USER MOD reduce.3.24.130724 H: found=0, std=0, add=706, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 707 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 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.033) USER MOD Single : A 18 MET CE :methyl 145:sc= -1.94 (180deg=-6.38!) USER MOD Single : A 21 ASN : amide:sc= -2.24 K(o=-2.2,f=-4.8!) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot -6:sc= 1.08 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 84:sc= 1.24 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 100:sc= -1.63 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.663 USER MOD Single : A 59 TYR OH : rot 180:sc= -0.579 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 138:sc= -0.91 (180deg=-2.45!) USER MOD Single : A 74 LYS NZ :NH3+ 154:sc= 0 (180deg=-0.269) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 MET CE :methyl -102:sc= -0.281 (180deg=-0.722) USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 75 N LEU A 5 9.742 -7.509 -6.941 1.00 0.00 N ATOM 76 CA LEU A 5 10.897 -7.501 -7.831 1.00 0.00 C ATOM 77 C LEU A 5 11.130 -8.883 -8.434 1.00 0.00 C ATOM 78 O LEU A 5 10.924 -9.902 -7.775 1.00 0.00 O ATOM 79 CB LEU A 5 12.146 -7.045 -7.075 1.00 0.00 C ATOM 80 CG LEU A 5 12.313 -5.535 -6.903 1.00 0.00 C ATOM 81 CD1 LEU A 5 12.368 -4.847 -8.259 1.00 0.00 C ATOM 82 CD2 LEU A 5 11.182 -4.965 -6.059 1.00 0.00 C ATOM 0 HA LEU A 5 10.695 -6.801 -8.641 1.00 0.00 H new ATOM 0 HB2 LEU A 5 12.136 -7.504 -6.086 1.00 0.00 H new ATOM 0 HB3 LEU A 5 13.022 -7.430 -7.596 1.00 0.00 H new ATOM 0 HG LEU A 5 13.254 -5.349 -6.385 1.00 0.00 H new ATOM 0 HD11 LEU A 5 12.487 -3.773 -8.117 1.00 0.00 H new ATOM 0 HD12 LEU A 5 13.213 -5.234 -8.829 1.00 0.00 H new ATOM 0 HD13 LEU A 5 11.444 -5.041 -8.803 1.00 0.00 H new ATOM 0 HD21 LEU A 5 11.318 -3.889 -5.947 1.00 0.00 H new ATOM 0 HD22 LEU A 5 10.228 -5.162 -6.548 1.00 0.00 H new ATOM 0 HD23 LEU A 5 11.189 -5.435 -5.076 1.00 0.00 H new ATOM 94 N LYS A 6 11.563 -8.910 -9.690 1.00 0.00 N ATOM 95 CA LYS A 6 11.828 -10.165 -10.382 1.00 0.00 C ATOM 96 C LYS A 6 13.248 -10.192 -10.936 1.00 0.00 C ATOM 97 O LYS A 6 13.720 -9.210 -11.509 1.00 0.00 O ATOM 98 CB LYS A 6 10.822 -10.368 -11.517 1.00 0.00 C ATOM 99 CG LYS A 6 11.120 -9.532 -12.750 1.00 0.00 C ATOM 100 CD LYS A 6 9.914 -9.447 -13.671 1.00 0.00 C ATOM 101 CE LYS A 6 8.884 -8.456 -13.150 1.00 0.00 C ATOM 102 NZ LYS A 6 7.533 -8.706 -13.726 1.00 0.00 N ATOM 0 H LYS A 6 11.738 -8.075 -10.250 1.00 0.00 H new ATOM 0 HA LYS A 6 11.723 -10.977 -9.662 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.810 -11.421 -11.797 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.824 -10.123 -11.155 1.00 0.00 H new ATOM 0 HG2 LYS A 6 11.419 -8.529 -12.447 1.00 0.00 H new ATOM 0 HG3 LYS A 6 11.962 -9.966 -13.290 1.00 0.00 H new ATOM 0 HD2 LYS A 6 10.237 -9.148 -14.668 1.00 0.00 H new ATOM 0 HD3 LYS A 6 9.457 -10.432 -13.766 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.833 -8.522 -12.063 1.00 0.00 H new ATOM 0 HE3 LYS A 6 9.200 -7.442 -13.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 6.860 -8.010 -13.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 7.575 -8.618 -14.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 7.220 -9.665 -13.473 1.00 0.00 H new ATOM 116 N VAL A 7 13.925 -11.323 -10.763 1.00 0.00 N ATOM 117 CA VAL A 7 15.291 -11.478 -11.248 1.00 0.00 C ATOM 118 C VAL A 7 15.399 -12.644 -12.224 1.00 0.00 C ATOM 119 O VAL A 7 15.094 -13.786 -11.880 1.00 0.00 O ATOM 120 CB VAL A 7 16.278 -11.703 -10.087 1.00 0.00 C ATOM 121 CG1 VAL A 7 16.396 -10.448 -9.236 1.00 0.00 C ATOM 122 CG2 VAL A 7 15.843 -12.891 -9.242 1.00 0.00 C ATOM 0 H VAL A 7 13.549 -12.145 -10.291 1.00 0.00 H new ATOM 0 HA VAL A 7 15.550 -10.552 -11.761 1.00 0.00 H new ATOM 0 HB VAL A 7 17.260 -11.923 -10.505 1.00 0.00 H new ATOM 0 HG11 VAL A 7 17.097 -10.626 -8.421 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.756 -9.624 -9.851 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.419 -10.194 -8.825 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.551 -13.036 -8.426 1.00 0.00 H new ATOM 0 HG22 VAL A 7 14.851 -12.702 -8.832 1.00 0.00 H new ATOM 0 HG23 VAL A 7 15.815 -13.787 -9.862 1.00 0.00 H new ATOM 132 N LYS A 8 15.834 -12.349 -13.444 1.00 0.00 N ATOM 133 CA LYS A 8 15.984 -13.372 -14.472 1.00 0.00 C ATOM 134 C LYS A 8 17.293 -13.190 -15.235 1.00 0.00 C ATOM 135 O LYS A 8 17.810 -12.078 -15.343 1.00 0.00 O ATOM 136 CB LYS A 8 14.804 -13.324 -15.445 1.00 0.00 C ATOM 137 CG LYS A 8 14.715 -12.027 -16.230 1.00 0.00 C ATOM 138 CD LYS A 8 13.671 -11.091 -15.644 1.00 0.00 C ATOM 139 CE LYS A 8 12.282 -11.400 -16.180 1.00 0.00 C ATOM 140 NZ LYS A 8 12.100 -10.902 -17.571 1.00 0.00 N ATOM 0 H LYS A 8 16.089 -11.409 -13.745 1.00 0.00 H new ATOM 0 HA LYS A 8 16.003 -14.345 -13.980 1.00 0.00 H new ATOM 0 HB2 LYS A 8 14.886 -14.157 -16.144 1.00 0.00 H new ATOM 0 HB3 LYS A 8 13.878 -13.466 -14.887 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.687 -11.534 -16.231 1.00 0.00 H new ATOM 0 HG3 LYS A 8 14.467 -12.246 -17.269 1.00 0.00 H new ATOM 0 HD2 LYS A 8 13.671 -11.179 -14.558 1.00 0.00 H new ATOM 0 HD3 LYS A 8 13.932 -10.059 -15.880 1.00 0.00 H new ATOM 0 HE2 LYS A 8 12.115 -12.477 -16.155 1.00 0.00 H new ATOM 0 HE3 LYS A 8 11.533 -10.946 -15.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 11.101 -10.994 -17.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 12.382 -9.902 -17.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 12.690 -11.461 -18.220 1.00 0.00 H new ATOM 154 N VAL A 9 17.823 -14.289 -15.762 1.00 0.00 N ATOM 155 CA VAL A 9 19.070 -14.249 -16.517 1.00 0.00 C ATOM 156 C VAL A 9 18.880 -13.545 -17.856 1.00 0.00 C ATOM 157 O VAL A 9 17.915 -13.805 -18.574 1.00 0.00 O ATOM 158 CB VAL A 9 19.619 -15.666 -16.769 1.00 0.00 C ATOM 159 CG1 VAL A 9 20.936 -15.602 -17.526 1.00 0.00 C ATOM 160 CG2 VAL A 9 19.785 -16.414 -15.454 1.00 0.00 C ATOM 0 H VAL A 9 17.409 -15.217 -15.680 1.00 0.00 H new ATOM 0 HA VAL A 9 19.787 -13.691 -15.915 1.00 0.00 H new ATOM 0 HB VAL A 9 18.902 -16.211 -17.383 1.00 0.00 H new ATOM 0 HG11 VAL A 9 21.308 -16.613 -17.695 1.00 0.00 H new ATOM 0 HG12 VAL A 9 20.781 -15.108 -18.485 1.00 0.00 H new ATOM 0 HG13 VAL A 9 21.665 -15.040 -16.942 1.00 0.00 H new ATOM 0 HG21 VAL A 9 20.174 -17.413 -15.650 1.00 0.00 H new ATOM 0 HG22 VAL A 9 20.481 -15.873 -14.813 1.00 0.00 H new ATOM 0 HG23 VAL A 9 18.819 -16.492 -14.955 1.00 0.00 H new ATOM 170 N GLU A 10 19.807 -12.651 -18.185 1.00 0.00 N ATOM 171 CA GLU A 10 19.741 -11.908 -19.438 1.00 0.00 C ATOM 172 C GLU A 10 20.752 -12.449 -20.445 1.00 0.00 C ATOM 173 O GLU A 10 20.458 -12.565 -21.635 1.00 0.00 O ATOM 174 CB GLU A 10 19.998 -10.421 -19.189 1.00 0.00 C ATOM 175 CG GLU A 10 21.179 -10.152 -18.271 1.00 0.00 C ATOM 176 CD GLU A 10 21.530 -8.680 -18.187 1.00 0.00 C ATOM 177 OE1 GLU A 10 20.979 -7.988 -17.304 1.00 0.00 O ATOM 178 OE2 GLU A 10 22.355 -8.219 -19.003 1.00 0.00 O ATOM 0 H GLU A 10 20.612 -12.424 -17.602 1.00 0.00 H new ATOM 0 HA GLU A 10 18.740 -12.032 -19.852 1.00 0.00 H new ATOM 0 HB2 GLU A 10 20.171 -9.926 -20.145 1.00 0.00 H new ATOM 0 HB3 GLU A 10 19.103 -9.974 -18.756 1.00 0.00 H new ATOM 0 HG2 GLU A 10 20.950 -10.524 -17.272 1.00 0.00 H new ATOM 0 HG3 GLU A 10 22.046 -10.708 -18.628 1.00 0.00 H new ATOM 185 N ASP A 11 21.944 -12.778 -19.960 1.00 0.00 N ATOM 186 CA ASP A 11 22.999 -13.307 -20.816 1.00 0.00 C ATOM 187 C ASP A 11 24.132 -13.896 -19.981 1.00 0.00 C ATOM 188 O ASP A 11 24.953 -13.165 -19.426 1.00 0.00 O ATOM 189 CB ASP A 11 23.541 -12.209 -21.732 1.00 0.00 C ATOM 190 CG ASP A 11 23.630 -12.653 -23.178 1.00 0.00 C ATOM 191 OD1 ASP A 11 23.794 -13.867 -23.417 1.00 0.00 O ATOM 192 OD2 ASP A 11 23.537 -11.785 -24.072 1.00 0.00 O ATOM 0 H ASP A 11 22.204 -12.688 -18.978 1.00 0.00 H new ATOM 0 HA ASP A 11 22.572 -14.101 -21.428 1.00 0.00 H new ATOM 0 HB2 ASP A 11 22.897 -11.332 -21.663 1.00 0.00 H new ATOM 0 HB3 ASP A 11 24.530 -11.907 -21.386 1.00 0.00 H new ATOM 197 N PHE A 12 24.170 -15.222 -19.896 1.00 0.00 N ATOM 198 CA PHE A 12 25.201 -15.909 -19.127 1.00 0.00 C ATOM 199 C PHE A 12 26.215 -16.576 -20.052 1.00 0.00 C ATOM 200 O PHE A 12 25.982 -16.712 -21.253 1.00 0.00 O ATOM 201 CB PHE A 12 24.569 -16.954 -18.206 1.00 0.00 C ATOM 202 CG PHE A 12 24.094 -18.182 -18.929 1.00 0.00 C ATOM 203 CD1 PHE A 12 22.821 -18.233 -19.473 1.00 0.00 C ATOM 204 CD2 PHE A 12 24.921 -19.285 -19.065 1.00 0.00 C ATOM 205 CE1 PHE A 12 22.380 -19.361 -20.139 1.00 0.00 C ATOM 206 CE2 PHE A 12 24.487 -20.416 -19.731 1.00 0.00 C ATOM 207 CZ PHE A 12 23.214 -20.454 -20.267 1.00 0.00 C ATOM 0 H PHE A 12 23.499 -15.842 -20.350 1.00 0.00 H new ATOM 0 HA PHE A 12 25.721 -15.168 -18.520 1.00 0.00 H new ATOM 0 HB2 PHE A 12 25.296 -17.247 -17.449 1.00 0.00 H new ATOM 0 HB3 PHE A 12 23.727 -16.502 -17.681 1.00 0.00 H new ATOM 0 HD1 PHE A 12 22.165 -17.381 -19.375 1.00 0.00 H new ATOM 0 HD2 PHE A 12 25.916 -19.261 -18.646 1.00 0.00 H new ATOM 0 HE1 PHE A 12 21.385 -19.387 -20.558 1.00 0.00 H new ATOM 0 HE2 PHE A 12 25.142 -21.269 -19.832 1.00 0.00 H new ATOM 0 HZ PHE A 12 22.872 -21.337 -20.785 1.00 0.00 H new ATOM 217 N GLY A 13 27.343 -16.992 -19.483 1.00 0.00 N ATOM 218 CA GLY A 13 28.376 -17.640 -20.270 1.00 0.00 C ATOM 219 C GLY A 13 29.469 -18.241 -19.409 1.00 0.00 C ATOM 220 O GLY A 13 29.305 -18.389 -18.198 1.00 0.00 O ATOM 0 H GLY A 13 27.559 -16.892 -18.491 1.00 0.00 H new ATOM 0 HA2 GLY A 13 27.926 -18.423 -20.880 1.00 0.00 H new ATOM 0 HA3 GLY A 13 28.815 -16.915 -20.955 1.00 0.00 H new ATOM 224 N PHE A 14 30.589 -18.589 -20.035 1.00 0.00 N ATOM 225 CA PHE A 14 31.713 -19.180 -19.319 1.00 0.00 C ATOM 226 C PHE A 14 33.037 -18.613 -19.821 1.00 0.00 C ATOM 227 O PHE A 14 33.241 -18.459 -21.026 1.00 0.00 O ATOM 228 CB PHE A 14 31.703 -20.702 -19.478 1.00 0.00 C ATOM 229 CG PHE A 14 30.323 -21.294 -19.498 1.00 0.00 C ATOM 230 CD1 PHE A 14 29.530 -21.273 -18.362 1.00 0.00 C ATOM 231 CD2 PHE A 14 29.819 -21.871 -20.652 1.00 0.00 C ATOM 232 CE1 PHE A 14 28.260 -21.818 -18.377 1.00 0.00 C ATOM 233 CE2 PHE A 14 28.549 -22.417 -20.674 1.00 0.00 C ATOM 234 CZ PHE A 14 27.768 -22.390 -19.535 1.00 0.00 C ATOM 0 H PHE A 14 30.742 -18.472 -21.037 1.00 0.00 H new ATOM 0 HA PHE A 14 31.610 -18.931 -18.263 1.00 0.00 H new ATOM 0 HB2 PHE A 14 32.216 -20.966 -20.403 1.00 0.00 H new ATOM 0 HB3 PHE A 14 32.269 -21.148 -18.661 1.00 0.00 H new ATOM 0 HD1 PHE A 14 29.909 -20.826 -17.455 1.00 0.00 H new ATOM 0 HD2 PHE A 14 30.425 -21.895 -21.545 1.00 0.00 H new ATOM 0 HE1 PHE A 14 27.652 -21.797 -17.484 1.00 0.00 H new ATOM 0 HE2 PHE A 14 28.168 -22.864 -21.580 1.00 0.00 H new ATOM 0 HZ PHE A 14 26.775 -22.815 -19.549 1.00 0.00 H new ATOM 244 N ARG A 15 33.933 -18.304 -18.890 1.00 0.00 N ATOM 245 CA ARG A 15 35.237 -17.752 -19.237 1.00 0.00 C ATOM 246 C ARG A 15 36.315 -18.830 -19.184 1.00 0.00 C ATOM 247 O ARG A 15 36.656 -19.329 -18.112 1.00 0.00 O ATOM 248 CB ARG A 15 35.599 -16.607 -18.290 1.00 0.00 C ATOM 249 CG ARG A 15 35.843 -15.285 -18.998 1.00 0.00 C ATOM 250 CD ARG A 15 36.976 -15.394 -20.007 1.00 0.00 C ATOM 251 NE ARG A 15 37.348 -14.092 -20.555 1.00 0.00 N ATOM 252 CZ ARG A 15 38.031 -13.939 -21.684 1.00 0.00 C ATOM 253 NH1 ARG A 15 38.414 -14.999 -22.381 1.00 0.00 N ATOM 254 NH2 ARG A 15 38.332 -12.721 -22.118 1.00 0.00 N ATOM 0 H ARG A 15 33.780 -18.427 -17.889 1.00 0.00 H new ATOM 0 HA ARG A 15 35.181 -17.368 -20.255 1.00 0.00 H new ATOM 0 HB2 ARG A 15 34.795 -16.478 -17.565 1.00 0.00 H new ATOM 0 HB3 ARG A 15 36.493 -16.880 -17.729 1.00 0.00 H new ATOM 0 HG2 ARG A 15 34.932 -14.969 -19.506 1.00 0.00 H new ATOM 0 HG3 ARG A 15 36.081 -14.516 -18.263 1.00 0.00 H new ATOM 0 HD2 ARG A 15 37.844 -15.848 -19.529 1.00 0.00 H new ATOM 0 HD3 ARG A 15 36.676 -16.057 -20.819 1.00 0.00 H new ATOM 0 HE ARG A 15 37.068 -13.255 -20.043 1.00 0.00 H new ATOM 0 HH11 ARG A 15 38.184 -15.936 -22.051 1.00 0.00 H new ATOM 0 HH12 ARG A 15 38.938 -14.877 -23.247 1.00 0.00 H new ATOM 0 HH21 ARG A 15 38.039 -11.903 -21.584 1.00 0.00 H new ATOM 0 HH22 ARG A 15 38.856 -12.604 -22.985 1.00 0.00 H new ATOM 268 N GLU A 16 36.848 -19.185 -20.350 1.00 0.00 N ATOM 269 CA GLU A 16 37.886 -20.206 -20.435 1.00 0.00 C ATOM 270 C GLU A 16 39.208 -19.684 -19.878 1.00 0.00 C ATOM 271 O GLU A 16 40.054 -20.459 -19.430 1.00 0.00 O ATOM 272 CB GLU A 16 38.074 -20.654 -21.886 1.00 0.00 C ATOM 273 CG GLU A 16 38.711 -19.598 -22.772 1.00 0.00 C ATOM 274 CD GLU A 16 38.405 -19.808 -24.242 1.00 0.00 C ATOM 275 OE1 GLU A 16 38.959 -20.756 -24.836 1.00 0.00 O ATOM 276 OE2 GLU A 16 37.609 -19.022 -24.800 1.00 0.00 O ATOM 0 H GLU A 16 36.578 -18.781 -21.247 1.00 0.00 H new ATOM 0 HA GLU A 16 37.570 -21.060 -19.836 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.693 -21.551 -21.903 1.00 0.00 H new ATOM 0 HB3 GLU A 16 37.104 -20.928 -22.301 1.00 0.00 H new ATOM 0 HG2 GLU A 16 38.357 -18.613 -22.468 1.00 0.00 H new ATOM 0 HG3 GLU A 16 39.791 -19.608 -22.624 1.00 0.00 H new ATOM 283 N ASP A 17 39.378 -18.367 -19.910 1.00 0.00 N ATOM 284 CA ASP A 17 40.596 -17.741 -19.408 1.00 0.00 C ATOM 285 C ASP A 17 40.574 -17.654 -17.885 1.00 0.00 C ATOM 286 O ASP A 17 41.617 -17.515 -17.247 1.00 0.00 O ATOM 287 CB ASP A 17 40.762 -16.345 -20.009 1.00 0.00 C ATOM 288 CG ASP A 17 41.581 -16.358 -21.285 1.00 0.00 C ATOM 289 OD1 ASP A 17 42.567 -17.121 -21.349 1.00 0.00 O ATOM 290 OD2 ASP A 17 41.237 -15.604 -22.219 1.00 0.00 O ATOM 0 H ASP A 17 38.688 -17.712 -20.278 1.00 0.00 H new ATOM 0 HA ASP A 17 41.443 -18.359 -19.706 1.00 0.00 H new ATOM 0 HB2 ASP A 17 39.779 -15.922 -20.216 1.00 0.00 H new ATOM 0 HB3 ASP A 17 41.242 -15.693 -19.279 1.00 0.00 H new ATOM 295 N MET A 18 39.379 -17.734 -17.310 1.00 0.00 N ATOM 296 CA MET A 18 39.222 -17.664 -15.862 1.00 0.00 C ATOM 297 C MET A 18 38.924 -19.042 -15.280 1.00 0.00 C ATOM 298 O MET A 18 39.156 -19.291 -14.098 1.00 0.00 O ATOM 299 CB MET A 18 38.101 -16.690 -15.496 1.00 0.00 C ATOM 300 CG MET A 18 38.270 -15.310 -16.111 1.00 0.00 C ATOM 301 SD MET A 18 37.599 -13.999 -15.071 1.00 0.00 S ATOM 302 CE MET A 18 35.916 -13.914 -15.676 1.00 0.00 C ATOM 0 H MET A 18 38.505 -17.847 -17.824 1.00 0.00 H new ATOM 0 HA MET A 18 40.159 -17.305 -15.437 1.00 0.00 H new ATOM 0 HB2 MET A 18 37.148 -17.108 -15.819 1.00 0.00 H new ATOM 0 HB3 MET A 18 38.055 -16.592 -14.411 1.00 0.00 H new ATOM 0 HG2 MET A 18 39.329 -15.122 -16.287 1.00 0.00 H new ATOM 0 HG3 MET A 18 37.776 -15.286 -17.082 1.00 0.00 H new ATOM 0 HE1 MET A 18 35.244 -13.682 -14.850 1.00 0.00 H new ATOM 0 HE2 MET A 18 35.841 -13.135 -16.435 1.00 0.00 H new ATOM 0 HE3 MET A 18 35.637 -14.873 -16.112 1.00 0.00 H new ATOM 312 N GLY A 19 38.406 -19.935 -16.119 1.00 0.00 N ATOM 313 CA GLY A 19 38.085 -21.277 -15.669 1.00 0.00 C ATOM 314 C GLY A 19 36.899 -21.302 -14.725 1.00 0.00 C ATOM 315 O GLY A 19 36.766 -22.215 -13.908 1.00 0.00 O ATOM 0 H GLY A 19 38.203 -19.753 -17.102 1.00 0.00 H new ATOM 0 HA2 GLY A 19 37.871 -21.906 -16.533 1.00 0.00 H new ATOM 0 HA3 GLY A 19 38.953 -21.707 -15.169 1.00 0.00 H new ATOM 319 N LEU A 20 36.035 -20.299 -14.835 1.00 0.00 N ATOM 320 CA LEU A 20 34.855 -20.209 -13.983 1.00 0.00 C ATOM 321 C LEU A 20 33.616 -19.865 -14.803 1.00 0.00 C ATOM 322 O LEU A 20 33.715 -19.528 -15.983 1.00 0.00 O ATOM 323 CB LEU A 20 35.067 -19.157 -12.893 1.00 0.00 C ATOM 324 CG LEU A 20 35.814 -17.892 -13.318 1.00 0.00 C ATOM 325 CD1 LEU A 20 35.019 -17.129 -14.367 1.00 0.00 C ATOM 326 CD2 LEU A 20 36.094 -17.007 -12.111 1.00 0.00 C ATOM 0 H LEU A 20 36.130 -19.537 -15.506 1.00 0.00 H new ATOM 0 HA LEU A 20 34.700 -21.181 -13.516 1.00 0.00 H new ATOM 0 HB2 LEU A 20 34.092 -18.865 -12.503 1.00 0.00 H new ATOM 0 HB3 LEU A 20 35.614 -19.619 -12.071 1.00 0.00 H new ATOM 0 HG LEU A 20 36.767 -18.187 -13.757 1.00 0.00 H new ATOM 0 HD11 LEU A 20 35.566 -16.232 -14.657 1.00 0.00 H new ATOM 0 HD12 LEU A 20 34.870 -17.762 -15.242 1.00 0.00 H new ATOM 0 HD13 LEU A 20 34.051 -16.846 -13.955 1.00 0.00 H new ATOM 0 HD21 LEU A 20 36.626 -16.112 -12.432 1.00 0.00 H new ATOM 0 HD22 LEU A 20 35.152 -16.721 -11.643 1.00 0.00 H new ATOM 0 HD23 LEU A 20 36.705 -17.554 -11.393 1.00 0.00 H new ATOM 338 N ASN A 21 32.450 -19.949 -14.170 1.00 0.00 N ATOM 339 CA ASN A 21 31.192 -19.645 -14.842 1.00 0.00 C ATOM 340 C ASN A 21 30.659 -18.284 -14.407 1.00 0.00 C ATOM 341 O ASN A 21 30.810 -17.886 -13.251 1.00 0.00 O ATOM 342 CB ASN A 21 30.155 -20.730 -14.543 1.00 0.00 C ATOM 343 CG ASN A 21 30.682 -22.125 -14.820 1.00 0.00 C ATOM 344 OD1 ASN A 21 31.685 -22.547 -14.243 1.00 0.00 O ATOM 345 ND2 ASN A 21 30.007 -22.848 -15.705 1.00 0.00 N ATOM 0 H ASN A 21 32.350 -20.225 -13.193 1.00 0.00 H new ATOM 0 HA ASN A 21 31.380 -19.617 -15.915 1.00 0.00 H new ATOM 0 HB2 ASN A 21 29.851 -20.660 -13.499 1.00 0.00 H new ATOM 0 HB3 ASN A 21 29.265 -20.554 -15.147 1.00 0.00 H new ATOM 0 HD21 ASN A 21 30.314 -23.794 -15.931 1.00 0.00 H new ATOM 0 HD22 ASN A 21 29.181 -22.458 -16.159 1.00 0.00 H new ATOM 352 N TYR A 22 30.034 -17.574 -15.340 1.00 0.00 N ATOM 353 CA TYR A 22 29.480 -16.256 -15.054 1.00 0.00 C ATOM 354 C TYR A 22 28.080 -16.114 -15.644 1.00 0.00 C ATOM 355 O TYR A 22 27.732 -16.785 -16.616 1.00 0.00 O ATOM 356 CB TYR A 22 30.393 -15.163 -15.612 1.00 0.00 C ATOM 357 CG TYR A 22 30.366 -15.063 -17.121 1.00 0.00 C ATOM 358 CD1 TYR A 22 29.396 -14.307 -17.768 1.00 0.00 C ATOM 359 CD2 TYR A 22 31.308 -15.724 -17.898 1.00 0.00 C ATOM 360 CE1 TYR A 22 29.367 -14.213 -19.146 1.00 0.00 C ATOM 361 CE2 TYR A 22 31.287 -15.635 -19.277 1.00 0.00 C ATOM 362 CZ TYR A 22 30.314 -14.878 -19.896 1.00 0.00 C ATOM 363 OH TYR A 22 30.289 -14.787 -21.269 1.00 0.00 O ATOM 0 H TYR A 22 29.898 -17.889 -16.301 1.00 0.00 H new ATOM 0 HA TYR A 22 29.412 -16.146 -13.972 1.00 0.00 H new ATOM 0 HB2 TYR A 22 30.098 -14.203 -15.187 1.00 0.00 H new ATOM 0 HB3 TYR A 22 31.416 -15.355 -15.287 1.00 0.00 H new ATOM 0 HD1 TYR A 22 28.653 -13.784 -17.184 1.00 0.00 H new ATOM 0 HD2 TYR A 22 32.070 -16.318 -17.416 1.00 0.00 H new ATOM 0 HE1 TYR A 22 28.606 -13.621 -19.634 1.00 0.00 H new ATOM 0 HE2 TYR A 22 32.028 -16.155 -19.866 1.00 0.00 H new ATOM 0 HH TYR A 22 31.025 -15.313 -21.645 1.00 0.00 H new ATOM 373 N VAL A 23 27.280 -15.235 -15.048 1.00 0.00 N ATOM 374 CA VAL A 23 25.918 -15.002 -15.514 1.00 0.00 C ATOM 375 C VAL A 23 25.461 -13.585 -15.189 1.00 0.00 C ATOM 376 O VAL A 23 25.789 -13.042 -14.134 1.00 0.00 O ATOM 377 CB VAL A 23 24.932 -16.005 -14.887 1.00 0.00 C ATOM 378 CG1 VAL A 23 25.096 -16.041 -13.375 1.00 0.00 C ATOM 379 CG2 VAL A 23 23.501 -15.653 -15.268 1.00 0.00 C ATOM 0 H VAL A 23 27.552 -14.673 -14.242 1.00 0.00 H new ATOM 0 HA VAL A 23 25.925 -15.139 -16.595 1.00 0.00 H new ATOM 0 HB VAL A 23 25.154 -16.999 -15.276 1.00 0.00 H new ATOM 0 HG11 VAL A 23 24.391 -16.755 -12.949 1.00 0.00 H new ATOM 0 HG12 VAL A 23 26.113 -16.343 -13.126 1.00 0.00 H new ATOM 0 HG13 VAL A 23 24.901 -15.050 -12.964 1.00 0.00 H new ATOM 0 HG21 VAL A 23 22.817 -16.372 -14.817 1.00 0.00 H new ATOM 0 HG22 VAL A 23 23.264 -14.652 -14.908 1.00 0.00 H new ATOM 0 HG23 VAL A 23 23.395 -15.683 -16.352 1.00 0.00 H new ATOM 389 N ARG A 24 24.702 -12.989 -16.104 1.00 0.00 N ATOM 390 CA ARG A 24 24.200 -11.634 -15.915 1.00 0.00 C ATOM 391 C ARG A 24 22.719 -11.649 -15.547 1.00 0.00 C ATOM 392 O ARG A 24 21.910 -12.292 -16.215 1.00 0.00 O ATOM 393 CB ARG A 24 24.412 -10.807 -17.185 1.00 0.00 C ATOM 394 CG ARG A 24 25.682 -9.971 -17.162 1.00 0.00 C ATOM 395 CD ARG A 24 26.885 -10.774 -17.631 1.00 0.00 C ATOM 396 NE ARG A 24 27.653 -10.064 -18.650 1.00 0.00 N ATOM 397 CZ ARG A 24 28.929 -10.317 -18.918 1.00 0.00 C ATOM 398 NH1 ARG A 24 29.577 -11.258 -18.246 1.00 0.00 N ATOM 399 NH2 ARG A 24 29.560 -9.628 -19.861 1.00 0.00 N ATOM 0 H ARG A 24 24.422 -13.424 -16.983 1.00 0.00 H new ATOM 0 HA ARG A 24 24.756 -11.179 -15.095 1.00 0.00 H new ATOM 0 HB2 ARG A 24 24.444 -11.477 -18.044 1.00 0.00 H new ATOM 0 HB3 ARG A 24 23.556 -10.148 -17.327 1.00 0.00 H new ATOM 0 HG2 ARG A 24 25.555 -9.097 -17.801 1.00 0.00 H new ATOM 0 HG3 ARG A 24 25.859 -9.604 -16.151 1.00 0.00 H new ATOM 0 HD2 ARG A 24 27.529 -10.994 -16.779 1.00 0.00 H new ATOM 0 HD3 ARG A 24 26.549 -11.730 -18.031 1.00 0.00 H new ATOM 0 HE ARG A 24 27.184 -9.334 -19.185 1.00 0.00 H new ATOM 0 HH11 ARG A 24 29.096 -11.790 -17.521 1.00 0.00 H new ATOM 0 HH12 ARG A 24 30.557 -11.450 -18.454 1.00 0.00 H new ATOM 0 HH21 ARG A 24 29.065 -8.903 -20.381 1.00 0.00 H new ATOM 0 HH22 ARG A 24 30.540 -9.823 -20.066 1.00 0.00 H new ATOM 413 N TYR A 25 22.374 -10.937 -14.480 1.00 0.00 N ATOM 414 CA TYR A 25 20.991 -10.871 -14.021 1.00 0.00 C ATOM 415 C TYR A 25 20.358 -9.532 -14.389 1.00 0.00 C ATOM 416 O TYR A 25 21.005 -8.487 -14.320 1.00 0.00 O ATOM 417 CB TYR A 25 20.924 -11.080 -12.507 1.00 0.00 C ATOM 418 CG TYR A 25 21.703 -12.284 -12.027 1.00 0.00 C ATOM 419 CD1 TYR A 25 21.231 -13.573 -12.244 1.00 0.00 C ATOM 420 CD2 TYR A 25 22.911 -12.132 -11.358 1.00 0.00 C ATOM 421 CE1 TYR A 25 21.939 -14.675 -11.806 1.00 0.00 C ATOM 422 CE2 TYR A 25 23.627 -13.229 -10.918 1.00 0.00 C ATOM 423 CZ TYR A 25 23.136 -14.499 -11.144 1.00 0.00 C ATOM 424 OH TYR A 25 23.845 -15.594 -10.708 1.00 0.00 O ATOM 0 H TYR A 25 23.032 -10.398 -13.917 1.00 0.00 H new ATOM 0 HA TYR A 25 20.432 -11.665 -14.516 1.00 0.00 H new ATOM 0 HB2 TYR A 25 21.305 -10.189 -12.008 1.00 0.00 H new ATOM 0 HB3 TYR A 25 19.881 -11.190 -12.210 1.00 0.00 H new ATOM 0 HD1 TYR A 25 20.295 -13.715 -12.764 1.00 0.00 H new ATOM 0 HD2 TYR A 25 23.297 -11.139 -11.179 1.00 0.00 H new ATOM 0 HE1 TYR A 25 21.557 -15.670 -11.981 1.00 0.00 H new ATOM 0 HE2 TYR A 25 24.565 -13.093 -10.400 1.00 0.00 H new ATOM 0 HH TYR A 25 23.319 -16.406 -10.860 1.00 0.00 H new ATOM 434 N ARG A 26 19.089 -9.573 -14.779 1.00 0.00 N ATOM 435 CA ARG A 26 18.367 -8.364 -15.159 1.00 0.00 C ATOM 436 C ARG A 26 17.320 -8.004 -14.110 1.00 0.00 C ATOM 437 O ARG A 26 16.320 -8.705 -13.949 1.00 0.00 O ATOM 438 CB ARG A 26 17.696 -8.552 -16.521 1.00 0.00 C ATOM 439 CG ARG A 26 17.679 -7.292 -17.370 1.00 0.00 C ATOM 440 CD ARG A 26 16.452 -7.241 -18.267 1.00 0.00 C ATOM 441 NE ARG A 26 16.718 -7.800 -19.590 1.00 0.00 N ATOM 442 CZ ARG A 26 15.922 -7.619 -20.638 1.00 0.00 C ATOM 443 NH1 ARG A 26 14.817 -6.896 -20.518 1.00 0.00 N ATOM 444 NH2 ARG A 26 16.232 -8.159 -21.810 1.00 0.00 N ATOM 0 H ARG A 26 18.539 -10.430 -14.840 1.00 0.00 H new ATOM 0 HA ARG A 26 19.086 -7.547 -15.225 1.00 0.00 H new ATOM 0 HB2 ARG A 26 18.215 -9.341 -17.066 1.00 0.00 H new ATOM 0 HB3 ARG A 26 16.671 -8.891 -16.368 1.00 0.00 H new ATOM 0 HG2 ARG A 26 17.694 -6.415 -16.722 1.00 0.00 H new ATOM 0 HG3 ARG A 26 18.580 -7.252 -17.982 1.00 0.00 H new ATOM 0 HD2 ARG A 26 15.637 -7.792 -17.798 1.00 0.00 H new ATOM 0 HD3 ARG A 26 16.121 -6.208 -18.370 1.00 0.00 H new ATOM 0 HE ARG A 26 17.561 -8.360 -19.716 1.00 0.00 H new ATOM 0 HH11 ARG A 26 14.577 -6.477 -19.620 1.00 0.00 H new ATOM 0 HH12 ARG A 26 14.207 -6.758 -21.324 1.00 0.00 H new ATOM 0 HH21 ARG A 26 17.082 -8.714 -21.907 1.00 0.00 H new ATOM 0 HH22 ARG A 26 15.620 -8.019 -22.614 1.00 0.00 H new ATOM 458 N VAL A 27 17.556 -6.907 -13.397 1.00 0.00 N ATOM 459 CA VAL A 27 16.633 -6.453 -12.364 1.00 0.00 C ATOM 460 C VAL A 27 16.163 -5.028 -12.634 1.00 0.00 C ATOM 461 O VAL A 27 16.959 -4.155 -12.978 1.00 0.00 O ATOM 462 CB VAL A 27 17.282 -6.512 -10.968 1.00 0.00 C ATOM 463 CG1 VAL A 27 17.739 -7.927 -10.650 1.00 0.00 C ATOM 464 CG2 VAL A 27 18.444 -5.534 -10.879 1.00 0.00 C ATOM 0 H VAL A 27 18.379 -6.316 -13.516 1.00 0.00 H new ATOM 0 HA VAL A 27 15.775 -7.125 -12.387 1.00 0.00 H new ATOM 0 HB VAL A 27 16.536 -6.223 -10.228 1.00 0.00 H new ATOM 0 HG11 VAL A 27 18.195 -7.948 -9.660 1.00 0.00 H new ATOM 0 HG12 VAL A 27 16.881 -8.599 -10.669 1.00 0.00 H new ATOM 0 HG13 VAL A 27 18.469 -8.249 -11.393 1.00 0.00 H new ATOM 0 HG21 VAL A 27 18.891 -5.589 -9.886 1.00 0.00 H new ATOM 0 HG22 VAL A 27 19.193 -5.790 -11.629 1.00 0.00 H new ATOM 0 HG23 VAL A 27 18.082 -4.522 -11.058 1.00 0.00 H new ATOM 474 N SER A 28 14.863 -4.800 -12.476 1.00 0.00 N ATOM 475 CA SER A 28 14.285 -3.481 -12.706 1.00 0.00 C ATOM 476 C SER A 28 13.455 -3.035 -11.506 1.00 0.00 C ATOM 477 O SER A 28 12.673 -3.808 -10.955 1.00 0.00 O ATOM 478 CB SER A 28 13.415 -3.495 -13.964 1.00 0.00 C ATOM 479 OG SER A 28 12.946 -4.803 -14.245 1.00 0.00 O ATOM 0 H SER A 28 14.190 -5.511 -12.190 1.00 0.00 H new ATOM 0 HA SER A 28 15.102 -2.773 -12.845 1.00 0.00 H new ATOM 0 HB2 SER A 28 12.568 -2.822 -13.832 1.00 0.00 H new ATOM 0 HB3 SER A 28 13.990 -3.121 -14.812 1.00 0.00 H new ATOM 0 HG SER A 28 12.391 -4.785 -15.053 1.00 0.00 H new ATOM 485 N GLY A 29 13.633 -1.779 -11.105 1.00 0.00 N ATOM 486 CA GLY A 29 12.896 -1.250 -9.973 1.00 0.00 C ATOM 487 C GLY A 29 13.770 -0.433 -9.043 1.00 0.00 C ATOM 488 O GLY A 29 13.281 0.160 -8.080 1.00 0.00 O ATOM 0 H GLY A 29 14.275 -1.119 -11.545 1.00 0.00 H new ATOM 0 HA2 GLY A 29 12.076 -0.629 -10.335 1.00 0.00 H new ATOM 0 HA3 GLY A 29 12.450 -2.074 -9.417 1.00 0.00 H new ATOM 492 N LEU A 30 15.067 -0.402 -9.327 1.00 0.00 N ATOM 493 CA LEU A 30 16.013 0.347 -8.507 1.00 0.00 C ATOM 494 C LEU A 30 16.390 1.664 -9.177 1.00 0.00 C ATOM 495 O LEU A 30 16.071 1.892 -10.344 1.00 0.00 O ATOM 496 CB LEU A 30 17.269 -0.487 -8.252 1.00 0.00 C ATOM 497 CG LEU A 30 17.745 -1.358 -9.415 1.00 0.00 C ATOM 498 CD1 LEU A 30 19.259 -1.292 -9.547 1.00 0.00 C ATOM 499 CD2 LEU A 30 17.286 -2.796 -9.227 1.00 0.00 C ATOM 0 H LEU A 30 15.488 -0.887 -10.119 1.00 0.00 H new ATOM 0 HA LEU A 30 15.533 0.570 -7.554 1.00 0.00 H new ATOM 0 HB2 LEU A 30 18.079 0.188 -7.975 1.00 0.00 H new ATOM 0 HB3 LEU A 30 17.084 -1.132 -7.393 1.00 0.00 H new ATOM 0 HG LEU A 30 17.304 -0.975 -10.335 1.00 0.00 H new ATOM 0 HD11 LEU A 30 19.579 -1.918 -10.380 1.00 0.00 H new ATOM 0 HD12 LEU A 30 19.564 -0.262 -9.730 1.00 0.00 H new ATOM 0 HD13 LEU A 30 19.720 -1.649 -8.626 1.00 0.00 H new ATOM 0 HD21 LEU A 30 17.634 -3.401 -10.064 1.00 0.00 H new ATOM 0 HD22 LEU A 30 17.697 -3.191 -8.298 1.00 0.00 H new ATOM 0 HD23 LEU A 30 16.197 -2.828 -9.184 1.00 0.00 H new ATOM 511 N ASP A 31 17.073 2.526 -8.433 1.00 0.00 N ATOM 512 CA ASP A 31 17.498 3.820 -8.956 1.00 0.00 C ATOM 513 C ASP A 31 19.001 4.011 -8.778 1.00 0.00 C ATOM 514 O ASP A 31 19.670 3.192 -8.148 1.00 0.00 O ATOM 515 CB ASP A 31 16.742 4.950 -8.256 1.00 0.00 C ATOM 516 CG ASP A 31 15.401 5.237 -8.904 1.00 0.00 C ATOM 517 OD1 ASP A 31 14.875 4.344 -9.601 1.00 0.00 O ATOM 518 OD2 ASP A 31 14.878 6.354 -8.713 1.00 0.00 O ATOM 0 H ASP A 31 17.345 2.353 -7.465 1.00 0.00 H new ATOM 0 HA ASP A 31 17.270 3.846 -10.022 1.00 0.00 H new ATOM 0 HB2 ASP A 31 16.588 4.687 -7.210 1.00 0.00 H new ATOM 0 HB3 ASP A 31 17.351 5.854 -8.271 1.00 0.00 H new ATOM 523 N GLU A 32 19.525 5.096 -9.339 1.00 0.00 N ATOM 524 CA GLU A 32 20.950 5.393 -9.243 1.00 0.00 C ATOM 525 C GLU A 32 21.399 5.439 -7.786 1.00 0.00 C ATOM 526 O GLU A 32 22.534 5.086 -7.465 1.00 0.00 O ATOM 527 CB GLU A 32 21.263 6.725 -9.927 1.00 0.00 C ATOM 528 CG GLU A 32 20.796 6.793 -11.371 1.00 0.00 C ATOM 529 CD GLU A 32 21.301 8.028 -12.091 1.00 0.00 C ATOM 530 OE1 GLU A 32 22.507 8.332 -11.974 1.00 0.00 O ATOM 531 OE2 GLU A 32 20.490 8.691 -12.771 1.00 0.00 O ATOM 0 H GLU A 32 18.985 5.784 -9.864 1.00 0.00 H new ATOM 0 HA GLU A 32 21.496 4.596 -9.748 1.00 0.00 H new ATOM 0 HB2 GLU A 32 20.794 7.532 -9.364 1.00 0.00 H new ATOM 0 HB3 GLU A 32 22.339 6.897 -9.894 1.00 0.00 H new ATOM 0 HG2 GLU A 32 21.137 5.904 -11.901 1.00 0.00 H new ATOM 0 HG3 GLU A 32 19.706 6.782 -11.397 1.00 0.00 H new ATOM 538 N GLU A 33 20.501 5.876 -6.909 1.00 0.00 N ATOM 539 CA GLU A 33 20.806 5.969 -5.486 1.00 0.00 C ATOM 540 C GLU A 33 20.819 4.586 -4.840 1.00 0.00 C ATOM 541 O GLU A 33 21.770 4.221 -4.147 1.00 0.00 O ATOM 542 CB GLU A 33 19.785 6.863 -4.780 1.00 0.00 C ATOM 543 CG GLU A 33 20.151 7.189 -3.342 1.00 0.00 C ATOM 544 CD GLU A 33 19.246 8.242 -2.733 1.00 0.00 C ATOM 545 OE1 GLU A 33 18.130 7.885 -2.301 1.00 0.00 O ATOM 546 OE2 GLU A 33 19.653 9.421 -2.689 1.00 0.00 O ATOM 0 H GLU A 33 19.557 6.171 -7.159 1.00 0.00 H new ATOM 0 HA GLU A 33 21.798 6.409 -5.382 1.00 0.00 H new ATOM 0 HB2 GLU A 33 19.681 7.793 -5.339 1.00 0.00 H new ATOM 0 HB3 GLU A 33 18.812 6.371 -4.796 1.00 0.00 H new ATOM 0 HG2 GLU A 33 20.099 6.280 -2.743 1.00 0.00 H new ATOM 0 HG3 GLU A 33 21.183 7.537 -3.304 1.00 0.00 H new ATOM 553 N LEU A 34 19.759 3.821 -5.073 1.00 0.00 N ATOM 554 CA LEU A 34 19.647 2.478 -4.515 1.00 0.00 C ATOM 555 C LEU A 34 20.748 1.571 -5.053 1.00 0.00 C ATOM 556 O LEU A 34 21.259 0.706 -4.341 1.00 0.00 O ATOM 557 CB LEU A 34 18.276 1.882 -4.839 1.00 0.00 C ATOM 558 CG LEU A 34 17.455 1.397 -3.644 1.00 0.00 C ATOM 559 CD1 LEU A 34 18.206 0.314 -2.885 1.00 0.00 C ATOM 560 CD2 LEU A 34 17.116 2.559 -2.722 1.00 0.00 C ATOM 0 H LEU A 34 18.964 4.108 -5.645 1.00 0.00 H new ATOM 0 HA LEU A 34 19.758 2.551 -3.433 1.00 0.00 H new ATOM 0 HB2 LEU A 34 17.693 2.632 -5.374 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.419 1.043 -5.521 1.00 0.00 H new ATOM 0 HG LEU A 34 16.523 0.972 -4.017 1.00 0.00 H new ATOM 0 HD11 LEU A 34 17.606 -0.019 -2.038 1.00 0.00 H new ATOM 0 HD12 LEU A 34 18.397 -0.530 -3.548 1.00 0.00 H new ATOM 0 HD13 LEU A 34 19.154 0.713 -2.524 1.00 0.00 H new ATOM 0 HD21 LEU A 34 16.531 2.195 -1.877 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.037 3.014 -2.357 1.00 0.00 H new ATOM 0 HD23 LEU A 34 16.537 3.302 -3.271 1.00 0.00 H new ATOM 572 N THR A 35 21.113 1.776 -6.315 1.00 0.00 N ATOM 573 CA THR A 35 22.154 0.978 -6.949 1.00 0.00 C ATOM 574 C THR A 35 23.428 0.970 -6.111 1.00 0.00 C ATOM 575 O THR A 35 24.095 -0.056 -5.990 1.00 0.00 O ATOM 576 CB THR A 35 22.485 1.503 -8.359 1.00 0.00 C ATOM 577 OG1 THR A 35 21.330 1.406 -9.201 1.00 0.00 O ATOM 578 CG2 THR A 35 23.634 0.718 -8.973 1.00 0.00 C ATOM 0 H THR A 35 20.702 2.489 -6.918 1.00 0.00 H new ATOM 0 HA THR A 35 21.768 -0.038 -7.029 1.00 0.00 H new ATOM 0 HB THR A 35 22.785 2.547 -8.273 1.00 0.00 H new ATOM 0 HG1 THR A 35 20.758 2.189 -9.063 1.00 0.00 H new ATOM 0 HG21 THR A 35 23.849 1.107 -9.968 1.00 0.00 H new ATOM 0 HG22 THR A 35 24.519 0.818 -8.345 1.00 0.00 H new ATOM 0 HG23 THR A 35 23.358 -0.334 -9.046 1.00 0.00 H new ATOM 586 N GLU A 36 23.758 2.121 -5.534 1.00 0.00 N ATOM 587 CA GLU A 36 24.952 2.245 -4.706 1.00 0.00 C ATOM 588 C GLU A 36 24.879 1.312 -3.502 1.00 0.00 C ATOM 589 O GLU A 36 25.904 0.909 -2.950 1.00 0.00 O ATOM 590 CB GLU A 36 25.126 3.691 -4.235 1.00 0.00 C ATOM 591 CG GLU A 36 25.397 4.671 -5.365 1.00 0.00 C ATOM 592 CD GLU A 36 26.799 5.245 -5.315 1.00 0.00 C ATOM 593 OE1 GLU A 36 27.764 4.471 -5.485 1.00 0.00 O ATOM 594 OE2 GLU A 36 26.931 6.469 -5.105 1.00 0.00 O ATOM 0 H GLU A 36 23.216 2.980 -5.624 1.00 0.00 H new ATOM 0 HA GLU A 36 25.813 1.962 -5.311 1.00 0.00 H new ATOM 0 HB2 GLU A 36 24.226 4.002 -3.704 1.00 0.00 H new ATOM 0 HB3 GLU A 36 25.949 3.735 -3.522 1.00 0.00 H new ATOM 0 HG2 GLU A 36 25.248 4.168 -6.321 1.00 0.00 H new ATOM 0 HG3 GLU A 36 24.673 5.485 -5.317 1.00 0.00 H new ATOM 601 N LYS A 37 23.660 0.972 -3.097 1.00 0.00 N ATOM 602 CA LYS A 37 23.450 0.085 -1.959 1.00 0.00 C ATOM 603 C LYS A 37 23.770 -1.360 -2.328 1.00 0.00 C ATOM 604 O LYS A 37 24.569 -2.019 -1.662 1.00 0.00 O ATOM 605 CB LYS A 37 22.005 0.189 -1.465 1.00 0.00 C ATOM 606 CG LYS A 37 21.537 1.617 -1.249 1.00 0.00 C ATOM 607 CD LYS A 37 22.200 2.244 -0.033 1.00 0.00 C ATOM 608 CE LYS A 37 21.349 3.360 0.553 1.00 0.00 C ATOM 609 NZ LYS A 37 21.831 3.776 1.899 1.00 0.00 N ATOM 0 H LYS A 37 22.801 1.298 -3.541 1.00 0.00 H new ATOM 0 HA LYS A 37 24.124 0.394 -1.160 1.00 0.00 H new ATOM 0 HB2 LYS A 37 21.347 -0.295 -2.187 1.00 0.00 H new ATOM 0 HB3 LYS A 37 21.910 -0.361 -0.529 1.00 0.00 H new ATOM 0 HG2 LYS A 37 21.761 2.212 -2.134 1.00 0.00 H new ATOM 0 HG3 LYS A 37 20.455 1.631 -1.122 1.00 0.00 H new ATOM 0 HD2 LYS A 37 22.370 1.479 0.725 1.00 0.00 H new ATOM 0 HD3 LYS A 37 23.177 2.639 -0.313 1.00 0.00 H new ATOM 0 HE2 LYS A 37 21.363 4.218 -0.119 1.00 0.00 H new ATOM 0 HE3 LYS A 37 20.313 3.028 0.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 21.225 4.538 2.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 21.794 2.964 2.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 22.811 4.117 1.827 1.00 0.00 H new ATOM 623 N LEU A 38 23.143 -1.846 -3.394 1.00 0.00 N ATOM 624 CA LEU A 38 23.363 -3.213 -3.853 1.00 0.00 C ATOM 625 C LEU A 38 24.802 -3.406 -4.321 1.00 0.00 C ATOM 626 O LEU A 38 25.464 -4.371 -3.940 1.00 0.00 O ATOM 627 CB LEU A 38 22.395 -3.552 -4.988 1.00 0.00 C ATOM 628 CG LEU A 38 20.924 -3.219 -4.738 1.00 0.00 C ATOM 629 CD1 LEU A 38 20.604 -3.296 -3.254 1.00 0.00 C ATOM 630 CD2 LEU A 38 20.589 -1.839 -5.286 1.00 0.00 C ATOM 0 H LEU A 38 22.479 -1.314 -3.956 1.00 0.00 H new ATOM 0 HA LEU A 38 23.181 -3.886 -3.015 1.00 0.00 H new ATOM 0 HB2 LEU A 38 22.719 -3.024 -5.885 1.00 0.00 H new ATOM 0 HB3 LEU A 38 22.474 -4.618 -5.200 1.00 0.00 H new ATOM 0 HG LEU A 38 20.311 -3.954 -5.260 1.00 0.00 H new ATOM 0 HD11 LEU A 38 19.553 -3.056 -3.096 1.00 0.00 H new ATOM 0 HD12 LEU A 38 20.805 -4.304 -2.890 1.00 0.00 H new ATOM 0 HD13 LEU A 38 21.225 -2.584 -2.711 1.00 0.00 H new ATOM 0 HD21 LEU A 38 19.538 -1.619 -5.099 1.00 0.00 H new ATOM 0 HD22 LEU A 38 21.210 -1.091 -4.793 1.00 0.00 H new ATOM 0 HD23 LEU A 38 20.779 -1.818 -6.359 1.00 0.00 H new ATOM 642 N ILE A 39 25.279 -2.481 -5.147 1.00 0.00 N ATOM 643 CA ILE A 39 26.640 -2.548 -5.664 1.00 0.00 C ATOM 644 C ILE A 39 27.653 -2.675 -4.531 1.00 0.00 C ATOM 645 O ILE A 39 28.732 -3.238 -4.711 1.00 0.00 O ATOM 646 CB ILE A 39 26.984 -1.307 -6.508 1.00 0.00 C ATOM 647 CG1 ILE A 39 28.205 -1.583 -7.387 1.00 0.00 C ATOM 648 CG2 ILE A 39 27.234 -0.107 -5.606 1.00 0.00 C ATOM 649 CD1 ILE A 39 28.753 -0.347 -8.065 1.00 0.00 C ATOM 0 H ILE A 39 24.743 -1.676 -5.472 1.00 0.00 H new ATOM 0 HA ILE A 39 26.693 -3.434 -6.297 1.00 0.00 H new ATOM 0 HB ILE A 39 26.138 -1.080 -7.156 1.00 0.00 H new ATOM 0 HG12 ILE A 39 28.989 -2.030 -6.776 1.00 0.00 H new ATOM 0 HG13 ILE A 39 27.937 -2.316 -8.148 1.00 0.00 H new ATOM 0 HG21 ILE A 39 27.476 0.763 -6.217 1.00 0.00 H new ATOM 0 HG22 ILE A 39 26.339 0.099 -5.019 1.00 0.00 H new ATOM 0 HG23 ILE A 39 28.066 -0.323 -4.936 1.00 0.00 H new ATOM 0 HD11 ILE A 39 29.617 -0.618 -8.671 1.00 0.00 H new ATOM 0 HD12 ILE A 39 27.984 0.089 -8.703 1.00 0.00 H new ATOM 0 HD13 ILE A 39 29.053 0.380 -7.310 1.00 0.00 H new ATOM 661 N GLU A 40 27.295 -2.150 -3.363 1.00 0.00 N ATOM 662 CA GLU A 40 28.173 -2.206 -2.200 1.00 0.00 C ATOM 663 C GLU A 40 28.128 -3.585 -1.550 1.00 0.00 C ATOM 664 O GLU A 40 29.165 -4.174 -1.245 1.00 0.00 O ATOM 665 CB GLU A 40 27.775 -1.136 -1.181 1.00 0.00 C ATOM 666 CG GLU A 40 28.514 0.179 -1.358 1.00 0.00 C ATOM 667 CD GLU A 40 28.482 1.039 -0.109 1.00 0.00 C ATOM 668 OE1 GLU A 40 27.501 0.936 0.657 1.00 0.00 O ATOM 669 OE2 GLU A 40 29.437 1.815 0.103 1.00 0.00 O ATOM 0 H GLU A 40 26.404 -1.682 -3.197 1.00 0.00 H new ATOM 0 HA GLU A 40 29.192 -2.016 -2.537 1.00 0.00 H new ATOM 0 HB2 GLU A 40 26.703 -0.954 -1.258 1.00 0.00 H new ATOM 0 HB3 GLU A 40 27.962 -1.516 -0.177 1.00 0.00 H new ATOM 0 HG2 GLU A 40 29.550 -0.024 -1.628 1.00 0.00 H new ATOM 0 HG3 GLU A 40 28.071 0.732 -2.187 1.00 0.00 H new ATOM 676 N ARG A 41 26.919 -4.095 -1.341 1.00 0.00 N ATOM 677 CA ARG A 41 26.737 -5.405 -0.726 1.00 0.00 C ATOM 678 C ARG A 41 27.083 -6.520 -1.709 1.00 0.00 C ATOM 679 O ARG A 41 27.279 -7.670 -1.315 1.00 0.00 O ATOM 680 CB ARG A 41 25.296 -5.568 -0.239 1.00 0.00 C ATOM 681 CG ARG A 41 24.884 -4.538 0.800 1.00 0.00 C ATOM 682 CD ARG A 41 23.407 -4.654 1.144 1.00 0.00 C ATOM 683 NE ARG A 41 23.077 -5.962 1.703 1.00 0.00 N ATOM 684 CZ ARG A 41 23.341 -6.314 2.956 1.00 0.00 C ATOM 685 NH1 ARG A 41 23.936 -5.459 3.777 1.00 0.00 N ATOM 686 NH2 ARG A 41 23.009 -7.523 3.392 1.00 0.00 N ATOM 0 H ARG A 41 26.050 -3.621 -1.588 1.00 0.00 H new ATOM 0 HA ARG A 41 27.411 -5.475 0.128 1.00 0.00 H new ATOM 0 HB2 ARG A 41 24.623 -5.499 -1.093 1.00 0.00 H new ATOM 0 HB3 ARG A 41 25.175 -6.566 0.183 1.00 0.00 H new ATOM 0 HG2 ARG A 41 25.480 -4.671 1.703 1.00 0.00 H new ATOM 0 HG3 ARG A 41 25.094 -3.537 0.424 1.00 0.00 H new ATOM 0 HD2 ARG A 41 23.139 -3.876 1.859 1.00 0.00 H new ATOM 0 HD3 ARG A 41 22.811 -4.482 0.248 1.00 0.00 H new ATOM 0 HE ARG A 41 22.618 -6.643 1.098 1.00 0.00 H new ATOM 0 HH11 ARG A 41 24.192 -4.529 3.446 1.00 0.00 H new ATOM 0 HH12 ARG A 41 24.138 -5.732 4.739 1.00 0.00 H new ATOM 0 HH21 ARG A 41 22.550 -8.183 2.764 1.00 0.00 H new ATOM 0 HH22 ARG A 41 23.213 -7.792 4.355 1.00 0.00 H new ATOM 700 N LEU A 42 27.155 -6.171 -2.989 1.00 0.00 N ATOM 701 CA LEU A 42 27.476 -7.142 -4.029 1.00 0.00 C ATOM 702 C LEU A 42 28.946 -7.049 -4.426 1.00 0.00 C ATOM 703 O LEU A 42 29.612 -8.065 -4.623 1.00 0.00 O ATOM 704 CB LEU A 42 26.590 -6.918 -5.255 1.00 0.00 C ATOM 705 CG LEU A 42 25.091 -7.141 -5.050 1.00 0.00 C ATOM 706 CD1 LEU A 42 24.314 -6.711 -6.284 1.00 0.00 C ATOM 707 CD2 LEU A 42 24.809 -8.600 -4.721 1.00 0.00 C ATOM 0 H LEU A 42 26.996 -5.223 -3.331 1.00 0.00 H new ATOM 0 HA LEU A 42 27.289 -8.139 -3.630 1.00 0.00 H new ATOM 0 HB2 LEU A 42 26.740 -5.897 -5.605 1.00 0.00 H new ATOM 0 HB3 LEU A 42 26.930 -7.581 -6.050 1.00 0.00 H new ATOM 0 HG LEU A 42 24.764 -6.530 -4.209 1.00 0.00 H new ATOM 0 HD11 LEU A 42 23.249 -6.877 -6.120 1.00 0.00 H new ATOM 0 HD12 LEU A 42 24.491 -5.653 -6.475 1.00 0.00 H new ATOM 0 HD13 LEU A 42 24.644 -7.295 -7.143 1.00 0.00 H new ATOM 0 HD21 LEU A 42 23.738 -8.740 -4.578 1.00 0.00 H new ATOM 0 HD22 LEU A 42 25.152 -9.231 -5.541 1.00 0.00 H new ATOM 0 HD23 LEU A 42 25.336 -8.875 -3.807 1.00 0.00 H new ATOM 719 N ASP A 43 29.446 -5.823 -4.538 1.00 0.00 N ATOM 720 CA ASP A 43 30.839 -5.597 -4.908 1.00 0.00 C ATOM 721 C ASP A 43 31.124 -6.133 -6.307 1.00 0.00 C ATOM 722 O ASP A 43 32.266 -6.446 -6.641 1.00 0.00 O ATOM 723 CB ASP A 43 31.772 -6.260 -3.894 1.00 0.00 C ATOM 724 CG ASP A 43 33.164 -5.658 -3.908 1.00 0.00 C ATOM 725 OD1 ASP A 43 33.372 -4.664 -4.634 1.00 0.00 O ATOM 726 OD2 ASP A 43 34.044 -6.181 -3.193 1.00 0.00 O ATOM 0 H ASP A 43 28.908 -4.971 -4.378 1.00 0.00 H new ATOM 0 HA ASP A 43 31.019 -4.522 -4.907 1.00 0.00 H new ATOM 0 HB2 ASP A 43 31.347 -6.162 -2.895 1.00 0.00 H new ATOM 0 HB3 ASP A 43 31.838 -7.327 -4.109 1.00 0.00 H new ATOM 731 N GLU A 44 30.077 -6.237 -7.120 1.00 0.00 N ATOM 732 CA GLU A 44 30.216 -6.737 -8.483 1.00 0.00 C ATOM 733 C GLU A 44 30.086 -5.603 -9.495 1.00 0.00 C ATOM 734 O GLU A 44 29.897 -4.444 -9.124 1.00 0.00 O ATOM 735 CB GLU A 44 29.162 -7.810 -8.765 1.00 0.00 C ATOM 736 CG GLU A 44 28.942 -8.767 -7.606 1.00 0.00 C ATOM 737 CD GLU A 44 30.166 -9.609 -7.304 1.00 0.00 C ATOM 738 OE1 GLU A 44 31.177 -9.468 -8.023 1.00 0.00 O ATOM 739 OE2 GLU A 44 30.113 -10.410 -6.347 1.00 0.00 O ATOM 0 H GLU A 44 29.125 -5.982 -6.859 1.00 0.00 H new ATOM 0 HA GLU A 44 31.208 -7.177 -8.582 1.00 0.00 H new ATOM 0 HB2 GLU A 44 28.217 -7.324 -9.008 1.00 0.00 H new ATOM 0 HB3 GLU A 44 29.463 -8.380 -9.644 1.00 0.00 H new ATOM 0 HG2 GLU A 44 28.669 -8.198 -6.717 1.00 0.00 H new ATOM 0 HG3 GLU A 44 28.102 -9.423 -7.836 1.00 0.00 H new ATOM 746 N ASP A 45 30.189 -5.945 -10.774 1.00 0.00 N ATOM 747 CA ASP A 45 30.083 -4.956 -11.841 1.00 0.00 C ATOM 748 C ASP A 45 28.623 -4.620 -12.127 1.00 0.00 C ATOM 749 O ASP A 45 27.875 -5.446 -12.651 1.00 0.00 O ATOM 750 CB ASP A 45 30.759 -5.472 -13.113 1.00 0.00 C ATOM 751 CG ASP A 45 31.840 -4.535 -13.615 1.00 0.00 C ATOM 752 OD1 ASP A 45 32.553 -3.946 -12.775 1.00 0.00 O ATOM 753 OD2 ASP A 45 31.974 -4.390 -14.848 1.00 0.00 O ATOM 0 H ASP A 45 30.346 -6.899 -11.098 1.00 0.00 H new ATOM 0 HA ASP A 45 30.589 -4.048 -11.513 1.00 0.00 H new ATOM 0 HB2 ASP A 45 31.194 -6.452 -12.918 1.00 0.00 H new ATOM 0 HB3 ASP A 45 30.008 -5.606 -13.891 1.00 0.00 H new ATOM 758 N THR A 46 28.223 -3.401 -11.779 1.00 0.00 N ATOM 759 CA THR A 46 26.852 -2.956 -11.995 1.00 0.00 C ATOM 760 C THR A 46 26.781 -1.916 -13.108 1.00 0.00 C ATOM 761 O THR A 46 27.764 -1.235 -13.396 1.00 0.00 O ATOM 762 CB THR A 46 26.245 -2.359 -10.711 1.00 0.00 C ATOM 763 OG1 THR A 46 27.115 -1.353 -10.180 1.00 0.00 O ATOM 764 CG2 THR A 46 26.017 -3.442 -9.667 1.00 0.00 C ATOM 0 H THR A 46 28.829 -2.704 -11.346 1.00 0.00 H new ATOM 0 HA THR A 46 26.277 -3.835 -12.285 1.00 0.00 H new ATOM 0 HB THR A 46 25.284 -1.911 -10.963 1.00 0.00 H new ATOM 0 HG1 THR A 46 26.784 -0.467 -10.435 1.00 0.00 H new ATOM 0 HG21 THR A 46 25.588 -2.997 -8.769 1.00 0.00 H new ATOM 0 HG22 THR A 46 25.332 -4.191 -10.064 1.00 0.00 H new ATOM 0 HG23 THR A 46 26.968 -3.914 -9.419 1.00 0.00 H new ATOM 772 N GLU A 47 25.611 -1.799 -13.728 1.00 0.00 N ATOM 773 CA GLU A 47 25.413 -0.841 -14.810 1.00 0.00 C ATOM 774 C GLU A 47 23.928 -0.576 -15.037 1.00 0.00 C ATOM 775 O GLU A 47 23.104 -1.486 -14.949 1.00 0.00 O ATOM 776 CB GLU A 47 26.055 -1.355 -16.100 1.00 0.00 C ATOM 777 CG GLU A 47 27.457 -0.820 -16.339 1.00 0.00 C ATOM 778 CD GLU A 47 27.753 -0.595 -17.809 1.00 0.00 C ATOM 779 OE1 GLU A 47 26.986 -1.102 -18.653 1.00 0.00 O ATOM 780 OE2 GLU A 47 28.752 0.090 -18.114 1.00 0.00 O ATOM 0 H GLU A 47 24.787 -2.355 -13.500 1.00 0.00 H new ATOM 0 HA GLU A 47 25.891 0.096 -14.524 1.00 0.00 H new ATOM 0 HB2 GLU A 47 26.092 -2.444 -16.069 1.00 0.00 H new ATOM 0 HB3 GLU A 47 25.422 -1.082 -16.944 1.00 0.00 H new ATOM 0 HG2 GLU A 47 27.580 0.119 -15.800 1.00 0.00 H new ATOM 0 HG3 GLU A 47 28.184 -1.521 -15.929 1.00 0.00 H new ATOM 787 N ARG A 48 23.594 0.677 -15.330 1.00 0.00 N ATOM 788 CA ARG A 48 22.208 1.062 -15.569 1.00 0.00 C ATOM 789 C ARG A 48 21.929 1.189 -17.063 1.00 0.00 C ATOM 790 O ARG A 48 22.497 2.047 -17.740 1.00 0.00 O ATOM 791 CB ARG A 48 21.897 2.385 -14.866 1.00 0.00 C ATOM 792 CG ARG A 48 23.053 3.371 -14.883 1.00 0.00 C ATOM 793 CD ARG A 48 22.675 4.685 -14.219 1.00 0.00 C ATOM 794 NE ARG A 48 21.437 5.237 -14.763 1.00 0.00 N ATOM 795 CZ ARG A 48 21.370 5.898 -15.913 1.00 0.00 C ATOM 796 NH1 ARG A 48 22.465 6.087 -16.638 1.00 0.00 N ATOM 797 NH2 ARG A 48 20.207 6.370 -16.342 1.00 0.00 N ATOM 0 H ARG A 48 24.264 1.442 -15.408 1.00 0.00 H new ATOM 0 HA ARG A 48 21.564 0.282 -15.163 1.00 0.00 H new ATOM 0 HB2 ARG A 48 21.031 2.845 -15.343 1.00 0.00 H new ATOM 0 HB3 ARG A 48 21.620 2.181 -13.832 1.00 0.00 H new ATOM 0 HG2 ARG A 48 23.911 2.936 -14.370 1.00 0.00 H new ATOM 0 HG3 ARG A 48 23.359 3.557 -15.913 1.00 0.00 H new ATOM 0 HD2 ARG A 48 22.562 4.530 -13.146 1.00 0.00 H new ATOM 0 HD3 ARG A 48 23.483 5.405 -14.353 1.00 0.00 H new ATOM 0 HE ARG A 48 20.577 5.108 -14.230 1.00 0.00 H new ATOM 0 HH11 ARG A 48 23.361 5.724 -16.313 1.00 0.00 H new ATOM 0 HH12 ARG A 48 22.411 6.595 -17.521 1.00 0.00 H new ATOM 0 HH21 ARG A 48 19.363 6.226 -15.788 1.00 0.00 H new ATOM 0 HH22 ARG A 48 20.157 6.877 -17.225 1.00 0.00 H new ATOM 811 N ASP A 49 21.052 0.330 -17.571 1.00 0.00 N ATOM 812 CA ASP A 49 20.697 0.347 -18.986 1.00 0.00 C ATOM 813 C ASP A 49 19.188 0.216 -19.168 1.00 0.00 C ATOM 814 O ASP A 49 18.596 -0.804 -18.816 1.00 0.00 O ATOM 815 CB ASP A 49 21.413 -0.784 -19.726 1.00 0.00 C ATOM 816 CG ASP A 49 21.387 -0.598 -21.230 1.00 0.00 C ATOM 817 OD1 ASP A 49 21.441 0.564 -21.686 1.00 0.00 O ATOM 818 OD2 ASP A 49 21.314 -1.614 -21.952 1.00 0.00 O ATOM 0 H ASP A 49 20.574 -0.387 -17.025 1.00 0.00 H new ATOM 0 HA ASP A 49 21.014 1.302 -19.405 1.00 0.00 H new ATOM 0 HB2 ASP A 49 22.448 -0.838 -19.387 1.00 0.00 H new ATOM 0 HB3 ASP A 49 20.944 -1.735 -19.472 1.00 0.00 H new ATOM 823 N ASP A 50 18.572 1.256 -19.720 1.00 0.00 N ATOM 824 CA ASP A 50 17.132 1.257 -19.950 1.00 0.00 C ATOM 825 C ASP A 50 16.374 1.004 -18.650 1.00 0.00 C ATOM 826 O ASP A 50 15.245 0.515 -18.663 1.00 0.00 O ATOM 827 CB ASP A 50 16.758 0.198 -20.987 1.00 0.00 C ATOM 828 CG ASP A 50 17.192 0.581 -22.388 1.00 0.00 C ATOM 829 OD1 ASP A 50 17.829 1.645 -22.542 1.00 0.00 O ATOM 830 OD2 ASP A 50 16.895 -0.181 -23.332 1.00 0.00 O ATOM 0 H ASP A 50 19.047 2.109 -20.016 1.00 0.00 H new ATOM 0 HA ASP A 50 16.851 2.240 -20.329 1.00 0.00 H new ATOM 0 HB2 ASP A 50 17.218 -0.752 -20.714 1.00 0.00 H new ATOM 0 HB3 ASP A 50 15.679 0.045 -20.973 1.00 0.00 H new ATOM 835 N GLY A 51 17.004 1.339 -17.528 1.00 0.00 N ATOM 836 CA GLY A 51 16.375 1.139 -16.236 1.00 0.00 C ATOM 837 C GLY A 51 16.729 -0.200 -15.619 1.00 0.00 C ATOM 838 O GLY A 51 16.516 -0.418 -14.427 1.00 0.00 O ATOM 0 H GLY A 51 17.939 1.745 -17.491 1.00 0.00 H new ATOM 0 HA2 GLY A 51 16.679 1.938 -15.560 1.00 0.00 H new ATOM 0 HA3 GLY A 51 15.293 1.209 -16.347 1.00 0.00 H new ATOM 842 N ASP A 52 17.271 -1.099 -16.433 1.00 0.00 N ATOM 843 CA ASP A 52 17.655 -2.425 -15.961 1.00 0.00 C ATOM 844 C ASP A 52 19.064 -2.406 -15.378 1.00 0.00 C ATOM 845 O ASP A 52 19.902 -1.596 -15.777 1.00 0.00 O ATOM 846 CB ASP A 52 17.575 -3.439 -17.103 1.00 0.00 C ATOM 847 CG ASP A 52 16.259 -3.367 -17.851 1.00 0.00 C ATOM 848 OD1 ASP A 52 15.199 -3.479 -17.200 1.00 0.00 O ATOM 849 OD2 ASP A 52 16.288 -3.196 -19.088 1.00 0.00 O ATOM 0 H ASP A 52 17.455 -0.934 -17.423 1.00 0.00 H new ATOM 0 HA ASP A 52 16.960 -2.720 -15.175 1.00 0.00 H new ATOM 0 HB2 ASP A 52 18.395 -3.263 -17.799 1.00 0.00 H new ATOM 0 HB3 ASP A 52 17.707 -4.444 -16.702 1.00 0.00 H new ATOM 854 N LEU A 53 19.318 -3.302 -14.430 1.00 0.00 N ATOM 855 CA LEU A 53 20.627 -3.389 -13.790 1.00 0.00 C ATOM 856 C LEU A 53 21.296 -4.725 -14.097 1.00 0.00 C ATOM 857 O LEU A 53 20.712 -5.787 -13.879 1.00 0.00 O ATOM 858 CB LEU A 53 20.489 -3.210 -12.278 1.00 0.00 C ATOM 859 CG LEU A 53 21.648 -2.501 -11.577 1.00 0.00 C ATOM 860 CD1 LEU A 53 22.916 -3.336 -11.666 1.00 0.00 C ATOM 861 CD2 LEU A 53 21.872 -1.122 -12.180 1.00 0.00 C ATOM 0 H LEU A 53 18.635 -3.978 -14.088 1.00 0.00 H new ATOM 0 HA LEU A 53 21.253 -2.591 -14.189 1.00 0.00 H new ATOM 0 HB2 LEU A 53 19.575 -2.651 -12.081 1.00 0.00 H new ATOM 0 HB3 LEU A 53 20.365 -4.194 -11.826 1.00 0.00 H new ATOM 0 HG LEU A 53 21.391 -2.378 -10.525 1.00 0.00 H new ATOM 0 HD11 LEU A 53 23.730 -2.816 -11.162 1.00 0.00 H new ATOM 0 HD12 LEU A 53 22.750 -4.301 -11.187 1.00 0.00 H new ATOM 0 HD13 LEU A 53 23.177 -3.490 -12.713 1.00 0.00 H new ATOM 0 HD21 LEU A 53 22.701 -0.632 -11.669 1.00 0.00 H new ATOM 0 HD22 LEU A 53 22.107 -1.222 -13.240 1.00 0.00 H new ATOM 0 HD23 LEU A 53 20.969 -0.523 -12.064 1.00 0.00 H new ATOM 873 N ILE A 54 22.523 -4.663 -14.603 1.00 0.00 N ATOM 874 CA ILE A 54 23.272 -5.868 -14.936 1.00 0.00 C ATOM 875 C ILE A 54 24.243 -6.238 -13.820 1.00 0.00 C ATOM 876 O ILE A 54 24.966 -5.385 -13.304 1.00 0.00 O ATOM 877 CB ILE A 54 24.058 -5.697 -16.249 1.00 0.00 C ATOM 878 CG1 ILE A 54 23.307 -4.763 -17.201 1.00 0.00 C ATOM 879 CG2 ILE A 54 24.296 -7.050 -16.904 1.00 0.00 C ATOM 880 CD1 ILE A 54 21.914 -5.242 -17.543 1.00 0.00 C ATOM 0 H ILE A 54 23.019 -3.792 -14.791 1.00 0.00 H new ATOM 0 HA ILE A 54 22.543 -6.669 -15.060 1.00 0.00 H new ATOM 0 HB ILE A 54 25.026 -5.250 -16.020 1.00 0.00 H new ATOM 0 HG12 ILE A 54 23.241 -3.773 -16.749 1.00 0.00 H new ATOM 0 HG13 ILE A 54 23.882 -4.656 -18.121 1.00 0.00 H new ATOM 0 HG21 ILE A 54 24.853 -6.913 -17.831 1.00 0.00 H new ATOM 0 HG22 ILE A 54 24.868 -7.686 -16.228 1.00 0.00 H new ATOM 0 HG23 ILE A 54 23.338 -7.522 -17.123 1.00 0.00 H new ATOM 0 HD11 ILE A 54 21.441 -4.532 -18.221 1.00 0.00 H new ATOM 0 HD12 ILE A 54 21.973 -6.218 -18.024 1.00 0.00 H new ATOM 0 HD13 ILE A 54 21.322 -5.322 -16.631 1.00 0.00 H new ATOM 892 N ILE A 55 24.256 -7.515 -13.454 1.00 0.00 N ATOM 893 CA ILE A 55 25.141 -7.999 -12.401 1.00 0.00 C ATOM 894 C ILE A 55 25.819 -9.303 -12.808 1.00 0.00 C ATOM 895 O ILE A 55 25.154 -10.304 -13.077 1.00 0.00 O ATOM 896 CB ILE A 55 24.378 -8.220 -11.082 1.00 0.00 C ATOM 897 CG1 ILE A 55 23.475 -7.021 -10.783 1.00 0.00 C ATOM 898 CG2 ILE A 55 25.354 -8.453 -9.938 1.00 0.00 C ATOM 899 CD1 ILE A 55 22.727 -7.141 -9.473 1.00 0.00 C ATOM 0 H ILE A 55 23.664 -8.233 -13.871 1.00 0.00 H new ATOM 0 HA ILE A 55 25.899 -7.231 -12.248 1.00 0.00 H new ATOM 0 HB ILE A 55 23.752 -9.106 -11.186 1.00 0.00 H new ATOM 0 HG12 ILE A 55 24.081 -6.115 -10.765 1.00 0.00 H new ATOM 0 HG13 ILE A 55 22.756 -6.907 -11.594 1.00 0.00 H new ATOM 0 HG21 ILE A 55 24.799 -8.608 -9.012 1.00 0.00 H new ATOM 0 HG22 ILE A 55 25.959 -9.334 -10.150 1.00 0.00 H new ATOM 0 HG23 ILE A 55 26.003 -7.584 -9.831 1.00 0.00 H new ATOM 0 HD11 ILE A 55 22.107 -6.257 -9.326 1.00 0.00 H new ATOM 0 HD12 ILE A 55 22.094 -8.028 -9.495 1.00 0.00 H new ATOM 0 HD13 ILE A 55 23.440 -7.225 -8.653 1.00 0.00 H new ATOM 911 N THR A 56 27.147 -9.285 -12.850 1.00 0.00 N ATOM 912 CA THR A 56 27.916 -10.466 -13.223 1.00 0.00 C ATOM 913 C THR A 56 28.696 -11.013 -12.033 1.00 0.00 C ATOM 914 O THR A 56 29.497 -10.305 -11.424 1.00 0.00 O ATOM 915 CB THR A 56 28.899 -10.158 -14.368 1.00 0.00 C ATOM 916 OG1 THR A 56 28.261 -9.340 -15.355 1.00 0.00 O ATOM 917 CG2 THR A 56 29.399 -11.442 -15.013 1.00 0.00 C ATOM 0 H THR A 56 27.713 -8.465 -12.630 1.00 0.00 H new ATOM 0 HA THR A 56 27.200 -11.215 -13.560 1.00 0.00 H new ATOM 0 HB THR A 56 29.752 -9.624 -13.950 1.00 0.00 H new ATOM 0 HG1 THR A 56 28.893 -9.147 -16.079 1.00 0.00 H new ATOM 0 HG21 THR A 56 30.092 -11.199 -15.819 1.00 0.00 H new ATOM 0 HG22 THR A 56 29.910 -12.049 -14.266 1.00 0.00 H new ATOM 0 HG23 THR A 56 28.554 -11.999 -15.417 1.00 0.00 H new ATOM 925 N VAL A 57 28.456 -12.279 -11.706 1.00 0.00 N ATOM 926 CA VAL A 57 29.137 -12.923 -10.589 1.00 0.00 C ATOM 927 C VAL A 57 29.738 -14.260 -11.008 1.00 0.00 C ATOM 928 O VAL A 57 29.018 -15.187 -11.378 1.00 0.00 O ATOM 929 CB VAL A 57 28.180 -13.151 -9.404 1.00 0.00 C ATOM 930 CG1 VAL A 57 27.786 -11.825 -8.772 1.00 0.00 C ATOM 931 CG2 VAL A 57 26.949 -13.923 -9.855 1.00 0.00 C ATOM 0 H VAL A 57 27.795 -12.879 -12.199 1.00 0.00 H new ATOM 0 HA VAL A 57 29.936 -12.251 -10.276 1.00 0.00 H new ATOM 0 HB VAL A 57 28.698 -13.745 -8.651 1.00 0.00 H new ATOM 0 HG11 VAL A 57 27.110 -12.007 -7.937 1.00 0.00 H new ATOM 0 HG12 VAL A 57 28.679 -11.314 -8.411 1.00 0.00 H new ATOM 0 HG13 VAL A 57 27.287 -11.202 -9.514 1.00 0.00 H new ATOM 0 HG21 VAL A 57 26.284 -14.075 -9.005 1.00 0.00 H new ATOM 0 HG22 VAL A 57 26.428 -13.358 -10.627 1.00 0.00 H new ATOM 0 HG23 VAL A 57 27.253 -14.890 -10.256 1.00 0.00 H new ATOM 941 N PHE A 58 31.062 -14.353 -10.947 1.00 0.00 N ATOM 942 CA PHE A 58 31.761 -15.577 -11.321 1.00 0.00 C ATOM 943 C PHE A 58 32.579 -16.115 -10.150 1.00 0.00 C ATOM 944 O PHE A 58 33.112 -15.349 -9.347 1.00 0.00 O ATOM 945 CB PHE A 58 32.674 -15.322 -12.521 1.00 0.00 C ATOM 946 CG PHE A 58 33.488 -14.066 -12.399 1.00 0.00 C ATOM 947 CD1 PHE A 58 34.622 -14.034 -11.604 1.00 0.00 C ATOM 948 CD2 PHE A 58 33.118 -12.916 -13.079 1.00 0.00 C ATOM 949 CE1 PHE A 58 35.374 -12.879 -11.490 1.00 0.00 C ATOM 950 CE2 PHE A 58 33.866 -11.759 -12.969 1.00 0.00 C ATOM 951 CZ PHE A 58 34.994 -11.740 -12.172 1.00 0.00 C ATOM 0 H PHE A 58 31.673 -13.595 -10.642 1.00 0.00 H new ATOM 0 HA PHE A 58 31.015 -16.323 -11.594 1.00 0.00 H new ATOM 0 HB2 PHE A 58 33.347 -16.171 -12.642 1.00 0.00 H new ATOM 0 HB3 PHE A 58 32.066 -15.265 -13.424 1.00 0.00 H new ATOM 0 HD1 PHE A 58 34.922 -14.922 -11.067 1.00 0.00 H new ATOM 0 HD2 PHE A 58 32.236 -12.924 -13.702 1.00 0.00 H new ATOM 0 HE1 PHE A 58 36.257 -12.868 -10.868 1.00 0.00 H new ATOM 0 HE2 PHE A 58 33.569 -10.870 -13.506 1.00 0.00 H new ATOM 0 HZ PHE A 58 35.578 -10.836 -12.082 1.00 0.00 H new ATOM 961 N TYR A 59 32.673 -17.437 -10.061 1.00 0.00 N ATOM 962 CA TYR A 59 33.423 -18.079 -8.988 1.00 0.00 C ATOM 963 C TYR A 59 34.066 -19.375 -9.472 1.00 0.00 C ATOM 964 O TYR A 59 33.461 -20.136 -10.226 1.00 0.00 O ATOM 965 CB TYR A 59 32.507 -18.365 -7.797 1.00 0.00 C ATOM 966 CG TYR A 59 31.608 -17.206 -7.432 1.00 0.00 C ATOM 967 CD1 TYR A 59 30.363 -17.050 -8.030 1.00 0.00 C ATOM 968 CD2 TYR A 59 32.003 -16.265 -6.489 1.00 0.00 C ATOM 969 CE1 TYR A 59 29.539 -15.992 -7.700 1.00 0.00 C ATOM 970 CE2 TYR A 59 31.185 -15.204 -6.151 1.00 0.00 C ATOM 971 CZ TYR A 59 29.955 -15.071 -6.760 1.00 0.00 C ATOM 972 OH TYR A 59 29.137 -14.016 -6.427 1.00 0.00 O ATOM 0 H TYR A 59 32.239 -18.085 -10.719 1.00 0.00 H new ATOM 0 HA TYR A 59 34.214 -17.398 -8.674 1.00 0.00 H new ATOM 0 HB2 TYR A 59 31.890 -19.235 -8.024 1.00 0.00 H new ATOM 0 HB3 TYR A 59 33.119 -18.625 -6.933 1.00 0.00 H new ATOM 0 HD1 TYR A 59 30.034 -17.769 -8.766 1.00 0.00 H new ATOM 0 HD2 TYR A 59 32.967 -16.365 -6.012 1.00 0.00 H new ATOM 0 HE1 TYR A 59 28.575 -15.886 -8.175 1.00 0.00 H new ATOM 0 HE2 TYR A 59 31.507 -14.483 -5.414 1.00 0.00 H new ATOM 0 HH TYR A 59 29.578 -13.461 -5.750 1.00 0.00 H new ATOM 982 N GLU A 60 35.297 -19.618 -9.032 1.00 0.00 N ATOM 983 CA GLU A 60 36.022 -20.822 -9.421 1.00 0.00 C ATOM 984 C GLU A 60 35.822 -21.933 -8.394 1.00 0.00 C ATOM 985 O GLU A 60 35.097 -21.764 -7.414 1.00 0.00 O ATOM 986 CB GLU A 60 37.514 -20.517 -9.575 1.00 0.00 C ATOM 987 CG GLU A 60 38.238 -20.335 -8.252 1.00 0.00 C ATOM 988 CD GLU A 60 39.183 -19.149 -8.262 1.00 0.00 C ATOM 989 OE1 GLU A 60 39.696 -18.808 -9.348 1.00 0.00 O ATOM 990 OE2 GLU A 60 39.409 -18.563 -7.182 1.00 0.00 O ATOM 0 H GLU A 60 35.812 -18.998 -8.407 1.00 0.00 H new ATOM 0 HA GLU A 60 35.627 -21.161 -10.379 1.00 0.00 H new ATOM 0 HB2 GLU A 60 37.987 -21.328 -10.129 1.00 0.00 H new ATOM 0 HB3 GLU A 60 37.632 -19.612 -10.171 1.00 0.00 H new ATOM 0 HG2 GLU A 60 37.505 -20.204 -7.456 1.00 0.00 H new ATOM 0 HG3 GLU A 60 38.800 -21.240 -8.022 1.00 0.00 H new ATOM 997 N ARG A 61 36.470 -23.069 -8.628 1.00 0.00 N ATOM 998 CA ARG A 61 36.363 -24.209 -7.725 1.00 0.00 C ATOM 999 C ARG A 61 36.515 -23.769 -6.272 1.00 0.00 C ATOM 1000 O ARG A 61 35.884 -24.327 -5.375 1.00 0.00 O ATOM 1001 CB ARG A 61 37.424 -25.258 -8.065 1.00 0.00 C ATOM 1002 CG ARG A 61 36.886 -26.429 -8.871 1.00 0.00 C ATOM 1003 CD ARG A 61 37.988 -27.112 -9.665 1.00 0.00 C ATOM 1004 NE ARG A 61 37.540 -28.373 -10.250 1.00 0.00 N ATOM 1005 CZ ARG A 61 38.346 -29.213 -10.891 1.00 0.00 C ATOM 1006 NH1 ARG A 61 39.633 -28.928 -11.027 1.00 0.00 N ATOM 1007 NH2 ARG A 61 37.863 -30.341 -11.397 1.00 0.00 N ATOM 0 H ARG A 61 37.074 -23.225 -9.435 1.00 0.00 H new ATOM 0 HA ARG A 61 35.374 -24.648 -7.852 1.00 0.00 H new ATOM 0 HB2 ARG A 61 38.228 -24.781 -8.625 1.00 0.00 H new ATOM 0 HB3 ARG A 61 37.860 -25.635 -7.140 1.00 0.00 H new ATOM 0 HG2 ARG A 61 36.419 -27.150 -8.200 1.00 0.00 H new ATOM 0 HG3 ARG A 61 36.110 -26.078 -9.551 1.00 0.00 H new ATOM 0 HD2 ARG A 61 38.330 -26.446 -10.457 1.00 0.00 H new ATOM 0 HD3 ARG A 61 38.842 -27.298 -9.014 1.00 0.00 H new ATOM 0 HE ARG A 61 36.555 -28.623 -10.162 1.00 0.00 H new ATOM 0 HH11 ARG A 61 40.007 -28.062 -10.639 1.00 0.00 H new ATOM 0 HH12 ARG A 61 40.249 -29.575 -11.519 1.00 0.00 H new ATOM 0 HH21 ARG A 61 36.873 -30.563 -11.294 1.00 0.00 H new ATOM 0 HH22 ARG A 61 38.482 -30.985 -11.889 1.00 0.00 H new ATOM 1021 N GLU A 62 37.357 -22.764 -6.049 1.00 0.00 N ATOM 1022 CA GLU A 62 37.593 -22.251 -4.705 1.00 0.00 C ATOM 1023 C GLU A 62 36.277 -21.893 -4.021 1.00 0.00 C ATOM 1024 O GLU A 62 36.119 -22.087 -2.815 1.00 0.00 O ATOM 1025 CB GLU A 62 38.504 -21.022 -4.757 1.00 0.00 C ATOM 1026 CG GLU A 62 39.969 -21.360 -4.978 1.00 0.00 C ATOM 1027 CD GLU A 62 40.661 -21.815 -3.708 1.00 0.00 C ATOM 1028 OE1 GLU A 62 40.159 -21.490 -2.611 1.00 0.00 O ATOM 1029 OE2 GLU A 62 41.703 -22.495 -3.810 1.00 0.00 O ATOM 0 H GLU A 62 37.886 -22.290 -6.781 1.00 0.00 H new ATOM 0 HA GLU A 62 38.083 -23.034 -4.126 1.00 0.00 H new ATOM 0 HB2 GLU A 62 38.167 -20.364 -5.558 1.00 0.00 H new ATOM 0 HB3 GLU A 62 38.405 -20.467 -3.824 1.00 0.00 H new ATOM 0 HG2 GLU A 62 40.047 -22.144 -5.731 1.00 0.00 H new ATOM 0 HG3 GLU A 62 40.484 -20.485 -5.374 1.00 0.00 H new ATOM 1036 N TYR A 63 35.336 -21.369 -4.798 1.00 0.00 N ATOM 1037 CA TYR A 63 34.035 -20.981 -4.268 1.00 0.00 C ATOM 1038 C TYR A 63 32.913 -21.747 -4.962 1.00 0.00 C ATOM 1039 O TYR A 63 31.738 -21.399 -4.839 1.00 0.00 O ATOM 1040 CB TYR A 63 33.820 -19.476 -4.437 1.00 0.00 C ATOM 1041 CG TYR A 63 34.045 -18.686 -3.168 1.00 0.00 C ATOM 1042 CD1 TYR A 63 35.318 -18.553 -2.626 1.00 0.00 C ATOM 1043 CD2 TYR A 63 32.986 -18.073 -2.510 1.00 0.00 C ATOM 1044 CE1 TYR A 63 35.529 -17.833 -1.466 1.00 0.00 C ATOM 1045 CE2 TYR A 63 33.188 -17.349 -1.351 1.00 0.00 C ATOM 1046 CZ TYR A 63 34.461 -17.232 -0.833 1.00 0.00 C ATOM 1047 OH TYR A 63 34.666 -16.514 0.323 1.00 0.00 O ATOM 0 H TYR A 63 35.450 -21.203 -5.798 1.00 0.00 H new ATOM 0 HA TYR A 63 34.016 -21.227 -3.206 1.00 0.00 H new ATOM 0 HB2 TYR A 63 34.494 -19.106 -5.210 1.00 0.00 H new ATOM 0 HB3 TYR A 63 32.804 -19.300 -4.789 1.00 0.00 H new ATOM 0 HD1 TYR A 63 36.157 -19.021 -3.120 1.00 0.00 H new ATOM 0 HD2 TYR A 63 31.988 -18.164 -2.912 1.00 0.00 H new ATOM 0 HE1 TYR A 63 36.524 -17.741 -1.057 1.00 0.00 H new ATOM 0 HE2 TYR A 63 32.354 -16.877 -0.853 1.00 0.00 H new ATOM 0 HH TYR A 63 33.811 -16.155 0.641 1.00 0.00 H new ATOM 1057 N PHE A 64 33.284 -22.794 -5.692 1.00 0.00 N ATOM 1058 CA PHE A 64 32.310 -23.611 -6.407 1.00 0.00 C ATOM 1059 C PHE A 64 31.657 -22.817 -7.534 1.00 0.00 C ATOM 1060 O PHE A 64 30.779 -21.982 -7.311 1.00 0.00 O ATOM 1061 CB PHE A 64 31.239 -24.127 -5.443 1.00 0.00 C ATOM 1062 CG PHE A 64 31.214 -25.623 -5.320 1.00 0.00 C ATOM 1063 CD1 PHE A 64 32.136 -26.282 -4.523 1.00 0.00 C ATOM 1064 CD2 PHE A 64 30.268 -26.372 -6.003 1.00 0.00 C ATOM 1065 CE1 PHE A 64 32.115 -27.660 -4.407 1.00 0.00 C ATOM 1066 CE2 PHE A 64 30.242 -27.749 -5.891 1.00 0.00 C ATOM 1067 CZ PHE A 64 31.167 -28.394 -5.093 1.00 0.00 C ATOM 0 H PHE A 64 34.252 -23.097 -5.804 1.00 0.00 H new ATOM 0 HA PHE A 64 32.836 -24.461 -6.843 1.00 0.00 H new ATOM 0 HB2 PHE A 64 31.408 -23.692 -4.458 1.00 0.00 H new ATOM 0 HB3 PHE A 64 30.262 -23.782 -5.780 1.00 0.00 H new ATOM 0 HD1 PHE A 64 32.880 -25.713 -3.986 1.00 0.00 H new ATOM 0 HD2 PHE A 64 29.543 -25.874 -6.630 1.00 0.00 H new ATOM 0 HE1 PHE A 64 32.839 -28.161 -3.781 1.00 0.00 H new ATOM 0 HE2 PHE A 64 29.499 -28.321 -6.427 1.00 0.00 H new ATOM 0 HZ PHE A 64 31.149 -29.470 -5.006 1.00 0.00 H new ATOM 1077 N PRO A 65 32.094 -23.081 -8.774 1.00 0.00 N ATOM 1078 CA PRO A 65 31.565 -22.402 -9.961 1.00 0.00 C ATOM 1079 C PRO A 65 30.131 -22.813 -10.273 1.00 0.00 C ATOM 1080 O PRO A 65 29.685 -23.893 -9.884 1.00 0.00 O ATOM 1081 CB PRO A 65 32.507 -22.857 -11.078 1.00 0.00 C ATOM 1082 CG PRO A 65 33.047 -24.165 -10.611 1.00 0.00 C ATOM 1083 CD PRO A 65 33.137 -24.064 -9.113 1.00 0.00 C ATOM 0 HA PRO A 65 31.528 -21.321 -9.830 1.00 0.00 H new ATOM 0 HB2 PRO A 65 31.976 -22.963 -12.024 1.00 0.00 H new ATOM 0 HB3 PRO A 65 33.307 -22.134 -11.240 1.00 0.00 H new ATOM 0 HG2 PRO A 65 32.394 -24.986 -10.908 1.00 0.00 H new ATOM 0 HG3 PRO A 65 34.026 -24.362 -11.049 1.00 0.00 H new ATOM 0 HD2 PRO A 65 32.954 -25.026 -8.634 1.00 0.00 H new ATOM 0 HD3 PRO A 65 34.124 -23.730 -8.791 1.00 0.00 H new ATOM 1091 N PHE A 66 29.412 -21.946 -10.979 1.00 0.00 N ATOM 1092 CA PHE A 66 28.027 -22.220 -11.343 1.00 0.00 C ATOM 1093 C PHE A 66 27.955 -23.111 -12.579 1.00 0.00 C ATOM 1094 O PHE A 66 28.151 -22.650 -13.703 1.00 0.00 O ATOM 1095 CB PHE A 66 27.277 -20.911 -11.601 1.00 0.00 C ATOM 1096 CG PHE A 66 25.820 -20.973 -11.242 1.00 0.00 C ATOM 1097 CD1 PHE A 66 24.903 -21.542 -12.111 1.00 0.00 C ATOM 1098 CD2 PHE A 66 25.368 -20.463 -10.036 1.00 0.00 C ATOM 1099 CE1 PHE A 66 23.561 -21.602 -11.783 1.00 0.00 C ATOM 1100 CE2 PHE A 66 24.028 -20.521 -9.703 1.00 0.00 C ATOM 1101 CZ PHE A 66 23.123 -21.089 -10.578 1.00 0.00 C ATOM 0 H PHE A 66 29.766 -21.048 -11.310 1.00 0.00 H new ATOM 0 HA PHE A 66 27.556 -22.744 -10.511 1.00 0.00 H new ATOM 0 HB2 PHE A 66 27.750 -20.112 -11.030 1.00 0.00 H new ATOM 0 HB3 PHE A 66 27.372 -20.649 -12.655 1.00 0.00 H new ATOM 0 HD1 PHE A 66 25.240 -21.943 -13.055 1.00 0.00 H new ATOM 0 HD2 PHE A 66 26.070 -20.015 -9.349 1.00 0.00 H new ATOM 0 HE1 PHE A 66 22.856 -22.049 -12.468 1.00 0.00 H new ATOM 0 HE2 PHE A 66 23.689 -20.122 -8.759 1.00 0.00 H new ATOM 0 HZ PHE A 66 22.075 -21.132 -10.320 1.00 0.00 H new ATOM 1111 N GLY A 67 27.674 -24.393 -12.362 1.00 0.00 N ATOM 1112 CA GLY A 67 27.582 -25.330 -13.467 1.00 0.00 C ATOM 1113 C GLY A 67 27.056 -26.684 -13.036 1.00 0.00 C ATOM 1114 O GLY A 67 27.646 -27.343 -12.180 1.00 0.00 O ATOM 0 H GLY A 67 27.509 -24.799 -11.441 1.00 0.00 H new ATOM 0 HA2 GLY A 67 26.928 -24.918 -14.236 1.00 0.00 H new ATOM 0 HA3 GLY A 67 28.567 -25.453 -13.918 1.00 0.00 H new ATOM 1118 N SER A 68 25.941 -27.100 -13.628 1.00 0.00 N ATOM 1119 CA SER A 68 25.331 -28.383 -13.296 1.00 0.00 C ATOM 1120 C SER A 68 24.198 -28.712 -14.263 1.00 0.00 C ATOM 1121 O SER A 68 23.237 -29.389 -13.900 1.00 0.00 O ATOM 1122 CB SER A 68 24.803 -28.364 -11.860 1.00 0.00 C ATOM 1123 OG SER A 68 24.840 -29.660 -11.287 1.00 0.00 O ATOM 0 H SER A 68 25.441 -26.567 -14.340 1.00 0.00 H new ATOM 0 HA SER A 68 26.096 -29.155 -13.384 1.00 0.00 H new ATOM 0 HB2 SER A 68 25.401 -27.679 -11.258 1.00 0.00 H new ATOM 0 HB3 SER A 68 23.780 -27.987 -11.850 1.00 0.00 H new ATOM 0 HG SER A 68 24.499 -29.622 -10.369 1.00 0.00 H new ATOM 1129 N GLU A 69 24.320 -28.227 -15.495 1.00 0.00 N ATOM 1130 CA GLU A 69 23.305 -28.469 -16.514 1.00 0.00 C ATOM 1131 C GLU A 69 23.256 -29.947 -16.893 1.00 0.00 C ATOM 1132 O GLU A 69 22.248 -30.433 -17.403 1.00 0.00 O ATOM 1133 CB GLU A 69 23.586 -27.622 -17.756 1.00 0.00 C ATOM 1134 CG GLU A 69 24.949 -27.881 -18.374 1.00 0.00 C ATOM 1135 CD GLU A 69 24.886 -28.847 -19.542 1.00 0.00 C ATOM 1136 OE1 GLU A 69 23.841 -29.510 -19.709 1.00 0.00 O ATOM 1137 OE2 GLU A 69 25.882 -28.938 -20.290 1.00 0.00 O ATOM 0 H GLU A 69 25.110 -27.665 -15.811 1.00 0.00 H new ATOM 0 HA GLU A 69 22.337 -28.185 -16.101 1.00 0.00 H new ATOM 0 HB2 GLU A 69 22.815 -27.819 -18.501 1.00 0.00 H new ATOM 0 HB3 GLU A 69 23.511 -26.567 -17.491 1.00 0.00 H new ATOM 0 HG2 GLU A 69 25.376 -26.937 -18.711 1.00 0.00 H new ATOM 0 HG3 GLU A 69 25.619 -28.280 -17.613 1.00 0.00 H new ATOM 1144 N GLU A 70 24.353 -30.653 -16.640 1.00 0.00 N ATOM 1145 CA GLU A 70 24.436 -32.074 -16.956 1.00 0.00 C ATOM 1146 C GLU A 70 23.290 -32.844 -16.305 1.00 0.00 C ATOM 1147 O GLU A 70 22.903 -33.915 -16.772 1.00 0.00 O ATOM 1148 CB GLU A 70 25.777 -32.646 -16.491 1.00 0.00 C ATOM 1149 CG GLU A 70 26.931 -32.328 -17.427 1.00 0.00 C ATOM 1150 CD GLU A 70 26.970 -33.241 -18.637 1.00 0.00 C ATOM 1151 OE1 GLU A 70 27.460 -34.382 -18.503 1.00 0.00 O ATOM 1152 OE2 GLU A 70 26.511 -32.815 -19.717 1.00 0.00 O ATOM 0 H GLU A 70 25.196 -30.265 -16.217 1.00 0.00 H new ATOM 0 HA GLU A 70 24.358 -32.184 -18.038 1.00 0.00 H new ATOM 0 HB2 GLU A 70 26.006 -32.254 -15.500 1.00 0.00 H new ATOM 0 HB3 GLU A 70 25.687 -33.728 -16.393 1.00 0.00 H new ATOM 0 HG2 GLU A 70 26.849 -31.293 -17.760 1.00 0.00 H new ATOM 0 HG3 GLU A 70 27.871 -32.414 -16.881 1.00 0.00 H new ATOM 1159 N SER A 71 22.751 -32.289 -15.224 1.00 0.00 N ATOM 1160 CA SER A 71 21.653 -32.925 -14.506 1.00 0.00 C ATOM 1161 C SER A 71 20.377 -32.913 -15.344 1.00 0.00 C ATOM 1162 O SER A 71 19.818 -33.963 -15.660 1.00 0.00 O ATOM 1163 CB SER A 71 21.408 -32.214 -13.174 1.00 0.00 C ATOM 1164 OG SER A 71 22.354 -32.617 -12.199 1.00 0.00 O ATOM 0 H SER A 71 23.057 -31.401 -14.827 1.00 0.00 H new ATOM 0 HA SER A 71 21.930 -33.961 -14.312 1.00 0.00 H new ATOM 0 HB2 SER A 71 21.467 -31.135 -13.318 1.00 0.00 H new ATOM 0 HB3 SER A 71 20.401 -32.434 -12.821 1.00 0.00 H new ATOM 0 HG SER A 71 22.177 -32.147 -11.357 1.00 0.00 H new ATOM 1170 N LYS A 72 19.922 -31.717 -15.700 1.00 0.00 N ATOM 1171 CA LYS A 72 18.714 -31.565 -16.502 1.00 0.00 C ATOM 1172 C LYS A 72 18.971 -31.960 -17.953 1.00 0.00 C ATOM 1173 O LYS A 72 18.040 -32.274 -18.695 1.00 0.00 O ATOM 1174 CB LYS A 72 18.211 -30.121 -16.436 1.00 0.00 C ATOM 1175 CG LYS A 72 17.351 -29.831 -15.218 1.00 0.00 C ATOM 1176 CD LYS A 72 16.543 -28.557 -15.397 1.00 0.00 C ATOM 1177 CE LYS A 72 15.070 -28.858 -15.625 1.00 0.00 C ATOM 1178 NZ LYS A 72 14.678 -28.661 -17.048 1.00 0.00 N ATOM 0 H LYS A 72 20.372 -30.838 -15.446 1.00 0.00 H new ATOM 0 HA LYS A 72 17.951 -32.227 -16.093 1.00 0.00 H new ATOM 0 HB2 LYS A 72 19.067 -29.447 -16.434 1.00 0.00 H new ATOM 0 HB3 LYS A 72 17.636 -29.904 -17.336 1.00 0.00 H new ATOM 0 HG2 LYS A 72 16.677 -30.669 -15.040 1.00 0.00 H new ATOM 0 HG3 LYS A 72 17.986 -29.740 -14.337 1.00 0.00 H new ATOM 0 HD2 LYS A 72 16.654 -27.927 -14.514 1.00 0.00 H new ATOM 0 HD3 LYS A 72 16.935 -27.992 -16.243 1.00 0.00 H new ATOM 0 HE2 LYS A 72 14.859 -29.886 -15.329 1.00 0.00 H new ATOM 0 HE3 LYS A 72 14.465 -28.212 -14.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 14.051 -29.435 -17.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 14.180 -27.754 -17.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 15.529 -28.656 -17.645 1.00 0.00 H new ATOM 1192 N VAL A 73 20.239 -31.942 -18.350 1.00 0.00 N ATOM 1193 CA VAL A 73 20.618 -32.301 -19.712 1.00 0.00 C ATOM 1194 C VAL A 73 20.161 -31.241 -20.707 1.00 0.00 C ATOM 1195 O VAL A 73 19.969 -31.524 -21.890 1.00 0.00 O ATOM 1196 CB VAL A 73 20.025 -33.662 -20.120 1.00 0.00 C ATOM 1197 CG1 VAL A 73 20.743 -34.214 -21.342 1.00 0.00 C ATOM 1198 CG2 VAL A 73 20.098 -34.644 -18.960 1.00 0.00 C ATOM 0 H VAL A 73 21.021 -31.683 -17.749 1.00 0.00 H new ATOM 0 HA VAL A 73 21.706 -32.367 -19.730 1.00 0.00 H new ATOM 0 HB VAL A 73 18.976 -33.518 -20.379 1.00 0.00 H new ATOM 0 HG11 VAL A 73 20.310 -35.176 -21.615 1.00 0.00 H new ATOM 0 HG12 VAL A 73 20.634 -33.518 -22.174 1.00 0.00 H new ATOM 0 HG13 VAL A 73 21.801 -34.344 -21.114 1.00 0.00 H new ATOM 0 HG21 VAL A 73 19.675 -35.601 -19.266 1.00 0.00 H new ATOM 0 HG22 VAL A 73 21.139 -34.785 -18.667 1.00 0.00 H new ATOM 0 HG23 VAL A 73 19.533 -34.251 -18.115 1.00 0.00 H new ATOM 1208 N LYS A 74 19.988 -30.016 -20.221 1.00 0.00 N ATOM 1209 CA LYS A 74 19.554 -28.911 -21.067 1.00 0.00 C ATOM 1210 C LYS A 74 19.937 -27.570 -20.449 1.00 0.00 C ATOM 1211 O LYS A 74 20.389 -27.509 -19.306 1.00 0.00 O ATOM 1212 CB LYS A 74 18.040 -28.971 -21.284 1.00 0.00 C ATOM 1213 CG LYS A 74 17.256 -29.269 -20.019 1.00 0.00 C ATOM 1214 CD LYS A 74 15.766 -29.381 -20.299 1.00 0.00 C ATOM 1215 CE LYS A 74 15.444 -30.625 -21.112 1.00 0.00 C ATOM 1216 NZ LYS A 74 15.213 -30.305 -22.548 1.00 0.00 N ATOM 0 H LYS A 74 20.142 -29.764 -19.245 1.00 0.00 H new ATOM 0 HA LYS A 74 20.056 -29.004 -22.030 1.00 0.00 H new ATOM 0 HB2 LYS A 74 17.702 -28.020 -21.695 1.00 0.00 H new ATOM 0 HB3 LYS A 74 17.818 -29.736 -22.028 1.00 0.00 H new ATOM 0 HG2 LYS A 74 17.615 -30.199 -19.578 1.00 0.00 H new ATOM 0 HG3 LYS A 74 17.431 -28.481 -19.287 1.00 0.00 H new ATOM 0 HD2 LYS A 74 15.219 -29.409 -19.357 1.00 0.00 H new ATOM 0 HD3 LYS A 74 15.428 -28.496 -20.838 1.00 0.00 H new ATOM 0 HE2 LYS A 74 16.265 -31.337 -21.026 1.00 0.00 H new ATOM 0 HE3 LYS A 74 14.558 -31.108 -20.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 15.431 -31.139 -23.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 14.218 -30.036 -22.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 15.828 -29.515 -22.831 1.00 0.00 H new ATOM 1230 N MET A 75 19.751 -26.497 -21.211 1.00 0.00 N ATOM 1231 CA MET A 75 20.075 -25.157 -20.736 1.00 0.00 C ATOM 1232 C MET A 75 19.091 -24.709 -19.660 1.00 0.00 C ATOM 1233 O MET A 75 19.404 -23.847 -18.840 1.00 0.00 O ATOM 1234 CB MET A 75 20.063 -24.163 -21.900 1.00 0.00 C ATOM 1235 CG MET A 75 18.736 -24.109 -22.639 1.00 0.00 C ATOM 1236 SD MET A 75 18.867 -24.679 -24.344 1.00 0.00 S ATOM 1237 CE MET A 75 18.953 -23.117 -25.217 1.00 0.00 C ATOM 0 H MET A 75 19.378 -26.529 -22.160 1.00 0.00 H new ATOM 0 HA MET A 75 21.074 -25.185 -20.301 1.00 0.00 H new ATOM 0 HB2 MET A 75 20.299 -23.169 -21.521 1.00 0.00 H new ATOM 0 HB3 MET A 75 20.851 -24.431 -22.604 1.00 0.00 H new ATOM 0 HG2 MET A 75 18.005 -24.721 -22.111 1.00 0.00 H new ATOM 0 HG3 MET A 75 18.361 -23.086 -22.630 1.00 0.00 H new ATOM 0 HE1 MET A 75 19.037 -23.303 -26.288 1.00 0.00 H new ATOM 0 HE2 MET A 75 18.050 -22.539 -25.019 1.00 0.00 H new ATOM 0 HE3 MET A 75 19.824 -22.557 -24.876 1.00 0.00 H new ATOM 1247 N ALA A 76 17.901 -25.301 -19.670 1.00 0.00 N ATOM 1248 CA ALA A 76 16.872 -24.964 -18.694 1.00 0.00 C ATOM 1249 C ALA A 76 17.430 -24.995 -17.275 1.00 0.00 C ATOM 1250 O ALA A 76 16.971 -24.259 -16.401 1.00 0.00 O ATOM 1251 CB ALA A 76 15.692 -25.917 -18.819 1.00 0.00 C ATOM 0 H ALA A 76 17.626 -26.016 -20.343 1.00 0.00 H new ATOM 0 HA ALA A 76 16.530 -23.950 -18.901 1.00 0.00 H new ATOM 0 HB1 ALA A 76 14.932 -25.653 -18.084 1.00 0.00 H new ATOM 0 HB2 ALA A 76 15.269 -25.843 -19.821 1.00 0.00 H new ATOM 0 HB3 ALA A 76 16.029 -26.938 -18.642 1.00 0.00 H new ATOM 1257 N ASP A 77 18.422 -25.850 -17.053 1.00 0.00 N ATOM 1258 CA ASP A 77 19.044 -25.977 -15.740 1.00 0.00 C ATOM 1259 C ASP A 77 19.765 -24.689 -15.354 1.00 0.00 C ATOM 1260 O ASP A 77 19.728 -24.268 -14.197 1.00 0.00 O ATOM 1261 CB ASP A 77 20.026 -27.149 -15.728 1.00 0.00 C ATOM 1262 CG ASP A 77 19.836 -28.050 -14.523 1.00 0.00 C ATOM 1263 OD1 ASP A 77 19.184 -27.613 -13.553 1.00 0.00 O ATOM 1264 OD2 ASP A 77 20.341 -29.193 -14.551 1.00 0.00 O ATOM 0 H ASP A 77 18.813 -26.466 -17.766 1.00 0.00 H new ATOM 0 HA ASP A 77 18.257 -26.165 -15.009 1.00 0.00 H new ATOM 0 HB2 ASP A 77 19.900 -27.734 -16.639 1.00 0.00 H new ATOM 0 HB3 ASP A 77 21.046 -26.765 -15.734 1.00 0.00 H new ATOM 1269 N PHE A 78 20.421 -24.069 -16.329 1.00 0.00 N ATOM 1270 CA PHE A 78 21.152 -22.830 -16.091 1.00 0.00 C ATOM 1271 C PHE A 78 20.199 -21.698 -15.722 1.00 0.00 C ATOM 1272 O PHE A 78 20.381 -21.024 -14.707 1.00 0.00 O ATOM 1273 CB PHE A 78 21.964 -22.446 -17.330 1.00 0.00 C ATOM 1274 CG PHE A 78 23.349 -23.027 -17.343 1.00 0.00 C ATOM 1275 CD1 PHE A 78 24.235 -22.763 -16.311 1.00 0.00 C ATOM 1276 CD2 PHE A 78 23.765 -23.836 -18.388 1.00 0.00 C ATOM 1277 CE1 PHE A 78 25.510 -23.297 -16.320 1.00 0.00 C ATOM 1278 CE2 PHE A 78 25.039 -24.372 -18.402 1.00 0.00 C ATOM 1279 CZ PHE A 78 25.913 -24.101 -17.368 1.00 0.00 C ATOM 0 H PHE A 78 20.461 -24.404 -17.291 1.00 0.00 H new ATOM 0 HA PHE A 78 21.833 -22.994 -15.256 1.00 0.00 H new ATOM 0 HB2 PHE A 78 21.431 -22.778 -18.221 1.00 0.00 H new ATOM 0 HB3 PHE A 78 22.034 -21.360 -17.386 1.00 0.00 H new ATOM 0 HD1 PHE A 78 23.926 -22.133 -15.490 1.00 0.00 H new ATOM 0 HD2 PHE A 78 23.086 -24.050 -19.200 1.00 0.00 H new ATOM 0 HE1 PHE A 78 26.190 -23.086 -15.508 1.00 0.00 H new ATOM 0 HE2 PHE A 78 25.351 -25.003 -19.221 1.00 0.00 H new ATOM 0 HZ PHE A 78 26.910 -24.517 -17.379 1.00 0.00 H new ATOM 1289 N ILE A 79 19.183 -21.494 -16.554 1.00 0.00 N ATOM 1290 CA ILE A 79 18.200 -20.443 -16.315 1.00 0.00 C ATOM 1291 C ILE A 79 17.380 -20.732 -15.063 1.00 0.00 C ATOM 1292 O ILE A 79 17.008 -19.818 -14.328 1.00 0.00 O ATOM 1293 CB ILE A 79 17.247 -20.282 -17.514 1.00 0.00 C ATOM 1294 CG1 ILE A 79 16.095 -19.341 -17.155 1.00 0.00 C ATOM 1295 CG2 ILE A 79 16.713 -21.637 -17.953 1.00 0.00 C ATOM 1296 CD1 ILE A 79 14.838 -20.062 -16.722 1.00 0.00 C ATOM 0 H ILE A 79 19.019 -22.042 -17.399 1.00 0.00 H new ATOM 0 HA ILE A 79 18.756 -19.516 -16.176 1.00 0.00 H new ATOM 0 HB ILE A 79 17.803 -19.846 -18.344 1.00 0.00 H new ATOM 0 HG12 ILE A 79 16.417 -18.675 -16.354 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.866 -18.715 -18.017 1.00 0.00 H new ATOM 0 HG21 ILE A 79 16.041 -21.506 -18.801 1.00 0.00 H new ATOM 0 HG22 ILE A 79 17.544 -22.279 -18.245 1.00 0.00 H new ATOM 0 HG23 ILE A 79 16.170 -22.099 -17.128 1.00 0.00 H new ATOM 0 HD11 ILE A 79 14.064 -19.333 -16.483 1.00 0.00 H new ATOM 0 HD12 ILE A 79 14.492 -20.707 -17.530 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.051 -20.667 -15.841 1.00 0.00 H new ATOM 1308 N ALA A 80 17.102 -22.010 -14.825 1.00 0.00 N ATOM 1309 CA ALA A 80 16.329 -22.420 -13.660 1.00 0.00 C ATOM 1310 C ALA A 80 17.142 -22.262 -12.379 1.00 0.00 C ATOM 1311 O ALA A 80 16.654 -21.722 -11.386 1.00 0.00 O ATOM 1312 CB ALA A 80 15.862 -23.860 -13.816 1.00 0.00 C ATOM 0 H ALA A 80 17.401 -22.779 -15.424 1.00 0.00 H new ATOM 0 HA ALA A 80 15.455 -21.772 -13.588 1.00 0.00 H new ATOM 0 HB1 ALA A 80 15.286 -24.153 -12.938 1.00 0.00 H new ATOM 0 HB2 ALA A 80 15.237 -23.946 -14.705 1.00 0.00 H new ATOM 0 HB3 ALA A 80 16.728 -24.514 -13.916 1.00 0.00 H new ATOM 1318 N ARG A 81 18.382 -22.738 -12.408 1.00 0.00 N ATOM 1319 CA ARG A 81 19.261 -22.651 -11.248 1.00 0.00 C ATOM 1320 C ARG A 81 19.680 -21.207 -10.990 1.00 0.00 C ATOM 1321 O ARG A 81 19.788 -20.778 -9.842 1.00 0.00 O ATOM 1322 CB ARG A 81 20.501 -23.524 -11.455 1.00 0.00 C ATOM 1323 CG ARG A 81 21.275 -23.795 -10.175 1.00 0.00 C ATOM 1324 CD ARG A 81 22.651 -24.371 -10.468 1.00 0.00 C ATOM 1325 NE ARG A 81 22.683 -25.823 -10.309 1.00 0.00 N ATOM 1326 CZ ARG A 81 22.642 -26.434 -9.130 1.00 0.00 C ATOM 1327 NH1 ARG A 81 22.568 -25.723 -8.013 1.00 0.00 N ATOM 1328 NH2 ARG A 81 22.674 -27.759 -9.067 1.00 0.00 N ATOM 0 H ARG A 81 18.801 -23.188 -13.222 1.00 0.00 H new ATOM 0 HA ARG A 81 18.711 -23.012 -10.379 1.00 0.00 H new ATOM 0 HB2 ARG A 81 20.197 -24.474 -11.894 1.00 0.00 H new ATOM 0 HB3 ARG A 81 21.161 -23.038 -12.173 1.00 0.00 H new ATOM 0 HG2 ARG A 81 21.380 -22.869 -9.609 1.00 0.00 H new ATOM 0 HG3 ARG A 81 20.714 -24.489 -9.549 1.00 0.00 H new ATOM 0 HD2 ARG A 81 22.943 -24.111 -11.486 1.00 0.00 H new ATOM 0 HD3 ARG A 81 23.383 -23.917 -9.800 1.00 0.00 H new ATOM 0 HE ARG A 81 22.740 -26.399 -11.149 1.00 0.00 H new ATOM 0 HH11 ARG A 81 22.542 -24.704 -8.058 1.00 0.00 H new ATOM 0 HH12 ARG A 81 22.537 -26.195 -7.109 1.00 0.00 H new ATOM 0 HH21 ARG A 81 22.730 -28.309 -9.924 1.00 0.00 H new ATOM 0 HH22 ARG A 81 22.643 -28.227 -8.161 1.00 0.00 H new ATOM 1342 N GLU A 82 19.915 -20.463 -12.067 1.00 0.00 N ATOM 1343 CA GLU A 82 20.323 -19.068 -11.956 1.00 0.00 C ATOM 1344 C GLU A 82 19.172 -18.203 -11.449 1.00 0.00 C ATOM 1345 O GLU A 82 19.381 -17.261 -10.686 1.00 0.00 O ATOM 1346 CB GLU A 82 20.809 -18.546 -13.310 1.00 0.00 C ATOM 1347 CG GLU A 82 22.194 -19.042 -13.691 1.00 0.00 C ATOM 1348 CD GLU A 82 23.278 -18.504 -12.778 1.00 0.00 C ATOM 1349 OE1 GLU A 82 22.944 -17.756 -11.835 1.00 0.00 O ATOM 1350 OE2 GLU A 82 24.462 -18.832 -13.006 1.00 0.00 O ATOM 0 H GLU A 82 19.830 -20.803 -13.025 1.00 0.00 H new ATOM 0 HA GLU A 82 21.141 -19.012 -11.238 1.00 0.00 H new ATOM 0 HB2 GLU A 82 20.100 -18.846 -14.082 1.00 0.00 H new ATOM 0 HB3 GLU A 82 20.815 -17.456 -13.289 1.00 0.00 H new ATOM 0 HG2 GLU A 82 22.207 -20.132 -13.661 1.00 0.00 H new ATOM 0 HG3 GLU A 82 22.411 -18.749 -14.718 1.00 0.00 H new ATOM 1357 N GLU A 83 17.959 -18.531 -11.880 1.00 0.00 N ATOM 1358 CA GLU A 83 16.775 -17.784 -11.471 1.00 0.00 C ATOM 1359 C GLU A 83 16.432 -18.064 -10.011 1.00 0.00 C ATOM 1360 O GLU A 83 16.290 -17.142 -9.207 1.00 0.00 O ATOM 1361 CB GLU A 83 15.585 -18.141 -12.364 1.00 0.00 C ATOM 1362 CG GLU A 83 15.542 -17.356 -13.664 1.00 0.00 C ATOM 1363 CD GLU A 83 14.303 -17.656 -14.485 1.00 0.00 C ATOM 1364 OE1 GLU A 83 13.594 -18.630 -14.154 1.00 0.00 O ATOM 1365 OE2 GLU A 83 14.043 -16.919 -15.459 1.00 0.00 O ATOM 0 H GLU A 83 17.770 -19.309 -12.512 1.00 0.00 H new ATOM 0 HA GLU A 83 16.993 -16.721 -11.577 1.00 0.00 H new ATOM 0 HB2 GLU A 83 15.621 -19.206 -12.594 1.00 0.00 H new ATOM 0 HB3 GLU A 83 14.662 -17.965 -11.812 1.00 0.00 H new ATOM 0 HG2 GLU A 83 15.577 -16.290 -13.442 1.00 0.00 H new ATOM 0 HG3 GLU A 83 16.429 -17.588 -14.254 1.00 0.00 H new ATOM 1372 N ILE A 84 16.301 -19.343 -9.675 1.00 0.00 N ATOM 1373 CA ILE A 84 15.975 -19.746 -8.313 1.00 0.00 C ATOM 1374 C ILE A 84 17.070 -19.324 -7.339 1.00 0.00 C ATOM 1375 O ILE A 84 16.799 -19.034 -6.174 1.00 0.00 O ATOM 1376 CB ILE A 84 15.770 -21.269 -8.209 1.00 0.00 C ATOM 1377 CG1 ILE A 84 17.095 -22.000 -8.438 1.00 0.00 C ATOM 1378 CG2 ILE A 84 14.723 -21.732 -9.211 1.00 0.00 C ATOM 1379 CD1 ILE A 84 17.788 -22.410 -7.158 1.00 0.00 C ATOM 0 H ILE A 84 16.416 -20.118 -10.328 1.00 0.00 H new ATOM 0 HA ILE A 84 15.044 -19.244 -8.050 1.00 0.00 H new ATOM 0 HB ILE A 84 15.414 -21.506 -7.206 1.00 0.00 H new ATOM 0 HG12 ILE A 84 16.911 -22.888 -9.042 1.00 0.00 H new ATOM 0 HG13 ILE A 84 17.761 -21.356 -9.012 1.00 0.00 H new ATOM 0 HG21 ILE A 84 14.589 -22.810 -9.125 1.00 0.00 H new ATOM 0 HG22 ILE A 84 13.777 -21.232 -9.006 1.00 0.00 H new ATOM 0 HG23 ILE A 84 15.052 -21.486 -10.221 1.00 0.00 H new ATOM 0 HD11 ILE A 84 18.720 -22.923 -7.397 1.00 0.00 H new ATOM 0 HD12 ILE A 84 18.004 -21.524 -6.561 1.00 0.00 H new ATOM 0 HD13 ILE A 84 17.140 -23.080 -6.592 1.00 0.00 H new ATOM 1391 N GLU A 85 18.307 -19.289 -7.825 1.00 0.00 N ATOM 1392 CA GLU A 85 19.442 -18.901 -6.997 1.00 0.00 C ATOM 1393 C GLU A 85 19.269 -17.481 -6.467 1.00 0.00 C ATOM 1394 O GLU A 85 19.430 -17.228 -5.274 1.00 0.00 O ATOM 1395 CB GLU A 85 20.743 -19.005 -7.795 1.00 0.00 C ATOM 1396 CG GLU A 85 21.945 -18.409 -7.081 1.00 0.00 C ATOM 1397 CD GLU A 85 22.003 -18.796 -5.616 1.00 0.00 C ATOM 1398 OE1 GLU A 85 21.636 -19.945 -5.291 1.00 0.00 O ATOM 1399 OE2 GLU A 85 22.416 -17.951 -4.795 1.00 0.00 O ATOM 0 H GLU A 85 18.548 -19.525 -8.788 1.00 0.00 H new ATOM 0 HA GLU A 85 19.490 -19.583 -6.148 1.00 0.00 H new ATOM 0 HB2 GLU A 85 20.943 -20.054 -8.012 1.00 0.00 H new ATOM 0 HB3 GLU A 85 20.613 -18.501 -8.753 1.00 0.00 H new ATOM 0 HG2 GLU A 85 22.858 -18.739 -7.577 1.00 0.00 H new ATOM 0 HG3 GLU A 85 21.911 -17.323 -7.165 1.00 0.00 H new ATOM 1406 N MET A 86 18.941 -16.557 -7.365 1.00 0.00 N ATOM 1407 CA MET A 86 18.745 -15.162 -6.989 1.00 0.00 C ATOM 1408 C MET A 86 17.409 -14.972 -6.278 1.00 0.00 C ATOM 1409 O MET A 86 17.337 -14.323 -5.235 1.00 0.00 O ATOM 1410 CB MET A 86 18.810 -14.264 -8.225 1.00 0.00 C ATOM 1411 CG MET A 86 18.957 -12.787 -7.897 1.00 0.00 C ATOM 1412 SD MET A 86 20.673 -12.303 -7.627 1.00 0.00 S ATOM 1413 CE MET A 86 20.728 -12.235 -5.838 1.00 0.00 C ATOM 0 H MET A 86 18.806 -16.749 -8.357 1.00 0.00 H new ATOM 0 HA MET A 86 19.544 -14.882 -6.303 1.00 0.00 H new ATOM 0 HB2 MET A 86 19.650 -14.575 -8.846 1.00 0.00 H new ATOM 0 HB3 MET A 86 17.906 -14.408 -8.816 1.00 0.00 H new ATOM 0 HG2 MET A 86 18.540 -12.195 -8.712 1.00 0.00 H new ATOM 0 HG3 MET A 86 18.374 -12.557 -7.005 1.00 0.00 H new ATOM 0 HE1 MET A 86 20.676 -11.196 -5.512 1.00 0.00 H new ATOM 0 HE2 MET A 86 19.883 -12.787 -5.427 1.00 0.00 H new ATOM 0 HE3 MET A 86 21.658 -12.680 -5.485 1.00 0.00 H new ATOM 1423 N MET A 87 16.354 -15.543 -6.849 1.00 0.00 N ATOM 1424 CA MET A 87 15.020 -15.438 -6.269 1.00 0.00 C ATOM 1425 C MET A 87 15.011 -15.948 -4.832 1.00 0.00 C ATOM 1426 O MET A 87 14.460 -15.305 -3.938 1.00 0.00 O ATOM 1427 CB MET A 87 14.011 -16.224 -7.108 1.00 0.00 C ATOM 1428 CG MET A 87 13.877 -15.713 -8.534 1.00 0.00 C ATOM 1429 SD MET A 87 12.520 -14.541 -8.726 1.00 0.00 S ATOM 1430 CE MET A 87 11.629 -15.276 -10.094 1.00 0.00 C ATOM 0 H MET A 87 16.397 -16.083 -7.713 1.00 0.00 H new ATOM 0 HA MET A 87 14.735 -14.386 -6.265 1.00 0.00 H new ATOM 0 HB2 MET A 87 14.310 -17.272 -7.133 1.00 0.00 H new ATOM 0 HB3 MET A 87 13.036 -16.182 -6.623 1.00 0.00 H new ATOM 0 HG2 MET A 87 14.810 -15.236 -8.834 1.00 0.00 H new ATOM 0 HG3 MET A 87 13.721 -16.557 -9.205 1.00 0.00 H new ATOM 0 HE1 MET A 87 10.759 -14.664 -10.332 1.00 0.00 H new ATOM 0 HE2 MET A 87 12.282 -15.333 -10.965 1.00 0.00 H new ATOM 0 HE3 MET A 87 11.303 -16.279 -9.819 1.00 0.00 H new ATOM 1440 N VAL A 88 15.623 -17.107 -4.616 1.00 0.00 N ATOM 1441 CA VAL A 88 15.686 -17.703 -3.286 1.00 0.00 C ATOM 1442 C VAL A 88 16.651 -16.939 -2.387 1.00 0.00 C ATOM 1443 O VAL A 88 16.399 -16.765 -1.194 1.00 0.00 O ATOM 1444 CB VAL A 88 16.123 -19.179 -3.353 1.00 0.00 C ATOM 1445 CG1 VAL A 88 16.374 -19.725 -1.956 1.00 0.00 C ATOM 1446 CG2 VAL A 88 15.077 -20.011 -4.079 1.00 0.00 C ATOM 0 H VAL A 88 16.083 -17.653 -5.345 1.00 0.00 H new ATOM 0 HA VAL A 88 14.682 -17.648 -2.866 1.00 0.00 H new ATOM 0 HB VAL A 88 17.056 -19.239 -3.914 1.00 0.00 H new ATOM 0 HG11 VAL A 88 16.682 -20.769 -2.023 1.00 0.00 H new ATOM 0 HG12 VAL A 88 17.161 -19.145 -1.475 1.00 0.00 H new ATOM 0 HG13 VAL A 88 15.459 -19.654 -1.368 1.00 0.00 H new ATOM 0 HG21 VAL A 88 15.402 -21.051 -4.117 1.00 0.00 H new ATOM 0 HG22 VAL A 88 14.128 -19.947 -3.547 1.00 0.00 H new ATOM 0 HG23 VAL A 88 14.951 -19.633 -5.093 1.00 0.00 H new ATOM 1456 N PHE A 89 17.757 -16.484 -2.966 1.00 0.00 N ATOM 1457 CA PHE A 89 18.761 -15.738 -2.216 1.00 0.00 C ATOM 1458 C PHE A 89 18.159 -14.475 -1.608 1.00 0.00 C ATOM 1459 O PHE A 89 18.242 -14.254 -0.399 1.00 0.00 O ATOM 1460 CB PHE A 89 19.937 -15.370 -3.124 1.00 0.00 C ATOM 1461 CG PHE A 89 20.932 -14.453 -2.473 1.00 0.00 C ATOM 1462 CD1 PHE A 89 21.972 -14.964 -1.714 1.00 0.00 C ATOM 1463 CD2 PHE A 89 20.827 -13.079 -2.620 1.00 0.00 C ATOM 1464 CE1 PHE A 89 22.890 -14.122 -1.114 1.00 0.00 C ATOM 1465 CE2 PHE A 89 21.742 -12.232 -2.023 1.00 0.00 C ATOM 1466 CZ PHE A 89 22.774 -12.755 -1.268 1.00 0.00 C ATOM 0 H PHE A 89 17.981 -16.619 -3.952 1.00 0.00 H new ATOM 0 HA PHE A 89 19.120 -16.374 -1.407 1.00 0.00 H new ATOM 0 HB2 PHE A 89 20.445 -16.283 -3.435 1.00 0.00 H new ATOM 0 HB3 PHE A 89 19.554 -14.895 -4.027 1.00 0.00 H new ATOM 0 HD1 PHE A 89 22.067 -16.033 -1.589 1.00 0.00 H new ATOM 0 HD2 PHE A 89 20.021 -12.665 -3.208 1.00 0.00 H new ATOM 0 HE1 PHE A 89 23.697 -14.533 -0.526 1.00 0.00 H new ATOM 0 HE2 PHE A 89 21.650 -11.163 -2.147 1.00 0.00 H new ATOM 0 HZ PHE A 89 23.489 -12.095 -0.799 1.00 0.00 H new ATOM 1476 N LEU A 90 17.553 -13.649 -2.454 1.00 0.00 N ATOM 1477 CA LEU A 90 16.936 -12.407 -2.001 1.00 0.00 C ATOM 1478 C LEU A 90 15.746 -12.691 -1.089 1.00 0.00 C ATOM 1479 O LEU A 90 15.491 -11.952 -0.138 1.00 0.00 O ATOM 1480 CB LEU A 90 16.486 -11.572 -3.201 1.00 0.00 C ATOM 1481 CG LEU A 90 15.457 -12.224 -4.125 1.00 0.00 C ATOM 1482 CD1 LEU A 90 14.045 -11.950 -3.630 1.00 0.00 C ATOM 1483 CD2 LEU A 90 15.629 -11.725 -5.552 1.00 0.00 C ATOM 0 H LEU A 90 17.476 -13.817 -3.457 1.00 0.00 H new ATOM 0 HA LEU A 90 17.679 -11.846 -1.434 1.00 0.00 H new ATOM 0 HB2 LEU A 90 16.070 -10.635 -2.831 1.00 0.00 H new ATOM 0 HB3 LEU A 90 17.366 -11.318 -3.792 1.00 0.00 H new ATOM 0 HG LEU A 90 15.621 -13.302 -4.116 1.00 0.00 H new ATOM 0 HD11 LEU A 90 13.327 -12.422 -4.300 1.00 0.00 H new ATOM 0 HD12 LEU A 90 13.926 -12.357 -2.626 1.00 0.00 H new ATOM 0 HD13 LEU A 90 13.869 -10.874 -3.609 1.00 0.00 H new ATOM 0 HD21 LEU A 90 14.888 -12.200 -6.195 1.00 0.00 H new ATOM 0 HD22 LEU A 90 15.493 -10.644 -5.578 1.00 0.00 H new ATOM 0 HD23 LEU A 90 16.629 -11.973 -5.906 1.00 0.00 H new ATOM 1495 N SER A 91 15.023 -13.766 -1.385 1.00 0.00 N ATOM 1496 CA SER A 91 13.860 -14.147 -0.593 1.00 0.00 C ATOM 1497 C SER A 91 14.219 -14.245 0.886 1.00 0.00 C ATOM 1498 O SER A 91 13.416 -13.904 1.755 1.00 0.00 O ATOM 1499 CB SER A 91 13.297 -15.482 -1.083 1.00 0.00 C ATOM 1500 OG SER A 91 12.630 -16.169 -0.039 1.00 0.00 O ATOM 0 H SER A 91 15.222 -14.389 -2.168 1.00 0.00 H new ATOM 0 HA SER A 91 13.100 -13.375 -0.714 1.00 0.00 H new ATOM 0 HB2 SER A 91 12.606 -15.308 -1.907 1.00 0.00 H new ATOM 0 HB3 SER A 91 14.106 -16.101 -1.471 1.00 0.00 H new ATOM 0 HG SER A 91 12.278 -17.018 -0.379 1.00 0.00 H new ATOM 1506 N SER A 92 15.430 -14.715 1.165 1.00 0.00 N ATOM 1507 CA SER A 92 15.896 -14.863 2.539 1.00 0.00 C ATOM 1508 C SER A 92 16.105 -13.500 3.191 1.00 0.00 C ATOM 1509 O SER A 92 15.926 -13.343 4.399 1.00 0.00 O ATOM 1510 CB SER A 92 17.198 -15.664 2.575 1.00 0.00 C ATOM 1511 OG SER A 92 17.397 -16.258 3.846 1.00 0.00 O ATOM 0 H SER A 92 16.107 -15.000 0.457 1.00 0.00 H new ATOM 0 HA SER A 92 15.132 -15.401 3.100 1.00 0.00 H new ATOM 0 HB2 SER A 92 17.173 -16.438 1.808 1.00 0.00 H new ATOM 0 HB3 SER A 92 18.038 -15.010 2.341 1.00 0.00 H new ATOM 0 HG SER A 92 18.235 -16.766 3.842 1.00 0.00 H new