USER MOD reduce.3.24.130724 H: found=0, std=0, add=618, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 621 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 172 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 176 HIS : no HD1:sc= -8.49! C(o=-8.5!,f=-9.1!) USER MOD Single : A 127 SER OG : rot 180:sc= 0.131 USER MOD Single : A 128 HIS :FLIP no HD1:sc= -0.572 F(o=-1.6!,f=-0.57) USER MOD Single : A 129 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN :FLIP amide:sc= -0.227 F(o=-2.5,f=-0.23) USER MOD Single : A 140 GLN : amide:sc= -0.182 X(o=-0.18,f=-0.18) USER MOD Single : A 141 THR OG1 : rot -14:sc= -0.336 USER MOD Single : A 143 SER OG : rot -89:sc= -0.325! USER MOD Single : A 148 GLN :FLIP amide:sc= -5.61! C(o=-8.8!,f=-5.6!) USER MOD Single : A 151 SER OG : rot -68:sc= 0.827 USER MOD Single : A 159 ASN : amide:sc= 0.138 K(o=0.14,f=-2.3!) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 SER OG : rot -150:sc= -1.47 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 SER OG : rot 180:sc= 0.12 USER MOD Single : A 179 ASN : amide:sc= -0.287 K(o=-0.29,f=-2.1!) USER MOD Single : A 181 MET CE :methyl 161:sc= -5.84! (180deg=-7.47!) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 184 MET CE :methyl 179:sc= -7.24! (180deg=-7.35!) USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 187 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 188 SER OG : rot 180:sc= -0.811 USER MOD Single : A 191 HIS : no HD1:sc= -1.15 X(o=-1.2,f=-1.5) USER MOD Single : A 195 MET CE :methyl 155:sc= -0.715 (180deg=-1.59) USER MOD Single : A 204 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 126 13.435 1.526 11.903 1.00 0.00 N ATOM 2 CA GLY A 126 14.780 0.956 11.617 1.00 0.00 C ATOM 3 C GLY A 126 15.192 1.137 10.170 1.00 0.00 C ATOM 4 O GLY A 126 15.210 2.256 9.658 1.00 0.00 O ATOM 0 HA2 GLY A 126 15.517 1.432 12.263 1.00 0.00 H new ATOM 0 HA3 GLY A 126 14.780 -0.106 11.861 1.00 0.00 H new ATOM 10 N SER A 127 15.525 0.032 9.509 1.00 0.00 N ATOM 11 CA SER A 127 15.938 0.074 8.111 1.00 0.00 C ATOM 12 C SER A 127 14.765 0.432 7.206 1.00 0.00 C ATOM 13 O SER A 127 13.638 0.598 7.671 1.00 0.00 O ATOM 14 CB SER A 127 16.528 -1.274 7.692 1.00 0.00 C ATOM 15 OG SER A 127 16.782 -2.093 8.820 1.00 0.00 O ATOM 0 H SER A 127 15.517 -0.902 9.919 1.00 0.00 H new ATOM 0 HA SER A 127 16.701 0.846 8.007 1.00 0.00 H new ATOM 0 HB2 SER A 127 15.839 -1.782 7.018 1.00 0.00 H new ATOM 0 HB3 SER A 127 17.454 -1.113 7.140 1.00 0.00 H new ATOM 0 HG SER A 127 17.157 -2.949 8.525 1.00 0.00 H new ATOM 21 N HIS A 128 15.038 0.549 5.911 1.00 0.00 N ATOM 22 CA HIS A 128 14.005 0.887 4.938 1.00 0.00 C ATOM 23 C HIS A 128 14.337 0.305 3.568 1.00 0.00 C ATOM 24 O HIS A 128 15.491 0.325 3.138 1.00 0.00 O ATOM 25 CB HIS A 128 13.848 2.406 4.836 1.00 0.00 C ATOM 26 CG HIS A 128 15.153 3.139 4.792 1.00 0.00 C ATOM 27 ND1 HIS A 128 16.219 3.104 5.627 1.00 0.00 N flip ATOM 28 CD2 HIS A 128 15.476 4.040 3.799 1.00 0.00 C flip ATOM 29 CE1 HIS A 128 17.156 3.974 5.127 1.00 0.00 C flip ATOM 30 NE2 HIS A 128 16.684 4.525 4.024 1.00 0.00 N flip ATOM 0 H HIS A 128 15.966 0.415 5.510 1.00 0.00 H new ATOM 0 HA HIS A 128 13.064 0.454 5.278 1.00 0.00 H new ATOM 0 HB2 HIS A 128 13.276 2.645 3.940 1.00 0.00 H new ATOM 0 HB3 HIS A 128 13.269 2.762 5.688 1.00 0.00 H new ATOM 0 HD2 HIS A 128 14.841 4.307 2.968 1.00 0.00 H new ATOM 0 HE1 HIS A 128 18.123 4.175 5.565 1.00 0.00 H new ATOM 0 HE2 HIS A 128 17.170 5.209 3.444 1.00 0.00 H new ATOM 39 N MET A 129 13.318 -0.215 2.887 1.00 0.00 N ATOM 40 CA MET A 129 13.495 -0.807 1.563 1.00 0.00 C ATOM 41 C MET A 129 14.730 -1.705 1.517 1.00 0.00 C ATOM 42 O MET A 129 15.718 -1.385 0.857 1.00 0.00 O ATOM 43 CB MET A 129 13.605 0.290 0.499 1.00 0.00 C ATOM 44 CG MET A 129 14.689 1.315 0.790 1.00 0.00 C ATOM 45 SD MET A 129 14.966 2.444 -0.588 1.00 0.00 S ATOM 46 CE MET A 129 16.705 2.820 -0.375 1.00 0.00 C ATOM 0 H MET A 129 12.358 -0.238 3.232 1.00 0.00 H new ATOM 0 HA MET A 129 12.620 -1.422 1.354 1.00 0.00 H new ATOM 0 HB2 MET A 129 13.804 -0.172 -0.468 1.00 0.00 H new ATOM 0 HB3 MET A 129 12.646 0.802 0.416 1.00 0.00 H new ATOM 0 HG2 MET A 129 14.413 1.889 1.675 1.00 0.00 H new ATOM 0 HG3 MET A 129 15.620 0.798 1.023 1.00 0.00 H new ATOM 0 HE1 MET A 129 17.026 3.510 -1.155 1.00 0.00 H new ATOM 0 HE2 MET A 129 16.861 3.278 0.602 1.00 0.00 H new ATOM 0 HE3 MET A 129 17.287 1.901 -0.442 1.00 0.00 H new ATOM 56 N ASP A 130 14.666 -2.831 2.225 1.00 0.00 N ATOM 57 CA ASP A 130 15.777 -3.771 2.264 1.00 0.00 C ATOM 58 C ASP A 130 15.610 -4.854 1.196 1.00 0.00 C ATOM 59 O ASP A 130 15.843 -4.604 0.013 1.00 0.00 O ATOM 60 CB ASP A 130 15.907 -4.372 3.669 1.00 0.00 C ATOM 61 CG ASP A 130 16.692 -3.477 4.609 1.00 0.00 C ATOM 62 OD1 ASP A 130 16.639 -2.242 4.435 1.00 0.00 O ATOM 63 OD2 ASP A 130 17.358 -4.012 5.521 1.00 0.00 O ATOM 0 H ASP A 130 13.856 -3.112 2.778 1.00 0.00 H new ATOM 0 HA ASP A 130 16.701 -3.238 2.039 1.00 0.00 H new ATOM 0 HB2 ASP A 130 14.913 -4.544 4.081 1.00 0.00 H new ATOM 0 HB3 ASP A 130 16.397 -5.343 3.602 1.00 0.00 H new ATOM 68 N ASP A 131 15.205 -6.045 1.607 1.00 0.00 N ATOM 69 CA ASP A 131 15.009 -7.147 0.676 1.00 0.00 C ATOM 70 C ASP A 131 13.539 -7.275 0.293 1.00 0.00 C ATOM 71 O ASP A 131 12.653 -7.212 1.145 1.00 0.00 O ATOM 72 CB ASP A 131 15.522 -8.454 1.281 1.00 0.00 C ATOM 73 CG ASP A 131 14.856 -8.792 2.597 1.00 0.00 C ATOM 74 OD1 ASP A 131 15.126 -8.090 3.595 1.00 0.00 O ATOM 75 OD2 ASP A 131 14.072 -9.762 2.634 1.00 0.00 O ATOM 0 H ASP A 131 15.005 -6.274 2.581 1.00 0.00 H new ATOM 0 HA ASP A 131 15.579 -6.937 -0.229 1.00 0.00 H new ATOM 0 HB2 ASP A 131 15.354 -9.267 0.575 1.00 0.00 H new ATOM 0 HB3 ASP A 131 16.599 -8.381 1.432 1.00 0.00 H new ATOM 80 N ALA A 132 13.291 -7.439 -1.001 1.00 0.00 N ATOM 81 CA ALA A 132 11.934 -7.560 -1.525 1.00 0.00 C ATOM 82 C ALA A 132 11.059 -8.475 -0.671 1.00 0.00 C ATOM 83 O ALA A 132 9.880 -8.193 -0.458 1.00 0.00 O ATOM 84 CB ALA A 132 11.976 -8.065 -2.959 1.00 0.00 C ATOM 0 H ALA A 132 14.019 -7.492 -1.713 1.00 0.00 H new ATOM 0 HA ALA A 132 11.484 -6.567 -1.496 1.00 0.00 H new ATOM 0 HB1 ALA A 132 10.960 -8.153 -3.344 1.00 0.00 H new ATOM 0 HB2 ALA A 132 12.538 -7.363 -3.576 1.00 0.00 H new ATOM 0 HB3 ALA A 132 12.460 -9.041 -2.987 1.00 0.00 H new ATOM 90 N ASN A 133 11.629 -9.580 -0.202 1.00 0.00 N ATOM 91 CA ASN A 133 10.888 -10.532 0.602 1.00 0.00 C ATOM 92 C ASN A 133 10.548 -9.973 1.969 1.00 0.00 C ATOM 93 O ASN A 133 9.385 -9.949 2.371 1.00 0.00 O ATOM 94 CB ASN A 133 11.678 -11.830 0.739 1.00 0.00 C ATOM 95 CG ASN A 133 11.100 -12.913 -0.137 1.00 0.00 C ATOM 96 OD1 ASN A 133 9.784 -13.054 -0.081 1.00 0.00 O flip ATOM 97 ND2 ASN A 133 11.820 -13.610 -0.852 1.00 0.00 N flip ATOM 0 H ASN A 133 12.603 -9.834 -0.368 1.00 0.00 H new ATOM 0 HA ASN A 133 9.947 -10.736 0.091 1.00 0.00 H new ATOM 0 HB2 ASN A 133 12.719 -11.656 0.468 1.00 0.00 H new ATOM 0 HB3 ASN A 133 11.670 -12.156 1.779 1.00 0.00 H new ATOM 0 HD21 ASN A 133 12.829 -13.461 -0.859 1.00 0.00 H new ATOM 0 HD22 ASN A 133 11.407 -14.336 -1.437 1.00 0.00 H new ATOM 104 N ASP A 134 11.561 -9.523 2.684 1.00 0.00 N ATOM 105 CA ASP A 134 11.352 -8.963 4.010 1.00 0.00 C ATOM 106 C ASP A 134 10.301 -7.864 3.956 1.00 0.00 C ATOM 107 O ASP A 134 9.602 -7.605 4.937 1.00 0.00 O ATOM 108 CB ASP A 134 12.660 -8.413 4.581 1.00 0.00 C ATOM 109 CG ASP A 134 12.487 -7.844 5.977 1.00 0.00 C ATOM 110 OD1 ASP A 134 11.715 -6.875 6.130 1.00 0.00 O ATOM 111 OD2 ASP A 134 13.123 -8.367 6.915 1.00 0.00 O ATOM 0 H ASP A 134 12.533 -9.533 2.373 1.00 0.00 H new ATOM 0 HA ASP A 134 11.000 -9.759 4.666 1.00 0.00 H new ATOM 0 HB2 ASP A 134 13.405 -9.208 4.605 1.00 0.00 H new ATOM 0 HB3 ASP A 134 13.044 -7.636 3.920 1.00 0.00 H new ATOM 116 N ILE A 135 10.183 -7.230 2.793 1.00 0.00 N ATOM 117 CA ILE A 135 9.206 -6.172 2.600 1.00 0.00 C ATOM 118 C ILE A 135 7.794 -6.744 2.624 1.00 0.00 C ATOM 119 O ILE A 135 6.985 -6.373 3.468 1.00 0.00 O ATOM 120 CB ILE A 135 9.446 -5.424 1.280 1.00 0.00 C ATOM 121 CG1 ILE A 135 10.758 -4.652 1.369 1.00 0.00 C ATOM 122 CG2 ILE A 135 8.296 -4.472 0.966 1.00 0.00 C ATOM 123 CD1 ILE A 135 11.381 -4.377 0.030 1.00 0.00 C ATOM 0 H ILE A 135 10.753 -7.433 1.972 1.00 0.00 H new ATOM 0 HA ILE A 135 9.319 -5.462 3.419 1.00 0.00 H new ATOM 0 HB ILE A 135 9.502 -6.154 0.472 1.00 0.00 H new ATOM 0 HG12 ILE A 135 10.580 -3.706 1.880 1.00 0.00 H new ATOM 0 HG13 ILE A 135 11.462 -5.217 1.980 1.00 0.00 H new ATOM 0 HG21 ILE A 135 8.496 -3.958 0.026 1.00 0.00 H new ATOM 0 HG22 ILE A 135 7.368 -5.038 0.880 1.00 0.00 H new ATOM 0 HG23 ILE A 135 8.201 -3.739 1.767 1.00 0.00 H new ATOM 0 HD11 ILE A 135 12.311 -3.825 0.168 1.00 0.00 H new ATOM 0 HD12 ILE A 135 11.590 -5.320 -0.474 1.00 0.00 H new ATOM 0 HD13 ILE A 135 10.695 -3.786 -0.576 1.00 0.00 H new ATOM 135 N ARG A 136 7.508 -7.659 1.697 1.00 0.00 N ATOM 136 CA ARG A 136 6.192 -8.283 1.628 1.00 0.00 C ATOM 137 C ARG A 136 5.785 -8.812 2.996 1.00 0.00 C ATOM 138 O ARG A 136 4.631 -8.690 3.411 1.00 0.00 O ATOM 139 CB ARG A 136 6.184 -9.407 0.597 1.00 0.00 C ATOM 140 CG ARG A 136 7.243 -10.453 0.853 1.00 0.00 C ATOM 141 CD ARG A 136 6.955 -11.738 0.099 1.00 0.00 C ATOM 142 NE ARG A 136 7.084 -12.916 0.951 1.00 0.00 N ATOM 143 CZ ARG A 136 6.805 -14.152 0.546 1.00 0.00 C ATOM 144 NH1 ARG A 136 6.387 -14.367 -0.693 1.00 0.00 N ATOM 145 NH2 ARG A 136 6.946 -15.173 1.380 1.00 0.00 N ATOM 0 H ARG A 136 8.168 -7.981 0.989 1.00 0.00 H new ATOM 0 HA ARG A 136 5.469 -7.529 1.318 1.00 0.00 H new ATOM 0 HB2 ARG A 136 5.204 -9.884 0.596 1.00 0.00 H new ATOM 0 HB3 ARG A 136 6.333 -8.982 -0.396 1.00 0.00 H new ATOM 0 HG2 ARG A 136 8.217 -10.066 0.554 1.00 0.00 H new ATOM 0 HG3 ARG A 136 7.298 -10.662 1.921 1.00 0.00 H new ATOM 0 HD2 ARG A 136 5.947 -11.698 -0.313 1.00 0.00 H new ATOM 0 HD3 ARG A 136 7.640 -11.824 -0.744 1.00 0.00 H new ATOM 0 HE ARG A 136 7.406 -12.784 1.910 1.00 0.00 H new ATOM 0 HH11 ARG A 136 6.279 -13.584 -1.338 1.00 0.00 H new ATOM 0 HH12 ARG A 136 6.174 -15.315 -1.002 1.00 0.00 H new ATOM 0 HH21 ARG A 136 7.269 -15.011 2.334 1.00 0.00 H new ATOM 0 HH22 ARG A 136 6.732 -16.120 1.068 1.00 0.00 H new ATOM 159 N ALA A 137 6.749 -9.374 3.712 1.00 0.00 N ATOM 160 CA ALA A 137 6.488 -9.880 5.045 1.00 0.00 C ATOM 161 C ALA A 137 6.057 -8.728 5.932 1.00 0.00 C ATOM 162 O ALA A 137 5.230 -8.888 6.828 1.00 0.00 O ATOM 163 CB ALA A 137 7.720 -10.555 5.611 1.00 0.00 C ATOM 0 H ALA A 137 7.711 -9.489 3.392 1.00 0.00 H new ATOM 0 HA ALA A 137 5.692 -10.624 5.001 1.00 0.00 H new ATOM 0 HB1 ALA A 137 7.503 -10.928 6.612 1.00 0.00 H new ATOM 0 HB2 ALA A 137 8.007 -11.387 4.968 1.00 0.00 H new ATOM 0 HB3 ALA A 137 8.538 -9.836 5.661 1.00 0.00 H new ATOM 169 N ARG A 138 6.616 -7.556 5.647 1.00 0.00 N ATOM 170 CA ARG A 138 6.285 -6.353 6.387 1.00 0.00 C ATOM 171 C ARG A 138 4.992 -5.760 5.847 1.00 0.00 C ATOM 172 O ARG A 138 4.212 -5.172 6.592 1.00 0.00 O ATOM 173 CB ARG A 138 7.419 -5.330 6.283 1.00 0.00 C ATOM 174 CG ARG A 138 7.266 -4.153 7.232 1.00 0.00 C ATOM 175 CD ARG A 138 7.937 -2.904 6.685 1.00 0.00 C ATOM 176 NE ARG A 138 8.487 -2.067 7.749 1.00 0.00 N ATOM 177 CZ ARG A 138 9.653 -2.303 8.340 1.00 0.00 C ATOM 178 NH1 ARG A 138 10.387 -3.345 7.975 1.00 0.00 N ATOM 179 NH2 ARG A 138 10.087 -1.495 9.298 1.00 0.00 N ATOM 0 H ARG A 138 7.302 -7.418 4.905 1.00 0.00 H new ATOM 0 HA ARG A 138 6.151 -6.611 7.438 1.00 0.00 H new ATOM 0 HB2 ARG A 138 8.367 -5.829 6.486 1.00 0.00 H new ATOM 0 HB3 ARG A 138 7.468 -4.957 5.260 1.00 0.00 H new ATOM 0 HG2 ARG A 138 6.207 -3.955 7.399 1.00 0.00 H new ATOM 0 HG3 ARG A 138 7.700 -4.406 8.200 1.00 0.00 H new ATOM 0 HD2 ARG A 138 8.735 -3.192 6.001 1.00 0.00 H new ATOM 0 HD3 ARG A 138 7.214 -2.328 6.107 1.00 0.00 H new ATOM 0 HE ARG A 138 7.946 -1.258 8.054 1.00 0.00 H new ATOM 0 HH11 ARG A 138 10.057 -3.968 7.238 1.00 0.00 H new ATOM 0 HH12 ARG A 138 11.282 -3.523 8.431 1.00 0.00 H new ATOM 0 HH21 ARG A 138 9.525 -0.692 9.581 1.00 0.00 H new ATOM 0 HH22 ARG A 138 10.982 -1.677 9.752 1.00 0.00 H new ATOM 193 N LEU A 139 4.769 -5.938 4.544 1.00 0.00 N ATOM 194 CA LEU A 139 3.566 -5.439 3.889 1.00 0.00 C ATOM 195 C LEU A 139 2.322 -5.841 4.670 1.00 0.00 C ATOM 196 O LEU A 139 1.309 -5.141 4.660 1.00 0.00 O ATOM 197 CB LEU A 139 3.465 -5.986 2.468 1.00 0.00 C ATOM 198 CG LEU A 139 3.948 -5.042 1.370 1.00 0.00 C ATOM 199 CD1 LEU A 139 5.319 -4.487 1.701 1.00 0.00 C ATOM 200 CD2 LEU A 139 3.978 -5.765 0.042 1.00 0.00 C ATOM 0 H LEU A 139 5.412 -6.427 3.921 1.00 0.00 H new ATOM 0 HA LEU A 139 3.631 -4.352 3.854 1.00 0.00 H new ATOM 0 HB2 LEU A 139 4.041 -6.909 2.410 1.00 0.00 H new ATOM 0 HB3 LEU A 139 2.425 -6.246 2.269 1.00 0.00 H new ATOM 0 HG LEU A 139 3.252 -4.206 1.302 1.00 0.00 H new ATOM 0 HD11 LEU A 139 5.642 -3.817 0.904 1.00 0.00 H new ATOM 0 HD12 LEU A 139 5.272 -3.937 2.641 1.00 0.00 H new ATOM 0 HD13 LEU A 139 6.030 -5.307 1.796 1.00 0.00 H new ATOM 0 HD21 LEU A 139 4.324 -5.084 -0.735 1.00 0.00 H new ATOM 0 HD22 LEU A 139 4.656 -6.616 0.106 1.00 0.00 H new ATOM 0 HD23 LEU A 139 2.976 -6.117 -0.203 1.00 0.00 H new ATOM 212 N GLN A 140 2.406 -6.988 5.333 1.00 0.00 N ATOM 213 CA GLN A 140 1.291 -7.515 6.111 1.00 0.00 C ATOM 214 C GLN A 140 1.421 -7.189 7.598 1.00 0.00 C ATOM 215 O GLN A 140 0.472 -7.357 8.361 1.00 0.00 O ATOM 216 CB GLN A 140 1.204 -9.023 5.906 1.00 0.00 C ATOM 217 CG GLN A 140 1.278 -9.413 4.443 1.00 0.00 C ATOM 218 CD GLN A 140 0.050 -10.167 3.974 1.00 0.00 C ATOM 219 OE1 GLN A 140 -1.047 -9.612 3.906 1.00 0.00 O ATOM 220 NE2 GLN A 140 0.228 -11.442 3.647 1.00 0.00 N ATOM 0 H GLN A 140 3.240 -7.574 5.347 1.00 0.00 H new ATOM 0 HA GLN A 140 0.377 -7.037 5.759 1.00 0.00 H new ATOM 0 HB2 GLN A 140 2.015 -9.508 6.450 1.00 0.00 H new ATOM 0 HB3 GLN A 140 0.270 -9.391 6.331 1.00 0.00 H new ATOM 0 HG2 GLN A 140 1.400 -8.515 3.838 1.00 0.00 H new ATOM 0 HG3 GLN A 140 2.162 -10.030 4.280 1.00 0.00 H new ATOM 0 HE21 GLN A 140 1.155 -11.862 3.718 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -0.562 -12.001 3.325 1.00 0.00 H new ATOM 229 N THR A 141 2.596 -6.721 8.005 1.00 0.00 N ATOM 230 CA THR A 141 2.836 -6.373 9.399 1.00 0.00 C ATOM 231 C THR A 141 2.302 -4.973 9.726 1.00 0.00 C ATOM 232 O THR A 141 2.510 -4.468 10.829 1.00 0.00 O ATOM 233 CB THR A 141 4.332 -6.453 9.709 1.00 0.00 C ATOM 234 OG1 THR A 141 5.055 -5.504 8.947 1.00 0.00 O ATOM 235 CG2 THR A 141 4.924 -7.817 9.429 1.00 0.00 C ATOM 0 H THR A 141 3.396 -6.574 7.389 1.00 0.00 H new ATOM 0 HA THR A 141 2.300 -7.089 10.022 1.00 0.00 H new ATOM 0 HB THR A 141 4.419 -6.247 10.776 1.00 0.00 H new ATOM 0 HG1 THR A 141 4.483 -5.153 8.233 1.00 0.00 H new ATOM 0 HG21 THR A 141 5.987 -7.808 9.669 1.00 0.00 H new ATOM 0 HG22 THR A 141 4.420 -8.565 10.041 1.00 0.00 H new ATOM 0 HG23 THR A 141 4.792 -8.062 8.375 1.00 0.00 H new ATOM 243 N LEU A 142 1.611 -4.351 8.768 1.00 0.00 N ATOM 244 CA LEU A 142 1.053 -3.018 8.970 1.00 0.00 C ATOM 245 C LEU A 142 -0.364 -3.096 9.516 1.00 0.00 C ATOM 246 O LEU A 142 -0.600 -2.863 10.702 1.00 0.00 O ATOM 247 CB LEU A 142 1.088 -2.226 7.664 1.00 0.00 C ATOM 248 CG LEU A 142 2.482 -2.086 7.054 1.00 0.00 C ATOM 249 CD1 LEU A 142 2.676 -3.119 5.959 1.00 0.00 C ATOM 250 CD2 LEU A 142 2.702 -0.676 6.529 1.00 0.00 C ATOM 0 H LEU A 142 1.426 -4.750 7.848 1.00 0.00 H new ATOM 0 HA LEU A 142 1.665 -2.499 9.707 1.00 0.00 H new ATOM 0 HB2 LEU A 142 0.434 -2.712 6.940 1.00 0.00 H new ATOM 0 HB3 LEU A 142 0.681 -1.231 7.844 1.00 0.00 H new ATOM 0 HG LEU A 142 3.226 -2.266 7.830 1.00 0.00 H new ATOM 0 HD11 LEU A 142 3.672 -3.012 5.530 1.00 0.00 H new ATOM 0 HD12 LEU A 142 2.567 -4.119 6.379 1.00 0.00 H new ATOM 0 HD13 LEU A 142 1.928 -2.969 5.181 1.00 0.00 H new ATOM 0 HD21 LEU A 142 3.701 -0.599 6.099 1.00 0.00 H new ATOM 0 HD22 LEU A 142 1.959 -0.453 5.763 1.00 0.00 H new ATOM 0 HD23 LEU A 142 2.604 0.037 7.348 1.00 0.00 H new ATOM 262 N SER A 143 -1.299 -3.428 8.644 1.00 0.00 N ATOM 263 CA SER A 143 -2.707 -3.548 9.020 1.00 0.00 C ATOM 264 C SER A 143 -3.591 -3.613 7.781 1.00 0.00 C ATOM 265 O SER A 143 -3.105 -3.510 6.655 1.00 0.00 O ATOM 266 CB SER A 143 -3.138 -2.367 9.897 1.00 0.00 C ATOM 267 OG SER A 143 -2.292 -1.248 9.700 1.00 0.00 O ATOM 0 H SER A 143 -1.112 -3.622 7.660 1.00 0.00 H new ATOM 0 HA SER A 143 -2.823 -4.471 9.588 1.00 0.00 H new ATOM 0 HB2 SER A 143 -4.167 -2.094 9.664 1.00 0.00 H new ATOM 0 HB3 SER A 143 -3.116 -2.662 10.946 1.00 0.00 H new ATOM 0 HG SER A 143 -1.532 -1.299 10.317 1.00 0.00 H new ATOM 273 N GLU A 144 -4.894 -3.775 7.993 1.00 0.00 N ATOM 274 CA GLU A 144 -5.845 -3.842 6.889 1.00 0.00 C ATOM 275 C GLU A 144 -5.626 -2.680 5.928 1.00 0.00 C ATOM 276 O GLU A 144 -5.660 -2.850 4.710 1.00 0.00 O ATOM 277 CB GLU A 144 -7.279 -3.816 7.421 1.00 0.00 C ATOM 278 CG GLU A 144 -8.138 -4.962 6.910 1.00 0.00 C ATOM 279 CD GLU A 144 -9.545 -4.931 7.472 1.00 0.00 C ATOM 280 OE1 GLU A 144 -10.210 -3.882 7.351 1.00 0.00 O ATOM 281 OE2 GLU A 144 -9.982 -5.958 8.034 1.00 0.00 O ATOM 0 H GLU A 144 -5.315 -3.862 8.918 1.00 0.00 H new ATOM 0 HA GLU A 144 -5.684 -4.777 6.352 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -7.254 -3.849 8.510 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -7.745 -2.871 7.141 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -8.184 -4.919 5.822 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -7.667 -5.909 7.172 1.00 0.00 H new ATOM 288 N ARG A 145 -5.393 -1.502 6.493 1.00 0.00 N ATOM 289 CA ARG A 145 -5.162 -0.299 5.704 1.00 0.00 C ATOM 290 C ARG A 145 -4.158 -0.554 4.584 1.00 0.00 C ATOM 291 O ARG A 145 -4.464 -0.349 3.411 1.00 0.00 O ATOM 292 CB ARG A 145 -4.665 0.846 6.594 1.00 0.00 C ATOM 293 CG ARG A 145 -5.276 0.866 7.985 1.00 0.00 C ATOM 294 CD ARG A 145 -6.788 0.712 7.933 1.00 0.00 C ATOM 295 NE ARG A 145 -7.244 -0.468 8.662 1.00 0.00 N ATOM 296 CZ ARG A 145 -7.222 -0.570 9.987 1.00 0.00 C ATOM 297 NH1 ARG A 145 -6.770 0.435 10.724 1.00 0.00 N ATOM 298 NH2 ARG A 145 -7.655 -1.677 10.576 1.00 0.00 N ATOM 0 H ARG A 145 -5.359 -1.354 7.502 1.00 0.00 H new ATOM 0 HA ARG A 145 -6.114 -0.015 5.256 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -3.581 0.775 6.687 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -4.881 1.794 6.101 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -4.848 0.061 8.583 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -5.022 1.802 8.482 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -7.257 1.601 8.353 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -7.110 0.643 6.894 1.00 0.00 H new ATOM 0 HE ARG A 145 -7.599 -1.258 8.124 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -6.438 1.288 10.274 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -6.754 0.355 11.741 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -8.005 -2.451 10.012 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -7.638 -1.754 11.593 1.00 0.00 H new ATOM 312 N GLU A 146 -2.955 -0.994 4.949 1.00 0.00 N ATOM 313 CA GLU A 146 -1.918 -1.258 3.958 1.00 0.00 C ATOM 314 C GLU A 146 -2.360 -2.303 2.950 1.00 0.00 C ATOM 315 O GLU A 146 -2.467 -2.020 1.758 1.00 0.00 O ATOM 316 CB GLU A 146 -0.609 -1.702 4.615 1.00 0.00 C ATOM 317 CG GLU A 146 0.549 -1.694 3.636 1.00 0.00 C ATOM 318 CD GLU A 146 0.816 -3.065 3.052 1.00 0.00 C ATOM 319 OE1 GLU A 146 -0.156 -3.811 2.816 1.00 0.00 O ATOM 320 OE2 GLU A 146 1.997 -3.393 2.831 1.00 0.00 O ATOM 0 H GLU A 146 -2.678 -1.173 5.914 1.00 0.00 H new ATOM 0 HA GLU A 146 -1.745 -0.318 3.434 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -0.381 -1.042 5.452 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -0.731 -2.705 5.024 1.00 0.00 H new ATOM 0 HG2 GLU A 146 0.335 -0.993 2.829 1.00 0.00 H new ATOM 0 HG3 GLU A 146 1.446 -1.335 4.140 1.00 0.00 H new ATOM 327 N ARG A 147 -2.615 -3.511 3.428 1.00 0.00 N ATOM 328 CA ARG A 147 -3.044 -4.587 2.553 1.00 0.00 C ATOM 329 C ARG A 147 -4.248 -4.142 1.737 1.00 0.00 C ATOM 330 O ARG A 147 -4.497 -4.655 0.646 1.00 0.00 O ATOM 331 CB ARG A 147 -3.382 -5.841 3.363 1.00 0.00 C ATOM 332 CG ARG A 147 -4.686 -5.738 4.135 1.00 0.00 C ATOM 333 CD ARG A 147 -4.890 -6.939 5.044 1.00 0.00 C ATOM 334 NE ARG A 147 -6.007 -7.773 4.609 1.00 0.00 N ATOM 335 CZ ARG A 147 -6.247 -8.990 5.087 1.00 0.00 C ATOM 336 NH1 ARG A 147 -5.456 -9.509 6.015 1.00 0.00 N ATOM 337 NH2 ARG A 147 -7.282 -9.688 4.639 1.00 0.00 N ATOM 0 H ARG A 147 -2.533 -3.769 4.411 1.00 0.00 H new ATOM 0 HA ARG A 147 -2.227 -4.831 1.874 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -3.437 -6.695 2.688 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -2.571 -6.040 4.063 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -4.687 -4.825 4.731 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -5.519 -5.663 3.436 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -3.979 -7.536 5.065 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -5.070 -6.596 6.063 1.00 0.00 H new ATOM 0 HE ARG A 147 -6.638 -7.401 3.899 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -4.661 -8.974 6.364 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -5.643 -10.443 6.380 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -7.895 -9.291 3.927 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -7.465 -10.622 5.007 1.00 0.00 H new ATOM 351 N GLN A 148 -4.988 -3.173 2.272 1.00 0.00 N ATOM 352 CA GLN A 148 -6.157 -2.651 1.597 1.00 0.00 C ATOM 353 C GLN A 148 -5.755 -1.737 0.440 1.00 0.00 C ATOM 354 O GLN A 148 -5.883 -2.103 -0.730 1.00 0.00 O ATOM 355 CB GLN A 148 -7.036 -1.890 2.589 1.00 0.00 C ATOM 356 CG GLN A 148 -7.980 -2.782 3.379 1.00 0.00 C ATOM 357 CD GLN A 148 -9.440 -2.482 3.104 1.00 0.00 C ATOM 358 OE1 GLN A 148 -9.779 -1.200 3.042 1.00 0.00 O flip ATOM 359 NE2 GLN A 148 -10.254 -3.393 2.948 1.00 0.00 N flip ATOM 0 H GLN A 148 -4.792 -2.738 3.173 1.00 0.00 H new ATOM 0 HA GLN A 148 -6.722 -3.489 1.189 1.00 0.00 H new ATOM 0 HB2 GLN A 148 -6.397 -1.347 3.285 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -7.621 -1.147 2.047 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -7.776 -3.825 3.136 1.00 0.00 H new ATOM 0 HG3 GLN A 148 -7.783 -2.659 4.444 1.00 0.00 H new ATOM 0 HE21 GLN A 148 -9.949 -4.365 3.004 1.00 0.00 H new ATOM 0 HE22 GLN A 148 -11.233 -3.176 2.763 1.00 0.00 H new ATOM 368 N VAL A 149 -5.269 -0.544 0.774 1.00 0.00 N ATOM 369 CA VAL A 149 -4.855 0.417 -0.240 1.00 0.00 C ATOM 370 C VAL A 149 -3.751 -0.145 -1.116 1.00 0.00 C ATOM 371 O VAL A 149 -3.767 0.026 -2.334 1.00 0.00 O ATOM 372 CB VAL A 149 -4.362 1.742 0.363 1.00 0.00 C ATOM 373 CG1 VAL A 149 -5.512 2.719 0.514 1.00 0.00 C ATOM 374 CG2 VAL A 149 -3.661 1.516 1.683 1.00 0.00 C ATOM 0 H VAL A 149 -5.153 -0.222 1.735 1.00 0.00 H new ATOM 0 HA VAL A 149 -5.746 0.613 -0.836 1.00 0.00 H new ATOM 0 HB VAL A 149 -3.635 2.176 -0.323 1.00 0.00 H new ATOM 0 HG11 VAL A 149 -5.144 3.651 0.942 1.00 0.00 H new ATOM 0 HG12 VAL A 149 -5.951 2.918 -0.464 1.00 0.00 H new ATOM 0 HG13 VAL A 149 -6.269 2.291 1.172 1.00 0.00 H new ATOM 0 HG21 VAL A 149 -3.324 2.472 2.084 1.00 0.00 H new ATOM 0 HG22 VAL A 149 -4.351 1.050 2.386 1.00 0.00 H new ATOM 0 HG23 VAL A 149 -2.802 0.863 1.531 1.00 0.00 H new ATOM 384 N LEU A 150 -2.785 -0.806 -0.492 1.00 0.00 N ATOM 385 CA LEU A 150 -1.667 -1.374 -1.227 1.00 0.00 C ATOM 386 C LEU A 150 -2.155 -2.223 -2.396 1.00 0.00 C ATOM 387 O LEU A 150 -1.867 -1.917 -3.551 1.00 0.00 O ATOM 388 CB LEU A 150 -0.772 -2.205 -0.298 1.00 0.00 C ATOM 389 CG LEU A 150 0.599 -2.611 -0.866 1.00 0.00 C ATOM 390 CD1 LEU A 150 1.105 -1.599 -1.888 1.00 0.00 C ATOM 391 CD2 LEU A 150 1.608 -2.770 0.258 1.00 0.00 C ATOM 0 H LEU A 150 -2.754 -0.961 0.516 1.00 0.00 H new ATOM 0 HA LEU A 150 -1.078 -0.550 -1.628 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -0.610 -1.639 0.619 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -1.311 -3.111 -0.022 1.00 0.00 H new ATOM 0 HG LEU A 150 0.477 -3.567 -1.376 1.00 0.00 H new ATOM 0 HD11 LEU A 150 2.076 -1.919 -2.267 1.00 0.00 H new ATOM 0 HD12 LEU A 150 0.397 -1.531 -2.714 1.00 0.00 H new ATOM 0 HD13 LEU A 150 1.205 -0.622 -1.414 1.00 0.00 H new ATOM 0 HD21 LEU A 150 2.574 -3.057 -0.158 1.00 0.00 H new ATOM 0 HD22 LEU A 150 1.710 -1.825 0.792 1.00 0.00 H new ATOM 0 HD23 LEU A 150 1.266 -3.542 0.948 1.00 0.00 H new ATOM 403 N SER A 151 -2.904 -3.283 -2.095 1.00 0.00 N ATOM 404 CA SER A 151 -3.430 -4.162 -3.138 1.00 0.00 C ATOM 405 C SER A 151 -4.157 -3.358 -4.208 1.00 0.00 C ATOM 406 O SER A 151 -4.281 -3.794 -5.349 1.00 0.00 O ATOM 407 CB SER A 151 -4.351 -5.225 -2.559 1.00 0.00 C ATOM 408 OG SER A 151 -5.274 -4.667 -1.642 1.00 0.00 O ATOM 0 H SER A 151 -3.159 -3.553 -1.145 1.00 0.00 H new ATOM 0 HA SER A 151 -2.581 -4.667 -3.598 1.00 0.00 H new ATOM 0 HB2 SER A 151 -4.892 -5.719 -3.366 1.00 0.00 H new ATOM 0 HB3 SER A 151 -3.757 -5.990 -2.059 1.00 0.00 H new ATOM 0 HG SER A 151 -4.796 -4.357 -0.845 1.00 0.00 H new ATOM 414 N ALA A 152 -4.612 -2.168 -3.848 1.00 0.00 N ATOM 415 CA ALA A 152 -5.275 -1.301 -4.806 1.00 0.00 C ATOM 416 C ALA A 152 -4.210 -0.493 -5.531 1.00 0.00 C ATOM 417 O ALA A 152 -4.304 -0.221 -6.728 1.00 0.00 O ATOM 418 CB ALA A 152 -6.263 -0.382 -4.112 1.00 0.00 C ATOM 0 H ALA A 152 -4.535 -1.784 -2.906 1.00 0.00 H new ATOM 0 HA ALA A 152 -5.838 -1.903 -5.519 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -6.746 0.257 -4.851 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -7.017 -0.979 -3.600 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -5.736 0.237 -3.386 1.00 0.00 H new ATOM 424 N VAL A 153 -3.180 -0.137 -4.770 1.00 0.00 N ATOM 425 CA VAL A 153 -2.048 0.615 -5.265 1.00 0.00 C ATOM 426 C VAL A 153 -1.222 -0.244 -6.235 1.00 0.00 C ATOM 427 O VAL A 153 -0.668 0.260 -7.212 1.00 0.00 O ATOM 428 CB VAL A 153 -1.200 1.088 -4.046 1.00 0.00 C ATOM 429 CG1 VAL A 153 0.297 0.861 -4.220 1.00 0.00 C ATOM 430 CG2 VAL A 153 -1.497 2.541 -3.733 1.00 0.00 C ATOM 0 H VAL A 153 -3.114 -0.369 -3.779 1.00 0.00 H new ATOM 0 HA VAL A 153 -2.385 1.490 -5.821 1.00 0.00 H new ATOM 0 HB VAL A 153 -1.497 0.468 -3.200 1.00 0.00 H new ATOM 0 HG11 VAL A 153 0.824 1.214 -3.333 1.00 0.00 H new ATOM 0 HG12 VAL A 153 0.490 -0.203 -4.358 1.00 0.00 H new ATOM 0 HG13 VAL A 153 0.649 1.410 -5.094 1.00 0.00 H new ATOM 0 HG21 VAL A 153 -0.898 2.859 -2.880 1.00 0.00 H new ATOM 0 HG22 VAL A 153 -1.252 3.157 -4.598 1.00 0.00 H new ATOM 0 HG23 VAL A 153 -2.555 2.653 -3.496 1.00 0.00 H new ATOM 440 N VAL A 154 -1.146 -1.540 -5.943 1.00 0.00 N ATOM 441 CA VAL A 154 -0.395 -2.475 -6.763 1.00 0.00 C ATOM 442 C VAL A 154 -0.839 -2.421 -8.222 1.00 0.00 C ATOM 443 O VAL A 154 -0.048 -2.678 -9.131 1.00 0.00 O ATOM 444 CB VAL A 154 -0.553 -3.912 -6.228 1.00 0.00 C ATOM 445 CG1 VAL A 154 -0.138 -3.989 -4.767 1.00 0.00 C ATOM 446 CG2 VAL A 154 -1.975 -4.402 -6.423 1.00 0.00 C ATOM 0 H VAL A 154 -1.602 -1.965 -5.136 1.00 0.00 H new ATOM 0 HA VAL A 154 0.654 -2.183 -6.712 1.00 0.00 H new ATOM 0 HB VAL A 154 0.107 -4.567 -6.797 1.00 0.00 H new ATOM 0 HG11 VAL A 154 -0.257 -5.011 -4.408 1.00 0.00 H new ATOM 0 HG12 VAL A 154 0.905 -3.689 -4.669 1.00 0.00 H new ATOM 0 HG13 VAL A 154 -0.765 -3.322 -4.175 1.00 0.00 H new ATOM 0 HG21 VAL A 154 -2.066 -5.418 -6.039 1.00 0.00 H new ATOM 0 HG22 VAL A 154 -2.662 -3.748 -5.886 1.00 0.00 H new ATOM 0 HG23 VAL A 154 -2.221 -4.392 -7.485 1.00 0.00 H new ATOM 456 N ALA A 155 -2.107 -2.087 -8.440 1.00 0.00 N ATOM 457 CA ALA A 155 -2.650 -2.000 -9.790 1.00 0.00 C ATOM 458 C ALA A 155 -2.490 -0.593 -10.356 1.00 0.00 C ATOM 459 O ALA A 155 -2.077 -0.417 -11.501 1.00 0.00 O ATOM 460 CB ALA A 155 -4.114 -2.414 -9.797 1.00 0.00 C ATOM 0 H ALA A 155 -2.776 -1.873 -7.701 1.00 0.00 H new ATOM 0 HA ALA A 155 -2.089 -2.684 -10.427 1.00 0.00 H new ATOM 0 HB1 ALA A 155 -4.507 -2.344 -10.811 1.00 0.00 H new ATOM 0 HB2 ALA A 155 -4.203 -3.441 -9.443 1.00 0.00 H new ATOM 0 HB3 ALA A 155 -4.682 -1.754 -9.142 1.00 0.00 H new ATOM 466 N GLY A 156 -2.810 0.408 -9.541 1.00 0.00 N ATOM 467 CA GLY A 156 -2.686 1.787 -9.978 1.00 0.00 C ATOM 468 C GLY A 156 -4.025 2.464 -10.203 1.00 0.00 C ATOM 469 O GLY A 156 -4.114 3.435 -10.954 1.00 0.00 O ATOM 0 H GLY A 156 -3.152 0.289 -8.588 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -2.123 2.349 -9.233 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -2.110 1.818 -10.903 1.00 0.00 H new ATOM 473 N LEU A 157 -5.069 1.956 -9.556 1.00 0.00 N ATOM 474 CA LEU A 157 -6.402 2.521 -9.696 1.00 0.00 C ATOM 475 C LEU A 157 -6.486 3.903 -9.054 1.00 0.00 C ATOM 476 O LEU A 157 -5.564 4.334 -8.361 1.00 0.00 O ATOM 477 CB LEU A 157 -7.434 1.584 -9.062 1.00 0.00 C ATOM 478 CG LEU A 157 -7.263 0.093 -9.384 1.00 0.00 C ATOM 479 CD1 LEU A 157 -6.669 -0.108 -10.773 1.00 0.00 C ATOM 480 CD2 LEU A 157 -6.415 -0.593 -8.324 1.00 0.00 C ATOM 0 H LEU A 157 -5.015 1.153 -8.929 1.00 0.00 H new ATOM 0 HA LEU A 157 -6.616 2.629 -10.759 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -7.396 1.710 -7.980 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -8.427 1.895 -9.385 1.00 0.00 H new ATOM 0 HG LEU A 157 -8.251 -0.366 -9.378 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -6.560 -1.174 -10.971 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -7.330 0.334 -11.519 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -5.692 0.372 -10.824 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -6.307 -1.649 -8.572 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -5.431 -0.126 -8.287 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -6.899 -0.496 -7.352 1.00 0.00 H new ATOM 492 N PRO A 158 -7.598 4.621 -9.285 1.00 0.00 N ATOM 493 CA PRO A 158 -7.807 5.963 -8.735 1.00 0.00 C ATOM 494 C PRO A 158 -8.000 5.942 -7.222 1.00 0.00 C ATOM 495 O PRO A 158 -8.358 4.914 -6.647 1.00 0.00 O ATOM 496 CB PRO A 158 -9.088 6.451 -9.432 1.00 0.00 C ATOM 497 CG PRO A 158 -9.329 5.487 -10.547 1.00 0.00 C ATOM 498 CD PRO A 158 -8.737 4.186 -10.102 1.00 0.00 C ATOM 0 HA PRO A 158 -6.946 6.609 -8.907 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -9.929 6.468 -8.739 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -8.966 7.466 -9.810 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -10.395 5.382 -10.749 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -8.863 5.833 -11.470 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -9.447 3.593 -9.526 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -8.421 3.574 -10.946 1.00 0.00 H new ATOM 506 N ASN A 159 -7.759 7.081 -6.584 1.00 0.00 N ATOM 507 CA ASN A 159 -7.904 7.195 -5.137 1.00 0.00 C ATOM 508 C ASN A 159 -9.324 6.850 -4.699 1.00 0.00 C ATOM 509 O ASN A 159 -9.553 6.464 -3.553 1.00 0.00 O ATOM 510 CB ASN A 159 -7.545 8.608 -4.678 1.00 0.00 C ATOM 511 CG ASN A 159 -6.156 9.026 -5.121 1.00 0.00 C ATOM 512 OD1 ASN A 159 -5.909 9.237 -6.308 1.00 0.00 O ATOM 513 ND2 ASN A 159 -5.241 9.145 -4.167 1.00 0.00 N ATOM 0 H ASN A 159 -7.462 7.940 -7.046 1.00 0.00 H new ATOM 0 HA ASN A 159 -7.220 6.484 -4.673 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -8.277 9.312 -5.074 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -7.608 8.661 -3.591 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -4.289 9.421 -4.405 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -5.490 8.960 -3.195 1.00 0.00 H new ATOM 520 N LYS A 160 -10.276 6.994 -5.616 1.00 0.00 N ATOM 521 CA LYS A 160 -11.673 6.698 -5.318 1.00 0.00 C ATOM 522 C LYS A 160 -11.962 5.210 -5.476 1.00 0.00 C ATOM 523 O LYS A 160 -12.313 4.533 -4.511 1.00 0.00 O ATOM 524 CB LYS A 160 -12.595 7.511 -6.229 1.00 0.00 C ATOM 525 CG LYS A 160 -13.534 8.439 -5.476 1.00 0.00 C ATOM 526 CD LYS A 160 -13.334 9.887 -5.890 1.00 0.00 C ATOM 527 CE LYS A 160 -13.987 10.845 -4.905 1.00 0.00 C ATOM 528 NZ LYS A 160 -15.346 11.258 -5.350 1.00 0.00 N ATOM 0 H LYS A 160 -10.106 7.313 -6.570 1.00 0.00 H new ATOM 0 HA LYS A 160 -11.863 6.976 -4.281 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -11.986 8.102 -6.913 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -13.186 6.826 -6.838 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -14.567 8.145 -5.664 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -13.364 8.339 -4.404 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -12.268 10.103 -5.957 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -13.754 10.043 -6.884 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -14.054 10.369 -3.927 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -13.359 11.728 -4.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -15.757 11.910 -4.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -15.279 11.735 -6.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -15.953 10.418 -5.438 1.00 0.00 H new ATOM 542 N SER A 161 -11.806 4.701 -6.698 1.00 0.00 N ATOM 543 CA SER A 161 -12.046 3.285 -6.969 1.00 0.00 C ATOM 544 C SER A 161 -11.357 2.419 -5.922 1.00 0.00 C ATOM 545 O SER A 161 -11.900 1.410 -5.478 1.00 0.00 O ATOM 546 CB SER A 161 -11.541 2.916 -8.365 1.00 0.00 C ATOM 547 OG SER A 161 -11.582 4.032 -9.236 1.00 0.00 O ATOM 0 H SER A 161 -11.516 5.245 -7.511 1.00 0.00 H new ATOM 0 HA SER A 161 -13.120 3.104 -6.924 1.00 0.00 H new ATOM 0 HB2 SER A 161 -10.520 2.541 -8.298 1.00 0.00 H new ATOM 0 HB3 SER A 161 -12.150 2.110 -8.774 1.00 0.00 H new ATOM 0 HG SER A 161 -11.727 3.724 -10.155 1.00 0.00 H new ATOM 553 N ILE A 162 -10.162 2.837 -5.527 1.00 0.00 N ATOM 554 CA ILE A 162 -9.385 2.125 -4.522 1.00 0.00 C ATOM 555 C ILE A 162 -10.130 2.082 -3.195 1.00 0.00 C ATOM 556 O ILE A 162 -10.459 1.013 -2.681 1.00 0.00 O ATOM 557 CB ILE A 162 -8.019 2.813 -4.306 1.00 0.00 C ATOM 558 CG1 ILE A 162 -7.151 2.659 -5.551 1.00 0.00 C ATOM 559 CG2 ILE A 162 -7.300 2.262 -3.078 1.00 0.00 C ATOM 560 CD1 ILE A 162 -6.002 3.633 -5.595 1.00 0.00 C ATOM 0 H ILE A 162 -9.706 3.674 -5.891 1.00 0.00 H new ATOM 0 HA ILE A 162 -9.230 1.108 -4.883 1.00 0.00 H new ATOM 0 HB ILE A 162 -8.201 3.873 -4.129 1.00 0.00 H new ATOM 0 HG12 ILE A 162 -6.759 1.643 -5.590 1.00 0.00 H new ATOM 0 HG13 ILE A 162 -7.770 2.796 -6.438 1.00 0.00 H new ATOM 0 HG21 ILE A 162 -6.343 2.770 -2.958 1.00 0.00 H new ATOM 0 HG22 ILE A 162 -7.913 2.429 -2.192 1.00 0.00 H new ATOM 0 HG23 ILE A 162 -7.130 1.193 -3.205 1.00 0.00 H new ATOM 0 HD11 ILE A 162 -5.423 3.472 -6.504 1.00 0.00 H new ATOM 0 HD12 ILE A 162 -6.388 4.652 -5.586 1.00 0.00 H new ATOM 0 HD13 ILE A 162 -5.362 3.480 -4.726 1.00 0.00 H new ATOM 572 N ALA A 163 -10.377 3.261 -2.648 1.00 0.00 N ATOM 573 CA ALA A 163 -11.063 3.389 -1.383 1.00 0.00 C ATOM 574 C ALA A 163 -12.373 2.641 -1.405 1.00 0.00 C ATOM 575 O ALA A 163 -12.734 1.971 -0.440 1.00 0.00 O ATOM 576 CB ALA A 163 -11.301 4.853 -1.069 1.00 0.00 C ATOM 0 H ALA A 163 -10.107 4.150 -3.070 1.00 0.00 H new ATOM 0 HA ALA A 163 -10.436 2.955 -0.605 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -11.819 4.941 -0.114 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -10.345 5.373 -1.013 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -11.911 5.299 -1.855 1.00 0.00 H new ATOM 582 N TYR A 164 -13.095 2.757 -2.506 1.00 0.00 N ATOM 583 CA TYR A 164 -14.368 2.081 -2.603 1.00 0.00 C ATOM 584 C TYR A 164 -14.190 0.613 -2.962 1.00 0.00 C ATOM 585 O TYR A 164 -15.069 -0.209 -2.702 1.00 0.00 O ATOM 586 CB TYR A 164 -15.304 2.777 -3.591 1.00 0.00 C ATOM 587 CG TYR A 164 -16.591 3.242 -2.942 1.00 0.00 C ATOM 588 CD1 TYR A 164 -17.149 2.528 -1.867 1.00 0.00 C ATOM 589 CD2 TYR A 164 -17.251 4.401 -3.384 1.00 0.00 C ATOM 590 CE1 TYR A 164 -18.326 2.952 -1.249 1.00 0.00 C ATOM 591 CE2 TYR A 164 -18.431 4.836 -2.770 1.00 0.00 C ATOM 592 CZ TYR A 164 -18.963 4.107 -1.703 1.00 0.00 C ATOM 593 OH TYR A 164 -20.124 4.532 -1.098 1.00 0.00 O ATOM 0 H TYR A 164 -12.826 3.301 -3.326 1.00 0.00 H new ATOM 0 HA TYR A 164 -14.834 2.131 -1.619 1.00 0.00 H new ATOM 0 HB2 TYR A 164 -14.792 3.633 -4.030 1.00 0.00 H new ATOM 0 HB3 TYR A 164 -15.539 2.094 -4.407 1.00 0.00 H new ATOM 0 HD1 TYR A 164 -16.657 1.634 -1.513 1.00 0.00 H new ATOM 0 HD2 TYR A 164 -16.842 4.964 -4.210 1.00 0.00 H new ATOM 0 HE1 TYR A 164 -18.741 2.390 -0.425 1.00 0.00 H new ATOM 0 HE2 TYR A 164 -18.927 5.730 -3.119 1.00 0.00 H new ATOM 0 HH TYR A 164 -20.439 5.352 -1.533 1.00 0.00 H new ATOM 603 N ASP A 165 -13.042 0.278 -3.539 1.00 0.00 N ATOM 604 CA ASP A 165 -12.756 -1.103 -3.899 1.00 0.00 C ATOM 605 C ASP A 165 -12.452 -1.918 -2.644 1.00 0.00 C ATOM 606 O ASP A 165 -12.544 -3.146 -2.653 1.00 0.00 O ATOM 607 CB ASP A 165 -11.579 -1.175 -4.877 1.00 0.00 C ATOM 608 CG ASP A 165 -11.122 -2.598 -5.138 1.00 0.00 C ATOM 609 OD1 ASP A 165 -11.962 -3.426 -5.547 1.00 0.00 O ATOM 610 OD2 ASP A 165 -9.923 -2.882 -4.933 1.00 0.00 O ATOM 0 H ASP A 165 -12.299 0.940 -3.766 1.00 0.00 H new ATOM 0 HA ASP A 165 -13.634 -1.522 -4.390 1.00 0.00 H new ATOM 0 HB2 ASP A 165 -11.867 -0.711 -5.820 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -10.745 -0.597 -4.479 1.00 0.00 H new ATOM 615 N LEU A 166 -12.104 -1.225 -1.559 1.00 0.00 N ATOM 616 CA LEU A 166 -11.805 -1.883 -0.298 1.00 0.00 C ATOM 617 C LEU A 166 -12.820 -1.462 0.761 1.00 0.00 C ATOM 618 O LEU A 166 -12.471 -1.204 1.914 1.00 0.00 O ATOM 619 CB LEU A 166 -10.385 -1.542 0.170 1.00 0.00 C ATOM 620 CG LEU A 166 -9.369 -1.259 -0.943 1.00 0.00 C ATOM 621 CD1 LEU A 166 -8.405 -0.163 -0.514 1.00 0.00 C ATOM 622 CD2 LEU A 166 -8.608 -2.526 -1.307 1.00 0.00 C ATOM 0 H LEU A 166 -12.024 -0.208 -1.534 1.00 0.00 H new ATOM 0 HA LEU A 166 -11.868 -2.961 -0.447 1.00 0.00 H new ATOM 0 HB2 LEU A 166 -10.436 -0.669 0.821 1.00 0.00 H new ATOM 0 HB3 LEU A 166 -10.013 -2.369 0.775 1.00 0.00 H new ATOM 0 HG LEU A 166 -9.910 -0.918 -1.826 1.00 0.00 H new ATOM 0 HD11 LEU A 166 -7.690 0.027 -1.315 1.00 0.00 H new ATOM 0 HD12 LEU A 166 -8.962 0.749 -0.302 1.00 0.00 H new ATOM 0 HD13 LEU A 166 -7.871 -0.479 0.382 1.00 0.00 H new ATOM 0 HD21 LEU A 166 -7.892 -2.305 -2.098 1.00 0.00 H new ATOM 0 HD22 LEU A 166 -8.077 -2.896 -0.430 1.00 0.00 H new ATOM 0 HD23 LEU A 166 -9.309 -3.285 -1.654 1.00 0.00 H new ATOM 634 N ASP A 167 -14.081 -1.412 0.350 1.00 0.00 N ATOM 635 CA ASP A 167 -15.184 -1.043 1.235 1.00 0.00 C ATOM 636 C ASP A 167 -14.835 0.139 2.141 1.00 0.00 C ATOM 637 O ASP A 167 -14.972 0.048 3.361 1.00 0.00 O ATOM 638 CB ASP A 167 -15.586 -2.243 2.093 1.00 0.00 C ATOM 639 CG ASP A 167 -16.074 -3.412 1.261 1.00 0.00 C ATOM 640 OD1 ASP A 167 -15.682 -3.504 0.078 1.00 0.00 O ATOM 641 OD2 ASP A 167 -16.848 -4.237 1.791 1.00 0.00 O ATOM 0 H ASP A 167 -14.370 -1.625 -0.605 1.00 0.00 H new ATOM 0 HA ASP A 167 -16.017 -0.737 0.601 1.00 0.00 H new ATOM 0 HB2 ASP A 167 -14.733 -2.559 2.693 1.00 0.00 H new ATOM 0 HB3 ASP A 167 -16.370 -1.943 2.788 1.00 0.00 H new ATOM 646 N ILE A 168 -14.400 1.251 1.548 1.00 0.00 N ATOM 647 CA ILE A 168 -14.056 2.435 2.330 1.00 0.00 C ATOM 648 C ILE A 168 -14.098 3.712 1.499 1.00 0.00 C ATOM 649 O ILE A 168 -14.278 3.673 0.283 1.00 0.00 O ATOM 650 CB ILE A 168 -12.684 2.300 2.988 1.00 0.00 C ATOM 651 CG1 ILE A 168 -11.648 1.815 1.982 1.00 0.00 C ATOM 652 CG2 ILE A 168 -12.786 1.346 4.164 1.00 0.00 C ATOM 653 CD1 ILE A 168 -10.322 1.488 2.615 1.00 0.00 C ATOM 0 H ILE A 168 -14.279 1.355 0.541 1.00 0.00 H new ATOM 0 HA ILE A 168 -14.816 2.509 3.108 1.00 0.00 H new ATOM 0 HB ILE A 168 -12.360 3.276 3.348 1.00 0.00 H new ATOM 0 HG12 ILE A 168 -12.030 0.930 1.474 1.00 0.00 H new ATOM 0 HG13 ILE A 168 -11.502 2.581 1.221 1.00 0.00 H new ATOM 0 HG21 ILE A 168 -11.809 1.246 4.637 1.00 0.00 H new ATOM 0 HG22 ILE A 168 -13.502 1.736 4.888 1.00 0.00 H new ATOM 0 HG23 ILE A 168 -13.120 0.370 3.813 1.00 0.00 H new ATOM 0 HD11 ILE A 168 -9.626 1.148 1.848 1.00 0.00 H new ATOM 0 HD12 ILE A 168 -9.921 2.378 3.100 1.00 0.00 H new ATOM 0 HD13 ILE A 168 -10.457 0.701 3.356 1.00 0.00 H new ATOM 665 N SER A 169 -13.945 4.849 2.173 1.00 0.00 N ATOM 666 CA SER A 169 -13.976 6.143 1.513 1.00 0.00 C ATOM 667 C SER A 169 -12.589 6.559 1.026 1.00 0.00 C ATOM 668 O SER A 169 -11.573 6.085 1.534 1.00 0.00 O ATOM 669 CB SER A 169 -14.535 7.205 2.461 1.00 0.00 C ATOM 670 OG SER A 169 -14.608 6.716 3.789 1.00 0.00 O ATOM 0 H SER A 169 -13.798 4.896 3.181 1.00 0.00 H new ATOM 0 HA SER A 169 -14.626 6.055 0.642 1.00 0.00 H new ATOM 0 HB2 SER A 169 -13.903 8.092 2.431 1.00 0.00 H new ATOM 0 HB3 SER A 169 -15.527 7.509 2.127 1.00 0.00 H new ATOM 0 HG SER A 169 -14.967 7.414 4.375 1.00 0.00 H new ATOM 676 N PRO A 170 -12.534 7.459 0.026 1.00 0.00 N ATOM 677 CA PRO A 170 -11.270 7.944 -0.536 1.00 0.00 C ATOM 678 C PRO A 170 -10.529 8.883 0.407 1.00 0.00 C ATOM 679 O PRO A 170 -9.353 9.180 0.202 1.00 0.00 O ATOM 680 CB PRO A 170 -11.703 8.668 -1.808 1.00 0.00 C ATOM 681 CG PRO A 170 -13.099 9.111 -1.537 1.00 0.00 C ATOM 682 CD PRO A 170 -13.703 8.072 -0.633 1.00 0.00 C ATOM 0 HA PRO A 170 -10.565 7.132 -0.717 1.00 0.00 H new ATOM 0 HB2 PRO A 170 -11.053 9.517 -2.021 1.00 0.00 H new ATOM 0 HB3 PRO A 170 -11.659 8.007 -2.674 1.00 0.00 H new ATOM 0 HG2 PRO A 170 -13.110 10.093 -1.063 1.00 0.00 H new ATOM 0 HG3 PRO A 170 -13.666 9.198 -2.464 1.00 0.00 H new ATOM 0 HD2 PRO A 170 -14.383 8.519 0.092 1.00 0.00 H new ATOM 0 HD3 PRO A 170 -14.277 7.336 -1.196 1.00 0.00 H new ATOM 690 N ARG A 171 -11.204 9.315 1.462 1.00 0.00 N ATOM 691 CA ARG A 171 -10.582 10.174 2.451 1.00 0.00 C ATOM 692 C ARG A 171 -9.737 9.314 3.379 1.00 0.00 C ATOM 693 O ARG A 171 -8.752 9.774 3.962 1.00 0.00 O ATOM 694 CB ARG A 171 -11.641 10.936 3.249 1.00 0.00 C ATOM 695 CG ARG A 171 -11.527 12.447 3.124 1.00 0.00 C ATOM 696 CD ARG A 171 -11.239 13.097 4.468 1.00 0.00 C ATOM 697 NE ARG A 171 -10.164 14.081 4.380 1.00 0.00 N ATOM 698 CZ ARG A 171 -8.873 13.766 4.394 1.00 0.00 C ATOM 699 NH1 ARG A 171 -8.500 12.496 4.493 1.00 0.00 N ATOM 700 NH2 ARG A 171 -7.954 14.717 4.311 1.00 0.00 N ATOM 0 H ARG A 171 -12.179 9.084 1.652 1.00 0.00 H new ATOM 0 HA ARG A 171 -9.951 10.909 1.950 1.00 0.00 H new ATOM 0 HB2 ARG A 171 -12.630 10.626 2.913 1.00 0.00 H new ATOM 0 HB3 ARG A 171 -11.560 10.660 4.300 1.00 0.00 H new ATOM 0 HG2 ARG A 171 -10.733 12.696 2.421 1.00 0.00 H new ATOM 0 HG3 ARG A 171 -12.453 12.850 2.715 1.00 0.00 H new ATOM 0 HD2 ARG A 171 -12.143 13.580 4.838 1.00 0.00 H new ATOM 0 HD3 ARG A 171 -10.969 12.328 5.192 1.00 0.00 H new ATOM 0 HE ARG A 171 -10.418 15.066 4.303 1.00 0.00 H new ATOM 0 HH11 ARG A 171 -9.204 11.761 4.558 1.00 0.00 H new ATOM 0 HH12 ARG A 171 -7.509 12.255 4.504 1.00 0.00 H new ATOM 0 HH21 ARG A 171 -8.237 15.694 4.236 1.00 0.00 H new ATOM 0 HH22 ARG A 171 -6.964 14.472 4.322 1.00 0.00 H new ATOM 714 N THR A 172 -10.125 8.042 3.493 1.00 0.00 N ATOM 715 CA THR A 172 -9.410 7.099 4.325 1.00 0.00 C ATOM 716 C THR A 172 -8.113 6.684 3.639 1.00 0.00 C ATOM 717 O THR A 172 -7.032 6.847 4.198 1.00 0.00 O ATOM 718 CB THR A 172 -10.315 5.889 4.649 1.00 0.00 C ATOM 719 OG1 THR A 172 -10.556 5.814 6.042 1.00 0.00 O ATOM 720 CG2 THR A 172 -9.767 4.539 4.216 1.00 0.00 C ATOM 0 H THR A 172 -10.935 7.650 3.013 1.00 0.00 H new ATOM 0 HA THR A 172 -9.144 7.568 5.272 1.00 0.00 H new ATOM 0 HB THR A 172 -11.224 6.074 4.076 1.00 0.00 H new ATOM 0 HG1 THR A 172 -11.132 5.044 6.233 1.00 0.00 H new ATOM 0 HG21 THR A 172 -10.474 3.755 4.488 1.00 0.00 H new ATOM 0 HG22 THR A 172 -9.619 4.536 3.136 1.00 0.00 H new ATOM 0 HG23 THR A 172 -8.814 4.356 4.713 1.00 0.00 H new ATOM 728 N VAL A 173 -8.223 6.155 2.420 1.00 0.00 N ATOM 729 CA VAL A 173 -7.051 5.736 1.674 1.00 0.00 C ATOM 730 C VAL A 173 -6.012 6.844 1.669 1.00 0.00 C ATOM 731 O VAL A 173 -4.819 6.591 1.805 1.00 0.00 O ATOM 732 CB VAL A 173 -7.399 5.351 0.228 1.00 0.00 C ATOM 733 CG1 VAL A 173 -8.453 4.256 0.199 1.00 0.00 C ATOM 734 CG2 VAL A 173 -7.850 6.566 -0.567 1.00 0.00 C ATOM 0 H VAL A 173 -9.109 6.010 1.936 1.00 0.00 H new ATOM 0 HA VAL A 173 -6.648 4.853 2.169 1.00 0.00 H new ATOM 0 HB VAL A 173 -6.497 4.962 -0.244 1.00 0.00 H new ATOM 0 HG11 VAL A 173 -8.683 4.000 -0.835 1.00 0.00 H new ATOM 0 HG12 VAL A 173 -8.075 3.374 0.716 1.00 0.00 H new ATOM 0 HG13 VAL A 173 -9.357 4.608 0.696 1.00 0.00 H new ATOM 0 HG21 VAL A 173 -8.090 6.265 -1.587 1.00 0.00 H new ATOM 0 HG22 VAL A 173 -8.734 6.999 -0.099 1.00 0.00 H new ATOM 0 HG23 VAL A 173 -7.050 7.306 -0.586 1.00 0.00 H new ATOM 744 N GLU A 174 -6.479 8.084 1.550 1.00 0.00 N ATOM 745 CA GLU A 174 -5.579 9.224 1.574 1.00 0.00 C ATOM 746 C GLU A 174 -4.774 9.176 2.861 1.00 0.00 C ATOM 747 O GLU A 174 -3.571 9.438 2.873 1.00 0.00 O ATOM 748 CB GLU A 174 -6.361 10.536 1.481 1.00 0.00 C ATOM 749 CG GLU A 174 -6.197 11.246 0.146 1.00 0.00 C ATOM 750 CD GLU A 174 -5.130 12.322 0.185 1.00 0.00 C ATOM 751 OE1 GLU A 174 -5.080 13.072 1.182 1.00 0.00 O ATOM 752 OE2 GLU A 174 -4.345 12.413 -0.782 1.00 0.00 O ATOM 0 H GLU A 174 -7.465 8.320 1.437 1.00 0.00 H new ATOM 0 HA GLU A 174 -4.909 9.178 0.715 1.00 0.00 H new ATOM 0 HB2 GLU A 174 -7.419 10.332 1.648 1.00 0.00 H new ATOM 0 HB3 GLU A 174 -6.035 11.202 2.280 1.00 0.00 H new ATOM 0 HG2 GLU A 174 -5.942 10.515 -0.621 1.00 0.00 H new ATOM 0 HG3 GLU A 174 -7.148 11.693 -0.143 1.00 0.00 H new ATOM 759 N VAL A 175 -5.455 8.799 3.938 1.00 0.00 N ATOM 760 CA VAL A 175 -4.814 8.669 5.236 1.00 0.00 C ATOM 761 C VAL A 175 -4.043 7.360 5.311 1.00 0.00 C ATOM 762 O VAL A 175 -2.833 7.348 5.525 1.00 0.00 O ATOM 763 CB VAL A 175 -5.834 8.703 6.390 1.00 0.00 C ATOM 764 CG1 VAL A 175 -5.144 9.057 7.701 1.00 0.00 C ATOM 765 CG2 VAL A 175 -6.957 9.682 6.087 1.00 0.00 C ATOM 0 H VAL A 175 -6.451 8.579 3.935 1.00 0.00 H new ATOM 0 HA VAL A 175 -4.138 9.518 5.343 1.00 0.00 H new ATOM 0 HB VAL A 175 -6.272 7.710 6.492 1.00 0.00 H new ATOM 0 HG11 VAL A 175 -5.879 9.077 8.505 1.00 0.00 H new ATOM 0 HG12 VAL A 175 -4.382 8.310 7.924 1.00 0.00 H new ATOM 0 HG13 VAL A 175 -4.676 10.038 7.613 1.00 0.00 H new ATOM 0 HG21 VAL A 175 -7.666 9.690 6.915 1.00 0.00 H new ATOM 0 HG22 VAL A 175 -6.543 10.681 5.954 1.00 0.00 H new ATOM 0 HG23 VAL A 175 -7.469 9.377 5.174 1.00 0.00 H new ATOM 775 N HIS A 176 -4.765 6.260 5.128 1.00 0.00 N ATOM 776 CA HIS A 176 -4.179 4.926 5.170 1.00 0.00 C ATOM 777 C HIS A 176 -2.933 4.835 4.298 1.00 0.00 C ATOM 778 O HIS A 176 -1.927 4.262 4.702 1.00 0.00 O ATOM 779 CB HIS A 176 -5.206 3.889 4.713 1.00 0.00 C ATOM 780 CG HIS A 176 -6.335 3.698 5.677 1.00 0.00 C ATOM 781 ND1 HIS A 176 -6.564 4.540 6.745 1.00 0.00 N ATOM 782 CD2 HIS A 176 -7.305 2.754 5.729 1.00 0.00 C ATOM 783 CE1 HIS A 176 -7.624 4.121 7.413 1.00 0.00 C ATOM 784 NE2 HIS A 176 -8.093 3.041 6.817 1.00 0.00 N ATOM 0 H HIS A 176 -5.769 6.268 4.947 1.00 0.00 H new ATOM 0 HA HIS A 176 -3.886 4.723 6.200 1.00 0.00 H new ATOM 0 HB2 HIS A 176 -5.611 4.192 3.748 1.00 0.00 H new ATOM 0 HB3 HIS A 176 -4.703 2.934 4.562 1.00 0.00 H new ATOM 0 HD2 HIS A 176 -7.435 1.930 5.043 1.00 0.00 H new ATOM 0 HE1 HIS A 176 -8.037 4.584 8.297 1.00 0.00 H new ATOM 0 HE2 HIS A 176 -8.908 2.506 7.116 1.00 0.00 H new ATOM 793 N ARG A 177 -3.013 5.393 3.097 1.00 0.00 N ATOM 794 CA ARG A 177 -1.892 5.363 2.165 1.00 0.00 C ATOM 795 C ARG A 177 -0.674 6.082 2.740 1.00 0.00 C ATOM 796 O ARG A 177 0.339 5.453 3.046 1.00 0.00 O ATOM 797 CB ARG A 177 -2.293 5.994 0.832 1.00 0.00 C ATOM 798 CG ARG A 177 -1.382 5.609 -0.319 1.00 0.00 C ATOM 799 CD ARG A 177 -0.970 6.822 -1.133 1.00 0.00 C ATOM 800 NE ARG A 177 -0.547 7.934 -0.287 1.00 0.00 N ATOM 801 CZ ARG A 177 -0.522 9.200 -0.692 1.00 0.00 C ATOM 802 NH1 ARG A 177 -0.889 9.510 -1.928 1.00 0.00 N ATOM 803 NH2 ARG A 177 -0.129 10.156 0.138 1.00 0.00 N ATOM 0 H ARG A 177 -3.842 5.872 2.745 1.00 0.00 H new ATOM 0 HA ARG A 177 -1.623 4.320 1.999 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -3.314 5.698 0.591 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -2.293 7.079 0.938 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -0.493 5.112 0.070 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -1.892 4.893 -0.964 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -0.156 6.548 -1.804 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -1.805 7.140 -1.757 1.00 0.00 H new ATOM 0 HE ARG A 177 -0.254 7.728 0.668 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -1.191 8.777 -2.569 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -0.869 10.482 -2.237 1.00 0.00 H new ATOM 0 HH21 ARG A 177 0.155 9.921 1.089 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -0.110 11.127 -0.174 1.00 0.00 H new ATOM 817 N ALA A 178 -0.776 7.401 2.884 1.00 0.00 N ATOM 818 CA ALA A 178 0.324 8.197 3.422 1.00 0.00 C ATOM 819 C ALA A 178 0.880 7.573 4.698 1.00 0.00 C ATOM 820 O ALA A 178 2.075 7.668 4.983 1.00 0.00 O ATOM 821 CB ALA A 178 -0.138 9.622 3.687 1.00 0.00 C ATOM 0 H ALA A 178 -1.606 7.940 2.637 1.00 0.00 H new ATOM 0 HA ALA A 178 1.123 8.217 2.681 1.00 0.00 H new ATOM 0 HB1 ALA A 178 0.691 10.205 4.088 1.00 0.00 H new ATOM 0 HB2 ALA A 178 -0.481 10.072 2.756 1.00 0.00 H new ATOM 0 HB3 ALA A 178 -0.956 9.611 4.408 1.00 0.00 H new ATOM 827 N ASN A 179 0.005 6.920 5.452 1.00 0.00 N ATOM 828 CA ASN A 179 0.396 6.260 6.691 1.00 0.00 C ATOM 829 C ASN A 179 1.055 4.935 6.376 1.00 0.00 C ATOM 830 O ASN A 179 2.056 4.549 6.980 1.00 0.00 O ATOM 831 CB ASN A 179 -0.832 6.004 7.563 1.00 0.00 C ATOM 832 CG ASN A 179 -0.723 6.638 8.934 1.00 0.00 C ATOM 833 OD1 ASN A 179 0.219 6.374 9.682 1.00 0.00 O ATOM 834 ND2 ASN A 179 -1.693 7.484 9.271 1.00 0.00 N ATOM 0 H ASN A 179 -0.986 6.833 5.225 1.00 0.00 H new ATOM 0 HA ASN A 179 1.093 6.906 7.225 1.00 0.00 H new ATOM 0 HB2 ASN A 179 -1.717 6.391 7.058 1.00 0.00 H new ATOM 0 HB3 ASN A 179 -0.974 4.929 7.675 1.00 0.00 H new ATOM 0 HD21 ASN A 179 -1.675 7.944 10.181 1.00 0.00 H new ATOM 0 HD22 ASN A 179 -2.454 7.673 8.619 1.00 0.00 H new ATOM 841 N VAL A 180 0.463 4.245 5.419 1.00 0.00 N ATOM 842 CA VAL A 180 0.929 2.966 4.982 1.00 0.00 C ATOM 843 C VAL A 180 2.368 3.066 4.482 1.00 0.00 C ATOM 844 O VAL A 180 3.281 2.509 5.086 1.00 0.00 O ATOM 845 CB VAL A 180 -0.042 2.455 3.896 1.00 0.00 C ATOM 846 CG1 VAL A 180 0.646 1.611 2.853 1.00 0.00 C ATOM 847 CG2 VAL A 180 -1.184 1.696 4.545 1.00 0.00 C ATOM 0 H VAL A 180 -0.366 4.572 4.924 1.00 0.00 H new ATOM 0 HA VAL A 180 0.943 2.252 5.805 1.00 0.00 H new ATOM 0 HB VAL A 180 -0.439 3.325 3.372 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -0.084 1.279 2.115 1.00 0.00 H new ATOM 0 HG12 VAL A 180 1.419 2.201 2.360 1.00 0.00 H new ATOM 0 HG13 VAL A 180 1.101 0.743 3.330 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -1.867 1.337 3.775 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -0.787 0.847 5.102 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -1.720 2.357 5.226 1.00 0.00 H new ATOM 857 N MET A 181 2.565 3.784 3.386 1.00 0.00 N ATOM 858 CA MET A 181 3.898 3.954 2.832 1.00 0.00 C ATOM 859 C MET A 181 4.840 4.527 3.884 1.00 0.00 C ATOM 860 O MET A 181 6.048 4.291 3.847 1.00 0.00 O ATOM 861 CB MET A 181 3.857 4.867 1.609 1.00 0.00 C ATOM 862 CG MET A 181 2.905 6.040 1.758 1.00 0.00 C ATOM 863 SD MET A 181 3.686 7.613 1.357 1.00 0.00 S ATOM 864 CE MET A 181 4.580 7.172 -0.133 1.00 0.00 C ATOM 0 H MET A 181 1.824 4.255 2.867 1.00 0.00 H new ATOM 0 HA MET A 181 4.270 2.977 2.524 1.00 0.00 H new ATOM 0 HB2 MET A 181 4.860 5.246 1.415 1.00 0.00 H new ATOM 0 HB3 MET A 181 3.564 4.281 0.738 1.00 0.00 H new ATOM 0 HG2 MET A 181 2.043 5.889 1.108 1.00 0.00 H new ATOM 0 HG3 MET A 181 2.531 6.073 2.781 1.00 0.00 H new ATOM 0 HE1 MET A 181 4.832 8.076 -0.687 1.00 0.00 H new ATOM 0 HE2 MET A 181 5.495 6.643 0.135 1.00 0.00 H new ATOM 0 HE3 MET A 181 3.957 6.528 -0.754 1.00 0.00 H new ATOM 874 N ALA A 182 4.277 5.278 4.824 1.00 0.00 N ATOM 875 CA ALA A 182 5.064 5.882 5.893 1.00 0.00 C ATOM 876 C ALA A 182 5.501 4.835 6.915 1.00 0.00 C ATOM 877 O ALA A 182 6.604 4.904 7.456 1.00 0.00 O ATOM 878 CB ALA A 182 4.270 6.988 6.571 1.00 0.00 C ATOM 0 H ALA A 182 3.279 5.483 4.868 1.00 0.00 H new ATOM 0 HA ALA A 182 5.962 6.313 5.451 1.00 0.00 H new ATOM 0 HB1 ALA A 182 4.869 7.430 7.367 1.00 0.00 H new ATOM 0 HB2 ALA A 182 4.016 7.755 5.839 1.00 0.00 H new ATOM 0 HB3 ALA A 182 3.355 6.573 6.994 1.00 0.00 H new ATOM 884 N LYS A 183 4.629 3.862 7.174 1.00 0.00 N ATOM 885 CA LYS A 183 4.928 2.799 8.130 1.00 0.00 C ATOM 886 C LYS A 183 5.639 1.637 7.444 1.00 0.00 C ATOM 887 O LYS A 183 6.513 0.997 8.029 1.00 0.00 O ATOM 888 CB LYS A 183 3.643 2.301 8.793 1.00 0.00 C ATOM 889 CG LYS A 183 2.785 3.411 9.373 1.00 0.00 C ATOM 890 CD LYS A 183 1.306 3.153 9.135 1.00 0.00 C ATOM 891 CE LYS A 183 0.791 2.018 10.005 1.00 0.00 C ATOM 892 NZ LYS A 183 -0.595 2.272 10.488 1.00 0.00 N ATOM 0 H LYS A 183 3.711 3.788 6.735 1.00 0.00 H new ATOM 0 HA LYS A 183 5.588 3.209 8.895 1.00 0.00 H new ATOM 0 HB2 LYS A 183 3.057 1.747 8.059 1.00 0.00 H new ATOM 0 HB3 LYS A 183 3.902 1.602 9.588 1.00 0.00 H new ATOM 0 HG2 LYS A 183 2.973 3.496 10.443 1.00 0.00 H new ATOM 0 HG3 LYS A 183 3.067 4.363 8.923 1.00 0.00 H new ATOM 0 HD2 LYS A 183 0.739 4.060 9.345 1.00 0.00 H new ATOM 0 HD3 LYS A 183 1.142 2.911 8.085 1.00 0.00 H new ATOM 0 HE2 LYS A 183 0.813 1.087 9.438 1.00 0.00 H new ATOM 0 HE3 LYS A 183 1.455 1.886 10.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 -0.909 1.475 11.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 -0.612 3.146 11.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 -1.234 2.373 9.673 1.00 0.00 H new ATOM 906 N MET A 184 5.259 1.376 6.198 1.00 0.00 N ATOM 907 CA MET A 184 5.857 0.298 5.420 1.00 0.00 C ATOM 908 C MET A 184 7.328 0.576 5.117 1.00 0.00 C ATOM 909 O MET A 184 8.045 -0.303 4.639 1.00 0.00 O ATOM 910 CB MET A 184 5.089 0.104 4.111 1.00 0.00 C ATOM 911 CG MET A 184 4.722 -1.343 3.829 1.00 0.00 C ATOM 912 SD MET A 184 4.097 -1.591 2.157 1.00 0.00 S ATOM 913 CE MET A 184 5.612 -1.482 1.209 1.00 0.00 C ATOM 0 H MET A 184 4.536 1.899 5.704 1.00 0.00 H new ATOM 0 HA MET A 184 5.799 -0.613 6.016 1.00 0.00 H new ATOM 0 HB2 MET A 184 4.178 0.702 4.142 1.00 0.00 H new ATOM 0 HB3 MET A 184 5.692 0.484 3.286 1.00 0.00 H new ATOM 0 HG2 MET A 184 5.599 -1.972 3.981 1.00 0.00 H new ATOM 0 HG3 MET A 184 3.968 -1.668 4.546 1.00 0.00 H new ATOM 0 HE1 MET A 184 5.392 -1.634 0.152 1.00 0.00 H new ATOM 0 HE2 MET A 184 6.059 -0.498 1.349 1.00 0.00 H new ATOM 0 HE3 MET A 184 6.309 -2.248 1.548 1.00 0.00 H new ATOM 923 N LYS A 185 7.774 1.805 5.387 1.00 0.00 N ATOM 924 CA LYS A 185 9.155 2.206 5.137 1.00 0.00 C ATOM 925 C LYS A 185 9.362 2.554 3.667 1.00 0.00 C ATOM 926 O LYS A 185 10.494 2.600 3.186 1.00 0.00 O ATOM 927 CB LYS A 185 10.140 1.108 5.559 1.00 0.00 C ATOM 928 CG LYS A 185 9.843 0.512 6.926 1.00 0.00 C ATOM 929 CD LYS A 185 9.812 1.581 8.006 1.00 0.00 C ATOM 930 CE LYS A 185 11.208 1.898 8.517 1.00 0.00 C ATOM 931 NZ LYS A 185 11.202 3.025 9.489 1.00 0.00 N ATOM 0 H LYS A 185 7.191 2.543 5.782 1.00 0.00 H new ATOM 0 HA LYS A 185 9.351 3.093 5.740 1.00 0.00 H new ATOM 0 HB2 LYS A 185 10.124 0.312 4.814 1.00 0.00 H new ATOM 0 HB3 LYS A 185 11.149 1.520 5.564 1.00 0.00 H new ATOM 0 HG2 LYS A 185 8.884 -0.006 6.898 1.00 0.00 H new ATOM 0 HG3 LYS A 185 10.600 -0.233 7.172 1.00 0.00 H new ATOM 0 HD2 LYS A 185 9.354 2.487 7.609 1.00 0.00 H new ATOM 0 HD3 LYS A 185 9.188 1.245 8.834 1.00 0.00 H new ATOM 0 HE2 LYS A 185 11.631 1.012 8.991 1.00 0.00 H new ATOM 0 HE3 LYS A 185 11.854 2.148 7.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 12.173 3.209 9.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 10.823 3.878 9.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 10.606 2.777 10.304 1.00 0.00 H new ATOM 945 N ALA A 186 8.265 2.803 2.953 1.00 0.00 N ATOM 946 CA ALA A 186 8.345 3.151 1.543 1.00 0.00 C ATOM 947 C ALA A 186 8.733 4.611 1.367 1.00 0.00 C ATOM 948 O ALA A 186 9.249 5.245 2.287 1.00 0.00 O ATOM 949 CB ALA A 186 7.020 2.872 0.852 1.00 0.00 C ATOM 0 H ALA A 186 7.317 2.769 3.329 1.00 0.00 H new ATOM 0 HA ALA A 186 9.117 2.533 1.084 1.00 0.00 H new ATOM 0 HB1 ALA A 186 7.096 3.138 -0.202 1.00 0.00 H new ATOM 0 HB2 ALA A 186 6.778 1.813 0.943 1.00 0.00 H new ATOM 0 HB3 ALA A 186 6.234 3.465 1.320 1.00 0.00 H new ATOM 955 N LYS A 187 8.477 5.140 0.179 1.00 0.00 N ATOM 956 CA LYS A 187 8.791 6.526 -0.125 1.00 0.00 C ATOM 957 C LYS A 187 7.657 7.161 -0.923 1.00 0.00 C ATOM 958 O LYS A 187 7.118 8.199 -0.539 1.00 0.00 O ATOM 959 CB LYS A 187 10.106 6.607 -0.907 1.00 0.00 C ATOM 960 CG LYS A 187 10.357 7.960 -1.558 1.00 0.00 C ATOM 961 CD LYS A 187 11.664 8.573 -1.084 1.00 0.00 C ATOM 962 CE LYS A 187 12.172 9.624 -2.058 1.00 0.00 C ATOM 963 NZ LYS A 187 13.660 9.686 -2.082 1.00 0.00 N ATOM 0 H LYS A 187 8.051 4.626 -0.592 1.00 0.00 H new ATOM 0 HA LYS A 187 8.906 7.075 0.810 1.00 0.00 H new ATOM 0 HB2 LYS A 187 10.932 6.381 -0.233 1.00 0.00 H new ATOM 0 HB3 LYS A 187 10.105 5.838 -1.680 1.00 0.00 H new ATOM 0 HG2 LYS A 187 10.380 7.845 -2.642 1.00 0.00 H new ATOM 0 HG3 LYS A 187 9.533 8.635 -1.327 1.00 0.00 H new ATOM 0 HD2 LYS A 187 11.520 9.024 -0.102 1.00 0.00 H new ATOM 0 HD3 LYS A 187 12.413 7.790 -0.968 1.00 0.00 H new ATOM 0 HE2 LYS A 187 11.802 9.401 -3.059 1.00 0.00 H new ATOM 0 HE3 LYS A 187 11.772 10.599 -1.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 187 13.966 10.414 -2.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 187 14.013 9.924 -1.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 187 14.041 8.763 -2.372 1.00 0.00 H new ATOM 977 N SER A 188 7.303 6.527 -2.033 1.00 0.00 N ATOM 978 CA SER A 188 6.234 7.025 -2.886 1.00 0.00 C ATOM 979 C SER A 188 5.248 5.916 -3.219 1.00 0.00 C ATOM 980 O SER A 188 5.466 4.754 -2.877 1.00 0.00 O ATOM 981 CB SER A 188 6.812 7.621 -4.172 1.00 0.00 C ATOM 982 OG SER A 188 7.582 6.664 -4.877 1.00 0.00 O ATOM 0 H SER A 188 7.741 5.667 -2.363 1.00 0.00 H new ATOM 0 HA SER A 188 5.702 7.807 -2.344 1.00 0.00 H new ATOM 0 HB2 SER A 188 6.001 7.979 -4.807 1.00 0.00 H new ATOM 0 HB3 SER A 188 7.432 8.484 -3.930 1.00 0.00 H new ATOM 0 HG SER A 188 7.938 7.069 -5.695 1.00 0.00 H new ATOM 988 N LEU A 189 4.161 6.281 -3.889 1.00 0.00 N ATOM 989 CA LEU A 189 3.145 5.309 -4.265 1.00 0.00 C ATOM 990 C LEU A 189 3.744 4.220 -5.146 1.00 0.00 C ATOM 991 O LEU A 189 3.524 3.033 -4.910 1.00 0.00 O ATOM 992 CB LEU A 189 1.975 5.995 -4.980 1.00 0.00 C ATOM 993 CG LEU A 189 0.628 5.270 -4.880 1.00 0.00 C ATOM 994 CD1 LEU A 189 0.401 4.745 -3.471 1.00 0.00 C ATOM 995 CD2 LEU A 189 -0.505 6.197 -5.293 1.00 0.00 C ATOM 0 H LEU A 189 3.962 7.238 -4.181 1.00 0.00 H new ATOM 0 HA LEU A 189 2.765 4.845 -3.355 1.00 0.00 H new ATOM 0 HB2 LEU A 189 1.860 6.999 -4.571 1.00 0.00 H new ATOM 0 HB3 LEU A 189 2.231 6.107 -6.034 1.00 0.00 H new ATOM 0 HG LEU A 189 0.646 4.419 -5.561 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -0.561 4.234 -3.424 1.00 0.00 H new ATOM 0 HD12 LEU A 189 1.196 4.046 -3.211 1.00 0.00 H new ATOM 0 HD13 LEU A 189 0.405 5.578 -2.767 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -1.455 5.667 -5.217 1.00 0.00 H new ATOM 0 HD22 LEU A 189 -0.521 7.067 -4.637 1.00 0.00 H new ATOM 0 HD23 LEU A 189 -0.353 6.522 -6.322 1.00 0.00 H new ATOM 1007 N PRO A 190 4.523 4.606 -6.171 1.00 0.00 N ATOM 1008 CA PRO A 190 5.159 3.643 -7.071 1.00 0.00 C ATOM 1009 C PRO A 190 6.108 2.718 -6.319 1.00 0.00 C ATOM 1010 O PRO A 190 6.149 1.515 -6.569 1.00 0.00 O ATOM 1011 CB PRO A 190 5.939 4.522 -8.053 1.00 0.00 C ATOM 1012 CG PRO A 190 5.307 5.866 -7.954 1.00 0.00 C ATOM 1013 CD PRO A 190 4.857 5.995 -6.530 1.00 0.00 C ATOM 0 HA PRO A 190 4.433 2.992 -7.558 1.00 0.00 H new ATOM 0 HB2 PRO A 190 6.996 4.563 -7.792 1.00 0.00 H new ATOM 0 HB3 PRO A 190 5.877 4.130 -9.068 1.00 0.00 H new ATOM 0 HG2 PRO A 190 6.015 6.653 -8.214 1.00 0.00 H new ATOM 0 HG3 PRO A 190 4.465 5.955 -8.641 1.00 0.00 H new ATOM 0 HD2 PRO A 190 5.642 6.401 -5.892 1.00 0.00 H new ATOM 0 HD3 PRO A 190 3.996 6.656 -6.435 1.00 0.00 H new ATOM 1021 N HIS A 191 6.867 3.293 -5.388 1.00 0.00 N ATOM 1022 CA HIS A 191 7.811 2.521 -4.590 1.00 0.00 C ATOM 1023 C HIS A 191 7.094 1.377 -3.887 1.00 0.00 C ATOM 1024 O HIS A 191 7.542 0.231 -3.925 1.00 0.00 O ATOM 1025 CB HIS A 191 8.497 3.421 -3.561 1.00 0.00 C ATOM 1026 CG HIS A 191 9.950 3.114 -3.370 1.00 0.00 C ATOM 1027 ND1 HIS A 191 10.649 3.460 -2.233 1.00 0.00 N ATOM 1028 CD2 HIS A 191 10.838 2.490 -4.179 1.00 0.00 C ATOM 1029 CE1 HIS A 191 11.904 3.063 -2.351 1.00 0.00 C ATOM 1030 NE2 HIS A 191 12.044 2.471 -3.523 1.00 0.00 N ATOM 0 H HIS A 191 6.845 4.289 -5.170 1.00 0.00 H new ATOM 0 HA HIS A 191 8.569 2.106 -5.254 1.00 0.00 H new ATOM 0 HB2 HIS A 191 8.392 4.460 -3.872 1.00 0.00 H new ATOM 0 HB3 HIS A 191 7.984 3.321 -2.604 1.00 0.00 H new ATOM 0 HD2 HIS A 191 10.635 2.083 -5.159 1.00 0.00 H new ATOM 0 HE1 HIS A 191 12.682 3.199 -1.615 1.00 0.00 H new ATOM 0 HE2 HIS A 191 12.908 2.065 -3.883 1.00 0.00 H new ATOM 1039 N LEU A 192 5.970 1.695 -3.253 1.00 0.00 N ATOM 1040 CA LEU A 192 5.178 0.694 -2.549 1.00 0.00 C ATOM 1041 C LEU A 192 4.903 -0.495 -3.447 1.00 0.00 C ATOM 1042 O LEU A 192 5.529 -1.548 -3.325 1.00 0.00 O ATOM 1043 CB LEU A 192 3.846 1.294 -2.106 1.00 0.00 C ATOM 1044 CG LEU A 192 3.879 2.031 -0.778 1.00 0.00 C ATOM 1045 CD1 LEU A 192 2.470 2.411 -0.353 1.00 0.00 C ATOM 1046 CD2 LEU A 192 4.544 1.171 0.280 1.00 0.00 C ATOM 0 H LEU A 192 5.587 2.640 -3.213 1.00 0.00 H new ATOM 0 HA LEU A 192 5.745 0.367 -1.677 1.00 0.00 H new ATOM 0 HB2 LEU A 192 3.502 1.983 -2.877 1.00 0.00 H new ATOM 0 HB3 LEU A 192 3.109 0.494 -2.041 1.00 0.00 H new ATOM 0 HG LEU A 192 4.461 2.945 -0.895 1.00 0.00 H new ATOM 0 HD11 LEU A 192 2.507 2.939 0.600 1.00 0.00 H new ATOM 0 HD12 LEU A 192 2.024 3.058 -1.109 1.00 0.00 H new ATOM 0 HD13 LEU A 192 1.867 1.509 -0.245 1.00 0.00 H new ATOM 0 HD21 LEU A 192 4.562 1.709 1.228 1.00 0.00 H new ATOM 0 HD22 LEU A 192 3.984 0.244 0.400 1.00 0.00 H new ATOM 0 HD23 LEU A 192 5.565 0.941 -0.026 1.00 0.00 H new ATOM 1058 N VAL A 193 3.960 -0.305 -4.361 1.00 0.00 N ATOM 1059 CA VAL A 193 3.580 -1.343 -5.312 1.00 0.00 C ATOM 1060 C VAL A 193 4.820 -2.042 -5.863 1.00 0.00 C ATOM 1061 O VAL A 193 4.827 -3.257 -6.052 1.00 0.00 O ATOM 1062 CB VAL A 193 2.722 -0.762 -6.467 1.00 0.00 C ATOM 1063 CG1 VAL A 193 3.160 0.650 -6.793 1.00 0.00 C ATOM 1064 CG2 VAL A 193 2.764 -1.646 -7.710 1.00 0.00 C ATOM 0 H VAL A 193 3.440 0.566 -4.464 1.00 0.00 H new ATOM 0 HA VAL A 193 2.972 -2.077 -4.783 1.00 0.00 H new ATOM 0 HB VAL A 193 1.687 -0.737 -6.127 1.00 0.00 H new ATOM 0 HG11 VAL A 193 2.548 1.042 -7.605 1.00 0.00 H new ATOM 0 HG12 VAL A 193 3.041 1.280 -5.912 1.00 0.00 H new ATOM 0 HG13 VAL A 193 4.207 0.645 -7.097 1.00 0.00 H new ATOM 0 HG21 VAL A 193 2.150 -1.202 -8.493 1.00 0.00 H new ATOM 0 HG22 VAL A 193 3.793 -1.732 -8.060 1.00 0.00 H new ATOM 0 HG23 VAL A 193 2.380 -2.636 -7.465 1.00 0.00 H new ATOM 1074 N ARG A 194 5.873 -1.273 -6.095 1.00 0.00 N ATOM 1075 CA ARG A 194 7.112 -1.847 -6.598 1.00 0.00 C ATOM 1076 C ARG A 194 7.620 -2.872 -5.601 1.00 0.00 C ATOM 1077 O ARG A 194 7.882 -4.022 -5.954 1.00 0.00 O ATOM 1078 CB ARG A 194 8.162 -0.762 -6.841 1.00 0.00 C ATOM 1079 CG ARG A 194 7.869 0.109 -8.051 1.00 0.00 C ATOM 1080 CD ARG A 194 8.721 -0.290 -9.245 1.00 0.00 C ATOM 1081 NE ARG A 194 9.378 0.860 -9.858 1.00 0.00 N ATOM 1082 CZ ARG A 194 10.448 1.458 -9.343 1.00 0.00 C ATOM 1083 NH1 ARG A 194 10.977 1.014 -8.211 1.00 0.00 N ATOM 1084 NH2 ARG A 194 10.989 2.499 -9.960 1.00 0.00 N ATOM 0 H ARG A 194 5.896 -0.264 -5.946 1.00 0.00 H new ATOM 0 HA ARG A 194 6.919 -2.333 -7.555 1.00 0.00 H new ATOM 0 HB2 ARG A 194 8.230 -0.129 -5.956 1.00 0.00 H new ATOM 0 HB3 ARG A 194 9.136 -1.234 -6.971 1.00 0.00 H new ATOM 0 HG2 ARG A 194 6.814 0.027 -8.312 1.00 0.00 H new ATOM 0 HG3 ARG A 194 8.056 1.154 -7.802 1.00 0.00 H new ATOM 0 HD2 ARG A 194 9.474 -1.011 -8.928 1.00 0.00 H new ATOM 0 HD3 ARG A 194 8.096 -0.788 -9.986 1.00 0.00 H new ATOM 0 HE ARG A 194 8.995 1.225 -10.730 1.00 0.00 H new ATOM 0 HH11 ARG A 194 10.563 0.213 -7.734 1.00 0.00 H new ATOM 0 HH12 ARG A 194 11.798 1.474 -7.817 1.00 0.00 H new ATOM 0 HH21 ARG A 194 10.584 2.842 -10.831 1.00 0.00 H new ATOM 0 HH22 ARG A 194 11.810 2.957 -9.564 1.00 0.00 H new ATOM 1098 N MET A 195 7.707 -2.461 -4.342 1.00 0.00 N ATOM 1099 CA MET A 195 8.125 -3.365 -3.287 1.00 0.00 C ATOM 1100 C MET A 195 7.083 -4.470 -3.143 1.00 0.00 C ATOM 1101 O MET A 195 7.380 -5.566 -2.665 1.00 0.00 O ATOM 1102 CB MET A 195 8.283 -2.614 -1.964 1.00 0.00 C ATOM 1103 CG MET A 195 8.885 -1.231 -2.116 1.00 0.00 C ATOM 1104 SD MET A 195 10.385 -1.024 -1.148 1.00 0.00 S ATOM 1105 CE MET A 195 9.866 0.319 -0.098 1.00 0.00 C ATOM 0 H MET A 195 7.494 -1.513 -4.031 1.00 0.00 H new ATOM 0 HA MET A 195 9.091 -3.799 -3.545 1.00 0.00 H new ATOM 0 HB2 MET A 195 7.306 -2.525 -1.488 1.00 0.00 H new ATOM 0 HB3 MET A 195 8.911 -3.202 -1.295 1.00 0.00 H new ATOM 0 HG2 MET A 195 9.107 -1.048 -3.167 1.00 0.00 H new ATOM 0 HG3 MET A 195 8.153 -0.484 -1.810 1.00 0.00 H new ATOM 0 HE1 MET A 195 10.443 0.302 0.827 1.00 0.00 H new ATOM 0 HE2 MET A 195 10.031 1.267 -0.611 1.00 0.00 H new ATOM 0 HE3 MET A 195 8.806 0.211 0.134 1.00 0.00 H new ATOM 1115 N ALA A 196 5.857 -4.170 -3.583 1.00 0.00 N ATOM 1116 CA ALA A 196 4.767 -5.126 -3.532 1.00 0.00 C ATOM 1117 C ALA A 196 5.050 -6.279 -4.482 1.00 0.00 C ATOM 1118 O ALA A 196 4.998 -7.441 -4.094 1.00 0.00 O ATOM 1119 CB ALA A 196 3.449 -4.445 -3.883 1.00 0.00 C ATOM 0 H ALA A 196 5.602 -3.265 -3.979 1.00 0.00 H new ATOM 0 HA ALA A 196 4.684 -5.521 -2.520 1.00 0.00 H new ATOM 0 HB1 ALA A 196 2.640 -5.174 -3.841 1.00 0.00 H new ATOM 0 HB2 ALA A 196 3.253 -3.644 -3.171 1.00 0.00 H new ATOM 0 HB3 ALA A 196 3.511 -4.030 -4.889 1.00 0.00 H new ATOM 1125 N LEU A 197 5.382 -5.945 -5.726 1.00 0.00 N ATOM 1126 CA LEU A 197 5.707 -6.969 -6.719 1.00 0.00 C ATOM 1127 C LEU A 197 7.004 -7.640 -6.328 1.00 0.00 C ATOM 1128 O LEU A 197 7.085 -8.864 -6.230 1.00 0.00 O ATOM 1129 CB LEU A 197 5.840 -6.403 -8.139 1.00 0.00 C ATOM 1130 CG LEU A 197 5.407 -4.963 -8.318 1.00 0.00 C ATOM 1131 CD1 LEU A 197 5.720 -4.485 -9.726 1.00 0.00 C ATOM 1132 CD2 LEU A 197 3.925 -4.824 -8.017 1.00 0.00 C ATOM 0 H LEU A 197 5.433 -4.986 -6.069 1.00 0.00 H new ATOM 0 HA LEU A 197 4.883 -7.682 -6.733 1.00 0.00 H new ATOM 0 HB2 LEU A 197 6.881 -6.491 -8.449 1.00 0.00 H new ATOM 0 HB3 LEU A 197 5.253 -7.026 -8.814 1.00 0.00 H new ATOM 0 HG LEU A 197 5.962 -4.338 -7.618 1.00 0.00 H new ATOM 0 HD11 LEU A 197 5.402 -3.448 -9.837 1.00 0.00 H new ATOM 0 HD12 LEU A 197 6.793 -4.557 -9.905 1.00 0.00 H new ATOM 0 HD13 LEU A 197 5.190 -5.106 -10.448 1.00 0.00 H new ATOM 0 HD21 LEU A 197 3.623 -3.785 -8.148 1.00 0.00 H new ATOM 0 HD22 LEU A 197 3.355 -5.457 -8.697 1.00 0.00 H new ATOM 0 HD23 LEU A 197 3.732 -5.131 -6.989 1.00 0.00 H new ATOM 1144 N ALA A 198 8.019 -6.817 -6.082 1.00 0.00 N ATOM 1145 CA ALA A 198 9.316 -7.319 -5.674 1.00 0.00 C ATOM 1146 C ALA A 198 9.151 -8.281 -4.504 1.00 0.00 C ATOM 1147 O ALA A 198 9.956 -9.191 -4.306 1.00 0.00 O ATOM 1148 CB ALA A 198 10.238 -6.168 -5.297 1.00 0.00 C ATOM 0 H ALA A 198 7.963 -5.801 -6.159 1.00 0.00 H new ATOM 0 HA ALA A 198 9.768 -7.855 -6.509 1.00 0.00 H new ATOM 0 HB1 ALA A 198 11.207 -6.563 -4.993 1.00 0.00 H new ATOM 0 HB2 ALA A 198 10.367 -5.509 -6.156 1.00 0.00 H new ATOM 0 HB3 ALA A 198 9.800 -5.606 -4.472 1.00 0.00 H new ATOM 1154 N GLY A 199 8.079 -8.069 -3.742 1.00 0.00 N ATOM 1155 CA GLY A 199 7.787 -8.916 -2.603 1.00 0.00 C ATOM 1156 C GLY A 199 6.695 -9.926 -2.908 1.00 0.00 C ATOM 1157 O GLY A 199 5.975 -10.362 -2.011 1.00 0.00 O ATOM 0 H GLY A 199 7.405 -7.319 -3.898 1.00 0.00 H new ATOM 0 HA2 GLY A 199 8.693 -9.442 -2.301 1.00 0.00 H new ATOM 0 HA3 GLY A 199 7.482 -8.296 -1.760 1.00 0.00 H new ATOM 1161 N GLY A 200 6.561 -10.287 -4.185 1.00 0.00 N ATOM 1162 CA GLY A 200 5.535 -11.237 -4.591 1.00 0.00 C ATOM 1163 C GLY A 200 4.193 -10.940 -3.954 1.00 0.00 C ATOM 1164 O GLY A 200 3.370 -11.833 -3.755 1.00 0.00 O ATOM 0 H GLY A 200 7.145 -9.938 -4.945 1.00 0.00 H new ATOM 0 HA2 GLY A 200 5.432 -11.216 -5.676 1.00 0.00 H new ATOM 0 HA3 GLY A 200 5.848 -12.245 -4.320 1.00 0.00 H new ATOM 1168 N PHE A 201 3.986 -9.669 -3.639 1.00 0.00 N ATOM 1169 CA PHE A 201 2.750 -9.208 -3.021 1.00 0.00 C ATOM 1170 C PHE A 201 1.693 -8.885 -4.075 1.00 0.00 C ATOM 1171 O PHE A 201 0.503 -8.802 -3.770 1.00 0.00 O ATOM 1172 CB PHE A 201 3.028 -7.969 -2.167 1.00 0.00 C ATOM 1173 CG PHE A 201 2.091 -7.810 -1.008 1.00 0.00 C ATOM 1174 CD1 PHE A 201 2.173 -8.667 0.096 1.00 0.00 C ATOM 1175 CD2 PHE A 201 1.118 -6.800 -1.012 1.00 0.00 C ATOM 1176 CE1 PHE A 201 1.301 -8.521 1.179 1.00 0.00 C ATOM 1177 CE2 PHE A 201 0.244 -6.648 0.067 1.00 0.00 C ATOM 1178 CZ PHE A 201 0.336 -7.509 1.164 1.00 0.00 C ATOM 0 H PHE A 201 4.669 -8.929 -3.804 1.00 0.00 H new ATOM 0 HA PHE A 201 2.366 -10.009 -2.389 1.00 0.00 H new ATOM 0 HB2 PHE A 201 4.050 -8.020 -1.791 1.00 0.00 H new ATOM 0 HB3 PHE A 201 2.964 -7.083 -2.798 1.00 0.00 H new ATOM 0 HD1 PHE A 201 2.918 -9.449 0.111 1.00 0.00 H new ATOM 0 HD2 PHE A 201 1.044 -6.133 -1.858 1.00 0.00 H new ATOM 0 HE1 PHE A 201 1.372 -9.188 2.025 1.00 0.00 H new ATOM 0 HE2 PHE A 201 -0.501 -5.867 0.054 1.00 0.00 H new ATOM 0 HZ PHE A 201 -0.338 -7.393 2.000 1.00 0.00 H new ATOM 1188 N GLY A 202 2.138 -8.699 -5.310 1.00 0.00 N ATOM 1189 CA GLY A 202 1.225 -8.382 -6.393 1.00 0.00 C ATOM 1190 C GLY A 202 0.028 -9.313 -6.439 1.00 0.00 C ATOM 1191 O GLY A 202 0.117 -10.462 -6.009 1.00 0.00 O ATOM 0 H GLY A 202 3.119 -8.762 -5.583 1.00 0.00 H new ATOM 0 HA2 GLY A 202 0.878 -7.355 -6.281 1.00 0.00 H new ATOM 0 HA3 GLY A 202 1.759 -8.436 -7.341 1.00 0.00 H new ATOM 1195 N PRO A 203 -1.116 -8.839 -6.960 1.00 0.00 N ATOM 1196 CA PRO A 203 -2.335 -9.647 -7.057 1.00 0.00 C ATOM 1197 C PRO A 203 -2.090 -10.983 -7.749 1.00 0.00 C ATOM 1198 O PRO A 203 -0.946 -11.364 -7.998 1.00 0.00 O ATOM 1199 CB PRO A 203 -3.275 -8.777 -7.894 1.00 0.00 C ATOM 1200 CG PRO A 203 -2.799 -7.383 -7.674 1.00 0.00 C ATOM 1201 CD PRO A 203 -1.308 -7.477 -7.494 1.00 0.00 C ATOM 0 HA PRO A 203 -2.732 -9.903 -6.075 1.00 0.00 H new ATOM 0 HB2 PRO A 203 -3.231 -9.048 -8.949 1.00 0.00 H new ATOM 0 HB3 PRO A 203 -4.311 -8.896 -7.577 1.00 0.00 H new ATOM 0 HG2 PRO A 203 -3.050 -6.747 -8.523 1.00 0.00 H new ATOM 0 HG3 PRO A 203 -3.271 -6.944 -6.795 1.00 0.00 H new ATOM 0 HD2 PRO A 203 -0.779 -7.336 -8.437 1.00 0.00 H new ATOM 0 HD3 PRO A 203 -0.937 -6.719 -6.804 1.00 0.00 H new ATOM 1209 N SER A 204 -3.171 -11.691 -8.058 1.00 0.00 N ATOM 1210 CA SER A 204 -3.073 -12.986 -8.723 1.00 0.00 C ATOM 1211 C SER A 204 -2.718 -12.814 -10.196 1.00 0.00 C ATOM 1212 O SER A 204 -1.568 -13.129 -10.568 1.00 0.00 O ATOM 1213 CB SER A 204 -4.389 -13.753 -8.588 1.00 0.00 C ATOM 1214 OG SER A 204 -4.351 -14.644 -7.486 1.00 0.00 O ATOM 1215 OXT SER A 204 -3.595 -12.369 -10.967 1.00 0.00 O ATOM 0 H SER A 204 -4.125 -11.390 -7.859 1.00 0.00 H new ATOM 0 HA SER A 204 -2.279 -13.556 -8.241 1.00 0.00 H new ATOM 0 HB2 SER A 204 -5.212 -13.049 -8.462 1.00 0.00 H new ATOM 0 HB3 SER A 204 -4.584 -14.311 -9.504 1.00 0.00 H new ATOM 0 HG SER A 204 -5.205 -15.121 -7.421 1.00 0.00 H new TER 1221 SER A 204