USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 988 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 128 CYS SG : rot -79:sc= -0.592 USER MOD Set 1.2: A 129 GLN : amide:sc= -5.12! C(o=-5.7!,f=-9.8!) USER MOD Set 2.1: A 19 CYS SG : rot 35:sc= -1.15! USER MOD Set 2.2: A 106 TYR OH : rot 174:sc= 0.484 USER MOD Set 3.1: A 86 ASN :FLIP amide:sc= -5.44! C(o=-15!,f=-5.4!) USER MOD Set 3.2: A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot -100:sc= -13.2! USER MOD Single : A 35 GLN : amide:sc= -0.0662 K(o=-0.066,f=-1.3!) USER MOD Single : A 37 SER OG : rot 180:sc= -0.0384 USER MOD Single : A 42 HIS :FLIP no HE2:sc= -1.08 F(o=-4!,f=-1.1) USER MOD Single : A 44 THR OG1 : rot 180:sc=-0.00118 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 HIS :FLIP no HD1:sc= -2.78! C(o=-8.6!,f=-2.8!) USER MOD Single : A 59 THR OG1 : rot -70:sc= -2.67! USER MOD Single : A 64 THR OG1 : rot 64:sc= -5.11! USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 74 GLN : amide:sc= -6.3! C(o=-6.3!,f=-9.8!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot -163:sc= 1.41 USER MOD Single : A 104 LYS NZ :NH3+ 150:sc= -0.0803 (180deg=-0.527) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 HIS :FLIP no HD1:sc= -2.52! C(o=-4.1!,f=-2.5!) USER MOD Single : A 116 HIS : no HD1:sc= -1.96 X(o=-2,f=-2.3!) USER MOD Single : A 117 GLN : amide:sc= -0.169 X(o=-0.17,f=-0.29) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=-0.0099) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 MET CE :methyl 156:sc= -4.86! (180deg=-7.33!) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 GLN :FLIP amide:sc= 0 F(o=-1.3!,f=0) USER MOD Single : A 144 HIS : no HE2:sc= -13.6! C(o=-14!,f=-19!) USER MOD Single : A 145 GLN : amide:sc= -0.0296 X(o=-0.03,f=-0.051) USER MOD Single : A 148 CYS SG : rot 76:sc= 0.0322 USER MOD Single : A 149 SER OG : rot 73:sc= 0.426 USER MOD ----------------------------------------------------------------- ATOM 105 N ARG A 9 12.314 -3.508 -7.104 1.00 0.00 N ATOM 106 CA ARG A 9 11.431 -2.387 -7.500 1.00 0.00 C ATOM 107 C ARG A 9 10.386 -2.936 -8.471 1.00 0.00 C ATOM 108 O ARG A 9 10.708 -3.434 -9.532 1.00 0.00 O ATOM 109 CB ARG A 9 12.261 -1.277 -8.161 1.00 0.00 C ATOM 110 CG ARG A 9 12.123 -1.342 -9.683 1.00 0.00 C ATOM 111 CD ARG A 9 12.971 -0.237 -10.317 1.00 0.00 C ATOM 112 NE ARG A 9 14.413 -0.550 -10.121 1.00 0.00 N ATOM 113 CZ ARG A 9 15.023 -1.354 -10.948 1.00 0.00 C ATOM 114 NH1 ARG A 9 14.367 -1.888 -11.943 1.00 0.00 N ATOM 115 NH2 ARG A 9 16.288 -1.628 -10.776 1.00 0.00 N ATOM 0 HA ARG A 9 10.936 -1.958 -6.629 1.00 0.00 H new ATOM 0 HB2 ARG A 9 11.930 -0.303 -7.801 1.00 0.00 H new ATOM 0 HB3 ARG A 9 13.309 -1.381 -7.880 1.00 0.00 H new ATOM 0 HG2 ARG A 9 12.445 -2.317 -10.047 1.00 0.00 H new ATOM 0 HG3 ARG A 9 11.078 -1.224 -9.970 1.00 0.00 H new ATOM 0 HD2 ARG A 9 12.746 -0.155 -11.380 1.00 0.00 H new ATOM 0 HD3 ARG A 9 12.731 0.726 -9.865 1.00 0.00 H new ATOM 0 HE ARG A 9 14.924 -0.136 -9.341 1.00 0.00 H new ATOM 0 HH11 ARG A 9 13.378 -1.677 -12.074 1.00 0.00 H new ATOM 0 HH12 ARG A 9 14.844 -2.516 -12.589 1.00 0.00 H new ATOM 0 HH21 ARG A 9 16.798 -1.214 -9.996 1.00 0.00 H new ATOM 0 HH22 ARG A 9 16.766 -2.256 -11.422 1.00 0.00 H new ATOM 129 N ALA A 10 9.141 -2.859 -8.116 1.00 0.00 N ATOM 130 CA ALA A 10 8.085 -3.385 -9.018 1.00 0.00 C ATOM 131 C ALA A 10 7.357 -2.203 -9.645 1.00 0.00 C ATOM 132 O ALA A 10 7.512 -1.078 -9.224 1.00 0.00 O ATOM 133 CB ALA A 10 7.094 -4.235 -8.216 1.00 0.00 C ATOM 0 H ALA A 10 8.807 -2.455 -7.241 1.00 0.00 H new ATOM 0 HA ALA A 10 8.532 -4.006 -9.794 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.321 -4.619 -8.882 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.621 -5.069 -7.754 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.633 -3.623 -7.441 1.00 0.00 H new ATOM 139 N CYS A 11 6.580 -2.436 -10.655 1.00 0.00 N ATOM 140 CA CYS A 11 5.862 -1.306 -11.294 1.00 0.00 C ATOM 141 C CYS A 11 4.416 -1.717 -11.552 1.00 0.00 C ATOM 142 O CYS A 11 4.147 -2.721 -12.179 1.00 0.00 O ATOM 143 CB CYS A 11 6.561 -0.953 -12.602 1.00 0.00 C ATOM 144 SG CYS A 11 8.118 -1.870 -12.705 1.00 0.00 S ATOM 0 H CYS A 11 6.410 -3.354 -11.066 1.00 0.00 H new ATOM 0 HA CYS A 11 5.868 -0.432 -10.642 1.00 0.00 H new ATOM 0 HB2 CYS A 11 5.922 -1.201 -13.449 1.00 0.00 H new ATOM 0 HB3 CYS A 11 6.752 0.119 -12.649 1.00 0.00 H new ATOM 0 HG CYS A 11 9.103 -1.091 -12.370 1.00 0.00 H new ATOM 150 N GLY A 12 3.482 -0.957 -11.057 1.00 0.00 N ATOM 151 CA GLY A 12 2.056 -1.315 -11.260 1.00 0.00 C ATOM 152 C GLY A 12 1.461 -0.480 -12.378 1.00 0.00 C ATOM 153 O GLY A 12 2.037 0.495 -12.819 1.00 0.00 O ATOM 0 H GLY A 12 3.646 -0.105 -10.521 1.00 0.00 H new ATOM 0 HA2 GLY A 12 1.970 -2.374 -11.502 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.498 -1.152 -10.338 1.00 0.00 H new ATOM 157 N LEU A 13 0.302 -0.854 -12.836 1.00 0.00 N ATOM 158 CA LEU A 13 -0.334 -0.077 -13.926 1.00 0.00 C ATOM 159 C LEU A 13 -1.714 0.384 -13.458 1.00 0.00 C ATOM 160 O LEU A 13 -2.604 -0.417 -13.250 1.00 0.00 O ATOM 161 CB LEU A 13 -0.492 -0.978 -15.165 1.00 0.00 C ATOM 162 CG LEU A 13 -0.160 -0.235 -16.480 1.00 0.00 C ATOM 163 CD1 LEU A 13 -1.167 -0.623 -17.562 1.00 0.00 C ATOM 164 CD2 LEU A 13 -0.212 1.281 -16.300 1.00 0.00 C ATOM 0 H LEU A 13 -0.228 -1.660 -12.504 1.00 0.00 H new ATOM 0 HA LEU A 13 0.282 0.786 -14.179 1.00 0.00 H new ATOM 0 HB2 LEU A 13 0.161 -1.845 -15.066 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.515 -1.353 -15.211 1.00 0.00 H new ATOM 0 HG LEU A 13 0.851 -0.522 -16.770 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -0.929 -0.097 -18.486 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.120 -1.698 -17.734 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -2.172 -0.351 -17.238 1.00 0.00 H new ATOM 0 HD21 LEU A 13 0.027 1.768 -17.245 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -1.212 1.576 -15.983 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.512 1.583 -15.543 1.00 0.00 H new ATOM 176 N ILE A 14 -1.911 1.663 -13.299 1.00 0.00 N ATOM 177 CA ILE A 14 -3.248 2.143 -12.857 1.00 0.00 C ATOM 178 C ILE A 14 -4.211 2.039 -14.039 1.00 0.00 C ATOM 179 O ILE A 14 -4.140 2.811 -14.974 1.00 0.00 O ATOM 180 CB ILE A 14 -3.151 3.609 -12.407 1.00 0.00 C ATOM 181 CG1 ILE A 14 -2.189 3.728 -11.221 1.00 0.00 C ATOM 182 CG2 ILE A 14 -4.535 4.128 -12.012 1.00 0.00 C ATOM 183 CD1 ILE A 14 -2.848 3.195 -9.944 1.00 0.00 C ATOM 0 H ILE A 14 -1.212 2.389 -13.454 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.604 1.539 -12.023 1.00 0.00 H new ATOM 0 HB ILE A 14 -2.771 4.209 -13.234 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.276 3.169 -11.427 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.900 4.770 -11.082 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -4.457 5.168 -11.694 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.207 4.060 -12.867 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -4.929 3.527 -11.192 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.152 3.286 -9.110 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.748 3.772 -9.731 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -3.114 2.147 -10.082 1.00 0.00 H new ATOM 195 N ILE A 15 -5.113 1.097 -14.009 1.00 0.00 N ATOM 196 CA ILE A 15 -6.071 0.973 -15.139 1.00 0.00 C ATOM 197 C ILE A 15 -7.391 1.620 -14.768 1.00 0.00 C ATOM 198 O ILE A 15 -7.896 1.458 -13.675 1.00 0.00 O ATOM 199 CB ILE A 15 -6.356 -0.487 -15.477 1.00 0.00 C ATOM 200 CG1 ILE A 15 -5.119 -1.139 -16.100 1.00 0.00 C ATOM 201 CG2 ILE A 15 -7.529 -0.527 -16.460 1.00 0.00 C ATOM 202 CD1 ILE A 15 -5.447 -2.583 -16.496 1.00 0.00 C ATOM 0 H ILE A 15 -5.227 0.415 -13.259 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.617 1.464 -16.000 1.00 0.00 H new ATOM 0 HB ILE A 15 -6.606 -1.040 -14.571 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.799 -0.574 -16.976 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.291 -1.124 -15.391 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.753 -1.562 -16.718 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -8.405 -0.070 -16.000 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -7.266 0.023 -17.363 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.566 -3.048 -16.940 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -5.746 -3.144 -15.611 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -6.262 -2.586 -17.220 1.00 0.00 H new ATOM 214 N PHE A 16 -7.964 2.334 -15.683 1.00 0.00 N ATOM 215 CA PHE A 16 -9.267 2.976 -15.410 1.00 0.00 C ATOM 216 C PHE A 16 -9.992 3.191 -16.733 1.00 0.00 C ATOM 217 O PHE A 16 -9.382 3.249 -17.780 1.00 0.00 O ATOM 218 CB PHE A 16 -9.046 4.326 -14.735 1.00 0.00 C ATOM 219 CG PHE A 16 -8.465 5.286 -15.738 1.00 0.00 C ATOM 220 CD1 PHE A 16 -9.314 5.997 -16.592 1.00 0.00 C ATOM 221 CD2 PHE A 16 -7.081 5.468 -15.812 1.00 0.00 C ATOM 222 CE1 PHE A 16 -8.779 6.892 -17.523 1.00 0.00 C ATOM 223 CE2 PHE A 16 -6.546 6.362 -16.741 1.00 0.00 C ATOM 224 CZ PHE A 16 -7.396 7.075 -17.599 1.00 0.00 C ATOM 0 H PHE A 16 -7.584 2.502 -16.614 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.860 2.339 -14.753 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -9.989 4.712 -14.347 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -8.373 4.216 -13.885 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -10.383 5.855 -16.532 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.427 4.918 -15.152 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.434 7.441 -18.183 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.477 6.505 -16.799 1.00 0.00 H new ATOM 0 HZ PHE A 16 -6.981 7.766 -18.318 1.00 0.00 H new ATOM 234 N ARG A 17 -11.282 3.326 -16.696 1.00 0.00 N ATOM 235 CA ARG A 17 -12.036 3.560 -17.955 1.00 0.00 C ATOM 236 C ARG A 17 -13.004 4.714 -17.724 1.00 0.00 C ATOM 237 O ARG A 17 -13.745 4.727 -16.761 1.00 0.00 O ATOM 238 CB ARG A 17 -12.822 2.300 -18.334 1.00 0.00 C ATOM 239 CG ARG A 17 -14.038 2.152 -17.421 1.00 0.00 C ATOM 240 CD ARG A 17 -14.668 0.777 -17.639 1.00 0.00 C ATOM 241 NE ARG A 17 -15.927 0.681 -16.852 1.00 0.00 N ATOM 242 CZ ARG A 17 -16.774 -0.280 -17.090 1.00 0.00 C ATOM 243 NH1 ARG A 17 -16.515 -1.162 -18.015 1.00 0.00 N ATOM 244 NH2 ARG A 17 -17.876 -0.358 -16.401 1.00 0.00 N ATOM 0 H ARG A 17 -11.849 3.285 -15.849 1.00 0.00 H new ATOM 0 HA ARG A 17 -11.346 3.799 -18.764 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -13.142 2.360 -19.374 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -12.182 1.422 -18.247 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -13.741 2.268 -16.379 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -14.765 2.936 -17.634 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -14.875 0.623 -18.698 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -13.974 -0.006 -17.333 1.00 0.00 H new ATOM 0 HE ARG A 17 -16.127 1.368 -16.125 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -15.650 -1.099 -18.552 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -17.178 -1.915 -18.202 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -18.075 0.332 -15.677 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -18.541 -1.109 -16.585 1.00 0.00 H new ATOM 258 N ARG A 18 -13.005 5.689 -18.585 1.00 0.00 N ATOM 259 CA ARG A 18 -13.932 6.832 -18.383 1.00 0.00 C ATOM 260 C ARG A 18 -15.172 6.648 -19.252 1.00 0.00 C ATOM 261 O ARG A 18 -15.083 6.356 -20.429 1.00 0.00 O ATOM 262 CB ARG A 18 -13.225 8.142 -18.728 1.00 0.00 C ATOM 263 CG ARG A 18 -12.780 8.132 -20.185 1.00 0.00 C ATOM 264 CD ARG A 18 -11.650 9.144 -20.362 1.00 0.00 C ATOM 265 NE ARG A 18 -11.622 9.618 -21.774 1.00 0.00 N ATOM 266 CZ ARG A 18 -12.425 10.574 -22.151 1.00 0.00 C ATOM 267 NH1 ARG A 18 -13.251 11.105 -21.290 1.00 0.00 N ATOM 268 NH2 ARG A 18 -12.403 11.000 -23.385 1.00 0.00 N ATOM 0 H ARG A 18 -12.410 5.745 -19.412 1.00 0.00 H new ATOM 0 HA ARG A 18 -14.239 6.869 -17.338 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -13.895 8.983 -18.551 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -12.361 8.280 -18.077 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.442 7.136 -20.469 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -13.617 8.383 -20.837 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -11.794 9.988 -19.687 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -10.695 8.688 -20.102 1.00 0.00 H new ATOM 0 HE ARG A 18 -10.978 9.197 -22.443 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -13.267 10.772 -20.326 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -13.880 11.853 -21.581 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -11.757 10.585 -24.056 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -13.032 11.748 -23.678 1.00 0.00 H new ATOM 282 N CYS A 19 -16.332 6.803 -18.674 1.00 0.00 N ATOM 283 CA CYS A 19 -17.582 6.624 -19.459 1.00 0.00 C ATOM 284 C CYS A 19 -17.985 7.951 -20.093 1.00 0.00 C ATOM 285 O CYS A 19 -17.331 8.960 -19.929 1.00 0.00 O ATOM 286 CB CYS A 19 -18.710 6.151 -18.542 1.00 0.00 C ATOM 287 SG CYS A 19 -18.014 5.223 -17.155 1.00 0.00 S ATOM 0 H CYS A 19 -16.466 7.046 -17.692 1.00 0.00 H new ATOM 0 HA CYS A 19 -17.406 5.880 -20.236 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -19.276 7.007 -18.173 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -19.407 5.525 -19.099 1.00 0.00 H new ATOM 0 HG CYS A 19 -16.873 5.743 -16.814 1.00 0.00 H new ATOM 424 N ALA A 28 -18.052 8.659 -14.257 1.00 0.00 N ATOM 425 CA ALA A 28 -17.610 8.271 -15.623 1.00 0.00 C ATOM 426 C ALA A 28 -16.278 7.523 -15.540 1.00 0.00 C ATOM 427 O ALA A 28 -15.987 6.672 -16.355 1.00 0.00 O ATOM 428 CB ALA A 28 -17.435 9.526 -16.482 1.00 0.00 C ATOM 0 HA ALA A 28 -18.362 7.624 -16.073 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.111 9.240 -17.483 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.384 10.058 -16.546 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -16.685 10.175 -16.030 1.00 0.00 H new ATOM 434 N ILE A 29 -15.463 7.841 -14.568 1.00 0.00 N ATOM 435 CA ILE A 29 -14.140 7.159 -14.445 1.00 0.00 C ATOM 436 C ILE A 29 -14.177 6.114 -13.334 1.00 0.00 C ATOM 437 O ILE A 29 -14.712 6.337 -12.267 1.00 0.00 O ATOM 438 CB ILE A 29 -13.060 8.198 -14.136 1.00 0.00 C ATOM 439 CG1 ILE A 29 -13.085 9.282 -15.223 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.689 7.517 -14.098 1.00 0.00 C ATOM 441 CD1 ILE A 29 -11.667 9.563 -15.733 1.00 0.00 C ATOM 0 H ILE A 29 -15.656 8.543 -13.854 1.00 0.00 H new ATOM 0 HA ILE A 29 -13.913 6.659 -15.386 1.00 0.00 H new ATOM 0 HB ILE A 29 -13.250 8.656 -13.165 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.719 8.962 -16.050 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.522 10.197 -14.823 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -10.921 8.258 -13.878 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.685 6.750 -13.324 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -11.484 7.058 -15.065 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.703 10.334 -16.503 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -11.044 9.905 -14.906 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.244 8.650 -16.153 1.00 0.00 H new ATOM 453 N GLU A 30 -13.607 4.965 -13.589 1.00 0.00 N ATOM 454 CA GLU A 30 -13.597 3.884 -12.567 1.00 0.00 C ATOM 455 C GLU A 30 -12.219 3.215 -12.538 1.00 0.00 C ATOM 456 O GLU A 30 -11.478 3.269 -13.499 1.00 0.00 O ATOM 457 CB GLU A 30 -14.657 2.843 -12.933 1.00 0.00 C ATOM 458 CG GLU A 30 -16.036 3.502 -12.962 1.00 0.00 C ATOM 459 CD GLU A 30 -17.098 2.444 -13.269 1.00 0.00 C ATOM 460 OE1 GLU A 30 -18.270 2.755 -13.141 1.00 0.00 O ATOM 461 OE2 GLU A 30 -16.719 1.342 -13.629 1.00 0.00 O ATOM 0 H GLU A 30 -13.146 4.731 -14.468 1.00 0.00 H new ATOM 0 HA GLU A 30 -13.813 4.306 -11.586 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -14.431 2.406 -13.906 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.647 2.029 -12.208 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -16.245 3.976 -12.003 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -16.060 4.287 -13.717 1.00 0.00 H new ATOM 469 N PHE A 31 -11.877 2.570 -11.453 1.00 0.00 N ATOM 470 CA PHE A 31 -10.555 1.887 -11.380 1.00 0.00 C ATOM 471 C PHE A 31 -10.768 0.377 -11.384 1.00 0.00 C ATOM 472 O PHE A 31 -11.701 -0.133 -10.799 1.00 0.00 O ATOM 473 CB PHE A 31 -9.825 2.256 -10.089 1.00 0.00 C ATOM 474 CG PHE A 31 -9.483 3.720 -10.073 1.00 0.00 C ATOM 475 CD1 PHE A 31 -8.602 4.250 -11.024 1.00 0.00 C ATOM 476 CD2 PHE A 31 -10.036 4.548 -9.095 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.277 5.614 -10.992 1.00 0.00 C ATOM 478 CE2 PHE A 31 -9.711 5.907 -9.061 1.00 0.00 C ATOM 479 CZ PHE A 31 -8.833 6.442 -10.008 1.00 0.00 C ATOM 0 H PHE A 31 -12.456 2.488 -10.617 1.00 0.00 H new ATOM 0 HA PHE A 31 -9.961 2.201 -12.238 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.450 2.014 -9.230 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -8.915 1.664 -9.998 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -8.174 3.609 -11.781 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -10.716 4.138 -8.363 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -7.599 6.026 -11.725 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -10.139 6.545 -8.302 1.00 0.00 H new ATOM 0 HZ PHE A 31 -8.583 7.492 -9.981 1.00 0.00 H new ATOM 489 N LEU A 32 -9.898 -0.339 -12.031 1.00 0.00 N ATOM 490 CA LEU A 32 -10.032 -1.815 -12.069 1.00 0.00 C ATOM 491 C LEU A 32 -8.917 -2.434 -11.207 1.00 0.00 C ATOM 492 O LEU A 32 -7.754 -2.416 -11.558 1.00 0.00 O ATOM 493 CB LEU A 32 -9.975 -2.254 -13.546 1.00 0.00 C ATOM 494 CG LEU A 32 -9.251 -3.591 -13.739 1.00 0.00 C ATOM 495 CD1 LEU A 32 -10.244 -4.740 -13.613 1.00 0.00 C ATOM 496 CD2 LEU A 32 -8.651 -3.622 -15.141 1.00 0.00 C ATOM 0 H LEU A 32 -9.096 0.037 -12.537 1.00 0.00 H new ATOM 0 HA LEU A 32 -10.980 -2.159 -11.655 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.990 -2.336 -13.936 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -9.470 -1.485 -14.130 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.473 -3.695 -12.983 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.723 -5.688 -13.751 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.702 -4.718 -12.624 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.018 -4.637 -14.374 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.132 -4.568 -15.294 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.446 -3.521 -15.879 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.945 -2.799 -15.253 1.00 0.00 H new ATOM 508 N LEU A 33 -9.279 -2.969 -10.065 1.00 0.00 N ATOM 509 CA LEU A 33 -8.270 -3.585 -9.144 1.00 0.00 C ATOM 510 C LEU A 33 -8.402 -5.105 -9.202 1.00 0.00 C ATOM 511 O LEU A 33 -9.382 -5.628 -9.693 1.00 0.00 O ATOM 512 CB LEU A 33 -8.533 -3.139 -7.701 1.00 0.00 C ATOM 513 CG LEU A 33 -8.249 -1.643 -7.534 1.00 0.00 C ATOM 514 CD1 LEU A 33 -8.915 -1.142 -6.248 1.00 0.00 C ATOM 515 CD2 LEU A 33 -6.739 -1.416 -7.426 1.00 0.00 C ATOM 0 H LEU A 33 -10.241 -3.006 -9.728 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.273 -3.271 -9.453 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.569 -3.349 -7.434 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.905 -3.711 -7.018 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.643 -1.104 -8.395 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.715 -0.078 -6.126 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -9.991 -1.305 -6.308 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -8.513 -1.687 -5.394 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.539 -0.351 -7.307 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.351 -1.957 -6.563 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.251 -1.778 -8.331 1.00 0.00 H new ATOM 527 N LEU A 34 -7.427 -5.821 -8.706 1.00 0.00 N ATOM 528 CA LEU A 34 -7.517 -7.309 -8.735 1.00 0.00 C ATOM 529 C LEU A 34 -7.341 -7.881 -7.327 1.00 0.00 C ATOM 530 O LEU A 34 -6.450 -7.493 -6.599 1.00 0.00 O ATOM 531 CB LEU A 34 -6.419 -7.880 -9.638 1.00 0.00 C ATOM 532 CG LEU A 34 -6.441 -7.206 -11.012 1.00 0.00 C ATOM 533 CD1 LEU A 34 -5.488 -7.947 -11.949 1.00 0.00 C ATOM 534 CD2 LEU A 34 -7.847 -7.249 -11.607 1.00 0.00 C ATOM 0 H LEU A 34 -6.578 -5.442 -8.285 1.00 0.00 H new ATOM 0 HA LEU A 34 -8.498 -7.586 -9.120 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.445 -7.733 -9.171 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.559 -8.955 -9.753 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.133 -6.167 -10.898 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -5.499 -7.472 -12.930 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.478 -7.914 -11.541 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.806 -8.985 -12.045 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.844 -6.765 -12.584 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -8.164 -8.286 -11.717 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -8.538 -6.726 -10.946 1.00 0.00 H new ATOM 546 N GLN A 35 -8.161 -8.828 -6.946 1.00 0.00 N ATOM 547 CA GLN A 35 -7.999 -9.440 -5.598 1.00 0.00 C ATOM 548 C GLN A 35 -7.247 -10.755 -5.773 1.00 0.00 C ATOM 549 O GLN A 35 -7.807 -11.745 -6.198 1.00 0.00 O ATOM 550 CB GLN A 35 -9.361 -9.727 -4.965 1.00 0.00 C ATOM 551 CG GLN A 35 -9.209 -9.807 -3.443 1.00 0.00 C ATOM 552 CD GLN A 35 -10.566 -10.106 -2.804 1.00 0.00 C ATOM 553 OE1 GLN A 35 -11.587 -10.062 -3.462 1.00 0.00 O ATOM 554 NE2 GLN A 35 -10.620 -10.411 -1.538 1.00 0.00 N ATOM 0 H GLN A 35 -8.928 -9.199 -7.506 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.456 -8.754 -4.948 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -10.070 -8.942 -5.230 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -9.763 -10.664 -5.351 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -8.493 -10.586 -3.180 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -8.814 -8.867 -3.057 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -9.763 -10.448 -0.985 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -11.519 -10.613 -1.100 1.00 0.00 H new ATOM 563 N ALA A 36 -5.983 -10.781 -5.468 1.00 0.00 N ATOM 564 CA ALA A 36 -5.218 -12.043 -5.639 1.00 0.00 C ATOM 565 C ALA A 36 -5.836 -13.128 -4.760 1.00 0.00 C ATOM 566 O ALA A 36 -6.101 -12.916 -3.597 1.00 0.00 O ATOM 567 CB ALA A 36 -3.762 -11.812 -5.240 1.00 0.00 C ATOM 0 H ALA A 36 -5.449 -9.989 -5.110 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.255 -12.361 -6.681 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.199 -12.737 -5.365 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.330 -11.036 -5.872 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.716 -11.497 -4.197 1.00 0.00 H new ATOM 573 N SER A 37 -6.069 -14.291 -5.303 1.00 0.00 N ATOM 574 CA SER A 37 -6.676 -15.377 -4.482 1.00 0.00 C ATOM 575 C SER A 37 -5.567 -16.132 -3.755 1.00 0.00 C ATOM 576 O SER A 37 -5.814 -16.918 -2.862 1.00 0.00 O ATOM 577 CB SER A 37 -7.444 -16.338 -5.391 1.00 0.00 C ATOM 578 OG SER A 37 -7.428 -17.640 -4.823 1.00 0.00 O ATOM 0 H SER A 37 -5.867 -14.536 -6.272 1.00 0.00 H new ATOM 0 HA SER A 37 -7.364 -14.947 -3.754 1.00 0.00 H new ATOM 0 HB2 SER A 37 -8.472 -15.996 -5.515 1.00 0.00 H new ATOM 0 HB3 SER A 37 -6.993 -16.357 -6.383 1.00 0.00 H new ATOM 0 HG SER A 37 -7.921 -18.256 -5.404 1.00 0.00 H new ATOM 641 N HIS A 42 -5.957 -9.724 -1.062 1.00 0.00 N ATOM 642 CA HIS A 42 -5.856 -8.240 -0.974 1.00 0.00 C ATOM 643 C HIS A 42 -6.247 -7.632 -2.319 1.00 0.00 C ATOM 644 O HIS A 42 -6.258 -8.305 -3.327 1.00 0.00 O ATOM 645 CB HIS A 42 -4.410 -7.848 -0.644 1.00 0.00 C ATOM 646 CG HIS A 42 -3.465 -8.444 -1.661 1.00 0.00 C ATOM 647 ND1 HIS A 42 -3.467 -8.449 -3.038 1.00 0.00 N flip ATOM 648 CD2 HIS A 42 -2.326 -9.149 -1.288 1.00 0.00 C flip ATOM 649 CE1 HIS A 42 -2.355 -9.143 -3.501 1.00 0.00 C flip ATOM 650 NE2 HIS A 42 -1.702 -9.544 -2.412 1.00 0.00 N flip ATOM 0 HA HIS A 42 -6.522 -7.872 -0.194 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -4.312 -6.762 -0.637 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -4.149 -8.198 0.355 1.00 0.00 H new ATOM 0 HD1 HIS A 42 -4.175 -8.011 -3.627 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -2.001 -9.344 -0.277 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -2.078 -9.320 -4.530 1.00 0.00 H new ATOM 659 N TRP A 43 -6.558 -6.365 -2.351 1.00 0.00 N ATOM 660 CA TRP A 43 -6.934 -5.722 -3.643 1.00 0.00 C ATOM 661 C TRP A 43 -5.791 -4.826 -4.117 1.00 0.00 C ATOM 662 O TRP A 43 -5.216 -4.081 -3.352 1.00 0.00 O ATOM 663 CB TRP A 43 -8.178 -4.860 -3.452 1.00 0.00 C ATOM 664 CG TRP A 43 -9.410 -5.698 -3.542 1.00 0.00 C ATOM 665 CD1 TRP A 43 -10.170 -6.079 -2.491 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.047 -6.249 -4.726 1.00 0.00 C ATOM 667 NE1 TRP A 43 -11.238 -6.823 -2.956 1.00 0.00 N ATOM 668 CE2 TRP A 43 -11.203 -6.962 -4.327 1.00 0.00 C ATOM 669 CE3 TRP A 43 -9.738 -6.204 -6.096 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.023 -7.603 -5.255 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -10.557 -6.850 -7.030 1.00 0.00 C ATOM 672 CH2 TRP A 43 -11.697 -7.552 -6.610 1.00 0.00 C ATOM 0 H TRP A 43 -6.568 -5.747 -1.539 1.00 0.00 H new ATOM 0 HA TRP A 43 -7.134 -6.501 -4.379 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.139 -4.363 -2.483 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -8.206 -4.078 -4.211 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -9.974 -5.841 -1.456 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -11.963 -7.220 -2.358 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -8.863 -5.667 -6.431 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -12.904 -8.135 -4.927 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.310 -6.808 -8.080 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -12.321 -8.052 -7.335 1.00 0.00 H new ATOM 683 N THR A 44 -5.465 -4.888 -5.374 1.00 0.00 N ATOM 684 CA THR A 44 -4.367 -4.033 -5.905 1.00 0.00 C ATOM 685 C THR A 44 -4.402 -4.066 -7.431 1.00 0.00 C ATOM 686 O THR A 44 -4.862 -5.019 -8.026 1.00 0.00 O ATOM 687 CB THR A 44 -3.012 -4.555 -5.410 1.00 0.00 C ATOM 688 OG1 THR A 44 -2.101 -4.605 -6.499 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.175 -5.957 -4.822 1.00 0.00 C ATOM 0 H THR A 44 -5.912 -5.495 -6.061 1.00 0.00 H new ATOM 0 HA THR A 44 -4.502 -3.010 -5.555 1.00 0.00 H new ATOM 0 HB THR A 44 -2.631 -3.886 -4.639 1.00 0.00 H new ATOM 0 HG1 THR A 44 -1.234 -4.937 -6.185 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.208 -6.320 -4.473 1.00 0.00 H new ATOM 0 HG22 THR A 44 -3.873 -5.922 -3.985 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.560 -6.630 -5.588 1.00 0.00 H new ATOM 697 N PRO A 45 -3.916 -3.034 -8.059 1.00 0.00 N ATOM 698 CA PRO A 45 -3.879 -2.936 -9.542 1.00 0.00 C ATOM 699 C PRO A 45 -2.875 -3.912 -10.142 1.00 0.00 C ATOM 700 O PRO A 45 -1.962 -4.363 -9.477 1.00 0.00 O ATOM 701 CB PRO A 45 -3.435 -1.497 -9.804 1.00 0.00 C ATOM 702 CG PRO A 45 -2.672 -1.107 -8.585 1.00 0.00 C ATOM 703 CD PRO A 45 -3.341 -1.840 -7.423 1.00 0.00 C ATOM 0 HA PRO A 45 -4.841 -3.180 -9.992 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -2.814 -1.431 -10.697 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.291 -0.841 -9.962 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -1.623 -1.389 -8.673 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -2.700 -0.028 -8.435 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -2.622 -2.105 -6.648 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -4.109 -1.227 -6.950 1.00 0.00 H new ATOM 711 N PRO A 46 -3.039 -4.232 -11.388 1.00 0.00 N ATOM 712 CA PRO A 46 -2.126 -5.167 -12.087 1.00 0.00 C ATOM 713 C PRO A 46 -0.660 -4.763 -11.879 1.00 0.00 C ATOM 714 O PRO A 46 -0.128 -3.946 -12.602 1.00 0.00 O ATOM 715 CB PRO A 46 -2.497 -5.045 -13.565 1.00 0.00 C ATOM 716 CG PRO A 46 -3.692 -4.143 -13.662 1.00 0.00 C ATOM 717 CD PRO A 46 -4.111 -3.735 -12.252 1.00 0.00 C ATOM 0 HA PRO A 46 -2.227 -6.185 -11.711 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -1.663 -4.638 -14.136 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -2.723 -6.025 -13.985 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -3.453 -3.261 -14.256 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -4.512 -4.654 -14.167 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -4.218 -2.654 -12.168 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.072 -4.173 -11.982 1.00 0.00 H new ATOM 725 N LYS A 47 -0.006 -5.314 -10.890 1.00 0.00 N ATOM 726 CA LYS A 47 1.418 -4.936 -10.639 1.00 0.00 C ATOM 727 C LYS A 47 2.295 -6.187 -10.556 1.00 0.00 C ATOM 728 O LYS A 47 1.881 -7.221 -10.077 1.00 0.00 O ATOM 729 CB LYS A 47 1.502 -4.150 -9.322 1.00 0.00 C ATOM 730 CG LYS A 47 2.494 -4.813 -8.359 1.00 0.00 C ATOM 731 CD LYS A 47 2.114 -4.498 -6.915 1.00 0.00 C ATOM 732 CE LYS A 47 2.752 -5.533 -5.986 1.00 0.00 C ATOM 733 NZ LYS A 47 1.739 -5.993 -4.997 1.00 0.00 N ATOM 0 H LYS A 47 -0.393 -6.006 -10.248 1.00 0.00 H new ATOM 0 HA LYS A 47 1.777 -4.318 -11.462 1.00 0.00 H new ATOM 0 HB2 LYS A 47 1.813 -3.125 -9.523 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.516 -4.099 -8.859 1.00 0.00 H new ATOM 0 HG2 LYS A 47 2.498 -5.892 -8.515 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.504 -4.457 -8.563 1.00 0.00 H new ATOM 0 HD2 LYS A 47 2.451 -3.496 -6.648 1.00 0.00 H new ATOM 0 HD3 LYS A 47 1.030 -4.510 -6.801 1.00 0.00 H new ATOM 0 HE2 LYS A 47 3.123 -6.379 -6.565 1.00 0.00 H new ATOM 0 HE3 LYS A 47 3.609 -5.098 -5.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 2.168 -6.697 -4.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 1.406 -5.181 -4.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 0.935 -6.422 -5.498 1.00 0.00 H new ATOM 747 N GLY A 48 3.516 -6.090 -11.009 1.00 0.00 N ATOM 748 CA GLY A 48 4.434 -7.261 -10.946 1.00 0.00 C ATOM 749 C GLY A 48 5.866 -6.771 -10.726 1.00 0.00 C ATOM 750 O GLY A 48 6.180 -5.625 -10.968 1.00 0.00 O ATOM 0 H GLY A 48 3.917 -5.247 -11.421 1.00 0.00 H new ATOM 0 HA2 GLY A 48 4.137 -7.927 -10.136 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.372 -7.836 -11.870 1.00 0.00 H new ATOM 754 N HIS A 49 6.741 -7.630 -10.277 1.00 0.00 N ATOM 755 CA HIS A 49 8.152 -7.202 -10.049 1.00 0.00 C ATOM 756 C HIS A 49 8.861 -7.071 -11.398 1.00 0.00 C ATOM 757 O HIS A 49 8.336 -7.456 -12.422 1.00 0.00 O ATOM 758 CB HIS A 49 8.869 -8.239 -9.181 1.00 0.00 C ATOM 759 CG HIS A 49 10.361 -8.056 -9.285 1.00 0.00 C ATOM 760 ND1 HIS A 49 11.187 -6.998 -8.980 1.00 0.00 N flip ATOM 761 CD2 HIS A 49 11.194 -9.063 -9.749 1.00 0.00 C flip ATOM 762 CE1 HIS A 49 12.503 -7.347 -9.253 1.00 0.00 C flip ATOM 763 NE2 HIS A 49 12.456 -8.598 -9.710 1.00 0.00 N flip ATOM 0 H HIS A 49 6.541 -8.606 -10.059 1.00 0.00 H new ATOM 0 HA HIS A 49 8.167 -6.240 -9.537 1.00 0.00 H new ATOM 0 HB2 HIS A 49 8.553 -8.137 -8.143 1.00 0.00 H new ATOM 0 HB3 HIS A 49 8.595 -9.244 -9.500 1.00 0.00 H new ATOM 0 HD2 HIS A 49 10.886 -10.043 -10.082 1.00 0.00 H new ATOM 0 HE1 HIS A 49 13.382 -6.733 -9.122 1.00 0.00 H new ATOM 0 HE2 HIS A 49 13.275 -9.136 -9.995 1.00 0.00 H new ATOM 772 N VAL A 50 10.040 -6.511 -11.413 1.00 0.00 N ATOM 773 CA VAL A 50 10.762 -6.342 -12.705 1.00 0.00 C ATOM 774 C VAL A 50 11.715 -7.517 -12.944 1.00 0.00 C ATOM 775 O VAL A 50 12.505 -7.874 -12.094 1.00 0.00 O ATOM 776 CB VAL A 50 11.556 -5.028 -12.664 1.00 0.00 C ATOM 777 CG1 VAL A 50 13.063 -5.309 -12.666 1.00 0.00 C ATOM 778 CG2 VAL A 50 11.206 -4.182 -13.890 1.00 0.00 C ATOM 0 H VAL A 50 10.532 -6.165 -10.590 1.00 0.00 H new ATOM 0 HA VAL A 50 10.039 -6.314 -13.520 1.00 0.00 H new ATOM 0 HB VAL A 50 11.295 -4.493 -11.751 1.00 0.00 H new ATOM 0 HG11 VAL A 50 13.609 -4.366 -12.637 1.00 0.00 H new ATOM 0 HG12 VAL A 50 13.323 -5.906 -11.792 1.00 0.00 H new ATOM 0 HG13 VAL A 50 13.330 -5.855 -13.571 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.769 -3.249 -13.861 1.00 0.00 H new ATOM 0 HG22 VAL A 50 11.460 -4.732 -14.796 1.00 0.00 H new ATOM 0 HG23 VAL A 50 10.139 -3.961 -13.887 1.00 0.00 H new ATOM 841 N ASP A 55 11.521 -3.499 -18.151 1.00 0.00 N ATOM 842 CA ASP A 55 11.634 -2.051 -17.834 1.00 0.00 C ATOM 843 C ASP A 55 10.694 -1.742 -16.674 1.00 0.00 C ATOM 844 O ASP A 55 9.901 -2.570 -16.274 1.00 0.00 O ATOM 845 CB ASP A 55 11.222 -1.212 -19.045 1.00 0.00 C ATOM 846 CG ASP A 55 11.929 0.145 -18.991 1.00 0.00 C ATOM 847 OD1 ASP A 55 13.031 0.199 -18.471 1.00 0.00 O ATOM 848 OD2 ASP A 55 11.353 1.107 -19.470 1.00 0.00 O ATOM 0 HA ASP A 55 12.665 -1.812 -17.572 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.482 -1.733 -19.967 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.141 -1.071 -19.052 1.00 0.00 H new ATOM 854 N ASP A 56 10.771 -0.567 -16.124 1.00 0.00 N ATOM 855 CA ASP A 56 9.869 -0.236 -14.994 1.00 0.00 C ATOM 856 C ASP A 56 8.422 -0.157 -15.499 1.00 0.00 C ATOM 857 O ASP A 56 7.539 -0.802 -14.975 1.00 0.00 O ATOM 858 CB ASP A 56 10.278 1.099 -14.375 1.00 0.00 C ATOM 859 CG ASP A 56 11.638 0.948 -13.692 1.00 0.00 C ATOM 860 OD1 ASP A 56 12.093 -0.177 -13.565 1.00 0.00 O ATOM 861 OD2 ASP A 56 12.202 1.959 -13.306 1.00 0.00 O ATOM 0 H ASP A 56 11.414 0.173 -16.405 1.00 0.00 H new ATOM 0 HA ASP A 56 9.943 -1.014 -14.234 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.329 1.869 -15.145 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.529 1.421 -13.651 1.00 0.00 H new ATOM 867 N LEU A 57 8.167 0.621 -16.519 1.00 0.00 N ATOM 868 CA LEU A 57 6.772 0.712 -17.044 1.00 0.00 C ATOM 869 C LEU A 57 6.436 -0.541 -17.840 1.00 0.00 C ATOM 870 O LEU A 57 5.385 -1.126 -17.673 1.00 0.00 O ATOM 871 CB LEU A 57 6.620 1.940 -17.946 1.00 0.00 C ATOM 872 CG LEU A 57 5.258 1.901 -18.656 1.00 0.00 C ATOM 873 CD1 LEU A 57 4.131 2.218 -17.670 1.00 0.00 C ATOM 874 CD2 LEU A 57 5.250 2.937 -19.779 1.00 0.00 C ATOM 0 H LEU A 57 8.857 1.192 -17.007 1.00 0.00 H new ATOM 0 HA LEU A 57 6.090 0.803 -16.199 1.00 0.00 H new ATOM 0 HB2 LEU A 57 6.705 2.851 -17.353 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.423 1.963 -18.682 1.00 0.00 H new ATOM 0 HG LEU A 57 5.099 0.902 -19.063 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.173 2.186 -18.190 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.133 1.481 -16.867 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.283 3.213 -17.251 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.286 2.915 -20.287 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.417 3.929 -19.360 1.00 0.00 H new ATOM 0 HD23 LEU A 57 6.042 2.707 -20.492 1.00 0.00 H new ATOM 886 N GLU A 58 7.312 -0.971 -18.702 1.00 0.00 N ATOM 887 CA GLU A 58 7.006 -2.192 -19.484 1.00 0.00 C ATOM 888 C GLU A 58 6.608 -3.271 -18.487 1.00 0.00 C ATOM 889 O GLU A 58 5.778 -4.115 -18.757 1.00 0.00 O ATOM 890 CB GLU A 58 8.241 -2.630 -20.277 1.00 0.00 C ATOM 891 CG GLU A 58 8.610 -1.540 -21.285 1.00 0.00 C ATOM 892 CD GLU A 58 7.464 -1.352 -22.279 1.00 0.00 C ATOM 893 OE1 GLU A 58 7.412 -0.306 -22.905 1.00 0.00 O ATOM 894 OE2 GLU A 58 6.656 -2.257 -22.397 1.00 0.00 O ATOM 0 H GLU A 58 8.214 -0.535 -18.895 1.00 0.00 H new ATOM 0 HA GLU A 58 6.201 -2.009 -20.196 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.076 -2.812 -19.600 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.040 -3.568 -20.796 1.00 0.00 H new ATOM 0 HG2 GLU A 58 8.812 -0.603 -20.765 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.523 -1.814 -21.814 1.00 0.00 H new ATOM 902 N THR A 59 7.179 -3.222 -17.313 1.00 0.00 N ATOM 903 CA THR A 59 6.824 -4.212 -16.267 1.00 0.00 C ATOM 904 C THR A 59 5.368 -3.985 -15.853 1.00 0.00 C ATOM 905 O THR A 59 4.583 -4.908 -15.774 1.00 0.00 O ATOM 906 CB THR A 59 7.734 -4.022 -15.055 1.00 0.00 C ATOM 907 OG1 THR A 59 8.829 -4.921 -15.139 1.00 0.00 O ATOM 908 CG2 THR A 59 6.946 -4.284 -13.774 1.00 0.00 C ATOM 0 H THR A 59 7.879 -2.534 -17.037 1.00 0.00 H new ATOM 0 HA THR A 59 6.949 -5.224 -16.653 1.00 0.00 H new ATOM 0 HB THR A 59 8.109 -2.999 -15.040 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.512 -5.837 -14.993 1.00 0.00 H new ATOM 0 HG21 THR A 59 7.598 -4.148 -12.911 1.00 0.00 H new ATOM 0 HG22 THR A 59 6.111 -3.586 -13.711 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.566 -5.305 -13.783 1.00 0.00 H new ATOM 916 N ALA A 60 4.997 -2.756 -15.601 1.00 0.00 N ATOM 917 CA ALA A 60 3.588 -2.480 -15.210 1.00 0.00 C ATOM 918 C ALA A 60 2.691 -2.895 -16.370 1.00 0.00 C ATOM 919 O ALA A 60 1.686 -3.553 -16.194 1.00 0.00 O ATOM 920 CB ALA A 60 3.412 -0.987 -14.919 1.00 0.00 C ATOM 0 H ALA A 60 5.606 -1.939 -15.649 1.00 0.00 H new ATOM 0 HA ALA A 60 3.326 -3.038 -14.311 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.378 -0.791 -14.633 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.075 -0.694 -14.105 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.657 -0.411 -15.811 1.00 0.00 H new ATOM 926 N LEU A 61 3.077 -2.540 -17.564 1.00 0.00 N ATOM 927 CA LEU A 61 2.286 -2.936 -18.758 1.00 0.00 C ATOM 928 C LEU A 61 2.342 -4.458 -18.885 1.00 0.00 C ATOM 929 O LEU A 61 1.384 -5.106 -19.262 1.00 0.00 O ATOM 930 CB LEU A 61 2.906 -2.289 -20.004 1.00 0.00 C ATOM 931 CG LEU A 61 2.719 -0.771 -19.941 1.00 0.00 C ATOM 932 CD1 LEU A 61 3.569 -0.095 -21.019 1.00 0.00 C ATOM 933 CD2 LEU A 61 1.248 -0.431 -20.180 1.00 0.00 C ATOM 0 H LEU A 61 3.912 -1.989 -17.763 1.00 0.00 H new ATOM 0 HA LEU A 61 1.251 -2.609 -18.661 1.00 0.00 H new ATOM 0 HB2 LEU A 61 3.967 -2.533 -20.063 1.00 0.00 H new ATOM 0 HB3 LEU A 61 2.437 -2.686 -20.904 1.00 0.00 H new ATOM 0 HG LEU A 61 3.029 -0.414 -18.959 1.00 0.00 H new ATOM 0 HD11 LEU A 61 3.430 0.985 -20.968 1.00 0.00 H new ATOM 0 HD12 LEU A 61 4.620 -0.334 -20.857 1.00 0.00 H new ATOM 0 HD13 LEU A 61 3.263 -0.454 -22.002 1.00 0.00 H new ATOM 0 HD21 LEU A 61 1.112 0.650 -20.136 1.00 0.00 H new ATOM 0 HD22 LEU A 61 0.945 -0.795 -21.162 1.00 0.00 H new ATOM 0 HD23 LEU A 61 0.636 -0.905 -19.413 1.00 0.00 H new ATOM 945 N ARG A 62 3.470 -5.027 -18.558 1.00 0.00 N ATOM 946 CA ARG A 62 3.631 -6.507 -18.635 1.00 0.00 C ATOM 947 C ARG A 62 2.635 -7.188 -17.697 1.00 0.00 C ATOM 948 O ARG A 62 1.933 -8.103 -18.079 1.00 0.00 O ATOM 949 CB ARG A 62 5.053 -6.861 -18.193 1.00 0.00 C ATOM 950 CG ARG A 62 5.244 -8.378 -18.159 1.00 0.00 C ATOM 951 CD ARG A 62 6.567 -8.690 -17.457 1.00 0.00 C ATOM 952 NE ARG A 62 6.739 -10.163 -17.338 1.00 0.00 N ATOM 953 CZ ARG A 62 6.955 -10.881 -18.402 1.00 0.00 C ATOM 954 NH1 ARG A 62 7.027 -10.305 -19.570 1.00 0.00 N ATOM 955 NH2 ARG A 62 7.105 -12.172 -18.297 1.00 0.00 N ATOM 0 H ARG A 62 4.297 -4.523 -18.237 1.00 0.00 H new ATOM 0 HA ARG A 62 3.450 -6.845 -19.655 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.774 -6.413 -18.877 1.00 0.00 H new ATOM 0 HB3 ARG A 62 5.248 -6.442 -17.206 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.416 -8.851 -17.632 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.249 -8.781 -19.172 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.397 -8.262 -18.019 1.00 0.00 H new ATOM 0 HD3 ARG A 62 6.581 -8.232 -16.468 1.00 0.00 H new ATOM 0 HE ARG A 62 6.688 -10.610 -16.423 1.00 0.00 H new ATOM 0 HH11 ARG A 62 6.914 -9.294 -19.648 1.00 0.00 H new ATOM 0 HH12 ARG A 62 7.196 -10.865 -20.405 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.053 -12.619 -17.381 1.00 0.00 H new ATOM 0 HH22 ARG A 62 7.274 -12.735 -19.130 1.00 0.00 H new ATOM 969 N ALA A 63 2.577 -6.754 -16.468 1.00 0.00 N ATOM 970 CA ALA A 63 1.637 -7.380 -15.502 1.00 0.00 C ATOM 971 C ALA A 63 0.204 -6.985 -15.850 1.00 0.00 C ATOM 972 O ALA A 63 -0.737 -7.687 -15.541 1.00 0.00 O ATOM 973 CB ALA A 63 1.967 -6.904 -14.087 1.00 0.00 C ATOM 0 H ALA A 63 3.142 -5.992 -16.093 1.00 0.00 H new ATOM 0 HA ALA A 63 1.736 -8.464 -15.554 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.277 -7.363 -13.379 1.00 0.00 H new ATOM 0 HB2 ALA A 63 2.989 -7.189 -13.836 1.00 0.00 H new ATOM 0 HB3 ALA A 63 1.870 -5.819 -14.036 1.00 0.00 H new ATOM 979 N THR A 64 0.024 -5.861 -16.477 1.00 0.00 N ATOM 980 CA THR A 64 -1.352 -5.426 -16.822 1.00 0.00 C ATOM 981 C THR A 64 -2.055 -6.511 -17.628 1.00 0.00 C ATOM 982 O THR A 64 -3.178 -6.874 -17.345 1.00 0.00 O ATOM 983 CB THR A 64 -1.278 -4.139 -17.634 1.00 0.00 C ATOM 984 OG1 THR A 64 -0.390 -3.239 -16.991 1.00 0.00 O ATOM 985 CG2 THR A 64 -2.667 -3.521 -17.702 1.00 0.00 C ATOM 0 H THR A 64 0.768 -5.226 -16.765 1.00 0.00 H new ATOM 0 HA THR A 64 -1.919 -5.249 -15.908 1.00 0.00 H new ATOM 0 HB THR A 64 -0.919 -4.349 -18.642 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.513 -3.620 -16.983 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.627 -2.598 -18.281 1.00 0.00 H new ATOM 0 HG22 THR A 64 -3.353 -4.220 -18.180 1.00 0.00 H new ATOM 0 HG23 THR A 64 -3.017 -3.301 -16.693 1.00 0.00 H new ATOM 993 N GLN A 65 -1.407 -7.033 -18.625 1.00 0.00 N ATOM 994 CA GLN A 65 -2.047 -8.099 -19.438 1.00 0.00 C ATOM 995 C GLN A 65 -2.017 -9.428 -18.679 1.00 0.00 C ATOM 996 O GLN A 65 -3.002 -10.128 -18.600 1.00 0.00 O ATOM 997 CB GLN A 65 -1.304 -8.237 -20.774 1.00 0.00 C ATOM 998 CG GLN A 65 -1.052 -9.713 -21.089 1.00 0.00 C ATOM 999 CD GLN A 65 -0.460 -9.845 -22.493 1.00 0.00 C ATOM 1000 OE1 GLN A 65 0.347 -9.033 -22.905 1.00 0.00 O ATOM 1001 NE2 GLN A 65 -0.825 -10.840 -23.251 1.00 0.00 N ATOM 0 H GLN A 65 -0.465 -6.770 -18.913 1.00 0.00 H new ATOM 0 HA GLN A 65 -3.086 -7.832 -19.630 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -1.890 -7.782 -21.573 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -0.356 -7.700 -20.728 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -0.370 -10.141 -20.354 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -1.984 -10.274 -21.022 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -1.501 -11.522 -22.907 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -0.434 -10.937 -24.188 1.00 0.00 H new ATOM 1010 N GLU A 66 -0.893 -9.795 -18.143 1.00 0.00 N ATOM 1011 CA GLU A 66 -0.812 -11.095 -17.423 1.00 0.00 C ATOM 1012 C GLU A 66 -1.700 -11.100 -16.173 1.00 0.00 C ATOM 1013 O GLU A 66 -2.390 -12.062 -15.907 1.00 0.00 O ATOM 1014 CB GLU A 66 0.638 -11.354 -17.014 1.00 0.00 C ATOM 1015 CG GLU A 66 0.744 -12.742 -16.384 1.00 0.00 C ATOM 1016 CD GLU A 66 2.173 -12.972 -15.897 1.00 0.00 C ATOM 1017 OE1 GLU A 66 2.436 -14.040 -15.371 1.00 0.00 O ATOM 1018 OE2 GLU A 66 2.982 -12.074 -16.060 1.00 0.00 O ATOM 0 H GLU A 66 -0.028 -9.255 -18.170 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.164 -11.879 -18.093 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.291 -11.286 -17.884 1.00 0.00 H new ATOM 0 HB3 GLU A 66 0.970 -10.594 -16.306 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.046 -12.829 -15.551 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.469 -13.505 -17.112 1.00 0.00 H new ATOM 1026 N GLU A 67 -1.681 -10.059 -15.387 1.00 0.00 N ATOM 1027 CA GLU A 67 -2.515 -10.063 -14.146 1.00 0.00 C ATOM 1028 C GLU A 67 -3.990 -9.767 -14.448 1.00 0.00 C ATOM 1029 O GLU A 67 -4.871 -10.374 -13.871 1.00 0.00 O ATOM 1030 CB GLU A 67 -1.963 -9.039 -13.158 1.00 0.00 C ATOM 1031 CG GLU A 67 -0.596 -9.521 -12.671 1.00 0.00 C ATOM 1032 CD GLU A 67 -0.052 -8.568 -11.607 1.00 0.00 C ATOM 1033 OE1 GLU A 67 0.910 -8.935 -10.956 1.00 0.00 O ATOM 1034 OE2 GLU A 67 -0.604 -7.492 -11.463 1.00 0.00 O ATOM 0 H GLU A 67 -1.132 -9.214 -15.545 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.467 -11.060 -13.709 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.872 -8.063 -13.635 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -2.645 -8.920 -12.316 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.682 -10.527 -12.260 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.098 -9.577 -13.509 1.00 0.00 H new ATOM 1042 N ALA A 68 -4.280 -8.844 -15.326 1.00 0.00 N ATOM 1043 CA ALA A 68 -5.712 -8.537 -15.619 1.00 0.00 C ATOM 1044 C ALA A 68 -6.101 -9.052 -17.003 1.00 0.00 C ATOM 1045 O ALA A 68 -7.266 -9.185 -17.314 1.00 0.00 O ATOM 1046 CB ALA A 68 -5.939 -7.027 -15.566 1.00 0.00 C ATOM 0 H ALA A 68 -3.597 -8.295 -15.848 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.329 -9.032 -14.869 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -6.985 -6.809 -15.780 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.687 -6.656 -14.573 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.307 -6.538 -16.307 1.00 0.00 H new ATOM 1052 N GLY A 69 -5.148 -9.347 -17.838 1.00 0.00 N ATOM 1053 CA GLY A 69 -5.497 -9.853 -19.194 1.00 0.00 C ATOM 1054 C GLY A 69 -5.566 -8.685 -20.171 1.00 0.00 C ATOM 1055 O GLY A 69 -5.925 -8.851 -21.318 1.00 0.00 O ATOM 0 H GLY A 69 -4.150 -9.261 -17.644 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.752 -10.576 -19.527 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -6.454 -10.373 -19.164 1.00 0.00 H new ATOM 1059 N ILE A 70 -5.229 -7.503 -19.733 1.00 0.00 N ATOM 1060 CA ILE A 70 -5.292 -6.341 -20.655 1.00 0.00 C ATOM 1061 C ILE A 70 -3.882 -5.967 -21.115 1.00 0.00 C ATOM 1062 O ILE A 70 -3.004 -5.712 -20.316 1.00 0.00 O ATOM 1063 CB ILE A 70 -5.900 -5.141 -19.939 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -7.106 -5.585 -19.117 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -6.353 -4.119 -20.980 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -7.658 -4.380 -18.363 1.00 0.00 C ATOM 0 H ILE A 70 -4.916 -7.295 -18.785 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.906 -6.612 -21.514 1.00 0.00 H new ATOM 0 HB ILE A 70 -5.156 -4.698 -19.277 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -7.872 -6.006 -19.768 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -6.817 -6.369 -18.416 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.790 -3.256 -20.477 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.496 -3.798 -21.572 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.097 -4.572 -21.635 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -8.521 -4.685 -17.771 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.888 -3.980 -17.703 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.960 -3.612 -19.075 1.00 0.00 H new ATOM 1078 N GLU A 71 -3.665 -5.916 -22.397 1.00 0.00 N ATOM 1079 CA GLU A 71 -2.320 -5.545 -22.911 1.00 0.00 C ATOM 1080 C GLU A 71 -2.278 -4.044 -23.180 1.00 0.00 C ATOM 1081 O GLU A 71 -3.296 -3.388 -23.264 1.00 0.00 O ATOM 1082 CB GLU A 71 -2.039 -6.304 -24.206 1.00 0.00 C ATOM 1083 CG GLU A 71 -3.035 -5.865 -25.284 1.00 0.00 C ATOM 1084 CD GLU A 71 -2.827 -6.705 -26.545 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -1.890 -7.487 -26.562 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -3.604 -6.551 -27.471 1.00 0.00 O ATOM 0 H GLU A 71 -4.363 -6.116 -23.113 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.564 -5.804 -22.170 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.019 -6.111 -24.539 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -2.121 -7.377 -24.036 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -4.056 -5.983 -24.920 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -2.898 -4.808 -25.512 1.00 0.00 H new ATOM 1094 N ALA A 72 -1.110 -3.492 -23.312 1.00 0.00 N ATOM 1095 CA ALA A 72 -1.014 -2.033 -23.575 1.00 0.00 C ATOM 1096 C ALA A 72 -1.665 -1.726 -24.924 1.00 0.00 C ATOM 1097 O ALA A 72 -2.094 -0.618 -25.183 1.00 0.00 O ATOM 1098 CB ALA A 72 0.452 -1.604 -23.598 1.00 0.00 C ATOM 0 H ALA A 72 -0.219 -3.985 -23.250 1.00 0.00 H new ATOM 0 HA ALA A 72 -1.528 -1.485 -22.786 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.515 -0.533 -23.791 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.911 -1.826 -22.635 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.977 -2.146 -24.384 1.00 0.00 H new ATOM 1104 N GLY A 73 -1.738 -2.705 -25.788 1.00 0.00 N ATOM 1105 CA GLY A 73 -2.355 -2.481 -27.127 1.00 0.00 C ATOM 1106 C GLY A 73 -3.738 -1.847 -26.964 1.00 0.00 C ATOM 1107 O GLY A 73 -4.155 -1.034 -27.767 1.00 0.00 O ATOM 0 H GLY A 73 -1.396 -3.652 -25.623 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -1.717 -1.833 -27.727 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -2.440 -3.428 -27.661 1.00 0.00 H new ATOM 1111 N GLN A 74 -4.456 -2.198 -25.930 1.00 0.00 N ATOM 1112 CA GLN A 74 -5.806 -1.595 -25.733 1.00 0.00 C ATOM 1113 C GLN A 74 -5.743 -0.531 -24.632 1.00 0.00 C ATOM 1114 O GLN A 74 -6.734 0.091 -24.305 1.00 0.00 O ATOM 1115 CB GLN A 74 -6.820 -2.681 -25.362 1.00 0.00 C ATOM 1116 CG GLN A 74 -6.322 -3.476 -24.160 1.00 0.00 C ATOM 1117 CD GLN A 74 -7.003 -4.844 -24.145 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -6.348 -5.862 -24.025 1.00 0.00 O ATOM 1119 NE2 GLN A 74 -8.300 -4.914 -24.264 1.00 0.00 N ATOM 0 H GLN A 74 -4.169 -2.871 -25.219 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.125 -1.125 -26.663 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.784 -2.226 -25.133 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -6.976 -3.348 -26.210 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.240 -3.596 -24.211 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -6.540 -2.938 -23.237 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -8.850 -4.061 -24.365 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -8.765 -5.822 -24.256 1.00 0.00 H new ATOM 1128 N LEU A 75 -4.584 -0.301 -24.071 1.00 0.00 N ATOM 1129 CA LEU A 75 -4.465 0.744 -23.009 1.00 0.00 C ATOM 1130 C LEU A 75 -3.588 1.884 -23.513 1.00 0.00 C ATOM 1131 O LEU A 75 -2.683 1.687 -24.299 1.00 0.00 O ATOM 1132 CB LEU A 75 -3.801 0.181 -21.755 1.00 0.00 C ATOM 1133 CG LEU A 75 -4.552 -1.046 -21.260 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -3.619 -1.872 -20.381 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -5.754 -0.597 -20.430 1.00 0.00 C ATOM 0 H LEU A 75 -3.718 -0.789 -24.301 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.471 1.090 -22.771 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -2.766 -0.082 -21.971 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.780 0.942 -20.974 1.00 0.00 H new ATOM 0 HG LEU A 75 -4.892 -1.642 -22.107 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.146 -2.755 -20.020 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.750 -2.181 -20.962 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.293 -1.272 -19.532 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -6.296 -1.472 -20.072 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -5.409 -0.011 -19.578 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.415 0.012 -21.047 1.00 0.00 H new ATOM 1147 N THR A 76 -3.828 3.070 -23.038 1.00 0.00 N ATOM 1148 CA THR A 76 -2.988 4.220 -23.452 1.00 0.00 C ATOM 1149 C THR A 76 -2.366 4.820 -22.188 1.00 0.00 C ATOM 1150 O THR A 76 -3.057 5.289 -21.308 1.00 0.00 O ATOM 1151 CB THR A 76 -3.856 5.254 -24.184 1.00 0.00 C ATOM 1152 OG1 THR A 76 -3.266 5.552 -25.442 1.00 0.00 O ATOM 1153 CG2 THR A 76 -3.973 6.541 -23.363 1.00 0.00 C ATOM 0 H THR A 76 -4.573 3.292 -22.378 1.00 0.00 H new ATOM 0 HA THR A 76 -2.199 3.905 -24.135 1.00 0.00 H new ATOM 0 HB THR A 76 -4.854 4.838 -24.325 1.00 0.00 H new ATOM 0 HG1 THR A 76 -3.817 6.210 -25.914 1.00 0.00 H new ATOM 0 HG21 THR A 76 -4.592 7.260 -23.900 1.00 0.00 H new ATOM 0 HG22 THR A 76 -4.430 6.317 -22.399 1.00 0.00 H new ATOM 0 HG23 THR A 76 -2.981 6.963 -23.205 1.00 0.00 H new ATOM 1161 N ILE A 77 -1.067 4.789 -22.076 1.00 0.00 N ATOM 1162 CA ILE A 77 -0.424 5.343 -20.854 1.00 0.00 C ATOM 1163 C ILE A 77 -0.497 6.866 -20.888 1.00 0.00 C ATOM 1164 O ILE A 77 0.341 7.529 -21.464 1.00 0.00 O ATOM 1165 CB ILE A 77 1.042 4.895 -20.779 1.00 0.00 C ATOM 1166 CG1 ILE A 77 1.103 3.368 -20.667 1.00 0.00 C ATOM 1167 CG2 ILE A 77 1.725 5.529 -19.559 1.00 0.00 C ATOM 1168 CD1 ILE A 77 0.611 2.922 -19.285 1.00 0.00 C ATOM 0 H ILE A 77 -0.428 4.407 -22.773 1.00 0.00 H new ATOM 0 HA ILE A 77 -0.950 4.973 -19.974 1.00 0.00 H new ATOM 0 HB ILE A 77 1.561 5.217 -21.682 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.489 2.914 -21.445 1.00 0.00 H new ATOM 0 HG13 ILE A 77 2.125 3.024 -20.826 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.765 5.205 -19.515 1.00 0.00 H new ATOM 0 HG22 ILE A 77 1.687 6.615 -19.644 1.00 0.00 H new ATOM 0 HG23 ILE A 77 1.209 5.218 -18.651 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.658 1.835 -19.215 1.00 0.00 H new ATOM 0 HD12 ILE A 77 1.243 3.363 -18.514 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -0.418 3.250 -19.142 1.00 0.00 H new ATOM 1180 N ILE A 78 -1.490 7.424 -20.257 1.00 0.00 N ATOM 1181 CA ILE A 78 -1.618 8.902 -20.221 1.00 0.00 C ATOM 1182 C ILE A 78 -0.389 9.471 -19.543 1.00 0.00 C ATOM 1183 O ILE A 78 0.076 10.549 -19.850 1.00 0.00 O ATOM 1184 CB ILE A 78 -2.831 9.286 -19.387 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -4.102 8.782 -20.062 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -2.882 10.799 -19.239 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -4.547 7.504 -19.360 1.00 0.00 C ATOM 0 H ILE A 78 -2.222 6.915 -19.762 1.00 0.00 H new ATOM 0 HA ILE A 78 -1.723 9.286 -21.236 1.00 0.00 H new ATOM 0 HB ILE A 78 -2.754 8.831 -18.400 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -4.886 9.537 -20.006 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -3.919 8.590 -21.119 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.750 11.077 -18.642 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -1.975 11.147 -18.745 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -2.957 11.259 -20.224 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -5.456 7.128 -19.830 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.761 6.753 -19.439 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.743 7.716 -18.309 1.00 0.00 H new ATOM 1199 N GLU A 79 0.118 8.745 -18.595 1.00 0.00 N ATOM 1200 CA GLU A 79 1.304 9.216 -17.844 1.00 0.00 C ATOM 1201 C GLU A 79 0.863 10.337 -16.914 1.00 0.00 C ATOM 1202 O GLU A 79 0.015 10.150 -16.065 1.00 0.00 O ATOM 1203 CB GLU A 79 2.364 9.742 -18.818 1.00 0.00 C ATOM 1204 CG GLU A 79 2.416 8.833 -20.046 1.00 0.00 C ATOM 1205 CD GLU A 79 2.019 9.613 -21.304 1.00 0.00 C ATOM 1206 OE1 GLU A 79 1.863 8.984 -22.338 1.00 0.00 O ATOM 1207 OE2 GLU A 79 1.881 10.821 -21.216 1.00 0.00 O ATOM 0 H GLU A 79 -0.243 7.836 -18.306 1.00 0.00 H new ATOM 0 HA GLU A 79 1.734 8.395 -17.271 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.126 10.763 -19.117 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.339 9.772 -18.331 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.421 8.427 -20.164 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.744 7.986 -19.908 1.00 0.00 H new ATOM 1215 N GLY A 80 1.421 11.499 -17.066 1.00 0.00 N ATOM 1216 CA GLY A 80 1.024 12.623 -16.179 1.00 0.00 C ATOM 1217 C GLY A 80 1.396 12.263 -14.746 1.00 0.00 C ATOM 1218 O GLY A 80 2.186 12.932 -14.113 1.00 0.00 O ATOM 0 H GLY A 80 2.132 11.721 -17.763 1.00 0.00 H new ATOM 0 HA2 GLY A 80 1.528 13.541 -16.482 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -0.047 12.807 -16.257 1.00 0.00 H new ATOM 1222 N PHE A 81 0.845 11.198 -14.233 1.00 0.00 N ATOM 1223 CA PHE A 81 1.190 10.797 -12.846 1.00 0.00 C ATOM 1224 C PHE A 81 2.107 9.572 -12.883 1.00 0.00 C ATOM 1225 O PHE A 81 1.727 8.508 -13.331 1.00 0.00 O ATOM 1226 CB PHE A 81 -0.082 10.443 -12.071 1.00 0.00 C ATOM 1227 CG PHE A 81 0.265 10.260 -10.612 1.00 0.00 C ATOM 1228 CD1 PHE A 81 0.741 9.026 -10.153 1.00 0.00 C ATOM 1229 CD2 PHE A 81 0.124 11.331 -9.720 1.00 0.00 C ATOM 1230 CE1 PHE A 81 1.072 8.862 -8.803 1.00 0.00 C ATOM 1231 CE2 PHE A 81 0.457 11.167 -8.370 1.00 0.00 C ATOM 1232 CZ PHE A 81 0.930 9.932 -7.910 1.00 0.00 C ATOM 0 H PHE A 81 0.177 10.594 -14.712 1.00 0.00 H new ATOM 0 HA PHE A 81 1.696 11.627 -12.353 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -0.824 11.233 -12.185 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -0.524 9.530 -12.470 1.00 0.00 H new ATOM 0 HD1 PHE A 81 0.853 8.201 -10.841 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -0.242 12.284 -10.074 1.00 0.00 H new ATOM 0 HE1 PHE A 81 1.437 7.909 -8.449 1.00 0.00 H new ATOM 0 HE2 PHE A 81 0.349 11.993 -7.683 1.00 0.00 H new ATOM 0 HZ PHE A 81 1.185 9.805 -6.868 1.00 0.00 H new ATOM 1242 N LYS A 82 3.304 9.712 -12.389 1.00 0.00 N ATOM 1243 CA LYS A 82 4.243 8.557 -12.364 1.00 0.00 C ATOM 1244 C LYS A 82 5.205 8.738 -11.210 1.00 0.00 C ATOM 1245 O LYS A 82 6.055 9.603 -11.231 1.00 0.00 O ATOM 1246 CB LYS A 82 5.046 8.474 -13.666 1.00 0.00 C ATOM 1247 CG LYS A 82 6.093 7.348 -13.570 1.00 0.00 C ATOM 1248 CD LYS A 82 7.280 7.783 -12.694 1.00 0.00 C ATOM 1249 CE LYS A 82 8.509 6.933 -13.032 1.00 0.00 C ATOM 1250 NZ LYS A 82 9.725 7.554 -12.434 1.00 0.00 N ATOM 0 H LYS A 82 3.674 10.579 -12.000 1.00 0.00 H new ATOM 0 HA LYS A 82 3.666 7.639 -12.250 1.00 0.00 H new ATOM 0 HB2 LYS A 82 4.375 8.287 -14.505 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.541 9.426 -13.859 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.634 6.453 -13.151 1.00 0.00 H new ATOM 0 HG3 LYS A 82 6.447 7.088 -14.568 1.00 0.00 H new ATOM 0 HD2 LYS A 82 7.499 8.838 -12.859 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.027 7.671 -11.640 1.00 0.00 H new ATOM 0 HE2 LYS A 82 8.380 5.920 -12.650 1.00 0.00 H new ATOM 0 HE3 LYS A 82 8.623 6.854 -14.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 10.559 6.976 -12.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 9.851 8.512 -12.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 9.615 7.608 -11.401 1.00 0.00 H new ATOM 1264 N ARG A 83 5.101 7.909 -10.222 1.00 0.00 N ATOM 1265 CA ARG A 83 6.036 8.002 -9.074 1.00 0.00 C ATOM 1266 C ARG A 83 6.266 6.597 -8.540 1.00 0.00 C ATOM 1267 O ARG A 83 5.526 5.683 -8.844 1.00 0.00 O ATOM 1268 CB ARG A 83 5.451 8.898 -7.977 1.00 0.00 C ATOM 1269 CG ARG A 83 5.380 10.348 -8.475 1.00 0.00 C ATOM 1270 CD ARG A 83 6.787 10.853 -8.813 1.00 0.00 C ATOM 1271 NE ARG A 83 7.002 12.191 -8.199 1.00 0.00 N ATOM 1272 CZ ARG A 83 6.328 13.223 -8.628 1.00 0.00 C ATOM 1273 NH1 ARG A 83 5.436 13.079 -9.571 1.00 0.00 N ATOM 1274 NH2 ARG A 83 6.544 14.397 -8.108 1.00 0.00 N ATOM 0 H ARG A 83 4.406 7.166 -10.157 1.00 0.00 H new ATOM 0 HA ARG A 83 6.980 8.443 -9.395 1.00 0.00 H new ATOM 0 HB2 ARG A 83 4.456 8.549 -7.702 1.00 0.00 H new ATOM 0 HB3 ARG A 83 6.068 8.841 -7.080 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.741 10.408 -9.356 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.930 10.982 -7.711 1.00 0.00 H new ATOM 0 HD2 ARG A 83 7.534 10.150 -8.445 1.00 0.00 H new ATOM 0 HD3 ARG A 83 6.912 10.914 -9.894 1.00 0.00 H new ATOM 0 HE ARG A 83 7.677 12.302 -7.442 1.00 0.00 H new ATOM 0 HH11 ARG A 83 5.264 12.158 -9.974 1.00 0.00 H new ATOM 0 HH12 ARG A 83 4.911 13.888 -9.904 1.00 0.00 H new ATOM 0 HH21 ARG A 83 7.238 14.507 -7.368 1.00 0.00 H new ATOM 0 HH22 ARG A 83 6.020 15.206 -8.440 1.00 0.00 H new ATOM 1288 N GLU A 84 7.284 6.399 -7.759 1.00 0.00 N ATOM 1289 CA GLU A 84 7.530 5.035 -7.243 1.00 0.00 C ATOM 1290 C GLU A 84 6.602 4.762 -6.069 1.00 0.00 C ATOM 1291 O GLU A 84 6.907 5.065 -4.933 1.00 0.00 O ATOM 1292 CB GLU A 84 8.987 4.896 -6.802 1.00 0.00 C ATOM 1293 CG GLU A 84 9.900 5.056 -8.018 1.00 0.00 C ATOM 1294 CD GLU A 84 10.285 6.526 -8.187 1.00 0.00 C ATOM 1295 OE1 GLU A 84 9.804 7.340 -7.416 1.00 0.00 O ATOM 1296 OE2 GLU A 84 11.060 6.814 -9.084 1.00 0.00 O ATOM 0 H GLU A 84 7.948 7.113 -7.460 1.00 0.00 H new ATOM 0 HA GLU A 84 7.334 4.311 -8.033 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.226 5.650 -6.052 1.00 0.00 H new ATOM 0 HB3 GLU A 84 9.147 3.923 -6.338 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.796 4.448 -7.894 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.393 4.698 -8.914 1.00 0.00 H new ATOM 1304 N LEU A 85 5.478 4.164 -6.338 1.00 0.00 N ATOM 1305 CA LEU A 85 4.534 3.835 -5.244 1.00 0.00 C ATOM 1306 C LEU A 85 5.246 2.832 -4.343 1.00 0.00 C ATOM 1307 O LEU A 85 5.746 1.834 -4.808 1.00 0.00 O ATOM 1308 CB LEU A 85 3.280 3.187 -5.844 1.00 0.00 C ATOM 1309 CG LEU A 85 2.066 3.469 -4.951 1.00 0.00 C ATOM 1310 CD1 LEU A 85 1.114 4.448 -5.645 1.00 0.00 C ATOM 1311 CD2 LEU A 85 1.312 2.170 -4.665 1.00 0.00 C ATOM 0 H LEU A 85 5.174 3.889 -7.272 1.00 0.00 H new ATOM 0 HA LEU A 85 4.238 4.724 -4.687 1.00 0.00 H new ATOM 0 HB2 LEU A 85 3.103 3.577 -6.846 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.428 2.112 -5.942 1.00 0.00 H new ATOM 0 HG LEU A 85 2.422 3.903 -4.017 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.256 4.640 -5.001 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.636 5.384 -5.843 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.772 4.017 -6.586 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.452 2.381 -4.030 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.972 1.733 -5.604 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.974 1.469 -4.157 1.00 0.00 H new ATOM 1323 N ASN A 86 5.344 3.090 -3.073 1.00 0.00 N ATOM 1324 CA ASN A 86 6.078 2.131 -2.202 1.00 0.00 C ATOM 1325 C ASN A 86 5.239 1.751 -0.986 1.00 0.00 C ATOM 1326 O ASN A 86 4.710 2.590 -0.290 1.00 0.00 O ATOM 1327 CB ASN A 86 7.388 2.775 -1.753 1.00 0.00 C ATOM 1328 CG ASN A 86 8.234 3.083 -2.990 1.00 0.00 C ATOM 1329 OD1 ASN A 86 7.822 2.667 -4.156 1.00 0.00 O flip ATOM 1330 ND2 ASN A 86 9.276 3.701 -2.894 1.00 0.00 N flip ATOM 0 H ASN A 86 4.956 3.908 -2.604 1.00 0.00 H new ATOM 0 HA ASN A 86 6.284 1.221 -2.766 1.00 0.00 H new ATOM 0 HB2 ASN A 86 7.187 3.690 -1.195 1.00 0.00 H new ATOM 0 HB3 ASN A 86 7.928 2.105 -1.083 1.00 0.00 H new ATOM 0 HD21 ASN A 86 9.595 4.025 -1.981 1.00 0.00 H new ATOM 0 HD22 ASN A 86 9.832 3.896 -3.727 1.00 0.00 H new ATOM 1480 N THR A 95 9.684 -1.106 -3.620 1.00 0.00 N ATOM 1481 CA THR A 95 9.267 0.031 -4.487 1.00 0.00 C ATOM 1482 C THR A 95 8.265 -0.435 -5.542 1.00 0.00 C ATOM 1483 O THR A 95 8.402 -1.484 -6.136 1.00 0.00 O ATOM 1484 CB THR A 95 10.484 0.641 -5.183 1.00 0.00 C ATOM 1485 OG1 THR A 95 11.105 1.586 -4.318 1.00 0.00 O ATOM 1486 CG2 THR A 95 10.033 1.335 -6.473 1.00 0.00 C ATOM 0 HA THR A 95 8.795 0.783 -3.854 1.00 0.00 H new ATOM 0 HB THR A 95 11.200 -0.144 -5.425 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.886 1.975 -4.765 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.898 1.772 -6.973 1.00 0.00 H new ATOM 0 HG22 THR A 95 9.562 0.606 -7.133 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.318 2.122 -6.232 1.00 0.00 H new ATOM 1494 N VAL A 96 7.264 0.366 -5.779 1.00 0.00 N ATOM 1495 CA VAL A 96 6.236 0.023 -6.799 1.00 0.00 C ATOM 1496 C VAL A 96 5.892 1.288 -7.591 1.00 0.00 C ATOM 1497 O VAL A 96 5.609 2.315 -7.021 1.00 0.00 O ATOM 1498 CB VAL A 96 4.988 -0.503 -6.092 1.00 0.00 C ATOM 1499 CG1 VAL A 96 3.854 -0.662 -7.101 1.00 0.00 C ATOM 1500 CG2 VAL A 96 5.302 -1.862 -5.456 1.00 0.00 C ATOM 0 H VAL A 96 7.113 1.255 -5.303 1.00 0.00 H new ATOM 0 HA VAL A 96 6.613 -0.742 -7.477 1.00 0.00 H new ATOM 0 HB VAL A 96 4.684 0.202 -5.318 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.965 -1.037 -6.593 1.00 0.00 H new ATOM 0 HG12 VAL A 96 3.632 0.304 -7.554 1.00 0.00 H new ATOM 0 HG13 VAL A 96 4.153 -1.367 -7.877 1.00 0.00 H new ATOM 0 HG21 VAL A 96 4.414 -2.241 -4.950 1.00 0.00 H new ATOM 0 HG22 VAL A 96 5.606 -2.565 -6.231 1.00 0.00 H new ATOM 0 HG23 VAL A 96 6.110 -1.748 -4.733 1.00 0.00 H new ATOM 1510 N ILE A 97 5.913 1.233 -8.895 1.00 0.00 N ATOM 1511 CA ILE A 97 5.586 2.460 -9.686 1.00 0.00 C ATOM 1512 C ILE A 97 4.192 2.315 -10.294 1.00 0.00 C ATOM 1513 O ILE A 97 3.839 1.280 -10.818 1.00 0.00 O ATOM 1514 CB ILE A 97 6.614 2.647 -10.801 1.00 0.00 C ATOM 1515 CG1 ILE A 97 7.989 2.203 -10.295 1.00 0.00 C ATOM 1516 CG2 ILE A 97 6.671 4.128 -11.192 1.00 0.00 C ATOM 1517 CD1 ILE A 97 9.066 2.715 -11.245 1.00 0.00 C ATOM 0 H ILE A 97 6.139 0.404 -9.444 1.00 0.00 H new ATOM 0 HA ILE A 97 5.609 3.329 -9.029 1.00 0.00 H new ATOM 0 HB ILE A 97 6.331 2.050 -11.668 1.00 0.00 H new ATOM 0 HG12 ILE A 97 8.161 2.589 -9.290 1.00 0.00 H new ATOM 0 HG13 ILE A 97 8.032 1.116 -10.231 1.00 0.00 H new ATOM 0 HG21 ILE A 97 7.403 4.266 -11.987 1.00 0.00 H new ATOM 0 HG22 ILE A 97 5.690 4.450 -11.542 1.00 0.00 H new ATOM 0 HG23 ILE A 97 6.960 4.722 -10.325 1.00 0.00 H new ATOM 0 HD11 ILE A 97 10.046 2.400 -10.887 1.00 0.00 H new ATOM 0 HD12 ILE A 97 8.896 2.308 -12.242 1.00 0.00 H new ATOM 0 HD13 ILE A 97 9.027 3.804 -11.286 1.00 0.00 H new ATOM 1529 N TYR A 98 3.392 3.344 -10.212 1.00 0.00 N ATOM 1530 CA TYR A 98 2.007 3.268 -10.761 1.00 0.00 C ATOM 1531 C TYR A 98 1.833 4.262 -11.919 1.00 0.00 C ATOM 1532 O TYR A 98 2.107 5.440 -11.790 1.00 0.00 O ATOM 1533 CB TYR A 98 1.023 3.629 -9.639 1.00 0.00 C ATOM 1534 CG TYR A 98 0.684 2.429 -8.770 1.00 0.00 C ATOM 1535 CD1 TYR A 98 1.371 1.208 -8.889 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.344 2.551 -7.829 1.00 0.00 C ATOM 1537 CE1 TYR A 98 1.025 0.125 -8.071 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.687 1.468 -7.016 1.00 0.00 C ATOM 1539 CZ TYR A 98 -0.006 0.255 -7.136 1.00 0.00 C ATOM 1540 OH TYR A 98 -0.350 -0.812 -6.330 1.00 0.00 O ATOM 0 H TYR A 98 3.639 4.238 -9.787 1.00 0.00 H new ATOM 0 HA TYR A 98 1.819 2.261 -11.133 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.453 4.416 -9.019 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.108 4.031 -10.075 1.00 0.00 H new ATOM 0 HD1 TYR A 98 2.167 1.105 -9.612 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.875 3.486 -7.731 1.00 0.00 H new ATOM 0 HE1 TYR A 98 1.555 -0.811 -8.163 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.482 1.569 -6.292 1.00 0.00 H new ATOM 0 HH TYR A 98 -1.235 -0.655 -5.940 1.00 0.00 H new ATOM 1550 N TRP A 99 1.363 3.787 -13.047 1.00 0.00 N ATOM 1551 CA TRP A 99 1.153 4.687 -14.221 1.00 0.00 C ATOM 1552 C TRP A 99 -0.334 4.744 -14.570 1.00 0.00 C ATOM 1553 O TRP A 99 -1.067 3.802 -14.350 1.00 0.00 O ATOM 1554 CB TRP A 99 1.911 4.148 -15.433 1.00 0.00 C ATOM 1555 CG TRP A 99 3.290 4.698 -15.466 1.00 0.00 C ATOM 1556 CD1 TRP A 99 3.617 5.946 -15.861 1.00 0.00 C ATOM 1557 CD2 TRP A 99 4.534 4.032 -15.120 1.00 0.00 C ATOM 1558 NE1 TRP A 99 4.987 6.090 -15.778 1.00 0.00 N ATOM 1559 CE2 TRP A 99 5.598 4.936 -15.325 1.00 0.00 C ATOM 1560 CE3 TRP A 99 4.839 2.743 -14.650 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 6.920 4.574 -15.079 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 6.168 2.376 -14.402 1.00 0.00 C ATOM 1563 CH2 TRP A 99 7.207 3.290 -14.617 1.00 0.00 C ATOM 0 H TRP A 99 1.115 2.810 -13.204 1.00 0.00 H new ATOM 0 HA TRP A 99 1.517 5.682 -13.965 1.00 0.00 H new ATOM 0 HB2 TRP A 99 1.947 3.059 -15.393 1.00 0.00 H new ATOM 0 HB3 TRP A 99 1.384 4.416 -16.349 1.00 0.00 H new ATOM 0 HD1 TRP A 99 2.922 6.706 -16.188 1.00 0.00 H new ATOM 0 HE1 TRP A 99 5.488 6.945 -16.021 1.00 0.00 H new ATOM 0 HE3 TRP A 99 4.045 2.032 -14.479 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.718 5.283 -15.245 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 6.393 1.383 -14.043 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.230 3.001 -14.425 1.00 0.00 H new ATOM 1574 N LEU A 100 -0.778 5.834 -15.135 1.00 0.00 N ATOM 1575 CA LEU A 100 -2.214 5.941 -15.514 1.00 0.00 C ATOM 1576 C LEU A 100 -2.434 5.299 -16.885 1.00 0.00 C ATOM 1577 O LEU A 100 -1.719 5.559 -17.830 1.00 0.00 O ATOM 1578 CB LEU A 100 -2.626 7.417 -15.563 1.00 0.00 C ATOM 1579 CG LEU A 100 -2.742 7.968 -14.141 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -3.063 9.462 -14.197 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -3.875 7.244 -13.409 1.00 0.00 C ATOM 0 H LEU A 100 -0.209 6.653 -15.350 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.822 5.422 -14.772 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.891 7.991 -16.127 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.579 7.521 -16.083 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.800 7.813 -13.615 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.146 9.855 -13.184 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.266 9.986 -14.725 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -4.006 9.612 -14.722 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.961 7.634 -12.395 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.813 7.405 -13.940 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.659 6.176 -13.370 1.00 0.00 H new ATOM 1593 N ALA A 101 -3.431 4.463 -16.992 1.00 0.00 N ATOM 1594 CA ALA A 101 -3.717 3.797 -18.291 1.00 0.00 C ATOM 1595 C ALA A 101 -5.230 3.794 -18.510 1.00 0.00 C ATOM 1596 O ALA A 101 -5.997 3.658 -17.578 1.00 0.00 O ATOM 1597 CB ALA A 101 -3.197 2.354 -18.256 1.00 0.00 C ATOM 0 H ALA A 101 -4.062 4.213 -16.231 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.223 4.331 -19.103 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.408 1.868 -19.209 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.121 2.359 -18.081 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -3.692 1.808 -17.453 1.00 0.00 H new ATOM 1603 N GLU A 102 -5.665 3.953 -19.729 1.00 0.00 N ATOM 1604 CA GLU A 102 -7.133 3.973 -19.996 1.00 0.00 C ATOM 1605 C GLU A 102 -7.496 2.885 -21.001 1.00 0.00 C ATOM 1606 O GLU A 102 -6.836 2.709 -22.004 1.00 0.00 O ATOM 1607 CB GLU A 102 -7.522 5.331 -20.583 1.00 0.00 C ATOM 1608 CG GLU A 102 -9.035 5.385 -20.805 1.00 0.00 C ATOM 1609 CD GLU A 102 -9.397 6.700 -21.501 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -10.575 6.922 -21.730 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -8.490 7.462 -21.791 1.00 0.00 O ATOM 0 H GLU A 102 -5.071 4.070 -20.550 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.665 3.799 -19.061 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -7.215 6.130 -19.908 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.001 5.493 -21.527 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.356 4.538 -21.412 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.557 5.309 -19.851 1.00 0.00 H new ATOM 1619 N VAL A 103 -8.558 2.168 -20.756 1.00 0.00 N ATOM 1620 CA VAL A 103 -8.967 1.115 -21.720 1.00 0.00 C ATOM 1621 C VAL A 103 -9.877 1.737 -22.770 1.00 0.00 C ATOM 1622 O VAL A 103 -10.996 2.122 -22.491 1.00 0.00 O ATOM 1623 CB VAL A 103 -9.724 -0.012 -21.005 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -8.766 -0.817 -20.129 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -10.821 0.579 -20.125 1.00 0.00 C ATOM 0 H VAL A 103 -9.155 2.266 -19.935 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.075 0.696 -22.185 1.00 0.00 H new ATOM 0 HB VAL A 103 -10.165 -0.666 -21.757 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.315 -1.614 -19.627 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.983 -1.251 -20.750 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.316 -0.161 -19.384 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.355 -0.226 -19.620 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.375 1.241 -19.382 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -11.518 1.145 -20.743 1.00 0.00 H new ATOM 1635 N LYS A 104 -9.417 1.817 -23.982 1.00 0.00 N ATOM 1636 CA LYS A 104 -10.270 2.391 -25.048 1.00 0.00 C ATOM 1637 C LYS A 104 -11.410 1.409 -25.298 1.00 0.00 C ATOM 1638 O LYS A 104 -12.360 1.694 -25.997 1.00 0.00 O ATOM 1639 CB LYS A 104 -9.439 2.594 -26.313 1.00 0.00 C ATOM 1640 CG LYS A 104 -8.719 1.295 -26.674 1.00 0.00 C ATOM 1641 CD LYS A 104 -7.639 1.584 -27.718 1.00 0.00 C ATOM 1642 CE LYS A 104 -6.538 2.453 -27.099 1.00 0.00 C ATOM 1643 NZ LYS A 104 -6.628 3.833 -27.650 1.00 0.00 N ATOM 0 H LYS A 104 -8.491 1.511 -24.279 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.672 3.360 -24.754 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.083 2.904 -27.136 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -8.713 3.392 -26.158 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.270 0.856 -25.783 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -9.431 0.568 -27.064 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -7.215 0.649 -28.084 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -8.077 2.093 -28.577 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -6.644 2.475 -26.014 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -5.558 2.027 -27.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -6.288 4.513 -26.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -6.042 3.904 -28.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -7.617 4.048 -27.889 1.00 0.00 H new ATOM 1657 N ASP A 105 -11.323 0.257 -24.688 1.00 0.00 N ATOM 1658 CA ASP A 105 -12.396 -0.757 -24.833 1.00 0.00 C ATOM 1659 C ASP A 105 -13.244 -0.732 -23.563 1.00 0.00 C ATOM 1660 O ASP A 105 -12.883 -1.301 -22.552 1.00 0.00 O ATOM 1661 CB ASP A 105 -11.777 -2.147 -25.006 1.00 0.00 C ATOM 1662 CG ASP A 105 -11.314 -2.333 -26.453 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -10.712 -3.356 -26.731 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -11.576 -1.455 -27.257 1.00 0.00 O ATOM 0 H ASP A 105 -10.545 -0.023 -24.091 1.00 0.00 H new ATOM 0 HA ASP A 105 -13.009 -0.535 -25.707 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.933 -2.266 -24.327 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -12.506 -2.915 -24.746 1.00 0.00 H new ATOM 1670 N TYR A 106 -14.365 -0.072 -23.603 1.00 0.00 N ATOM 1671 CA TYR A 106 -15.229 -0.008 -22.395 1.00 0.00 C ATOM 1672 C TYR A 106 -15.532 -1.436 -21.948 1.00 0.00 C ATOM 1673 O TYR A 106 -15.710 -1.714 -20.779 1.00 0.00 O ATOM 1674 CB TYR A 106 -16.532 0.718 -22.740 1.00 0.00 C ATOM 1675 CG TYR A 106 -17.256 1.094 -21.470 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -18.114 0.177 -20.852 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -17.076 2.367 -20.916 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -18.790 0.532 -19.679 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -17.752 2.724 -19.741 1.00 0.00 C ATOM 1680 CZ TYR A 106 -18.609 1.806 -19.122 1.00 0.00 C ATOM 1681 OH TYR A 106 -19.276 2.154 -17.964 1.00 0.00 O ATOM 0 H TYR A 106 -14.720 0.426 -24.419 1.00 0.00 H new ATOM 0 HA TYR A 106 -14.726 0.534 -21.594 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -16.318 1.612 -23.326 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -17.165 0.078 -23.355 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -18.254 -0.804 -21.280 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -16.415 3.075 -21.394 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -19.452 -0.176 -19.202 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -17.612 3.706 -19.314 1.00 0.00 H new ATOM 0 HH TYR A 106 -18.967 3.033 -17.660 1.00 0.00 H new ATOM 1691 N ASP A 107 -15.587 -2.340 -22.883 1.00 0.00 N ATOM 1692 CA ASP A 107 -15.872 -3.763 -22.547 1.00 0.00 C ATOM 1693 C ASP A 107 -14.578 -4.573 -22.641 1.00 0.00 C ATOM 1694 O ASP A 107 -14.596 -5.756 -22.914 1.00 0.00 O ATOM 1695 CB ASP A 107 -16.898 -4.321 -23.534 1.00 0.00 C ATOM 1696 CG ASP A 107 -16.296 -4.343 -24.941 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -17.052 -4.491 -25.886 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -15.088 -4.214 -25.050 1.00 0.00 O ATOM 0 H ASP A 107 -15.445 -2.153 -23.876 1.00 0.00 H new ATOM 0 HA ASP A 107 -16.270 -3.829 -21.534 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -17.193 -5.328 -23.238 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -17.800 -3.708 -23.523 1.00 0.00 H new ATOM 1704 N VAL A 108 -13.451 -3.945 -22.429 1.00 0.00 N ATOM 1705 CA VAL A 108 -12.161 -4.684 -22.524 1.00 0.00 C ATOM 1706 C VAL A 108 -12.319 -6.059 -21.882 1.00 0.00 C ATOM 1707 O VAL A 108 -13.138 -6.257 -21.007 1.00 0.00 O ATOM 1708 CB VAL A 108 -11.060 -3.907 -21.804 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -11.500 -3.582 -20.377 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -9.786 -4.751 -21.766 1.00 0.00 C ATOM 0 H VAL A 108 -13.370 -2.956 -22.195 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.888 -4.797 -23.573 1.00 0.00 H new ATOM 0 HB VAL A 108 -10.868 -2.977 -22.339 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -10.710 -3.028 -19.870 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -12.407 -2.978 -20.405 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -11.698 -4.508 -19.837 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.999 -4.199 -21.253 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -9.982 -5.682 -21.234 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -9.467 -4.975 -22.784 1.00 0.00 H new ATOM 1720 N GLU A 109 -11.549 -7.016 -22.318 1.00 0.00 N ATOM 1721 CA GLU A 109 -11.664 -8.378 -21.742 1.00 0.00 C ATOM 1722 C GLU A 109 -10.651 -8.549 -20.617 1.00 0.00 C ATOM 1723 O GLU A 109 -9.470 -8.728 -20.839 1.00 0.00 O ATOM 1724 CB GLU A 109 -11.423 -9.412 -22.847 1.00 0.00 C ATOM 1725 CG GLU A 109 -10.997 -10.747 -22.237 1.00 0.00 C ATOM 1726 CD GLU A 109 -11.032 -11.828 -23.316 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -10.599 -11.549 -24.421 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -11.493 -12.919 -23.021 1.00 0.00 O ATOM 0 H GLU A 109 -10.845 -6.911 -23.049 1.00 0.00 H new ATOM 0 HA GLU A 109 -12.663 -8.524 -21.330 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -12.331 -9.546 -23.434 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -10.652 -9.053 -23.529 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -9.993 -10.666 -21.820 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -11.663 -11.014 -21.416 1.00 0.00 H new ATOM 1736 N ILE A 110 -11.119 -8.499 -19.405 1.00 0.00 N ATOM 1737 CA ILE A 110 -10.216 -8.660 -18.235 1.00 0.00 C ATOM 1738 C ILE A 110 -9.900 -10.135 -18.034 1.00 0.00 C ATOM 1739 O ILE A 110 -10.592 -10.833 -17.320 1.00 0.00 O ATOM 1740 CB ILE A 110 -10.920 -8.141 -16.981 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -11.237 -6.652 -17.133 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -10.024 -8.358 -15.755 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -9.949 -5.852 -17.185 1.00 0.00 C ATOM 0 H ILE A 110 -12.101 -8.352 -19.172 1.00 0.00 H new ATOM 0 HA ILE A 110 -9.296 -8.102 -18.412 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.853 -8.689 -16.847 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -11.816 -6.485 -18.042 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.851 -6.315 -16.298 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -10.530 -7.986 -14.864 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -9.818 -9.422 -15.638 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -9.086 -7.820 -15.890 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.183 -4.793 -17.293 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.387 -6.007 -16.264 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.351 -6.180 -18.035 1.00 0.00 H new ATOM 1755 N ARG A 111 -8.855 -10.615 -18.638 1.00 0.00 N ATOM 1756 CA ARG A 111 -8.507 -12.046 -18.448 1.00 0.00 C ATOM 1757 C ARG A 111 -7.496 -12.168 -17.320 1.00 0.00 C ATOM 1758 O ARG A 111 -6.479 -11.506 -17.302 1.00 0.00 O ATOM 1759 CB ARG A 111 -7.911 -12.616 -19.729 1.00 0.00 C ATOM 1760 CG ARG A 111 -9.042 -13.098 -20.632 1.00 0.00 C ATOM 1761 CD ARG A 111 -8.534 -13.203 -22.072 1.00 0.00 C ATOM 1762 NE ARG A 111 -7.402 -14.170 -22.132 1.00 0.00 N ATOM 1763 CZ ARG A 111 -6.851 -14.454 -23.279 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -7.293 -13.889 -24.370 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -5.860 -15.302 -23.338 1.00 0.00 N ATOM 0 H ARG A 111 -8.232 -10.086 -19.249 1.00 0.00 H new ATOM 0 HA ARG A 111 -9.409 -12.605 -18.199 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -7.320 -11.856 -20.240 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -7.238 -13.441 -19.496 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -9.406 -14.067 -20.292 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -9.883 -12.406 -20.581 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -9.340 -13.529 -22.730 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -8.209 -12.225 -22.426 1.00 0.00 H new ATOM 0 HE ARG A 111 -7.059 -14.609 -21.278 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -8.068 -13.227 -24.324 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -6.864 -14.110 -25.269 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -5.515 -15.744 -22.486 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -5.430 -15.523 -24.236 1.00 0.00 H new ATOM 1779 N LEU A 112 -7.773 -13.004 -16.369 1.00 0.00 N ATOM 1780 CA LEU A 112 -6.830 -13.158 -15.232 1.00 0.00 C ATOM 1781 C LEU A 112 -5.999 -14.427 -15.423 1.00 0.00 C ATOM 1782 O LEU A 112 -6.500 -15.529 -15.327 1.00 0.00 O ATOM 1783 CB LEU A 112 -7.624 -13.261 -13.931 1.00 0.00 C ATOM 1784 CG LEU A 112 -8.671 -12.145 -13.881 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -9.321 -12.116 -12.495 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -8.009 -10.792 -14.161 1.00 0.00 C ATOM 0 H LEU A 112 -8.609 -13.587 -16.327 1.00 0.00 H new ATOM 0 HA LEU A 112 -6.166 -12.295 -15.190 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.111 -14.234 -13.866 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.953 -13.183 -13.076 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.431 -12.335 -14.639 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.066 -11.322 -12.459 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.802 -13.074 -12.299 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.558 -11.932 -11.739 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.761 -10.004 -14.123 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.244 -10.599 -13.409 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.551 -10.809 -15.150 1.00 0.00 H new ATOM 1798 N SER A 113 -4.731 -14.280 -15.682 1.00 0.00 N ATOM 1799 CA SER A 113 -3.868 -15.479 -15.866 1.00 0.00 C ATOM 1800 C SER A 113 -3.475 -16.029 -14.495 1.00 0.00 C ATOM 1801 O SER A 113 -3.702 -15.400 -13.480 1.00 0.00 O ATOM 1802 CB SER A 113 -2.612 -15.091 -16.644 1.00 0.00 C ATOM 1803 OG SER A 113 -2.985 -14.651 -17.943 1.00 0.00 O ATOM 0 H SER A 113 -4.255 -13.383 -15.774 1.00 0.00 H new ATOM 0 HA SER A 113 -4.413 -16.241 -16.423 1.00 0.00 H new ATOM 0 HB2 SER A 113 -2.074 -14.301 -16.120 1.00 0.00 H new ATOM 0 HB3 SER A 113 -1.936 -15.943 -16.716 1.00 0.00 H new ATOM 0 HG SER A 113 -2.183 -14.399 -18.446 1.00 0.00 H new ATOM 1809 N HIS A 114 -2.891 -17.194 -14.449 1.00 0.00 N ATOM 1810 CA HIS A 114 -2.492 -17.766 -13.133 1.00 0.00 C ATOM 1811 C HIS A 114 -1.859 -16.665 -12.277 1.00 0.00 C ATOM 1812 O HIS A 114 -0.689 -16.360 -12.401 1.00 0.00 O ATOM 1813 CB HIS A 114 -1.482 -18.895 -13.346 1.00 0.00 C ATOM 1814 CG HIS A 114 -0.271 -18.653 -12.487 1.00 0.00 C ATOM 1815 ND1 HIS A 114 -0.121 -18.519 -11.126 1.00 0.00 N flip ATOM 1816 CD2 HIS A 114 0.997 -18.489 -13.024 1.00 0.00 C flip ATOM 1817 CE1 HIS A 114 1.215 -18.276 -10.829 1.00 0.00 C flip ATOM 1818 NE2 HIS A 114 1.846 -18.266 -12.002 1.00 0.00 N flip ATOM 0 H HIS A 114 -2.674 -17.772 -15.261 1.00 0.00 H new ATOM 0 HA HIS A 114 -3.371 -18.164 -12.627 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -1.934 -19.854 -13.094 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -1.192 -18.945 -14.396 1.00 0.00 H new ATOM 0 HD2 HIS A 114 1.257 -18.532 -14.071 1.00 0.00 H new ATOM 0 HE1 HIS A 114 1.650 -18.127 -9.852 1.00 0.00 H new ATOM 0 HE2 HIS A 114 2.848 -18.109 -12.113 1.00 0.00 H new ATOM 1827 N GLU A 115 -2.625 -16.059 -11.412 1.00 0.00 N ATOM 1828 CA GLU A 115 -2.069 -14.976 -10.551 1.00 0.00 C ATOM 1829 C GLU A 115 -3.209 -14.317 -9.777 1.00 0.00 C ATOM 1830 O GLU A 115 -3.244 -14.336 -8.563 1.00 0.00 O ATOM 1831 CB GLU A 115 -1.388 -13.918 -11.426 1.00 0.00 C ATOM 1832 CG GLU A 115 -0.018 -13.571 -10.842 1.00 0.00 C ATOM 1833 CD GLU A 115 0.686 -12.574 -11.762 1.00 0.00 C ATOM 1834 OE1 GLU A 115 0.241 -12.425 -12.889 1.00 0.00 O ATOM 1835 OE2 GLU A 115 1.655 -11.974 -11.326 1.00 0.00 O ATOM 0 H GLU A 115 -3.613 -16.267 -11.264 1.00 0.00 H new ATOM 0 HA GLU A 115 -1.342 -15.402 -9.860 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -1.276 -14.291 -12.444 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -2.008 -13.023 -11.481 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -0.132 -13.145 -9.845 1.00 0.00 H new ATOM 0 HG3 GLU A 115 0.584 -14.473 -10.736 1.00 0.00 H new ATOM 1843 N HIS A 116 -4.140 -13.735 -10.478 1.00 0.00 N ATOM 1844 CA HIS A 116 -5.284 -13.068 -9.801 1.00 0.00 C ATOM 1845 C HIS A 116 -6.579 -13.808 -10.133 1.00 0.00 C ATOM 1846 O HIS A 116 -6.753 -14.317 -11.221 1.00 0.00 O ATOM 1847 CB HIS A 116 -5.391 -11.624 -10.292 1.00 0.00 C ATOM 1848 CG HIS A 116 -4.253 -10.812 -9.736 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -2.973 -10.875 -10.266 1.00 0.00 N ATOM 1850 CD2 HIS A 116 -4.192 -9.903 -8.709 1.00 0.00 C ATOM 1851 CE1 HIS A 116 -2.201 -10.025 -9.561 1.00 0.00 C ATOM 1852 NE2 HIS A 116 -2.896 -9.409 -8.603 1.00 0.00 N ATOM 0 H HIS A 116 -4.157 -13.693 -11.497 1.00 0.00 H new ATOM 0 HA HIS A 116 -5.123 -13.081 -8.723 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -5.370 -11.598 -11.381 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -6.343 -11.194 -9.981 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -5.022 -9.616 -8.080 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -1.150 -9.862 -9.748 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -2.550 -8.721 -7.934 1.00 0.00 H new ATOM 1861 N GLN A 117 -7.491 -13.867 -9.205 1.00 0.00 N ATOM 1862 CA GLN A 117 -8.779 -14.565 -9.472 1.00 0.00 C ATOM 1863 C GLN A 117 -9.930 -13.649 -9.050 1.00 0.00 C ATOM 1864 O GLN A 117 -10.922 -14.086 -8.503 1.00 0.00 O ATOM 1865 CB GLN A 117 -8.830 -15.869 -8.673 1.00 0.00 C ATOM 1866 CG GLN A 117 -9.999 -16.728 -9.163 1.00 0.00 C ATOM 1867 CD GLN A 117 -9.687 -17.273 -10.559 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -8.660 -17.887 -10.772 1.00 0.00 O ATOM 1869 NE2 GLN A 117 -10.539 -17.071 -11.525 1.00 0.00 N ATOM 0 H GLN A 117 -7.401 -13.462 -8.273 1.00 0.00 H new ATOM 0 HA GLN A 117 -8.865 -14.799 -10.533 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -7.893 -16.414 -8.787 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -8.945 -15.652 -7.611 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -10.173 -17.552 -8.471 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -10.913 -16.135 -9.189 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -11.401 -16.556 -11.346 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -10.344 -17.428 -12.460 1.00 0.00 H new ATOM 1878 N ALA A 118 -9.802 -12.374 -9.300 1.00 0.00 N ATOM 1879 CA ALA A 118 -10.887 -11.431 -8.913 1.00 0.00 C ATOM 1880 C ALA A 118 -10.589 -10.044 -9.471 1.00 0.00 C ATOM 1881 O ALA A 118 -9.513 -9.515 -9.294 1.00 0.00 O ATOM 1882 CB ALA A 118 -10.961 -11.334 -7.392 1.00 0.00 C ATOM 0 H ALA A 118 -8.995 -11.947 -9.754 1.00 0.00 H new ATOM 0 HA ALA A 118 -11.832 -11.798 -9.313 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -11.756 -10.643 -7.110 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.171 -12.319 -6.974 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -10.010 -10.970 -7.004 1.00 0.00 H new ATOM 1888 N TYR A 119 -11.539 -9.440 -10.127 1.00 0.00 N ATOM 1889 CA TYR A 119 -11.308 -8.074 -10.668 1.00 0.00 C ATOM 1890 C TYR A 119 -12.642 -7.336 -10.764 1.00 0.00 C ATOM 1891 O TYR A 119 -13.664 -7.919 -11.072 1.00 0.00 O ATOM 1892 CB TYR A 119 -10.645 -8.172 -12.040 1.00 0.00 C ATOM 1893 CG TYR A 119 -11.641 -8.582 -13.086 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -11.977 -9.930 -13.243 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -12.214 -7.615 -13.916 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -12.890 -10.313 -14.230 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -13.126 -7.997 -14.908 1.00 0.00 C ATOM 1898 CZ TYR A 119 -13.464 -9.347 -15.065 1.00 0.00 C ATOM 1899 OH TYR A 119 -14.360 -9.725 -16.043 1.00 0.00 O ATOM 0 H TYR A 119 -12.462 -9.832 -10.311 1.00 0.00 H new ATOM 0 HA TYR A 119 -10.647 -7.518 -10.003 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -10.206 -7.210 -12.306 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -9.830 -8.895 -12.004 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -11.531 -10.676 -12.602 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -11.954 -6.574 -13.793 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -13.152 -11.354 -14.348 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -13.568 -7.251 -15.551 1.00 0.00 H new ATOM 0 HH TYR A 119 -14.664 -8.932 -16.532 1.00 0.00 H new ATOM 1909 N ARG A 120 -12.651 -6.059 -10.489 1.00 0.00 N ATOM 1910 CA ARG A 120 -13.930 -5.300 -10.551 1.00 0.00 C ATOM 1911 C ARG A 120 -13.680 -3.896 -11.101 1.00 0.00 C ATOM 1912 O ARG A 120 -12.610 -3.343 -10.959 1.00 0.00 O ATOM 1913 CB ARG A 120 -14.497 -5.139 -9.139 1.00 0.00 C ATOM 1914 CG ARG A 120 -14.452 -6.465 -8.383 1.00 0.00 C ATOM 1915 CD ARG A 120 -14.804 -6.217 -6.909 1.00 0.00 C ATOM 1916 NE ARG A 120 -16.278 -6.042 -6.770 1.00 0.00 N ATOM 1917 CZ ARG A 120 -16.779 -5.510 -5.686 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -15.990 -5.119 -4.721 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -18.073 -5.366 -5.566 1.00 0.00 N ATOM 0 H ARG A 120 -11.831 -5.512 -10.225 1.00 0.00 H new ATOM 0 HA ARG A 120 -14.622 -5.845 -11.193 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -13.925 -4.386 -8.596 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.525 -4.781 -9.194 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -15.155 -7.173 -8.823 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -13.460 -6.910 -8.463 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -14.468 -7.055 -6.298 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -14.286 -5.329 -6.545 1.00 0.00 H new ATOM 0 HE ARG A 120 -16.898 -6.339 -7.524 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -14.980 -5.228 -4.812 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -16.384 -4.704 -3.877 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -18.692 -5.669 -6.318 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -18.464 -4.951 -4.720 1.00 0.00 H new ATOM 1933 N TRP A 121 -14.683 -3.298 -11.681 1.00 0.00 N ATOM 1934 CA TRP A 121 -14.535 -1.907 -12.188 1.00 0.00 C ATOM 1935 C TRP A 121 -15.314 -0.999 -11.234 1.00 0.00 C ATOM 1936 O TRP A 121 -16.529 -0.978 -11.240 1.00 0.00 O ATOM 1937 CB TRP A 121 -15.112 -1.809 -13.603 1.00 0.00 C ATOM 1938 CG TRP A 121 -14.118 -2.338 -14.587 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -14.052 -3.620 -15.021 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -13.050 -1.621 -15.267 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -13.014 -3.729 -15.929 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -12.366 -2.524 -16.112 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -12.615 -0.288 -15.232 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -11.288 -2.114 -16.898 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -11.530 0.127 -16.019 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -10.868 -0.786 -16.851 1.00 0.00 C ATOM 0 H TRP A 121 -15.602 -3.715 -11.826 1.00 0.00 H new ATOM 0 HA TRP A 121 -13.487 -1.612 -12.231 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -16.041 -2.376 -13.668 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -15.354 -0.772 -13.837 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -14.702 -4.424 -14.709 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -12.759 -4.594 -16.405 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -13.119 0.424 -14.595 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -10.782 -2.821 -17.539 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -11.203 1.156 -15.983 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -10.034 -0.461 -17.455 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.630 -0.286 -10.379 1.00 0.00 N ATOM 1958 CA LEU A 122 -15.345 0.571 -9.389 1.00 0.00 C ATOM 1959 C LEU A 122 -14.852 2.017 -9.452 1.00 0.00 C ATOM 1960 O LEU A 122 -13.905 2.340 -10.143 1.00 0.00 O ATOM 1961 CB LEU A 122 -15.095 0.041 -7.977 1.00 0.00 C ATOM 1962 CG LEU A 122 -14.566 -1.396 -8.023 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -13.177 -1.436 -7.389 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -15.515 -2.319 -7.251 1.00 0.00 C ATOM 0 H LEU A 122 -13.612 -0.260 -10.323 1.00 0.00 H new ATOM 0 HA LEU A 122 -16.408 0.544 -9.630 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -14.377 0.682 -7.465 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -16.020 0.075 -7.402 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.506 -1.734 -9.058 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.793 -2.456 -7.418 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.505 -0.780 -7.942 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -13.240 -1.101 -6.354 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -15.137 -3.341 -7.285 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -15.579 -1.990 -6.214 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -16.506 -2.284 -7.704 1.00 0.00 H new ATOM 1976 N GLY A 123 -15.497 2.886 -8.720 1.00 0.00 N ATOM 1977 CA GLY A 123 -15.093 4.321 -8.710 1.00 0.00 C ATOM 1978 C GLY A 123 -13.976 4.550 -7.685 1.00 0.00 C ATOM 1979 O GLY A 123 -13.513 3.633 -7.035 1.00 0.00 O ATOM 0 H GLY A 123 -16.293 2.660 -8.124 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -14.752 4.617 -9.702 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -15.952 4.946 -8.468 1.00 0.00 H new ATOM 1983 N LEU A 124 -13.540 5.773 -7.546 1.00 0.00 N ATOM 1984 CA LEU A 124 -12.447 6.091 -6.577 1.00 0.00 C ATOM 1985 C LEU A 124 -12.820 5.645 -5.163 1.00 0.00 C ATOM 1986 O LEU A 124 -12.044 5.010 -4.478 1.00 0.00 O ATOM 1987 CB LEU A 124 -12.213 7.605 -6.583 1.00 0.00 C ATOM 1988 CG LEU A 124 -11.321 8.019 -5.407 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -10.056 7.155 -5.364 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -10.923 9.486 -5.580 1.00 0.00 C ATOM 0 H LEU A 124 -13.897 6.574 -8.067 1.00 0.00 H new ATOM 0 HA LEU A 124 -11.544 5.560 -6.877 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -11.747 7.902 -7.522 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -13.168 8.126 -6.523 1.00 0.00 H new ATOM 0 HG LEU A 124 -11.871 7.882 -4.476 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -9.434 7.462 -4.523 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -10.334 6.108 -5.246 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -9.499 7.280 -6.292 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -10.288 9.791 -4.748 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -10.378 9.607 -6.516 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -11.819 10.106 -5.599 1.00 0.00 H new ATOM 2002 N GLU A 125 -13.989 5.985 -4.711 1.00 0.00 N ATOM 2003 CA GLU A 125 -14.382 5.594 -3.330 1.00 0.00 C ATOM 2004 C GLU A 125 -14.314 4.074 -3.175 1.00 0.00 C ATOM 2005 O GLU A 125 -13.665 3.567 -2.283 1.00 0.00 O ATOM 2006 CB GLU A 125 -15.798 6.093 -3.046 1.00 0.00 C ATOM 2007 CG GLU A 125 -16.824 5.192 -3.738 1.00 0.00 C ATOM 2008 CD GLU A 125 -18.207 5.840 -3.653 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -18.305 6.902 -3.060 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -19.142 5.264 -4.182 1.00 0.00 O ATOM 0 H GLU A 125 -14.688 6.514 -5.233 1.00 0.00 H new ATOM 0 HA GLU A 125 -13.693 6.045 -2.616 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -15.979 6.104 -1.971 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -15.908 7.119 -3.398 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -16.545 5.039 -4.781 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -16.840 4.210 -3.265 1.00 0.00 H new ATOM 2018 N GLU A 126 -14.962 3.335 -4.030 1.00 0.00 N ATOM 2019 CA GLU A 126 -14.904 1.855 -3.904 1.00 0.00 C ATOM 2020 C GLU A 126 -13.468 1.384 -4.135 1.00 0.00 C ATOM 2021 O GLU A 126 -13.001 0.455 -3.512 1.00 0.00 O ATOM 2022 CB GLU A 126 -15.836 1.208 -4.920 1.00 0.00 C ATOM 2023 CG GLU A 126 -15.805 -0.301 -4.723 1.00 0.00 C ATOM 2024 CD GLU A 126 -17.080 -0.917 -5.296 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -17.310 -2.090 -5.048 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -17.807 -0.208 -5.972 1.00 0.00 O ATOM 0 H GLU A 126 -15.524 3.688 -4.804 1.00 0.00 H new ATOM 0 HA GLU A 126 -15.223 1.564 -2.903 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -16.851 1.584 -4.794 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.525 1.463 -5.933 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -14.930 -0.725 -5.216 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -15.719 -0.538 -3.663 1.00 0.00 H new ATOM 2034 N ALA A 127 -12.758 2.026 -5.016 1.00 0.00 N ATOM 2035 CA ALA A 127 -11.348 1.624 -5.260 1.00 0.00 C ATOM 2036 C ALA A 127 -10.523 1.979 -4.021 1.00 0.00 C ATOM 2037 O ALA A 127 -9.533 1.347 -3.706 1.00 0.00 O ATOM 2038 CB ALA A 127 -10.806 2.387 -6.471 1.00 0.00 C ATOM 0 H ALA A 127 -13.092 2.810 -5.577 1.00 0.00 H new ATOM 0 HA ALA A 127 -11.289 0.553 -5.455 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.772 2.094 -6.652 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.409 2.153 -7.348 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.851 3.458 -6.276 1.00 0.00 H new ATOM 2044 N CYS A 128 -10.934 3.003 -3.320 1.00 0.00 N ATOM 2045 CA CYS A 128 -10.196 3.438 -2.100 1.00 0.00 C ATOM 2046 C CYS A 128 -10.311 2.377 -0.996 1.00 0.00 C ATOM 2047 O CYS A 128 -9.350 2.083 -0.312 1.00 0.00 O ATOM 2048 CB CYS A 128 -10.787 4.761 -1.605 1.00 0.00 C ATOM 2049 SG CYS A 128 -11.143 4.635 0.164 1.00 0.00 S ATOM 0 H CYS A 128 -11.758 3.561 -3.544 1.00 0.00 H new ATOM 0 HA CYS A 128 -9.142 3.569 -2.347 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -10.087 5.576 -1.789 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -11.699 4.993 -2.155 1.00 0.00 H new ATOM 0 HG CYS A 128 -12.257 3.987 0.337 1.00 0.00 H new ATOM 2055 N GLN A 129 -11.472 1.801 -0.807 1.00 0.00 N ATOM 2056 CA GLN A 129 -11.612 0.765 0.266 1.00 0.00 C ATOM 2057 C GLN A 129 -10.803 -0.472 -0.113 1.00 0.00 C ATOM 2058 O GLN A 129 -10.034 -0.995 0.673 1.00 0.00 O ATOM 2059 CB GLN A 129 -13.080 0.350 0.452 1.00 0.00 C ATOM 2060 CG GLN A 129 -13.918 0.790 -0.745 1.00 0.00 C ATOM 2061 CD GLN A 129 -14.560 2.144 -0.442 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -13.886 3.068 -0.038 1.00 0.00 O ATOM 2063 NE2 GLN A 129 -15.844 2.300 -0.622 1.00 0.00 N ATOM 0 H GLN A 129 -12.319 1.998 -1.340 1.00 0.00 H new ATOM 0 HA GLN A 129 -11.246 1.195 1.198 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -13.146 -0.732 0.571 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -13.477 0.796 1.364 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -13.292 0.862 -1.635 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -14.688 0.048 -0.956 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -16.410 1.522 -0.962 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -16.281 3.200 -0.423 1.00 0.00 H new ATOM 2072 N LEU A 130 -10.983 -0.957 -1.306 1.00 0.00 N ATOM 2073 CA LEU A 130 -10.248 -2.170 -1.739 1.00 0.00 C ATOM 2074 C LEU A 130 -8.736 -1.939 -1.641 1.00 0.00 C ATOM 2075 O LEU A 130 -8.012 -2.750 -1.100 1.00 0.00 O ATOM 2076 CB LEU A 130 -10.629 -2.473 -3.183 1.00 0.00 C ATOM 2077 CG LEU A 130 -12.150 -2.564 -3.300 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -12.517 -2.837 -4.749 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -12.685 -3.702 -2.426 1.00 0.00 C ATOM 0 H LEU A 130 -11.613 -0.561 -2.004 1.00 0.00 H new ATOM 0 HA LEU A 130 -10.510 -3.009 -1.094 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -10.249 -1.692 -3.842 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -10.172 -3.410 -3.502 1.00 0.00 H new ATOM 0 HG LEU A 130 -12.590 -1.624 -2.967 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -13.601 -2.904 -4.843 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -12.147 -2.026 -5.377 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -12.066 -3.777 -5.068 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -13.770 -3.754 -2.520 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -12.247 -4.646 -2.750 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -12.420 -3.517 -1.385 1.00 0.00 H new ATOM 2091 N ALA A 131 -8.244 -0.842 -2.150 1.00 0.00 N ATOM 2092 CA ALA A 131 -6.778 -0.594 -2.065 1.00 0.00 C ATOM 2093 C ALA A 131 -6.357 -0.613 -0.594 1.00 0.00 C ATOM 2094 O ALA A 131 -5.528 -1.399 -0.186 1.00 0.00 O ATOM 2095 CB ALA A 131 -6.452 0.768 -2.673 1.00 0.00 C ATOM 0 H ALA A 131 -8.787 -0.115 -2.616 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.240 -1.367 -2.614 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.379 0.947 -2.610 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -6.761 0.783 -3.718 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -6.983 1.547 -2.126 1.00 0.00 H new ATOM 2101 N GLN A 132 -6.947 0.228 0.209 1.00 0.00 N ATOM 2102 CA GLN A 132 -6.610 0.244 1.662 1.00 0.00 C ATOM 2103 C GLN A 132 -5.188 0.776 1.893 1.00 0.00 C ATOM 2104 O GLN A 132 -4.756 0.926 3.020 1.00 0.00 O ATOM 2105 CB GLN A 132 -6.731 -1.184 2.218 1.00 0.00 C ATOM 2106 CG GLN A 132 -5.355 -1.726 2.626 1.00 0.00 C ATOM 2107 CD GLN A 132 -5.473 -3.221 2.940 1.00 0.00 C ATOM 2108 OE1 GLN A 132 -5.757 -4.015 2.065 1.00 0.00 O ATOM 2109 NE2 GLN A 132 -5.262 -3.640 4.158 1.00 0.00 N ATOM 0 H GLN A 132 -7.651 0.908 -0.079 1.00 0.00 H new ATOM 0 HA GLN A 132 -7.304 0.907 2.178 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -7.399 -1.189 3.079 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -7.176 -1.836 1.466 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -4.636 -1.567 1.823 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -4.983 -1.188 3.498 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -5.024 -2.974 4.892 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -5.335 -4.634 4.375 1.00 0.00 H new ATOM 2118 N PHE A 133 -4.452 1.073 0.854 1.00 0.00 N ATOM 2119 CA PHE A 133 -3.067 1.595 1.066 1.00 0.00 C ATOM 2120 C PHE A 133 -3.070 3.116 0.885 1.00 0.00 C ATOM 2121 O PHE A 133 -3.728 3.644 0.010 1.00 0.00 O ATOM 2122 CB PHE A 133 -2.105 0.966 0.057 1.00 0.00 C ATOM 2123 CG PHE A 133 -2.385 -0.511 -0.073 1.00 0.00 C ATOM 2124 CD1 PHE A 133 -1.813 -1.422 0.823 1.00 0.00 C ATOM 2125 CD2 PHE A 133 -3.212 -0.971 -1.105 1.00 0.00 C ATOM 2126 CE1 PHE A 133 -2.070 -2.794 0.686 1.00 0.00 C ATOM 2127 CE2 PHE A 133 -3.470 -2.339 -1.241 1.00 0.00 C ATOM 2128 CZ PHE A 133 -2.899 -3.250 -0.346 1.00 0.00 C ATOM 0 H PHE A 133 -4.743 0.979 -0.119 1.00 0.00 H new ATOM 0 HA PHE A 133 -2.739 1.340 2.074 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -2.214 1.452 -0.913 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -1.075 1.122 0.378 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -1.174 -1.069 1.619 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -3.652 -0.268 -1.797 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -1.629 -3.498 1.376 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -4.110 -2.692 -2.036 1.00 0.00 H new ATOM 0 HZ PHE A 133 -3.098 -4.306 -0.451 1.00 0.00 H new ATOM 2138 N LYS A 134 -2.349 3.825 1.712 1.00 0.00 N ATOM 2139 CA LYS A 134 -2.321 5.313 1.587 1.00 0.00 C ATOM 2140 C LYS A 134 -1.826 5.711 0.197 1.00 0.00 C ATOM 2141 O LYS A 134 -2.384 6.580 -0.444 1.00 0.00 O ATOM 2142 CB LYS A 134 -1.379 5.903 2.638 1.00 0.00 C ATOM 2143 CG LYS A 134 -1.454 7.432 2.588 1.00 0.00 C ATOM 2144 CD LYS A 134 -0.466 8.028 3.595 1.00 0.00 C ATOM 2145 CE LYS A 134 -0.635 9.548 3.642 1.00 0.00 C ATOM 2146 NZ LYS A 134 -1.701 9.898 4.622 1.00 0.00 N ATOM 0 H LYS A 134 -1.780 3.441 2.466 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.330 5.697 1.739 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -1.655 5.547 3.630 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -0.357 5.572 2.453 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -1.222 7.785 1.583 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -2.467 7.764 2.817 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -0.638 7.602 4.584 1.00 0.00 H new ATOM 0 HD3 LYS A 134 0.555 7.774 3.311 1.00 0.00 H new ATOM 0 HE2 LYS A 134 0.305 10.021 3.926 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -0.896 9.927 2.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -1.817 10.931 4.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -2.598 9.458 4.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -1.434 9.549 5.565 1.00 0.00 H new ATOM 2160 N GLU A 135 -0.781 5.089 -0.278 1.00 0.00 N ATOM 2161 CA GLU A 135 -0.265 5.452 -1.624 1.00 0.00 C ATOM 2162 C GLU A 135 -1.288 5.059 -2.685 1.00 0.00 C ATOM 2163 O GLU A 135 -1.634 5.847 -3.538 1.00 0.00 O ATOM 2164 CB GLU A 135 1.042 4.716 -1.888 1.00 0.00 C ATOM 2165 CG GLU A 135 2.102 5.176 -0.887 1.00 0.00 C ATOM 2166 CD GLU A 135 3.422 4.473 -1.189 1.00 0.00 C ATOM 2167 OE1 GLU A 135 3.402 3.536 -1.969 1.00 0.00 O ATOM 2168 OE2 GLU A 135 4.429 4.879 -0.636 1.00 0.00 O ATOM 0 H GLU A 135 -0.268 4.352 0.205 1.00 0.00 H new ATOM 0 HA GLU A 135 -0.091 6.527 -1.664 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.889 3.640 -1.802 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.381 4.909 -2.906 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.231 6.257 -0.947 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.781 4.950 0.130 1.00 0.00 H new ATOM 2176 N MET A 136 -1.786 3.853 -2.633 1.00 0.00 N ATOM 2177 CA MET A 136 -2.793 3.437 -3.646 1.00 0.00 C ATOM 2178 C MET A 136 -3.968 4.391 -3.588 1.00 0.00 C ATOM 2179 O MET A 136 -4.458 4.860 -4.595 1.00 0.00 O ATOM 2180 CB MET A 136 -3.310 2.037 -3.326 1.00 0.00 C ATOM 2181 CG MET A 136 -2.294 0.987 -3.765 1.00 0.00 C ATOM 2182 SD MET A 136 -3.028 -0.118 -5.001 1.00 0.00 S ATOM 2183 CE MET A 136 -3.944 1.112 -5.969 1.00 0.00 C ATOM 0 H MET A 136 -1.541 3.146 -1.940 1.00 0.00 H new ATOM 0 HA MET A 136 -2.328 3.445 -4.632 1.00 0.00 H new ATOM 0 HB2 MET A 136 -3.498 1.947 -2.256 1.00 0.00 H new ATOM 0 HB3 MET A 136 -4.260 1.868 -3.832 1.00 0.00 H new ATOM 0 HG2 MET A 136 -1.413 1.475 -4.181 1.00 0.00 H new ATOM 0 HG3 MET A 136 -1.961 0.410 -2.902 1.00 0.00 H new ATOM 0 HE1 MET A 136 -4.105 0.734 -6.979 1.00 0.00 H new ATOM 0 HE2 MET A 136 -4.907 1.304 -5.496 1.00 0.00 H new ATOM 0 HE3 MET A 136 -3.371 2.038 -6.015 1.00 0.00 H new ATOM 2193 N LYS A 137 -4.426 4.679 -2.409 1.00 0.00 N ATOM 2194 CA LYS A 137 -5.571 5.601 -2.278 1.00 0.00 C ATOM 2195 C LYS A 137 -5.185 6.937 -2.902 1.00 0.00 C ATOM 2196 O LYS A 137 -5.896 7.481 -3.723 1.00 0.00 O ATOM 2197 CB LYS A 137 -5.887 5.799 -0.799 1.00 0.00 C ATOM 2198 CG LYS A 137 -7.180 6.597 -0.665 1.00 0.00 C ATOM 2199 CD LYS A 137 -7.476 6.854 0.811 1.00 0.00 C ATOM 2200 CE LYS A 137 -8.891 7.408 0.950 1.00 0.00 C ATOM 2201 NZ LYS A 137 -9.204 7.620 2.392 1.00 0.00 N ATOM 0 H LYS A 137 -4.055 4.314 -1.532 1.00 0.00 H new ATOM 0 HA LYS A 137 -6.448 5.194 -2.781 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -5.989 4.833 -0.304 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -5.069 6.325 -0.307 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -7.091 7.544 -1.198 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -8.005 6.050 -1.121 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -7.377 5.930 1.380 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -6.754 7.560 1.221 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -8.980 8.348 0.406 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -9.609 6.716 0.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -10.168 7.998 2.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -9.136 6.714 2.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -8.526 8.296 2.799 1.00 0.00 H new ATOM 2215 N ALA A 138 -4.048 7.458 -2.528 1.00 0.00 N ATOM 2216 CA ALA A 138 -3.595 8.752 -3.105 1.00 0.00 C ATOM 2217 C ALA A 138 -3.247 8.547 -4.580 1.00 0.00 C ATOM 2218 O ALA A 138 -3.573 9.364 -5.421 1.00 0.00 O ATOM 2219 CB ALA A 138 -2.365 9.255 -2.350 1.00 0.00 C ATOM 0 H ALA A 138 -3.414 7.041 -1.847 1.00 0.00 H new ATOM 0 HA ALA A 138 -4.392 9.491 -3.015 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -2.038 10.203 -2.777 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -2.617 9.398 -1.299 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -1.562 8.523 -2.434 1.00 0.00 H new ATOM 2225 N ALA A 139 -2.602 7.458 -4.911 1.00 0.00 N ATOM 2226 CA ALA A 139 -2.264 7.218 -6.340 1.00 0.00 C ATOM 2227 C ALA A 139 -3.562 7.240 -7.138 1.00 0.00 C ATOM 2228 O ALA A 139 -3.657 7.853 -8.184 1.00 0.00 O ATOM 2229 CB ALA A 139 -1.596 5.849 -6.499 1.00 0.00 C ATOM 0 H ALA A 139 -2.299 6.734 -4.260 1.00 0.00 H new ATOM 0 HA ALA A 139 -1.577 7.986 -6.696 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.352 5.683 -7.548 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -0.682 5.819 -5.905 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -2.277 5.070 -6.157 1.00 0.00 H new ATOM 2235 N LEU A 140 -4.571 6.587 -6.631 1.00 0.00 N ATOM 2236 CA LEU A 140 -5.885 6.575 -7.325 1.00 0.00 C ATOM 2237 C LEU A 140 -6.509 7.968 -7.234 1.00 0.00 C ATOM 2238 O LEU A 140 -7.058 8.480 -8.191 1.00 0.00 O ATOM 2239 CB LEU A 140 -6.804 5.560 -6.641 1.00 0.00 C ATOM 2240 CG LEU A 140 -6.404 4.144 -7.056 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -6.749 3.167 -5.930 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -7.179 3.754 -8.313 1.00 0.00 C ATOM 0 H LEU A 140 -4.539 6.058 -5.759 1.00 0.00 H new ATOM 0 HA LEU A 140 -5.751 6.300 -8.371 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -6.736 5.665 -5.558 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -7.841 5.751 -6.916 1.00 0.00 H new ATOM 0 HG LEU A 140 -5.333 4.109 -7.255 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -6.464 2.157 -6.225 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -6.208 3.447 -5.026 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -7.821 3.200 -5.736 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -6.899 2.745 -8.615 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -8.249 3.787 -8.106 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -6.944 4.452 -9.117 1.00 0.00 H new ATOM 2254 N GLN A 141 -6.420 8.587 -6.087 1.00 0.00 N ATOM 2255 CA GLN A 141 -6.998 9.951 -5.927 1.00 0.00 C ATOM 2256 C GLN A 141 -6.180 10.946 -6.750 1.00 0.00 C ATOM 2257 O GLN A 141 -6.724 11.745 -7.486 1.00 0.00 O ATOM 2258 CB GLN A 141 -6.977 10.341 -4.442 1.00 0.00 C ATOM 2259 CG GLN A 141 -6.378 11.739 -4.266 1.00 0.00 C ATOM 2260 CD GLN A 141 -6.488 12.148 -2.796 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -7.017 11.319 -1.938 1.00 0.00 O flip ATOM 2262 NE2 GLN A 141 -6.089 13.235 -2.426 1.00 0.00 N flip ATOM 0 H GLN A 141 -5.971 8.206 -5.254 1.00 0.00 H new ATOM 0 HA GLN A 141 -8.029 9.963 -6.281 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.990 10.319 -4.039 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -6.393 9.614 -3.877 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -5.334 11.744 -4.581 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -6.904 12.456 -4.896 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -5.676 13.882 -3.097 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -6.167 13.500 -1.444 1.00 0.00 H new ATOM 2271 N GLU A 142 -4.881 10.900 -6.645 1.00 0.00 N ATOM 2272 CA GLU A 142 -4.048 11.841 -7.439 1.00 0.00 C ATOM 2273 C GLU A 142 -4.216 11.507 -8.919 1.00 0.00 C ATOM 2274 O GLU A 142 -4.269 12.378 -9.764 1.00 0.00 O ATOM 2275 CB GLU A 142 -2.577 11.696 -7.040 1.00 0.00 C ATOM 2276 CG GLU A 142 -2.392 12.142 -5.587 1.00 0.00 C ATOM 2277 CD GLU A 142 -2.773 13.618 -5.446 1.00 0.00 C ATOM 2278 OE1 GLU A 142 -2.811 14.299 -6.457 1.00 0.00 O ATOM 2279 OE2 GLU A 142 -3.019 14.040 -4.329 1.00 0.00 O ATOM 0 H GLU A 142 -4.364 10.255 -6.047 1.00 0.00 H new ATOM 0 HA GLU A 142 -4.363 12.867 -7.249 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -2.259 10.660 -7.156 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -1.950 12.298 -7.698 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -3.011 11.533 -4.928 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -1.357 11.993 -5.280 1.00 0.00 H new ATOM 2287 N GLY A 143 -4.315 10.247 -9.236 1.00 0.00 N ATOM 2288 CA GLY A 143 -4.500 9.854 -10.659 1.00 0.00 C ATOM 2289 C GLY A 143 -5.805 10.459 -11.170 1.00 0.00 C ATOM 2290 O GLY A 143 -5.870 10.996 -12.255 1.00 0.00 O ATOM 0 H GLY A 143 -4.276 9.474 -8.572 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.661 10.205 -11.260 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.526 8.768 -10.750 1.00 0.00 H new ATOM 2294 N HIS A 144 -6.844 10.388 -10.378 1.00 0.00 N ATOM 2295 CA HIS A 144 -8.149 10.968 -10.803 1.00 0.00 C ATOM 2296 C HIS A 144 -7.984 12.476 -11.003 1.00 0.00 C ATOM 2297 O HIS A 144 -8.587 13.065 -11.877 1.00 0.00 O ATOM 2298 CB HIS A 144 -9.204 10.705 -9.723 1.00 0.00 C ATOM 2299 CG HIS A 144 -10.164 9.648 -10.202 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -10.595 8.610 -9.387 1.00 0.00 N ATOM 2301 CD2 HIS A 144 -10.790 9.456 -11.413 1.00 0.00 C ATOM 2302 CE1 HIS A 144 -11.439 7.849 -10.110 1.00 0.00 C ATOM 2303 NE2 HIS A 144 -11.589 8.323 -11.348 1.00 0.00 N ATOM 0 H HIS A 144 -6.843 9.953 -9.455 1.00 0.00 H new ATOM 0 HA HIS A 144 -8.470 10.506 -11.737 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -8.722 10.382 -8.800 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -9.743 11.624 -9.496 1.00 0.00 H new ATOM 0 HD1 HIS A 144 -10.322 8.452 -8.417 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -10.677 10.090 -12.280 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -11.933 6.965 -9.734 1.00 0.00 H new ATOM 2312 N GLN A 145 -7.171 13.101 -10.198 1.00 0.00 N ATOM 2313 CA GLN A 145 -6.965 14.569 -10.343 1.00 0.00 C ATOM 2314 C GLN A 145 -6.463 14.883 -11.757 1.00 0.00 C ATOM 2315 O GLN A 145 -6.961 15.772 -12.419 1.00 0.00 O ATOM 2316 CB GLN A 145 -5.924 15.028 -9.318 1.00 0.00 C ATOM 2317 CG GLN A 145 -5.790 16.550 -9.364 1.00 0.00 C ATOM 2318 CD GLN A 145 -6.964 17.192 -8.623 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -7.144 16.976 -7.440 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -7.777 17.978 -9.273 1.00 0.00 N ATOM 0 H GLN A 145 -6.641 12.659 -9.447 1.00 0.00 H new ATOM 0 HA GLN A 145 -7.907 15.091 -10.174 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -6.219 14.710 -8.318 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -4.962 14.562 -9.530 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -4.848 16.856 -8.908 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -5.769 16.892 -10.399 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -7.626 18.159 -10.265 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -8.563 18.411 -8.789 1.00 0.00 H new ATOM 2329 N PHE A 146 -5.481 14.157 -12.225 1.00 0.00 N ATOM 2330 CA PHE A 146 -4.949 14.413 -13.596 1.00 0.00 C ATOM 2331 C PHE A 146 -6.032 14.112 -14.634 1.00 0.00 C ATOM 2332 O PHE A 146 -6.237 14.866 -15.563 1.00 0.00 O ATOM 2333 CB PHE A 146 -3.729 13.521 -13.847 1.00 0.00 C ATOM 2334 CG PHE A 146 -3.097 13.878 -15.173 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.680 13.435 -16.364 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.929 14.649 -15.214 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -3.098 13.761 -17.595 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -1.348 14.975 -16.449 1.00 0.00 C ATOM 2339 CZ PHE A 146 -1.935 14.527 -17.637 1.00 0.00 C ATOM 0 H PHE A 146 -5.025 13.399 -11.717 1.00 0.00 H new ATOM 0 HA PHE A 146 -4.654 15.459 -13.680 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -3.004 13.646 -13.043 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -4.027 12.473 -13.847 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.581 12.840 -16.334 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -1.476 14.993 -14.296 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -3.551 13.418 -18.513 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -0.448 15.571 -16.482 1.00 0.00 H new ATOM 0 HZ PHE A 146 -1.486 14.775 -18.588 1.00 0.00 H new ATOM 2349 N LEU A 147 -6.732 13.017 -14.487 1.00 0.00 N ATOM 2350 CA LEU A 147 -7.797 12.677 -15.474 1.00 0.00 C ATOM 2351 C LEU A 147 -8.729 13.879 -15.649 1.00 0.00 C ATOM 2352 O LEU A 147 -9.067 14.253 -16.753 1.00 0.00 O ATOM 2353 CB LEU A 147 -8.589 11.468 -14.970 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.650 10.265 -14.829 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.456 9.029 -14.439 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -6.940 9.997 -16.157 1.00 0.00 C ATOM 0 H LEU A 147 -6.612 12.346 -13.728 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.345 12.432 -16.435 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -9.051 11.697 -14.010 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -9.396 11.234 -15.664 1.00 0.00 H new ATOM 0 HG LEU A 147 -6.910 10.484 -14.059 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -7.787 8.175 -14.339 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.960 9.208 -13.489 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -9.198 8.820 -15.210 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -6.275 9.141 -16.048 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -7.680 9.785 -16.929 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.359 10.874 -16.442 1.00 0.00 H new ATOM 2368 N CYS A 148 -9.127 14.504 -14.575 1.00 0.00 N ATOM 2369 CA CYS A 148 -10.014 15.694 -14.699 1.00 0.00 C ATOM 2370 C CYS A 148 -9.265 16.790 -15.459 1.00 0.00 C ATOM 2371 O CYS A 148 -9.841 17.553 -16.208 1.00 0.00 O ATOM 2372 CB CYS A 148 -10.390 16.199 -13.303 1.00 0.00 C ATOM 2373 SG CYS A 148 -11.431 14.971 -12.476 1.00 0.00 S ATOM 0 H CYS A 148 -8.877 14.243 -13.621 1.00 0.00 H new ATOM 0 HA CYS A 148 -10.923 15.426 -15.238 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -9.490 16.382 -12.716 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -10.920 17.149 -13.379 1.00 0.00 H new ATOM 0 HG CYS A 148 -10.695 13.977 -12.076 1.00 0.00 H new ATOM 2379 N SER A 149 -7.978 16.870 -15.261 1.00 0.00 N ATOM 2380 CA SER A 149 -7.163 17.910 -15.953 1.00 0.00 C ATOM 2381 C SER A 149 -7.152 17.665 -17.466 1.00 0.00 C ATOM 2382 O SER A 149 -7.060 18.586 -18.252 1.00 0.00 O ATOM 2383 CB SER A 149 -5.730 17.848 -15.426 1.00 0.00 C ATOM 2384 OG SER A 149 -5.751 17.890 -14.003 1.00 0.00 O ATOM 0 H SER A 149 -7.450 16.253 -14.643 1.00 0.00 H new ATOM 0 HA SER A 149 -7.598 18.890 -15.758 1.00 0.00 H new ATOM 0 HB2 SER A 149 -5.244 16.934 -15.767 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.150 18.683 -15.818 1.00 0.00 H new ATOM 0 HG SER A 149 -6.070 17.031 -13.655 1.00 0.00 H new ATOM 2390 N ILE A 150 -7.227 16.431 -17.874 1.00 0.00 N ATOM 2391 CA ILE A 150 -7.203 16.116 -19.326 1.00 0.00 C ATOM 2392 C ILE A 150 -8.481 16.601 -19.986 1.00 0.00 C ATOM 2393 O ILE A 150 -9.029 17.631 -19.648 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.122 14.604 -19.495 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -6.280 14.016 -18.375 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -6.488 14.263 -20.842 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -5.918 12.574 -18.724 1.00 0.00 C ATOM 0 H ILE A 150 -7.304 15.621 -17.258 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.345 16.607 -19.786 1.00 0.00 H new ATOM 0 HB ILE A 150 -8.127 14.185 -19.458 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -5.375 14.607 -18.235 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -6.830 14.048 -17.435 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -6.434 13.180 -20.955 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -7.094 14.682 -21.646 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -5.483 14.683 -20.888 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -5.314 12.147 -17.924 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.830 11.988 -18.842 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -5.352 12.556 -19.655 1.00 0.00 H new ATOM 2409 N GLU A 151 -8.959 15.832 -20.918 1.00 0.00 N ATOM 2410 CA GLU A 151 -10.216 16.183 -21.622 1.00 0.00 C ATOM 2411 C GLU A 151 -11.356 15.425 -20.951 1.00 0.00 C ATOM 2412 O GLU A 151 -12.441 15.295 -21.482 1.00 0.00 O ATOM 2413 CB GLU A 151 -10.108 15.787 -23.099 1.00 0.00 C ATOM 2414 CG GLU A 151 -10.114 14.262 -23.226 1.00 0.00 C ATOM 2415 CD GLU A 151 -9.832 13.874 -24.677 1.00 0.00 C ATOM 2416 OE1 GLU A 151 -9.723 12.687 -24.943 1.00 0.00 O ATOM 2417 OE2 GLU A 151 -9.728 14.768 -25.499 1.00 0.00 O ATOM 0 H GLU A 151 -8.525 14.962 -21.226 1.00 0.00 H new ATOM 0 HA GLU A 151 -10.400 17.256 -21.569 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -10.940 16.212 -23.661 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -9.192 16.194 -23.529 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -9.361 13.828 -22.569 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -11.079 13.863 -22.912 1.00 0.00 H new ATOM 2425 N ALA A 152 -11.093 14.922 -19.777 1.00 0.00 N ATOM 2426 CA ALA A 152 -12.125 14.158 -19.025 1.00 0.00 C ATOM 2427 C ALA A 152 -13.260 15.097 -18.613 1.00 0.00 C ATOM 2428 O ALA A 152 -14.419 14.731 -18.631 1.00 0.00 O ATOM 2429 CB ALA A 152 -11.490 13.549 -17.773 1.00 0.00 C ATOM 0 H ALA A 152 -10.195 15.010 -19.301 1.00 0.00 H new ATOM 0 HA ALA A 152 -12.523 13.365 -19.658 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -12.243 12.988 -17.219 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -10.681 12.880 -18.064 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -11.093 14.345 -17.142 1.00 0.00 H new ATOM 2435 N LEU A 153 -12.935 16.306 -18.241 1.00 0.00 N ATOM 2436 CA LEU A 153 -13.994 17.270 -17.828 1.00 0.00 C ATOM 2437 C LEU A 153 -15.153 17.200 -18.825 1.00 0.00 C ATOM 2438 O LEU A 153 -15.120 16.419 -19.774 1.00 0.00 O ATOM 2439 CB LEU A 153 -13.412 18.690 -17.816 1.00 0.00 C ATOM 2440 CG LEU A 153 -14.350 19.628 -17.049 1.00 0.00 C ATOM 2441 CD1 LEU A 153 -13.568 20.855 -16.571 1.00 0.00 C ATOM 2442 CD2 LEU A 153 -15.497 20.076 -17.963 1.00 0.00 C ATOM 0 H LEU A 153 -11.982 16.667 -18.205 1.00 0.00 H new ATOM 0 HA LEU A 153 -14.354 17.018 -16.831 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -12.427 18.685 -17.350 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -13.280 19.048 -18.837 1.00 0.00 H new ATOM 0 HG LEU A 153 -14.761 19.100 -16.188 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -14.236 21.522 -16.025 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -12.757 20.537 -15.915 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -13.154 21.380 -17.432 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -16.161 20.743 -17.413 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -15.090 20.601 -18.827 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -16.056 19.203 -18.299 1.00 0.00 H new