H new ATOM 0 HG22 VAL A 144 0.797 -2.545 0.449 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -0.465 -1.303 0.633 1.00 0.00 H new ATOM 1695 N ILE A 145 3.066 0.839 -2.458 1.00 0.00 N ATOM 1696 CA ILE A 145 3.463 1.695 -3.571 1.00 0.00 C ATOM 1697 C ILE A 145 3.378 0.970 -4.909 1.00 0.00 C ATOM 1698 O ILE A 145 3.166 1.597 -5.949 1.00 0.00 O ATOM 1699 CB ILE A 145 4.894 2.237 -3.382 1.00 0.00 C ATOM 1700 CG1 ILE A 145 5.906 1.088 -3.339 1.00 0.00 C ATOM 1701 CG2 ILE A 145 4.979 3.071 -2.113 1.00 0.00 C ATOM 1702 CD1 ILE A 145 6.670 0.908 -4.633 1.00 0.00 C ATOM 0 H ILE A 145 3.846 0.469 -1.915 1.00 0.00 H new ATOM 0 HA ILE A 145 2.760 2.528 -3.580 1.00 0.00 H new ATOM 0 HB ILE A 145 5.137 2.873 -4.233 1.00 0.00 H new ATOM 0 HG12 ILE A 145 6.614 1.268 -2.530 1.00 0.00 H new ATOM 0 HG13 ILE A 145 5.382 0.162 -3.104 1.00 0.00 H new ATOM 0 HG21 ILE A 145 5.995 3.447 -1.992 1.00 0.00 H new ATOM 0 HG22 ILE A 145 4.287 3.910 -2.182 1.00 0.00 H new ATOM 0 HG23 ILE A 145 4.716 2.454 -1.254 1.00 0.00 H new ATOM 0 HD11 ILE A 145 7.368 0.077 -4.531 1.00 0.00 H new ATOM 0 HD12 ILE A 145 5.971 0.697 -5.442 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.222 1.820 -4.860 1.00 0.00 H new ATOM 1714 N SER A 146 3.541 -0.350 -4.888 1.00 0.00 N ATOM 1715 CA SER A 146 3.476 -1.129 -6.121 1.00 0.00 C ATOM 1716 C SER A 146 2.781 -2.470 -5.902 1.00 0.00 C ATOM 1717 O SER A 146 2.732 -2.988 -4.785 1.00 0.00 O ATOM 1718 CB SER A 146 4.881 -1.340 -6.696 1.00 0.00 C ATOM 1719 OG SER A 146 5.299 -2.691 -6.576 1.00 0.00 O ATOM 0 H SER A 146 3.716 -0.896 -4.045 1.00 0.00 H new ATOM 0 HA SER A 146 2.883 -0.563 -6.840 1.00 0.00 H new ATOM 0 HB2 SER A 146 4.892 -1.047 -7.746 1.00 0.00 H new ATOM 0 HB3 SER A 146 5.588 -0.693 -6.177 1.00 0.00 H new ATOM 0 HG SER A 146 5.629 -3.009 -7.442 1.00 0.00 H new ATOM 1725 N LEU A 147 2.257 -3.027 -6.990 1.00 0.00 N ATOM 1726 CA LEU A 147 1.569 -4.307 -6.949 1.00 0.00 C ATOM 1727 C LEU A 147 1.919 -5.115 -8.187 1.00 0.00 C ATOM 1728 O LEU A 147 2.333 -4.557 -9.202 1.00 0.00 O ATOM 1729 CB LEU A 147 0.053 -4.097 -6.873 1.00 0.00 C ATOM 1730 CG LEU A 147 -0.712 -5.127 -6.037 1.00 0.00 C ATOM 1731 CD1 LEU A 147 -0.908 -4.618 -4.618 1.00 0.00 C ATOM 1732 CD2 LEU A 147 -2.056 -5.444 -6.677 1.00 0.00 C ATOM 0 H LEU A 147 2.298 -2.605 -7.918 1.00 0.00 H new ATOM 0 HA LEU A 147 1.889 -4.851 -6.060 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.139 -3.106 -6.462 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.349 -4.106 -7.886 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.124 -6.044 -5.999 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -1.453 -5.362 -4.037 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.064 -4.439 -4.158 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -1.475 -3.688 -4.640 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -2.585 -6.178 -6.068 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -2.650 -4.533 -6.745 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.897 -5.849 -7.676 1.00 0.00 H new ATOM 1744 N ASN A 148 1.764 -6.426 -8.098 1.00 0.00 N ATOM 1745 CA ASN A 148 2.075 -7.313 -9.215 1.00 0.00 C ATOM 1746 C ASN A 148 1.582 -6.755 -10.554 1.00 0.00 C ATOM 1747 O ASN A 148 0.416 -6.913 -10.909 1.00 0.00 O ATOM 1748 CB ASN A 148 1.413 -8.669 -8.980 1.00 0.00 C ATOM 1749 CG ASN A 148 -0.019 -8.522 -8.491 1.00 0.00 C ATOM 1750 OD1 ASN A 148 -0.282 -7.817 -7.517 1.00 0.00 O ATOM 1751 ND2 ASN A 148 -0.955 -9.172 -9.171 1.00 0.00 N ATOM 0 H ASN A 148 1.424 -6.904 -7.263 1.00 0.00 H new ATOM 0 HA ASN A 148 3.160 -7.407 -9.265 1.00 0.00 H new ATOM 0 HB2 ASN A 148 1.423 -9.244 -9.906 1.00 0.00 H new ATOM 0 HB3 ASN A 148 1.991 -9.233 -8.248 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -1.933 -9.097 -8.892 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -0.696 -9.747 -9.973 1.00 0.00 H new ATOM 1758 N GLY A 149 2.493 -6.151 -11.309 1.00 0.00 N ATOM 1759 CA GLY A 149 2.150 -5.623 -12.622 1.00 0.00 C ATOM 1760 C GLY A 149 1.406 -4.296 -12.592 1.00 0.00 C ATOM 1761 O GLY A 149 0.649 -3.992 -13.515 1.00 0.00 O ATOM 0 H GLY A 149 3.467 -6.016 -11.036 1.00 0.00 H new ATOM 0 HA2 GLY A 149 3.065 -5.499 -13.201 1.00 0.00 H new ATOM 0 HA3 GLY A 149 1.538 -6.357 -13.147 1.00 0.00 H new ATOM 1765 N HIS A 150 1.624 -3.497 -11.555 1.00 0.00 N ATOM 1766 CA HIS A 150 0.968 -2.193 -11.448 1.00 0.00 C ATOM 1767 C HIS A 150 1.741 -1.275 -10.518 1.00 0.00 C ATOM 1768 O HIS A 150 2.588 -1.725 -9.747 1.00 0.00 O ATOM 1769 CB HIS A 150 -0.471 -2.331 -10.948 1.00 0.00 C ATOM 1770 CG HIS A 150 -1.208 -3.473 -11.563 1.00 0.00 C ATOM 1771 ND1 HIS A 150 -2.029 -3.345 -12.664 1.00 0.00 N ATOM 1772 CD2 HIS A 150 -1.232 -4.776 -11.226 1.00 0.00 C ATOM 1773 CE1 HIS A 150 -2.526 -4.528 -12.977 1.00 0.00 C ATOM 1774 NE2 HIS A 150 -2.056 -5.415 -12.119 1.00 0.00 N ATOM 0 H HIS A 150 2.245 -3.724 -10.779 1.00 0.00 H new ATOM 0 HA HIS A 150 0.949 -1.759 -12.448 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -0.461 -2.457 -9.865 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -1.010 -1.407 -11.156 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -0.701 -5.234 -10.405 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -3.201 -4.734 -13.794 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -2.270 -6.412 -12.120 1.00 0.00 H new ATOM 1783 N THR A 151 1.445 0.014 -10.600 1.00 0.00 N ATOM 1784 CA THR A 151 2.117 0.999 -9.769 1.00 0.00 C ATOM 1785 C THR A 151 1.167 2.120 -9.374 1.00 0.00 C ATOM 1786 O THR A 151 0.232 2.448 -10.106 1.00 0.00 O ATOM 1787 CB THR A 151 3.327 1.559 -10.507 1.00 0.00 C ATOM 1788 OG1 THR A 151 2.931 2.527 -11.464 1.00 0.00 O ATOM 1789 CG2 THR A 151 4.120 0.490 -11.231 1.00 0.00 C ATOM 0 H THR A 151 0.745 0.401 -11.233 1.00 0.00 H new ATOM 0 HA THR A 151 2.453 0.509 -8.855 1.00 0.00 H new ATOM 0 HB THR A 151 3.958 2.007 -9.740 1.00 0.00 H new ATOM 0 HG1 THR A 151 3.723 2.875 -11.925 1.00 0.00 H new ATOM 0 HG21 THR A 151 4.969 0.948 -11.738 1.00 0.00 H new ATOM 0 HG22 THR A 151 4.480 -0.246 -10.512 1.00 0.00 H new ATOM 0 HG23 THR A 151 3.482 -0.002 -11.965 1.00 0.00 H new ATOM 1797 N LEU A 152 1.405 2.693 -8.200 1.00 0.00 N ATOM 1798 CA LEU A 152 0.568 3.768 -7.684 1.00 0.00 C ATOM 1799 C LEU A 152 0.423 4.902 -8.692 1.00 0.00 C ATOM 1800 O LEU A 152 -0.663 5.459 -8.860 1.00 0.00 O ATOM 1801 CB LEU A 152 1.153 4.291 -6.373 1.00 0.00 C ATOM 1802 CG LEU A 152 0.404 3.858 -5.114 1.00 0.00 C ATOM 1803 CD1 LEU A 152 1.142 4.321 -3.867 1.00 0.00 C ATOM 1804 CD2 LEU A 152 -1.013 4.405 -5.128 1.00 0.00 C ATOM 0 H LEU A 152 2.175 2.429 -7.585 1.00 0.00 H new ATOM 0 HA LEU A 152 -0.428 3.365 -7.502 1.00 0.00 H new ATOM 0 HB2 LEU A 152 2.188 3.957 -6.295 1.00 0.00 H new ATOM 0 HB3 LEU A 152 1.172 5.380 -6.410 1.00 0.00 H new ATOM 0 HG LEU A 152 0.355 2.769 -5.098 1.00 0.00 H new ATOM 0 HD11 LEU A 152 0.593 4.003 -2.980 1.00 0.00 H new ATOM 0 HD12 LEU A 152 2.140 3.884 -3.852 1.00 0.00 H new ATOM 0 HD13 LEU A 152 1.222 5.408 -3.874 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -1.534 4.088 -4.225 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -0.982 5.494 -5.166 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -1.541 4.026 -6.003 1.00 0.00 H new