USER MOD reduce.3.24.130724 H: found=0, std=0, add=432, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 424 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 179 CYS SG : rot -170:sc= -0.175 USER MOD Set 1.2: A 182 CYS SG : rot 180:sc= 0 USER MOD Set 1.3: A 186 HIS : no HE2:sc= -0.129 K(o=-0.3,f=-3!) USER MOD Set 2.1: A 138 CYS SG : rot -97:sc= -3.36! USER MOD Set 2.2: A 143 CYS SG : rot 180:sc= 0 USER MOD Set 2.3: A 160 CYS SG : rot 180:sc= -0.0268 USER MOD Set 2.4: A 163 CYS SG : rot 145:sc= -0.693 USER MOD Single : A 139 GLN : amide:sc= -1.53 K(o=-1.5,f=-2.4) USER MOD Single : A 148 SER OG : rot -99:sc= 0.416 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 HIS : no HD1:sc= -3.29! K(o=-3.3!,f=-0.58) USER MOD Single : A 155 LYS NZ :NH3+ 147:sc= 0 (180deg=-0.0707) USER MOD Single : A 157 HIS : no HD1:sc= -2.23 K(o=-2.2,f=-0.74) USER MOD Single : A 165 THR OG1 : rot -71:sc= 0.00543 USER MOD Single : A 167 SER OG : rot 97:sc= 0.0578 USER MOD Single : A 175 ASN : amide:sc= -1.04 K(o=-1,f=-4.5!) USER MOD Single : A 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 178 TYR OH : rot 154:sc= 0.841 USER MOD Single : A 180 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 181 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 17 N ALA A 136 -7.965 20.201 -11.896 1.00 0.00 N ATOM 18 CA ALA A 136 -8.081 19.381 -10.697 1.00 0.00 C ATOM 19 C ALA A 136 -9.441 19.567 -10.033 1.00 0.00 C ATOM 20 O ALA A 136 -9.701 20.592 -9.404 1.00 0.00 O ATOM 21 CB ALA A 136 -6.963 19.717 -9.722 1.00 0.00 C ATOM 0 HA ALA A 136 -7.992 18.335 -10.990 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -7.060 19.098 -8.830 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -5.999 19.525 -10.194 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -7.028 20.769 -9.443 1.00 0.00 H new ATOM 27 N ARG A 137 -10.305 18.568 -10.180 1.00 0.00 N ATOM 28 CA ARG A 137 -11.642 18.620 -9.599 1.00 0.00 C ATOM 29 C ARG A 137 -12.196 17.212 -9.392 1.00 0.00 C ATOM 30 O ARG A 137 -12.398 16.468 -10.351 1.00 0.00 O ATOM 31 CB ARG A 137 -12.577 19.428 -10.506 1.00 0.00 C ATOM 32 CG ARG A 137 -14.046 19.340 -10.118 1.00 0.00 C ATOM 33 CD ARG A 137 -14.647 20.715 -9.879 1.00 0.00 C ATOM 34 NE ARG A 137 -15.825 20.657 -9.015 1.00 0.00 N ATOM 35 CZ ARG A 137 -17.014 20.212 -9.412 1.00 0.00 C ATOM 36 NH1 ARG A 137 -17.190 19.787 -10.659 1.00 0.00 N ATOM 37 NH2 ARG A 137 -18.032 20.192 -8.563 1.00 0.00 N ATOM 0 H ARG A 137 -10.103 17.712 -10.697 1.00 0.00 H new ATOM 0 HA ARG A 137 -11.578 19.110 -8.627 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -12.269 20.474 -10.488 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -12.462 19.079 -11.532 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -14.601 18.832 -10.907 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -14.149 18.736 -9.216 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -13.897 21.364 -9.426 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -14.920 21.162 -10.835 1.00 0.00 H new ATOM 0 HE ARG A 137 -15.729 20.977 -8.051 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -16.411 19.801 -11.317 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -18.104 19.447 -10.958 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -17.904 20.518 -7.605 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -18.944 19.851 -8.868 1.00 0.00 H new ATOM 51 N CYS A 138 -12.447 16.854 -8.134 1.00 0.00 N ATOM 52 CA CYS A 138 -12.986 15.536 -7.814 1.00 0.00 C ATOM 53 C CYS A 138 -14.314 15.315 -8.530 1.00 0.00 C ATOM 54 O CYS A 138 -15.358 15.794 -8.085 1.00 0.00 O ATOM 55 CB CYS A 138 -13.169 15.384 -6.303 1.00 0.00 C ATOM 56 SG CYS A 138 -13.445 13.680 -5.768 1.00 0.00 S ATOM 0 H CYS A 138 -12.287 17.455 -7.325 1.00 0.00 H new ATOM 0 HA CYS A 138 -12.276 14.783 -8.156 1.00 0.00 H new ATOM 0 HB2 CYS A 138 -12.285 15.774 -5.799 1.00 0.00 H new ATOM 0 HB3 CYS A 138 -14.014 15.996 -5.986 1.00 0.00 H new ATOM 0 HG CYS A 138 -14.720 13.470 -5.630 1.00 0.00 H new ATOM 61 N GLN A 139 -14.258 14.600 -9.650 1.00 0.00 N ATOM 62 CA GLN A 139 -15.449 14.327 -10.449 1.00 0.00 C ATOM 63 C GLN A 139 -16.161 13.051 -10.003 1.00 0.00 C ATOM 64 O GLN A 139 -16.604 12.258 -10.834 1.00 0.00 O ATOM 65 CB GLN A 139 -15.075 14.218 -11.931 1.00 0.00 C ATOM 66 CG GLN A 139 -14.027 13.155 -12.221 1.00 0.00 C ATOM 67 CD GLN A 139 -14.635 11.846 -12.685 1.00 0.00 C ATOM 68 OE1 GLN A 139 -15.622 11.832 -13.422 1.00 0.00 O ATOM 69 NE2 GLN A 139 -14.049 10.736 -12.252 1.00 0.00 N ATOM 0 H GLN A 139 -13.399 14.198 -10.026 1.00 0.00 H new ATOM 0 HA GLN A 139 -16.136 15.160 -10.301 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -15.973 13.997 -12.508 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -14.705 15.184 -12.275 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -13.343 13.524 -12.985 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -13.436 12.978 -11.322 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -13.233 10.794 -11.643 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -14.415 9.825 -12.529 1.00 0.00 H new ATOM 78 N VAL A 140 -16.287 12.861 -8.694 1.00 0.00 N ATOM 79 CA VAL A 140 -16.966 11.685 -8.165 1.00 0.00 C ATOM 80 C VAL A 140 -18.458 11.965 -7.981 1.00 0.00 C ATOM 81 O VAL A 140 -18.836 12.879 -7.251 1.00 0.00 O ATOM 82 CB VAL A 140 -16.361 11.237 -6.819 1.00 0.00 C ATOM 83 CG1 VAL A 140 -16.993 9.932 -6.352 1.00 0.00 C ATOM 84 CG2 VAL A 140 -14.852 11.094 -6.937 1.00 0.00 C ATOM 0 H VAL A 140 -15.931 13.501 -7.985 1.00 0.00 H new ATOM 0 HA VAL A 140 -16.831 10.881 -8.889 1.00 0.00 H new ATOM 0 HB VAL A 140 -16.576 12.002 -6.073 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -16.552 9.634 -5.401 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -18.067 10.072 -6.226 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -16.813 9.155 -7.095 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -14.440 10.777 -5.979 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -14.615 10.350 -7.697 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -14.417 12.052 -7.220 1.00 0.00 H new ATOM 94 N PRO A 141 -19.330 11.185 -8.647 1.00 0.00 N ATOM 95 CA PRO A 141 -20.783 11.361 -8.556 1.00 0.00 C ATOM 96 C PRO A 141 -21.255 11.671 -7.138 1.00 0.00 C ATOM 97 O PRO A 141 -21.978 12.642 -6.912 1.00 0.00 O ATOM 98 CB PRO A 141 -21.315 10.007 -9.015 1.00 0.00 C ATOM 99 CG PRO A 141 -20.303 9.520 -9.995 1.00 0.00 C ATOM 100 CD PRO A 141 -18.971 10.073 -9.548 1.00 0.00 C ATOM 0 HA PRO A 141 -21.132 12.205 -9.150 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -21.420 9.317 -8.177 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -22.299 10.102 -9.475 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -20.281 8.431 -10.021 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -20.545 9.858 -11.003 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -18.378 9.317 -9.033 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -18.379 10.421 -10.395 1.00 0.00 H new ATOM 108 N ASP A 142 -20.845 10.840 -6.187 1.00 0.00 N ATOM 109 CA ASP A 142 -21.228 11.025 -4.793 1.00 0.00 C ATOM 110 C ASP A 142 -20.409 12.134 -4.137 1.00 0.00 C ATOM 111 O ASP A 142 -20.850 12.750 -3.168 1.00 0.00 O ATOM 112 CB ASP A 142 -21.051 9.719 -4.016 1.00 0.00 C ATOM 113 CG ASP A 142 -19.672 9.119 -4.202 1.00 0.00 C ATOM 114 OD1 ASP A 142 -19.357 8.694 -5.334 1.00 0.00 O ATOM 115 OD2 ASP A 142 -18.907 9.071 -3.217 1.00 0.00 O ATOM 0 H ASP A 142 -20.247 10.031 -6.356 1.00 0.00 H new ATOM 0 HA ASP A 142 -22.278 11.317 -4.771 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -21.224 9.904 -2.956 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -21.804 9.001 -4.341 1.00 0.00 H new ATOM 120 N CYS A 143 -19.214 12.383 -4.666 1.00 0.00 N ATOM 121 CA CYS A 143 -18.341 13.418 -4.121 1.00 0.00 C ATOM 122 C CYS A 143 -17.854 14.366 -5.214 1.00 0.00 C ATOM 123 O CYS A 143 -16.785 14.171 -5.791 1.00 0.00 O ATOM 124 CB CYS A 143 -17.143 12.780 -3.411 1.00 0.00 C ATOM 125 SG CYS A 143 -15.993 13.972 -2.684 1.00 0.00 S ATOM 0 H CYS A 143 -18.829 11.884 -5.468 1.00 0.00 H new ATOM 0 HA CYS A 143 -18.919 13.998 -3.402 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -17.510 12.120 -2.625 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -16.602 12.157 -4.123 1.00 0.00 H new ATOM 0 HG CYS A 143 -15.017 13.337 -2.106 1.00 0.00 H new ATOM 130 N GLU A 144 -18.645 15.400 -5.486 1.00 0.00 N ATOM 131 CA GLU A 144 -18.292 16.385 -6.503 1.00 0.00 C ATOM 132 C GLU A 144 -17.555 17.559 -5.868 1.00 0.00 C ATOM 133 O GLU A 144 -18.125 18.633 -5.677 1.00 0.00 O ATOM 134 CB GLU A 144 -19.544 16.880 -7.227 1.00 0.00 C ATOM 135 CG GLU A 144 -19.296 17.275 -8.673 1.00 0.00 C ATOM 136 CD GLU A 144 -19.295 16.084 -9.610 1.00 0.00 C ATOM 137 OE1 GLU A 144 -20.117 15.167 -9.407 1.00 0.00 O ATOM 138 OE2 GLU A 144 -18.469 16.068 -10.548 1.00 0.00 O ATOM 0 H GLU A 144 -19.533 15.577 -5.017 1.00 0.00 H new ATOM 0 HA GLU A 144 -17.635 15.909 -7.231 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -20.303 16.098 -7.198 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -19.949 17.737 -6.689 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -20.064 17.981 -8.990 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -18.339 17.791 -8.746 1.00 0.00 H new ATOM 145 N ALA A 145 -16.288 17.341 -5.533 1.00 0.00 N ATOM 146 CA ALA A 145 -15.472 18.377 -4.909 1.00 0.00 C ATOM 147 C ALA A 145 -14.744 19.217 -5.950 1.00 0.00 C ATOM 148 O ALA A 145 -14.408 18.732 -7.030 1.00 0.00 O ATOM 149 CB ALA A 145 -14.476 17.750 -3.946 1.00 0.00 C ATOM 0 H ALA A 145 -15.803 16.456 -5.683 1.00 0.00 H new ATOM 0 HA ALA A 145 -16.137 19.039 -4.355 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -13.872 18.533 -3.486 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -15.014 17.204 -3.171 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -13.827 17.064 -4.490 1.00 0.00 H new ATOM 155 N ASP A 146 -14.502 20.480 -5.615 1.00 0.00 N ATOM 156 CA ASP A 146 -13.809 21.393 -6.516 1.00 0.00 C ATOM 157 C ASP A 146 -12.410 21.706 -5.993 1.00 0.00 C ATOM 158 O ASP A 146 -12.184 22.752 -5.383 1.00 0.00 O ATOM 159 CB ASP A 146 -14.608 22.687 -6.678 1.00 0.00 C ATOM 160 CG ASP A 146 -14.209 23.459 -7.922 1.00 0.00 C ATOM 161 OD1 ASP A 146 -13.184 24.170 -7.876 1.00 0.00 O ATOM 162 OD2 ASP A 146 -14.923 23.353 -8.941 1.00 0.00 O ATOM 0 H ASP A 146 -14.776 20.895 -4.724 1.00 0.00 H new ATOM 0 HA ASP A 146 -13.717 20.909 -7.489 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -15.671 22.451 -6.725 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -14.459 23.315 -5.800 1.00 0.00 H new ATOM 167 N ILE A 147 -11.476 20.792 -6.235 1.00 0.00 N ATOM 168 CA ILE A 147 -10.100 20.969 -5.787 1.00 0.00 C ATOM 169 C ILE A 147 -9.244 21.618 -6.872 1.00 0.00 C ATOM 170 O ILE A 147 -8.123 21.182 -7.137 1.00 0.00 O ATOM 171 CB ILE A 147 -9.466 19.622 -5.384 1.00 0.00 C ATOM 172 CG1 ILE A 147 -9.542 18.627 -6.546 1.00 0.00 C ATOM 173 CG2 ILE A 147 -10.155 19.062 -4.149 1.00 0.00 C ATOM 174 CD1 ILE A 147 -8.198 18.062 -6.947 1.00 0.00 C ATOM 0 H ILE A 147 -11.647 19.922 -6.739 1.00 0.00 H new ATOM 0 HA ILE A 147 -10.132 21.624 -4.917 1.00 0.00 H new ATOM 0 HB ILE A 147 -8.416 19.788 -5.145 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -10.204 17.806 -6.268 1.00 0.00 H new ATOM 0 HG13 ILE A 147 -9.991 19.121 -7.408 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -9.697 18.111 -3.876 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -10.050 19.766 -3.323 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -11.213 18.907 -4.361 1.00 0.00 H new ATOM 0 HD11 ILE A 147 -8.329 17.365 -7.775 1.00 0.00 H new ATOM 0 HD12 ILE A 147 -7.540 18.874 -7.256 1.00 0.00 H new ATOM 0 HD13 ILE A 147 -7.756 17.539 -6.099 1.00 0.00 H new ATOM 186 N SER A 148 -9.778 22.665 -7.494 1.00 0.00 N ATOM 187 CA SER A 148 -9.063 23.374 -8.549 1.00 0.00 C ATOM 188 C SER A 148 -7.712 23.879 -8.051 1.00 0.00 C ATOM 189 O SER A 148 -6.759 23.994 -8.821 1.00 0.00 O ATOM 190 CB SER A 148 -9.900 24.548 -9.060 1.00 0.00 C ATOM 191 OG SER A 148 -10.409 25.318 -7.984 1.00 0.00 O ATOM 0 H SER A 148 -10.703 23.041 -7.285 1.00 0.00 H new ATOM 0 HA SER A 148 -8.889 22.674 -9.367 1.00 0.00 H new ATOM 0 HB2 SER A 148 -9.290 25.179 -9.707 1.00 0.00 H new ATOM 0 HB3 SER A 148 -10.725 24.174 -9.666 1.00 0.00 H new ATOM 0 HG SER A 148 -11.339 25.063 -7.810 1.00 0.00 H new ATOM 197 N GLU A 149 -7.637 24.177 -6.758 1.00 0.00 N ATOM 198 CA GLU A 149 -6.402 24.670 -6.157 1.00 0.00 C ATOM 199 C GLU A 149 -5.881 23.693 -5.107 1.00 0.00 C ATOM 200 O GLU A 149 -5.876 23.991 -3.912 1.00 0.00 O ATOM 201 CB GLU A 149 -6.632 26.045 -5.524 1.00 0.00 C ATOM 202 CG GLU A 149 -6.462 27.199 -6.499 1.00 0.00 C ATOM 203 CD GLU A 149 -5.721 28.372 -5.889 1.00 0.00 C ATOM 204 OE1 GLU A 149 -6.367 29.190 -5.201 1.00 0.00 O ATOM 205 OE2 GLU A 149 -4.494 28.474 -6.100 1.00 0.00 O ATOM 0 H GLU A 149 -8.416 24.086 -6.106 1.00 0.00 H new ATOM 0 HA GLU A 149 -5.654 24.761 -6.945 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -7.638 26.079 -5.105 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -5.937 26.175 -4.695 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -5.921 26.850 -7.379 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -7.443 27.531 -6.839 1.00 0.00 H new ATOM 212 N LEU A 150 -5.443 22.523 -5.561 1.00 0.00 N ATOM 213 CA LEU A 150 -4.920 21.499 -4.662 1.00 0.00 C ATOM 214 C LEU A 150 -3.418 21.316 -4.860 1.00 0.00 C ATOM 215 O LEU A 150 -2.817 21.940 -5.734 1.00 0.00 O ATOM 216 CB LEU A 150 -5.646 20.170 -4.894 1.00 0.00 C ATOM 217 CG LEU A 150 -6.060 19.427 -3.621 1.00 0.00 C ATOM 218 CD1 LEU A 150 -7.017 20.272 -2.794 1.00 0.00 C ATOM 219 CD2 LEU A 150 -6.694 18.087 -3.969 1.00 0.00 C ATOM 0 H LEU A 150 -5.440 22.260 -6.546 1.00 0.00 H new ATOM 0 HA LEU A 150 -5.094 21.826 -3.637 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -6.537 20.360 -5.492 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -5.000 19.519 -5.483 1.00 0.00 H new ATOM 0 HG LEU A 150 -5.166 19.242 -3.026 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -7.299 19.726 -1.894 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -6.529 21.206 -2.514 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -7.909 20.490 -3.381 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -6.982 17.572 -3.053 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -7.577 18.252 -4.586 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -5.977 17.477 -4.518 1.00 0.00 H new ATOM 231 N LYS A 151 -2.820 20.455 -4.043 1.00 0.00 N ATOM 232 CA LYS A 151 -1.388 20.189 -4.128 1.00 0.00 C ATOM 233 C LYS A 151 -1.088 18.725 -3.822 1.00 0.00 C ATOM 234 O LYS A 151 -1.238 18.273 -2.688 1.00 0.00 O ATOM 235 CB LYS A 151 -0.621 21.089 -3.158 1.00 0.00 C ATOM 236 CG LYS A 151 -1.209 21.117 -1.755 1.00 0.00 C ATOM 237 CD LYS A 151 -0.437 20.210 -0.808 1.00 0.00 C ATOM 238 CE LYS A 151 -0.266 20.849 0.562 1.00 0.00 C ATOM 239 NZ LYS A 151 1.131 21.312 0.789 1.00 0.00 N ATOM 0 H LYS A 151 -3.304 19.930 -3.315 1.00 0.00 H new ATOM 0 HA LYS A 151 -1.065 20.404 -5.146 1.00 0.00 H new ATOM 0 HB2 LYS A 151 0.413 20.750 -3.102 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -0.603 22.104 -3.555 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -1.195 22.138 -1.374 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -2.252 20.804 -1.790 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -0.961 19.260 -0.704 1.00 0.00 H new ATOM 0 HD3 LYS A 151 0.542 19.989 -1.232 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -0.948 21.694 0.656 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -0.540 20.130 1.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 1.205 21.741 1.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 1.780 20.502 0.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 1.385 22.017 0.068 1.00 0.00 H new ATOM 253 N GLY A 152 -0.663 17.988 -4.844 1.00 0.00 N ATOM 254 CA GLY A 152 -0.348 16.583 -4.664 1.00 0.00 C ATOM 255 C GLY A 152 -0.673 15.754 -5.890 1.00 0.00 C ATOM 256 O GLY A 152 -1.099 16.286 -6.915 1.00 0.00 O ATOM 0 H GLY A 152 -0.531 18.339 -5.793 1.00 0.00 H new ATOM 0 HA2 GLY A 152 0.711 16.479 -4.429 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -0.904 16.196 -3.810 1.00 0.00 H new ATOM 260 N TYR A 153 -0.471 14.443 -5.785 1.00 0.00 N ATOM 261 CA TYR A 153 -0.743 13.536 -6.893 1.00 0.00 C ATOM 262 C TYR A 153 -2.242 13.439 -7.168 1.00 0.00 C ATOM 263 O TYR A 153 -2.658 13.121 -8.281 1.00 0.00 O ATOM 264 CB TYR A 153 -0.181 12.146 -6.591 1.00 0.00 C ATOM 265 CG TYR A 153 -0.610 11.596 -5.250 1.00 0.00 C ATOM 266 CD1 TYR A 153 -1.936 11.260 -5.009 1.00 0.00 C ATOM 267 CD2 TYR A 153 0.309 11.417 -4.225 1.00 0.00 C ATOM 268 CE1 TYR A 153 -2.334 10.758 -3.785 1.00 0.00 C ATOM 269 CE2 TYR A 153 -0.081 10.916 -2.996 1.00 0.00 C ATOM 270 CZ TYR A 153 -1.402 10.588 -2.783 1.00 0.00 C ATOM 271 OH TYR A 153 -1.794 10.089 -1.561 1.00 0.00 O ATOM 0 H TYR A 153 -0.120 13.987 -4.943 1.00 0.00 H new ATOM 0 HA TYR A 153 -0.254 13.936 -7.782 1.00 0.00 H new ATOM 0 HB2 TYR A 153 -0.498 11.458 -7.374 1.00 0.00 H new ATOM 0 HB3 TYR A 153 0.908 12.189 -6.625 1.00 0.00 H new ATOM 0 HD1 TYR A 153 -2.668 11.393 -5.792 1.00 0.00 H new ATOM 0 HD2 TYR A 153 1.345 11.673 -4.390 1.00 0.00 H new ATOM 0 HE1 TYR A 153 -3.369 10.500 -3.614 1.00 0.00 H new ATOM 0 HE2 TYR A 153 0.646 10.783 -2.208 1.00 0.00 H new ATOM 0 HH TYR A 153 -1.017 10.030 -0.967 1.00 0.00 H new ATOM 281 N HIS A 154 -3.049 13.714 -6.146 1.00 0.00 N ATOM 282 CA HIS A 154 -4.501 13.656 -6.283 1.00 0.00 C ATOM 283 C HIS A 154 -5.046 14.872 -7.034 1.00 0.00 C ATOM 284 O HIS A 154 -6.245 14.958 -7.298 1.00 0.00 O ATOM 285 CB HIS A 154 -5.166 13.556 -4.907 1.00 0.00 C ATOM 286 CG HIS A 154 -4.588 14.486 -3.885 1.00 0.00 C ATOM 287 ND1 HIS A 154 -4.435 14.142 -2.558 1.00 0.00 N ATOM 288 CD2 HIS A 154 -4.129 15.755 -3.998 1.00 0.00 C ATOM 289 CE1 HIS A 154 -3.907 15.159 -1.901 1.00 0.00 C ATOM 290 NE2 HIS A 154 -3.712 16.149 -2.752 1.00 0.00 N ATOM 0 H HIS A 154 -2.723 13.978 -5.217 1.00 0.00 H new ATOM 0 HA HIS A 154 -4.738 12.765 -6.864 1.00 0.00 H new ATOM 0 HB2 HIS A 154 -6.231 13.764 -5.013 1.00 0.00 H new ATOM 0 HB3 HIS A 154 -5.076 12.532 -4.544 1.00 0.00 H new ATOM 0 HD2 HIS A 154 -4.097 16.347 -4.901 1.00 0.00 H new ATOM 0 HE1 HIS A 154 -3.674 15.177 -0.847 1.00 0.00 H new ATOM 0 HE2 HIS A 154 -3.315 17.060 -2.521 1.00 0.00 H new ATOM 298 N LYS A 155 -4.165 15.808 -7.378 1.00 0.00 N ATOM 299 CA LYS A 155 -4.572 17.008 -8.097 1.00 0.00 C ATOM 300 C LYS A 155 -4.631 16.745 -9.599 1.00 0.00 C ATOM 301 O LYS A 155 -5.506 17.256 -10.296 1.00 0.00 O ATOM 302 CB LYS A 155 -3.606 18.157 -7.806 1.00 0.00 C ATOM 303 CG LYS A 155 -3.971 19.456 -8.506 1.00 0.00 C ATOM 304 CD LYS A 155 -2.741 20.303 -8.787 1.00 0.00 C ATOM 305 CE LYS A 155 -2.121 19.961 -10.134 1.00 0.00 C ATOM 306 NZ LYS A 155 -0.759 19.378 -9.986 1.00 0.00 N ATOM 0 H LYS A 155 -3.168 15.757 -7.170 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.568 17.287 -7.754 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -3.576 18.331 -6.730 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -2.602 17.861 -8.109 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -4.483 19.234 -9.442 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -4.669 20.020 -7.887 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -3.013 21.358 -8.769 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -2.005 20.150 -7.998 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -2.763 19.255 -10.660 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -2.066 20.860 -10.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -0.595 18.683 -10.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -0.049 20.135 -10.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -0.681 18.908 -9.061 1.00 0.00 H new ATOM 320 N ARG A 156 -3.690 15.944 -10.089 1.00 0.00 N ATOM 321 CA ARG A 156 -3.628 15.610 -11.509 1.00 0.00 C ATOM 322 C ARG A 156 -4.434 14.350 -11.824 1.00 0.00 C ATOM 323 O ARG A 156 -4.155 13.660 -12.805 1.00 0.00 O ATOM 324 CB ARG A 156 -2.175 15.417 -11.940 1.00 0.00 C ATOM 325 CG ARG A 156 -1.940 15.662 -13.421 1.00 0.00 C ATOM 326 CD ARG A 156 -0.456 15.725 -13.749 1.00 0.00 C ATOM 327 NE ARG A 156 -0.155 16.774 -14.721 1.00 0.00 N ATOM 328 CZ ARG A 156 -0.265 18.075 -14.466 1.00 0.00 C ATOM 329 NH1 ARG A 156 -0.670 18.493 -13.274 1.00 0.00 N ATOM 330 NH2 ARG A 156 0.031 18.962 -15.407 1.00 0.00 N ATOM 0 H ARG A 156 -2.959 15.513 -9.523 1.00 0.00 H new ATOM 0 HA ARG A 156 -4.066 16.439 -12.065 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -1.542 16.092 -11.364 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -1.864 14.401 -11.695 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -2.408 14.866 -14.001 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -2.419 16.596 -13.716 1.00 0.00 H new ATOM 0 HD2 ARG A 156 0.110 15.904 -12.835 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -0.130 14.762 -14.142 1.00 0.00 H new ATOM 0 HE ARG A 156 0.158 16.492 -15.650 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -0.899 17.816 -12.547 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -0.752 19.492 -13.085 1.00 0.00 H new ATOM 0 HH21 ARG A 156 0.343 18.646 -16.325 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -0.053 19.960 -15.212 1.00 0.00 H new ATOM 344 N HIS A 157 -5.431 14.053 -10.995 1.00 0.00 N ATOM 345 CA HIS A 157 -6.265 12.873 -11.203 1.00 0.00 C ATOM 346 C HIS A 157 -7.737 13.172 -10.921 1.00 0.00 C ATOM 347 O HIS A 157 -8.545 12.256 -10.772 1.00 0.00 O ATOM 348 CB HIS A 157 -5.787 11.725 -10.312 1.00 0.00 C ATOM 349 CG HIS A 157 -4.624 10.974 -10.881 1.00 0.00 C ATOM 350 ND1 HIS A 157 -4.766 9.861 -11.682 1.00 0.00 N ATOM 351 CD2 HIS A 157 -3.292 11.183 -10.764 1.00 0.00 C ATOM 352 CE1 HIS A 157 -3.571 9.418 -12.034 1.00 0.00 C ATOM 353 NE2 HIS A 157 -2.660 10.204 -11.490 1.00 0.00 N ATOM 0 H HIS A 157 -5.680 14.610 -10.177 1.00 0.00 H new ATOM 0 HA HIS A 157 -6.174 12.581 -12.249 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -5.510 12.124 -9.336 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -6.613 11.032 -10.150 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -2.815 11.973 -10.204 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -3.374 8.560 -12.660 1.00 0.00 H new ATOM 0 HE2 HIS A 157 -1.650 10.101 -11.593 1.00 0.00 H new ATOM 361 N ARG A 158 -8.081 14.457 -10.858 1.00 0.00 N ATOM 362 CA ARG A 158 -9.457 14.871 -10.601 1.00 0.00 C ATOM 363 C ARG A 158 -10.033 14.163 -9.376 1.00 0.00 C ATOM 364 O ARG A 158 -11.055 13.480 -9.462 1.00 0.00 O ATOM 365 CB ARG A 158 -10.330 14.594 -11.827 1.00 0.00 C ATOM 366 CG ARG A 158 -10.161 15.620 -12.935 1.00 0.00 C ATOM 367 CD ARG A 158 -11.432 15.775 -13.755 1.00 0.00 C ATOM 368 NE ARG A 158 -12.028 17.101 -13.595 1.00 0.00 N ATOM 369 CZ ARG A 158 -13.171 17.474 -14.166 1.00 0.00 C ATOM 370 NH1 ARG A 158 -13.843 16.626 -14.935 1.00 0.00 N ATOM 371 NH2 ARG A 158 -13.643 18.697 -13.968 1.00 0.00 N ATOM 0 H ARG A 158 -7.425 15.228 -10.981 1.00 0.00 H new ATOM 0 HA ARG A 158 -9.451 15.942 -10.399 1.00 0.00 H new ATOM 0 HB2 ARG A 158 -10.090 13.605 -12.218 1.00 0.00 H new ATOM 0 HB3 ARG A 158 -11.376 14.570 -11.521 1.00 0.00 H new ATOM 0 HG2 ARG A 158 -9.888 16.582 -12.502 1.00 0.00 H new ATOM 0 HG3 ARG A 158 -9.341 15.320 -13.587 1.00 0.00 H new ATOM 0 HD2 ARG A 158 -11.208 15.603 -14.808 1.00 0.00 H new ATOM 0 HD3 ARG A 158 -12.153 15.015 -13.454 1.00 0.00 H new ATOM 0 HE ARG A 158 -11.539 17.780 -13.012 1.00 0.00 H new ATOM 0 HH11 ARG A 158 -13.484 15.684 -15.090 1.00 0.00 H new ATOM 0 HH12 ARG A 158 -14.718 16.916 -15.370 1.00 0.00 H new ATOM 0 HH21 ARG A 158 -13.130 19.352 -13.378 1.00 0.00 H new ATOM 0 HH22 ARG A 158 -14.519 18.983 -14.406 1.00 0.00 H new ATOM 385 N VAL A 159 -9.373 14.337 -8.235 1.00 0.00 N ATOM 386 CA VAL A 159 -9.818 13.721 -6.992 1.00 0.00 C ATOM 387 C VAL A 159 -9.329 14.521 -5.786 1.00 0.00 C ATOM 388 O VAL A 159 -8.229 15.073 -5.802 1.00 0.00 O ATOM 389 CB VAL A 159 -9.322 12.265 -6.875 1.00 0.00 C ATOM 390 CG1 VAL A 159 -7.805 12.209 -6.928 1.00 0.00 C ATOM 391 CG2 VAL A 159 -9.845 11.618 -5.600 1.00 0.00 C ATOM 0 H VAL A 159 -8.527 14.900 -8.147 1.00 0.00 H new ATOM 0 HA VAL A 159 -10.908 13.718 -7.006 1.00 0.00 H new ATOM 0 HB VAL A 159 -9.711 11.702 -7.723 1.00 0.00 H new ATOM 0 HG11 VAL A 159 -7.476 11.173 -6.844 1.00 0.00 H new ATOM 0 HG12 VAL A 159 -7.458 12.624 -7.874 1.00 0.00 H new ATOM 0 HG13 VAL A 159 -7.390 12.789 -6.104 1.00 0.00 H new ATOM 0 HG21 VAL A 159 -9.483 10.592 -5.538 1.00 0.00 H new ATOM 0 HG22 VAL A 159 -9.492 12.180 -4.735 1.00 0.00 H new ATOM 0 HG23 VAL A 159 -10.935 11.618 -5.613 1.00 0.00 H new ATOM 401 N CYS A 160 -10.157 14.585 -4.747 1.00 0.00 N ATOM 402 CA CYS A 160 -9.808 15.325 -3.539 1.00 0.00 C ATOM 403 C CYS A 160 -9.011 14.455 -2.569 1.00 0.00 C ATOM 404 O CYS A 160 -8.946 13.236 -2.722 1.00 0.00 O ATOM 405 CB CYS A 160 -11.074 15.862 -2.860 1.00 0.00 C ATOM 406 SG CYS A 160 -12.043 14.612 -1.978 1.00 0.00 S ATOM 0 H CYS A 160 -11.072 14.135 -4.717 1.00 0.00 H new ATOM 0 HA CYS A 160 -9.179 16.167 -3.828 1.00 0.00 H new ATOM 0 HB2 CYS A 160 -10.789 16.645 -2.157 1.00 0.00 H new ATOM 0 HB3 CYS A 160 -11.707 16.327 -3.616 1.00 0.00 H new ATOM 0 HG CYS A 160 -13.087 15.171 -1.441 1.00 0.00 H new ATOM 411 N LEU A 161 -8.405 15.095 -1.573 1.00 0.00 N ATOM 412 CA LEU A 161 -7.611 14.384 -0.578 1.00 0.00 C ATOM 413 C LEU A 161 -8.488 13.467 0.269 1.00 0.00 C ATOM 414 O LEU A 161 -8.045 12.411 0.721 1.00 0.00 O ATOM 415 CB LEU A 161 -6.878 15.381 0.323 1.00 0.00 C ATOM 416 CG LEU A 161 -5.944 14.752 1.360 1.00 0.00 C ATOM 417 CD1 LEU A 161 -4.717 15.626 1.573 1.00 0.00 C ATOM 418 CD2 LEU A 161 -6.678 14.532 2.674 1.00 0.00 C ATOM 0 H LEU A 161 -8.449 16.105 -1.434 1.00 0.00 H new ATOM 0 HA LEU A 161 -6.880 13.770 -1.104 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -6.297 16.056 -0.305 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -7.618 15.989 0.844 1.00 0.00 H new ATOM 0 HG LEU A 161 -5.614 13.784 0.984 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -4.065 15.163 2.313 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -4.179 15.733 0.631 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -5.028 16.609 1.927 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -5.999 14.084 3.400 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -7.037 15.488 3.055 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -7.525 13.866 2.510 1.00 0.00 H new ATOM 430 N ARG A 162 -9.735 13.878 0.481 1.00 0.00 N ATOM 431 CA ARG A 162 -10.672 13.093 1.275 1.00 0.00 C ATOM 432 C ARG A 162 -10.889 11.713 0.662 1.00 0.00 C ATOM 433 O ARG A 162 -11.095 10.731 1.375 1.00 0.00 O ATOM 434 CB ARG A 162 -12.010 13.826 1.393 1.00 0.00 C ATOM 435 CG ARG A 162 -12.699 13.625 2.733 1.00 0.00 C ATOM 436 CD ARG A 162 -13.744 14.700 2.991 1.00 0.00 C ATOM 437 NE ARG A 162 -13.576 15.324 4.301 1.00 0.00 N ATOM 438 CZ ARG A 162 -12.669 16.264 4.563 1.00 0.00 C ATOM 439 NH1 ARG A 162 -11.846 16.685 3.611 1.00 0.00 N ATOM 440 NH2 ARG A 162 -12.585 16.782 5.780 1.00 0.00 N ATOM 0 H ARG A 162 -10.119 14.749 0.114 1.00 0.00 H new ATOM 0 HA ARG A 162 -10.244 12.964 2.269 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -11.846 14.892 1.235 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -12.673 13.484 0.598 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -13.172 12.643 2.756 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -11.956 13.640 3.531 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -13.678 15.463 2.215 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -14.740 14.261 2.923 1.00 0.00 H new ATOM 0 HE ARG A 162 -14.188 15.023 5.059 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -11.906 16.289 2.673 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -11.154 17.405 3.817 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -13.215 16.461 6.515 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -11.891 17.502 5.981 1.00 0.00 H new ATOM 454 N CYS A 163 -10.839 11.646 -0.664 1.00 0.00 N ATOM 455 CA CYS A 163 -11.030 10.385 -1.374 1.00 0.00 C ATOM 456 C CYS A 163 -9.726 9.595 -1.442 1.00 0.00 C ATOM 457 O CYS A 163 -9.738 8.365 -1.502 1.00 0.00 O ATOM 458 CB CYS A 163 -11.558 10.645 -2.786 1.00 0.00 C ATOM 459 SG CYS A 163 -13.334 10.977 -2.859 1.00 0.00 S ATOM 0 H CYS A 163 -10.668 12.449 -1.269 1.00 0.00 H new ATOM 0 HA CYS A 163 -11.762 9.794 -0.824 1.00 0.00 H new ATOM 0 HB2 CYS A 163 -11.023 11.493 -3.212 1.00 0.00 H new ATOM 0 HB3 CYS A 163 -11.335 9.780 -3.411 1.00 0.00 H new ATOM 0 HG CYS A 163 -13.574 11.849 -3.793 1.00 0.00 H new ATOM 464 N ALA A 164 -8.605 10.307 -1.434 1.00 0.00 N ATOM 465 CA ALA A 164 -7.294 9.673 -1.496 1.00 0.00 C ATOM 466 C ALA A 164 -6.998 8.893 -0.219 1.00 0.00 C ATOM 467 O ALA A 164 -6.297 7.882 -0.247 1.00 0.00 O ATOM 468 CB ALA A 164 -6.214 10.716 -1.742 1.00 0.00 C ATOM 0 H ALA A 164 -8.578 11.325 -1.385 1.00 0.00 H new ATOM 0 HA ALA A 164 -7.299 8.968 -2.327 1.00 0.00 H new ATOM 0 HB1 ALA A 164 -5.240 10.228 -1.786 1.00 0.00 H new ATOM 0 HB2 ALA A 164 -6.408 11.225 -2.686 1.00 0.00 H new ATOM 0 HB3 ALA A 164 -6.219 11.443 -0.930 1.00 0.00 H new ATOM 474 N THR A 165 -7.536 9.370 0.898 1.00 0.00 N ATOM 475 CA THR A 165 -7.327 8.717 2.186 1.00 0.00 C ATOM 476 C THR A 165 -8.546 7.896 2.596 1.00 0.00 C ATOM 477 O THR A 165 -8.430 6.934 3.352 1.00 0.00 O ATOM 478 CB THR A 165 -7.021 9.744 3.292 1.00 0.00 C ATOM 479 OG1 THR A 165 -8.156 10.593 3.502 1.00 0.00 O ATOM 480 CG2 THR A 165 -5.810 10.590 2.924 1.00 0.00 C ATOM 0 H THR A 165 -8.120 10.206 0.938 1.00 0.00 H new ATOM 0 HA THR A 165 -6.471 8.053 2.066 1.00 0.00 H new ATOM 0 HB THR A 165 -6.800 9.200 4.211 1.00 0.00 H new ATOM 0 HG1 THR A 165 -8.262 11.193 2.734 1.00 0.00 H new ATOM 0 HG21 THR A 165 -5.613 11.308 3.720 1.00 0.00 H new ATOM 0 HG22 THR A 165 -4.941 9.945 2.794 1.00 0.00 H new ATOM 0 HG23 THR A 165 -6.008 11.124 1.994 1.00 0.00 H new ATOM 488 N ALA A 166 -9.716 8.284 2.092 1.00 0.00 N ATOM 489 CA ALA A 166 -10.955 7.582 2.410 1.00 0.00 C ATOM 490 C ALA A 166 -10.847 6.095 2.084 1.00 0.00 C ATOM 491 O ALA A 166 -10.048 5.691 1.238 1.00 0.00 O ATOM 492 CB ALA A 166 -12.121 8.203 1.656 1.00 0.00 C ATOM 0 H ALA A 166 -9.831 9.079 1.463 1.00 0.00 H new ATOM 0 HA ALA A 166 -11.132 7.680 3.481 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -13.039 7.670 1.902 1.00 0.00 H new ATOM 0 HB2 ALA A 166 -12.222 9.250 1.941 1.00 0.00 H new ATOM 0 HB3 ALA A 166 -11.938 8.135 0.584 1.00 0.00 H new ATOM 498 N SER A 167 -11.655 5.286 2.761 1.00 0.00 N ATOM 499 CA SER A 167 -11.651 3.845 2.546 1.00 0.00 C ATOM 500 C SER A 167 -12.172 3.501 1.154 1.00 0.00 C ATOM 501 O SER A 167 -11.649 2.607 0.488 1.00 0.00 O ATOM 502 CB SER A 167 -12.502 3.148 3.608 1.00 0.00 C ATOM 503 OG SER A 167 -13.604 3.952 3.990 1.00 0.00 O ATOM 0 H SER A 167 -12.322 5.605 3.464 1.00 0.00 H new ATOM 0 HA SER A 167 -10.622 3.494 2.626 1.00 0.00 H new ATOM 0 HB2 SER A 167 -12.861 2.194 3.222 1.00 0.00 H new ATOM 0 HB3 SER A 167 -11.889 2.928 4.482 1.00 0.00 H new ATOM 0 HG SER A 167 -14.400 3.673 3.492 1.00 0.00 H new ATOM 509 N PHE A 168 -13.205 4.215 0.721 1.00 0.00 N ATOM 510 CA PHE A 168 -13.796 3.984 -0.593 1.00 0.00 C ATOM 511 C PHE A 168 -14.751 5.114 -0.967 1.00 0.00 C ATOM 512 O PHE A 168 -15.010 6.011 -0.166 1.00 0.00 O ATOM 513 CB PHE A 168 -14.539 2.647 -0.612 1.00 0.00 C ATOM 514 CG PHE A 168 -15.682 2.581 0.360 1.00 0.00 C ATOM 515 CD1 PHE A 168 -16.899 3.171 0.060 1.00 0.00 C ATOM 516 CD2 PHE A 168 -15.540 1.927 1.574 1.00 0.00 C ATOM 517 CE1 PHE A 168 -17.952 3.113 0.952 1.00 0.00 C ATOM 518 CE2 PHE A 168 -16.590 1.865 2.470 1.00 0.00 C ATOM 519 CZ PHE A 168 -17.798 2.459 2.159 1.00 0.00 C ATOM 0 H PHE A 168 -13.650 4.958 1.260 1.00 0.00 H new ATOM 0 HA PHE A 168 -12.990 3.956 -1.326 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -14.917 2.465 -1.618 1.00 0.00 H new ATOM 0 HB3 PHE A 168 -13.835 1.846 -0.387 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -17.026 3.682 -0.883 1.00 0.00 H new ATOM 0 HD2 PHE A 168 -14.598 1.461 1.822 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -18.895 3.579 0.706 1.00 0.00 H new ATOM 0 HE2 PHE A 168 -16.467 1.353 3.413 1.00 0.00 H new ATOM 0 HZ PHE A 168 -18.620 2.412 2.858 1.00 0.00 H new ATOM 529 N VAL A 169 -15.272 5.061 -2.188 1.00 0.00 N ATOM 530 CA VAL A 169 -16.198 6.078 -2.668 1.00 0.00 C ATOM 531 C VAL A 169 -17.435 5.444 -3.295 1.00 0.00 C ATOM 532 O VAL A 169 -17.335 4.475 -4.046 1.00 0.00 O ATOM 533 CB VAL A 169 -15.530 7.005 -3.702 1.00 0.00 C ATOM 534 CG1 VAL A 169 -14.427 7.825 -3.051 1.00 0.00 C ATOM 535 CG2 VAL A 169 -14.988 6.199 -4.874 1.00 0.00 C ATOM 0 H VAL A 169 -15.068 4.324 -2.863 1.00 0.00 H new ATOM 0 HA VAL A 169 -16.495 6.668 -1.801 1.00 0.00 H new ATOM 0 HB VAL A 169 -16.283 7.693 -4.085 1.00 0.00 H new ATOM 0 HG11 VAL A 169 -13.967 8.473 -3.797 1.00 0.00 H new ATOM 0 HG12 VAL A 169 -14.850 8.434 -2.252 1.00 0.00 H new ATOM 0 HG13 VAL A 169 -13.672 7.156 -2.637 1.00 0.00 H new ATOM 0 HG21 VAL A 169 -14.520 6.872 -5.593 1.00 0.00 H new ATOM 0 HG22 VAL A 169 -14.249 5.483 -4.513 1.00 0.00 H new ATOM 0 HG23 VAL A 169 -15.806 5.664 -5.357 1.00 0.00 H new ATOM 545 N VAL A 170 -18.600 6.000 -2.981 1.00 0.00 N ATOM 546 CA VAL A 170 -19.857 5.489 -3.515 1.00 0.00 C ATOM 547 C VAL A 170 -20.142 6.071 -4.897 1.00 0.00 C ATOM 548 O VAL A 170 -21.084 6.844 -5.077 1.00 0.00 O ATOM 549 CB VAL A 170 -21.037 5.810 -2.578 1.00 0.00 C ATOM 550 CG1 VAL A 170 -22.306 5.124 -3.061 1.00 0.00 C ATOM 551 CG2 VAL A 170 -20.711 5.399 -1.149 1.00 0.00 C ATOM 0 H VAL A 170 -18.700 6.803 -2.360 1.00 0.00 H new ATOM 0 HA VAL A 170 -19.753 4.407 -3.594 1.00 0.00 H new ATOM 0 HB VAL A 170 -21.206 6.887 -2.593 1.00 0.00 H new ATOM 0 HG11 VAL A 170 -23.128 5.363 -2.386 1.00 0.00 H new ATOM 0 HG12 VAL A 170 -22.548 5.472 -4.065 1.00 0.00 H new ATOM 0 HG13 VAL A 170 -22.152 4.045 -3.078 1.00 0.00 H new ATOM 0 HG21 VAL A 170 -21.556 5.633 -0.501 1.00 0.00 H new ATOM 0 HG22 VAL A 170 -20.514 4.328 -1.115 1.00 0.00 H new ATOM 0 HG23 VAL A 170 -19.830 5.941 -0.806 1.00 0.00 H new ATOM 561 N LEU A 171 -19.322 5.693 -5.872 1.00 0.00 N ATOM 562 CA LEU A 171 -19.484 6.177 -7.238 1.00 0.00 C ATOM 563 C LEU A 171 -20.852 5.788 -7.792 1.00 0.00 C ATOM 564 O LEU A 171 -21.697 5.258 -7.072 1.00 0.00 O ATOM 565 CB LEU A 171 -18.373 5.623 -8.133 1.00 0.00 C ATOM 566 CG LEU A 171 -17.830 6.605 -9.173 1.00 0.00 C ATOM 567 CD1 LEU A 171 -16.584 7.302 -8.649 1.00 0.00 C ATOM 568 CD2 LEU A 171 -17.532 5.892 -10.482 1.00 0.00 C ATOM 0 H LEU A 171 -18.539 5.053 -5.742 1.00 0.00 H new ATOM 0 HA LEU A 171 -19.416 7.265 -7.225 1.00 0.00 H new ATOM 0 HB2 LEU A 171 -17.548 5.294 -7.501 1.00 0.00 H new ATOM 0 HB3 LEU A 171 -18.750 4.741 -8.650 1.00 0.00 H new ATOM 0 HG LEU A 171 -18.594 7.360 -9.362 1.00 0.00 H new ATOM 0 HD11 LEU A 171 -16.212 7.997 -9.402 1.00 0.00 H new ATOM 0 HD12 LEU A 171 -16.829 7.850 -7.739 1.00 0.00 H new ATOM 0 HD13 LEU A 171 -15.817 6.559 -8.430 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -17.147 6.609 -11.207 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -16.788 5.114 -10.311 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -18.447 5.442 -10.867 1.00 0.00 H new ATOM 580 N ASP A 172 -21.064 6.057 -9.077 1.00 0.00 N ATOM 581 CA ASP A 172 -22.331 5.738 -9.729 1.00 0.00 C ATOM 582 C ASP A 172 -22.668 4.257 -9.584 1.00 0.00 C ATOM 583 O ASP A 172 -22.293 3.440 -10.426 1.00 0.00 O ATOM 584 CB ASP A 172 -22.275 6.117 -11.209 1.00 0.00 C ATOM 585 CG ASP A 172 -23.636 6.491 -11.762 1.00 0.00 C ATOM 586 OD1 ASP A 172 -24.458 7.037 -10.997 1.00 0.00 O ATOM 587 OD2 ASP A 172 -23.880 6.238 -12.962 1.00 0.00 O ATOM 0 H ASP A 172 -20.375 6.495 -9.688 1.00 0.00 H new ATOM 0 HA ASP A 172 -23.115 6.316 -9.240 1.00 0.00 H new ATOM 0 HB2 ASP A 172 -21.590 6.954 -11.341 1.00 0.00 H new ATOM 0 HB3 ASP A 172 -21.871 5.281 -11.780 1.00 0.00 H new ATOM 592 N GLY A 173 -23.379 3.919 -8.513 1.00 0.00 N ATOM 593 CA GLY A 173 -23.757 2.538 -8.275 1.00 0.00 C ATOM 594 C GLY A 173 -22.570 1.593 -8.288 1.00 0.00 C ATOM 595 O GLY A 173 -22.720 0.403 -8.566 1.00 0.00 O ATOM 0 H GLY A 173 -23.701 4.578 -7.804 1.00 0.00 H new ATOM 0 HA2 GLY A 173 -24.263 2.465 -7.312 1.00 0.00 H new ATOM 0 HA3 GLY A 173 -24.473 2.226 -9.036 1.00 0.00 H new ATOM 599 N GLU A 174 -21.388 2.123 -7.989 1.00 0.00 N ATOM 600 CA GLU A 174 -20.174 1.318 -7.969 1.00 0.00 C ATOM 601 C GLU A 174 -19.185 1.849 -6.937 1.00 0.00 C ATOM 602 O GLU A 174 -18.780 3.009 -6.988 1.00 0.00 O ATOM 603 CB GLU A 174 -19.524 1.305 -9.353 1.00 0.00 C ATOM 604 CG GLU A 174 -20.290 0.485 -10.378 1.00 0.00 C ATOM 605 CD GLU A 174 -20.119 -1.007 -10.178 1.00 0.00 C ATOM 606 OE1 GLU A 174 -20.600 -1.528 -9.150 1.00 0.00 O ATOM 607 OE2 GLU A 174 -19.503 -1.656 -11.049 1.00 0.00 O ATOM 0 H GLU A 174 -21.246 3.106 -7.757 1.00 0.00 H new ATOM 0 HA GLU A 174 -20.448 0.300 -7.693 1.00 0.00 H new ATOM 0 HB2 GLU A 174 -19.435 2.330 -9.713 1.00 0.00 H new ATOM 0 HB3 GLU A 174 -18.512 0.909 -9.266 1.00 0.00 H new ATOM 0 HG2 GLU A 174 -21.349 0.736 -10.320 1.00 0.00 H new ATOM 0 HG3 GLU A 174 -19.952 0.754 -11.379 1.00 0.00 H new ATOM 614 N ASN A 175 -18.797 0.988 -5.999 1.00 0.00 N ATOM 615 CA ASN A 175 -17.852 1.370 -4.956 1.00 0.00 C ATOM 616 C ASN A 175 -16.418 1.148 -5.420 1.00 0.00 C ATOM 617 O ASN A 175 -15.943 0.014 -5.482 1.00 0.00 O ATOM 618 CB ASN A 175 -18.119 0.569 -3.680 1.00 0.00 C ATOM 619 CG ASN A 175 -19.326 1.082 -2.918 1.00 0.00 C ATOM 620 OD1 ASN A 175 -19.740 2.228 -3.086 1.00 0.00 O ATOM 621 ND2 ASN A 175 -19.896 0.231 -2.073 1.00 0.00 N ATOM 0 H ASN A 175 -19.123 0.023 -5.941 1.00 0.00 H new ATOM 0 HA ASN A 175 -17.987 2.431 -4.744 1.00 0.00 H new ATOM 0 HB2 ASN A 175 -18.274 -0.479 -3.938 1.00 0.00 H new ATOM 0 HB3 ASN A 175 -17.241 0.613 -3.036 1.00 0.00 H new ATOM 0 HD21 ASN A 175 -20.711 0.519 -1.532 1.00 0.00 H new ATOM 0 HD22 ASN A 175 -19.519 -0.711 -1.965 1.00 0.00 H new ATOM 628 N LYS A 176 -15.731 2.237 -5.749 1.00 0.00 N ATOM 629 CA LYS A 176 -14.349 2.156 -6.212 1.00 0.00 C ATOM 630 C LYS A 176 -13.382 2.649 -5.140 1.00 0.00 C ATOM 631 O LYS A 176 -13.748 3.449 -4.280 1.00 0.00 O ATOM 632 CB LYS A 176 -14.171 2.977 -7.490 1.00 0.00 C ATOM 633 CG LYS A 176 -14.733 2.301 -8.730 1.00 0.00 C ATOM 634 CD LYS A 176 -15.205 3.320 -9.755 1.00 0.00 C ATOM 635 CE LYS A 176 -14.887 2.878 -11.174 1.00 0.00 C ATOM 636 NZ LYS A 176 -16.119 2.551 -11.944 1.00 0.00 N ATOM 0 H LYS A 176 -16.107 3.184 -5.704 1.00 0.00 H new ATOM 0 HA LYS A 176 -14.125 1.110 -6.422 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.657 3.944 -7.361 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -13.109 3.172 -7.642 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -13.970 1.663 -9.175 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -15.564 1.655 -8.448 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -16.280 3.469 -9.652 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -14.730 4.281 -9.558 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -14.338 3.669 -11.686 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -14.235 2.005 -11.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -15.859 2.254 -12.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -16.630 1.779 -11.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -16.730 3.391 -11.994 1.00 0.00 H new ATOM 650 N ARG A 177 -12.147 2.162 -5.199 1.00 0.00 N ATOM 651 CA ARG A 177 -11.123 2.551 -4.237 1.00 0.00 C ATOM 652 C ARG A 177 -9.986 3.297 -4.928 1.00 0.00 C ATOM 653 O ARG A 177 -9.632 2.993 -6.067 1.00 0.00 O ATOM 654 CB ARG A 177 -10.576 1.316 -3.517 1.00 0.00 C ATOM 655 CG ARG A 177 -10.247 1.563 -2.054 1.00 0.00 C ATOM 656 CD ARG A 177 -8.838 2.110 -1.885 1.00 0.00 C ATOM 657 NE ARG A 177 -8.740 3.028 -0.751 1.00 0.00 N ATOM 658 CZ ARG A 177 -7.653 3.743 -0.471 1.00 0.00 C ATOM 659 NH1 ARG A 177 -6.572 3.651 -1.235 1.00 0.00 N ATOM 660 NH2 ARG A 177 -7.647 4.555 0.579 1.00 0.00 N ATOM 0 H ARG A 177 -11.831 1.496 -5.904 1.00 0.00 H new ATOM 0 HA ARG A 177 -11.579 3.217 -3.505 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -11.308 0.511 -3.586 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -9.677 0.974 -4.031 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -10.965 2.267 -1.632 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -10.347 0.632 -1.495 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -8.142 1.283 -1.743 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -8.538 2.626 -2.797 1.00 0.00 H new ATOM 0 HE ARG A 177 -9.551 3.126 -0.140 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -6.570 3.029 -2.043 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -5.743 4.202 -1.014 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -8.475 4.630 1.170 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -6.815 5.104 0.795 1.00 0.00 H new ATOM 674 N TYR A 178 -9.417 4.278 -4.231 1.00 0.00 N ATOM 675 CA TYR A 178 -8.322 5.067 -4.781 1.00 0.00 C ATOM 676 C TYR A 178 -7.047 4.238 -4.888 1.00 0.00 C ATOM 677 O TYR A 178 -6.566 3.687 -3.897 1.00 0.00 O ATOM 678 CB TYR A 178 -8.071 6.301 -3.913 1.00 0.00 C ATOM 679 CG TYR A 178 -7.117 7.297 -4.534 1.00 0.00 C ATOM 680 CD1 TYR A 178 -7.501 8.068 -5.624 1.00 0.00 C ATOM 681 CD2 TYR A 178 -5.832 7.465 -4.031 1.00 0.00 C ATOM 682 CE1 TYR A 178 -6.632 8.978 -6.196 1.00 0.00 C ATOM 683 CE2 TYR A 178 -4.958 8.375 -4.596 1.00 0.00 C ATOM 684 CZ TYR A 178 -5.363 9.128 -5.679 1.00 0.00 C ATOM 685 OH TYR A 178 -4.495 10.033 -6.244 1.00 0.00 O ATOM 0 H TYR A 178 -9.697 4.544 -3.287 1.00 0.00 H new ATOM 0 HA TYR A 178 -8.607 5.386 -5.783 1.00 0.00 H new ATOM 0 HB2 TYR A 178 -9.022 6.796 -3.717 1.00 0.00 H new ATOM 0 HB3 TYR A 178 -7.673 5.982 -2.950 1.00 0.00 H new ATOM 0 HD1 TYR A 178 -8.495 7.954 -6.031 1.00 0.00 H new ATOM 0 HD2 TYR A 178 -5.511 6.875 -3.185 1.00 0.00 H new ATOM 0 HE1 TYR A 178 -6.946 9.569 -7.044 1.00 0.00 H new ATOM 0 HE2 TYR A 178 -3.964 8.496 -4.192 1.00 0.00 H new ATOM 0 HH TYR A 178 -3.843 10.324 -5.573 1.00 0.00 H new ATOM 695 N CYS A 179 -6.502 4.154 -6.098 1.00 0.00 N ATOM 696 CA CYS A 179 -5.281 3.394 -6.338 1.00 0.00 C ATOM 697 C CYS A 179 -4.067 4.317 -6.362 1.00 0.00 C ATOM 698 O CYS A 179 -3.891 5.100 -7.293 1.00 0.00 O ATOM 699 CB CYS A 179 -5.383 2.634 -7.662 1.00 0.00 C ATOM 700 SG CYS A 179 -4.155 1.320 -7.859 1.00 0.00 S ATOM 0 H CYS A 179 -6.888 4.604 -6.928 1.00 0.00 H new ATOM 0 HA CYS A 179 -5.158 2.679 -5.524 1.00 0.00 H new ATOM 0 HB2 CYS A 179 -6.380 2.200 -7.743 1.00 0.00 H new ATOM 0 HB3 CYS A 179 -5.276 3.342 -8.484 1.00 0.00 H new ATOM 0 HG CYS A 179 -4.184 0.878 -9.081 1.00 0.00 H new ATOM 705 N GLN A 180 -3.235 4.222 -5.331 1.00 0.00 N ATOM 706 CA GLN A 180 -2.041 5.055 -5.233 1.00 0.00 C ATOM 707 C GLN A 180 -0.973 4.631 -6.244 1.00 0.00 C ATOM 708 O GLN A 180 0.042 5.309 -6.400 1.00 0.00 O ATOM 709 CB GLN A 180 -1.468 4.987 -3.817 1.00 0.00 C ATOM 710 CG GLN A 180 -2.358 5.635 -2.768 1.00 0.00 C ATOM 711 CD GLN A 180 -1.921 5.310 -1.354 1.00 0.00 C ATOM 712 OE1 GLN A 180 -0.839 5.704 -0.919 1.00 0.00 O ATOM 713 NE2 GLN A 180 -2.765 4.587 -0.626 1.00 0.00 N ATOM 0 H GLN A 180 -3.365 3.577 -4.551 1.00 0.00 H new ATOM 0 HA GLN A 180 -2.333 6.080 -5.461 1.00 0.00 H new ATOM 0 HB2 GLN A 180 -1.306 3.943 -3.549 1.00 0.00 H new ATOM 0 HB3 GLN A 180 -0.493 5.474 -3.805 1.00 0.00 H new ATOM 0 HG2 GLN A 180 -2.350 6.716 -2.908 1.00 0.00 H new ATOM 0 HG3 GLN A 180 -3.386 5.302 -2.913 1.00 0.00 H new ATOM 0 HE21 GLN A 180 -3.652 4.281 -1.027 1.00 0.00 H new ATOM 0 HE22 GLN A 180 -2.526 4.338 0.334 1.00 0.00 H new ATOM 722 N GLN A 181 -1.200 3.510 -6.924 1.00 0.00 N ATOM 723 CA GLN A 181 -0.245 3.012 -7.909 1.00 0.00 C ATOM 724 C GLN A 181 -0.523 3.591 -9.294 1.00 0.00 C ATOM 725 O GLN A 181 0.392 3.741 -10.105 1.00 0.00 O ATOM 726 CB GLN A 181 -0.292 1.483 -7.963 1.00 0.00 C ATOM 727 CG GLN A 181 0.686 0.811 -7.014 1.00 0.00 C ATOM 728 CD GLN A 181 1.807 0.094 -7.741 1.00 0.00 C ATOM 729 OE1 GLN A 181 2.912 0.621 -7.875 1.00 0.00 O ATOM 730 NE2 GLN A 181 1.528 -1.114 -8.216 1.00 0.00 N ATOM 0 H GLN A 181 -2.033 2.932 -6.812 1.00 0.00 H new ATOM 0 HA GLN A 181 0.751 3.332 -7.602 1.00 0.00 H new ATOM 0 HB2 GLN A 181 -1.302 1.150 -7.726 1.00 0.00 H new ATOM 0 HB3 GLN A 181 -0.080 1.157 -8.981 1.00 0.00 H new ATOM 0 HG2 GLN A 181 1.112 1.560 -6.347 1.00 0.00 H new ATOM 0 HG3 GLN A 181 0.148 0.097 -6.390 1.00 0.00 H new ATOM 0 HE21 GLN A 181 0.599 -1.513 -8.082 1.00 0.00 H new ATOM 0 HE22 GLN A 181 2.243 -1.644 -8.715 1.00 0.00 H new ATOM 739 N CYS A 182 -1.785 3.905 -9.565 1.00 0.00 N ATOM 740 CA CYS A 182 -2.170 4.459 -10.862 1.00 0.00 C ATOM 741 C CYS A 182 -2.807 5.838 -10.713 1.00 0.00 C ATOM 742 O CYS A 182 -2.748 6.661 -11.627 1.00 0.00 O ATOM 743 CB CYS A 182 -3.140 3.515 -11.574 1.00 0.00 C ATOM 744 SG CYS A 182 -2.635 1.779 -11.545 1.00 0.00 S ATOM 0 H CYS A 182 -2.557 3.787 -8.909 1.00 0.00 H new ATOM 0 HA CYS A 182 -1.264 4.566 -11.459 1.00 0.00 H new ATOM 0 HB2 CYS A 182 -4.123 3.604 -11.111 1.00 0.00 H new ATOM 0 HB3 CYS A 182 -3.246 3.834 -12.611 1.00 0.00 H new ATOM 0 HG CYS A 182 -3.519 1.059 -12.170 1.00 0.00 H new ATOM 749 N GLY A 183 -3.420 6.086 -9.560 1.00 0.00 N ATOM 750 CA GLY A 183 -4.061 7.366 -9.321 1.00 0.00 C ATOM 751 C GLY A 183 -5.541 7.336 -9.641 1.00 0.00 C ATOM 752 O GLY A 183 -6.354 7.899 -8.908 1.00 0.00 O ATOM 0 H GLY A 183 -3.484 5.424 -8.787 1.00 0.00 H new ATOM 0 HA2 GLY A 183 -3.923 7.650 -8.278 1.00 0.00 H new ATOM 0 HA3 GLY A 183 -3.576 8.132 -9.927 1.00 0.00 H new ATOM 756 N LYS A 184 -5.893 6.675 -10.740 1.00 0.00 N ATOM 757 CA LYS A 184 -7.286 6.572 -11.157 1.00 0.00 C ATOM 758 C LYS A 184 -8.097 5.769 -10.146 1.00 0.00 C ATOM 759 O LYS A 184 -7.584 5.367 -9.102 1.00 0.00 O ATOM 760 CB LYS A 184 -7.381 5.919 -12.538 1.00 0.00 C ATOM 761 CG LYS A 184 -6.441 6.528 -13.565 1.00 0.00 C ATOM 762 CD LYS A 184 -6.730 6.004 -14.963 1.00 0.00 C ATOM 763 CE LYS A 184 -5.832 6.660 -16.000 1.00 0.00 C ATOM 764 NZ LYS A 184 -4.636 5.828 -16.306 1.00 0.00 N ATOM 0 H LYS A 184 -5.232 6.203 -11.357 1.00 0.00 H new ATOM 0 HA LYS A 184 -7.699 7.579 -11.210 1.00 0.00 H new ATOM 0 HB2 LYS A 184 -7.162 4.855 -12.443 1.00 0.00 H new ATOM 0 HB3 LYS A 184 -8.405 6.003 -12.901 1.00 0.00 H new ATOM 0 HG2 LYS A 184 -6.542 7.613 -13.554 1.00 0.00 H new ATOM 0 HG3 LYS A 184 -5.409 6.301 -13.296 1.00 0.00 H new ATOM 0 HD2 LYS A 184 -6.585 4.924 -14.985 1.00 0.00 H new ATOM 0 HD3 LYS A 184 -7.774 6.190 -15.214 1.00 0.00 H new ATOM 0 HE2 LYS A 184 -6.399 6.831 -16.915 1.00 0.00 H new ATOM 0 HE3 LYS A 184 -5.511 7.636 -15.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 184 -4.050 6.311 -17.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 184 -4.081 5.686 -15.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 184 -4.941 4.905 -16.677 1.00 0.00 H new ATOM 778 N PHE A 185 -9.368 5.539 -10.460 1.00 0.00 N ATOM 779 CA PHE A 185 -10.249 4.783 -9.578 1.00 0.00 C ATOM 780 C PHE A 185 -10.388 3.340 -10.054 1.00 0.00 C ATOM 781 O PHE A 185 -10.395 3.070 -11.255 1.00 0.00 O ATOM 782 CB PHE A 185 -11.626 5.444 -9.509 1.00 0.00 C ATOM 783 CG PHE A 185 -11.689 6.601 -8.552 1.00 0.00 C ATOM 784 CD1 PHE A 185 -11.342 6.434 -7.221 1.00 0.00 C ATOM 785 CD2 PHE A 185 -12.095 7.854 -8.984 1.00 0.00 C ATOM 786 CE1 PHE A 185 -11.399 7.496 -6.338 1.00 0.00 C ATOM 787 CE2 PHE A 185 -12.153 8.920 -8.105 1.00 0.00 C ATOM 788 CZ PHE A 185 -11.805 8.739 -6.781 1.00 0.00 C ATOM 0 H PHE A 185 -9.811 5.866 -11.319 1.00 0.00 H new ATOM 0 HA PHE A 185 -9.806 4.777 -8.582 1.00 0.00 H new ATOM 0 HB2 PHE A 185 -11.904 5.791 -10.504 1.00 0.00 H new ATOM 0 HB3 PHE A 185 -12.364 4.698 -9.214 1.00 0.00 H new ATOM 0 HD1 PHE A 185 -11.024 5.464 -6.870 1.00 0.00 H new ATOM 0 HD2 PHE A 185 -12.369 7.999 -10.018 1.00 0.00 H new ATOM 0 HE1 PHE A 185 -11.126 7.354 -5.303 1.00 0.00 H new ATOM 0 HE2 PHE A 185 -12.470 9.892 -8.453 1.00 0.00 H new ATOM 0 HZ PHE A 185 -11.850 9.570 -6.092 1.00 0.00 H new ATOM 798 N HIS A 186 -10.496 2.417 -9.103 1.00 0.00 N ATOM 799 CA HIS A 186 -10.632 1.000 -9.425 1.00 0.00 C ATOM 800 C HIS A 186 -11.800 0.379 -8.666 1.00 0.00 C ATOM 801 O HIS A 186 -12.325 0.969 -7.721 1.00 0.00 O ATOM 802 CB HIS A 186 -9.339 0.254 -9.094 1.00 0.00 C ATOM 803 CG HIS A 186 -8.190 0.626 -9.980 1.00 0.00 C ATOM 804 ND1 HIS A 186 -8.354 1.228 -11.210 1.00 0.00 N ATOM 805 CD2 HIS A 186 -6.856 0.479 -9.807 1.00 0.00 C ATOM 806 CE1 HIS A 186 -7.168 1.435 -11.758 1.00 0.00 C ATOM 807 NE2 HIS A 186 -6.244 0.989 -10.927 1.00 0.00 N ATOM 0 H HIS A 186 -10.492 2.624 -8.104 1.00 0.00 H new ATOM 0 HA HIS A 186 -10.830 0.913 -10.493 1.00 0.00 H new ATOM 0 HB2 HIS A 186 -9.068 0.455 -8.058 1.00 0.00 H new ATOM 0 HB3 HIS A 186 -9.517 -0.818 -9.174 1.00 0.00 H new ATOM 0 HD1 HIS A 186 -9.250 1.475 -11.631 1.00 0.00 H new ATOM 0 HD2 HIS A 186 -6.365 0.043 -8.950 1.00 0.00 H new ATOM 0 HE1 HIS A 186 -6.987 1.891 -12.720 1.00 0.00 H new ATOM 815 N LEU A 187 -12.202 -0.817 -9.086 1.00 0.00 N ATOM 816 CA LEU A 187 -13.308 -1.520 -8.445 1.00 0.00 C ATOM 817 C LEU A 187 -12.866 -2.147 -7.125 1.00 0.00 C ATOM 818 O LEU A 187 -11.749 -2.652 -7.010 1.00 0.00 O ATOM 819 CB LEU A 187 -13.861 -2.599 -9.381 1.00 0.00 C ATOM 820 CG LEU A 187 -15.154 -2.221 -10.109 1.00 0.00 C ATOM 821 CD1 LEU A 187 -15.589 -3.342 -11.040 1.00 0.00 C ATOM 822 CD2 LEU A 187 -16.254 -1.902 -9.107 1.00 0.00 C ATOM 0 H LEU A 187 -11.779 -1.319 -9.867 1.00 0.00 H new ATOM 0 HA LEU A 187 -14.094 -0.795 -8.232 1.00 0.00 H new ATOM 0 HB2 LEU A 187 -13.100 -2.840 -10.124 1.00 0.00 H new ATOM 0 HB3 LEU A 187 -14.039 -3.505 -8.802 1.00 0.00 H new ATOM 0 HG LEU A 187 -14.965 -1.331 -10.709 1.00 0.00 H new ATOM 0 HD11 LEU A 187 -16.509 -3.056 -11.549 1.00 0.00 H new ATOM 0 HD12 LEU A 187 -14.808 -3.525 -11.778 1.00 0.00 H new ATOM 0 HD13 LEU A 187 -15.761 -4.249 -10.461 1.00 0.00 H new ATOM 0 HD21 LEU A 187 -17.166 -1.635 -9.641 1.00 0.00 H new ATOM 0 HD22 LEU A 187 -16.441 -2.775 -8.482 1.00 0.00 H new ATOM 0 HD23 LEU A 187 -15.943 -1.067 -8.479 1.00 0.00 H new ATOM 834 N LEU A 188 -13.751 -2.109 -6.134 1.00 0.00 N ATOM 835 CA LEU A 188 -13.454 -2.671 -4.822 1.00 0.00 C ATOM 836 C LEU A 188 -13.253 -4.191 -4.882 1.00 0.00 C ATOM 837 O LEU A 188 -12.348 -4.716 -4.234 1.00 0.00 O ATOM 838 CB LEU A 188 -14.564 -2.321 -3.824 1.00 0.00 C ATOM 839 CG LEU A 188 -14.129 -1.413 -2.672 1.00 0.00 C ATOM 840 CD1 LEU A 188 -14.037 0.031 -3.137 1.00 0.00 C ATOM 841 CD2 LEU A 188 -15.096 -1.538 -1.503 1.00 0.00 C ATOM 0 H LEU A 188 -14.680 -1.695 -6.215 1.00 0.00 H new ATOM 0 HA LEU A 188 -12.517 -2.228 -4.483 1.00 0.00 H new ATOM 0 HB2 LEU A 188 -15.378 -1.836 -4.363 1.00 0.00 H new ATOM 0 HB3 LEU A 188 -14.964 -3.246 -3.408 1.00 0.00 H new ATOM 0 HG LEU A 188 -13.141 -1.729 -2.337 1.00 0.00 H new ATOM 0 HD11 LEU A 188 -13.726 0.662 -2.304 1.00 0.00 H new ATOM 0 HD12 LEU A 188 -13.307 0.108 -3.943 1.00 0.00 H new ATOM 0 HD13 LEU A 188 -15.012 0.360 -3.498 1.00 0.00 H new ATOM 0 HD21 LEU A 188 -14.772 -0.886 -0.692 1.00 0.00 H new ATOM 0 HD22 LEU A 188 -16.096 -1.248 -1.825 1.00 0.00 H new ATOM 0 HD23 LEU A 188 -15.113 -2.570 -1.154 1.00 0.00 H new ATOM 853 N PRO A 189 -14.084 -4.931 -5.650 1.00 0.00 N ATOM 854 CA PRO A 189 -13.950 -6.390 -5.751 1.00 0.00 C ATOM 855 C PRO A 189 -12.624 -6.814 -6.375 1.00 0.00 C ATOM 856 O PRO A 189 -12.231 -7.977 -6.289 1.00 0.00 O ATOM 857 CB PRO A 189 -15.122 -6.808 -6.646 1.00 0.00 C ATOM 858 CG PRO A 189 -15.492 -5.577 -7.395 1.00 0.00 C ATOM 859 CD PRO A 189 -15.206 -4.429 -6.470 1.00 0.00 C ATOM 0 HA PRO A 189 -13.964 -6.861 -4.768 1.00 0.00 H new ATOM 0 HB2 PRO A 189 -14.834 -7.611 -7.324 1.00 0.00 H new ATOM 0 HB3 PRO A 189 -15.959 -7.176 -6.053 1.00 0.00 H new ATOM 0 HG2 PRO A 189 -14.913 -5.491 -8.315 1.00 0.00 H new ATOM 0 HG3 PRO A 189 -16.544 -5.595 -7.681 1.00 0.00 H new ATOM 0 HD2 PRO A 189 -14.933 -3.528 -7.019 1.00 0.00 H new ATOM 0 HD3 PRO A 189 -16.072 -4.179 -5.858 1.00 0.00 H new ATOM 867 N ASP A 190 -11.932 -5.865 -7.004 1.00 0.00 N ATOM 868 CA ASP A 190 -10.650 -6.148 -7.636 1.00 0.00 C ATOM 869 C ASP A 190 -9.495 -5.806 -6.699 1.00 0.00 C ATOM 870 O ASP A 190 -8.464 -5.287 -7.129 1.00 0.00 O ATOM 871 CB ASP A 190 -10.515 -5.358 -8.939 1.00 0.00 C ATOM 872 CG ASP A 190 -9.768 -6.131 -10.008 1.00 0.00 C ATOM 873 OD1 ASP A 190 -8.617 -6.540 -9.752 1.00 0.00 O ATOM 874 OD2 ASP A 190 -10.333 -6.325 -11.105 1.00 0.00 O ATOM 0 H ASP A 190 -12.239 -4.896 -7.088 1.00 0.00 H new ATOM 0 HA ASP A 190 -10.610 -7.214 -7.859 1.00 0.00 H new ATOM 0 HB2 ASP A 190 -11.507 -5.099 -9.308 1.00 0.00 H new ATOM 0 HB3 ASP A 190 -9.994 -4.421 -8.741 1.00 0.00 H new