USER MOD reduce.3.24.130724 H: found=0, std=0, add=769, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 768 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 152 SER OG : rot 79:sc= 0.37 USER MOD Set 1.2: A 164 ASN :FLIP amide:sc= -1.26 F(o=-2.2!,f=-0.89) USER MOD Set 2.1: A 95 SER OG : rot 158:sc= -0.0597 USER MOD Set 2.2: A 101 THR OG1 : rot 0:sc= -0.664! USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN :FLIP amide:sc= -0.718 F(o=-1.6,f=-0.72) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.444 X(o=-0.44,f=-0.027) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -1.43 K(o=-1.4,f=-3.6!) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 88 SER OG : rot -12:sc= 0.685! USER MOD Single : A 98 ASN : amide:sc= -2.16! C(o=-2.2!,f=-5.1!) USER MOD Single : A 99 MET CE :methyl 144:sc= -0.0031 (180deg=-1.05) USER MOD Single : A 104 SER OG : rot -30:sc= 0.114 USER MOD Single : A 106 GLN : amide:sc= -0.198 K(o=-0.2,f=-0.81) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 120 ASN :FLIP amide:sc= -0.0349 F(o=-1.6!,f=-0.035) USER MOD Single : A 124 MET CE :methyl -159:sc= -0.0454 (180deg=-0.589) USER MOD Single : A 125 ASN : amide:sc= -10.2! C(o=-10!,f=-11!) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 133 HIS : no HD1:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 137 GLN :FLIP amide:sc= -0.301 F(o=-1.6!,f=-0.3) USER MOD Single : A 138 LYS NZ :NH3+ -166:sc=-0.00867 (180deg=-0.204) USER MOD Single : A 140 TYR OH : rot 180:sc= -0.0871 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 147 GLN : amide:sc= -0.261 X(o=-0.26,f=0) USER MOD Single : A 156 ASN : amide:sc= -0.145 K(o=-0.15,f=-1.8!) USER MOD Single : A 169 THR OG1 : rot 180:sc= 0 USER MOD Single : A 170 TYR OH : rot 180:sc= 0 USER MOD Single : A 173 THR OG1 : rot 66:sc= 1.18 USER MOD Single : A 176 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD ----------------------------------------------------------------- ATOM 115 N LEU A 53 40.384 -4.701 -19.276 1.00 0.00 N ATOM 116 CA LEU A 53 39.337 -4.539 -18.283 1.00 0.00 C ATOM 117 C LEU A 53 39.005 -5.872 -17.631 1.00 0.00 C ATOM 118 O LEU A 53 39.336 -6.934 -18.159 1.00 0.00 O ATOM 119 CB LEU A 53 38.082 -3.967 -18.932 1.00 0.00 C ATOM 120 CG LEU A 53 38.385 -2.581 -19.533 1.00 0.00 C ATOM 121 CD1 LEU A 53 37.143 -2.048 -20.294 1.00 0.00 C ATOM 122 CD2 LEU A 53 38.790 -1.593 -18.415 1.00 0.00 C ATOM 0 HA LEU A 53 39.697 -3.851 -17.518 1.00 0.00 H new ATOM 0 HB2 LEU A 53 37.726 -4.641 -19.712 1.00 0.00 H new ATOM 0 HB3 LEU A 53 37.285 -3.886 -18.193 1.00 0.00 H new ATOM 0 HG LEU A 53 39.214 -2.675 -20.235 1.00 0.00 H new ATOM 0 HD11 LEU A 53 37.367 -1.068 -20.715 1.00 0.00 H new ATOM 0 HD12 LEU A 53 36.885 -2.738 -21.098 1.00 0.00 H new ATOM 0 HD13 LEU A 53 36.303 -1.963 -19.605 1.00 0.00 H new ATOM 0 HD21 LEU A 53 39.002 -0.617 -18.851 1.00 0.00 H new ATOM 0 HD22 LEU A 53 37.974 -1.501 -17.698 1.00 0.00 H new ATOM 0 HD23 LEU A 53 39.680 -1.964 -17.906 1.00 0.00 H new ATOM 134 N LYS A 54 38.351 -5.806 -16.471 1.00 0.00 N ATOM 135 CA LYS A 54 37.977 -7.006 -15.733 1.00 0.00 C ATOM 136 C LYS A 54 36.472 -7.045 -15.487 1.00 0.00 C ATOM 137 O LYS A 54 35.765 -6.047 -15.670 1.00 0.00 O ATOM 138 CB LYS A 54 38.711 -7.052 -14.402 1.00 0.00 C ATOM 139 CG LYS A 54 40.217 -7.198 -14.654 1.00 0.00 C ATOM 140 CD LYS A 54 40.980 -7.130 -13.324 1.00 0.00 C ATOM 141 CE LYS A 54 40.853 -8.459 -12.567 1.00 0.00 C ATOM 142 NZ LYS A 54 41.818 -8.475 -11.431 1.00 0.00 N ATOM 0 H LYS A 54 38.071 -4.933 -16.025 1.00 0.00 H new ATOM 0 HA LYS A 54 38.256 -7.873 -16.332 1.00 0.00 H new ATOM 0 HB2 LYS A 54 38.513 -6.143 -13.834 1.00 0.00 H new ATOM 0 HB3 LYS A 54 38.349 -7.888 -13.803 1.00 0.00 H new ATOM 0 HG2 LYS A 54 40.421 -8.146 -15.152 1.00 0.00 H new ATOM 0 HG3 LYS A 54 40.561 -6.408 -15.321 1.00 0.00 H new ATOM 0 HD2 LYS A 54 42.031 -6.909 -13.511 1.00 0.00 H new ATOM 0 HD3 LYS A 54 40.587 -6.317 -12.713 1.00 0.00 H new ATOM 0 HE2 LYS A 54 39.836 -8.583 -12.196 1.00 0.00 H new ATOM 0 HE3 LYS A 54 41.052 -9.294 -13.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 41.734 -9.375 -10.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 42.786 -8.375 -11.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 41.608 -7.687 -10.786 1.00 0.00 H new ATOM 156 N GLY A 55 35.988 -8.209 -15.082 1.00 0.00 N ATOM 157 CA GLY A 55 34.569 -8.385 -14.818 1.00 0.00 C ATOM 158 C GLY A 55 33.761 -8.328 -16.111 1.00 0.00 C ATOM 159 O GLY A 55 34.263 -7.893 -17.149 1.00 0.00 O ATOM 0 H GLY A 55 36.555 -9.043 -14.929 1.00 0.00 H new ATOM 0 HA2 GLY A 55 34.403 -9.342 -14.323 1.00 0.00 H new ATOM 0 HA3 GLY A 55 34.224 -7.609 -14.135 1.00 0.00 H new ATOM 163 N PRO A 56 32.525 -8.752 -16.063 1.00 0.00 N ATOM 164 CA PRO A 56 31.618 -8.750 -17.251 1.00 0.00 C ATOM 165 C PRO A 56 31.249 -7.332 -17.683 1.00 0.00 C ATOM 166 O PRO A 56 31.869 -6.365 -17.253 1.00 0.00 O ATOM 167 CB PRO A 56 30.381 -9.529 -16.770 1.00 0.00 C ATOM 168 CG PRO A 56 30.385 -9.381 -15.280 1.00 0.00 C ATOM 169 CD PRO A 56 31.856 -9.288 -14.866 1.00 0.00 C ATOM 0 HA PRO A 56 32.085 -9.198 -18.128 1.00 0.00 H new ATOM 0 HB2 PRO A 56 29.467 -9.125 -17.204 1.00 0.00 H new ATOM 0 HB3 PRO A 56 30.436 -10.578 -17.063 1.00 0.00 H new ATOM 0 HG2 PRO A 56 29.837 -8.489 -14.976 1.00 0.00 H new ATOM 0 HG3 PRO A 56 29.899 -10.232 -14.803 1.00 0.00 H new ATOM 0 HD2 PRO A 56 31.989 -8.632 -14.006 1.00 0.00 H new ATOM 0 HD3 PRO A 56 32.256 -10.263 -14.587 1.00 0.00 H new ATOM 177 N ASN A 57 30.236 -7.227 -18.536 1.00 0.00 N ATOM 178 CA ASN A 57 29.785 -5.928 -19.025 1.00 0.00 C ATOM 179 C ASN A 57 30.925 -5.202 -19.731 1.00 0.00 C ATOM 180 O ASN A 57 31.042 -3.979 -19.641 1.00 0.00 O ATOM 181 CB ASN A 57 29.294 -5.070 -17.858 1.00 0.00 C ATOM 182 CG ASN A 57 28.347 -5.870 -16.982 1.00 0.00 C ATOM 183 OD1 ASN A 57 27.737 -6.900 -17.480 1.00 0.00 O flip ATOM 184 ND2 ASN A 57 28.162 -5.550 -15.807 1.00 0.00 N flip ATOM 0 H ASN A 57 29.713 -8.022 -18.902 1.00 0.00 H new ATOM 0 HA ASN A 57 28.969 -6.091 -19.729 1.00 0.00 H new ATOM 0 HB2 ASN A 57 30.143 -4.725 -17.268 1.00 0.00 H new ATOM 0 HB3 ASN A 57 28.788 -4.182 -18.237 1.00 0.00 H new ATOM 0 HD21 ASN A 57 28.643 -4.739 -15.417 1.00 0.00 H new ATOM 0 HD22 ASN A 57 27.528 -6.096 -15.224 1.00 0.00 H new ATOM 191 N VAL A 58 31.762 -5.964 -20.436 1.00 0.00 N ATOM 192 CA VAL A 58 32.899 -5.392 -21.159 1.00 0.00 C ATOM 193 C VAL A 58 32.563 -5.259 -22.638 1.00 0.00 C ATOM 194 O VAL A 58 31.982 -6.164 -23.236 1.00 0.00 O ATOM 195 CB VAL A 58 34.128 -6.291 -20.998 1.00 0.00 C ATOM 196 CG1 VAL A 58 33.880 -7.637 -21.679 1.00 0.00 C ATOM 197 CG2 VAL A 58 35.335 -5.611 -21.642 1.00 0.00 C ATOM 0 H VAL A 58 31.675 -6.977 -20.522 1.00 0.00 H new ATOM 0 HA VAL A 58 33.115 -4.406 -20.747 1.00 0.00 H new ATOM 0 HB VAL A 58 34.319 -6.457 -19.938 1.00 0.00 H new ATOM 0 HG11 VAL A 58 34.758 -8.272 -21.561 1.00 0.00 H new ATOM 0 HG12 VAL A 58 33.017 -8.122 -21.222 1.00 0.00 H new ATOM 0 HG13 VAL A 58 33.687 -7.478 -22.740 1.00 0.00 H new ATOM 0 HG21 VAL A 58 36.213 -6.247 -21.530 1.00 0.00 H new ATOM 0 HG22 VAL A 58 35.138 -5.447 -22.701 1.00 0.00 H new ATOM 0 HG23 VAL A 58 35.516 -4.653 -21.154 1.00 0.00 H new ATOM 207 N CYS A 59 32.925 -4.121 -23.224 1.00 0.00 N ATOM 208 CA CYS A 59 32.654 -3.870 -24.637 1.00 0.00 C ATOM 209 C CYS A 59 33.827 -3.136 -25.278 1.00 0.00 C ATOM 210 O CYS A 59 34.796 -2.784 -24.608 1.00 0.00 O ATOM 211 CB CYS A 59 31.397 -3.016 -24.771 1.00 0.00 C ATOM 212 SG CYS A 59 29.924 -4.019 -24.424 1.00 0.00 S ATOM 0 H CYS A 59 33.405 -3.360 -22.744 1.00 0.00 H new ATOM 0 HA CYS A 59 32.510 -4.825 -25.142 1.00 0.00 H new ATOM 0 HB2 CYS A 59 31.444 -2.174 -24.081 1.00 0.00 H new ATOM 0 HB3 CYS A 59 31.335 -2.600 -25.777 1.00 0.00 H new ATOM 217 N GLY A 60 33.731 -2.904 -26.583 1.00 0.00 N ATOM 218 CA GLY A 60 34.787 -2.207 -27.307 1.00 0.00 C ATOM 219 C GLY A 60 35.902 -3.167 -27.699 1.00 0.00 C ATOM 220 O GLY A 60 36.023 -4.256 -27.137 1.00 0.00 O ATOM 0 H GLY A 60 32.937 -3.187 -27.158 1.00 0.00 H new ATOM 0 HA2 GLY A 60 34.373 -1.740 -28.201 1.00 0.00 H new ATOM 0 HA3 GLY A 60 35.192 -1.407 -26.687 1.00 0.00 H new ATOM 224 N SER A 61 36.718 -2.757 -28.663 1.00 0.00 N ATOM 225 CA SER A 61 37.825 -3.582 -29.121 1.00 0.00 C ATOM 226 C SER A 61 38.985 -3.507 -28.136 1.00 0.00 C ATOM 227 O SER A 61 38.971 -2.694 -27.213 1.00 0.00 O ATOM 228 CB SER A 61 38.288 -3.121 -30.497 1.00 0.00 C ATOM 229 OG SER A 61 37.155 -2.930 -31.335 1.00 0.00 O ATOM 0 H SER A 61 36.633 -1.860 -29.141 1.00 0.00 H new ATOM 0 HA SER A 61 37.483 -4.615 -29.186 1.00 0.00 H new ATOM 0 HB2 SER A 61 38.852 -2.192 -30.411 1.00 0.00 H new ATOM 0 HB3 SER A 61 38.958 -3.861 -30.935 1.00 0.00 H new ATOM 0 HG SER A 61 37.450 -2.632 -32.221 1.00 0.00 H new ATOM 235 N ARG A 62 39.987 -4.353 -28.337 1.00 0.00 N ATOM 236 CA ARG A 62 41.149 -4.367 -27.458 1.00 0.00 C ATOM 237 C ARG A 62 41.844 -3.011 -27.475 1.00 0.00 C ATOM 238 O ARG A 62 42.250 -2.496 -26.432 1.00 0.00 O ATOM 239 CB ARG A 62 42.117 -5.452 -27.903 1.00 0.00 C ATOM 240 CG ARG A 62 43.289 -5.521 -26.923 1.00 0.00 C ATOM 241 CD ARG A 62 44.187 -6.701 -27.288 1.00 0.00 C ATOM 242 NE ARG A 62 43.486 -7.962 -27.067 1.00 0.00 N ATOM 243 CZ ARG A 62 43.952 -9.105 -27.566 1.00 0.00 C ATOM 244 NH1 ARG A 62 45.055 -9.114 -28.264 1.00 0.00 N ATOM 245 NH2 ARG A 62 43.303 -10.218 -27.357 1.00 0.00 N ATOM 0 H ARG A 62 40.019 -5.034 -29.096 1.00 0.00 H new ATOM 0 HA ARG A 62 40.818 -4.576 -26.441 1.00 0.00 H new ATOM 0 HB2 ARG A 62 41.607 -6.414 -27.945 1.00 0.00 H new ATOM 0 HB3 ARG A 62 42.481 -5.240 -28.908 1.00 0.00 H new ATOM 0 HG2 ARG A 62 43.859 -4.593 -26.955 1.00 0.00 H new ATOM 0 HG3 ARG A 62 42.919 -5.633 -25.904 1.00 0.00 H new ATOM 0 HD2 ARG A 62 44.491 -6.625 -28.332 1.00 0.00 H new ATOM 0 HD3 ARG A 62 45.096 -6.673 -26.688 1.00 0.00 H new ATOM 0 HE ARG A 62 42.624 -7.968 -26.521 1.00 0.00 H new ATOM 0 HH11 ARG A 62 45.562 -8.244 -28.428 1.00 0.00 H new ATOM 0 HH12 ARG A 62 45.410 -9.991 -28.645 1.00 0.00 H new ATOM 0 HH21 ARG A 62 42.441 -10.211 -26.812 1.00 0.00 H new ATOM 0 HH22 ARG A 62 43.658 -11.095 -27.738 1.00 0.00 H new ATOM 259 N TYR A 63 41.981 -2.438 -28.666 1.00 0.00 N ATOM 260 CA TYR A 63 42.627 -1.137 -28.808 1.00 0.00 C ATOM 261 C TYR A 63 41.842 -0.053 -28.072 1.00 0.00 C ATOM 262 O TYR A 63 42.425 0.829 -27.441 1.00 0.00 O ATOM 263 CB TYR A 63 42.750 -0.771 -30.282 1.00 0.00 C ATOM 264 CG TYR A 63 43.636 -1.776 -30.978 1.00 0.00 C ATOM 265 CD1 TYR A 63 45.028 -1.684 -30.860 1.00 0.00 C ATOM 266 CD2 TYR A 63 43.066 -2.804 -31.739 1.00 0.00 C ATOM 267 CE1 TYR A 63 45.849 -2.620 -31.503 1.00 0.00 C ATOM 268 CE2 TYR A 63 43.885 -3.738 -32.382 1.00 0.00 C ATOM 269 CZ TYR A 63 45.278 -3.646 -32.264 1.00 0.00 C ATOM 270 OH TYR A 63 46.086 -4.568 -32.898 1.00 0.00 O ATOM 0 H TYR A 63 41.656 -2.850 -29.541 1.00 0.00 H new ATOM 0 HA TYR A 63 43.622 -1.203 -28.367 1.00 0.00 H new ATOM 0 HB2 TYR A 63 41.764 -0.755 -30.747 1.00 0.00 H new ATOM 0 HB3 TYR A 63 43.167 0.231 -30.385 1.00 0.00 H new ATOM 0 HD1 TYR A 63 45.469 -0.892 -30.273 1.00 0.00 H new ATOM 0 HD2 TYR A 63 41.992 -2.876 -31.830 1.00 0.00 H new ATOM 0 HE1 TYR A 63 46.923 -2.549 -31.411 1.00 0.00 H new ATOM 0 HE2 TYR A 63 43.444 -4.530 -32.969 1.00 0.00 H new ATOM 0 HH TYR A 63 45.529 -5.213 -33.382 1.00 0.00 H new ATOM 280 N ASN A 64 40.513 -0.119 -28.166 1.00 0.00 N ATOM 281 CA ASN A 64 39.637 0.848 -27.525 1.00 0.00 C ATOM 282 C ASN A 64 38.616 0.142 -26.640 1.00 0.00 C ATOM 283 O ASN A 64 37.417 0.387 -26.742 1.00 0.00 O ATOM 284 CB ASN A 64 38.916 1.663 -28.584 1.00 0.00 C ATOM 285 CG ASN A 64 39.892 2.609 -29.274 1.00 0.00 C ATOM 286 OD1 ASN A 64 39.908 2.700 -30.502 1.00 0.00 O ATOM 287 ND2 ASN A 64 40.709 3.330 -28.553 1.00 0.00 N ATOM 0 H ASN A 64 40.020 -0.844 -28.688 1.00 0.00 H new ATOM 0 HA ASN A 64 40.242 1.508 -26.903 1.00 0.00 H new ATOM 0 HB2 ASN A 64 38.462 0.998 -29.319 1.00 0.00 H new ATOM 0 HB3 ASN A 64 38.107 2.233 -28.127 1.00 0.00 H new ATOM 0 HD21 ASN A 64 41.361 3.969 -29.007 1.00 0.00 H new ATOM 0 HD22 ASN A 64 40.695 3.254 -27.536 1.00 0.00 H new ATOM 294 N ALA A 65 39.103 -0.744 -25.782 1.00 0.00 N ATOM 295 CA ALA A 65 38.221 -1.482 -24.883 1.00 0.00 C ATOM 296 C ALA A 65 37.659 -0.558 -23.802 1.00 0.00 C ATOM 297 O ALA A 65 38.375 0.276 -23.249 1.00 0.00 O ATOM 298 CB ALA A 65 38.989 -2.627 -24.219 1.00 0.00 C ATOM 0 H ALA A 65 40.093 -0.969 -25.688 1.00 0.00 H new ATOM 0 HA ALA A 65 37.396 -1.886 -25.470 1.00 0.00 H new ATOM 0 HB1 ALA A 65 38.323 -3.172 -23.550 1.00 0.00 H new ATOM 0 HB2 ALA A 65 39.367 -3.304 -24.985 1.00 0.00 H new ATOM 0 HB3 ALA A 65 39.825 -2.222 -23.648 1.00 0.00 H new ATOM 304 N TYR A 66 36.373 -0.720 -23.509 1.00 0.00 N ATOM 305 CA TYR A 66 35.708 0.092 -22.492 1.00 0.00 C ATOM 306 C TYR A 66 34.455 -0.598 -21.973 1.00 0.00 C ATOM 307 O TYR A 66 33.959 -1.553 -22.572 1.00 0.00 O ATOM 308 CB TYR A 66 35.349 1.466 -23.052 1.00 0.00 C ATOM 309 CG TYR A 66 34.673 1.305 -24.392 1.00 0.00 C ATOM 310 CD1 TYR A 66 33.362 0.821 -24.470 1.00 0.00 C ATOM 311 CD2 TYR A 66 35.367 1.633 -25.563 1.00 0.00 C ATOM 312 CE1 TYR A 66 32.746 0.664 -25.717 1.00 0.00 C ATOM 313 CE2 TYR A 66 34.749 1.478 -26.810 1.00 0.00 C ATOM 314 CZ TYR A 66 33.439 0.990 -26.887 1.00 0.00 C ATOM 315 OH TYR A 66 32.831 0.832 -28.115 1.00 0.00 O ATOM 0 H TYR A 66 35.769 -1.406 -23.961 1.00 0.00 H new ATOM 0 HA TYR A 66 36.403 0.217 -21.661 1.00 0.00 H new ATOM 0 HB2 TYR A 66 34.689 1.991 -22.361 1.00 0.00 H new ATOM 0 HB3 TYR A 66 36.248 2.073 -23.157 1.00 0.00 H new ATOM 0 HD1 TYR A 66 32.825 0.569 -23.567 1.00 0.00 H new ATOM 0 HD2 TYR A 66 36.379 2.006 -25.504 1.00 0.00 H new ATOM 0 HE1 TYR A 66 31.734 0.291 -25.776 1.00 0.00 H new ATOM 0 HE2 TYR A 66 35.283 1.735 -27.713 1.00 0.00 H new ATOM 0 HH TYR A 66 33.450 1.105 -28.824 1.00 0.00 H new ATOM 325 N CYS A 67 33.938 -0.106 -20.855 1.00 0.00 N ATOM 326 CA CYS A 67 32.737 -0.691 -20.277 1.00 0.00 C ATOM 327 C CYS A 67 31.532 -0.404 -21.161 1.00 0.00 C ATOM 328 O CYS A 67 31.392 0.695 -21.696 1.00 0.00 O ATOM 329 CB CYS A 67 32.477 -0.138 -18.886 1.00 0.00 C ATOM 330 SG CYS A 67 33.869 -0.528 -17.801 1.00 0.00 S ATOM 0 H CYS A 67 34.324 0.684 -20.338 1.00 0.00 H new ATOM 0 HA CYS A 67 32.892 -1.768 -20.207 1.00 0.00 H new ATOM 0 HB2 CYS A 67 32.334 0.941 -18.935 1.00 0.00 H new ATOM 0 HB3 CYS A 67 31.559 -0.563 -18.481 1.00 0.00 H new ATOM 335 N CYS A 68 30.669 -1.402 -21.323 1.00 0.00 N ATOM 336 CA CYS A 68 29.492 -1.238 -22.164 1.00 0.00 C ATOM 337 C CYS A 68 28.671 -0.022 -21.731 1.00 0.00 C ATOM 338 O CYS A 68 28.619 0.300 -20.544 1.00 0.00 O ATOM 339 CB CYS A 68 28.632 -2.502 -22.124 1.00 0.00 C ATOM 340 SG CYS A 68 29.684 -3.951 -22.415 1.00 0.00 S ATOM 0 H CYS A 68 30.761 -2.320 -20.889 1.00 0.00 H new ATOM 0 HA CYS A 68 29.827 -1.071 -23.188 1.00 0.00 H new ATOM 0 HB2 CYS A 68 28.135 -2.587 -21.158 1.00 0.00 H new ATOM 0 HB3 CYS A 68 27.850 -2.448 -22.881 1.00 0.00 H new ATOM 345 N PRO A 69 28.028 0.660 -22.659 1.00 0.00 N ATOM 346 CA PRO A 69 27.203 1.854 -22.320 1.00 0.00 C ATOM 347 C PRO A 69 26.259 1.594 -21.144 1.00 0.00 C ATOM 348 O PRO A 69 25.473 0.648 -21.158 1.00 0.00 O ATOM 349 CB PRO A 69 26.388 2.103 -23.603 1.00 0.00 C ATOM 350 CG PRO A 69 27.194 1.515 -24.719 1.00 0.00 C ATOM 351 CD PRO A 69 28.036 0.389 -24.113 1.00 0.00 C ATOM 0 HA PRO A 69 27.821 2.698 -22.015 1.00 0.00 H new ATOM 0 HB2 PRO A 69 25.406 1.633 -23.540 1.00 0.00 H new ATOM 0 HB3 PRO A 69 26.222 3.169 -23.760 1.00 0.00 H new ATOM 0 HG2 PRO A 69 26.543 1.131 -25.505 1.00 0.00 H new ATOM 0 HG3 PRO A 69 27.832 2.272 -25.175 1.00 0.00 H new ATOM 0 HD2 PRO A 69 27.610 -0.589 -24.337 1.00 0.00 H new ATOM 0 HD3 PRO A 69 29.050 0.394 -24.512 1.00 0.00 H new ATOM 359 N GLY A 70 26.354 2.451 -20.130 1.00 0.00 N ATOM 360 CA GLY A 70 25.517 2.329 -18.938 1.00 0.00 C ATOM 361 C GLY A 70 26.292 1.700 -17.783 1.00 0.00 C ATOM 362 O GLY A 70 25.849 1.736 -16.637 1.00 0.00 O ATOM 0 H GLY A 70 27.003 3.238 -20.110 1.00 0.00 H new ATOM 0 HA2 GLY A 70 25.154 3.313 -18.643 1.00 0.00 H new ATOM 0 HA3 GLY A 70 24.641 1.721 -19.166 1.00 0.00 H new ATOM 366 N TRP A 71 27.461 1.131 -18.092 1.00 0.00 N ATOM 367 CA TRP A 71 28.304 0.503 -17.072 1.00 0.00 C ATOM 368 C TRP A 71 29.615 1.268 -16.928 1.00 0.00 C ATOM 369 O TRP A 71 30.259 1.615 -17.918 1.00 0.00 O ATOM 370 CB TRP A 71 28.598 -0.947 -17.464 1.00 0.00 C ATOM 371 CG TRP A 71 27.323 -1.727 -17.457 1.00 0.00 C ATOM 372 CD1 TRP A 71 26.471 -1.828 -18.502 1.00 0.00 C ATOM 373 CD2 TRP A 71 26.741 -2.517 -16.379 1.00 0.00 C ATOM 374 NE1 TRP A 71 25.401 -2.622 -18.133 1.00 0.00 N ATOM 375 CE2 TRP A 71 25.522 -3.070 -16.835 1.00 0.00 C ATOM 376 CE3 TRP A 71 27.143 -2.798 -15.062 1.00 0.00 C ATOM 377 CZ2 TRP A 71 24.733 -3.876 -16.019 1.00 0.00 C ATOM 378 CZ3 TRP A 71 26.350 -3.612 -14.235 1.00 0.00 C ATOM 379 CH2 TRP A 71 25.144 -4.148 -14.713 1.00 0.00 C ATOM 0 H TRP A 71 27.843 1.093 -19.037 1.00 0.00 H new ATOM 0 HA TRP A 71 27.775 0.522 -16.119 1.00 0.00 H new ATOM 0 HB2 TRP A 71 29.055 -0.983 -18.453 1.00 0.00 H new ATOM 0 HB3 TRP A 71 29.311 -1.387 -16.767 1.00 0.00 H new ATOM 0 HD1 TRP A 71 26.605 -1.364 -19.468 1.00 0.00 H new ATOM 0 HE1 TRP A 71 24.618 -2.849 -18.746 1.00 0.00 H new ATOM 0 HE3 TRP A 71 28.067 -2.386 -14.683 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 23.808 -4.289 -16.394 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 26.670 -3.826 -13.226 1.00 0.00 H new ATOM 0 HH2 TRP A 71 24.536 -4.769 -14.072 1.00 0.00 H new ATOM 390 N LYS A 72 30.008 1.519 -15.682 1.00 0.00 N ATOM 391 CA LYS A 72 31.247 2.239 -15.389 1.00 0.00 C ATOM 392 C LYS A 72 32.130 1.423 -14.457 1.00 0.00 C ATOM 393 O LYS A 72 31.861 0.251 -14.195 1.00 0.00 O ATOM 394 CB LYS A 72 30.939 3.584 -14.752 1.00 0.00 C ATOM 395 CG LYS A 72 30.149 3.379 -13.455 1.00 0.00 C ATOM 396 CD LYS A 72 29.898 4.727 -12.775 1.00 0.00 C ATOM 397 CE LYS A 72 31.194 5.219 -12.128 1.00 0.00 C ATOM 398 NZ LYS A 72 30.910 6.420 -11.295 1.00 0.00 N ATOM 0 H LYS A 72 29.484 1.233 -14.855 1.00 0.00 H new ATOM 0 HA LYS A 72 31.777 2.401 -16.328 1.00 0.00 H new ATOM 0 HB2 LYS A 72 31.866 4.118 -14.543 1.00 0.00 H new ATOM 0 HB3 LYS A 72 30.365 4.201 -15.444 1.00 0.00 H new ATOM 0 HG2 LYS A 72 29.199 2.890 -13.672 1.00 0.00 H new ATOM 0 HG3 LYS A 72 30.701 2.721 -12.784 1.00 0.00 H new ATOM 0 HD2 LYS A 72 29.544 5.455 -13.505 1.00 0.00 H new ATOM 0 HD3 LYS A 72 29.117 4.627 -12.021 1.00 0.00 H new ATOM 0 HE2 LYS A 72 31.627 4.431 -11.512 1.00 0.00 H new ATOM 0 HE3 LYS A 72 31.927 5.462 -12.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 31.791 6.754 -10.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 30.515 7.173 -11.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 30.225 6.173 -10.553 1.00 0.00 H new ATOM 412 N THR A 73 33.192 2.054 -13.957 1.00 0.00 N ATOM 413 CA THR A 73 34.127 1.390 -13.050 1.00 0.00 C ATOM 414 C THR A 73 34.389 2.259 -11.834 1.00 0.00 C ATOM 415 O THR A 73 34.004 3.428 -11.794 1.00 0.00 O ATOM 416 CB THR A 73 35.444 1.100 -13.769 1.00 0.00 C ATOM 417 OG1 THR A 73 36.257 2.264 -13.751 1.00 0.00 O ATOM 418 CG2 THR A 73 35.150 0.699 -15.213 1.00 0.00 C ATOM 0 H THR A 73 33.426 3.025 -14.165 1.00 0.00 H new ATOM 0 HA THR A 73 33.683 0.449 -12.725 1.00 0.00 H new ATOM 0 HB THR A 73 35.968 0.287 -13.266 1.00 0.00 H new ATOM 0 HG1 THR A 73 37.103 2.079 -14.210 1.00 0.00 H new ATOM 0 HG21 THR A 73 36.086 0.491 -15.731 1.00 0.00 H new ATOM 0 HG22 THR A 73 34.524 -0.193 -15.223 1.00 0.00 H new ATOM 0 HG23 THR A 73 34.629 1.513 -15.718 1.00 0.00 H new ATOM 426 N LEU A 74 35.036 1.673 -10.837 1.00 0.00 N ATOM 427 CA LEU A 74 35.340 2.384 -9.601 1.00 0.00 C ATOM 428 C LEU A 74 36.668 3.132 -9.728 1.00 0.00 C ATOM 429 O LEU A 74 37.455 2.858 -10.633 1.00 0.00 O ATOM 430 CB LEU A 74 35.386 1.396 -8.406 1.00 0.00 C ATOM 431 CG LEU A 74 34.630 0.097 -8.749 1.00 0.00 C ATOM 432 CD1 LEU A 74 35.565 -0.893 -9.458 1.00 0.00 C ATOM 433 CD2 LEU A 74 34.092 -0.536 -7.456 1.00 0.00 C ATOM 0 H LEU A 74 35.361 0.706 -10.859 1.00 0.00 H new ATOM 0 HA LEU A 74 34.550 3.112 -9.417 1.00 0.00 H new ATOM 0 HB2 LEU A 74 36.422 1.166 -8.157 1.00 0.00 H new ATOM 0 HB3 LEU A 74 34.942 1.860 -7.525 1.00 0.00 H new ATOM 0 HG LEU A 74 33.801 0.334 -9.415 1.00 0.00 H new ATOM 0 HD11 LEU A 74 35.017 -1.805 -9.694 1.00 0.00 H new ATOM 0 HD12 LEU A 74 35.938 -0.445 -10.379 1.00 0.00 H new ATOM 0 HD13 LEU A 74 36.404 -1.132 -8.805 1.00 0.00 H new ATOM 0 HD21 LEU A 74 33.557 -1.455 -7.696 1.00 0.00 H new ATOM 0 HD22 LEU A 74 34.924 -0.764 -6.789 1.00 0.00 H new ATOM 0 HD23 LEU A 74 33.413 0.161 -6.965 1.00 0.00 H new ATOM 445 N PRO A 75 36.934 4.058 -8.840 1.00 0.00 N ATOM 446 CA PRO A 75 38.204 4.836 -8.871 1.00 0.00 C ATOM 447 C PRO A 75 39.434 3.926 -8.913 1.00 0.00 C ATOM 448 O PRO A 75 39.615 3.062 -8.055 1.00 0.00 O ATOM 449 CB PRO A 75 38.164 5.650 -7.565 1.00 0.00 C ATOM 450 CG PRO A 75 36.721 5.730 -7.182 1.00 0.00 C ATOM 451 CD PRO A 75 36.058 4.468 -7.725 1.00 0.00 C ATOM 0 HA PRO A 75 38.283 5.459 -9.762 1.00 0.00 H new ATOM 0 HB2 PRO A 75 38.750 5.166 -6.784 1.00 0.00 H new ATOM 0 HB3 PRO A 75 38.586 6.644 -7.710 1.00 0.00 H new ATOM 0 HG2 PRO A 75 36.610 5.791 -6.099 1.00 0.00 H new ATOM 0 HG3 PRO A 75 36.257 6.623 -7.601 1.00 0.00 H new ATOM 0 HD2 PRO A 75 35.992 3.692 -6.963 1.00 0.00 H new ATOM 0 HD3 PRO A 75 35.042 4.666 -8.067 1.00 0.00 H new ATOM 459 N GLY A 76 40.283 4.146 -9.911 1.00 0.00 N ATOM 460 CA GLY A 76 41.503 3.359 -10.056 1.00 0.00 C ATOM 461 C GLY A 76 41.182 1.915 -10.421 1.00 0.00 C ATOM 462 O GLY A 76 42.080 1.092 -10.586 1.00 0.00 O ATOM 0 H GLY A 76 40.150 4.859 -10.628 1.00 0.00 H new ATOM 0 HA2 GLY A 76 42.135 3.800 -10.826 1.00 0.00 H new ATOM 0 HA3 GLY A 76 42.069 3.385 -9.125 1.00 0.00 H new ATOM 466 N GLY A 77 39.891 1.613 -10.538 1.00 0.00 N ATOM 467 CA GLY A 77 39.448 0.267 -10.880 1.00 0.00 C ATOM 468 C GLY A 77 39.261 0.122 -12.385 1.00 0.00 C ATOM 469 O GLY A 77 39.376 1.096 -13.129 1.00 0.00 O ATOM 0 H GLY A 77 39.135 2.283 -10.401 1.00 0.00 H new ATOM 0 HA2 GLY A 77 40.179 -0.461 -10.529 1.00 0.00 H new ATOM 0 HA3 GLY A 77 38.510 0.048 -10.370 1.00 0.00 H new ATOM 473 N ASN A 78 38.967 -1.099 -12.830 1.00 0.00 N ATOM 474 CA ASN A 78 38.756 -1.363 -14.254 1.00 0.00 C ATOM 475 C ASN A 78 37.601 -2.337 -14.456 1.00 0.00 C ATOM 476 O ASN A 78 37.363 -2.815 -15.568 1.00 0.00 O ATOM 477 CB ASN A 78 40.025 -1.936 -14.862 1.00 0.00 C ATOM 478 CG ASN A 78 41.133 -0.893 -14.821 1.00 0.00 C ATOM 479 OD1 ASN A 78 40.865 0.306 -14.906 1.00 0.00 O ATOM 480 ND2 ASN A 78 42.368 -1.280 -14.693 1.00 0.00 N ATOM 0 H ASN A 78 38.870 -1.918 -12.229 1.00 0.00 H new ATOM 0 HA ASN A 78 38.507 -0.424 -14.749 1.00 0.00 H new ATOM 0 HB2 ASN A 78 40.331 -2.827 -14.314 1.00 0.00 H new ATOM 0 HB3 ASN A 78 39.840 -2.243 -15.891 1.00 0.00 H new ATOM 0 HD21 ASN A 78 43.118 -0.590 -14.663 1.00 0.00 H new ATOM 0 HD22 ASN A 78 42.586 -2.274 -14.623 1.00 0.00 H new ATOM 487 N GLN A 79 36.900 -2.649 -13.369 1.00 0.00 N ATOM 488 CA GLN A 79 35.778 -3.577 -13.434 1.00 0.00 C ATOM 489 C GLN A 79 34.516 -2.852 -13.877 1.00 0.00 C ATOM 490 O GLN A 79 34.177 -1.797 -13.340 1.00 0.00 O ATOM 491 CB GLN A 79 35.547 -4.220 -12.068 1.00 0.00 C ATOM 492 CG GLN A 79 36.700 -5.150 -11.744 1.00 0.00 C ATOM 493 CD GLN A 79 36.579 -5.659 -10.314 1.00 0.00 C ATOM 494 OE1 GLN A 79 35.891 -6.648 -10.060 1.00 0.00 O ATOM 495 NE2 GLN A 79 37.210 -5.038 -9.356 1.00 0.00 N ATOM 0 H GLN A 79 37.088 -2.275 -12.439 1.00 0.00 H new ATOM 0 HA GLN A 79 36.015 -4.354 -14.161 1.00 0.00 H new ATOM 0 HB2 GLN A 79 35.461 -3.450 -11.302 1.00 0.00 H new ATOM 0 HB3 GLN A 79 34.608 -4.774 -12.069 1.00 0.00 H new ATOM 0 HG2 GLN A 79 36.705 -5.991 -12.438 1.00 0.00 H new ATOM 0 HG3 GLN A 79 37.647 -4.626 -11.872 1.00 0.00 H new ATOM 0 HE21 GLN A 79 37.780 -4.219 -9.568 1.00 0.00 H new ATOM 0 HE22 GLN A 79 37.134 -5.372 -8.395 1.00 0.00 H new ATOM 504 N CYS A 80 33.820 -3.422 -14.858 1.00 0.00 N ATOM 505 CA CYS A 80 32.587 -2.810 -15.360 1.00 0.00 C ATOM 506 C CYS A 80 31.376 -3.406 -14.645 1.00 0.00 C ATOM 507 O CYS A 80 30.335 -3.638 -15.254 1.00 0.00 O ATOM 508 CB CYS A 80 32.440 -3.069 -16.856 1.00 0.00 C ATOM 509 SG CYS A 80 33.920 -2.546 -17.757 1.00 0.00 S ATOM 0 H CYS A 80 34.082 -4.294 -15.317 1.00 0.00 H new ATOM 0 HA CYS A 80 32.639 -1.737 -15.173 1.00 0.00 H new ATOM 0 HB2 CYS A 80 32.262 -4.130 -17.029 1.00 0.00 H new ATOM 0 HB3 CYS A 80 31.570 -2.534 -17.237 1.00 0.00 H new ATOM 514 N ILE A 81 31.525 -3.656 -13.351 1.00 0.00 N ATOM 515 CA ILE A 81 30.447 -4.236 -12.551 1.00 0.00 C ATOM 516 C ILE A 81 29.641 -3.148 -11.872 1.00 0.00 C ATOM 517 O ILE A 81 28.764 -3.434 -11.057 1.00 0.00 O ATOM 518 CB ILE A 81 31.030 -5.174 -11.495 1.00 0.00 C ATOM 519 CG1 ILE A 81 32.003 -4.399 -10.603 1.00 0.00 C ATOM 520 CG2 ILE A 81 31.759 -6.324 -12.181 1.00 0.00 C ATOM 521 CD1 ILE A 81 32.650 -5.356 -9.601 1.00 0.00 C ATOM 0 H ILE A 81 32.381 -3.467 -12.830 1.00 0.00 H new ATOM 0 HA ILE A 81 29.790 -4.798 -13.215 1.00 0.00 H new ATOM 0 HB ILE A 81 30.224 -5.577 -10.881 1.00 0.00 H new ATOM 0 HG12 ILE A 81 32.770 -3.921 -11.213 1.00 0.00 H new ATOM 0 HG13 ILE A 81 31.475 -3.605 -10.075 1.00 0.00 H new ATOM 0 HG21 ILE A 81 32.175 -6.993 -11.427 1.00 0.00 H new ATOM 0 HG22 ILE A 81 31.059 -6.875 -12.809 1.00 0.00 H new ATOM 0 HG23 ILE A 81 32.565 -5.927 -12.798 1.00 0.00 H new ATOM 0 HD11 ILE A 81 33.343 -4.804 -8.966 1.00 0.00 H new ATOM 0 HD12 ILE A 81 31.877 -5.813 -8.983 1.00 0.00 H new ATOM 0 HD13 ILE A 81 33.192 -6.134 -10.139 1.00 0.00 H new ATOM 533 N VAL A 82 29.938 -1.890 -12.206 1.00 0.00 N ATOM 534 CA VAL A 82 29.221 -0.766 -11.613 1.00 0.00 C ATOM 535 C VAL A 82 28.263 -0.128 -12.631 1.00 0.00 C ATOM 536 O VAL A 82 28.706 0.398 -13.651 1.00 0.00 O ATOM 537 CB VAL A 82 30.210 0.287 -11.111 1.00 0.00 C ATOM 538 CG1 VAL A 82 29.432 1.494 -10.572 1.00 0.00 C ATOM 539 CG2 VAL A 82 31.055 -0.319 -9.983 1.00 0.00 C ATOM 0 H VAL A 82 30.661 -1.629 -12.876 1.00 0.00 H new ATOM 0 HA VAL A 82 28.638 -1.144 -10.773 1.00 0.00 H new ATOM 0 HB VAL A 82 30.859 0.606 -11.927 1.00 0.00 H new ATOM 0 HG11 VAL A 82 30.133 2.248 -10.213 1.00 0.00 H new ATOM 0 HG12 VAL A 82 28.820 1.918 -11.368 1.00 0.00 H new ATOM 0 HG13 VAL A 82 28.789 1.176 -9.751 1.00 0.00 H new ATOM 0 HG21 VAL A 82 31.763 0.425 -9.619 1.00 0.00 H new ATOM 0 HG22 VAL A 82 30.403 -0.629 -9.167 1.00 0.00 H new ATOM 0 HG23 VAL A 82 31.600 -1.184 -10.361 1.00 0.00 H new ATOM 549 N PRO A 83 26.968 -0.154 -12.381 1.00 0.00 N ATOM 550 CA PRO A 83 25.964 0.442 -13.306 1.00 0.00 C ATOM 551 C PRO A 83 25.947 1.966 -13.243 1.00 0.00 C ATOM 552 O PRO A 83 26.338 2.558 -12.237 1.00 0.00 O ATOM 553 CB PRO A 83 24.642 -0.171 -12.834 1.00 0.00 C ATOM 554 CG PRO A 83 24.830 -0.417 -11.374 1.00 0.00 C ATOM 555 CD PRO A 83 26.315 -0.735 -11.187 1.00 0.00 C ATOM 0 HA PRO A 83 26.180 0.228 -14.353 1.00 0.00 H new ATOM 0 HB2 PRO A 83 23.806 0.505 -13.016 1.00 0.00 H new ATOM 0 HB3 PRO A 83 24.424 -1.097 -13.366 1.00 0.00 H new ATOM 0 HG2 PRO A 83 24.542 0.458 -10.791 1.00 0.00 H new ATOM 0 HG3 PRO A 83 24.208 -1.245 -11.035 1.00 0.00 H new ATOM 0 HD2 PRO A 83 26.703 -0.295 -10.268 1.00 0.00 H new ATOM 0 HD3 PRO A 83 26.487 -1.810 -11.123 1.00 0.00 H new ATOM 563 N ILE A 84 25.491 2.595 -14.322 1.00 0.00 N ATOM 564 CA ILE A 84 25.419 4.054 -14.383 1.00 0.00 C ATOM 565 C ILE A 84 23.968 4.514 -14.289 1.00 0.00 C ATOM 566 O ILE A 84 23.146 4.180 -15.141 1.00 0.00 O ATOM 567 CB ILE A 84 26.013 4.550 -15.696 1.00 0.00 C ATOM 568 CG1 ILE A 84 27.475 4.103 -15.803 1.00 0.00 C ATOM 569 CG2 ILE A 84 25.945 6.075 -15.740 1.00 0.00 C ATOM 570 CD1 ILE A 84 28.030 4.376 -17.214 1.00 0.00 C ATOM 0 H ILE A 84 25.166 2.120 -15.164 1.00 0.00 H new ATOM 0 HA ILE A 84 25.985 4.463 -13.546 1.00 0.00 H new ATOM 0 HB ILE A 84 25.446 4.134 -16.529 1.00 0.00 H new ATOM 0 HG12 ILE A 84 28.076 4.631 -15.063 1.00 0.00 H new ATOM 0 HG13 ILE A 84 27.552 3.040 -15.577 1.00 0.00 H new ATOM 0 HG21 ILE A 84 26.370 6.431 -16.679 1.00 0.00 H new ATOM 0 HG22 ILE A 84 24.906 6.395 -15.667 1.00 0.00 H new ATOM 0 HG23 ILE A 84 26.511 6.489 -14.906 1.00 0.00 H new ATOM 0 HD11 ILE A 84 29.069 4.050 -17.266 1.00 0.00 H new ATOM 0 HD12 ILE A 84 27.441 3.828 -17.949 1.00 0.00 H new ATOM 0 HD13 ILE A 84 27.973 5.443 -17.427 1.00 0.00 H new ATOM 582 N CYS A 85 23.662 5.290 -13.257 1.00 0.00 N ATOM 583 CA CYS A 85 22.306 5.803 -13.060 1.00 0.00 C ATOM 584 C CYS A 85 22.183 7.172 -13.735 1.00 0.00 C ATOM 585 O CYS A 85 22.819 8.138 -13.314 1.00 0.00 O ATOM 586 CB CYS A 85 22.005 5.923 -11.547 1.00 0.00 C ATOM 587 SG CYS A 85 23.556 5.901 -10.612 1.00 0.00 S ATOM 0 H CYS A 85 24.331 5.579 -12.543 1.00 0.00 H new ATOM 0 HA CYS A 85 21.585 5.117 -13.505 1.00 0.00 H new ATOM 0 HB2 CYS A 85 21.462 6.846 -11.347 1.00 0.00 H new ATOM 0 HB3 CYS A 85 21.365 5.101 -11.227 1.00 0.00 H new ATOM 592 N ARG A 86 21.363 7.249 -14.773 1.00 0.00 N ATOM 593 CA ARG A 86 21.171 8.505 -15.486 1.00 0.00 C ATOM 594 C ARG A 86 20.573 9.556 -14.558 1.00 0.00 C ATOM 595 O ARG A 86 20.964 10.723 -14.597 1.00 0.00 O ATOM 596 CB ARG A 86 20.250 8.282 -16.686 1.00 0.00 C ATOM 597 CG ARG A 86 21.038 7.685 -17.857 1.00 0.00 C ATOM 598 CD ARG A 86 21.774 6.425 -17.399 1.00 0.00 C ATOM 599 NE ARG A 86 22.323 5.721 -18.551 1.00 0.00 N ATOM 600 CZ ARG A 86 23.498 6.056 -19.072 1.00 0.00 C ATOM 601 NH1 ARG A 86 24.185 7.041 -18.556 1.00 0.00 N ATOM 602 NH2 ARG A 86 23.963 5.404 -20.101 1.00 0.00 N ATOM 0 H ARG A 86 20.824 6.464 -15.139 1.00 0.00 H new ATOM 0 HA ARG A 86 22.139 8.862 -15.838 1.00 0.00 H new ATOM 0 HB2 ARG A 86 19.435 7.613 -16.408 1.00 0.00 H new ATOM 0 HB3 ARG A 86 19.798 9.227 -16.987 1.00 0.00 H new ATOM 0 HG2 ARG A 86 20.361 7.444 -18.677 1.00 0.00 H new ATOM 0 HG3 ARG A 86 21.752 8.416 -18.237 1.00 0.00 H new ATOM 0 HD2 ARG A 86 22.575 6.692 -16.710 1.00 0.00 H new ATOM 0 HD3 ARG A 86 21.091 5.772 -16.855 1.00 0.00 H new ATOM 0 HE ARG A 86 21.793 4.954 -18.966 1.00 0.00 H new ATOM 0 HH11 ARG A 86 23.819 7.553 -17.753 1.00 0.00 H new ATOM 0 HH12 ARG A 86 25.087 7.298 -18.956 1.00 0.00 H new ATOM 0 HH21 ARG A 86 23.425 4.638 -20.505 1.00 0.00 H new ATOM 0 HH22 ARG A 86 24.865 5.660 -20.502 1.00 0.00 H new ATOM 616 N HIS A 87 19.628 9.138 -13.719 1.00 0.00 N ATOM 617 CA HIS A 87 18.983 10.056 -12.779 1.00 0.00 C ATOM 618 C HIS A 87 19.429 9.738 -11.357 1.00 0.00 C ATOM 619 O HIS A 87 19.356 8.594 -10.910 1.00 0.00 O ATOM 620 CB HIS A 87 17.457 9.920 -12.888 1.00 0.00 C ATOM 621 CG HIS A 87 16.966 10.686 -14.087 1.00 0.00 C ATOM 622 ND1 HIS A 87 16.708 12.047 -14.038 1.00 0.00 N ATOM 623 CD2 HIS A 87 16.691 10.299 -15.376 1.00 0.00 C ATOM 624 CE1 HIS A 87 16.298 12.428 -15.261 1.00 0.00 C ATOM 625 NE2 HIS A 87 16.269 11.400 -16.114 1.00 0.00 N ATOM 0 H HIS A 87 19.292 8.176 -13.669 1.00 0.00 H new ATOM 0 HA HIS A 87 19.271 11.079 -13.022 1.00 0.00 H new ATOM 0 HB2 HIS A 87 17.181 8.869 -12.977 1.00 0.00 H new ATOM 0 HB3 HIS A 87 16.982 10.299 -11.983 1.00 0.00 H new ATOM 0 HD2 HIS A 87 16.788 9.293 -15.758 1.00 0.00 H new ATOM 0 HE1 HIS A 87 16.026 13.440 -15.521 1.00 0.00 H new ATOM 0 HE2 HIS A 87 15.996 11.419 -17.097 1.00 0.00 H new ATOM 633 N SER A 88 19.901 10.763 -10.653 1.00 0.00 N ATOM 634 CA SER A 88 20.367 10.582 -9.287 1.00 0.00 C ATOM 635 C SER A 88 19.331 9.819 -8.475 1.00 0.00 C ATOM 636 O SER A 88 18.181 10.243 -8.359 1.00 0.00 O ATOM 637 CB SER A 88 20.620 11.949 -8.644 1.00 0.00 C ATOM 638 OG SER A 88 19.409 12.428 -8.073 1.00 0.00 O ATOM 0 H SER A 88 19.970 11.718 -11.004 1.00 0.00 H new ATOM 0 HA SER A 88 21.295 10.010 -9.303 1.00 0.00 H new ATOM 0 HB2 SER A 88 21.390 11.867 -7.877 1.00 0.00 H new ATOM 0 HB3 SER A 88 20.988 12.653 -9.391 1.00 0.00 H new ATOM 0 HG SER A 88 18.661 11.874 -8.380 1.00 0.00 H new ATOM 644 N CYS A 89 19.747 8.688 -7.919 1.00 0.00 N ATOM 645 CA CYS A 89 18.846 7.866 -7.125 1.00 0.00 C ATOM 646 C CYS A 89 18.616 8.482 -5.752 1.00 0.00 C ATOM 647 O CYS A 89 17.600 8.221 -5.106 1.00 0.00 O ATOM 648 CB CYS A 89 19.406 6.454 -6.969 1.00 0.00 C ATOM 649 SG CYS A 89 19.773 5.777 -8.607 1.00 0.00 S ATOM 0 H CYS A 89 20.695 8.322 -8.003 1.00 0.00 H new ATOM 0 HA CYS A 89 17.892 7.815 -7.649 1.00 0.00 H new ATOM 0 HB2 CYS A 89 20.309 6.473 -6.359 1.00 0.00 H new ATOM 0 HB3 CYS A 89 18.686 5.819 -6.453 1.00 0.00 H new ATOM 654 N GLY A 90 19.566 9.295 -5.306 1.00 0.00 N ATOM 655 CA GLY A 90 19.457 9.935 -4.005 1.00 0.00 C ATOM 656 C GLY A 90 19.800 8.955 -2.889 1.00 0.00 C ATOM 657 O GLY A 90 20.933 8.485 -2.788 1.00 0.00 O ATOM 0 H GLY A 90 20.414 9.524 -5.824 1.00 0.00 H new ATOM 0 HA2 GLY A 90 20.127 10.794 -3.960 1.00 0.00 H new ATOM 0 HA3 GLY A 90 18.444 10.313 -3.864 1.00 0.00 H new ATOM 661 N ASP A 91 18.814 8.649 -2.052 1.00 0.00 N ATOM 662 CA ASP A 91 19.023 7.722 -0.945 1.00 0.00 C ATOM 663 C ASP A 91 19.027 6.284 -1.442 1.00 0.00 C ATOM 664 O ASP A 91 19.275 5.354 -0.674 1.00 0.00 O ATOM 665 CB ASP A 91 17.926 7.886 0.096 1.00 0.00 C ATOM 666 CG ASP A 91 18.066 9.231 0.796 1.00 0.00 C ATOM 667 OD1 ASP A 91 19.116 9.840 0.663 1.00 0.00 O ATOM 668 OD2 ASP A 91 17.124 9.635 1.459 1.00 0.00 O ATOM 0 H ASP A 91 17.869 9.026 -2.118 1.00 0.00 H new ATOM 0 HA ASP A 91 19.990 7.948 -0.495 1.00 0.00 H new ATOM 0 HB2 ASP A 91 16.948 7.815 -0.380 1.00 0.00 H new ATOM 0 HB3 ASP A 91 17.984 7.079 0.827 1.00 0.00 H new ATOM 673 N GLY A 92 18.756 6.105 -2.732 1.00 0.00 N ATOM 674 CA GLY A 92 18.738 4.772 -3.325 1.00 0.00 C ATOM 675 C GLY A 92 20.097 4.433 -3.925 1.00 0.00 C ATOM 676 O GLY A 92 21.010 5.262 -3.930 1.00 0.00 O ATOM 0 H GLY A 92 18.547 6.862 -3.383 1.00 0.00 H new ATOM 0 HA2 GLY A 92 18.475 4.034 -2.567 1.00 0.00 H new ATOM 0 HA3 GLY A 92 17.971 4.722 -4.098 1.00 0.00 H new ATOM 680 N PHE A 93 20.229 3.206 -4.422 1.00 0.00 N ATOM 681 CA PHE A 93 21.482 2.741 -5.023 1.00 0.00 C ATOM 682 C PHE A 93 21.262 2.264 -6.460 1.00 0.00 C ATOM 683 O PHE A 93 20.345 1.499 -6.743 1.00 0.00 O ATOM 684 CB PHE A 93 22.061 1.594 -4.175 1.00 0.00 C ATOM 685 CG PHE A 93 23.121 0.853 -4.962 1.00 0.00 C ATOM 686 CD1 PHE A 93 24.408 1.389 -5.098 1.00 0.00 C ATOM 687 CD2 PHE A 93 22.798 -0.361 -5.578 1.00 0.00 C ATOM 688 CE1 PHE A 93 25.370 0.706 -5.852 1.00 0.00 C ATOM 689 CE2 PHE A 93 23.758 -1.044 -6.327 1.00 0.00 C ATOM 690 CZ PHE A 93 25.045 -0.512 -6.466 1.00 0.00 C ATOM 0 H PHE A 93 19.482 2.511 -4.422 1.00 0.00 H new ATOM 0 HA PHE A 93 22.184 3.575 -5.048 1.00 0.00 H new ATOM 0 HB2 PHE A 93 22.490 1.991 -3.255 1.00 0.00 H new ATOM 0 HB3 PHE A 93 21.265 0.908 -3.885 1.00 0.00 H new ATOM 0 HD1 PHE A 93 24.657 2.326 -4.623 1.00 0.00 H new ATOM 0 HD2 PHE A 93 21.804 -0.771 -5.474 1.00 0.00 H new ATOM 0 HE1 PHE A 93 26.363 1.117 -5.961 1.00 0.00 H new ATOM 0 HE2 PHE A 93 23.508 -1.983 -6.799 1.00 0.00 H new ATOM 0 HZ PHE A 93 25.788 -1.040 -7.046 1.00 0.00 H new ATOM 700 N CYS A 94 22.125 2.719 -7.361 1.00 0.00 N ATOM 701 CA CYS A 94 22.027 2.320 -8.756 1.00 0.00 C ATOM 702 C CYS A 94 22.302 0.828 -8.887 1.00 0.00 C ATOM 703 O CYS A 94 23.394 0.357 -8.566 1.00 0.00 O ATOM 704 CB CYS A 94 23.038 3.108 -9.592 1.00 0.00 C ATOM 705 SG CYS A 94 23.133 4.804 -8.972 1.00 0.00 S ATOM 0 H CYS A 94 22.892 3.358 -7.152 1.00 0.00 H new ATOM 0 HA CYS A 94 21.021 2.531 -9.118 1.00 0.00 H new ATOM 0 HB2 CYS A 94 24.018 2.634 -9.540 1.00 0.00 H new ATOM 0 HB3 CYS A 94 22.739 3.108 -10.640 1.00 0.00 H new ATOM 710 N SER A 95 21.303 0.088 -9.353 1.00 0.00 N ATOM 711 CA SER A 95 21.437 -1.358 -9.523 1.00 0.00 C ATOM 712 C SER A 95 21.598 -1.708 -10.988 1.00 0.00 C ATOM 713 O SER A 95 22.122 -2.767 -11.325 1.00 0.00 O ATOM 714 CB SER A 95 20.208 -2.071 -8.965 1.00 0.00 C ATOM 715 OG SER A 95 20.222 -1.976 -7.550 1.00 0.00 O ATOM 0 H SER A 95 20.392 0.462 -9.620 1.00 0.00 H new ATOM 0 HA SER A 95 22.323 -1.684 -8.979 1.00 0.00 H new ATOM 0 HB2 SER A 95 19.299 -1.621 -9.364 1.00 0.00 H new ATOM 0 HB3 SER A 95 20.208 -3.117 -9.272 1.00 0.00 H new ATOM 0 HG SER A 95 19.313 -2.101 -7.205 1.00 0.00 H new ATOM 721 N ARG A 96 21.155 -0.810 -11.865 1.00 0.00 N ATOM 722 CA ARG A 96 21.274 -1.060 -13.296 1.00 0.00 C ATOM 723 C ARG A 96 21.214 0.251 -14.082 1.00 0.00 C ATOM 724 O ARG A 96 20.757 1.270 -13.563 1.00 0.00 O ATOM 725 CB ARG A 96 20.144 -2.015 -13.755 1.00 0.00 C ATOM 726 CG ARG A 96 20.683 -3.441 -13.957 1.00 0.00 C ATOM 727 CD ARG A 96 19.617 -4.310 -14.621 1.00 0.00 C ATOM 728 NE ARG A 96 20.220 -5.540 -15.110 1.00 0.00 N ATOM 729 CZ ARG A 96 19.473 -6.589 -15.416 1.00 0.00 C ATOM 730 NH1 ARG A 96 18.178 -6.526 -15.276 1.00 0.00 N ATOM 731 NH2 ARG A 96 20.033 -7.682 -15.855 1.00 0.00 N ATOM 0 H ARG A 96 20.720 0.078 -11.616 1.00 0.00 H new ATOM 0 HA ARG A 96 22.239 -1.528 -13.491 1.00 0.00 H new ATOM 0 HB2 ARG A 96 19.346 -2.025 -13.013 1.00 0.00 H new ATOM 0 HB3 ARG A 96 19.709 -1.650 -14.686 1.00 0.00 H new ATOM 0 HG2 ARG A 96 21.581 -3.416 -14.575 1.00 0.00 H new ATOM 0 HG3 ARG A 96 20.969 -3.871 -12.997 1.00 0.00 H new ATOM 0 HD2 ARG A 96 18.826 -4.540 -13.907 1.00 0.00 H new ATOM 0 HD3 ARG A 96 19.154 -3.768 -15.446 1.00 0.00 H new ATOM 0 HE ARG A 96 21.233 -5.595 -15.219 1.00 0.00 H new ATOM 0 HH11 ARG A 96 17.743 -5.670 -14.932 1.00 0.00 H new ATOM 0 HH12 ARG A 96 17.600 -7.333 -15.511 1.00 0.00 H new ATOM 0 HH21 ARG A 96 21.046 -7.728 -15.962 1.00 0.00 H new ATOM 0 HH22 ARG A 96 19.458 -8.491 -16.091 1.00 0.00 H new ATOM 745 N PRO A 97 21.641 0.231 -15.326 1.00 0.00 N ATOM 746 CA PRO A 97 21.601 1.442 -16.192 1.00 0.00 C ATOM 747 C PRO A 97 20.231 2.116 -16.149 1.00 0.00 C ATOM 748 O PRO A 97 19.219 1.511 -16.496 1.00 0.00 O ATOM 749 CB PRO A 97 21.908 0.896 -17.599 1.00 0.00 C ATOM 750 CG PRO A 97 22.677 -0.370 -17.379 1.00 0.00 C ATOM 751 CD PRO A 97 22.223 -0.933 -16.029 1.00 0.00 C ATOM 0 HA PRO A 97 22.308 2.207 -15.872 1.00 0.00 H new ATOM 0 HB2 PRO A 97 20.990 0.706 -18.155 1.00 0.00 H new ATOM 0 HB3 PRO A 97 22.489 1.612 -18.179 1.00 0.00 H new ATOM 0 HG2 PRO A 97 22.485 -1.084 -18.180 1.00 0.00 H new ATOM 0 HG3 PRO A 97 23.750 -0.176 -17.376 1.00 0.00 H new ATOM 0 HD2 PRO A 97 21.489 -1.729 -16.156 1.00 0.00 H new ATOM 0 HD3 PRO A 97 23.059 -1.356 -15.473 1.00 0.00 H new ATOM 759 N ASN A 98 20.218 3.374 -15.724 1.00 0.00 N ATOM 760 CA ASN A 98 18.974 4.129 -15.629 1.00 0.00 C ATOM 761 C ASN A 98 17.968 3.369 -14.774 1.00 0.00 C ATOM 762 O ASN A 98 16.781 3.312 -15.097 1.00 0.00 O ATOM 763 CB ASN A 98 18.377 4.349 -17.022 1.00 0.00 C ATOM 764 CG ASN A 98 17.216 5.336 -16.947 1.00 0.00 C ATOM 765 OD1 ASN A 98 16.643 5.542 -15.877 1.00 0.00 O ATOM 766 ND2 ASN A 98 16.829 5.958 -18.028 1.00 0.00 N ATOM 0 H ASN A 98 21.050 3.891 -15.441 1.00 0.00 H new ATOM 0 HA ASN A 98 19.192 5.094 -15.172 1.00 0.00 H new ATOM 0 HB2 ASN A 98 19.143 4.728 -17.698 1.00 0.00 H new ATOM 0 HB3 ASN A 98 18.031 3.400 -17.432 1.00 0.00 H new ATOM 0 HD21 ASN A 98 16.051 6.616 -17.987 1.00 0.00 H new ATOM 0 HD22 ASN A 98 17.305 5.786 -18.914 1.00 0.00 H new ATOM 773 N MET A 99 18.449 2.788 -13.679 1.00 0.00 N ATOM 774 CA MET A 99 17.590 2.027 -12.770 1.00 0.00 C ATOM 775 C MET A 99 18.081 2.183 -11.340 1.00 0.00 C ATOM 776 O MET A 99 19.186 1.745 -10.997 1.00 0.00 O ATOM 777 CB MET A 99 17.600 0.538 -13.148 1.00 0.00 C ATOM 778 CG MET A 99 16.908 0.325 -14.506 1.00 0.00 C ATOM 779 SD MET A 99 15.150 0.744 -14.394 1.00 0.00 S ATOM 780 CE MET A 99 14.576 -0.852 -13.765 1.00 0.00 C ATOM 0 H MET A 99 19.429 2.828 -13.397 1.00 0.00 H new ATOM 0 HA MET A 99 16.573 2.412 -12.852 1.00 0.00 H new ATOM 0 HB2 MET A 99 18.627 0.175 -13.195 1.00 0.00 H new ATOM 0 HB3 MET A 99 17.091 -0.043 -12.378 1.00 0.00 H new ATOM 0 HG2 MET A 99 17.387 0.942 -15.266 1.00 0.00 H new ATOM 0 HG3 MET A 99 17.021 -0.713 -14.820 1.00 0.00 H new ATOM 0 HE1 MET A 99 13.763 -0.693 -13.057 1.00 0.00 H new ATOM 0 HE2 MET A 99 14.221 -1.464 -14.594 1.00 0.00 H new ATOM 0 HE3 MET A 99 15.398 -1.363 -13.264 1.00 0.00 H new ATOM 790 N CYS A 100 17.244 2.802 -10.507 1.00 0.00 N ATOM 791 CA CYS A 100 17.565 3.027 -9.102 1.00 0.00 C ATOM 792 C CYS A 100 16.899 1.976 -8.222 1.00 0.00 C ATOM 793 O CYS A 100 15.794 1.516 -8.512 1.00 0.00 O ATOM 794 CB CYS A 100 17.060 4.401 -8.674 1.00 0.00 C ATOM 795 SG CYS A 100 17.976 5.701 -9.529 1.00 0.00 S ATOM 0 H CYS A 100 16.330 3.159 -10.787 1.00 0.00 H new ATOM 0 HA CYS A 100 18.647 2.965 -8.987 1.00 0.00 H new ATOM 0 HB2 CYS A 100 15.997 4.490 -8.896 1.00 0.00 H new ATOM 0 HB3 CYS A 100 17.172 4.517 -7.596 1.00 0.00 H new ATOM 800 N THR A 101 17.572 1.616 -7.135 1.00 0.00 N ATOM 801 CA THR A 101 17.049 0.634 -6.191 1.00 0.00 C ATOM 802 C THR A 101 16.882 1.284 -4.835 1.00 0.00 C ATOM 803 O THR A 101 17.857 1.685 -4.199 1.00 0.00 O ATOM 804 CB THR A 101 18.012 -0.553 -6.089 1.00 0.00 C ATOM 805 OG1 THR A 101 18.013 -1.254 -7.322 1.00 0.00 O ATOM 806 CG2 THR A 101 17.576 -1.493 -4.965 1.00 0.00 C ATOM 0 H THR A 101 18.486 1.992 -6.884 1.00 0.00 H new ATOM 0 HA THR A 101 16.082 0.272 -6.540 1.00 0.00 H new ATOM 0 HB THR A 101 19.014 -0.186 -5.869 1.00 0.00 H new ATOM 0 HG1 THR A 101 17.398 -0.817 -7.947 1.00 0.00 H new ATOM 0 HG21 THR A 101 18.269 -2.332 -4.903 1.00 0.00 H new ATOM 0 HG22 THR A 101 17.575 -0.953 -4.018 1.00 0.00 H new ATOM 0 HG23 THR A 101 16.572 -1.865 -5.171 1.00 0.00 H new ATOM 814 N CYS A 102 15.636 1.399 -4.397 1.00 0.00 N ATOM 815 CA CYS A 102 15.355 2.025 -3.117 1.00 0.00 C ATOM 816 C CYS A 102 15.531 1.025 -1.965 1.00 0.00 C ATOM 817 O CYS A 102 15.445 -0.185 -2.169 1.00 0.00 O ATOM 818 CB CYS A 102 13.918 2.599 -3.120 1.00 0.00 C ATOM 819 SG CYS A 102 13.961 4.376 -2.771 1.00 0.00 S ATOM 0 H CYS A 102 14.814 1.071 -4.904 1.00 0.00 H new ATOM 0 HA CYS A 102 16.065 2.838 -2.965 1.00 0.00 H new ATOM 0 HB2 CYS A 102 13.448 2.421 -4.087 1.00 0.00 H new ATOM 0 HB3 CYS A 102 13.312 2.088 -2.372 1.00 0.00 H new ATOM 824 N PRO A 103 15.734 1.509 -0.760 1.00 0.00 N ATOM 825 CA PRO A 103 15.877 0.638 0.449 1.00 0.00 C ATOM 826 C PRO A 103 14.673 -0.301 0.622 1.00 0.00 C ATOM 827 O PRO A 103 14.794 -1.387 1.189 1.00 0.00 O ATOM 828 CB PRO A 103 15.952 1.640 1.619 1.00 0.00 C ATOM 829 CG PRO A 103 16.406 2.929 1.015 1.00 0.00 C ATOM 830 CD PRO A 103 15.876 2.941 -0.417 1.00 0.00 C ATOM 0 HA PRO A 103 16.749 -0.013 0.382 1.00 0.00 H new ATOM 0 HB2 PRO A 103 14.981 1.753 2.101 1.00 0.00 H new ATOM 0 HB3 PRO A 103 16.649 1.298 2.384 1.00 0.00 H new ATOM 0 HG2 PRO A 103 16.022 3.779 1.579 1.00 0.00 H new ATOM 0 HG3 PRO A 103 17.493 3.003 1.028 1.00 0.00 H new ATOM 0 HD2 PRO A 103 14.922 3.464 -0.485 1.00 0.00 H new ATOM 0 HD3 PRO A 103 16.565 3.447 -1.093 1.00 0.00 H new ATOM 838 N SER A 104 13.517 0.133 0.129 1.00 0.00 N ATOM 839 CA SER A 104 12.299 -0.667 0.236 1.00 0.00 C ATOM 840 C SER A 104 12.441 -1.968 -0.548 1.00 0.00 C ATOM 841 O SER A 104 11.671 -2.909 -0.356 1.00 0.00 O ATOM 842 CB SER A 104 11.097 0.121 -0.290 1.00 0.00 C ATOM 843 OG SER A 104 9.905 -0.601 -0.009 1.00 0.00 O ATOM 0 H SER A 104 13.397 1.028 -0.346 1.00 0.00 H new ATOM 0 HA SER A 104 12.139 -0.904 1.288 1.00 0.00 H new ATOM 0 HB2 SER A 104 11.059 1.105 0.178 1.00 0.00 H new ATOM 0 HB3 SER A 104 11.194 0.282 -1.364 1.00 0.00 H new ATOM 0 HG SER A 104 10.099 -1.562 -0.001 1.00 0.00 H new ATOM 849 N GLY A 105 13.432 -2.012 -1.440 1.00 0.00 N ATOM 850 CA GLY A 105 13.676 -3.198 -2.259 1.00 0.00 C ATOM 851 C GLY A 105 13.108 -3.011 -3.660 1.00 0.00 C ATOM 852 O GLY A 105 13.423 -3.775 -4.574 1.00 0.00 O ATOM 0 H GLY A 105 14.077 -1.241 -1.613 1.00 0.00 H new ATOM 0 HA2 GLY A 105 14.747 -3.391 -2.318 1.00 0.00 H new ATOM 0 HA3 GLY A 105 13.220 -4.070 -1.790 1.00 0.00 H new ATOM 856 N GLN A 106 12.274 -1.990 -3.826 1.00 0.00 N ATOM 857 CA GLN A 106 11.675 -1.716 -5.123 1.00 0.00 C ATOM 858 C GLN A 106 12.739 -1.216 -6.095 1.00 0.00 C ATOM 859 O GLN A 106 13.713 -0.582 -5.694 1.00 0.00 O ATOM 860 CB GLN A 106 10.578 -0.667 -4.990 1.00 0.00 C ATOM 861 CG GLN A 106 9.699 -0.675 -6.233 1.00 0.00 C ATOM 862 CD GLN A 106 8.861 -1.948 -6.279 1.00 0.00 C ATOM 863 OE1 GLN A 106 8.305 -2.364 -5.262 1.00 0.00 O ATOM 864 NE2 GLN A 106 8.738 -2.600 -7.403 1.00 0.00 N ATOM 0 H GLN A 106 12.001 -1.345 -3.085 1.00 0.00 H new ATOM 0 HA GLN A 106 11.240 -2.640 -5.504 1.00 0.00 H new ATOM 0 HB2 GLN A 106 9.974 -0.870 -4.106 1.00 0.00 H new ATOM 0 HB3 GLN A 106 11.021 0.320 -4.854 1.00 0.00 H new ATOM 0 HG2 GLN A 106 9.047 0.198 -6.231 1.00 0.00 H new ATOM 0 HG3 GLN A 106 10.320 -0.607 -7.126 1.00 0.00 H new ATOM 0 HE21 GLN A 106 9.198 -2.256 -8.245 1.00 0.00 H new ATOM 0 HE22 GLN A 106 8.181 -3.454 -7.439 1.00 0.00 H new ATOM 873 N ILE A 107 12.540 -1.506 -7.376 1.00 0.00 N ATOM 874 CA ILE A 107 13.482 -1.084 -8.418 1.00 0.00 C ATOM 875 C ILE A 107 12.767 -0.298 -9.507 1.00 0.00 C ATOM 876 O ILE A 107 11.751 -0.740 -10.043 1.00 0.00 O ATOM 877 CB ILE A 107 14.156 -2.311 -9.037 1.00 0.00 C ATOM 878 CG1 ILE A 107 14.994 -3.017 -7.968 1.00 0.00 C ATOM 879 CG2 ILE A 107 15.070 -1.869 -10.183 1.00 0.00 C ATOM 880 CD1 ILE A 107 15.417 -4.396 -8.476 1.00 0.00 C ATOM 0 H ILE A 107 11.737 -2.031 -7.722 1.00 0.00 H new ATOM 0 HA ILE A 107 14.234 -0.443 -7.959 1.00 0.00 H new ATOM 0 HB ILE A 107 13.395 -2.991 -9.420 1.00 0.00 H new ATOM 0 HG12 ILE A 107 15.874 -2.420 -7.729 1.00 0.00 H new ATOM 0 HG13 ILE A 107 14.418 -3.118 -7.048 1.00 0.00 H new ATOM 0 HG21 ILE A 107 15.550 -2.743 -10.624 1.00 0.00 H new ATOM 0 HG22 ILE A 107 14.479 -1.358 -10.943 1.00 0.00 H new ATOM 0 HG23 ILE A 107 15.833 -1.191 -9.799 1.00 0.00 H new ATOM 0 HD11 ILE A 107 16.014 -4.897 -7.714 1.00 0.00 H new ATOM 0 HD12 ILE A 107 14.530 -4.992 -8.693 1.00 0.00 H new ATOM 0 HD13 ILE A 107 16.009 -4.283 -9.384 1.00 0.00 H new ATOM 892 N ALA A 108 13.306 0.869 -9.835 1.00 0.00 N ATOM 893 CA ALA A 108 12.706 1.698 -10.870 1.00 0.00 C ATOM 894 C ALA A 108 13.693 2.772 -11.336 1.00 0.00 C ATOM 895 O ALA A 108 14.805 2.863 -10.824 1.00 0.00 O ATOM 896 CB ALA A 108 11.413 2.344 -10.328 1.00 0.00 C ATOM 0 H ALA A 108 14.146 1.258 -9.406 1.00 0.00 H new ATOM 0 HA ALA A 108 12.458 1.074 -11.729 1.00 0.00 H new ATOM 0 HB1 ALA A 108 10.964 2.965 -11.103 1.00 0.00 H new ATOM 0 HB2 ALA A 108 10.711 1.563 -10.036 1.00 0.00 H new ATOM 0 HB3 ALA A 108 11.650 2.961 -9.461 1.00 0.00 H new ATOM 902 N PRO A 109 13.298 3.588 -12.282 1.00 0.00 N ATOM 903 CA PRO A 109 14.160 4.689 -12.816 1.00 0.00 C ATOM 904 C PRO A 109 14.572 5.676 -11.720 1.00 0.00 C ATOM 905 O PRO A 109 15.579 6.372 -11.843 1.00 0.00 O ATOM 906 CB PRO A 109 13.268 5.376 -13.872 1.00 0.00 C ATOM 907 CG PRO A 109 12.244 4.353 -14.238 1.00 0.00 C ATOM 908 CD PRO A 109 11.990 3.554 -12.963 1.00 0.00 C ATOM 0 HA PRO A 109 15.097 4.314 -13.227 1.00 0.00 H new ATOM 0 HB2 PRO A 109 12.801 6.275 -13.470 1.00 0.00 H new ATOM 0 HB3 PRO A 109 13.850 5.681 -14.742 1.00 0.00 H new ATOM 0 HG2 PRO A 109 11.328 4.825 -14.594 1.00 0.00 H new ATOM 0 HG3 PRO A 109 12.603 3.708 -15.040 1.00 0.00 H new ATOM 0 HD2 PRO A 109 11.206 4.005 -12.354 1.00 0.00 H new ATOM 0 HD3 PRO A 109 11.676 2.534 -13.182 1.00 0.00 H new ATOM 916 N SER A 110 13.783 5.731 -10.650 1.00 0.00 N ATOM 917 CA SER A 110 14.072 6.637 -9.543 1.00 0.00 C ATOM 918 C SER A 110 13.446 6.125 -8.251 1.00 0.00 C ATOM 919 O SER A 110 12.554 5.277 -8.277 1.00 0.00 O ATOM 920 CB SER A 110 13.527 8.029 -9.859 1.00 0.00 C ATOM 921 OG SER A 110 12.152 7.927 -10.204 1.00 0.00 O ATOM 0 H SER A 110 12.945 5.163 -10.527 1.00 0.00 H new ATOM 0 HA SER A 110 15.153 6.688 -9.411 1.00 0.00 H new ATOM 0 HB2 SER A 110 13.650 8.685 -8.997 1.00 0.00 H new ATOM 0 HB3 SER A 110 14.088 8.474 -10.681 1.00 0.00 H new ATOM 0 HG SER A 110 11.798 8.818 -10.406 1.00 0.00 H new ATOM 927 N CYS A 111 13.914 6.649 -7.121 1.00 0.00 N ATOM 928 CA CYS A 111 13.384 6.236 -5.827 1.00 0.00 C ATOM 929 C CYS A 111 12.040 6.921 -5.558 1.00 0.00 C ATOM 930 O CYS A 111 11.128 6.321 -4.990 1.00 0.00 O ATOM 931 CB CYS A 111 14.390 6.593 -4.714 1.00 0.00 C ATOM 932 SG CYS A 111 15.243 5.110 -4.142 1.00 0.00 S ATOM 0 H CYS A 111 14.651 7.353 -7.076 1.00 0.00 H new ATOM 0 HA CYS A 111 13.228 5.157 -5.838 1.00 0.00 H new ATOM 0 HB2 CYS A 111 15.115 7.316 -5.088 1.00 0.00 H new ATOM 0 HB3 CYS A 111 13.869 7.065 -3.881 1.00 0.00 H new ATOM 1043 N CYS A 119 8.018 -2.491 -16.715 1.00 0.00 N ATOM 1044 CA CYS A 119 7.559 -2.530 -18.105 1.00 0.00 C ATOM 1045 C CYS A 119 6.050 -2.311 -18.177 1.00 0.00 C ATOM 1046 O CYS A 119 5.280 -3.256 -18.350 1.00 0.00 O ATOM 1047 CB CYS A 119 7.922 -3.884 -18.733 1.00 0.00 C ATOM 1048 SG CYS A 119 9.605 -3.808 -19.391 1.00 0.00 S ATOM 0 HA CYS A 119 8.052 -1.731 -18.659 1.00 0.00 H new ATOM 0 HB2 CYS A 119 7.847 -4.675 -17.987 1.00 0.00 H new ATOM 0 HB3 CYS A 119 7.219 -4.128 -19.529 1.00 0.00 H new ATOM 1053 N ASN A 120 5.637 -1.056 -18.055 1.00 0.00 N ATOM 1054 CA ASN A 120 4.222 -0.721 -18.117 1.00 0.00 C ATOM 1055 C ASN A 120 3.664 -1.045 -19.498 1.00 0.00 C ATOM 1056 O ASN A 120 2.543 -1.538 -19.625 1.00 0.00 O ATOM 1057 CB ASN A 120 4.027 0.758 -17.813 1.00 0.00 C ATOM 1058 CG ASN A 120 4.347 1.041 -16.346 1.00 0.00 C ATOM 1059 OD1 ASN A 120 4.315 0.067 -15.472 1.00 0.00 O flip ATOM 1060 ND2 ASN A 120 4.638 2.180 -15.987 1.00 0.00 N flip ATOM 0 H ASN A 120 6.257 -0.259 -17.914 1.00 0.00 H new ATOM 0 HA ASN A 120 3.687 -1.313 -17.374 1.00 0.00 H new ATOM 0 HB2 ASN A 120 4.672 1.357 -18.456 1.00 0.00 H new ATOM 0 HB3 ASN A 120 3.000 1.049 -18.032 1.00 0.00 H new ATOM 0 HD21 ASN A 120 4.663 2.939 -16.668 1.00 0.00 H new ATOM 0 HD22 ASN A 120 4.855 2.366 -15.008 1.00 0.00 H new ATOM 1067 N ILE A 121 4.453 -0.762 -20.529 1.00 0.00 N ATOM 1068 CA ILE A 121 4.033 -1.026 -21.900 1.00 0.00 C ATOM 1069 C ILE A 121 4.178 -2.511 -22.223 1.00 0.00 C ATOM 1070 O ILE A 121 4.833 -3.255 -21.491 1.00 0.00 O ATOM 1071 CB ILE A 121 4.870 -0.193 -22.876 1.00 0.00 C ATOM 1072 CG1 ILE A 121 4.313 -0.345 -24.299 1.00 0.00 C ATOM 1073 CG2 ILE A 121 6.320 -0.679 -22.846 1.00 0.00 C ATOM 1074 CD1 ILE A 121 4.883 0.753 -25.200 1.00 0.00 C ATOM 0 H ILE A 121 5.383 -0.352 -20.442 1.00 0.00 H new ATOM 0 HA ILE A 121 2.985 -0.746 -22.003 1.00 0.00 H new ATOM 0 HB ILE A 121 4.828 0.856 -22.581 1.00 0.00 H new ATOM 0 HG12 ILE A 121 4.572 -1.326 -24.698 1.00 0.00 H new ATOM 0 HG13 ILE A 121 3.225 -0.285 -24.282 1.00 0.00 H new ATOM 0 HG21 ILE A 121 6.917 -0.087 -23.540 1.00 0.00 H new ATOM 0 HG22 ILE A 121 6.720 -0.568 -21.838 1.00 0.00 H new ATOM 0 HG23 ILE A 121 6.358 -1.728 -23.138 1.00 0.00 H new ATOM 0 HD11 ILE A 121 4.484 0.640 -26.208 1.00 0.00 H new ATOM 0 HD12 ILE A 121 4.602 1.730 -24.806 1.00 0.00 H new ATOM 0 HD13 ILE A 121 5.970 0.673 -25.229 1.00 0.00 H new ATOM 1086 N ARG A 122 3.567 -2.933 -23.328 1.00 0.00 N ATOM 1087 CA ARG A 122 3.635 -4.331 -23.748 1.00 0.00 C ATOM 1088 C ARG A 122 4.789 -4.525 -24.726 1.00 0.00 C ATOM 1089 O ARG A 122 4.854 -3.873 -25.770 1.00 0.00 O ATOM 1090 CB ARG A 122 2.306 -4.732 -24.415 1.00 0.00 C ATOM 1091 CG ARG A 122 1.309 -5.207 -23.355 1.00 0.00 C ATOM 1092 CD ARG A 122 1.029 -4.068 -22.378 1.00 0.00 C ATOM 1093 NE ARG A 122 -0.008 -4.461 -21.432 1.00 0.00 N ATOM 1094 CZ ARG A 122 0.281 -5.193 -20.361 1.00 0.00 C ATOM 1095 NH1 ARG A 122 1.509 -5.576 -20.142 1.00 0.00 N ATOM 1096 NH2 ARG A 122 -0.668 -5.530 -19.531 1.00 0.00 N ATOM 0 H ARG A 122 3.022 -2.331 -23.946 1.00 0.00 H new ATOM 0 HA ARG A 122 3.804 -4.962 -22.875 1.00 0.00 H new ATOM 0 HB2 ARG A 122 1.893 -3.883 -24.960 1.00 0.00 H new ATOM 0 HB3 ARG A 122 2.480 -5.524 -25.143 1.00 0.00 H new ATOM 0 HG2 ARG A 122 0.383 -5.530 -23.830 1.00 0.00 H new ATOM 0 HG3 ARG A 122 1.711 -6.068 -22.821 1.00 0.00 H new ATOM 0 HD2 ARG A 122 1.941 -3.807 -21.841 1.00 0.00 H new ATOM 0 HD3 ARG A 122 0.715 -3.179 -22.925 1.00 0.00 H new ATOM 0 HE ARG A 122 -0.972 -4.169 -21.595 1.00 0.00 H new ATOM 0 HH11 ARG A 122 2.249 -5.314 -20.793 1.00 0.00 H new ATOM 0 HH12 ARG A 122 1.729 -6.138 -19.320 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -1.628 -5.232 -19.705 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -0.450 -6.092 -18.708 1.00 0.00 H new ATOM 1110 N CYS A 123 5.695 -5.436 -24.377 1.00 0.00 N ATOM 1111 CA CYS A 123 6.853 -5.741 -25.218 1.00 0.00 C ATOM 1112 C CYS A 123 6.893 -7.222 -25.556 1.00 0.00 C ATOM 1113 O CYS A 123 6.584 -8.073 -24.720 1.00 0.00 O ATOM 1114 CB CYS A 123 8.138 -5.346 -24.495 1.00 0.00 C ATOM 1115 SG CYS A 123 8.257 -3.543 -24.432 1.00 0.00 S ATOM 0 H CYS A 123 5.650 -5.978 -23.514 1.00 0.00 H new ATOM 0 HA CYS A 123 6.767 -5.172 -26.144 1.00 0.00 H new ATOM 0 HB2 CYS A 123 8.143 -5.758 -23.486 1.00 0.00 H new ATOM 0 HB3 CYS A 123 9.003 -5.761 -25.013 1.00 0.00 H new ATOM 1120 N MET A 124 7.277 -7.528 -26.792 1.00 0.00 N ATOM 1121 CA MET A 124 7.359 -8.914 -27.247 1.00 0.00 C ATOM 1122 C MET A 124 8.505 -9.082 -28.236 1.00 0.00 C ATOM 1123 O MET A 124 9.012 -8.106 -28.790 1.00 0.00 O ATOM 1124 CB MET A 124 6.045 -9.328 -27.915 1.00 0.00 C ATOM 1125 CG MET A 124 4.919 -9.327 -26.872 1.00 0.00 C ATOM 1126 SD MET A 124 3.386 -9.924 -27.629 1.00 0.00 S ATOM 1127 CE MET A 124 3.032 -8.469 -28.648 1.00 0.00 C ATOM 0 H MET A 124 7.536 -6.837 -27.496 1.00 0.00 H new ATOM 0 HA MET A 124 7.540 -9.550 -26.380 1.00 0.00 H new ATOM 0 HB2 MET A 124 5.805 -8.641 -28.726 1.00 0.00 H new ATOM 0 HB3 MET A 124 6.146 -10.319 -28.356 1.00 0.00 H new ATOM 0 HG2 MET A 124 5.191 -9.962 -26.029 1.00 0.00 H new ATOM 0 HG3 MET A 124 4.774 -8.320 -26.480 1.00 0.00 H new ATOM 0 HE1 MET A 124 1.973 -8.455 -28.907 1.00 0.00 H new ATOM 0 HE2 MET A 124 3.282 -7.566 -28.092 1.00 0.00 H new ATOM 0 HE3 MET A 124 3.628 -8.510 -29.560 1.00 0.00 H new ATOM 1137 N ASN A 125 8.904 -10.329 -28.457 1.00 0.00 N ATOM 1138 CA ASN A 125 9.988 -10.624 -29.384 1.00 0.00 C ATOM 1139 C ASN A 125 11.301 -10.004 -28.905 1.00 0.00 C ATOM 1140 O ASN A 125 12.049 -9.426 -29.694 1.00 0.00 O ATOM 1141 CB ASN A 125 9.633 -10.077 -30.776 1.00 0.00 C ATOM 1142 CG ASN A 125 10.365 -10.864 -31.855 1.00 0.00 C ATOM 1143 OD1 ASN A 125 11.543 -10.621 -32.118 1.00 0.00 O ATOM 1144 ND2 ASN A 125 9.726 -11.806 -32.488 1.00 0.00 N ATOM 0 H ASN A 125 8.495 -11.149 -28.009 1.00 0.00 H new ATOM 0 HA ASN A 125 10.119 -11.705 -29.434 1.00 0.00 H new ATOM 0 HB2 ASN A 125 8.557 -10.142 -30.936 1.00 0.00 H new ATOM 0 HB3 ASN A 125 9.902 -9.023 -30.839 1.00 0.00 H new ATOM 0 HD21 ASN A 125 10.201 -12.350 -33.208 1.00 0.00 H new ATOM 0 HD22 ASN A 125 8.750 -12.000 -32.263 1.00 0.00 H new ATOM 1151 N GLY A 126 11.579 -10.138 -27.612 1.00 0.00 N ATOM 1152 CA GLY A 126 12.812 -9.597 -27.052 1.00 0.00 C ATOM 1153 C GLY A 126 12.758 -8.079 -26.972 1.00 0.00 C ATOM 1154 O GLY A 126 13.792 -7.414 -26.938 1.00 0.00 O ATOM 0 H GLY A 126 10.975 -10.611 -26.939 1.00 0.00 H new ATOM 0 HA2 GLY A 126 12.975 -10.011 -26.057 1.00 0.00 H new ATOM 0 HA3 GLY A 126 13.659 -9.902 -27.667 1.00 0.00 H new ATOM 1158 N GLY A 127 11.547 -7.534 -26.950 1.00 0.00 N ATOM 1159 CA GLY A 127 11.380 -6.090 -26.878 1.00 0.00 C ATOM 1160 C GLY A 127 11.922 -5.553 -25.559 1.00 0.00 C ATOM 1161 O GLY A 127 12.127 -6.308 -24.608 1.00 0.00 O ATOM 0 H GLY A 127 10.676 -8.064 -26.981 1.00 0.00 H new ATOM 0 HA2 GLY A 127 11.900 -5.616 -27.711 1.00 0.00 H new ATOM 0 HA3 GLY A 127 10.325 -5.835 -26.975 1.00 0.00 H new ATOM 1165 N SER A 128 12.158 -4.245 -25.506 1.00 0.00 N ATOM 1166 CA SER A 128 12.683 -3.610 -24.296 1.00 0.00 C ATOM 1167 C SER A 128 11.890 -2.350 -23.977 1.00 0.00 C ATOM 1168 O SER A 128 11.498 -1.609 -24.877 1.00 0.00 O ATOM 1169 CB SER A 128 14.153 -3.244 -24.499 1.00 0.00 C ATOM 1170 OG SER A 128 14.675 -2.707 -23.291 1.00 0.00 O ATOM 0 H SER A 128 11.995 -3.604 -26.283 1.00 0.00 H new ATOM 0 HA SER A 128 12.592 -4.311 -23.466 1.00 0.00 H new ATOM 0 HB2 SER A 128 14.722 -4.126 -24.794 1.00 0.00 H new ATOM 0 HB3 SER A 128 14.251 -2.517 -25.305 1.00 0.00 H new ATOM 0 HG SER A 128 15.618 -2.473 -23.418 1.00 0.00 H new ATOM 1176 N CYS A 129 11.652 -2.117 -22.689 1.00 0.00 N ATOM 1177 CA CYS A 129 10.898 -0.944 -22.251 1.00 0.00 C ATOM 1178 C CYS A 129 11.837 0.210 -21.922 1.00 0.00 C ATOM 1179 O CYS A 129 12.725 0.079 -21.080 1.00 0.00 O ATOM 1180 CB CYS A 129 10.075 -1.300 -21.011 1.00 0.00 C ATOM 1181 SG CYS A 129 9.380 -2.959 -21.211 1.00 0.00 S ATOM 0 H CYS A 129 11.969 -2.722 -21.932 1.00 0.00 H new ATOM 0 HA CYS A 129 10.236 -0.635 -23.060 1.00 0.00 H new ATOM 0 HB2 CYS A 129 10.702 -1.261 -20.120 1.00 0.00 H new ATOM 0 HB3 CYS A 129 9.275 -0.573 -20.870 1.00 0.00 H new ATOM 1186 N SER A 130 11.629 1.343 -22.585 1.00 0.00 N ATOM 1187 CA SER A 130 12.457 2.523 -22.348 1.00 0.00 C ATOM 1188 C SER A 130 11.647 3.798 -22.558 1.00 0.00 C ATOM 1189 O SER A 130 10.925 3.930 -23.545 1.00 0.00 O ATOM 1190 CB SER A 130 13.654 2.513 -23.297 1.00 0.00 C ATOM 1191 OG SER A 130 14.522 3.587 -22.966 1.00 0.00 O ATOM 0 H SER A 130 10.899 1.470 -23.286 1.00 0.00 H new ATOM 0 HA SER A 130 12.809 2.499 -21.317 1.00 0.00 H new ATOM 0 HB2 SER A 130 14.185 1.564 -23.222 1.00 0.00 H new ATOM 0 HB3 SER A 130 13.316 2.608 -24.329 1.00 0.00 H new ATOM 0 HG SER A 130 15.293 3.583 -23.571 1.00 0.00 H new ATOM 1197 N ASP A 131 11.781 4.739 -21.629 1.00 0.00 N ATOM 1198 CA ASP A 131 11.065 6.005 -21.735 1.00 0.00 C ATOM 1199 C ASP A 131 9.589 5.770 -22.045 1.00 0.00 C ATOM 1200 O ASP A 131 9.024 6.408 -22.933 1.00 0.00 O ATOM 1201 CB ASP A 131 11.690 6.867 -22.820 1.00 0.00 C ATOM 1202 CG ASP A 131 13.084 7.316 -22.393 1.00 0.00 C ATOM 1203 OD1 ASP A 131 13.204 7.855 -21.305 1.00 0.00 O ATOM 1204 OD2 ASP A 131 14.010 7.113 -23.159 1.00 0.00 O ATOM 0 H ASP A 131 12.372 4.651 -20.803 1.00 0.00 H new ATOM 0 HA ASP A 131 11.139 6.521 -20.778 1.00 0.00 H new ATOM 0 HB2 ASP A 131 11.750 6.306 -23.752 1.00 0.00 H new ATOM 0 HB3 ASP A 131 11.062 7.737 -23.011 1.00 0.00 H new ATOM 1209 N ASP A 132 8.974 4.847 -21.315 1.00 0.00 N ATOM 1210 CA ASP A 132 7.565 4.533 -21.527 1.00 0.00 C ATOM 1211 C ASP A 132 7.317 4.154 -22.982 1.00 0.00 C ATOM 1212 O ASP A 132 6.219 4.343 -23.504 1.00 0.00 O ATOM 1213 CB ASP A 132 6.696 5.741 -21.165 1.00 0.00 C ATOM 1214 CG ASP A 132 5.239 5.310 -21.019 1.00 0.00 C ATOM 1215 OD1 ASP A 132 5.008 4.267 -20.430 1.00 0.00 O ATOM 1216 OD2 ASP A 132 4.379 6.027 -21.503 1.00 0.00 O ATOM 0 H ASP A 132 9.424 4.306 -20.576 1.00 0.00 H new ATOM 0 HA ASP A 132 7.302 3.690 -20.888 1.00 0.00 H new ATOM 0 HB2 ASP A 132 7.047 6.186 -20.234 1.00 0.00 H new ATOM 0 HB3 ASP A 132 6.782 6.506 -21.937 1.00 0.00 H new ATOM 1221 N HIS A 133 8.344 3.617 -23.634 1.00 0.00 N ATOM 1222 CA HIS A 133 8.233 3.210 -25.035 1.00 0.00 C ATOM 1223 C HIS A 133 8.918 1.868 -25.249 1.00 0.00 C ATOM 1224 O HIS A 133 10.006 1.625 -24.727 1.00 0.00 O ATOM 1225 CB HIS A 133 8.878 4.266 -25.941 1.00 0.00 C ATOM 1226 CG HIS A 133 8.461 4.025 -27.367 1.00 0.00 C ATOM 1227 ND1 HIS A 133 9.284 3.388 -28.283 1.00 0.00 N ATOM 1228 CD2 HIS A 133 7.305 4.326 -28.045 1.00 0.00 C ATOM 1229 CE1 HIS A 133 8.616 3.326 -29.451 1.00 0.00 C ATOM 1230 NE2 HIS A 133 7.406 3.884 -29.361 1.00 0.00 N ATOM 0 H HIS A 133 9.261 3.453 -23.218 1.00 0.00 H new ATOM 0 HA HIS A 133 7.177 3.115 -25.287 1.00 0.00 H new ATOM 0 HB2 HIS A 133 8.575 5.265 -25.626 1.00 0.00 H new ATOM 0 HB3 HIS A 133 9.964 4.220 -25.855 1.00 0.00 H new ATOM 0 HD2 HIS A 133 6.448 4.829 -27.622 1.00 0.00 H new ATOM 0 HE1 HIS A 133 9.011 2.879 -30.351 1.00 0.00 H new ATOM 0 HE2 HIS A 133 6.706 3.968 -30.098 1.00 0.00 H new ATOM 1238 N CYS A 134 8.268 0.997 -26.016 1.00 0.00 N ATOM 1239 CA CYS A 134 8.816 -0.328 -26.295 1.00 0.00 C ATOM 1240 C CYS A 134 9.641 -0.317 -27.577 1.00 0.00 C ATOM 1241 O CYS A 134 9.186 0.164 -28.615 1.00 0.00 O ATOM 1242 CB CYS A 134 7.683 -1.340 -26.438 1.00 0.00 C ATOM 1243 SG CYS A 134 8.377 -3.010 -26.376 1.00 0.00 S ATOM 0 H CYS A 134 7.366 1.183 -26.454 1.00 0.00 H new ATOM 0 HA CYS A 134 9.461 -0.609 -25.463 1.00 0.00 H new ATOM 0 HB2 CYS A 134 6.954 -1.205 -25.639 1.00 0.00 H new ATOM 0 HB3 CYS A 134 7.156 -1.185 -27.380 1.00 0.00 H new ATOM 1248 N LEU A 135 10.859 -0.853 -27.496 1.00 0.00 N ATOM 1249 CA LEU A 135 11.754 -0.911 -28.654 1.00 0.00 C ATOM 1250 C LEU A 135 11.977 -2.357 -29.071 1.00 0.00 C ATOM 1251 O LEU A 135 12.051 -3.251 -28.228 1.00 0.00 O ATOM 1252 CB LEU A 135 13.098 -0.266 -28.308 1.00 0.00 C ATOM 1253 CG LEU A 135 12.871 1.178 -27.844 1.00 0.00 C ATOM 1254 CD1 LEU A 135 14.215 1.797 -27.450 1.00 0.00 C ATOM 1255 CD2 LEU A 135 12.227 2.004 -28.975 1.00 0.00 C ATOM 0 H LEU A 135 11.249 -1.253 -26.642 1.00 0.00 H new ATOM 0 HA LEU A 135 11.294 -0.367 -29.479 1.00 0.00 H new ATOM 0 HB2 LEU A 135 13.596 -0.837 -27.524 1.00 0.00 H new ATOM 0 HB3 LEU A 135 13.754 -0.280 -29.178 1.00 0.00 H new ATOM 0 HG LEU A 135 12.200 1.180 -26.985 1.00 0.00 H new ATOM 0 HD11 LEU A 135 14.060 2.824 -27.119 1.00 0.00 H new ATOM 0 HD12 LEU A 135 14.659 1.218 -26.640 1.00 0.00 H new ATOM 0 HD13 LEU A 135 14.885 1.790 -28.310 1.00 0.00 H new ATOM 0 HD21 LEU A 135 12.070 3.027 -28.634 1.00 0.00 H new ATOM 0 HD22 LEU A 135 12.886 2.007 -29.843 1.00 0.00 H new ATOM 0 HD23 LEU A 135 11.269 1.562 -29.248 1.00 0.00 H new ATOM 1267 N CYS A 136 12.077 -2.579 -30.380 1.00 0.00 N ATOM 1268 CA CYS A 136 12.286 -3.924 -30.914 1.00 0.00 C ATOM 1269 C CYS A 136 13.735 -4.105 -31.357 1.00 0.00 C ATOM 1270 O CYS A 136 14.363 -3.170 -31.855 1.00 0.00 O ATOM 1271 CB CYS A 136 11.340 -4.173 -32.101 1.00 0.00 C ATOM 1272 SG CYS A 136 9.827 -3.205 -31.885 1.00 0.00 S ATOM 0 H CYS A 136 12.017 -1.848 -31.089 1.00 0.00 H new ATOM 0 HA CYS A 136 12.070 -4.646 -30.127 1.00 0.00 H new ATOM 0 HB2 CYS A 136 11.831 -3.896 -33.034 1.00 0.00 H new ATOM 0 HB3 CYS A 136 11.098 -5.234 -32.170 1.00 0.00 H new ATOM 1277 N GLN A 137 14.258 -5.309 -31.167 1.00 0.00 N ATOM 1278 CA GLN A 137 15.633 -5.600 -31.548 1.00 0.00 C ATOM 1279 C GLN A 137 15.781 -5.577 -33.067 1.00 0.00 C ATOM 1280 O GLN A 137 14.797 -5.431 -33.794 1.00 0.00 O ATOM 1281 CB GLN A 137 16.048 -6.970 -31.015 1.00 0.00 C ATOM 1282 CG GLN A 137 15.996 -6.964 -29.484 1.00 0.00 C ATOM 1283 CD GLN A 137 16.539 -8.279 -28.939 1.00 0.00 C ATOM 1284 OE1 GLN A 137 15.720 -9.258 -28.687 1.00 0.00 O flip ATOM 1285 NE2 GLN A 137 17.747 -8.418 -28.745 1.00 0.00 N flip ATOM 0 H GLN A 137 13.755 -6.095 -30.754 1.00 0.00 H new ATOM 0 HA GLN A 137 16.279 -4.835 -31.117 1.00 0.00 H new ATOM 0 HB2 GLN A 137 15.385 -7.740 -31.408 1.00 0.00 H new ATOM 0 HB3 GLN A 137 17.055 -7.213 -31.354 1.00 0.00 H new ATOM 0 HG2 GLN A 137 16.581 -6.131 -29.095 1.00 0.00 H new ATOM 0 HG3 GLN A 137 14.970 -6.817 -29.147 1.00 0.00 H new ATOM 0 HE21 GLN A 137 18.387 -7.649 -28.943 1.00 0.00 H new ATOM 0 HE22 GLN A 137 18.107 -9.302 -28.386 1.00 0.00 H new ATOM 1294 N LYS A 138 17.013 -5.717 -33.545 1.00 0.00 N ATOM 1295 CA LYS A 138 17.268 -5.706 -34.981 1.00 0.00 C ATOM 1296 C LYS A 138 16.638 -6.926 -35.647 1.00 0.00 C ATOM 1297 O LYS A 138 16.807 -8.054 -35.181 1.00 0.00 O ATOM 1298 CB LYS A 138 18.770 -5.705 -35.240 1.00 0.00 C ATOM 1299 CG LYS A 138 19.039 -5.452 -36.727 1.00 0.00 C ATOM 1300 CD LYS A 138 20.544 -5.322 -36.959 1.00 0.00 C ATOM 1301 CE LYS A 138 20.805 -4.995 -38.430 1.00 0.00 C ATOM 1302 NZ LYS A 138 20.451 -6.163 -39.282 1.00 0.00 N ATOM 0 H LYS A 138 17.844 -5.838 -32.965 1.00 0.00 H new ATOM 0 HA LYS A 138 16.823 -4.805 -35.404 1.00 0.00 H new ATOM 0 HB2 LYS A 138 19.252 -4.935 -34.638 1.00 0.00 H new ATOM 0 HB3 LYS A 138 19.201 -6.660 -34.940 1.00 0.00 H new ATOM 0 HG2 LYS A 138 18.638 -6.271 -37.324 1.00 0.00 H new ATOM 0 HG3 LYS A 138 18.531 -4.543 -37.050 1.00 0.00 H new ATOM 0 HD2 LYS A 138 20.955 -4.538 -36.322 1.00 0.00 H new ATOM 0 HD3 LYS A 138 21.047 -6.250 -36.687 1.00 0.00 H new ATOM 0 HE2 LYS A 138 20.218 -4.126 -38.728 1.00 0.00 H new ATOM 0 HE3 LYS A 138 21.854 -4.735 -38.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 20.845 -6.030 -40.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 20.844 -7.030 -38.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 19.416 -6.247 -39.344 1.00 0.00 H new ATOM 1316 N GLY A 139 15.906 -6.691 -36.736 1.00 0.00 N ATOM 1317 CA GLY A 139 15.237 -7.774 -37.466 1.00 0.00 C ATOM 1318 C GLY A 139 13.742 -7.792 -37.164 1.00 0.00 C ATOM 1319 O GLY A 139 12.966 -8.423 -37.883 1.00 0.00 O ATOM 0 H GLY A 139 15.760 -5.763 -37.133 1.00 0.00 H new ATOM 0 HA2 GLY A 139 15.394 -7.647 -38.537 1.00 0.00 H new ATOM 0 HA3 GLY A 139 15.679 -8.731 -37.190 1.00 0.00 H new ATOM 1323 N TYR A 140 13.340 -7.091 -36.100 1.00 0.00 N ATOM 1324 CA TYR A 140 11.927 -7.026 -35.718 1.00 0.00 C ATOM 1325 C TYR A 140 11.419 -5.593 -35.816 1.00 0.00 C ATOM 1326 O TYR A 140 12.087 -4.658 -35.369 1.00 0.00 O ATOM 1327 CB TYR A 140 11.751 -7.520 -34.283 1.00 0.00 C ATOM 1328 CG TYR A 140 12.208 -8.955 -34.188 1.00 0.00 C ATOM 1329 CD1 TYR A 140 11.409 -9.982 -34.706 1.00 0.00 C ATOM 1330 CD2 TYR A 140 13.435 -9.260 -33.587 1.00 0.00 C ATOM 1331 CE1 TYR A 140 11.837 -11.311 -34.621 1.00 0.00 C ATOM 1332 CE2 TYR A 140 13.863 -10.588 -33.502 1.00 0.00 C ATOM 1333 CZ TYR A 140 13.063 -11.614 -34.017 1.00 0.00 C ATOM 1334 OH TYR A 140 13.486 -12.926 -33.934 1.00 0.00 O ATOM 0 H TYR A 140 13.968 -6.564 -35.492 1.00 0.00 H new ATOM 0 HA TYR A 140 11.357 -7.660 -36.397 1.00 0.00 H new ATOM 0 HB2 TYR A 140 12.327 -6.897 -33.599 1.00 0.00 H new ATOM 0 HB3 TYR A 140 10.706 -7.439 -33.984 1.00 0.00 H new ATOM 0 HD1 TYR A 140 10.463 -9.748 -35.171 1.00 0.00 H new ATOM 0 HD2 TYR A 140 14.052 -8.468 -33.188 1.00 0.00 H new ATOM 0 HE1 TYR A 140 11.222 -12.103 -35.021 1.00 0.00 H new ATOM 0 HE2 TYR A 140 14.810 -10.822 -33.039 1.00 0.00 H new ATOM 0 HH TYR A 140 14.358 -12.961 -33.487 1.00 0.00 H new ATOM 1344 N ILE A 141 10.237 -5.423 -36.405 1.00 0.00 N ATOM 1345 CA ILE A 141 9.640 -4.097 -36.566 1.00 0.00 C ATOM 1346 C ILE A 141 8.241 -4.089 -35.962 1.00 0.00 C ATOM 1347 O ILE A 141 7.661 -5.148 -35.688 1.00 0.00 O ATOM 1348 CB ILE A 141 9.573 -3.730 -38.059 1.00 0.00 C ATOM 1349 CG1 ILE A 141 8.640 -4.690 -38.803 1.00 0.00 C ATOM 1350 CG2 ILE A 141 10.970 -3.838 -38.664 1.00 0.00 C ATOM 1351 CD1 ILE A 141 8.544 -4.277 -40.271 1.00 0.00 C ATOM 0 H ILE A 141 9.673 -6.186 -36.779 1.00 0.00 H new ATOM 0 HA ILE A 141 10.256 -3.360 -36.050 1.00 0.00 H new ATOM 0 HB ILE A 141 9.193 -2.713 -38.155 1.00 0.00 H new ATOM 0 HG12 ILE A 141 9.015 -5.711 -38.726 1.00 0.00 H new ATOM 0 HG13 ILE A 141 7.650 -4.679 -38.346 1.00 0.00 H new ATOM 0 HG21 ILE A 141 10.929 -3.579 -39.722 1.00 0.00 H new ATOM 0 HG22 ILE A 141 11.644 -3.153 -38.149 1.00 0.00 H new ATOM 0 HG23 ILE A 141 11.336 -4.859 -38.554 1.00 0.00 H new ATOM 0 HD11 ILE A 141 7.880 -4.961 -40.799 1.00 0.00 H new ATOM 0 HD12 ILE A 141 8.149 -3.263 -40.339 1.00 0.00 H new ATOM 0 HD13 ILE A 141 9.535 -4.311 -40.724 1.00 0.00 H new ATOM 1363 N GLY A 142 7.698 -2.891 -35.763 1.00 0.00 N ATOM 1364 CA GLY A 142 6.360 -2.732 -35.199 1.00 0.00 C ATOM 1365 C GLY A 142 6.408 -1.887 -33.934 1.00 0.00 C ATOM 1366 O GLY A 142 7.429 -1.836 -33.246 1.00 0.00 O ATOM 0 H GLY A 142 8.166 -2.012 -35.985 1.00 0.00 H new ATOM 0 HA2 GLY A 142 5.704 -2.262 -35.932 1.00 0.00 H new ATOM 0 HA3 GLY A 142 5.936 -3.711 -34.973 1.00 0.00 H new ATOM 1370 N THR A 143 5.299 -1.221 -33.633 1.00 0.00 N ATOM 1371 CA THR A 143 5.227 -0.379 -32.448 1.00 0.00 C ATOM 1372 C THR A 143 5.420 -1.209 -31.186 1.00 0.00 C ATOM 1373 O THR A 143 6.188 -0.840 -30.298 1.00 0.00 O ATOM 1374 CB THR A 143 3.871 0.325 -32.394 1.00 0.00 C ATOM 1375 OG1 THR A 143 3.603 0.934 -33.648 1.00 0.00 O ATOM 1376 CG2 THR A 143 3.888 1.388 -31.295 1.00 0.00 C ATOM 0 H THR A 143 4.444 -1.248 -34.189 1.00 0.00 H new ATOM 0 HA THR A 143 6.023 0.364 -32.504 1.00 0.00 H new ATOM 0 HB THR A 143 3.091 -0.404 -32.174 1.00 0.00 H new ATOM 0 HG1 THR A 143 2.733 1.384 -33.614 1.00 0.00 H new ATOM 0 HG21 THR A 143 2.921 1.889 -31.258 1.00 0.00 H new ATOM 0 HG22 THR A 143 4.088 0.915 -30.334 1.00 0.00 H new ATOM 0 HG23 THR A 143 4.667 2.120 -31.508 1.00 0.00 H new ATOM 1384 N HIS A 144 4.712 -2.336 -31.110 1.00 0.00 N ATOM 1385 CA HIS A 144 4.804 -3.224 -29.949 1.00 0.00 C ATOM 1386 C HIS A 144 5.729 -4.397 -30.241 1.00 0.00 C ATOM 1387 O HIS A 144 5.890 -5.291 -29.411 1.00 0.00 O ATOM 1388 CB HIS A 144 3.415 -3.745 -29.577 1.00 0.00 C ATOM 1389 CG HIS A 144 2.564 -2.601 -29.098 1.00 0.00 C ATOM 1390 ND1 HIS A 144 2.607 -2.142 -27.791 1.00 0.00 N ATOM 1391 CD2 HIS A 144 1.643 -1.810 -29.741 1.00 0.00 C ATOM 1392 CE1 HIS A 144 1.737 -1.121 -27.687 1.00 0.00 C ATOM 1393 NE2 HIS A 144 1.123 -0.878 -28.848 1.00 0.00 N ATOM 0 H HIS A 144 4.070 -2.656 -31.836 1.00 0.00 H new ATOM 0 HA HIS A 144 5.213 -2.655 -29.114 1.00 0.00 H new ATOM 0 HB2 HIS A 144 2.950 -4.222 -30.440 1.00 0.00 H new ATOM 0 HB3 HIS A 144 3.496 -4.504 -28.798 1.00 0.00 H new ATOM 0 HD2 HIS A 144 1.365 -1.898 -30.781 1.00 0.00 H new ATOM 0 HE1 HIS A 144 1.557 -0.567 -26.778 1.00 0.00 H new ATOM 0 HE2 HIS A 144 0.422 -0.162 -29.039 1.00 0.00 H new ATOM 1401 N CYS A 145 6.327 -4.391 -31.428 1.00 0.00 N ATOM 1402 CA CYS A 145 7.232 -5.459 -31.827 1.00 0.00 C ATOM 1403 C CYS A 145 6.473 -6.770 -31.965 1.00 0.00 C ATOM 1404 O CYS A 145 5.637 -7.109 -31.129 1.00 0.00 O ATOM 1405 CB CYS A 145 8.351 -5.625 -30.797 1.00 0.00 C ATOM 1406 SG CYS A 145 8.937 -4.002 -30.257 1.00 0.00 S ATOM 0 H CYS A 145 6.201 -3.660 -32.128 1.00 0.00 H new ATOM 0 HA CYS A 145 7.669 -5.193 -32.789 1.00 0.00 H new ATOM 0 HB2 CYS A 145 7.988 -6.193 -29.941 1.00 0.00 H new ATOM 0 HB3 CYS A 145 9.174 -6.193 -31.230 1.00 0.00 H new ATOM 1411 N GLY A 146 6.773 -7.503 -33.025 1.00 0.00 N ATOM 1412 CA GLY A 146 6.114 -8.779 -33.269 1.00 0.00 C ATOM 1413 C GLY A 146 6.128 -9.116 -34.749 1.00 0.00 C ATOM 1414 O GLY A 146 5.783 -10.231 -35.138 1.00 0.00 O ATOM 0 H GLY A 146 7.464 -7.240 -33.727 1.00 0.00 H new ATOM 0 HA2 GLY A 146 6.616 -9.567 -32.707 1.00 0.00 H new ATOM 0 HA3 GLY A 146 5.086 -8.737 -32.910 1.00 0.00 H new ATOM 1418 N GLN A 147 6.531 -8.150 -35.580 1.00 0.00 N ATOM 1419 CA GLN A 147 6.583 -8.379 -37.021 1.00 0.00 C ATOM 1420 C GLN A 147 8.039 -8.606 -37.475 1.00 0.00 C ATOM 1421 O GLN A 147 8.835 -7.668 -37.492 1.00 0.00 O ATOM 1422 CB GLN A 147 5.986 -7.183 -37.762 1.00 0.00 C ATOM 1423 CG GLN A 147 6.258 -7.323 -39.266 1.00 0.00 C ATOM 1424 CD GLN A 147 5.380 -6.358 -40.045 1.00 0.00 C ATOM 1425 OE1 GLN A 147 4.863 -6.703 -41.109 1.00 0.00 O ATOM 1426 NE2 GLN A 147 5.178 -5.160 -39.576 1.00 0.00 N ATOM 0 H GLN A 147 6.821 -7.218 -35.283 1.00 0.00 H new ATOM 0 HA GLN A 147 6.000 -9.270 -37.255 1.00 0.00 H new ATOM 0 HB2 GLN A 147 4.913 -7.128 -37.580 1.00 0.00 H new ATOM 0 HB3 GLN A 147 6.421 -6.256 -37.388 1.00 0.00 H new ATOM 0 HG2 GLN A 147 7.309 -7.121 -39.474 1.00 0.00 H new ATOM 0 HG3 GLN A 147 6.061 -8.346 -39.586 1.00 0.00 H new ATOM 0 HE21 GLN A 147 5.608 -4.878 -38.695 1.00 0.00 H new ATOM 0 HE22 GLN A 147 4.590 -4.504 -40.090 1.00 0.00 H new ATOM 1435 N PRO A 148 8.405 -9.815 -37.841 1.00 0.00 N ATOM 1436 CA PRO A 148 9.787 -10.134 -38.300 1.00 0.00 C ATOM 1437 C PRO A 148 10.046 -9.645 -39.722 1.00 0.00 C ATOM 1438 O PRO A 148 9.109 -9.370 -40.471 1.00 0.00 O ATOM 1439 CB PRO A 148 9.858 -11.661 -38.190 1.00 0.00 C ATOM 1440 CG PRO A 148 8.452 -12.132 -38.382 1.00 0.00 C ATOM 1441 CD PRO A 148 7.543 -11.008 -37.872 1.00 0.00 C ATOM 0 HA PRO A 148 10.553 -9.636 -37.705 1.00 0.00 H new ATOM 0 HB2 PRO A 148 10.521 -12.080 -38.947 1.00 0.00 H new ATOM 0 HB3 PRO A 148 10.248 -11.969 -37.220 1.00 0.00 H new ATOM 0 HG2 PRO A 148 8.254 -12.344 -39.433 1.00 0.00 H new ATOM 0 HG3 PRO A 148 8.274 -13.055 -37.831 1.00 0.00 H new ATOM 0 HD2 PRO A 148 6.687 -10.861 -38.531 1.00 0.00 H new ATOM 0 HD3 PRO A 148 7.148 -11.237 -36.882 1.00 0.00 H new ATOM 1449 N VAL A 149 11.324 -9.535 -40.084 1.00 0.00 N ATOM 1450 CA VAL A 149 11.702 -9.076 -41.422 1.00 0.00 C ATOM 1451 C VAL A 149 12.441 -10.185 -42.165 1.00 0.00 C ATOM 1452 O VAL A 149 13.398 -10.757 -41.654 1.00 0.00 O ATOM 1453 CB VAL A 149 12.605 -7.842 -41.304 1.00 0.00 C ATOM 1454 CG1 VAL A 149 13.211 -7.510 -42.674 1.00 0.00 C ATOM 1455 CG2 VAL A 149 11.772 -6.656 -40.821 1.00 0.00 C ATOM 0 H VAL A 149 12.111 -9.756 -39.474 1.00 0.00 H new ATOM 0 HA VAL A 149 10.802 -8.816 -41.979 1.00 0.00 H new ATOM 0 HB VAL A 149 13.407 -8.046 -40.595 1.00 0.00 H new ATOM 0 HG11 VAL A 149 13.852 -6.633 -42.585 1.00 0.00 H new ATOM 0 HG12 VAL A 149 13.801 -8.356 -43.026 1.00 0.00 H new ATOM 0 HG13 VAL A 149 12.411 -7.305 -43.386 1.00 0.00 H new ATOM 0 HG21 VAL A 149 12.408 -5.775 -40.735 1.00 0.00 H new ATOM 0 HG22 VAL A 149 10.973 -6.458 -41.535 1.00 0.00 H new ATOM 0 HG23 VAL A 149 11.340 -6.887 -39.848 1.00 0.00 H new ATOM 1465 N CYS A 150 12.000 -10.473 -43.385 1.00 0.00 N ATOM 1466 CA CYS A 150 12.633 -11.509 -44.201 1.00 0.00 C ATOM 1467 C CYS A 150 13.620 -10.878 -45.178 1.00 0.00 C ATOM 1468 O CYS A 150 13.221 -10.244 -46.154 1.00 0.00 O ATOM 1469 CB CYS A 150 11.562 -12.277 -44.985 1.00 0.00 C ATOM 1470 SG CYS A 150 10.777 -13.508 -43.916 1.00 0.00 S ATOM 0 H CYS A 150 11.210 -10.007 -43.831 1.00 0.00 H new ATOM 0 HA CYS A 150 13.168 -12.195 -43.545 1.00 0.00 H new ATOM 0 HB2 CYS A 150 10.812 -11.584 -45.367 1.00 0.00 H new ATOM 0 HB3 CYS A 150 12.013 -12.767 -45.848 1.00 0.00 H new ATOM 1475 N GLU A 151 14.907 -11.057 -44.908 1.00 0.00 N ATOM 1476 CA GLU A 151 15.940 -10.500 -45.771 1.00 0.00 C ATOM 1477 C GLU A 151 15.909 -11.170 -47.139 1.00 0.00 C ATOM 1478 O GLU A 151 16.079 -10.511 -48.164 1.00 0.00 O ATOM 1479 CB GLU A 151 17.324 -10.694 -45.112 1.00 0.00 C ATOM 1480 CG GLU A 151 17.753 -9.420 -44.383 1.00 0.00 C ATOM 1481 CD GLU A 151 16.834 -9.170 -43.193 1.00 0.00 C ATOM 1482 OE1 GLU A 151 16.108 -10.081 -42.831 1.00 0.00 O ATOM 1483 OE2 GLU A 151 16.865 -8.071 -42.666 1.00 0.00 O ATOM 0 H GLU A 151 15.258 -11.579 -44.105 1.00 0.00 H new ATOM 0 HA GLU A 151 15.753 -9.435 -45.907 1.00 0.00 H new ATOM 0 HB2 GLU A 151 17.285 -11.527 -44.410 1.00 0.00 H new ATOM 0 HB3 GLU A 151 18.062 -10.952 -45.871 1.00 0.00 H new ATOM 0 HG2 GLU A 151 18.785 -9.514 -44.044 1.00 0.00 H new ATOM 0 HG3 GLU A 151 17.718 -8.571 -45.065 1.00 0.00 H new ATOM 1490 N SER A 152 15.697 -12.479 -47.154 1.00 0.00 N ATOM 1491 CA SER A 152 15.655 -13.217 -48.408 1.00 0.00 C ATOM 1492 C SER A 152 14.252 -13.184 -49.003 1.00 0.00 C ATOM 1493 O SER A 152 14.045 -13.575 -50.151 1.00 0.00 O ATOM 1494 CB SER A 152 16.074 -14.667 -48.162 1.00 0.00 C ATOM 1495 OG SER A 152 17.425 -14.696 -47.723 1.00 0.00 O ATOM 0 H SER A 152 15.553 -13.047 -46.319 1.00 0.00 H new ATOM 0 HA SER A 152 16.343 -12.749 -49.112 1.00 0.00 H new ATOM 0 HB2 SER A 152 15.426 -15.123 -47.413 1.00 0.00 H new ATOM 0 HB3 SER A 152 15.964 -15.250 -49.076 1.00 0.00 H new ATOM 0 HG SER A 152 17.466 -14.454 -46.774 1.00 0.00 H new ATOM 1501 N GLY A 153 13.291 -12.712 -48.214 1.00 0.00 N ATOM 1502 CA GLY A 153 11.912 -12.632 -48.675 1.00 0.00 C ATOM 1503 C GLY A 153 11.323 -14.028 -48.849 1.00 0.00 C ATOM 1504 O GLY A 153 11.984 -15.029 -48.569 1.00 0.00 O ATOM 0 H GLY A 153 13.441 -12.382 -47.261 1.00 0.00 H new ATOM 0 HA2 GLY A 153 11.316 -12.066 -47.959 1.00 0.00 H new ATOM 0 HA3 GLY A 153 11.870 -12.093 -49.621 1.00 0.00 H new ATOM 1508 N CYS A 154 10.077 -14.092 -49.319 1.00 0.00 N ATOM 1509 CA CYS A 154 9.402 -15.374 -49.535 1.00 0.00 C ATOM 1510 C CYS A 154 8.824 -15.428 -50.945 1.00 0.00 C ATOM 1511 O CYS A 154 7.915 -14.672 -51.284 1.00 0.00 O ATOM 1512 CB CYS A 154 8.279 -15.539 -48.510 1.00 0.00 C ATOM 1513 SG CYS A 154 8.909 -15.163 -46.851 1.00 0.00 S ATOM 0 H CYS A 154 9.515 -13.275 -49.557 1.00 0.00 H new ATOM 0 HA CYS A 154 10.123 -16.183 -49.417 1.00 0.00 H new ATOM 0 HB2 CYS A 154 7.450 -14.875 -48.754 1.00 0.00 H new ATOM 0 HB3 CYS A 154 7.892 -16.557 -48.541 1.00 0.00 H new ATOM 1518 N LEU A 155 9.362 -16.326 -51.764 1.00 0.00 N ATOM 1519 CA LEU A 155 8.901 -16.466 -53.139 1.00 0.00 C ATOM 1520 C LEU A 155 7.444 -16.910 -53.180 1.00 0.00 C ATOM 1521 O LEU A 155 6.654 -16.411 -53.981 1.00 0.00 O ATOM 1522 CB LEU A 155 9.765 -17.484 -53.873 1.00 0.00 C ATOM 1523 CG LEU A 155 11.194 -16.936 -54.050 1.00 0.00 C ATOM 1524 CD1 LEU A 155 12.098 -18.051 -54.589 1.00 0.00 C ATOM 1525 CD2 LEU A 155 11.198 -15.744 -55.030 1.00 0.00 C ATOM 0 H LEU A 155 10.113 -16.964 -51.501 1.00 0.00 H new ATOM 0 HA LEU A 155 8.983 -15.495 -53.628 1.00 0.00 H new ATOM 0 HB2 LEU A 155 9.793 -18.419 -53.314 1.00 0.00 H new ATOM 0 HB3 LEU A 155 9.330 -17.707 -54.847 1.00 0.00 H new ATOM 0 HG LEU A 155 11.565 -16.592 -53.085 1.00 0.00 H new ATOM 0 HD11 LEU A 155 13.111 -17.669 -54.716 1.00 0.00 H new ATOM 0 HD12 LEU A 155 12.110 -18.882 -53.884 1.00 0.00 H new ATOM 0 HD13 LEU A 155 11.717 -18.396 -55.550 1.00 0.00 H new ATOM 0 HD21 LEU A 155 12.215 -15.369 -55.143 1.00 0.00 H new ATOM 0 HD22 LEU A 155 10.821 -16.069 -56.000 1.00 0.00 H new ATOM 0 HD23 LEU A 155 10.560 -14.950 -54.640 1.00 0.00 H new ATOM 1537 N ASN A 156 7.095 -17.853 -52.312 1.00 0.00 N ATOM 1538 CA ASN A 156 5.729 -18.367 -52.251 1.00 0.00 C ATOM 1539 C ASN A 156 4.938 -17.645 -51.167 1.00 0.00 C ATOM 1540 O ASN A 156 5.413 -16.671 -50.580 1.00 0.00 O ATOM 1541 CB ASN A 156 5.747 -19.867 -51.959 1.00 0.00 C ATOM 1542 CG ASN A 156 6.303 -20.624 -53.160 1.00 0.00 C ATOM 1543 OD1 ASN A 156 6.338 -20.090 -54.268 1.00 0.00 O ATOM 1544 ND2 ASN A 156 6.743 -21.841 -53.006 1.00 0.00 N ATOM 0 H ASN A 156 7.736 -18.277 -51.642 1.00 0.00 H new ATOM 0 HA ASN A 156 5.250 -18.193 -53.214 1.00 0.00 H new ATOM 0 HB2 ASN A 156 6.357 -20.067 -51.078 1.00 0.00 H new ATOM 0 HB3 ASN A 156 4.739 -20.215 -51.734 1.00 0.00 H new ATOM 0 HD21 ASN A 156 7.117 -22.353 -53.805 1.00 0.00 H new ATOM 0 HD22 ASN A 156 6.713 -22.282 -52.087 1.00 0.00 H new ATOM 1551 N GLY A 157 3.730 -18.129 -50.906 1.00 0.00 N ATOM 1552 CA GLY A 157 2.875 -17.527 -49.889 1.00 0.00 C ATOM 1553 C GLY A 157 3.344 -17.899 -48.490 1.00 0.00 C ATOM 1554 O GLY A 157 2.534 -18.136 -47.594 1.00 0.00 O ATOM 0 H GLY A 157 3.321 -18.933 -51.382 1.00 0.00 H new ATOM 0 HA2 GLY A 157 2.879 -16.443 -50.001 1.00 0.00 H new ATOM 0 HA3 GLY A 157 1.846 -17.858 -50.031 1.00 0.00 H new ATOM 1558 N GLY A 158 4.659 -17.948 -48.308 1.00 0.00 N ATOM 1559 CA GLY A 158 5.225 -18.292 -47.009 1.00 0.00 C ATOM 1560 C GLY A 158 5.042 -17.148 -46.020 1.00 0.00 C ATOM 1561 O GLY A 158 4.537 -16.081 -46.375 1.00 0.00 O ATOM 0 H GLY A 158 5.347 -17.756 -49.036 1.00 0.00 H new ATOM 0 HA2 GLY A 158 4.744 -19.192 -46.624 1.00 0.00 H new ATOM 0 HA3 GLY A 158 6.286 -18.519 -47.118 1.00 0.00 H new ATOM 1565 N ARG A 159 5.454 -17.374 -44.773 1.00 0.00 N ATOM 1566 CA ARG A 159 5.335 -16.353 -43.729 1.00 0.00 C ATOM 1567 C ARG A 159 6.657 -16.179 -42.999 1.00 0.00 C ATOM 1568 O ARG A 159 7.428 -17.128 -42.855 1.00 0.00 O ATOM 1569 CB ARG A 159 4.247 -16.757 -42.728 1.00 0.00 C ATOM 1570 CG ARG A 159 2.888 -16.902 -43.454 1.00 0.00 C ATOM 1571 CD ARG A 159 2.630 -18.373 -43.790 1.00 0.00 C ATOM 1572 NE ARG A 159 1.383 -18.512 -44.529 1.00 0.00 N ATOM 1573 CZ ARG A 159 0.907 -19.710 -44.843 1.00 0.00 C ATOM 1574 NH1 ARG A 159 1.562 -20.784 -44.496 1.00 0.00 N ATOM 1575 NH2 ARG A 159 -0.213 -19.812 -45.502 1.00 0.00 N ATOM 0 H ARG A 159 5.872 -18.251 -44.461 1.00 0.00 H new ATOM 0 HA ARG A 159 5.066 -15.407 -44.199 1.00 0.00 H new ATOM 0 HB2 ARG A 159 4.514 -17.698 -42.248 1.00 0.00 H new ATOM 0 HB3 ARG A 159 4.170 -16.008 -41.940 1.00 0.00 H new ATOM 0 HG2 ARG A 159 2.086 -16.518 -42.823 1.00 0.00 H new ATOM 0 HG3 ARG A 159 2.888 -16.306 -44.367 1.00 0.00 H new ATOM 0 HD2 ARG A 159 3.456 -18.768 -44.381 1.00 0.00 H new ATOM 0 HD3 ARG A 159 2.584 -18.960 -42.873 1.00 0.00 H new ATOM 0 HE ARG A 159 0.868 -17.677 -44.809 1.00 0.00 H new ATOM 0 HH11 ARG A 159 2.440 -20.703 -43.983 1.00 0.00 H new ATOM 0 HH12 ARG A 159 1.196 -21.705 -44.737 1.00 0.00 H new ATOM 0 HH21 ARG A 159 -0.722 -18.972 -45.776 1.00 0.00 H new ATOM 0 HH22 ARG A 159 -0.580 -20.732 -45.744 1.00 0.00 H new ATOM 1589 N CYS A 160 6.916 -14.959 -42.539 1.00 0.00 N ATOM 1590 CA CYS A 160 8.154 -14.668 -41.825 1.00 0.00 C ATOM 1591 C CYS A 160 8.000 -15.011 -40.352 1.00 0.00 C ATOM 1592 O CYS A 160 7.136 -14.467 -39.662 1.00 0.00 O ATOM 1593 CB CYS A 160 8.490 -13.184 -41.972 1.00 0.00 C ATOM 1594 SG CYS A 160 8.889 -12.827 -43.699 1.00 0.00 S ATOM 0 H CYS A 160 6.290 -14.161 -42.647 1.00 0.00 H new ATOM 0 HA CYS A 160 8.959 -15.269 -42.247 1.00 0.00 H new ATOM 0 HB2 CYS A 160 7.646 -12.575 -41.649 1.00 0.00 H new ATOM 0 HB3 CYS A 160 9.333 -12.926 -41.331 1.00 0.00 H new ATOM 1599 N VAL A 161 8.840 -15.925 -39.873 1.00 0.00 N ATOM 1600 CA VAL A 161 8.788 -16.346 -38.471 1.00 0.00 C ATOM 1601 C VAL A 161 9.928 -15.716 -37.689 1.00 0.00 C ATOM 1602 O VAL A 161 9.952 -15.763 -36.459 1.00 0.00 O ATOM 1603 CB VAL A 161 8.888 -17.870 -38.376 1.00 0.00 C ATOM 1604 CG1 VAL A 161 7.713 -18.504 -39.121 1.00 0.00 C ATOM 1605 CG2 VAL A 161 10.202 -18.336 -39.005 1.00 0.00 C ATOM 0 H VAL A 161 9.560 -16.387 -40.428 1.00 0.00 H new ATOM 0 HA VAL A 161 7.839 -16.018 -38.047 1.00 0.00 H new ATOM 0 HB VAL A 161 8.860 -18.171 -37.329 1.00 0.00 H new ATOM 0 HG11 VAL A 161 7.783 -19.590 -39.054 1.00 0.00 H new ATOM 0 HG12 VAL A 161 6.776 -18.172 -38.673 1.00 0.00 H new ATOM 0 HG13 VAL A 161 7.741 -18.202 -40.168 1.00 0.00 H new ATOM 0 HG21 VAL A 161 10.273 -19.422 -38.937 1.00 0.00 H new ATOM 0 HG22 VAL A 161 10.231 -18.035 -40.052 1.00 0.00 H new ATOM 0 HG23 VAL A 161 11.040 -17.884 -38.474 1.00 0.00 H new ATOM 1615 N ALA A 162 10.874 -15.127 -38.408 1.00 0.00 N ATOM 1616 CA ALA A 162 12.013 -14.490 -37.760 1.00 0.00 C ATOM 1617 C ALA A 162 12.918 -13.810 -38.794 1.00 0.00 C ATOM 1618 O ALA A 162 12.702 -13.940 -39.999 1.00 0.00 O ATOM 1619 CB ALA A 162 12.812 -15.541 -36.950 1.00 0.00 C ATOM 0 H ALA A 162 10.877 -15.077 -39.427 1.00 0.00 H new ATOM 0 HA ALA A 162 11.643 -13.723 -37.080 1.00 0.00 H new ATOM 0 HB1 ALA A 162 13.662 -15.059 -36.468 1.00 0.00 H new ATOM 0 HB2 ALA A 162 12.167 -15.983 -36.191 1.00 0.00 H new ATOM 0 HB3 ALA A 162 13.170 -16.322 -37.621 1.00 0.00 H new ATOM 1625 N PRO A 163 13.931 -13.104 -38.343 1.00 0.00 N ATOM 1626 CA PRO A 163 14.890 -12.417 -39.257 1.00 0.00 C ATOM 1627 C PRO A 163 15.506 -13.402 -40.250 1.00 0.00 C ATOM 1628 O PRO A 163 16.092 -14.405 -39.854 1.00 0.00 O ATOM 1629 CB PRO A 163 15.953 -11.835 -38.304 1.00 0.00 C ATOM 1630 CG PRO A 163 15.272 -11.732 -36.978 1.00 0.00 C ATOM 1631 CD PRO A 163 14.261 -12.876 -36.929 1.00 0.00 C ATOM 0 HA PRO A 163 14.416 -11.650 -39.869 1.00 0.00 H new ATOM 0 HB2 PRO A 163 16.829 -12.482 -38.248 1.00 0.00 H new ATOM 0 HB3 PRO A 163 16.298 -10.860 -38.647 1.00 0.00 H new ATOM 0 HG2 PRO A 163 15.992 -11.813 -36.163 1.00 0.00 H new ATOM 0 HG3 PRO A 163 14.775 -10.768 -36.869 1.00 0.00 H new ATOM 0 HD2 PRO A 163 14.686 -13.767 -36.467 1.00 0.00 H new ATOM 0 HD3 PRO A 163 13.378 -12.607 -36.349 1.00 0.00 H new ATOM 1639 N ASN A 164 15.384 -13.094 -41.535 1.00 0.00 N ATOM 1640 CA ASN A 164 15.933 -13.952 -42.578 1.00 0.00 C ATOM 1641 C ASN A 164 15.382 -15.370 -42.455 1.00 0.00 C ATOM 1642 O ASN A 164 16.077 -16.344 -42.745 1.00 0.00 O ATOM 1643 CB ASN A 164 17.457 -13.991 -42.472 1.00 0.00 C ATOM 1644 CG ASN A 164 18.047 -14.691 -43.692 1.00 0.00 C ATOM 1645 OD1 ASN A 164 18.078 -14.070 -44.839 1.00 0.00 O flip ATOM 1646 ND2 ASN A 164 18.492 -15.835 -43.597 1.00 0.00 N flip ATOM 0 H ASN A 164 14.911 -12.259 -41.880 1.00 0.00 H new ATOM 0 HA ASN A 164 15.643 -13.543 -43.546 1.00 0.00 H new ATOM 0 HB2 ASN A 164 17.851 -12.977 -42.398 1.00 0.00 H new ATOM 0 HB3 ASN A 164 17.753 -14.515 -41.563 1.00 0.00 H new ATOM 0 HD21 ASN A 164 18.467 -16.319 -42.700 1.00 0.00 H new ATOM 0 HD22 ASN A 164 18.886 -16.299 -44.416 1.00 0.00 H new ATOM 1653 N ARG A 165 14.121 -15.477 -42.034 1.00 0.00 N ATOM 1654 CA ARG A 165 13.466 -16.778 -41.882 1.00 0.00 C ATOM 1655 C ARG A 165 12.059 -16.741 -42.462 1.00 0.00 C ATOM 1656 O ARG A 165 11.266 -15.843 -42.168 1.00 0.00 O ATOM 1657 CB ARG A 165 13.400 -17.159 -40.399 1.00 0.00 C ATOM 1658 CG ARG A 165 14.806 -17.394 -39.827 1.00 0.00 C ATOM 1659 CD ARG A 165 15.401 -18.702 -40.358 1.00 0.00 C ATOM 1660 NE ARG A 165 16.609 -19.029 -39.616 1.00 0.00 N ATOM 1661 CZ ARG A 165 17.765 -18.436 -39.889 1.00 0.00 C ATOM 1662 NH1 ARG A 165 17.825 -17.512 -40.809 1.00 0.00 N ATOM 1663 NH2 ARG A 165 18.833 -18.774 -39.227 1.00 0.00 N ATOM 0 H ARG A 165 13.533 -14.679 -41.792 1.00 0.00 H new ATOM 0 HA ARG A 165 14.049 -17.523 -42.424 1.00 0.00 H new ATOM 0 HB2 ARG A 165 12.903 -16.367 -39.838 1.00 0.00 H new ATOM 0 HB3 ARG A 165 12.799 -18.060 -40.278 1.00 0.00 H new ATOM 0 HG2 ARG A 165 15.455 -16.560 -40.093 1.00 0.00 H new ATOM 0 HG3 ARG A 165 14.759 -17.427 -38.738 1.00 0.00 H new ATOM 0 HD2 ARG A 165 14.674 -19.509 -40.262 1.00 0.00 H new ATOM 0 HD3 ARG A 165 15.630 -18.604 -41.419 1.00 0.00 H new ATOM 0 HE ARG A 165 16.567 -19.726 -38.873 1.00 0.00 H new ATOM 0 HH11 ARG A 165 16.983 -17.245 -41.319 1.00 0.00 H new ATOM 0 HH12 ARG A 165 18.714 -17.057 -41.018 1.00 0.00 H new ATOM 0 HH21 ARG A 165 18.779 -19.491 -38.503 1.00 0.00 H new ATOM 0 HH22 ARG A 165 19.724 -18.322 -39.432 1.00 0.00 H new ATOM 1677 N CYS A 166 11.754 -17.748 -43.273 1.00 0.00 N ATOM 1678 CA CYS A 166 10.445 -17.864 -43.901 1.00 0.00 C ATOM 1679 C CYS A 166 10.008 -19.320 -43.972 1.00 0.00 C ATOM 1680 O CYS A 166 10.833 -20.221 -44.134 1.00 0.00 O ATOM 1681 CB CYS A 166 10.485 -17.267 -45.313 1.00 0.00 C ATOM 1682 SG CYS A 166 8.793 -16.918 -45.858 1.00 0.00 S ATOM 0 H CYS A 166 12.401 -18.500 -43.511 1.00 0.00 H new ATOM 0 HA CYS A 166 9.725 -17.313 -43.296 1.00 0.00 H new ATOM 0 HB2 CYS A 166 11.078 -16.352 -45.318 1.00 0.00 H new ATOM 0 HB3 CYS A 166 10.966 -17.962 -46.001 1.00 0.00 H new ATOM 1687 N ALA A 167 8.700 -19.542 -43.863 1.00 0.00 N ATOM 1688 CA ALA A 167 8.139 -20.891 -43.930 1.00 0.00 C ATOM 1689 C ALA A 167 7.142 -20.983 -45.079 1.00 0.00 C ATOM 1690 O ALA A 167 6.168 -20.233 -45.125 1.00 0.00 O ATOM 1691 CB ALA A 167 7.436 -21.227 -42.613 1.00 0.00 C ATOM 0 H ALA A 167 8.008 -18.805 -43.728 1.00 0.00 H new ATOM 0 HA ALA A 167 8.947 -21.602 -44.099 1.00 0.00 H new ATOM 0 HB1 ALA A 167 7.020 -22.233 -42.669 1.00 0.00 H new ATOM 0 HB2 ALA A 167 8.154 -21.176 -41.794 1.00 0.00 H new ATOM 0 HB3 ALA A 167 6.633 -20.512 -42.437 1.00 0.00 H new ATOM 1697 N CYS A 168 7.397 -21.907 -46.004 1.00 0.00 N ATOM 1698 CA CYS A 168 6.522 -22.101 -47.162 1.00 0.00 C ATOM 1699 C CYS A 168 5.777 -23.421 -47.032 1.00 0.00 C ATOM 1700 O CYS A 168 6.235 -24.336 -46.346 1.00 0.00 O ATOM 1701 CB CYS A 168 7.350 -22.101 -48.448 1.00 0.00 C ATOM 1702 SG CYS A 168 8.285 -20.554 -48.554 1.00 0.00 S ATOM 0 H CYS A 168 8.202 -22.533 -45.975 1.00 0.00 H new ATOM 0 HA CYS A 168 5.801 -21.284 -47.201 1.00 0.00 H new ATOM 0 HB2 CYS A 168 8.030 -22.952 -48.457 1.00 0.00 H new ATOM 0 HB3 CYS A 168 6.698 -22.206 -49.315 1.00 0.00 H new ATOM 1707 N THR A 169 4.618 -23.511 -47.680 1.00 0.00 N ATOM 1708 CA THR A 169 3.798 -24.723 -47.617 1.00 0.00 C ATOM 1709 C THR A 169 3.861 -25.487 -48.929 1.00 0.00 C ATOM 1710 O THR A 169 3.038 -26.365 -49.191 1.00 0.00 O ATOM 1711 CB THR A 169 2.342 -24.350 -47.319 1.00 0.00 C ATOM 1712 OG1 THR A 169 1.690 -24.008 -48.533 1.00 0.00 O ATOM 1713 CG2 THR A 169 2.306 -23.149 -46.372 1.00 0.00 C ATOM 0 H THR A 169 4.225 -22.764 -48.253 1.00 0.00 H new ATOM 0 HA THR A 169 4.188 -25.358 -46.821 1.00 0.00 H new ATOM 0 HB THR A 169 1.837 -25.196 -46.853 1.00 0.00 H new ATOM 0 HG1 THR A 169 0.758 -23.770 -48.348 1.00 0.00 H new ATOM 0 HG21 THR A 169 1.270 -22.884 -46.160 1.00 0.00 H new ATOM 0 HG22 THR A 169 2.813 -23.404 -45.441 1.00 0.00 H new ATOM 0 HG23 THR A 169 2.809 -22.302 -46.839 1.00 0.00 H new ATOM 1721 N TYR A 170 4.840 -25.139 -49.752 1.00 0.00 N ATOM 1722 CA TYR A 170 5.021 -25.784 -51.057 1.00 0.00 C ATOM 1723 C TYR A 170 6.386 -26.458 -51.147 1.00 0.00 C ATOM 1724 O TYR A 170 6.993 -26.515 -52.218 1.00 0.00 O ATOM 1725 CB TYR A 170 4.879 -24.751 -52.179 1.00 0.00 C ATOM 1726 CG TYR A 170 4.602 -25.462 -53.487 1.00 0.00 C ATOM 1727 CD1 TYR A 170 3.314 -25.940 -53.756 1.00 0.00 C ATOM 1728 CD2 TYR A 170 5.627 -25.647 -54.423 1.00 0.00 C ATOM 1729 CE1 TYR A 170 3.051 -26.606 -54.960 1.00 0.00 C ATOM 1730 CE2 TYR A 170 5.362 -26.310 -55.628 1.00 0.00 C ATOM 1731 CZ TYR A 170 4.073 -26.790 -55.896 1.00 0.00 C ATOM 1732 OH TYR A 170 3.812 -27.445 -57.082 1.00 0.00 O ATOM 0 H TYR A 170 5.525 -24.413 -49.544 1.00 0.00 H new ATOM 0 HA TYR A 170 4.250 -26.547 -51.168 1.00 0.00 H new ATOM 0 HB2 TYR A 170 4.069 -24.059 -51.950 1.00 0.00 H new ATOM 0 HB3 TYR A 170 5.791 -24.159 -52.260 1.00 0.00 H new ATOM 0 HD1 TYR A 170 2.523 -25.795 -53.035 1.00 0.00 H new ATOM 0 HD2 TYR A 170 6.621 -25.279 -54.216 1.00 0.00 H new ATOM 0 HE1 TYR A 170 2.058 -26.978 -55.165 1.00 0.00 H new ATOM 0 HE2 TYR A 170 6.152 -26.451 -56.351 1.00 0.00 H new ATOM 0 HH TYR A 170 4.630 -27.487 -57.620 1.00 0.00 H new ATOM 1742 N GLY A 171 6.867 -26.963 -50.017 1.00 0.00 N ATOM 1743 CA GLY A 171 8.169 -27.629 -49.979 1.00 0.00 C ATOM 1744 C GLY A 171 9.277 -26.632 -49.665 1.00 0.00 C ATOM 1745 O GLY A 171 10.221 -26.474 -50.441 1.00 0.00 O ATOM 0 H GLY A 171 6.382 -26.926 -49.120 1.00 0.00 H new ATOM 0 HA2 GLY A 171 8.158 -28.417 -49.226 1.00 0.00 H new ATOM 0 HA3 GLY A 171 8.366 -28.108 -50.938 1.00 0.00 H new ATOM 1749 N PHE A 172 9.153 -25.954 -48.530 1.00 0.00 N ATOM 1750 CA PHE A 172 10.147 -24.966 -48.131 1.00 0.00 C ATOM 1751 C PHE A 172 11.556 -25.528 -48.286 1.00 0.00 C ATOM 1752 O PHE A 172 11.971 -26.410 -47.534 1.00 0.00 O ATOM 1753 CB PHE A 172 9.927 -24.566 -46.668 1.00 0.00 C ATOM 1754 CG PHE A 172 11.020 -23.618 -46.230 1.00 0.00 C ATOM 1755 CD1 PHE A 172 10.983 -22.280 -46.632 1.00 0.00 C ATOM 1756 CD2 PHE A 172 12.070 -24.076 -45.424 1.00 0.00 C ATOM 1757 CE1 PHE A 172 11.994 -21.396 -46.229 1.00 0.00 C ATOM 1758 CE2 PHE A 172 13.081 -23.193 -45.023 1.00 0.00 C ATOM 1759 CZ PHE A 172 13.042 -21.854 -45.426 1.00 0.00 C ATOM 0 H PHE A 172 8.380 -26.069 -47.874 1.00 0.00 H new ATOM 0 HA PHE A 172 10.038 -24.093 -48.775 1.00 0.00 H new ATOM 0 HB2 PHE A 172 8.953 -24.091 -46.553 1.00 0.00 H new ATOM 0 HB3 PHE A 172 9.926 -25.453 -46.034 1.00 0.00 H new ATOM 0 HD1 PHE A 172 10.174 -21.926 -47.254 1.00 0.00 H new ATOM 0 HD2 PHE A 172 12.100 -25.109 -45.112 1.00 0.00 H new ATOM 0 HE1 PHE A 172 11.963 -20.362 -46.539 1.00 0.00 H new ATOM 0 HE2 PHE A 172 13.891 -23.546 -44.402 1.00 0.00 H new ATOM 0 HZ PHE A 172 13.822 -21.174 -45.117 1.00 0.00 H new ATOM 1769 N THR A 173 12.289 -25.001 -49.265 1.00 0.00 N ATOM 1770 CA THR A 173 13.661 -25.436 -49.514 1.00 0.00 C ATOM 1771 C THR A 173 14.588 -24.233 -49.591 1.00 0.00 C ATOM 1772 O THR A 173 14.358 -23.299 -50.358 1.00 0.00 O ATOM 1773 CB THR A 173 13.730 -26.221 -50.815 1.00 0.00 C ATOM 1774 OG1 THR A 173 12.842 -27.327 -50.743 1.00 0.00 O ATOM 1775 CG2 THR A 173 15.158 -26.723 -51.037 1.00 0.00 C ATOM 0 H THR A 173 11.956 -24.273 -49.898 1.00 0.00 H new ATOM 0 HA THR A 173 13.979 -26.077 -48.691 1.00 0.00 H new ATOM 0 HB THR A 173 13.443 -25.576 -51.646 1.00 0.00 H new ATOM 0 HG1 THR A 173 11.918 -27.003 -50.699 1.00 0.00 H new ATOM 0 HG21 THR A 173 15.205 -27.285 -51.970 1.00 0.00 H new ATOM 0 HG22 THR A 173 15.838 -25.873 -51.091 1.00 0.00 H new ATOM 0 HG23 THR A 173 15.449 -27.369 -50.209 1.00 0.00 H new ATOM 1783 N GLY A 174 15.644 -24.273 -48.797 1.00 0.00 N ATOM 1784 CA GLY A 174 16.614 -23.193 -48.774 1.00 0.00 C ATOM 1785 C GLY A 174 15.986 -21.890 -48.273 1.00 0.00 C ATOM 1786 O GLY A 174 14.761 -21.779 -48.191 1.00 0.00 O ATOM 0 H GLY A 174 15.851 -25.042 -48.160 1.00 0.00 H new ATOM 0 HA2 GLY A 174 17.450 -23.467 -48.131 1.00 0.00 H new ATOM 0 HA3 GLY A 174 17.018 -23.043 -49.775 1.00 0.00 H new ATOM 1790 N PRO A 175 16.791 -20.905 -47.941 1.00 0.00 N ATOM 1791 CA PRO A 175 16.292 -19.585 -47.438 1.00 0.00 C ATOM 1792 C PRO A 175 15.307 -18.925 -48.412 1.00 0.00 C ATOM 1793 O PRO A 175 14.345 -18.278 -47.998 1.00 0.00 O ATOM 1794 CB PRO A 175 17.565 -18.739 -47.287 1.00 0.00 C ATOM 1795 CG PRO A 175 18.683 -19.723 -47.170 1.00 0.00 C ATOM 1796 CD PRO A 175 18.267 -20.931 -48.007 1.00 0.00 C ATOM 0 HA PRO A 175 15.737 -19.692 -46.506 1.00 0.00 H new ATOM 0 HB2 PRO A 175 17.706 -18.084 -48.147 1.00 0.00 H new ATOM 0 HB3 PRO A 175 17.510 -18.100 -46.406 1.00 0.00 H new ATOM 0 HG2 PRO A 175 19.618 -19.298 -47.536 1.00 0.00 H new ATOM 0 HG3 PRO A 175 18.847 -20.006 -46.130 1.00 0.00 H new ATOM 0 HD2 PRO A 175 18.624 -20.850 -49.034 1.00 0.00 H new ATOM 0 HD3 PRO A 175 18.671 -21.859 -47.601 1.00 0.00 H new ATOM 1804 N GLN A 176 15.572 -19.085 -49.704 1.00 0.00 N ATOM 1805 CA GLN A 176 14.725 -18.492 -50.737 1.00 0.00 C ATOM 1806 C GLN A 176 13.424 -19.270 -50.869 1.00 0.00 C ATOM 1807 O GLN A 176 12.994 -19.597 -51.973 1.00 0.00 O ATOM 1808 CB GLN A 176 15.468 -18.504 -52.073 1.00 0.00 C ATOM 1809 CG GLN A 176 16.683 -17.584 -51.980 1.00 0.00 C ATOM 1810 CD GLN A 176 17.583 -17.787 -53.193 1.00 0.00 C ATOM 1811 OE1 GLN A 176 17.214 -18.497 -54.130 1.00 0.00 O ATOM 1812 NE2 GLN A 176 18.759 -17.224 -53.223 1.00 0.00 N ATOM 0 H GLN A 176 16.364 -19.619 -50.062 1.00 0.00 H new ATOM 0 HA GLN A 176 14.491 -17.465 -50.455 1.00 0.00 H new ATOM 0 HB2 GLN A 176 15.783 -19.518 -52.319 1.00 0.00 H new ATOM 0 HB3 GLN A 176 14.807 -18.173 -52.874 1.00 0.00 H new ATOM 0 HG2 GLN A 176 16.359 -16.545 -51.927 1.00 0.00 H new ATOM 0 HG3 GLN A 176 17.238 -17.792 -51.066 1.00 0.00 H new ATOM 0 HE21 GLN A 176 19.063 -16.636 -52.447 1.00 0.00 H new ATOM 0 HE22 GLN A 176 19.375 -17.371 -54.023 1.00 0.00 H new ATOM 1821 N CYS A 177 12.805 -19.570 -49.736 1.00 0.00 N ATOM 1822 CA CYS A 177 11.556 -20.317 -49.738 1.00 0.00 C ATOM 1823 C CYS A 177 11.711 -21.619 -50.509 1.00 0.00 C ATOM 1824 O CYS A 177 12.126 -22.634 -49.951 1.00 0.00 O ATOM 1825 CB CYS A 177 10.443 -19.485 -50.368 1.00 0.00 C ATOM 1826 SG CYS A 177 8.938 -20.485 -50.463 1.00 0.00 S ATOM 0 H CYS A 177 13.144 -19.310 -48.810 1.00 0.00 H new ATOM 0 HA CYS A 177 11.296 -20.545 -48.704 1.00 0.00 H new ATOM 0 HB2 CYS A 177 10.262 -18.588 -49.775 1.00 0.00 H new ATOM 0 HB3 CYS A 177 10.738 -19.154 -51.364 1.00 0.00 H new