USER MOD reduce.3.24.130724 H: found=0, std=0, add=615, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 615 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 Single : A 213 LYS NZ :NH3+ -173:sc= 0.342 (180deg=0.315) USER MOD Single : A 223 THR OG1 : rot 180:sc= 0.0021 USER MOD Single : A 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 THR OG1 : rot -23:sc= -2.36! USER MOD Single : A 238 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 242 CYS SG : rot 180:sc= -5.21! USER MOD Single : A 252 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 253 ASN : amide:sc= -0.903 K(o=-0.9,f=-5.5!) USER MOD Single : A 260 THR OG1 : rot 180:sc= 0 USER MOD Single : A 262 TYR OH : rot 15:sc= -1.01 USER MOD Single : A 264 GLN : amide:sc=-0.00318 X(o=-0.0032,f=0) USER MOD Single : A 265 CYS SG : rot -130:sc= -3.02 USER MOD Single : A 266 GLN : amide:sc= -0.445 X(o=-0.45,f=0) USER MOD Single : A 268 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 269 TYR OH : rot -148:sc= -0.738 USER MOD Single : A 276 HIS :FLIP no HD1:sc= -4.5! C(o=-5.2!,f=-4.5!) USER MOD Single : A 277 LYS NZ :NH3+ -110:sc= 0.853 (180deg=-0.593) USER MOD Single : A 279 THR OG1 : rot 180:sc= 0 USER MOD Single : A 280 LYS NZ :NH3+ 166:sc= -0.132 (180deg=-0.366) USER MOD Single : B 451 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 210 13.200 10.761 2.586 1.00 0.00 N ATOM 2 CA ARG A 210 12.805 9.377 2.823 1.00 0.00 C ATOM 3 C ARG A 210 11.344 9.156 2.439 1.00 0.00 C ATOM 4 O ARG A 210 10.435 9.671 3.090 1.00 0.00 O ATOM 5 CB ARG A 210 13.023 9.007 4.292 1.00 0.00 C ATOM 6 CG ARG A 210 13.736 7.678 4.484 1.00 0.00 C ATOM 7 CD ARG A 210 14.563 7.669 5.761 1.00 0.00 C ATOM 8 NE ARG A 210 14.894 6.312 6.189 1.00 0.00 N ATOM 9 CZ ARG A 210 14.029 5.487 6.776 1.00 0.00 C ATOM 10 NH1 ARG A 210 12.782 5.877 7.005 1.00 0.00 N ATOM 11 NH2 ARG A 210 14.414 4.270 7.133 1.00 0.00 N ATOM 0 HA ARG A 210 13.426 8.734 2.199 1.00 0.00 H new ATOM 0 HB2 ARG A 210 13.603 9.794 4.774 1.00 0.00 H new ATOM 0 HB3 ARG A 210 12.057 8.968 4.796 1.00 0.00 H new ATOM 0 HG2 ARG A 210 13.003 6.872 4.518 1.00 0.00 H new ATOM 0 HG3 ARG A 210 14.383 7.484 3.629 1.00 0.00 H new ATOM 0 HD2 ARG A 210 15.482 8.233 5.602 1.00 0.00 H new ATOM 0 HD3 ARG A 210 14.012 8.175 6.554 1.00 0.00 H new ATOM 0 HE ARG A 210 15.844 5.977 6.029 1.00 0.00 H new ATOM 0 HH11 ARG A 210 12.482 6.813 6.731 1.00 0.00 H new ATOM 0 HH12 ARG A 210 12.123 5.241 7.455 1.00 0.00 H new ATOM 0 HH21 ARG A 210 15.372 3.966 6.958 1.00 0.00 H new ATOM 0 HH22 ARG A 210 13.752 3.637 7.583 1.00 0.00 H new ATOM 24 N GLU A 211 11.128 8.383 1.380 1.00 0.00 N ATOM 25 CA GLU A 211 9.778 8.092 0.910 1.00 0.00 C ATOM 26 C GLU A 211 9.630 6.614 0.563 1.00 0.00 C ATOM 27 O GLU A 211 10.614 5.878 0.505 1.00 0.00 O ATOM 28 CB GLU A 211 9.445 8.949 -0.312 1.00 0.00 C ATOM 29 CG GLU A 211 8.965 10.347 0.039 1.00 0.00 C ATOM 30 CD GLU A 211 7.542 10.361 0.568 1.00 0.00 C ATOM 31 OE1 GLU A 211 7.119 9.343 1.154 1.00 0.00 O ATOM 32 OE2 GLU A 211 6.854 11.389 0.395 1.00 0.00 O ATOM 0 H GLU A 211 11.869 7.947 0.831 1.00 0.00 H new ATOM 0 HA GLU A 211 9.081 8.331 1.714 1.00 0.00 H new ATOM 0 HB2 GLU A 211 10.330 9.026 -0.944 1.00 0.00 H new ATOM 0 HB3 GLU A 211 8.676 8.447 -0.899 1.00 0.00 H new ATOM 0 HG2 GLU A 211 9.631 10.778 0.787 1.00 0.00 H new ATOM 0 HG3 GLU A 211 9.026 10.981 -0.846 1.00 0.00 H new ATOM 39 N LEU A 212 8.392 6.186 0.334 1.00 0.00 N ATOM 40 CA LEU A 212 8.114 4.796 -0.006 1.00 0.00 C ATOM 41 C LEU A 212 7.567 4.684 -1.425 1.00 0.00 C ATOM 42 O LEU A 212 7.037 5.650 -1.976 1.00 0.00 O ATOM 43 CB LEU A 212 7.116 4.195 0.984 1.00 0.00 C ATOM 44 CG LEU A 212 7.669 3.946 2.389 1.00 0.00 C ATOM 45 CD1 LEU A 212 6.571 3.440 3.311 1.00 0.00 C ATOM 46 CD2 LEU A 212 8.825 2.957 2.340 1.00 0.00 C ATOM 0 H LEU A 212 7.566 6.783 0.378 1.00 0.00 H new ATOM 0 HA LEU A 212 9.050 4.241 0.051 1.00 0.00 H new ATOM 0 HB2 LEU A 212 6.257 4.862 1.061 1.00 0.00 H new ATOM 0 HB3 LEU A 212 6.751 3.250 0.581 1.00 0.00 H new ATOM 0 HG LEU A 212 8.042 4.890 2.785 1.00 0.00 H new ATOM 0 HD11 LEU A 212 6.982 3.268 4.306 1.00 0.00 H new ATOM 0 HD12 LEU A 212 5.775 4.182 3.370 1.00 0.00 H new ATOM 0 HD13 LEU A 212 6.168 2.506 2.919 1.00 0.00 H new ATOM 0 HD21 LEU A 212 9.206 2.792 3.348 1.00 0.00 H new ATOM 0 HD22 LEU A 212 8.477 2.011 1.924 1.00 0.00 H new ATOM 0 HD23 LEU A 212 9.621 3.358 1.713 1.00 0.00 H new ATOM 58 N LYS A 213 7.699 3.499 -2.014 1.00 0.00 N ATOM 59 CA LYS A 213 7.217 3.261 -3.368 1.00 0.00 C ATOM 60 C LYS A 213 6.497 1.921 -3.463 1.00 0.00 C ATOM 61 O LYS A 213 6.868 0.956 -2.796 1.00 0.00 O ATOM 62 CB LYS A 213 8.383 3.298 -4.360 1.00 0.00 C ATOM 63 CG LYS A 213 9.284 4.511 -4.194 1.00 0.00 C ATOM 64 CD LYS A 213 10.566 4.155 -3.459 1.00 0.00 C ATOM 65 CE LYS A 213 11.596 3.546 -4.396 1.00 0.00 C ATOM 66 NZ LYS A 213 12.616 2.751 -3.659 1.00 0.00 N ATOM 0 H LYS A 213 8.136 2.689 -1.574 1.00 0.00 H new ATOM 0 HA LYS A 213 6.509 4.051 -3.618 1.00 0.00 H new ATOM 0 HB2 LYS A 213 8.980 2.394 -4.241 1.00 0.00 H new ATOM 0 HB3 LYS A 213 7.986 3.287 -5.375 1.00 0.00 H new ATOM 0 HG2 LYS A 213 9.527 4.922 -5.174 1.00 0.00 H new ATOM 0 HG3 LYS A 213 8.752 5.288 -3.645 1.00 0.00 H new ATOM 0 HD2 LYS A 213 10.980 5.050 -2.994 1.00 0.00 H new ATOM 0 HD3 LYS A 213 10.343 3.452 -2.656 1.00 0.00 H new ATOM 0 HE2 LYS A 213 11.093 2.907 -5.122 1.00 0.00 H new ATOM 0 HE3 LYS A 213 12.090 4.339 -4.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 213 13.364 2.452 -4.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 213 13.031 3.333 -2.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 213 12.166 1.911 -3.241 1.00 0.00 H new ATOM 80 N ILE A 214 5.464 1.870 -4.298 1.00 0.00 N ATOM 81 CA ILE A 214 4.689 0.648 -4.483 1.00 0.00 C ATOM 82 C ILE A 214 5.578 -0.499 -4.953 1.00 0.00 C ATOM 83 O ILE A 214 6.445 -0.317 -5.808 1.00 0.00 O ATOM 84 CB ILE A 214 3.549 0.861 -5.500 1.00 0.00 C ATOM 85 CG1 ILE A 214 2.655 2.021 -5.058 1.00 0.00 C ATOM 86 CG2 ILE A 214 2.730 -0.412 -5.664 1.00 0.00 C ATOM 87 CD1 ILE A 214 2.269 2.952 -6.186 1.00 0.00 C ATOM 0 H ILE A 214 5.144 2.661 -4.857 1.00 0.00 H new ATOM 0 HA ILE A 214 4.258 0.390 -3.516 1.00 0.00 H new ATOM 0 HB ILE A 214 3.989 1.109 -6.466 1.00 0.00 H new ATOM 0 HG12 ILE A 214 1.749 1.618 -4.604 1.00 0.00 H new ATOM 0 HG13 ILE A 214 3.171 2.593 -4.287 1.00 0.00 H new ATOM 0 HG21 ILE A 214 1.931 -0.240 -6.385 1.00 0.00 H new ATOM 0 HG22 ILE A 214 3.374 -1.216 -6.020 1.00 0.00 H new ATOM 0 HG23 ILE A 214 2.297 -0.693 -4.704 1.00 0.00 H new ATOM 0 HD11 ILE A 214 1.635 3.750 -5.799 1.00 0.00 H new ATOM 0 HD12 ILE A 214 3.168 3.384 -6.625 1.00 0.00 H new ATOM 0 HD13 ILE A 214 1.725 2.394 -6.948 1.00 0.00 H new ATOM 99 N GLY A 215 5.360 -1.680 -4.384 1.00 0.00 N ATOM 100 CA GLY A 215 6.150 -2.839 -4.753 1.00 0.00 C ATOM 101 C GLY A 215 7.357 -3.034 -3.853 1.00 0.00 C ATOM 102 O GLY A 215 8.064 -4.036 -3.963 1.00 0.00 O ATOM 0 H GLY A 215 4.650 -1.855 -3.673 1.00 0.00 H new ATOM 0 HA2 GLY A 215 5.523 -3.730 -4.711 1.00 0.00 H new ATOM 0 HA3 GLY A 215 6.484 -2.732 -5.785 1.00 0.00 H new ATOM 106 N ASP A 216 7.600 -2.075 -2.963 1.00 0.00 N ATOM 107 CA ASP A 216 8.732 -2.152 -2.048 1.00 0.00 C ATOM 108 C ASP A 216 8.320 -2.766 -0.715 1.00 0.00 C ATOM 109 O ASP A 216 7.222 -2.520 -0.218 1.00 0.00 O ATOM 110 CB ASP A 216 9.324 -0.760 -1.818 1.00 0.00 C ATOM 111 CG ASP A 216 10.057 -0.234 -3.037 1.00 0.00 C ATOM 112 OD1 ASP A 216 10.385 -1.045 -3.929 1.00 0.00 O ATOM 113 OD2 ASP A 216 10.305 0.988 -3.100 1.00 0.00 O ATOM 0 H ASP A 216 7.028 -1.237 -2.857 1.00 0.00 H new ATOM 0 HA ASP A 216 9.488 -2.793 -2.503 1.00 0.00 H new ATOM 0 HB2 ASP A 216 8.525 -0.068 -1.551 1.00 0.00 H new ATOM 0 HB3 ASP A 216 10.010 -0.795 -0.972 1.00 0.00 H new ATOM 118 N ARG A 217 9.214 -3.566 -0.139 1.00 0.00 N ATOM 119 CA ARG A 217 8.947 -4.213 1.139 1.00 0.00 C ATOM 120 C ARG A 217 9.100 -3.219 2.283 1.00 0.00 C ATOM 121 O ARG A 217 10.056 -2.444 2.321 1.00 0.00 O ATOM 122 CB ARG A 217 9.894 -5.399 1.344 1.00 0.00 C ATOM 123 CG ARG A 217 9.382 -6.419 2.347 1.00 0.00 C ATOM 124 CD ARG A 217 8.318 -7.316 1.735 1.00 0.00 C ATOM 125 NE ARG A 217 8.867 -8.198 0.707 1.00 0.00 N ATOM 126 CZ ARG A 217 8.242 -9.278 0.246 1.00 0.00 C ATOM 127 NH1 ARG A 217 7.047 -9.614 0.715 1.00 0.00 N ATOM 128 NH2 ARG A 217 8.814 -10.025 -0.689 1.00 0.00 N ATOM 0 H ARG A 217 10.128 -3.780 -0.538 1.00 0.00 H new ATOM 0 HA ARG A 217 7.921 -4.580 1.130 1.00 0.00 H new ATOM 0 HB2 ARG A 217 10.057 -5.893 0.386 1.00 0.00 H new ATOM 0 HB3 ARG A 217 10.862 -5.027 1.679 1.00 0.00 H new ATOM 0 HG2 ARG A 217 10.212 -7.029 2.704 1.00 0.00 H new ATOM 0 HG3 ARG A 217 8.970 -5.903 3.214 1.00 0.00 H new ATOM 0 HD2 ARG A 217 7.856 -7.917 2.519 1.00 0.00 H new ATOM 0 HD3 ARG A 217 7.531 -6.700 1.301 1.00 0.00 H new ATOM 0 HE ARG A 217 9.783 -7.972 0.320 1.00 0.00 H new ATOM 0 HH11 ARG A 217 6.602 -9.043 1.433 1.00 0.00 H new ATOM 0 HH12 ARG A 217 6.573 -10.443 0.357 1.00 0.00 H new ATOM 0 HH21 ARG A 217 9.732 -9.771 -1.054 1.00 0.00 H new ATOM 0 HH22 ARG A 217 8.336 -10.853 -1.043 1.00 0.00 H new ATOM 142 N VAL A 218 8.150 -3.240 3.210 1.00 0.00 N ATOM 143 CA VAL A 218 8.177 -2.333 4.347 1.00 0.00 C ATOM 144 C VAL A 218 7.436 -2.916 5.543 1.00 0.00 C ATOM 145 O VAL A 218 6.952 -4.048 5.499 1.00 0.00 O ATOM 146 CB VAL A 218 7.541 -0.975 3.988 1.00 0.00 C ATOM 147 CG1 VAL A 218 8.158 -0.414 2.716 1.00 0.00 C ATOM 148 CG2 VAL A 218 6.029 -1.110 3.844 1.00 0.00 C ATOM 0 H VAL A 218 7.352 -3.876 3.195 1.00 0.00 H new ATOM 0 HA VAL A 218 9.225 -2.190 4.609 1.00 0.00 H new ATOM 0 HB VAL A 218 7.743 -0.276 4.800 1.00 0.00 H new ATOM 0 HG11 VAL A 218 7.696 0.544 2.479 1.00 0.00 H new ATOM 0 HG12 VAL A 218 9.229 -0.274 2.862 1.00 0.00 H new ATOM 0 HG13 VAL A 218 7.992 -1.110 1.894 1.00 0.00 H new ATOM 0 HG21 VAL A 218 5.600 -0.141 3.591 1.00 0.00 H new ATOM 0 HG22 VAL A 218 5.801 -1.826 3.054 1.00 0.00 H new ATOM 0 HG23 VAL A 218 5.604 -1.460 4.784 1.00 0.00 H new ATOM 158 N LEU A 219 7.334 -2.122 6.601 1.00 0.00 N ATOM 159 CA LEU A 219 6.632 -2.538 7.805 1.00 0.00 C ATOM 160 C LEU A 219 5.543 -1.536 8.150 1.00 0.00 C ATOM 161 O LEU A 219 5.819 -0.359 8.364 1.00 0.00 O ATOM 162 CB LEU A 219 7.596 -2.660 8.986 1.00 0.00 C ATOM 163 CG LEU A 219 8.723 -3.678 8.816 1.00 0.00 C ATOM 164 CD1 LEU A 219 9.473 -3.856 10.127 1.00 0.00 C ATOM 165 CD2 LEU A 219 8.171 -5.011 8.329 1.00 0.00 C ATOM 0 H LEU A 219 7.730 -1.183 6.648 1.00 0.00 H new ATOM 0 HA LEU A 219 6.185 -3.513 7.612 1.00 0.00 H new ATOM 0 HB2 LEU A 219 8.039 -1.682 9.173 1.00 0.00 H new ATOM 0 HB3 LEU A 219 7.022 -2.925 9.874 1.00 0.00 H new ATOM 0 HG LEU A 219 9.420 -3.303 8.066 1.00 0.00 H new ATOM 0 HD11 LEU A 219 10.273 -4.584 9.992 1.00 0.00 H new ATOM 0 HD12 LEU A 219 9.899 -2.901 10.435 1.00 0.00 H new ATOM 0 HD13 LEU A 219 8.785 -4.211 10.894 1.00 0.00 H new ATOM 0 HD21 LEU A 219 8.988 -5.723 8.214 1.00 0.00 H new ATOM 0 HD22 LEU A 219 7.455 -5.395 9.055 1.00 0.00 H new ATOM 0 HD23 LEU A 219 7.674 -4.870 7.369 1.00 0.00 H new ATOM 177 N VAL A 220 4.306 -2.008 8.215 1.00 0.00 N ATOM 178 CA VAL A 220 3.187 -1.137 8.549 1.00 0.00 C ATOM 179 C VAL A 220 2.992 -1.089 10.060 1.00 0.00 C ATOM 180 O VAL A 220 2.624 -2.086 10.684 1.00 0.00 O ATOM 181 CB VAL A 220 1.866 -1.580 7.866 1.00 0.00 C ATOM 182 CG1 VAL A 220 1.279 -0.439 7.049 1.00 0.00 C ATOM 183 CG2 VAL A 220 2.078 -2.809 6.994 1.00 0.00 C ATOM 0 H VAL A 220 4.053 -2.981 8.043 1.00 0.00 H new ATOM 0 HA VAL A 220 3.433 -0.144 8.174 1.00 0.00 H new ATOM 0 HB VAL A 220 1.158 -1.847 8.650 1.00 0.00 H new ATOM 0 HG11 VAL A 220 0.353 -0.768 6.577 1.00 0.00 H new ATOM 0 HG12 VAL A 220 1.072 0.408 7.703 1.00 0.00 H new ATOM 0 HG13 VAL A 220 1.991 -0.138 6.280 1.00 0.00 H new ATOM 0 HG21 VAL A 220 1.133 -3.093 6.530 1.00 0.00 H new ATOM 0 HG22 VAL A 220 2.810 -2.583 6.218 1.00 0.00 H new ATOM 0 HG23 VAL A 220 2.443 -3.632 7.608 1.00 0.00 H new ATOM 193 N GLY A 221 3.263 0.074 10.644 1.00 0.00 N ATOM 194 CA GLY A 221 3.131 0.235 12.078 1.00 0.00 C ATOM 195 C GLY A 221 4.390 -0.171 12.827 1.00 0.00 C ATOM 196 O GLY A 221 4.485 0.016 14.040 1.00 0.00 O ATOM 0 H GLY A 221 3.572 0.909 10.147 1.00 0.00 H new ATOM 0 HA2 GLY A 221 2.897 1.275 12.304 1.00 0.00 H new ATOM 0 HA3 GLY A 221 2.292 -0.364 12.432 1.00 0.00 H new ATOM 200 N GLY A 222 5.361 -0.729 12.103 1.00 0.00 N ATOM 201 CA GLY A 222 6.605 -1.153 12.724 1.00 0.00 C ATOM 202 C GLY A 222 6.561 -2.590 13.206 1.00 0.00 C ATOM 203 O GLY A 222 7.595 -3.250 13.307 1.00 0.00 O ATOM 0 H GLY A 222 5.307 -0.894 11.098 1.00 0.00 H new ATOM 0 HA2 GLY A 222 7.420 -1.039 12.009 1.00 0.00 H new ATOM 0 HA3 GLY A 222 6.827 -0.498 13.567 1.00 0.00 H new ATOM 207 N THR A 223 5.362 -3.077 13.503 1.00 0.00 N ATOM 208 CA THR A 223 5.188 -4.444 13.977 1.00 0.00 C ATOM 209 C THR A 223 4.727 -5.358 12.848 1.00 0.00 C ATOM 210 O THR A 223 4.993 -6.560 12.862 1.00 0.00 O ATOM 211 CB THR A 223 4.173 -4.475 15.120 1.00 0.00 C ATOM 212 OG1 THR A 223 2.978 -3.814 14.748 1.00 0.00 O ATOM 213 CG2 THR A 223 4.683 -3.824 16.386 1.00 0.00 C ATOM 0 H THR A 223 4.495 -2.545 13.424 1.00 0.00 H new ATOM 0 HA THR A 223 6.151 -4.805 14.339 1.00 0.00 H new ATOM 0 HB THR A 223 3.992 -5.531 15.319 1.00 0.00 H new ATOM 0 HG1 THR A 223 2.341 -3.846 15.492 1.00 0.00 H new ATOM 0 HG21 THR A 223 3.916 -3.879 17.158 1.00 0.00 H new ATOM 0 HG22 THR A 223 5.579 -4.343 16.727 1.00 0.00 H new ATOM 0 HG23 THR A 223 4.923 -2.780 16.187 1.00 0.00 H new ATOM 221 N LYS A 224 4.036 -4.781 11.871 1.00 0.00 N ATOM 222 CA LYS A 224 3.538 -5.546 10.734 1.00 0.00 C ATOM 223 C LYS A 224 4.451 -5.369 9.527 1.00 0.00 C ATOM 224 O LYS A 224 5.043 -4.307 9.337 1.00 0.00 O ATOM 225 CB LYS A 224 2.113 -5.108 10.382 1.00 0.00 C ATOM 226 CG LYS A 224 1.254 -4.759 11.590 1.00 0.00 C ATOM 227 CD LYS A 224 0.611 -5.997 12.194 1.00 0.00 C ATOM 228 CE LYS A 224 1.596 -6.778 13.048 1.00 0.00 C ATOM 229 NZ LYS A 224 0.970 -7.281 14.301 1.00 0.00 N ATOM 0 H LYS A 224 3.808 -3.787 11.844 1.00 0.00 H new ATOM 0 HA LYS A 224 3.526 -6.601 11.010 1.00 0.00 H new ATOM 0 HB2 LYS A 224 2.163 -4.241 9.723 1.00 0.00 H new ATOM 0 HB3 LYS A 224 1.627 -5.907 9.822 1.00 0.00 H new ATOM 0 HG2 LYS A 224 1.867 -4.263 12.342 1.00 0.00 H new ATOM 0 HG3 LYS A 224 0.478 -4.053 11.294 1.00 0.00 H new ATOM 0 HD2 LYS A 224 -0.245 -5.704 12.801 1.00 0.00 H new ATOM 0 HD3 LYS A 224 0.232 -6.637 11.397 1.00 0.00 H new ATOM 0 HE2 LYS A 224 1.986 -7.619 12.475 1.00 0.00 H new ATOM 0 HE3 LYS A 224 2.445 -6.141 13.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 224 1.676 -7.808 14.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 224 0.620 -6.478 14.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 224 0.176 -7.910 14.064 1.00 0.00 H new ATOM 243 N ALA A 225 4.564 -6.413 8.711 1.00 0.00 N ATOM 244 CA ALA A 225 5.407 -6.365 7.521 1.00 0.00 C ATOM 245 C ALA A 225 4.590 -6.601 6.261 1.00 0.00 C ATOM 246 O ALA A 225 3.654 -7.400 6.258 1.00 0.00 O ATOM 247 CB ALA A 225 6.524 -7.389 7.618 1.00 0.00 C ATOM 0 H ALA A 225 4.083 -7.301 8.852 1.00 0.00 H new ATOM 0 HA ALA A 225 5.845 -5.369 7.463 1.00 0.00 H new ATOM 0 HB1 ALA A 225 7.142 -7.339 6.722 1.00 0.00 H new ATOM 0 HB2 ALA A 225 7.137 -7.177 8.494 1.00 0.00 H new ATOM 0 HB3 ALA A 225 6.096 -8.387 7.708 1.00 0.00 H new ATOM 253 N GLY A 226 4.949 -5.903 5.189 1.00 0.00 N ATOM 254 CA GLY A 226 4.236 -6.054 3.938 1.00 0.00 C ATOM 255 C GLY A 226 4.884 -5.297 2.797 1.00 0.00 C ATOM 256 O GLY A 226 6.027 -4.853 2.906 1.00 0.00 O ATOM 0 H GLY A 226 5.721 -5.236 5.166 1.00 0.00 H new ATOM 0 HA2 GLY A 226 4.182 -7.112 3.681 1.00 0.00 H new ATOM 0 HA3 GLY A 226 3.212 -5.704 4.065 1.00 0.00 H new ATOM 260 N VAL A 227 4.150 -5.153 1.699 1.00 0.00 N ATOM 261 CA VAL A 227 4.653 -4.449 0.528 1.00 0.00 C ATOM 262 C VAL A 227 3.755 -3.265 0.176 1.00 0.00 C ATOM 263 O VAL A 227 2.532 -3.396 0.125 1.00 0.00 O ATOM 264 CB VAL A 227 4.749 -5.390 -0.691 1.00 0.00 C ATOM 265 CG1 VAL A 227 5.083 -4.614 -1.957 1.00 0.00 C ATOM 266 CG2 VAL A 227 5.781 -6.480 -0.442 1.00 0.00 C ATOM 0 H VAL A 227 3.202 -5.516 1.597 1.00 0.00 H new ATOM 0 HA VAL A 227 5.650 -4.085 0.776 1.00 0.00 H new ATOM 0 HB VAL A 227 3.776 -5.860 -0.833 1.00 0.00 H new ATOM 0 HG11 VAL A 227 5.144 -5.302 -2.800 1.00 0.00 H new ATOM 0 HG12 VAL A 227 4.304 -3.876 -2.147 1.00 0.00 H new ATOM 0 HG13 VAL A 227 6.040 -4.108 -1.832 1.00 0.00 H new ATOM 0 HG21 VAL A 227 5.836 -7.135 -1.312 1.00 0.00 H new ATOM 0 HG22 VAL A 227 6.756 -6.025 -0.268 1.00 0.00 H new ATOM 0 HG23 VAL A 227 5.491 -7.062 0.433 1.00 0.00 H new ATOM 276 N VAL A 228 4.368 -2.116 -0.074 1.00 0.00 N ATOM 277 CA VAL A 228 3.619 -0.917 -0.432 1.00 0.00 C ATOM 278 C VAL A 228 2.829 -1.140 -1.714 1.00 0.00 C ATOM 279 O VAL A 228 3.374 -1.595 -2.718 1.00 0.00 O ATOM 280 CB VAL A 228 4.552 0.292 -0.612 1.00 0.00 C ATOM 281 CG1 VAL A 228 3.747 1.570 -0.803 1.00 0.00 C ATOM 282 CG2 VAL A 228 5.494 0.415 0.577 1.00 0.00 C ATOM 0 H VAL A 228 5.379 -1.988 -0.036 1.00 0.00 H new ATOM 0 HA VAL A 228 2.930 -0.708 0.386 1.00 0.00 H new ATOM 0 HB VAL A 228 5.151 0.136 -1.509 1.00 0.00 H new ATOM 0 HG11 VAL A 228 4.427 2.413 -0.928 1.00 0.00 H new ATOM 0 HG12 VAL A 228 3.119 1.475 -1.689 1.00 0.00 H new ATOM 0 HG13 VAL A 228 3.118 1.738 0.071 1.00 0.00 H new ATOM 0 HG21 VAL A 228 6.148 1.275 0.435 1.00 0.00 H new ATOM 0 HG22 VAL A 228 4.913 0.548 1.490 1.00 0.00 H new ATOM 0 HG23 VAL A 228 6.097 -0.490 0.659 1.00 0.00 H new ATOM 292 N ARG A 229 1.537 -0.832 -1.671 1.00 0.00 N ATOM 293 CA ARG A 229 0.671 -1.017 -2.829 1.00 0.00 C ATOM 294 C ARG A 229 0.097 0.312 -3.317 1.00 0.00 C ATOM 295 O ARG A 229 -0.174 0.480 -4.508 1.00 0.00 O ATOM 296 CB ARG A 229 -0.462 -1.984 -2.482 1.00 0.00 C ATOM 297 CG ARG A 229 0.025 -3.304 -1.905 1.00 0.00 C ATOM 298 CD ARG A 229 1.082 -3.946 -2.790 1.00 0.00 C ATOM 299 NE ARG A 229 0.888 -5.388 -2.916 1.00 0.00 N ATOM 300 CZ ARG A 229 1.417 -6.125 -3.892 1.00 0.00 C ATOM 301 NH1 ARG A 229 2.172 -5.560 -4.826 1.00 0.00 N ATOM 302 NH2 ARG A 229 1.190 -7.430 -3.932 1.00 0.00 N ATOM 0 H ARG A 229 1.067 -0.454 -0.848 1.00 0.00 H new ATOM 0 HA ARG A 229 1.272 -1.436 -3.636 1.00 0.00 H new ATOM 0 HB2 ARG A 229 -1.130 -1.507 -1.765 1.00 0.00 H new ATOM 0 HB3 ARG A 229 -1.048 -2.183 -3.380 1.00 0.00 H new ATOM 0 HG2 ARG A 229 0.436 -3.137 -0.909 1.00 0.00 H new ATOM 0 HG3 ARG A 229 -0.818 -3.985 -1.792 1.00 0.00 H new ATOM 0 HD2 ARG A 229 1.053 -3.489 -3.779 1.00 0.00 H new ATOM 0 HD3 ARG A 229 2.071 -3.748 -2.376 1.00 0.00 H new ATOM 0 HE ARG A 229 0.314 -5.858 -2.216 1.00 0.00 H new ATOM 0 HH11 ARG A 229 2.350 -4.556 -4.799 1.00 0.00 H new ATOM 0 HH12 ARG A 229 2.574 -6.130 -5.570 1.00 0.00 H new ATOM 0 HH21 ARG A 229 0.611 -7.869 -3.216 1.00 0.00 H new ATOM 0 HH22 ARG A 229 1.594 -7.995 -4.679 1.00 0.00 H new ATOM 316 N PHE A 230 -0.086 1.255 -2.399 1.00 0.00 N ATOM 317 CA PHE A 230 -0.626 2.565 -2.747 1.00 0.00 C ATOM 318 C PHE A 230 -0.320 3.584 -1.657 1.00 0.00 C ATOM 319 O PHE A 230 -0.230 3.237 -0.484 1.00 0.00 O ATOM 320 CB PHE A 230 -2.138 2.475 -2.971 1.00 0.00 C ATOM 321 CG PHE A 230 -2.718 3.694 -3.629 1.00 0.00 C ATOM 322 CD1 PHE A 230 -2.464 3.966 -4.963 1.00 0.00 C ATOM 323 CD2 PHE A 230 -3.519 4.569 -2.911 1.00 0.00 C ATOM 324 CE1 PHE A 230 -2.997 5.087 -5.570 1.00 0.00 C ATOM 325 CE2 PHE A 230 -4.056 5.691 -3.512 1.00 0.00 C ATOM 326 CZ PHE A 230 -3.793 5.951 -4.844 1.00 0.00 C ATOM 0 H PHE A 230 0.131 1.137 -1.409 1.00 0.00 H new ATOM 0 HA PHE A 230 -0.150 2.894 -3.671 1.00 0.00 H new ATOM 0 HB2 PHE A 230 -2.355 1.602 -3.586 1.00 0.00 H new ATOM 0 HB3 PHE A 230 -2.631 2.320 -2.011 1.00 0.00 H new ATOM 0 HD1 PHE A 230 -1.842 3.294 -5.536 1.00 0.00 H new ATOM 0 HD2 PHE A 230 -3.726 4.371 -1.870 1.00 0.00 H new ATOM 0 HE1 PHE A 230 -2.791 5.287 -6.611 1.00 0.00 H new ATOM 0 HE2 PHE A 230 -4.680 6.364 -2.942 1.00 0.00 H new ATOM 0 HZ PHE A 230 -4.209 6.829 -5.316 1.00 0.00 H new ATOM 336 N LEU A 231 -0.163 4.844 -2.046 1.00 0.00 N ATOM 337 CA LEU A 231 0.130 5.902 -1.086 1.00 0.00 C ATOM 338 C LEU A 231 -0.748 7.124 -1.332 1.00 0.00 C ATOM 339 O LEU A 231 -0.825 7.631 -2.452 1.00 0.00 O ATOM 340 CB LEU A 231 1.608 6.290 -1.154 1.00 0.00 C ATOM 341 CG LEU A 231 2.583 5.111 -1.235 1.00 0.00 C ATOM 342 CD1 LEU A 231 3.238 5.052 -2.606 1.00 0.00 C ATOM 343 CD2 LEU A 231 3.636 5.211 -0.142 1.00 0.00 C ATOM 0 H LEU A 231 -0.233 5.157 -3.014 1.00 0.00 H new ATOM 0 HA LEU A 231 -0.089 5.521 -0.088 1.00 0.00 H new ATOM 0 HB2 LEU A 231 1.761 6.929 -2.024 1.00 0.00 H new ATOM 0 HB3 LEU A 231 1.853 6.885 -0.274 1.00 0.00 H new ATOM 0 HG LEU A 231 2.020 4.190 -1.084 1.00 0.00 H new ATOM 0 HD11 LEU A 231 3.927 4.208 -2.644 1.00 0.00 H new ATOM 0 HD12 LEU A 231 2.471 4.929 -3.371 1.00 0.00 H new ATOM 0 HD13 LEU A 231 3.786 5.976 -2.787 1.00 0.00 H new ATOM 0 HD21 LEU A 231 4.319 4.365 -0.216 1.00 0.00 H new ATOM 0 HD22 LEU A 231 4.195 6.140 -0.259 1.00 0.00 H new ATOM 0 HD23 LEU A 231 3.150 5.200 0.834 1.00 0.00 H new ATOM 355 N GLY A 232 -1.409 7.592 -0.279 1.00 0.00 N ATOM 356 CA GLY A 232 -2.275 8.750 -0.399 1.00 0.00 C ATOM 357 C GLY A 232 -3.173 8.930 0.809 1.00 0.00 C ATOM 358 O GLY A 232 -3.041 8.212 1.802 1.00 0.00 O ATOM 0 H GLY A 232 -1.360 7.189 0.657 1.00 0.00 H new ATOM 0 HA2 GLY A 232 -1.665 9.644 -0.531 1.00 0.00 H new ATOM 0 HA3 GLY A 232 -2.890 8.649 -1.293 1.00 0.00 H new ATOM 362 N GLU A 233 -4.087 9.891 0.728 1.00 0.00 N ATOM 363 CA GLU A 233 -5.009 10.162 1.824 1.00 0.00 C ATOM 364 C GLU A 233 -6.161 9.162 1.826 1.00 0.00 C ATOM 365 O GLU A 233 -6.381 8.453 0.845 1.00 0.00 O ATOM 366 CB GLU A 233 -5.555 11.587 1.718 1.00 0.00 C ATOM 367 CG GLU A 233 -4.487 12.627 1.426 1.00 0.00 C ATOM 368 CD GLU A 233 -4.401 12.978 -0.046 1.00 0.00 C ATOM 369 OE1 GLU A 233 -5.287 13.713 -0.534 1.00 0.00 O ATOM 370 OE2 GLU A 233 -3.451 12.520 -0.712 1.00 0.00 O ATOM 0 H GLU A 233 -4.209 10.495 -0.085 1.00 0.00 H new ATOM 0 HA GLU A 233 -4.461 10.059 2.761 1.00 0.00 H new ATOM 0 HB2 GLU A 233 -6.308 11.621 0.931 1.00 0.00 H new ATOM 0 HB3 GLU A 233 -6.057 11.845 2.651 1.00 0.00 H new ATOM 0 HG2 GLU A 233 -4.698 13.530 1.999 1.00 0.00 H new ATOM 0 HG3 GLU A 233 -3.520 12.254 1.764 1.00 0.00 H new ATOM 377 N THR A 234 -6.890 9.110 2.937 1.00 0.00 N ATOM 378 CA THR A 234 -8.020 8.195 3.067 1.00 0.00 C ATOM 379 C THR A 234 -9.335 8.962 3.155 1.00 0.00 C ATOM 380 O THR A 234 -9.345 10.174 3.372 1.00 0.00 O ATOM 381 CB THR A 234 -7.848 7.313 4.304 1.00 0.00 C ATOM 382 OG1 THR A 234 -8.017 8.071 5.487 1.00 0.00 O ATOM 383 CG2 THR A 234 -6.493 6.643 4.378 1.00 0.00 C ATOM 0 H THR A 234 -6.719 9.689 3.759 1.00 0.00 H new ATOM 0 HA THR A 234 -8.048 7.564 2.179 1.00 0.00 H new ATOM 0 HB THR A 234 -8.613 6.541 4.217 1.00 0.00 H new ATOM 0 HG1 THR A 234 -7.836 9.016 5.299 1.00 0.00 H new ATOM 0 HG21 THR A 234 -6.438 6.033 5.279 1.00 0.00 H new ATOM 0 HG22 THR A 234 -6.352 6.010 3.502 1.00 0.00 H new ATOM 0 HG23 THR A 234 -5.712 7.403 4.406 1.00 0.00 H new ATOM 391 N ASP A 235 -10.441 8.247 2.987 1.00 0.00 N ATOM 392 CA ASP A 235 -11.764 8.857 3.048 1.00 0.00 C ATOM 393 C ASP A 235 -12.322 8.826 4.472 1.00 0.00 C ATOM 394 O ASP A 235 -13.387 9.383 4.739 1.00 0.00 O ATOM 395 CB ASP A 235 -12.723 8.140 2.093 1.00 0.00 C ATOM 396 CG ASP A 235 -13.205 9.042 0.973 1.00 0.00 C ATOM 397 OD1 ASP A 235 -13.853 10.066 1.274 1.00 0.00 O ATOM 398 OD2 ASP A 235 -12.931 8.725 -0.202 1.00 0.00 O ATOM 0 H ASP A 235 -10.448 7.243 2.807 1.00 0.00 H new ATOM 0 HA ASP A 235 -11.668 9.899 2.743 1.00 0.00 H new ATOM 0 HB2 ASP A 235 -12.224 7.270 1.666 1.00 0.00 H new ATOM 0 HB3 ASP A 235 -13.582 7.771 2.654 1.00 0.00 H new ATOM 403 N PHE A 236 -11.601 8.176 5.383 1.00 0.00 N ATOM 404 CA PHE A 236 -12.037 8.082 6.773 1.00 0.00 C ATOM 405 C PHE A 236 -11.006 8.699 7.721 1.00 0.00 C ATOM 406 O PHE A 236 -11.316 8.998 8.875 1.00 0.00 O ATOM 407 CB PHE A 236 -12.295 6.618 7.155 1.00 0.00 C ATOM 408 CG PHE A 236 -11.053 5.841 7.505 1.00 0.00 C ATOM 409 CD1 PHE A 236 -10.041 5.661 6.574 1.00 0.00 C ATOM 410 CD2 PHE A 236 -10.900 5.295 8.769 1.00 0.00 C ATOM 411 CE1 PHE A 236 -8.903 4.948 6.899 1.00 0.00 C ATOM 412 CE2 PHE A 236 -9.764 4.582 9.099 1.00 0.00 C ATOM 413 CZ PHE A 236 -8.764 4.409 8.163 1.00 0.00 C ATOM 0 H PHE A 236 -10.716 7.709 5.184 1.00 0.00 H new ATOM 0 HA PHE A 236 -12.966 8.644 6.870 1.00 0.00 H new ATOM 0 HB2 PHE A 236 -12.978 6.591 8.004 1.00 0.00 H new ATOM 0 HB3 PHE A 236 -12.798 6.121 6.325 1.00 0.00 H new ATOM 0 HD1 PHE A 236 -10.143 6.082 5.585 1.00 0.00 H new ATOM 0 HD2 PHE A 236 -11.679 5.429 9.505 1.00 0.00 H new ATOM 0 HE1 PHE A 236 -8.123 4.812 6.165 1.00 0.00 H new ATOM 0 HE2 PHE A 236 -9.658 4.160 10.088 1.00 0.00 H new ATOM 0 HZ PHE A 236 -7.874 3.853 8.419 1.00 0.00 H new ATOM 423 N ALA A 237 -9.783 8.887 7.232 1.00 0.00 N ATOM 424 CA ALA A 237 -8.719 9.466 8.043 1.00 0.00 C ATOM 425 C ALA A 237 -8.185 10.749 7.417 1.00 0.00 C ATOM 426 O ALA A 237 -8.036 10.841 6.198 1.00 0.00 O ATOM 427 CB ALA A 237 -7.593 8.459 8.230 1.00 0.00 C ATOM 0 H ALA A 237 -9.506 8.647 6.280 1.00 0.00 H new ATOM 0 HA ALA A 237 -9.135 9.717 9.019 1.00 0.00 H new ATOM 0 HB1 ALA A 237 -6.805 8.903 8.837 1.00 0.00 H new ATOM 0 HB2 ALA A 237 -7.979 7.570 8.730 1.00 0.00 H new ATOM 0 HB3 ALA A 237 -7.188 8.181 7.257 1.00 0.00 H new ATOM 433 N LYS A 238 -7.898 11.737 8.258 1.00 0.00 N ATOM 434 CA LYS A 238 -7.379 13.016 7.785 1.00 0.00 C ATOM 435 C LYS A 238 -5.854 13.008 7.758 1.00 0.00 C ATOM 436 O LYS A 238 -5.207 12.717 8.764 1.00 0.00 O ATOM 437 CB LYS A 238 -7.879 14.154 8.679 1.00 0.00 C ATOM 438 CG LYS A 238 -7.638 13.916 10.159 1.00 0.00 C ATOM 439 CD LYS A 238 -7.512 15.226 10.920 1.00 0.00 C ATOM 440 CE LYS A 238 -6.485 15.125 12.036 1.00 0.00 C ATOM 441 NZ LYS A 238 -5.136 15.574 11.592 1.00 0.00 N ATOM 0 H LYS A 238 -8.016 11.677 9.269 1.00 0.00 H new ATOM 0 HA LYS A 238 -7.741 13.174 6.769 1.00 0.00 H new ATOM 0 HB2 LYS A 238 -7.386 15.080 8.384 1.00 0.00 H new ATOM 0 HB3 LYS A 238 -8.947 14.294 8.511 1.00 0.00 H new ATOM 0 HG2 LYS A 238 -8.459 13.331 10.573 1.00 0.00 H new ATOM 0 HG3 LYS A 238 -6.730 13.328 10.291 1.00 0.00 H new ATOM 0 HD2 LYS A 238 -7.226 16.022 10.232 1.00 0.00 H new ATOM 0 HD3 LYS A 238 -8.480 15.499 11.339 1.00 0.00 H new ATOM 0 HE2 LYS A 238 -6.808 15.730 12.883 1.00 0.00 H new ATOM 0 HE3 LYS A 238 -6.428 14.094 12.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 238 -4.465 15.490 12.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 238 -4.816 14.980 10.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 238 -5.184 16.566 11.283 1.00 0.00 H new ATOM 455 N GLY A 239 -5.287 13.329 6.600 1.00 0.00 N ATOM 456 CA GLY A 239 -3.841 13.354 6.463 1.00 0.00 C ATOM 457 C GLY A 239 -3.344 12.416 5.379 1.00 0.00 C ATOM 458 O GLY A 239 -4.116 11.976 4.528 1.00 0.00 O ATOM 0 H GLY A 239 -5.802 13.572 5.754 1.00 0.00 H new ATOM 0 HA2 GLY A 239 -3.518 14.370 6.236 1.00 0.00 H new ATOM 0 HA3 GLY A 239 -3.384 13.080 7.414 1.00 0.00 H new ATOM 462 N GLU A 240 -2.052 12.111 5.412 1.00 0.00 N ATOM 463 CA GLU A 240 -1.451 11.222 4.425 1.00 0.00 C ATOM 464 C GLU A 240 -1.351 9.798 4.966 1.00 0.00 C ATOM 465 O GLU A 240 -0.926 9.584 6.101 1.00 0.00 O ATOM 466 CB GLU A 240 -0.062 11.728 4.029 1.00 0.00 C ATOM 467 CG GLU A 240 0.944 11.707 5.169 1.00 0.00 C ATOM 468 CD GLU A 240 2.150 12.583 4.899 1.00 0.00 C ATOM 469 OE1 GLU A 240 1.965 13.800 4.688 1.00 0.00 O ATOM 470 OE2 GLU A 240 3.281 12.051 4.898 1.00 0.00 O ATOM 0 H GLU A 240 -1.400 12.466 6.112 1.00 0.00 H new ATOM 0 HA GLU A 240 -2.091 11.213 3.543 1.00 0.00 H new ATOM 0 HB2 GLU A 240 0.318 11.117 3.210 1.00 0.00 H new ATOM 0 HB3 GLU A 240 -0.150 12.747 3.652 1.00 0.00 H new ATOM 0 HG2 GLU A 240 0.456 12.040 6.085 1.00 0.00 H new ATOM 0 HG3 GLU A 240 1.275 10.682 5.338 1.00 0.00 H new ATOM 477 N TRP A 241 -1.743 8.829 4.144 1.00 0.00 N ATOM 478 CA TRP A 241 -1.697 7.426 4.541 1.00 0.00 C ATOM 479 C TRP A 241 -1.066 6.570 3.447 1.00 0.00 C ATOM 480 O TRP A 241 -0.924 7.011 2.307 1.00 0.00 O ATOM 481 CB TRP A 241 -3.105 6.921 4.858 1.00 0.00 C ATOM 482 CG TRP A 241 -3.703 7.560 6.074 1.00 0.00 C ATOM 483 CD1 TRP A 241 -4.163 8.840 6.184 1.00 0.00 C ATOM 484 CD2 TRP A 241 -3.900 6.951 7.354 1.00 0.00 C ATOM 485 NE1 TRP A 241 -4.635 9.065 7.455 1.00 0.00 N ATOM 486 CE2 TRP A 241 -4.485 7.919 8.193 1.00 0.00 C ATOM 487 CE3 TRP A 241 -3.641 5.680 7.874 1.00 0.00 C ATOM 488 CZ2 TRP A 241 -4.813 7.656 9.520 1.00 0.00 C ATOM 489 CZ3 TRP A 241 -3.967 5.420 9.192 1.00 0.00 C ATOM 490 CH2 TRP A 241 -4.549 6.403 10.002 1.00 0.00 C ATOM 0 H TRP A 241 -2.095 8.989 3.200 1.00 0.00 H new ATOM 0 HA TRP A 241 -1.080 7.345 5.436 1.00 0.00 H new ATOM 0 HB2 TRP A 241 -3.752 7.109 4.002 1.00 0.00 H new ATOM 0 HB3 TRP A 241 -3.072 5.841 5.002 1.00 0.00 H new ATOM 0 HD1 TRP A 241 -4.157 9.570 5.388 1.00 0.00 H new ATOM 0 HE1 TRP A 241 -5.032 9.941 7.794 1.00 0.00 H new ATOM 0 HE3 TRP A 241 -3.194 4.914 7.257 1.00 0.00 H new ATOM 0 HZ2 TRP A 241 -5.260 8.414 10.147 1.00 0.00 H new ATOM 0 HZ3 TRP A 241 -3.769 4.442 9.604 1.00 0.00 H new ATOM 0 HH2 TRP A 241 -4.794 6.167 11.027 1.00 0.00 H new ATOM 501 N CYS A 242 -0.689 5.346 3.802 1.00 0.00 N ATOM 502 CA CYS A 242 -0.073 4.431 2.847 1.00 0.00 C ATOM 503 C CYS A 242 -0.685 3.037 2.950 1.00 0.00 C ATOM 504 O CYS A 242 -1.224 2.656 3.989 1.00 0.00 O ATOM 505 CB CYS A 242 1.440 4.361 3.077 1.00 0.00 C ATOM 506 SG CYS A 242 2.305 3.217 1.974 1.00 0.00 S ATOM 0 H CYS A 242 -0.799 4.965 4.742 1.00 0.00 H new ATOM 0 HA CYS A 242 -0.262 4.813 1.844 1.00 0.00 H new ATOM 0 HB2 CYS A 242 1.862 5.358 2.951 1.00 0.00 H new ATOM 0 HB3 CYS A 242 1.626 4.064 4.109 1.00 0.00 H new ATOM 0 HG CYS A 242 3.576 3.231 2.245 1.00 0.00 H new ATOM 512 N GLY A 243 -0.593 2.286 1.861 1.00 0.00 N ATOM 513 CA GLY A 243 -1.134 0.941 1.824 1.00 0.00 C ATOM 514 C GLY A 243 -0.050 -0.108 1.676 1.00 0.00 C ATOM 515 O GLY A 243 0.763 -0.040 0.757 1.00 0.00 O ATOM 0 H GLY A 243 -0.149 2.588 0.994 1.00 0.00 H new ATOM 0 HA2 GLY A 243 -1.697 0.752 2.738 1.00 0.00 H new ATOM 0 HA3 GLY A 243 -1.835 0.856 0.994 1.00 0.00 H new ATOM 519 N VAL A 244 -0.036 -1.076 2.584 1.00 0.00 N ATOM 520 CA VAL A 244 0.961 -2.139 2.546 1.00 0.00 C ATOM 521 C VAL A 244 0.306 -3.512 2.636 1.00 0.00 C ATOM 522 O VAL A 244 -0.537 -3.753 3.500 1.00 0.00 O ATOM 523 CB VAL A 244 1.980 -1.998 3.698 1.00 0.00 C ATOM 524 CG1 VAL A 244 3.211 -2.849 3.435 1.00 0.00 C ATOM 525 CG2 VAL A 244 2.370 -0.542 3.908 1.00 0.00 C ATOM 0 H VAL A 244 -0.702 -1.147 3.354 1.00 0.00 H new ATOM 0 HA VAL A 244 1.482 -2.047 1.593 1.00 0.00 H new ATOM 0 HB VAL A 244 1.504 -2.355 4.611 1.00 0.00 H new ATOM 0 HG11 VAL A 244 3.915 -2.734 4.259 1.00 0.00 H new ATOM 0 HG12 VAL A 244 2.919 -3.896 3.351 1.00 0.00 H new ATOM 0 HG13 VAL A 244 3.683 -2.528 2.507 1.00 0.00 H new ATOM 0 HG21 VAL A 244 3.088 -0.472 4.725 1.00 0.00 H new ATOM 0 HG22 VAL A 244 2.819 -0.150 2.995 1.00 0.00 H new ATOM 0 HG23 VAL A 244 1.482 0.041 4.154 1.00 0.00 H new ATOM 535 N GLU A 245 0.708 -4.414 1.748 1.00 0.00 N ATOM 536 CA GLU A 245 0.170 -5.768 1.738 1.00 0.00 C ATOM 537 C GLU A 245 0.932 -6.633 2.733 1.00 0.00 C ATOM 538 O GLU A 245 2.116 -6.913 2.545 1.00 0.00 O ATOM 539 CB GLU A 245 0.263 -6.372 0.336 1.00 0.00 C ATOM 540 CG GLU A 245 -0.296 -7.783 0.243 1.00 0.00 C ATOM 541 CD GLU A 245 -0.751 -8.138 -1.159 1.00 0.00 C ATOM 542 OE1 GLU A 245 -0.993 -7.209 -1.959 1.00 0.00 O ATOM 543 OE2 GLU A 245 -0.864 -9.345 -1.459 1.00 0.00 O ATOM 0 H GLU A 245 1.405 -4.232 1.026 1.00 0.00 H new ATOM 0 HA GLU A 245 -0.880 -5.730 2.027 1.00 0.00 H new ATOM 0 HB2 GLU A 245 -0.274 -5.731 -0.363 1.00 0.00 H new ATOM 0 HB3 GLU A 245 1.307 -6.382 0.022 1.00 0.00 H new ATOM 0 HG2 GLU A 245 0.465 -8.494 0.565 1.00 0.00 H new ATOM 0 HG3 GLU A 245 -1.136 -7.883 0.930 1.00 0.00 H new ATOM 550 N LEU A 246 0.254 -7.036 3.801 1.00 0.00 N ATOM 551 CA LEU A 246 0.878 -7.846 4.836 1.00 0.00 C ATOM 552 C LEU A 246 1.234 -9.236 4.322 1.00 0.00 C ATOM 553 O LEU A 246 0.606 -9.753 3.398 1.00 0.00 O ATOM 554 CB LEU A 246 -0.049 -7.959 6.047 1.00 0.00 C ATOM 555 CG LEU A 246 -0.435 -6.626 6.689 1.00 0.00 C ATOM 556 CD1 LEU A 246 -1.539 -6.829 7.714 1.00 0.00 C ATOM 557 CD2 LEU A 246 0.779 -5.972 7.330 1.00 0.00 C ATOM 0 H LEU A 246 -0.727 -6.815 3.971 1.00 0.00 H new ATOM 0 HA LEU A 246 1.803 -7.351 5.132 1.00 0.00 H new ATOM 0 HB2 LEU A 246 -0.959 -8.476 5.743 1.00 0.00 H new ATOM 0 HB3 LEU A 246 0.435 -8.582 6.800 1.00 0.00 H new ATOM 0 HG LEU A 246 -0.809 -5.963 5.909 1.00 0.00 H new ATOM 0 HD11 LEU A 246 -1.801 -5.870 8.161 1.00 0.00 H new ATOM 0 HD12 LEU A 246 -2.416 -7.253 7.225 1.00 0.00 H new ATOM 0 HD13 LEU A 246 -1.193 -7.509 8.492 1.00 0.00 H new ATOM 0 HD21 LEU A 246 0.486 -5.024 7.782 1.00 0.00 H new ATOM 0 HD22 LEU A 246 1.184 -6.631 8.098 1.00 0.00 H new ATOM 0 HD23 LEU A 246 1.539 -5.791 6.570 1.00 0.00 H new ATOM 569 N ASP A 247 2.255 -9.832 4.931 1.00 0.00 N ATOM 570 CA ASP A 247 2.715 -11.162 4.547 1.00 0.00 C ATOM 571 C ASP A 247 1.779 -12.242 5.080 1.00 0.00 C ATOM 572 O ASP A 247 1.647 -13.311 4.484 1.00 0.00 O ATOM 573 CB ASP A 247 4.135 -11.394 5.069 1.00 0.00 C ATOM 574 CG ASP A 247 5.083 -10.274 4.686 1.00 0.00 C ATOM 575 OD1 ASP A 247 5.626 -10.317 3.561 1.00 0.00 O ATOM 576 OD2 ASP A 247 5.280 -9.354 5.507 1.00 0.00 O ATOM 0 H ASP A 247 2.782 -9.412 5.697 1.00 0.00 H new ATOM 0 HA ASP A 247 2.716 -11.221 3.459 1.00 0.00 H new ATOM 0 HB2 ASP A 247 4.109 -11.489 6.155 1.00 0.00 H new ATOM 0 HB3 ASP A 247 4.514 -12.337 4.676 1.00 0.00 H new ATOM 581 N GLU A 248 1.134 -11.959 6.207 1.00 0.00 N ATOM 582 CA GLU A 248 0.210 -12.908 6.820 1.00 0.00 C ATOM 583 C GLU A 248 -1.084 -12.215 7.240 1.00 0.00 C ATOM 584 O GLU A 248 -1.176 -10.988 7.209 1.00 0.00 O ATOM 585 CB GLU A 248 0.863 -13.576 8.032 1.00 0.00 C ATOM 586 CG GLU A 248 1.589 -14.869 7.697 1.00 0.00 C ATOM 587 CD GLU A 248 0.666 -16.071 7.695 1.00 0.00 C ATOM 588 OE1 GLU A 248 0.017 -16.324 8.732 1.00 0.00 O ATOM 589 OE2 GLU A 248 0.590 -16.760 6.655 1.00 0.00 O ATOM 0 H GLU A 248 1.234 -11.080 6.715 1.00 0.00 H new ATOM 0 HA GLU A 248 -0.033 -13.671 6.080 1.00 0.00 H new ATOM 0 HB2 GLU A 248 1.569 -12.879 8.484 1.00 0.00 H new ATOM 0 HB3 GLU A 248 0.097 -13.782 8.779 1.00 0.00 H new ATOM 0 HG2 GLU A 248 2.059 -14.775 6.718 1.00 0.00 H new ATOM 0 HG3 GLU A 248 2.389 -15.030 8.420 1.00 0.00 H new ATOM 596 N PRO A 249 -2.105 -12.996 7.639 1.00 0.00 N ATOM 597 CA PRO A 249 -3.397 -12.451 8.065 1.00 0.00 C ATOM 598 C PRO A 249 -3.280 -11.623 9.344 1.00 0.00 C ATOM 599 O PRO A 249 -3.758 -12.026 10.405 1.00 0.00 O ATOM 600 CB PRO A 249 -4.265 -13.697 8.309 1.00 0.00 C ATOM 601 CG PRO A 249 -3.535 -14.827 7.662 1.00 0.00 C ATOM 602 CD PRO A 249 -2.079 -14.463 7.705 1.00 0.00 C ATOM 0 HA PRO A 249 -3.814 -11.774 7.319 1.00 0.00 H new ATOM 0 HB2 PRO A 249 -4.401 -13.877 9.375 1.00 0.00 H new ATOM 0 HB3 PRO A 249 -5.258 -13.574 7.877 1.00 0.00 H new ATOM 0 HG2 PRO A 249 -3.718 -15.763 8.191 1.00 0.00 H new ATOM 0 HG3 PRO A 249 -3.871 -14.970 6.635 1.00 0.00 H new ATOM 0 HD2 PRO A 249 -1.601 -14.818 8.618 1.00 0.00 H new ATOM 0 HD3 PRO A 249 -1.530 -14.895 6.869 1.00 0.00 H new ATOM 610 N LEU A 250 -2.641 -10.464 9.234 1.00 0.00 N ATOM 611 CA LEU A 250 -2.460 -9.578 10.379 1.00 0.00 C ATOM 612 C LEU A 250 -2.965 -8.170 10.073 1.00 0.00 C ATOM 613 O LEU A 250 -2.556 -7.203 10.717 1.00 0.00 O ATOM 614 CB LEU A 250 -0.985 -9.528 10.783 1.00 0.00 C ATOM 615 CG LEU A 250 0.011 -9.511 9.617 1.00 0.00 C ATOM 616 CD1 LEU A 250 0.934 -8.305 9.715 1.00 0.00 C ATOM 617 CD2 LEU A 250 0.819 -10.798 9.587 1.00 0.00 C ATOM 0 H LEU A 250 -2.239 -10.115 8.364 1.00 0.00 H new ATOM 0 HA LEU A 250 -3.045 -9.977 11.208 1.00 0.00 H new ATOM 0 HB2 LEU A 250 -0.822 -8.639 11.392 1.00 0.00 H new ATOM 0 HB3 LEU A 250 -0.768 -10.391 11.413 1.00 0.00 H new ATOM 0 HG LEU A 250 -0.553 -9.436 8.687 1.00 0.00 H new ATOM 0 HD11 LEU A 250 1.632 -8.312 8.878 1.00 0.00 H new ATOM 0 HD12 LEU A 250 0.342 -7.390 9.685 1.00 0.00 H new ATOM 0 HD13 LEU A 250 1.490 -8.347 10.652 1.00 0.00 H new ATOM 0 HD21 LEU A 250 1.520 -10.768 8.753 1.00 0.00 H new ATOM 0 HD22 LEU A 250 1.370 -10.903 10.521 1.00 0.00 H new ATOM 0 HD23 LEU A 250 0.146 -11.647 9.465 1.00 0.00 H new ATOM 629 N GLY A 251 -3.853 -8.058 9.090 1.00 0.00 N ATOM 630 CA GLY A 251 -4.393 -6.762 8.725 1.00 0.00 C ATOM 631 C GLY A 251 -5.819 -6.572 9.203 1.00 0.00 C ATOM 632 O GLY A 251 -6.337 -7.387 9.965 1.00 0.00 O ATOM 0 H GLY A 251 -4.208 -8.841 8.541 1.00 0.00 H new ATOM 0 HA2 GLY A 251 -3.764 -5.978 9.147 1.00 0.00 H new ATOM 0 HA3 GLY A 251 -4.358 -6.650 7.641 1.00 0.00 H new ATOM 636 N LYS A 252 -6.453 -5.491 8.761 1.00 0.00 N ATOM 637 CA LYS A 252 -7.827 -5.198 9.153 1.00 0.00 C ATOM 638 C LYS A 252 -8.762 -5.215 7.948 1.00 0.00 C ATOM 639 O LYS A 252 -9.915 -5.636 8.052 1.00 0.00 O ATOM 640 CB LYS A 252 -7.900 -3.837 9.847 1.00 0.00 C ATOM 641 CG LYS A 252 -6.802 -3.615 10.874 1.00 0.00 C ATOM 642 CD LYS A 252 -7.141 -4.271 12.202 1.00 0.00 C ATOM 643 CE LYS A 252 -5.889 -4.576 13.009 1.00 0.00 C ATOM 644 NZ LYS A 252 -6.152 -5.561 14.094 1.00 0.00 N ATOM 0 H LYS A 252 -6.038 -4.804 8.132 1.00 0.00 H new ATOM 0 HA LYS A 252 -8.149 -5.975 9.846 1.00 0.00 H new ATOM 0 HB2 LYS A 252 -7.845 -3.051 9.093 1.00 0.00 H new ATOM 0 HB3 LYS A 252 -8.869 -3.741 10.337 1.00 0.00 H new ATOM 0 HG2 LYS A 252 -5.862 -4.019 10.497 1.00 0.00 H new ATOM 0 HG3 LYS A 252 -6.652 -2.546 11.023 1.00 0.00 H new ATOM 0 HD2 LYS A 252 -7.795 -3.615 12.777 1.00 0.00 H new ATOM 0 HD3 LYS A 252 -7.693 -5.194 12.023 1.00 0.00 H new ATOM 0 HE2 LYS A 252 -5.116 -4.964 12.346 1.00 0.00 H new ATOM 0 HE3 LYS A 252 -5.503 -3.653 13.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 252 -5.273 -5.741 14.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 252 -6.871 -5.180 14.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 252 -6.496 -6.451 13.679 1.00 0.00 H new ATOM 658 N ASN A 253 -8.262 -4.755 6.805 1.00 0.00 N ATOM 659 CA ASN A 253 -9.059 -4.718 5.583 1.00 0.00 C ATOM 660 C ASN A 253 -8.419 -5.560 4.484 1.00 0.00 C ATOM 661 O ASN A 253 -7.245 -5.924 4.570 1.00 0.00 O ATOM 662 CB ASN A 253 -9.230 -3.276 5.104 1.00 0.00 C ATOM 663 CG ASN A 253 -7.912 -2.636 4.709 1.00 0.00 C ATOM 664 OD1 ASN A 253 -7.623 -2.465 3.524 1.00 0.00 O ATOM 665 ND2 ASN A 253 -7.106 -2.281 5.701 1.00 0.00 N ATOM 0 H ASN A 253 -7.310 -4.403 6.699 1.00 0.00 H new ATOM 0 HA ASN A 253 -10.039 -5.138 5.809 1.00 0.00 H new ATOM 0 HB2 ASN A 253 -9.909 -3.258 4.252 1.00 0.00 H new ATOM 0 HB3 ASN A 253 -9.694 -2.686 5.894 1.00 0.00 H new ATOM 0 HD21 ASN A 253 -6.206 -1.847 5.496 1.00 0.00 H new ATOM 0 HD22 ASN A 253 -7.386 -2.442 6.668 1.00 0.00 H new ATOM 672 N ASP A 254 -9.198 -5.862 3.451 1.00 0.00 N ATOM 673 CA ASP A 254 -8.711 -6.660 2.331 1.00 0.00 C ATOM 674 C ASP A 254 -8.265 -5.767 1.174 1.00 0.00 C ATOM 675 O ASP A 254 -8.269 -6.189 0.018 1.00 0.00 O ATOM 676 CB ASP A 254 -9.797 -7.629 1.858 1.00 0.00 C ATOM 677 CG ASP A 254 -11.019 -6.911 1.318 1.00 0.00 C ATOM 678 OD1 ASP A 254 -11.466 -5.936 1.959 1.00 0.00 O ATOM 679 OD2 ASP A 254 -11.529 -7.324 0.256 1.00 0.00 O ATOM 0 H ASP A 254 -10.170 -5.566 3.366 1.00 0.00 H new ATOM 0 HA ASP A 254 -7.849 -7.232 2.674 1.00 0.00 H new ATOM 0 HB2 ASP A 254 -9.389 -8.278 1.083 1.00 0.00 H new ATOM 0 HB3 ASP A 254 -10.093 -8.271 2.688 1.00 0.00 H new ATOM 684 N GLY A 255 -7.882 -4.535 1.494 1.00 0.00 N ATOM 685 CA GLY A 255 -7.437 -3.608 0.467 1.00 0.00 C ATOM 686 C GLY A 255 -8.452 -2.518 0.180 1.00 0.00 C ATOM 687 O GLY A 255 -8.391 -1.866 -0.863 1.00 0.00 O ATOM 0 H GLY A 255 -7.871 -4.162 2.443 1.00 0.00 H new ATOM 0 HA2 GLY A 255 -6.498 -3.151 0.779 1.00 0.00 H new ATOM 0 HA3 GLY A 255 -7.234 -4.160 -0.451 1.00 0.00 H new ATOM 691 N ALA A 256 -9.387 -2.314 1.104 1.00 0.00 N ATOM 692 CA ALA A 256 -10.413 -1.292 0.937 1.00 0.00 C ATOM 693 C ALA A 256 -10.658 -0.538 2.238 1.00 0.00 C ATOM 694 O ALA A 256 -10.341 -1.028 3.322 1.00 0.00 O ATOM 695 CB ALA A 256 -11.706 -1.920 0.435 1.00 0.00 C ATOM 0 H ALA A 256 -9.454 -2.842 1.974 1.00 0.00 H new ATOM 0 HA ALA A 256 -10.058 -0.575 0.197 1.00 0.00 H new ATOM 0 HB1 ALA A 256 -12.464 -1.146 0.315 1.00 0.00 H new ATOM 0 HB2 ALA A 256 -11.527 -2.404 -0.525 1.00 0.00 H new ATOM 0 HB3 ALA A 256 -12.055 -2.660 1.155 1.00 0.00 H new ATOM 701 N VAL A 257 -11.222 0.661 2.122 1.00 0.00 N ATOM 702 CA VAL A 257 -11.509 1.487 3.287 1.00 0.00 C ATOM 703 C VAL A 257 -12.836 2.225 3.124 1.00 0.00 C ATOM 704 O VAL A 257 -12.991 3.050 2.224 1.00 0.00 O ATOM 705 CB VAL A 257 -10.385 2.515 3.536 1.00 0.00 C ATOM 706 CG1 VAL A 257 -10.685 3.361 4.766 1.00 0.00 C ATOM 707 CG2 VAL A 257 -9.043 1.812 3.678 1.00 0.00 C ATOM 0 H VAL A 257 -11.489 1.081 1.232 1.00 0.00 H new ATOM 0 HA VAL A 257 -11.574 0.817 4.144 1.00 0.00 H new ATOM 0 HB VAL A 257 -10.335 3.181 2.675 1.00 0.00 H new ATOM 0 HG11 VAL A 257 -9.878 4.078 4.920 1.00 0.00 H new ATOM 0 HG12 VAL A 257 -11.623 3.896 4.619 1.00 0.00 H new ATOM 0 HG13 VAL A 257 -10.769 2.715 5.640 1.00 0.00 H new ATOM 0 HG21 VAL A 257 -8.262 2.552 3.853 1.00 0.00 H new ATOM 0 HG22 VAL A 257 -9.082 1.119 4.519 1.00 0.00 H new ATOM 0 HG23 VAL A 257 -8.823 1.261 2.764 1.00 0.00 H new ATOM 717 N ALA A 258 -13.787 1.919 4.000 1.00 0.00 N ATOM 718 CA ALA A 258 -15.100 2.553 3.957 1.00 0.00 C ATOM 719 C ALA A 258 -15.782 2.325 2.611 1.00 0.00 C ATOM 720 O ALA A 258 -16.621 3.120 2.188 1.00 0.00 O ATOM 721 CB ALA A 258 -14.977 4.042 4.240 1.00 0.00 C ATOM 0 H ALA A 258 -13.673 1.236 4.749 1.00 0.00 H new ATOM 0 HA ALA A 258 -15.719 2.095 4.729 1.00 0.00 H new ATOM 0 HB1 ALA A 258 -15.965 4.502 4.205 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -14.543 4.190 5.229 1.00 0.00 H new ATOM 0 HB3 ALA A 258 -14.335 4.503 3.490 1.00 0.00 H new ATOM 727 N GLY A 259 -15.417 1.236 1.940 1.00 0.00 N ATOM 728 CA GLY A 259 -16.007 0.929 0.650 1.00 0.00 C ATOM 729 C GLY A 259 -15.145 1.384 -0.515 1.00 0.00 C ATOM 730 O GLY A 259 -15.483 1.142 -1.673 1.00 0.00 O ATOM 0 H GLY A 259 -14.724 0.562 2.266 1.00 0.00 H new ATOM 0 HA2 GLY A 259 -16.170 -0.146 0.577 1.00 0.00 H new ATOM 0 HA3 GLY A 259 -16.985 1.405 0.580 1.00 0.00 H new ATOM 734 N THR A 260 -14.029 2.043 -0.212 1.00 0.00 N ATOM 735 CA THR A 260 -13.123 2.526 -1.246 1.00 0.00 C ATOM 736 C THR A 260 -11.886 1.640 -1.342 1.00 0.00 C ATOM 737 O THR A 260 -11.084 1.576 -0.410 1.00 0.00 O ATOM 738 CB THR A 260 -12.711 3.970 -0.958 1.00 0.00 C ATOM 739 OG1 THR A 260 -13.849 4.778 -0.715 1.00 0.00 O ATOM 740 CG2 THR A 260 -11.928 4.607 -2.086 1.00 0.00 C ATOM 0 H THR A 260 -13.732 2.254 0.741 1.00 0.00 H new ATOM 0 HA THR A 260 -13.648 2.490 -2.201 1.00 0.00 H new ATOM 0 HB THR A 260 -12.070 3.916 -0.078 1.00 0.00 H new ATOM 0 HG1 THR A 260 -13.564 5.697 -0.531 1.00 0.00 H new ATOM 0 HG21 THR A 260 -11.668 5.630 -1.816 1.00 0.00 H new ATOM 0 HG22 THR A 260 -11.017 4.036 -2.264 1.00 0.00 H new ATOM 0 HG23 THR A 260 -12.535 4.614 -2.991 1.00 0.00 H new ATOM 748 N ARG A 261 -11.736 0.959 -2.473 1.00 0.00 N ATOM 749 CA ARG A 261 -10.596 0.078 -2.687 1.00 0.00 C ATOM 750 C ARG A 261 -9.423 0.845 -3.292 1.00 0.00 C ATOM 751 O ARG A 261 -9.537 1.420 -4.374 1.00 0.00 O ATOM 752 CB ARG A 261 -10.987 -1.086 -3.600 1.00 0.00 C ATOM 753 CG ARG A 261 -9.846 -2.052 -3.880 1.00 0.00 C ATOM 754 CD ARG A 261 -10.310 -3.246 -4.699 1.00 0.00 C ATOM 755 NE ARG A 261 -11.295 -4.053 -3.983 1.00 0.00 N ATOM 756 CZ ARG A 261 -12.609 -3.825 -4.008 1.00 0.00 C ATOM 757 NH1 ARG A 261 -13.103 -2.811 -4.708 1.00 0.00 N ATOM 758 NH2 ARG A 261 -13.429 -4.614 -3.328 1.00 0.00 N ATOM 0 H ARG A 261 -12.390 1.001 -3.255 1.00 0.00 H new ATOM 0 HA ARG A 261 -10.288 -0.318 -1.720 1.00 0.00 H new ATOM 0 HB2 ARG A 261 -11.811 -1.634 -3.143 1.00 0.00 H new ATOM 0 HB3 ARG A 261 -11.354 -0.687 -4.546 1.00 0.00 H new ATOM 0 HG2 ARG A 261 -9.051 -1.531 -4.414 1.00 0.00 H new ATOM 0 HG3 ARG A 261 -9.423 -2.399 -2.937 1.00 0.00 H new ATOM 0 HD2 ARG A 261 -10.741 -2.896 -5.637 1.00 0.00 H new ATOM 0 HD3 ARG A 261 -9.451 -3.866 -4.955 1.00 0.00 H new ATOM 0 HE ARG A 261 -10.957 -4.840 -3.429 1.00 0.00 H new ATOM 0 HH11 ARG A 261 -12.477 -2.200 -5.232 1.00 0.00 H new ATOM 0 HH12 ARG A 261 -14.109 -2.643 -4.722 1.00 0.00 H new ATOM 0 HH21 ARG A 261 -13.055 -5.394 -2.787 1.00 0.00 H new ATOM 0 HH22 ARG A 261 -14.434 -4.441 -3.346 1.00 0.00 H new ATOM 772 N TYR A 262 -8.298 0.846 -2.587 1.00 0.00 N ATOM 773 CA TYR A 262 -7.104 1.542 -3.051 1.00 0.00 C ATOM 774 C TYR A 262 -6.188 0.595 -3.819 1.00 0.00 C ATOM 775 O TYR A 262 -5.645 0.950 -4.864 1.00 0.00 O ATOM 776 CB TYR A 262 -6.353 2.155 -1.869 1.00 0.00 C ATOM 777 CG TYR A 262 -7.099 3.289 -1.202 1.00 0.00 C ATOM 778 CD1 TYR A 262 -8.176 3.038 -0.361 1.00 0.00 C ATOM 779 CD2 TYR A 262 -6.725 4.609 -1.415 1.00 0.00 C ATOM 780 CE1 TYR A 262 -8.861 4.073 0.248 1.00 0.00 C ATOM 781 CE2 TYR A 262 -7.405 5.649 -0.808 1.00 0.00 C ATOM 782 CZ TYR A 262 -8.471 5.375 0.022 1.00 0.00 C ATOM 783 OH TYR A 262 -9.150 6.406 0.627 1.00 0.00 O ATOM 0 H TYR A 262 -8.188 0.372 -1.691 1.00 0.00 H new ATOM 0 HA TYR A 262 -7.416 2.340 -3.724 1.00 0.00 H new ATOM 0 HB2 TYR A 262 -6.156 1.377 -1.131 1.00 0.00 H new ATOM 0 HB3 TYR A 262 -5.386 2.520 -2.214 1.00 0.00 H new ATOM 0 HD1 TYR A 262 -8.483 2.018 -0.180 1.00 0.00 H new ATOM 0 HD2 TYR A 262 -5.890 4.827 -2.065 1.00 0.00 H new ATOM 0 HE1 TYR A 262 -9.698 3.862 0.898 1.00 0.00 H new ATOM 0 HE2 TYR A 262 -7.102 6.671 -0.983 1.00 0.00 H new ATOM 0 HH TYR A 262 -9.707 6.051 1.351 1.00 0.00 H new ATOM 793 N PHE A 263 -6.025 -0.615 -3.294 1.00 0.00 N ATOM 794 CA PHE A 263 -5.179 -1.617 -3.929 1.00 0.00 C ATOM 795 C PHE A 263 -5.771 -3.013 -3.756 1.00 0.00 C ATOM 796 O PHE A 263 -6.756 -3.194 -3.041 1.00 0.00 O ATOM 797 CB PHE A 263 -3.764 -1.571 -3.345 1.00 0.00 C ATOM 798 CG PHE A 263 -3.733 -1.472 -1.846 1.00 0.00 C ATOM 799 CD1 PHE A 263 -3.949 -0.255 -1.218 1.00 0.00 C ATOM 800 CD2 PHE A 263 -3.483 -2.589 -1.068 1.00 0.00 C ATOM 801 CE1 PHE A 263 -3.919 -0.158 0.160 1.00 0.00 C ATOM 802 CE2 PHE A 263 -3.451 -2.497 0.311 1.00 0.00 C ATOM 803 CZ PHE A 263 -3.669 -1.280 0.925 1.00 0.00 C ATOM 0 H PHE A 263 -6.469 -0.925 -2.429 1.00 0.00 H new ATOM 0 HA PHE A 263 -5.128 -1.392 -4.994 1.00 0.00 H new ATOM 0 HB2 PHE A 263 -3.224 -2.467 -3.653 1.00 0.00 H new ATOM 0 HB3 PHE A 263 -3.233 -0.718 -3.768 1.00 0.00 H new ATOM 0 HD1 PHE A 263 -4.143 0.626 -1.812 1.00 0.00 H new ATOM 0 HD2 PHE A 263 -3.311 -3.543 -1.544 1.00 0.00 H new ATOM 0 HE1 PHE A 263 -4.091 0.795 0.638 1.00 0.00 H new ATOM 0 HE2 PHE A 263 -3.256 -3.376 0.907 1.00 0.00 H new ATOM 0 HZ PHE A 263 -3.644 -1.206 2.002 1.00 0.00 H new ATOM 813 N GLN A 264 -5.166 -3.995 -4.414 1.00 0.00 N ATOM 814 CA GLN A 264 -5.638 -5.372 -4.332 1.00 0.00 C ATOM 815 C GLN A 264 -4.724 -6.206 -3.443 1.00 0.00 C ATOM 816 O GLN A 264 -3.511 -6.252 -3.652 1.00 0.00 O ATOM 817 CB GLN A 264 -5.718 -5.992 -5.728 1.00 0.00 C ATOM 818 CG GLN A 264 -6.376 -7.362 -5.749 1.00 0.00 C ATOM 819 CD GLN A 264 -7.889 -7.284 -5.702 1.00 0.00 C ATOM 820 OE1 GLN A 264 -8.550 -7.239 -6.739 1.00 0.00 O ATOM 821 NE2 GLN A 264 -8.445 -7.270 -4.496 1.00 0.00 N ATOM 0 H GLN A 264 -4.348 -3.864 -5.010 1.00 0.00 H new ATOM 0 HA GLN A 264 -6.635 -5.363 -3.891 1.00 0.00 H new ATOM 0 HB2 GLN A 264 -6.274 -5.321 -6.383 1.00 0.00 H new ATOM 0 HB3 GLN A 264 -4.711 -6.075 -6.138 1.00 0.00 H new ATOM 0 HG2 GLN A 264 -6.071 -7.893 -6.651 1.00 0.00 H new ATOM 0 HG3 GLN A 264 -6.020 -7.945 -4.900 1.00 0.00 H new ATOM 0 HE21 GLN A 264 -7.858 -7.309 -3.663 1.00 0.00 H new ATOM 0 HE22 GLN A 264 -9.460 -7.220 -4.403 1.00 0.00 H new ATOM 830 N CYS A 265 -5.313 -6.867 -2.452 1.00 0.00 N ATOM 831 CA CYS A 265 -4.552 -7.702 -1.531 1.00 0.00 C ATOM 832 C CYS A 265 -5.428 -8.800 -0.937 1.00 0.00 C ATOM 833 O CYS A 265 -6.652 -8.689 -0.917 1.00 0.00 O ATOM 834 CB CYS A 265 -3.954 -6.847 -0.411 1.00 0.00 C ATOM 835 SG CYS A 265 -5.166 -5.835 0.471 1.00 0.00 S ATOM 0 H CYS A 265 -6.316 -6.840 -2.266 1.00 0.00 H new ATOM 0 HA CYS A 265 -3.744 -8.173 -2.091 1.00 0.00 H new ATOM 0 HB2 CYS A 265 -3.454 -7.501 0.303 1.00 0.00 H new ATOM 0 HB3 CYS A 265 -3.191 -6.194 -0.835 1.00 0.00 H new ATOM 0 HG CYS A 265 -4.746 -4.606 0.528 1.00 0.00 H new ATOM 841 N GLN A 266 -4.788 -9.860 -0.456 1.00 0.00 N ATOM 842 CA GLN A 266 -5.503 -10.982 0.140 1.00 0.00 C ATOM 843 C GLN A 266 -6.307 -10.534 1.359 1.00 0.00 C ATOM 844 O GLN A 266 -6.102 -9.438 1.880 1.00 0.00 O ATOM 845 CB GLN A 266 -4.521 -12.085 0.539 1.00 0.00 C ATOM 846 CG GLN A 266 -4.177 -13.033 -0.597 1.00 0.00 C ATOM 847 CD GLN A 266 -3.782 -14.411 -0.105 1.00 0.00 C ATOM 848 OE1 GLN A 266 -2.653 -14.857 -0.310 1.00 0.00 O ATOM 849 NE2 GLN A 266 -4.715 -15.096 0.546 1.00 0.00 N ATOM 0 H GLN A 266 -3.774 -9.966 -0.467 1.00 0.00 H new ATOM 0 HA GLN A 266 -6.197 -11.373 -0.604 1.00 0.00 H new ATOM 0 HB2 GLN A 266 -3.604 -11.627 0.909 1.00 0.00 H new ATOM 0 HB3 GLN A 266 -4.946 -12.658 1.363 1.00 0.00 H new ATOM 0 HG2 GLN A 266 -5.034 -13.121 -1.264 1.00 0.00 H new ATOM 0 HG3 GLN A 266 -3.360 -12.612 -1.182 1.00 0.00 H new ATOM 0 HE21 GLN A 266 -5.638 -14.687 0.694 1.00 0.00 H new ATOM 0 HE22 GLN A 266 -4.509 -16.031 0.899 1.00 0.00 H new ATOM 858 N PRO A 267 -7.238 -11.380 1.831 1.00 0.00 N ATOM 859 CA PRO A 267 -8.073 -11.067 2.995 1.00 0.00 C ATOM 860 C PRO A 267 -7.247 -10.912 4.269 1.00 0.00 C ATOM 861 O PRO A 267 -6.358 -11.717 4.545 1.00 0.00 O ATOM 862 CB PRO A 267 -9.012 -12.276 3.111 1.00 0.00 C ATOM 863 CG PRO A 267 -8.938 -12.960 1.789 1.00 0.00 C ATOM 864 CD PRO A 267 -7.554 -12.703 1.269 1.00 0.00 C ATOM 0 HA PRO A 267 -8.598 -10.120 2.872 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -8.699 -12.941 3.916 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -10.032 -11.962 3.335 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -9.124 -14.029 1.892 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -9.691 -12.569 1.105 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -6.848 -13.464 1.603 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -7.525 -12.698 0.179 1.00 0.00 H new ATOM 872 N LYS A 268 -7.550 -9.875 5.043 1.00 0.00 N ATOM 873 CA LYS A 268 -6.838 -9.613 6.290 1.00 0.00 C ATOM 874 C LYS A 268 -5.360 -9.323 6.039 1.00 0.00 C ATOM 875 O LYS A 268 -4.536 -9.437 6.945 1.00 0.00 O ATOM 876 CB LYS A 268 -6.979 -10.805 7.242 1.00 0.00 C ATOM 877 CG LYS A 268 -8.422 -11.137 7.589 1.00 0.00 C ATOM 878 CD LYS A 268 -8.921 -10.307 8.764 1.00 0.00 C ATOM 879 CE LYS A 268 -9.224 -11.173 9.978 1.00 0.00 C ATOM 880 NZ LYS A 268 -8.545 -10.669 11.204 1.00 0.00 N ATOM 0 H LYS A 268 -8.285 -9.201 4.829 1.00 0.00 H new ATOM 0 HA LYS A 268 -7.284 -8.730 6.747 1.00 0.00 H new ATOM 0 HB2 LYS A 268 -6.512 -11.679 6.788 1.00 0.00 H new ATOM 0 HB3 LYS A 268 -6.432 -10.593 8.161 1.00 0.00 H new ATOM 0 HG2 LYS A 268 -9.056 -10.958 6.721 1.00 0.00 H new ATOM 0 HG3 LYS A 268 -8.504 -12.197 7.830 1.00 0.00 H new ATOM 0 HD2 LYS A 268 -8.171 -9.561 9.027 1.00 0.00 H new ATOM 0 HD3 LYS A 268 -9.820 -9.765 8.471 1.00 0.00 H new ATOM 0 HE2 LYS A 268 -10.301 -11.200 10.145 1.00 0.00 H new ATOM 0 HE3 LYS A 268 -8.906 -12.197 9.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 -8.777 -11.286 12.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 -7.516 -10.667 11.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 -8.867 -9.701 11.406 1.00 0.00 H new ATOM 894 N TYR A 269 -5.029 -8.944 4.807 1.00 0.00 N ATOM 895 CA TYR A 269 -3.648 -8.634 4.449 1.00 0.00 C ATOM 896 C TYR A 269 -3.472 -7.140 4.182 1.00 0.00 C ATOM 897 O TYR A 269 -2.355 -6.624 4.207 1.00 0.00 O ATOM 898 CB TYR A 269 -3.222 -9.432 3.215 1.00 0.00 C ATOM 899 CG TYR A 269 -2.670 -10.804 3.530 1.00 0.00 C ATOM 900 CD1 TYR A 269 -3.245 -11.597 4.515 1.00 0.00 C ATOM 901 CD2 TYR A 269 -1.575 -11.306 2.838 1.00 0.00 C ATOM 902 CE1 TYR A 269 -2.742 -12.851 4.804 1.00 0.00 C ATOM 903 CE2 TYR A 269 -1.067 -12.560 3.120 1.00 0.00 C ATOM 904 CZ TYR A 269 -1.654 -13.328 4.103 1.00 0.00 C ATOM 905 OH TYR A 269 -1.152 -14.578 4.386 1.00 0.00 O ATOM 0 H TYR A 269 -5.696 -8.844 4.042 1.00 0.00 H new ATOM 0 HA TYR A 269 -3.016 -8.913 5.292 1.00 0.00 H new ATOM 0 HB2 TYR A 269 -4.080 -9.540 2.551 1.00 0.00 H new ATOM 0 HB3 TYR A 269 -2.467 -8.864 2.671 1.00 0.00 H new ATOM 0 HD1 TYR A 269 -4.099 -11.227 5.064 1.00 0.00 H new ATOM 0 HD2 TYR A 269 -1.113 -10.707 2.067 1.00 0.00 H new ATOM 0 HE1 TYR A 269 -3.198 -13.455 5.575 1.00 0.00 H new ATOM 0 HE2 TYR A 269 -0.215 -12.936 2.573 1.00 0.00 H new ATOM 0 HH TYR A 269 -0.184 -14.584 4.234 1.00 0.00 H new ATOM 915 N GLY A 270 -4.578 -6.448 3.920 1.00 0.00 N ATOM 916 CA GLY A 270 -4.514 -5.025 3.648 1.00 0.00 C ATOM 917 C GLY A 270 -4.402 -4.191 4.909 1.00 0.00 C ATOM 918 O GLY A 270 -5.293 -4.213 5.757 1.00 0.00 O ATOM 0 H GLY A 270 -5.516 -6.848 3.892 1.00 0.00 H new ATOM 0 HA2 GLY A 270 -3.658 -4.821 3.005 1.00 0.00 H new ATOM 0 HA3 GLY A 270 -5.405 -4.724 3.097 1.00 0.00 H new ATOM 922 N LEU A 271 -3.306 -3.449 5.028 1.00 0.00 N ATOM 923 CA LEU A 271 -3.077 -2.598 6.191 1.00 0.00 C ATOM 924 C LEU A 271 -2.786 -1.165 5.754 1.00 0.00 C ATOM 925 O LEU A 271 -1.895 -0.923 4.938 1.00 0.00 O ATOM 926 CB LEU A 271 -1.919 -3.142 7.028 1.00 0.00 C ATOM 927 CG LEU A 271 -1.999 -2.833 8.525 1.00 0.00 C ATOM 928 CD1 LEU A 271 -3.243 -3.462 9.137 1.00 0.00 C ATOM 929 CD2 LEU A 271 -0.745 -3.323 9.236 1.00 0.00 C ATOM 0 H LEU A 271 -2.561 -3.420 4.332 1.00 0.00 H new ATOM 0 HA LEU A 271 -3.979 -2.598 6.802 1.00 0.00 H new ATOM 0 HB2 LEU A 271 -1.874 -4.223 6.898 1.00 0.00 H new ATOM 0 HB3 LEU A 271 -0.986 -2.735 6.638 1.00 0.00 H new ATOM 0 HG LEU A 271 -2.067 -1.752 8.651 1.00 0.00 H new ATOM 0 HD11 LEU A 271 -3.281 -3.231 10.202 1.00 0.00 H new ATOM 0 HD12 LEU A 271 -4.131 -3.063 8.647 1.00 0.00 H new ATOM 0 HD13 LEU A 271 -3.208 -4.543 9.002 1.00 0.00 H new ATOM 0 HD21 LEU A 271 -0.817 -3.096 10.300 1.00 0.00 H new ATOM 0 HD22 LEU A 271 -0.648 -4.400 9.101 1.00 0.00 H new ATOM 0 HD23 LEU A 271 0.129 -2.824 8.817 1.00 0.00 H new ATOM 941 N PHE A 272 -3.548 -0.219 6.293 1.00 0.00 N ATOM 942 CA PHE A 272 -3.379 1.189 5.949 1.00 0.00 C ATOM 943 C PHE A 272 -2.697 1.961 7.076 1.00 0.00 C ATOM 944 O PHE A 272 -3.273 2.144 8.146 1.00 0.00 O ATOM 945 CB PHE A 272 -4.741 1.822 5.650 1.00 0.00 C ATOM 946 CG PHE A 272 -5.281 1.486 4.288 1.00 0.00 C ATOM 947 CD1 PHE A 272 -5.362 0.169 3.866 1.00 0.00 C ATOM 948 CD2 PHE A 272 -5.712 2.489 3.435 1.00 0.00 C ATOM 949 CE1 PHE A 272 -5.863 -0.141 2.615 1.00 0.00 C ATOM 950 CE2 PHE A 272 -6.212 2.185 2.184 1.00 0.00 C ATOM 951 CZ PHE A 272 -6.289 0.869 1.772 1.00 0.00 C ATOM 0 H PHE A 272 -4.289 -0.401 6.970 1.00 0.00 H new ATOM 0 HA PHE A 272 -2.744 1.241 5.064 1.00 0.00 H new ATOM 0 HB2 PHE A 272 -5.456 1.495 6.405 1.00 0.00 H new ATOM 0 HB3 PHE A 272 -4.655 2.905 5.739 1.00 0.00 H new ATOM 0 HD1 PHE A 272 -5.031 -0.623 4.521 1.00 0.00 H new ATOM 0 HD2 PHE A 272 -5.656 3.520 3.752 1.00 0.00 H new ATOM 0 HE1 PHE A 272 -5.922 -1.171 2.297 1.00 0.00 H new ATOM 0 HE2 PHE A 272 -6.543 2.976 1.528 1.00 0.00 H new ATOM 0 HZ PHE A 272 -6.681 0.629 0.794 1.00 0.00 H new ATOM 961 N ALA A 273 -1.476 2.425 6.822 1.00 0.00 N ATOM 962 CA ALA A 273 -0.731 3.192 7.817 1.00 0.00 C ATOM 963 C ALA A 273 0.064 4.319 7.161 1.00 0.00 C ATOM 964 O ALA A 273 0.507 4.198 6.019 1.00 0.00 O ATOM 965 CB ALA A 273 0.196 2.289 8.620 1.00 0.00 C ATOM 0 H ALA A 273 -0.983 2.284 5.940 1.00 0.00 H new ATOM 0 HA ALA A 273 -1.455 3.637 8.500 1.00 0.00 H new ATOM 0 HB1 ALA A 273 0.739 2.885 9.354 1.00 0.00 H new ATOM 0 HB2 ALA A 273 -0.392 1.529 9.134 1.00 0.00 H new ATOM 0 HB3 ALA A 273 0.906 1.806 7.948 1.00 0.00 H new ATOM 971 N PRO A 274 0.251 5.435 7.883 1.00 0.00 N ATOM 972 CA PRO A 274 0.991 6.598 7.381 1.00 0.00 C ATOM 973 C PRO A 274 2.338 6.222 6.776 1.00 0.00 C ATOM 974 O PRO A 274 2.861 5.135 7.018 1.00 0.00 O ATOM 975 CB PRO A 274 1.201 7.449 8.630 1.00 0.00 C ATOM 976 CG PRO A 274 0.079 7.090 9.535 1.00 0.00 C ATOM 977 CD PRO A 274 -0.253 5.650 9.252 1.00 0.00 C ATOM 0 HA PRO A 274 0.449 7.103 6.581 1.00 0.00 H new ATOM 0 HB2 PRO A 274 2.165 7.238 9.094 1.00 0.00 H new ATOM 0 HB3 PRO A 274 1.189 8.512 8.390 1.00 0.00 H new ATOM 0 HG2 PRO A 274 0.364 7.225 10.578 1.00 0.00 H new ATOM 0 HG3 PRO A 274 -0.785 7.730 9.355 1.00 0.00 H new ATOM 0 HD2 PRO A 274 0.228 4.981 9.965 1.00 0.00 H new ATOM 0 HD3 PRO A 274 -1.326 5.467 9.317 1.00 0.00 H new ATOM 985 N VAL A 275 2.899 7.137 5.992 1.00 0.00 N ATOM 986 CA VAL A 275 4.190 6.911 5.357 1.00 0.00 C ATOM 987 C VAL A 275 5.317 6.956 6.385 1.00 0.00 C ATOM 988 O VAL A 275 6.324 6.262 6.247 1.00 0.00 O ATOM 989 CB VAL A 275 4.466 7.957 4.255 1.00 0.00 C ATOM 990 CG1 VAL A 275 4.496 9.360 4.842 1.00 0.00 C ATOM 991 CG2 VAL A 275 5.768 7.642 3.532 1.00 0.00 C ATOM 0 H VAL A 275 2.479 8.042 5.782 1.00 0.00 H new ATOM 0 HA VAL A 275 4.155 5.921 4.902 1.00 0.00 H new ATOM 0 HB VAL A 275 3.655 7.913 3.528 1.00 0.00 H new ATOM 0 HG11 VAL A 275 4.692 10.082 4.049 1.00 0.00 H new ATOM 0 HG12 VAL A 275 3.534 9.581 5.305 1.00 0.00 H new ATOM 0 HG13 VAL A 275 5.283 9.423 5.593 1.00 0.00 H new ATOM 0 HG21 VAL A 275 5.945 8.390 2.759 1.00 0.00 H new ATOM 0 HG22 VAL A 275 6.592 7.654 4.245 1.00 0.00 H new ATOM 0 HG23 VAL A 275 5.700 6.656 3.073 1.00 0.00 H new ATOM 1001 N HIS A 276 5.137 7.773 7.420 1.00 0.00 N ATOM 1002 CA HIS A 276 6.139 7.899 8.473 1.00 0.00 C ATOM 1003 C HIS A 276 6.086 6.702 9.417 1.00 0.00 C ATOM 1004 O HIS A 276 7.088 6.346 10.038 1.00 0.00 O ATOM 1005 CB HIS A 276 5.941 9.199 9.258 1.00 0.00 C ATOM 1006 CG HIS A 276 4.522 9.458 9.660 1.00 0.00 C ATOM 1007 ND1 HIS A 276 3.618 8.667 10.288 1.00 0.00 N flip ATOM 1008 CD2 HIS A 276 3.882 10.657 9.427 1.00 0.00 C flip ATOM 1009 CE1 HIS A 276 2.463 9.398 10.422 1.00 0.00 C flip ATOM 1010 NE2 HIS A 276 2.648 10.594 9.895 1.00 0.00 N flip ATOM 0 H HIS A 276 4.310 8.355 7.551 1.00 0.00 H new ATOM 0 HA HIS A 276 7.121 7.925 8.000 1.00 0.00 H new ATOM 0 HB2 HIS A 276 6.562 9.169 10.153 1.00 0.00 H new ATOM 0 HB3 HIS A 276 6.295 10.034 8.653 1.00 0.00 H new ATOM 0 HD2 HIS A 276 4.321 11.514 8.938 1.00 0.00 H new ATOM 0 HE1 HIS A 276 1.551 9.050 10.884 1.00 0.00 H new ATOM 0 HE2 HIS A 276 1.956 11.342 9.856 1.00 0.00 H new ATOM 1019 N LYS A 277 4.915 6.077 9.514 1.00 0.00 N ATOM 1020 CA LYS A 277 4.742 4.913 10.375 1.00 0.00 C ATOM 1021 C LYS A 277 5.323 3.668 9.721 1.00 0.00 C ATOM 1022 O LYS A 277 5.612 2.678 10.393 1.00 0.00 O ATOM 1023 CB LYS A 277 3.259 4.685 10.679 1.00 0.00 C ATOM 1024 CG LYS A 277 2.718 5.566 11.791 1.00 0.00 C ATOM 1025 CD LYS A 277 2.117 4.736 12.916 1.00 0.00 C ATOM 1026 CE LYS A 277 3.195 4.114 13.791 1.00 0.00 C ATOM 1027 NZ LYS A 277 2.616 3.240 14.847 1.00 0.00 N ATOM 0 H LYS A 277 4.075 6.357 9.008 1.00 0.00 H new ATOM 0 HA LYS A 277 5.273 5.105 11.307 1.00 0.00 H new ATOM 0 HB2 LYS A 277 2.680 4.864 9.773 1.00 0.00 H new ATOM 0 HB3 LYS A 277 3.110 3.640 10.951 1.00 0.00 H new ATOM 0 HG2 LYS A 277 3.520 6.190 12.186 1.00 0.00 H new ATOM 0 HG3 LYS A 277 1.960 6.238 11.388 1.00 0.00 H new ATOM 0 HD2 LYS A 277 1.470 5.365 13.527 1.00 0.00 H new ATOM 0 HD3 LYS A 277 1.491 3.949 12.494 1.00 0.00 H new ATOM 0 HE2 LYS A 277 3.875 3.531 13.170 1.00 0.00 H new ATOM 0 HE3 LYS A 277 3.785 4.903 14.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 277 2.742 3.689 15.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 277 1.602 3.100 14.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 277 3.099 2.319 14.839 1.00 0.00 H new ATOM 1041 N VAL A 278 5.492 3.720 8.404 1.00 0.00 N ATOM 1042 CA VAL A 278 6.038 2.593 7.664 1.00 0.00 C ATOM 1043 C VAL A 278 7.541 2.734 7.470 1.00 0.00 C ATOM 1044 O VAL A 278 8.049 3.829 7.229 1.00 0.00 O ATOM 1045 CB VAL A 278 5.367 2.435 6.287 1.00 0.00 C ATOM 1046 CG1 VAL A 278 5.761 1.113 5.654 1.00 0.00 C ATOM 1047 CG2 VAL A 278 3.855 2.540 6.403 1.00 0.00 C ATOM 0 H VAL A 278 5.259 4.530 7.830 1.00 0.00 H new ATOM 0 HA VAL A 278 5.833 1.704 8.260 1.00 0.00 H new ATOM 0 HB VAL A 278 5.714 3.245 5.646 1.00 0.00 H new ATOM 0 HG11 VAL A 278 5.278 1.017 4.681 1.00 0.00 H new ATOM 0 HG12 VAL A 278 6.843 1.079 5.527 1.00 0.00 H new ATOM 0 HG13 VAL A 278 5.445 0.293 6.298 1.00 0.00 H new ATOM 0 HG21 VAL A 278 3.406 2.425 5.417 1.00 0.00 H new ATOM 0 HG22 VAL A 278 3.485 1.756 7.064 1.00 0.00 H new ATOM 0 HG23 VAL A 278 3.588 3.515 6.812 1.00 0.00 H new ATOM 1057 N THR A 279 8.249 1.616 7.581 1.00 0.00 N ATOM 1058 CA THR A 279 9.696 1.606 7.421 1.00 0.00 C ATOM 1059 C THR A 279 10.136 0.442 6.542 1.00 0.00 C ATOM 1060 O THR A 279 9.668 -0.686 6.706 1.00 0.00 O ATOM 1061 CB THR A 279 10.377 1.517 8.788 1.00 0.00 C ATOM 1062 OG1 THR A 279 9.478 1.873 9.822 1.00 0.00 O ATOM 1063 CG2 THR A 279 11.591 2.410 8.910 1.00 0.00 C ATOM 0 H THR A 279 7.842 0.703 7.782 1.00 0.00 H new ATOM 0 HA THR A 279 9.992 2.535 6.935 1.00 0.00 H new ATOM 0 HB THR A 279 10.697 0.479 8.883 1.00 0.00 H new ATOM 0 HG1 THR A 279 9.933 1.808 10.688 1.00 0.00 H new ATOM 0 HG21 THR A 279 12.026 2.299 9.903 1.00 0.00 H new ATOM 0 HG22 THR A 279 12.327 2.128 8.158 1.00 0.00 H new ATOM 0 HG23 THR A 279 11.296 3.448 8.757 1.00 0.00 H new ATOM 1071 N LYS A 280 11.042 0.717 5.610 1.00 0.00 N ATOM 1072 CA LYS A 280 11.545 -0.311 4.707 1.00 0.00 C ATOM 1073 C LYS A 280 12.263 -1.410 5.487 1.00 0.00 C ATOM 1074 O LYS A 280 13.075 -1.132 6.369 1.00 0.00 O ATOM 1075 CB LYS A 280 12.492 0.306 3.675 1.00 0.00 C ATOM 1076 CG LYS A 280 12.064 0.062 2.237 1.00 0.00 C ATOM 1077 CD LYS A 280 13.210 0.297 1.267 1.00 0.00 C ATOM 1078 CE LYS A 280 13.135 1.679 0.639 1.00 0.00 C ATOM 1079 NZ LYS A 280 12.988 2.748 1.665 1.00 0.00 N ATOM 0 H LYS A 280 11.443 1.643 5.460 1.00 0.00 H new ATOM 0 HA LYS A 280 10.696 -0.754 4.187 1.00 0.00 H new ATOM 0 HB2 LYS A 280 12.556 1.380 3.849 1.00 0.00 H new ATOM 0 HB3 LYS A 280 13.492 -0.101 3.822 1.00 0.00 H new ATOM 0 HG2 LYS A 280 11.702 -0.961 2.133 1.00 0.00 H new ATOM 0 HG3 LYS A 280 11.233 0.722 1.987 1.00 0.00 H new ATOM 0 HD2 LYS A 280 14.160 0.185 1.790 1.00 0.00 H new ATOM 0 HD3 LYS A 280 13.186 -0.461 0.484 1.00 0.00 H new ATOM 0 HE2 LYS A 280 14.035 1.860 0.052 1.00 0.00 H new ATOM 0 HE3 LYS A 280 12.292 1.719 -0.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 280 13.177 3.674 1.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 280 12.020 2.734 2.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 280 13.665 2.583 2.437 1.00 0.00 H new ATOM 1093 N ILE A 281 11.957 -2.659 5.154 1.00 0.00 N ATOM 1094 CA ILE A 281 12.571 -3.800 5.822 1.00 0.00 C ATOM 1095 C ILE A 281 13.835 -4.249 5.093 1.00 0.00 C ATOM 1096 O ILE A 281 14.759 -4.785 5.703 1.00 0.00 O ATOM 1097 CB ILE A 281 11.592 -4.988 5.919 1.00 0.00 C ATOM 1098 CG1 ILE A 281 12.216 -6.133 6.719 1.00 0.00 C ATOM 1099 CG2 ILE A 281 11.189 -5.462 4.530 1.00 0.00 C ATOM 1100 CD1 ILE A 281 11.201 -6.974 7.464 1.00 0.00 C ATOM 0 H ILE A 281 11.287 -2.907 4.426 1.00 0.00 H new ATOM 0 HA ILE A 281 12.834 -3.475 6.829 1.00 0.00 H new ATOM 0 HB ILE A 281 10.695 -4.654 6.441 1.00 0.00 H new ATOM 0 HG12 ILE A 281 12.780 -6.774 6.041 1.00 0.00 H new ATOM 0 HG13 ILE A 281 12.928 -5.720 7.433 1.00 0.00 H new ATOM 0 HG21 ILE A 281 10.498 -6.301 4.618 1.00 0.00 H new ATOM 0 HG22 ILE A 281 10.704 -4.647 3.994 1.00 0.00 H new ATOM 0 HG23 ILE A 281 12.076 -5.779 3.982 1.00 0.00 H new ATOM 0 HD11 ILE A 281 11.715 -7.766 8.009 1.00 0.00 H new ATOM 0 HD12 ILE A 281 10.654 -6.346 8.167 1.00 0.00 H new ATOM 0 HD13 ILE A 281 10.503 -7.416 6.753 1.00 0.00 H new ATOM 1112 N GLY A 282 13.867 -4.024 3.782 1.00 0.00 N ATOM 1113 CA GLY A 282 15.020 -4.412 2.992 1.00 0.00 C ATOM 1114 C GLY A 282 14.647 -5.292 1.818 1.00 0.00 C ATOM 1115 O GLY A 282 13.510 -5.262 1.346 1.00 0.00 O ATOM 0 H GLY A 282 13.115 -3.580 3.254 1.00 0.00 H new ATOM 0 HA2 GLY A 282 15.524 -3.517 2.626 1.00 0.00 H new ATOM 0 HA3 GLY A 282 15.731 -4.941 3.627 1.00 0.00 H new ATOM 1119 N PHE A 283 15.606 -6.080 1.342 1.00 0.00 N ATOM 1120 CA PHE A 283 15.371 -6.974 0.214 1.00 0.00 C ATOM 1121 C PHE A 283 15.236 -8.421 0.686 1.00 0.00 C ATOM 1122 O PHE A 283 15.912 -8.840 1.626 1.00 0.00 O ATOM 1123 CB PHE A 283 16.512 -6.862 -0.799 1.00 0.00 C ATOM 1124 CG PHE A 283 17.876 -6.866 -0.173 1.00 0.00 C ATOM 1125 CD1 PHE A 283 18.500 -8.060 0.151 1.00 0.00 C ATOM 1126 CD2 PHE A 283 18.535 -5.676 0.093 1.00 0.00 C ATOM 1127 CE1 PHE A 283 19.757 -8.067 0.728 1.00 0.00 C ATOM 1128 CE2 PHE A 283 19.790 -5.677 0.670 1.00 0.00 C ATOM 1129 CZ PHE A 283 20.403 -6.874 0.988 1.00 0.00 C ATOM 0 H PHE A 283 16.553 -6.117 1.720 1.00 0.00 H new ATOM 0 HA PHE A 283 14.438 -6.677 -0.265 1.00 0.00 H new ATOM 0 HB2 PHE A 283 16.443 -7.690 -1.504 1.00 0.00 H new ATOM 0 HB3 PHE A 283 16.388 -5.944 -1.373 1.00 0.00 H new ATOM 0 HD1 PHE A 283 17.999 -8.996 -0.049 1.00 0.00 H new ATOM 0 HD2 PHE A 283 18.062 -4.737 -0.154 1.00 0.00 H new ATOM 0 HE1 PHE A 283 20.233 -9.004 0.975 1.00 0.00 H new ATOM 0 HE2 PHE A 283 20.292 -4.743 0.873 1.00 0.00 H new ATOM 0 HZ PHE A 283 21.385 -6.877 1.439 1.00 0.00 H new TER 1139 PHE A 283 ATOM 1140 N GLY B 444 0.644 9.577 25.399 1.00 0.00 N ATOM 1141 CA GLY B 444 1.063 9.956 24.062 1.00 0.00 C ATOM 1142 C GLY B 444 0.496 9.041 22.995 1.00 0.00 C ATOM 1143 O GLY B 444 -0.174 8.055 23.305 1.00 0.00 O ATOM 0 HA2 GLY B 444 0.748 10.980 23.863 1.00 0.00 H new ATOM 0 HA3 GLY B 444 2.152 9.941 24.008 1.00 0.00 H new ATOM 1146 N GLU B 445 0.765 9.366 21.735 1.00 0.00 N ATOM 1147 CA GLU B 445 0.277 8.567 20.617 1.00 0.00 C ATOM 1148 C GLU B 445 1.437 8.005 19.801 1.00 0.00 C ATOM 1149 O GLU B 445 2.036 8.708 18.987 1.00 0.00 O ATOM 1150 CB GLU B 445 -0.633 9.409 19.720 1.00 0.00 C ATOM 1151 CG GLU B 445 -2.104 9.316 20.086 1.00 0.00 C ATOM 1152 CD GLU B 445 -2.998 9.125 18.876 1.00 0.00 C ATOM 1153 OE1 GLU B 445 -2.812 8.124 18.154 1.00 0.00 O ATOM 1154 OE2 GLU B 445 -3.883 9.979 18.651 1.00 0.00 O ATOM 0 H GLU B 445 1.319 10.178 21.462 1.00 0.00 H new ATOM 0 HA GLU B 445 -0.295 7.732 21.022 1.00 0.00 H new ATOM 0 HB2 GLU B 445 -0.319 10.451 19.775 1.00 0.00 H new ATOM 0 HB3 GLU B 445 -0.504 9.091 18.685 1.00 0.00 H new ATOM 0 HG2 GLU B 445 -2.251 8.485 20.776 1.00 0.00 H new ATOM 0 HG3 GLU B 445 -2.401 10.223 20.612 1.00 0.00 H new ATOM 1161 N GLU B 446 1.750 6.732 20.026 1.00 0.00 N ATOM 1162 CA GLU B 446 2.839 6.074 19.310 1.00 0.00 C ATOM 1163 C GLU B 446 2.301 4.997 18.374 1.00 0.00 C ATOM 1164 O GLU B 446 2.839 4.781 17.287 1.00 0.00 O ATOM 1165 CB GLU B 446 3.826 5.458 20.303 1.00 0.00 C ATOM 1166 CG GLU B 446 4.974 6.384 20.674 1.00 0.00 C ATOM 1167 CD GLU B 446 4.721 7.133 21.969 1.00 0.00 C ATOM 1168 OE1 GLU B 446 4.027 8.171 21.928 1.00 0.00 O ATOM 1169 OE2 GLU B 446 5.216 6.682 23.022 1.00 0.00 O ATOM 0 H GLU B 446 1.266 6.136 20.697 1.00 0.00 H new ATOM 0 HA GLU B 446 3.356 6.824 18.711 1.00 0.00 H new ATOM 0 HB2 GLU B 446 3.289 5.177 21.209 1.00 0.00 H new ATOM 0 HB3 GLU B 446 4.233 4.541 19.877 1.00 0.00 H new ATOM 0 HG2 GLU B 446 5.891 5.802 20.768 1.00 0.00 H new ATOM 0 HG3 GLU B 446 5.133 7.101 19.869 1.00 0.00 H new ATOM 1176 N GLU B 447 1.238 4.326 18.801 1.00 0.00 N ATOM 1177 CA GLU B 447 0.625 3.269 18.003 1.00 0.00 C ATOM 1178 C GLU B 447 -0.866 3.523 17.820 1.00 0.00 C ATOM 1179 O GLU B 447 -1.466 4.316 18.548 1.00 0.00 O ATOM 1180 CB GLU B 447 0.847 1.906 18.659 1.00 0.00 C ATOM 1181 CG GLU B 447 2.256 1.709 19.194 1.00 0.00 C ATOM 1182 CD GLU B 447 2.327 1.823 20.704 1.00 0.00 C ATOM 1183 OE1 GLU B 447 1.333 1.472 21.374 1.00 0.00 O ATOM 1184 OE2 GLU B 447 3.377 2.262 21.219 1.00 0.00 O ATOM 0 H GLU B 447 0.781 4.495 19.697 1.00 0.00 H new ATOM 0 HA GLU B 447 1.099 3.270 17.022 1.00 0.00 H new ATOM 0 HB2 GLU B 447 0.137 1.786 19.477 1.00 0.00 H new ATOM 0 HB3 GLU B 447 0.631 1.123 17.932 1.00 0.00 H new ATOM 0 HG2 GLU B 447 2.623 0.729 18.890 1.00 0.00 H new ATOM 0 HG3 GLU B 447 2.918 2.450 18.746 1.00 0.00 H new ATOM 1191 N GLY B 448 -1.463 2.849 16.842 1.00 0.00 N ATOM 1192 CA GLY B 448 -2.880 3.018 16.580 1.00 0.00 C ATOM 1193 C GLY B 448 -3.147 3.945 15.410 1.00 0.00 C ATOM 1194 O GLY B 448 -4.236 4.508 15.290 1.00 0.00 O ATOM 0 H GLY B 448 -0.990 2.188 16.226 1.00 0.00 H new ATOM 0 HA2 GLY B 448 -3.328 2.045 16.378 1.00 0.00 H new ATOM 0 HA3 GLY B 448 -3.367 3.414 17.472 1.00 0.00 H new ATOM 1198 N GLU B 449 -2.151 4.105 14.545 1.00 0.00 N ATOM 1199 CA GLU B 449 -2.281 4.970 13.378 1.00 0.00 C ATOM 1200 C GLU B 449 -2.423 4.152 12.105 1.00 0.00 C ATOM 1201 O GLU B 449 -2.057 4.609 11.026 1.00 0.00 O ATOM 1202 CB GLU B 449 -1.064 5.890 13.252 1.00 0.00 C ATOM 1203 CG GLU B 449 -0.496 6.343 14.588 1.00 0.00 C ATOM 1204 CD GLU B 449 -1.408 7.319 15.307 1.00 0.00 C ATOM 1205 OE1 GLU B 449 -2.599 6.990 15.494 1.00 0.00 O ATOM 1206 OE2 GLU B 449 -0.930 8.411 15.684 1.00 0.00 O ATOM 0 H GLU B 449 -1.244 3.646 14.630 1.00 0.00 H new ATOM 0 HA GLU B 449 -3.179 5.572 13.514 1.00 0.00 H new ATOM 0 HB2 GLU B 449 -0.285 5.372 12.693 1.00 0.00 H new ATOM 0 HB3 GLU B 449 -1.343 6.768 12.670 1.00 0.00 H new ATOM 0 HG2 GLU B 449 -0.329 5.472 15.222 1.00 0.00 H new ATOM 0 HG3 GLU B 449 0.475 6.810 14.426 1.00 0.00 H new ATOM 1213 N GLU B 450 -2.950 2.942 12.225 1.00 0.00 N ATOM 1214 CA GLU B 450 -3.122 2.081 11.065 1.00 0.00 C ATOM 1215 C GLU B 450 -4.475 1.376 11.091 1.00 0.00 C ATOM 1216 O GLU B 450 -5.024 1.103 12.159 1.00 0.00 O ATOM 1217 CB GLU B 450 -1.983 1.061 10.988 1.00 0.00 C ATOM 1218 CG GLU B 450 -2.102 -0.074 11.993 1.00 0.00 C ATOM 1219 CD GLU B 450 -1.933 0.396 13.425 1.00 0.00 C ATOM 1220 OE1 GLU B 450 -1.192 1.376 13.645 1.00 0.00 O ATOM 1221 OE2 GLU B 450 -2.545 -0.216 14.326 1.00 0.00 O ATOM 0 H GLU B 450 -3.264 2.537 13.107 1.00 0.00 H new ATOM 0 HA GLU B 450 -3.093 2.707 10.173 1.00 0.00 H new ATOM 0 HB2 GLU B 450 -1.952 0.641 9.983 1.00 0.00 H new ATOM 0 HB3 GLU B 450 -1.036 1.576 11.147 1.00 0.00 H new ATOM 0 HG2 GLU B 450 -3.076 -0.551 11.883 1.00 0.00 H new ATOM 0 HG3 GLU B 450 -1.350 -0.831 11.772 1.00 0.00 H new ATOM 1228 N TYR B 451 -5.005 1.090 9.907 1.00 0.00 N ATOM 1229 CA TYR B 451 -6.295 0.421 9.785 1.00 0.00 C ATOM 1230 C TYR B 451 -6.213 -0.745 8.806 1.00 0.00 C ATOM 1231 O TYR B 451 -5.105 -1.298 8.637 1.00 0.00 O ATOM 1232 CB TYR B 451 -7.362 1.415 9.324 1.00 0.00 C ATOM 1233 CG TYR B 451 -7.891 2.293 10.436 1.00 0.00 C ATOM 1234 CD1 TYR B 451 -7.229 3.461 10.798 1.00 0.00 C ATOM 1235 CD2 TYR B 451 -9.048 1.955 11.126 1.00 0.00 C ATOM 1236 CE1 TYR B 451 -7.707 4.265 11.815 1.00 0.00 C ATOM 1237 CE2 TYR B 451 -9.533 2.754 12.143 1.00 0.00 C ATOM 1238 CZ TYR B 451 -8.859 3.908 12.484 1.00 0.00 C ATOM 1239 OH TYR B 451 -9.337 4.707 13.496 1.00 0.00 O ATOM 1240 OXT TYR B 451 -7.257 -1.094 8.217 1.00 0.00 O ATOM 0 H TYR B 451 -4.560 1.312 9.016 1.00 0.00 H new ATOM 0 HA TYR B 451 -6.569 0.029 10.764 1.00 0.00 H new ATOM 0 HB2 TYR B 451 -6.944 2.047 8.541 1.00 0.00 H new ATOM 0 HB3 TYR B 451 -8.192 0.865 8.880 1.00 0.00 H new ATOM 0 HD1 TYR B 451 -6.327 3.744 10.276 1.00 0.00 H new ATOM 0 HD2 TYR B 451 -9.578 1.051 10.863 1.00 0.00 H new ATOM 0 HE1 TYR B 451 -7.181 5.169 12.085 1.00 0.00 H new ATOM 0 HE2 TYR B 451 -10.435 2.477 12.668 1.00 0.00 H new ATOM 0 HH TYR B 451 -10.157 4.315 13.863 1.00 0.00 H new TER 1250 TYR B 451