USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=25 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 -82:sc= 0.0546 USER MOD Set 1.2: A 129 GLN : amide:sc= -5.86! C(o=-4.7!,f=-6.5!) USER MOD Set 1.3: A 137 LYS NZ :NH3+ -118:sc= 1.1 (180deg=0) USER MOD Set 2.1: A 37 SER OG : rot -159:sc= 0.0152 USER MOD Set 2.2: A 117 GLN : amide:sc= 0.0202 K(o=0.035,f=-2.7!) USER MOD Set 3.1: A 19 CYS SG : rot 65:sc= 0.151 USER MOD Set 3.2: A 106 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 86 ASN :FLIP amide:sc= -3.97! C(o=-10!,f=-4!) USER MOD Set 4.2: A 95 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 44 THR OG1 : rot -103:sc= -0.571 USER MOD Set 5.2: A 47 LYS NZ :NH3+ -175:sc= 0.731 (180deg=-0.607) USER MOD Single : A 11 CYS SG : rot -110:sc= -8.82! USER MOD Single : A 35 GLN : amide:sc= -0.564 K(o=-0.56,f=-2.1!) USER MOD Single : A 42 HIS :FLIP no HD1:sc= -4! C(o=-4.6!,f=-4!) USER MOD Single : A 49 HIS :FLIP no HD1:sc= -2.59! C(o=-7.7!,f=-2.6!) USER MOD Single : A 59 THR OG1 : rot -61:sc= -3.42! USER MOD Single : A 64 THR OG1 : rot 74:sc= -3.41! USER MOD Single : A 65 GLN : amide:sc= -0.579 K(o=-0.58,f=-1.8!) USER MOD Single : A 74 GLN : amide:sc= -6.27! C(o=-6.3!,f=-12!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 170:sc= -2.52! (180deg=-2.64!) USER MOD Single : A 98 TYR OH : rot -174:sc= -2.42 USER MOD Single : A 104 LYS NZ :NH3+ 174:sc= 0.599 (180deg=0.527) USER MOD Single : A 113 SER OG : rot 88:sc= 0.476 USER MOD Single : A 114 HIS : no HD1:sc= -1.5! C(o=-1.5!,f=-1.4!) USER MOD Single : A 116 HIS : no HD1:sc= -4.97 K(o=-5,f=-6!) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 GLN : amide:sc= 0.202 K(o=0.2,f=-0.93) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 MET CE :methyl 147:sc= -3.03! (180deg=-5.55!) USER MOD Single : A 141 GLN :FLIP amide:sc=-0.00389 F(o=-1.4!,f=-0.0039) USER MOD Single : A 144 HIS : no HE2:sc= -15.3! C(o=-15!,f=-21!) USER MOD Single : A 145 GLN : amide:sc= -0.0608 X(o=-0.061,f=-0.061) USER MOD Single : A 148 CYS SG : rot 72:sc= 0.172 USER MOD Single : A 149 SER OG : rot 74:sc= 0.479 USER MOD ----------------------------------------------------------------- ATOM 105 N ARG A 9 12.055 -3.708 -7.284 1.00 0.00 N ATOM 106 CA ARG A 9 11.095 -2.639 -7.655 1.00 0.00 C ATOM 107 C ARG A 9 10.081 -3.232 -8.627 1.00 0.00 C ATOM 108 O ARG A 9 10.438 -3.851 -9.609 1.00 0.00 O ATOM 109 CB ARG A 9 11.828 -1.464 -8.311 1.00 0.00 C ATOM 110 CG ARG A 9 12.224 -1.812 -9.746 1.00 0.00 C ATOM 111 CD ARG A 9 13.000 -0.636 -10.340 1.00 0.00 C ATOM 112 NE ARG A 9 13.233 -0.865 -11.792 1.00 0.00 N ATOM 113 CZ ARG A 9 14.081 -1.775 -12.179 1.00 0.00 C ATOM 114 NH1 ARG A 9 14.717 -2.491 -11.292 1.00 0.00 N ATOM 115 NH2 ARG A 9 14.296 -1.966 -13.450 1.00 0.00 N ATOM 0 HA ARG A 9 10.592 -2.265 -6.763 1.00 0.00 H new ATOM 0 HB2 ARG A 9 11.188 -0.582 -8.308 1.00 0.00 H new ATOM 0 HB3 ARG A 9 12.718 -1.214 -7.733 1.00 0.00 H new ATOM 0 HG2 ARG A 9 12.836 -2.714 -9.761 1.00 0.00 H new ATOM 0 HG3 ARG A 9 11.336 -2.019 -10.343 1.00 0.00 H new ATOM 0 HD2 ARG A 9 12.443 0.290 -10.194 1.00 0.00 H new ATOM 0 HD3 ARG A 9 13.953 -0.520 -9.824 1.00 0.00 H new ATOM 0 HE ARG A 9 12.729 -0.310 -12.484 1.00 0.00 H new ATOM 0 HH11 ARG A 9 14.550 -2.338 -10.298 1.00 0.00 H new ATOM 0 HH12 ARG A 9 15.381 -3.204 -11.593 1.00 0.00 H new ATOM 0 HH21 ARG A 9 13.800 -1.403 -14.141 1.00 0.00 H new ATOM 0 HH22 ARG A 9 14.960 -2.678 -13.754 1.00 0.00 H new ATOM 129 N ALA A 10 8.822 -3.056 -8.368 1.00 0.00 N ATOM 130 CA ALA A 10 7.794 -3.612 -9.284 1.00 0.00 C ATOM 131 C ALA A 10 7.045 -2.448 -9.920 1.00 0.00 C ATOM 132 O ALA A 10 7.161 -1.322 -9.488 1.00 0.00 O ATOM 133 CB ALA A 10 6.826 -4.495 -8.492 1.00 0.00 C ATOM 0 H ALA A 10 8.458 -2.550 -7.560 1.00 0.00 H new ATOM 0 HA ALA A 10 8.261 -4.220 -10.059 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.072 -4.903 -9.165 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.377 -5.312 -8.027 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.339 -3.899 -7.720 1.00 0.00 H new ATOM 139 N CYS A 11 6.302 -2.692 -10.953 1.00 0.00 N ATOM 140 CA CYS A 11 5.580 -1.573 -11.603 1.00 0.00 C ATOM 141 C CYS A 11 4.154 -2.001 -11.940 1.00 0.00 C ATOM 142 O CYS A 11 3.889 -3.155 -12.213 1.00 0.00 O ATOM 143 CB CYS A 11 6.324 -1.175 -12.870 1.00 0.00 C ATOM 144 SG CYS A 11 8.043 -1.738 -12.764 1.00 0.00 S ATOM 0 H CYS A 11 6.163 -3.610 -11.374 1.00 0.00 H new ATOM 0 HA CYS A 11 5.534 -0.720 -10.926 1.00 0.00 H new ATOM 0 HB2 CYS A 11 5.840 -1.614 -13.742 1.00 0.00 H new ATOM 0 HB3 CYS A 11 6.292 -0.093 -12.999 1.00 0.00 H new ATOM 0 HG CYS A 11 8.829 -0.711 -12.631 1.00 0.00 H new ATOM 150 N GLY A 12 3.230 -1.080 -11.912 1.00 0.00 N ATOM 151 CA GLY A 12 1.817 -1.430 -12.223 1.00 0.00 C ATOM 152 C GLY A 12 1.156 -0.283 -12.986 1.00 0.00 C ATOM 153 O GLY A 12 1.711 0.789 -13.122 1.00 0.00 O ATOM 0 H GLY A 12 3.394 -0.099 -11.687 1.00 0.00 H new ATOM 0 HA2 GLY A 12 1.781 -2.343 -12.818 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.270 -1.628 -11.301 1.00 0.00 H new ATOM 157 N LEU A 13 -0.032 -0.500 -13.477 1.00 0.00 N ATOM 158 CA LEU A 13 -0.738 0.578 -14.223 1.00 0.00 C ATOM 159 C LEU A 13 -2.001 0.993 -13.485 1.00 0.00 C ATOM 160 O LEU A 13 -2.887 0.193 -13.265 1.00 0.00 O ATOM 161 CB LEU A 13 -1.194 0.071 -15.595 1.00 0.00 C ATOM 162 CG LEU A 13 -0.022 -0.147 -16.542 1.00 0.00 C ATOM 163 CD1 LEU A 13 -0.591 -0.515 -17.910 1.00 0.00 C ATOM 164 CD2 LEU A 13 0.784 1.140 -16.675 1.00 0.00 C ATOM 0 H LEU A 13 -0.545 -1.378 -13.394 1.00 0.00 H new ATOM 0 HA LEU A 13 -0.041 1.411 -14.320 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -1.740 -0.865 -15.473 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.887 0.789 -16.035 1.00 0.00 H new ATOM 0 HG LEU A 13 0.626 -0.936 -16.160 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.227 -0.678 -18.612 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.183 -1.426 -17.825 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.223 0.296 -18.271 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.621 0.977 -17.354 1.00 0.00 H new ATOM 0 HD22 LEU A 13 0.145 1.930 -17.070 1.00 0.00 H new ATOM 0 HD23 LEU A 13 1.163 1.435 -15.696 1.00 0.00 H new ATOM 176 N ILE A 14 -2.146 2.247 -13.178 1.00 0.00 N ATOM 177 CA ILE A 14 -3.418 2.668 -12.557 1.00 0.00 C ATOM 178 C ILE A 14 -4.454 2.494 -13.656 1.00 0.00 C ATOM 179 O ILE A 14 -4.717 3.402 -14.417 1.00 0.00 O ATOM 180 CB ILE A 14 -3.340 4.144 -12.149 1.00 0.00 C ATOM 181 CG1 ILE A 14 -2.417 4.300 -10.943 1.00 0.00 C ATOM 182 CG2 ILE A 14 -4.735 4.672 -11.813 1.00 0.00 C ATOM 183 CD1 ILE A 14 -2.903 3.412 -9.800 1.00 0.00 C ATOM 0 H ILE A 14 -1.454 2.982 -13.327 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.654 2.093 -11.661 1.00 0.00 H new ATOM 0 HB ILE A 14 -2.938 4.721 -12.982 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.397 4.030 -11.217 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -2.396 5.342 -10.622 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -4.667 5.721 -11.525 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.380 4.577 -12.686 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -5.153 4.095 -10.988 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.240 3.528 -8.942 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.915 3.703 -9.518 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -2.901 2.371 -10.122 1.00 0.00 H new ATOM 195 N ILE A 15 -5.018 1.326 -13.778 1.00 0.00 N ATOM 196 CA ILE A 15 -5.998 1.111 -14.870 1.00 0.00 C ATOM 197 C ILE A 15 -7.342 1.698 -14.488 1.00 0.00 C ATOM 198 O ILE A 15 -7.845 1.496 -13.401 1.00 0.00 O ATOM 199 CB ILE A 15 -6.148 -0.380 -15.170 1.00 0.00 C ATOM 200 CG1 ILE A 15 -4.838 -0.910 -15.770 1.00 0.00 C ATOM 201 CG2 ILE A 15 -7.299 -0.582 -16.161 1.00 0.00 C ATOM 202 CD1 ILE A 15 -5.043 -2.335 -16.293 1.00 0.00 C ATOM 0 H ILE A 15 -4.844 0.521 -13.176 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.631 1.612 -15.766 1.00 0.00 H new ATOM 0 HB ILE A 15 -6.367 -0.924 -14.251 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.510 -0.259 -16.581 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.052 -0.900 -15.015 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.410 -1.644 -16.378 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -8.224 -0.202 -15.727 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -7.083 -0.044 -17.084 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.110 -2.705 -16.717 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -5.350 -2.983 -15.472 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -5.815 -2.333 -17.062 1.00 0.00 H new ATOM 214 N PHE A 16 -7.924 2.424 -15.390 1.00 0.00 N ATOM 215 CA PHE A 16 -9.239 3.038 -15.117 1.00 0.00 C ATOM 216 C PHE A 16 -9.965 3.237 -16.446 1.00 0.00 C ATOM 217 O PHE A 16 -9.347 3.379 -17.481 1.00 0.00 O ATOM 218 CB PHE A 16 -9.028 4.391 -14.453 1.00 0.00 C ATOM 219 CG PHE A 16 -8.505 5.352 -15.482 1.00 0.00 C ATOM 220 CD1 PHE A 16 -9.392 5.964 -16.372 1.00 0.00 C ATOM 221 CD2 PHE A 16 -7.138 5.631 -15.549 1.00 0.00 C ATOM 222 CE1 PHE A 16 -8.915 6.859 -17.329 1.00 0.00 C ATOM 223 CE2 PHE A 16 -6.655 6.525 -16.508 1.00 0.00 C ATOM 224 CZ PHE A 16 -7.545 7.141 -17.400 1.00 0.00 C ATOM 0 H PHE A 16 -7.539 2.619 -16.314 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.827 2.397 -14.460 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -9.965 4.758 -14.035 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -8.323 4.301 -13.626 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -10.448 5.744 -16.318 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.455 5.156 -14.860 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.601 7.334 -18.015 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.598 6.741 -16.562 1.00 0.00 H new ATOM 0 HZ PHE A 16 -7.174 7.833 -18.142 1.00 0.00 H new ATOM 234 N ARG A 17 -11.263 3.250 -16.427 1.00 0.00 N ATOM 235 CA ARG A 17 -12.023 3.438 -17.691 1.00 0.00 C ATOM 236 C ARG A 17 -13.034 4.571 -17.497 1.00 0.00 C ATOM 237 O ARG A 17 -13.754 4.602 -16.520 1.00 0.00 O ATOM 238 CB ARG A 17 -12.761 2.135 -18.022 1.00 0.00 C ATOM 239 CG ARG A 17 -13.270 2.166 -19.466 1.00 0.00 C ATOM 240 CD ARG A 17 -14.659 2.802 -19.523 1.00 0.00 C ATOM 241 NE ARG A 17 -14.705 3.795 -20.634 1.00 0.00 N ATOM 242 CZ ARG A 17 -14.270 3.479 -21.826 1.00 0.00 C ATOM 243 NH1 ARG A 17 -13.786 2.289 -22.058 1.00 0.00 N ATOM 244 NH2 ARG A 17 -14.314 4.360 -22.786 1.00 0.00 N ATOM 0 H ARG A 17 -11.834 3.138 -15.589 1.00 0.00 H new ATOM 0 HA ARG A 17 -11.347 3.691 -18.507 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -12.093 1.285 -17.883 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -13.598 1.999 -17.337 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -12.578 2.730 -20.091 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -13.309 1.153 -19.867 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -15.417 2.034 -19.676 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -14.887 3.290 -18.575 1.00 0.00 H new ATOM 0 HE ARG A 17 -15.079 4.728 -20.463 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -13.746 1.600 -21.307 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -13.448 2.049 -22.990 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -14.687 5.292 -22.606 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -13.976 4.117 -23.717 1.00 0.00 H new ATOM 258 N ARG A 18 -13.098 5.500 -18.412 1.00 0.00 N ATOM 259 CA ARG A 18 -14.071 6.614 -18.250 1.00 0.00 C ATOM 260 C ARG A 18 -15.311 6.338 -19.094 1.00 0.00 C ATOM 261 O ARG A 18 -15.220 5.955 -20.242 1.00 0.00 O ATOM 262 CB ARG A 18 -13.432 7.937 -18.670 1.00 0.00 C ATOM 263 CG ARG A 18 -13.001 7.867 -20.134 1.00 0.00 C ATOM 264 CD ARG A 18 -12.070 9.042 -20.446 1.00 0.00 C ATOM 265 NE ARG A 18 -12.882 10.241 -20.797 1.00 0.00 N ATOM 266 CZ ARG A 18 -12.296 11.307 -21.272 1.00 0.00 C ATOM 267 NH1 ARG A 18 -11.001 11.330 -21.416 1.00 0.00 N ATOM 268 NH2 ARG A 18 -13.007 12.354 -21.594 1.00 0.00 N ATOM 0 H ARG A 18 -12.525 5.535 -19.255 1.00 0.00 H new ATOM 0 HA ARG A 18 -14.361 6.685 -17.202 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.140 8.753 -18.529 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -12.570 8.151 -18.038 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.492 6.923 -20.330 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -13.875 7.899 -20.784 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -11.438 9.257 -19.585 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -11.407 8.785 -21.272 1.00 0.00 H new ATOM 0 HE ARG A 18 -13.894 10.229 -20.667 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -10.445 10.515 -21.158 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -10.544 12.163 -21.787 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -14.020 12.339 -21.474 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -12.549 13.187 -21.965 1.00 0.00 H new ATOM 282 N CYS A 19 -16.471 6.518 -18.532 1.00 0.00 N ATOM 283 CA CYS A 19 -17.714 6.251 -19.304 1.00 0.00 C ATOM 284 C CYS A 19 -18.192 7.535 -19.976 1.00 0.00 C ATOM 285 O CYS A 19 -17.584 8.582 -19.857 1.00 0.00 O ATOM 286 CB CYS A 19 -18.805 5.739 -18.365 1.00 0.00 C ATOM 287 SG CYS A 19 -18.154 4.375 -17.367 1.00 0.00 S ATOM 0 H CYS A 19 -16.613 6.838 -17.574 1.00 0.00 H new ATOM 0 HA CYS A 19 -17.504 5.499 -20.064 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -19.150 6.545 -17.717 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -19.667 5.403 -18.941 1.00 0.00 H new ATOM 0 HG CYS A 19 -17.206 4.816 -16.595 1.00 0.00 H new ATOM 424 N ALA A 28 -17.967 8.705 -14.121 1.00 0.00 N ATOM 425 CA ALA A 28 -17.676 8.046 -15.420 1.00 0.00 C ATOM 426 C ALA A 28 -16.332 7.333 -15.320 1.00 0.00 C ATOM 427 O ALA A 28 -16.067 6.386 -16.031 1.00 0.00 O ATOM 428 CB ALA A 28 -17.610 9.099 -16.529 1.00 0.00 C ATOM 0 HA ALA A 28 -18.463 7.329 -15.653 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.396 8.612 -17.481 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.566 9.619 -16.594 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -16.821 9.816 -16.303 1.00 0.00 H new ATOM 434 N ILE A 29 -15.479 7.779 -14.437 1.00 0.00 N ATOM 435 CA ILE A 29 -14.150 7.127 -14.298 1.00 0.00 C ATOM 436 C ILE A 29 -14.206 6.057 -13.214 1.00 0.00 C ATOM 437 O ILE A 29 -14.721 6.270 -12.134 1.00 0.00 O ATOM 438 CB ILE A 29 -13.105 8.175 -13.925 1.00 0.00 C ATOM 439 CG1 ILE A 29 -13.131 9.307 -14.965 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.728 7.515 -13.890 1.00 0.00 C ATOM 441 CD1 ILE A 29 -11.773 9.422 -15.666 1.00 0.00 C ATOM 0 H ILE A 29 -15.647 8.565 -13.809 1.00 0.00 H new ATOM 0 HA ILE A 29 -13.880 6.662 -15.246 1.00 0.00 H new ATOM 0 HB ILE A 29 -13.324 8.593 -12.943 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.912 9.115 -15.701 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.377 10.251 -14.478 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -10.975 8.257 -13.624 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.727 6.715 -13.149 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -11.498 7.101 -14.872 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.809 10.228 -16.399 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -11.000 9.637 -14.928 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.543 8.483 -16.170 1.00 0.00 H new ATOM 453 N GLU A 30 -13.680 4.901 -13.502 1.00 0.00 N ATOM 454 CA GLU A 30 -13.698 3.803 -12.505 1.00 0.00 C ATOM 455 C GLU A 30 -12.313 3.161 -12.443 1.00 0.00 C ATOM 456 O GLU A 30 -11.538 3.256 -13.371 1.00 0.00 O ATOM 457 CB GLU A 30 -14.738 2.761 -12.928 1.00 0.00 C ATOM 458 CG GLU A 30 -16.127 3.404 -12.932 1.00 0.00 C ATOM 459 CD GLU A 30 -17.171 2.354 -13.308 1.00 0.00 C ATOM 460 OE1 GLU A 30 -18.350 2.649 -13.188 1.00 0.00 O ATOM 461 OE2 GLU A 30 -16.776 1.273 -13.710 1.00 0.00 O ATOM 0 H GLU A 30 -13.236 4.671 -14.391 1.00 0.00 H new ATOM 0 HA GLU A 30 -13.958 4.193 -11.521 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -14.501 2.375 -13.919 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.719 1.913 -12.243 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -16.350 3.819 -11.949 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -16.155 4.231 -13.641 1.00 0.00 H new ATOM 469 N PHE A 31 -11.993 2.507 -11.360 1.00 0.00 N ATOM 470 CA PHE A 31 -10.657 1.865 -11.254 1.00 0.00 C ATOM 471 C PHE A 31 -10.809 0.352 -11.306 1.00 0.00 C ATOM 472 O PHE A 31 -11.766 -0.210 -10.812 1.00 0.00 O ATOM 473 CB PHE A 31 -9.979 2.240 -9.936 1.00 0.00 C ATOM 474 CG PHE A 31 -9.621 3.704 -9.936 1.00 0.00 C ATOM 475 CD1 PHE A 31 -8.735 4.207 -10.894 1.00 0.00 C ATOM 476 CD2 PHE A 31 -10.163 4.556 -8.971 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.397 5.566 -10.890 1.00 0.00 C ATOM 478 CE2 PHE A 31 -9.824 5.910 -8.964 1.00 0.00 C ATOM 479 CZ PHE A 31 -8.942 6.418 -9.923 1.00 0.00 C ATOM 0 H PHE A 31 -12.598 2.391 -10.547 1.00 0.00 H new ATOM 0 HA PHE A 31 -10.046 2.214 -12.086 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.644 2.020 -9.101 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -9.081 1.638 -9.796 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -8.311 3.547 -11.637 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -10.845 4.167 -8.230 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -7.716 5.956 -11.632 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -10.244 6.567 -8.216 1.00 0.00 H new ATOM 0 HZ PHE A 31 -8.682 7.466 -9.917 1.00 0.00 H new ATOM 489 N LEU A 32 -9.861 -0.306 -11.899 1.00 0.00 N ATOM 490 CA LEU A 32 -9.915 -1.782 -11.992 1.00 0.00 C ATOM 491 C LEU A 32 -8.873 -2.388 -11.030 1.00 0.00 C ATOM 492 O LEU A 32 -7.683 -2.323 -11.263 1.00 0.00 O ATOM 493 CB LEU A 32 -9.641 -2.159 -13.455 1.00 0.00 C ATOM 494 CG LEU A 32 -9.121 -3.588 -13.578 1.00 0.00 C ATOM 495 CD1 LEU A 32 -10.274 -4.577 -13.446 1.00 0.00 C ATOM 496 CD2 LEU A 32 -8.489 -3.746 -14.950 1.00 0.00 C ATOM 0 H LEU A 32 -9.041 0.122 -12.328 1.00 0.00 H new ATOM 0 HA LEU A 32 -10.889 -2.175 -11.701 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.557 -2.053 -14.036 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.912 -1.468 -13.879 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.393 -3.785 -12.791 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.893 -5.594 -13.535 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.751 -4.452 -12.474 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.004 -4.393 -14.234 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.109 -4.762 -15.061 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.236 -3.552 -15.719 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.667 -3.038 -15.056 1.00 0.00 H new ATOM 508 N LEU A 33 -9.326 -2.976 -9.944 1.00 0.00 N ATOM 509 CA LEU A 33 -8.386 -3.593 -8.947 1.00 0.00 C ATOM 510 C LEU A 33 -8.513 -5.114 -9.017 1.00 0.00 C ATOM 511 O LEU A 33 -9.443 -5.635 -9.598 1.00 0.00 O ATOM 512 CB LEU A 33 -8.752 -3.157 -7.523 1.00 0.00 C ATOM 513 CG LEU A 33 -8.321 -1.717 -7.260 1.00 0.00 C ATOM 514 CD1 LEU A 33 -9.000 -1.229 -5.979 1.00 0.00 C ATOM 515 CD2 LEU A 33 -6.803 -1.664 -7.069 1.00 0.00 C ATOM 0 H LEU A 33 -10.314 -3.055 -9.704 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.371 -3.271 -9.182 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.828 -3.250 -7.376 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.274 -3.820 -6.802 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.604 -1.087 -8.103 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.701 -0.200 -5.778 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.082 -1.275 -6.100 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -8.701 -1.863 -5.144 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.496 -0.635 -6.881 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.521 -2.288 -6.221 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.310 -2.031 -7.969 1.00 0.00 H new ATOM 527 N LEU A 34 -7.592 -5.834 -8.430 1.00 0.00 N ATOM 528 CA LEU A 34 -7.687 -7.324 -8.469 1.00 0.00 C ATOM 529 C LEU A 34 -7.592 -7.914 -7.060 1.00 0.00 C ATOM 530 O LEU A 34 -6.731 -7.555 -6.282 1.00 0.00 O ATOM 531 CB LEU A 34 -6.548 -7.893 -9.320 1.00 0.00 C ATOM 532 CG LEU A 34 -6.534 -7.231 -10.699 1.00 0.00 C ATOM 533 CD1 LEU A 34 -5.554 -7.977 -11.607 1.00 0.00 C ATOM 534 CD2 LEU A 34 -7.928 -7.293 -11.318 1.00 0.00 C ATOM 0 H LEU A 34 -6.786 -5.459 -7.930 1.00 0.00 H new ATOM 0 HA LEU A 34 -8.651 -7.591 -8.903 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.594 -7.728 -8.820 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.669 -8.971 -9.428 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.229 -6.190 -10.593 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -5.541 -7.508 -12.591 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.555 -7.938 -11.173 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.867 -9.016 -11.704 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.911 -6.820 -12.300 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -8.234 -8.334 -11.422 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -8.635 -6.769 -10.675 1.00 0.00 H new ATOM 546 N GLN A 35 -8.451 -8.851 -6.741 1.00 0.00 N ATOM 547 CA GLN A 35 -8.379 -9.492 -5.399 1.00 0.00 C ATOM 548 C GLN A 35 -7.714 -10.856 -5.574 1.00 0.00 C ATOM 549 O GLN A 35 -8.299 -11.774 -6.116 1.00 0.00 O ATOM 550 CB GLN A 35 -9.783 -9.686 -4.822 1.00 0.00 C ATOM 551 CG GLN A 35 -9.708 -9.728 -3.293 1.00 0.00 C ATOM 552 CD GLN A 35 -11.116 -9.875 -2.714 1.00 0.00 C ATOM 553 OE1 GLN A 35 -12.097 -9.748 -3.422 1.00 0.00 O ATOM 554 NE2 GLN A 35 -11.258 -10.141 -1.445 1.00 0.00 N ATOM 0 H GLN A 35 -9.193 -9.195 -7.350 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.811 -8.861 -4.715 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -10.434 -8.873 -5.142 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -10.218 -10.611 -5.201 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -9.083 -10.562 -2.972 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -9.242 -8.817 -2.917 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -10.436 -10.248 -0.851 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -12.191 -10.242 -1.047 1.00 0.00 H new ATOM 563 N ALA A 36 -6.496 -10.996 -5.140 1.00 0.00 N ATOM 564 CA ALA A 36 -5.798 -12.298 -5.308 1.00 0.00 C ATOM 565 C ALA A 36 -6.527 -13.382 -4.515 1.00 0.00 C ATOM 566 O ALA A 36 -6.887 -13.194 -3.372 1.00 0.00 O ATOM 567 CB ALA A 36 -4.359 -12.164 -4.809 1.00 0.00 C ATOM 0 H ALA A 36 -5.954 -10.267 -4.677 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.792 -12.577 -6.362 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.842 -13.116 -4.930 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.844 -11.396 -5.386 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.364 -11.885 -3.755 1.00 0.00 H new ATOM 573 N SER A 37 -6.751 -14.520 -5.116 1.00 0.00 N ATOM 574 CA SER A 37 -7.461 -15.613 -4.396 1.00 0.00 C ATOM 575 C SER A 37 -6.445 -16.491 -3.665 1.00 0.00 C ATOM 576 O SER A 37 -6.789 -17.256 -2.788 1.00 0.00 O ATOM 577 CB SER A 37 -8.236 -16.460 -5.404 1.00 0.00 C ATOM 578 OG SER A 37 -8.382 -17.780 -4.898 1.00 0.00 O ATOM 0 H SER A 37 -6.473 -14.738 -6.073 1.00 0.00 H new ATOM 0 HA SER A 37 -8.152 -15.183 -3.671 1.00 0.00 H new ATOM 0 HB2 SER A 37 -9.216 -16.019 -5.589 1.00 0.00 H new ATOM 0 HB3 SER A 37 -7.710 -16.481 -6.359 1.00 0.00 H new ATOM 0 HG SER A 37 -8.565 -18.396 -5.638 1.00 0.00 H new ATOM 641 N HIS A 42 -6.433 -10.024 -1.031 1.00 0.00 N ATOM 642 CA HIS A 42 -6.177 -8.557 -0.959 1.00 0.00 C ATOM 643 C HIS A 42 -6.482 -7.902 -2.309 1.00 0.00 C ATOM 644 O HIS A 42 -6.250 -8.478 -3.352 1.00 0.00 O ATOM 645 CB HIS A 42 -4.703 -8.335 -0.619 1.00 0.00 C ATOM 646 CG HIS A 42 -3.852 -9.133 -1.572 1.00 0.00 C ATOM 647 ND1 HIS A 42 -3.107 -8.768 -2.667 1.00 0.00 N flip ATOM 648 CD2 HIS A 42 -3.695 -10.507 -1.453 1.00 0.00 C flip ATOM 649 CE1 HIS A 42 -2.504 -9.893 -3.217 1.00 0.00 C flip ATOM 650 NE2 HIS A 42 -2.887 -10.913 -2.451 1.00 0.00 N flip ATOM 0 HA HIS A 42 -6.817 -8.114 -0.196 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -4.456 -7.276 -0.691 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -4.504 -8.640 0.408 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -4.140 -11.137 -0.697 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -1.860 -9.932 -4.083 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -2.604 -11.881 -2.602 1.00 0.00 H new ATOM 659 N TRP A 43 -6.986 -6.695 -2.295 1.00 0.00 N ATOM 660 CA TRP A 43 -7.293 -5.998 -3.579 1.00 0.00 C ATOM 661 C TRP A 43 -6.069 -5.209 -4.041 1.00 0.00 C ATOM 662 O TRP A 43 -5.392 -4.581 -3.255 1.00 0.00 O ATOM 663 CB TRP A 43 -8.463 -5.032 -3.381 1.00 0.00 C ATOM 664 CG TRP A 43 -9.751 -5.770 -3.506 1.00 0.00 C ATOM 665 CD1 TRP A 43 -10.557 -6.115 -2.479 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.396 -6.257 -4.715 1.00 0.00 C ATOM 667 NE1 TRP A 43 -11.660 -6.782 -2.980 1.00 0.00 N ATOM 668 CE2 TRP A 43 -11.603 -6.897 -4.354 1.00 0.00 C ATOM 669 CE3 TRP A 43 -10.053 -6.207 -6.076 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.440 -7.467 -5.311 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -10.893 -6.779 -7.044 1.00 0.00 C ATOM 672 CH2 TRP A 43 -12.084 -7.410 -6.661 1.00 0.00 C ATOM 0 H TRP A 43 -7.198 -6.163 -1.451 1.00 0.00 H new ATOM 0 HA TRP A 43 -7.558 -6.742 -4.330 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.396 -4.561 -2.400 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -8.417 -4.234 -4.122 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -10.371 -5.904 -1.436 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -12.421 -7.144 -2.405 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -9.136 -5.725 -6.380 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -13.358 -7.950 -5.011 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.620 -6.733 -8.088 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -12.726 -7.852 -7.408 1.00 0.00 H new ATOM 683 N THR A 44 -5.780 -5.237 -5.312 1.00 0.00 N ATOM 684 CA THR A 44 -4.597 -4.486 -5.818 1.00 0.00 C ATOM 685 C THR A 44 -4.638 -4.426 -7.344 1.00 0.00 C ATOM 686 O THR A 44 -5.189 -5.293 -7.993 1.00 0.00 O ATOM 687 CB THR A 44 -3.326 -5.205 -5.372 1.00 0.00 C ATOM 688 OG1 THR A 44 -2.260 -4.880 -6.254 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.570 -6.713 -5.392 1.00 0.00 C ATOM 0 H THR A 44 -6.309 -5.745 -6.020 1.00 0.00 H new ATOM 0 HA THR A 44 -4.609 -3.471 -5.420 1.00 0.00 H new ATOM 0 HB THR A 44 -3.062 -4.891 -4.362 1.00 0.00 H new ATOM 0 HG1 THR A 44 -2.101 -5.630 -6.865 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.666 -7.232 -5.074 1.00 0.00 H new ATOM 0 HG22 THR A 44 -4.387 -6.958 -4.713 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.832 -7.026 -6.403 1.00 0.00 H new ATOM 697 N PRO A 45 -4.048 -3.411 -7.911 1.00 0.00 N ATOM 698 CA PRO A 45 -3.995 -3.231 -9.384 1.00 0.00 C ATOM 699 C PRO A 45 -3.042 -4.237 -10.022 1.00 0.00 C ATOM 700 O PRO A 45 -2.207 -4.814 -9.357 1.00 0.00 O ATOM 701 CB PRO A 45 -3.458 -1.811 -9.558 1.00 0.00 C ATOM 702 CG PRO A 45 -2.643 -1.572 -8.336 1.00 0.00 C ATOM 703 CD PRO A 45 -3.359 -2.318 -7.209 1.00 0.00 C ATOM 0 HA PRO A 45 -4.964 -3.384 -9.858 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -2.855 -1.722 -10.462 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.268 -1.087 -9.643 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -1.626 -1.941 -8.465 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -2.570 -0.507 -8.116 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -2.656 -2.697 -6.467 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -4.062 -1.672 -6.682 1.00 0.00 H new ATOM 711 N PRO A 46 -3.162 -4.442 -11.295 1.00 0.00 N ATOM 712 CA PRO A 46 -2.289 -5.395 -12.028 1.00 0.00 C ATOM 713 C PRO A 46 -0.833 -4.911 -12.080 1.00 0.00 C ATOM 714 O PRO A 46 -0.473 -4.084 -12.894 1.00 0.00 O ATOM 715 CB PRO A 46 -2.899 -5.456 -13.428 1.00 0.00 C ATOM 716 CG PRO A 46 -3.741 -4.230 -13.575 1.00 0.00 C ATOM 717 CD PRO A 46 -4.139 -3.785 -12.172 1.00 0.00 C ATOM 0 HA PRO A 46 -2.248 -6.370 -11.542 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -2.120 -5.486 -14.190 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -3.500 -6.357 -13.551 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -3.187 -3.442 -14.086 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -4.625 -4.440 -14.177 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -4.098 -2.700 -12.072 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.158 -4.089 -11.932 1.00 0.00 H new ATOM 725 N LYS A 47 0.002 -5.411 -11.205 1.00 0.00 N ATOM 726 CA LYS A 47 1.429 -4.971 -11.189 1.00 0.00 C ATOM 727 C LYS A 47 2.336 -6.180 -10.929 1.00 0.00 C ATOM 728 O LYS A 47 1.946 -7.116 -10.260 1.00 0.00 O ATOM 729 CB LYS A 47 1.607 -3.940 -10.075 1.00 0.00 C ATOM 730 CG LYS A 47 1.537 -4.637 -8.718 1.00 0.00 C ATOM 731 CD LYS A 47 1.410 -3.579 -7.632 1.00 0.00 C ATOM 732 CE LYS A 47 1.414 -4.244 -6.261 1.00 0.00 C ATOM 733 NZ LYS A 47 0.282 -5.208 -6.172 1.00 0.00 N ATOM 0 H LYS A 47 -0.244 -6.106 -10.500 1.00 0.00 H new ATOM 0 HA LYS A 47 1.697 -4.529 -12.149 1.00 0.00 H new ATOM 0 HB2 LYS A 47 2.565 -3.432 -10.185 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.832 -3.177 -10.144 1.00 0.00 H new ATOM 0 HG2 LYS A 47 0.685 -5.316 -8.686 1.00 0.00 H new ATOM 0 HG3 LYS A 47 2.431 -5.239 -8.556 1.00 0.00 H new ATOM 0 HD2 LYS A 47 2.234 -2.869 -7.705 1.00 0.00 H new ATOM 0 HD3 LYS A 47 0.489 -3.013 -7.769 1.00 0.00 H new ATOM 0 HE2 LYS A 47 2.360 -4.761 -6.099 1.00 0.00 H new ATOM 0 HE3 LYS A 47 1.325 -3.490 -5.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 0.234 -5.599 -5.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -0.609 -4.719 -6.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 0.430 -5.981 -6.852 1.00 0.00 H new ATOM 747 N GLY A 48 3.539 -6.176 -11.448 1.00 0.00 N ATOM 748 CA GLY A 48 4.452 -7.339 -11.217 1.00 0.00 C ATOM 749 C GLY A 48 5.889 -6.850 -11.003 1.00 0.00 C ATOM 750 O GLY A 48 6.224 -5.723 -11.308 1.00 0.00 O ATOM 0 H GLY A 48 3.927 -5.424 -12.018 1.00 0.00 H new ATOM 0 HA2 GLY A 48 4.119 -7.905 -10.347 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.414 -8.016 -12.071 1.00 0.00 H new ATOM 754 N HIS A 49 6.743 -7.700 -10.485 1.00 0.00 N ATOM 755 CA HIS A 49 8.160 -7.299 -10.249 1.00 0.00 C ATOM 756 C HIS A 49 8.875 -7.114 -11.588 1.00 0.00 C ATOM 757 O HIS A 49 8.390 -7.522 -12.624 1.00 0.00 O ATOM 758 CB HIS A 49 8.873 -8.382 -9.439 1.00 0.00 C ATOM 759 CG HIS A 49 10.355 -8.119 -9.451 1.00 0.00 C ATOM 760 ND1 HIS A 49 11.102 -7.033 -9.053 1.00 0.00 N flip ATOM 761 CD2 HIS A 49 11.269 -9.044 -9.940 1.00 0.00 C flip ATOM 762 CE1 HIS A 49 12.448 -7.282 -9.294 1.00 0.00 C flip ATOM 763 NE2 HIS A 49 12.497 -8.503 -9.827 1.00 0.00 N flip ATOM 0 H HIS A 49 6.516 -8.657 -10.216 1.00 0.00 H new ATOM 0 HA HIS A 49 8.178 -6.360 -9.696 1.00 0.00 H new ATOM 0 HB2 HIS A 49 8.502 -8.389 -8.414 1.00 0.00 H new ATOM 0 HB3 HIS A 49 8.663 -9.365 -9.861 1.00 0.00 H new ATOM 0 HD2 HIS A 49 11.037 -10.020 -10.339 1.00 0.00 H new ATOM 0 HE1 HIS A 49 13.280 -6.624 -9.092 1.00 0.00 H new ATOM 0 HE2 HIS A 49 13.358 -8.969 -10.114 1.00 0.00 H new ATOM 772 N VAL A 50 10.027 -6.497 -11.574 1.00 0.00 N ATOM 773 CA VAL A 50 10.772 -6.277 -12.846 1.00 0.00 C ATOM 774 C VAL A 50 11.717 -7.455 -13.103 1.00 0.00 C ATOM 775 O VAL A 50 12.500 -7.835 -12.256 1.00 0.00 O ATOM 776 CB VAL A 50 11.580 -4.972 -12.734 1.00 0.00 C ATOM 777 CG1 VAL A 50 13.082 -5.274 -12.672 1.00 0.00 C ATOM 778 CG2 VAL A 50 11.289 -4.086 -13.947 1.00 0.00 C ATOM 0 H VAL A 50 10.483 -6.136 -10.736 1.00 0.00 H new ATOM 0 HA VAL A 50 10.069 -6.202 -13.676 1.00 0.00 H new ATOM 0 HB VAL A 50 11.287 -4.456 -11.820 1.00 0.00 H new ATOM 0 HG11 VAL A 50 13.638 -4.340 -12.593 1.00 0.00 H new ATOM 0 HG12 VAL A 50 13.292 -5.896 -11.802 1.00 0.00 H new ATOM 0 HG13 VAL A 50 13.385 -5.801 -13.577 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.861 -3.162 -13.868 1.00 0.00 H new ATOM 0 HG22 VAL A 50 11.573 -4.612 -14.858 1.00 0.00 H new ATOM 0 HG23 VAL A 50 10.225 -3.852 -13.980 1.00 0.00 H new ATOM 841 N ASP A 55 11.813 -3.469 -18.130 1.00 0.00 N ATOM 842 CA ASP A 55 11.926 -2.013 -17.844 1.00 0.00 C ATOM 843 C ASP A 55 10.945 -1.672 -16.725 1.00 0.00 C ATOM 844 O ASP A 55 10.218 -2.519 -16.257 1.00 0.00 O ATOM 845 CB ASP A 55 11.577 -1.199 -19.089 1.00 0.00 C ATOM 846 CG ASP A 55 12.325 0.136 -19.050 1.00 0.00 C ATOM 847 OD1 ASP A 55 13.429 0.161 -18.531 1.00 0.00 O ATOM 848 OD2 ASP A 55 11.779 1.111 -19.537 1.00 0.00 O ATOM 0 HA ASP A 55 12.947 -1.773 -17.548 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.848 -1.754 -19.987 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.502 -1.025 -19.134 1.00 0.00 H new ATOM 854 N ASP A 56 10.918 -0.450 -16.281 1.00 0.00 N ATOM 855 CA ASP A 56 9.978 -0.090 -15.186 1.00 0.00 C ATOM 856 C ASP A 56 8.538 -0.105 -15.715 1.00 0.00 C ATOM 857 O ASP A 56 7.718 -0.888 -15.276 1.00 0.00 O ATOM 858 CB ASP A 56 10.324 1.297 -14.656 1.00 0.00 C ATOM 859 CG ASP A 56 11.757 1.291 -14.121 1.00 0.00 C ATOM 860 OD1 ASP A 56 12.267 2.364 -13.839 1.00 0.00 O ATOM 861 OD2 ASP A 56 12.321 0.215 -14.005 1.00 0.00 O ATOM 0 H ASP A 56 11.502 0.312 -16.626 1.00 0.00 H new ATOM 0 HA ASP A 56 10.066 -0.816 -14.377 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.223 2.038 -15.449 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.630 1.580 -13.865 1.00 0.00 H new ATOM 867 N LEU A 57 8.217 0.746 -16.657 1.00 0.00 N ATOM 868 CA LEU A 57 6.823 0.752 -17.199 1.00 0.00 C ATOM 869 C LEU A 57 6.575 -0.518 -18.005 1.00 0.00 C ATOM 870 O LEU A 57 5.533 -1.133 -17.898 1.00 0.00 O ATOM 871 CB LEU A 57 6.600 1.972 -18.100 1.00 0.00 C ATOM 872 CG LEU A 57 5.231 1.858 -18.787 1.00 0.00 C ATOM 873 CD1 LEU A 57 4.115 2.156 -17.783 1.00 0.00 C ATOM 874 CD2 LEU A 57 5.156 2.859 -19.944 1.00 0.00 C ATOM 0 H LEU A 57 8.851 1.430 -17.071 1.00 0.00 H new ATOM 0 HA LEU A 57 6.129 0.798 -16.360 1.00 0.00 H new ATOM 0 HB2 LEU A 57 6.647 2.887 -17.510 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.390 2.034 -18.848 1.00 0.00 H new ATOM 0 HG LEU A 57 5.107 0.845 -19.169 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.148 2.073 -18.279 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.164 1.441 -16.961 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.237 3.166 -17.393 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.185 2.779 -20.432 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.286 3.870 -19.559 1.00 0.00 H new ATOM 0 HD23 LEU A 57 5.944 2.641 -20.665 1.00 0.00 H new ATOM 886 N GLU A 58 7.514 -0.921 -18.812 1.00 0.00 N ATOM 887 CA GLU A 58 7.293 -2.154 -19.605 1.00 0.00 C ATOM 888 C GLU A 58 6.921 -3.256 -18.622 1.00 0.00 C ATOM 889 O GLU A 58 6.112 -4.119 -18.900 1.00 0.00 O ATOM 890 CB GLU A 58 8.570 -2.523 -20.361 1.00 0.00 C ATOM 891 CG GLU A 58 8.942 -1.375 -21.304 1.00 0.00 C ATOM 892 CD GLU A 58 7.835 -1.186 -22.344 1.00 0.00 C ATOM 893 OE1 GLU A 58 7.772 -0.114 -22.924 1.00 0.00 O ATOM 894 OE2 GLU A 58 7.073 -2.116 -22.545 1.00 0.00 O ATOM 0 H GLU A 58 8.411 -0.457 -18.954 1.00 0.00 H new ATOM 0 HA GLU A 58 6.501 -2.011 -20.340 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.382 -2.711 -19.659 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.420 -3.442 -20.928 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.082 -0.455 -20.736 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.888 -1.591 -21.800 1.00 0.00 H new ATOM 902 N THR A 59 7.486 -3.202 -17.449 1.00 0.00 N ATOM 903 CA THR A 59 7.152 -4.208 -16.413 1.00 0.00 C ATOM 904 C THR A 59 5.715 -3.964 -15.964 1.00 0.00 C ATOM 905 O THR A 59 4.935 -4.881 -15.813 1.00 0.00 O ATOM 906 CB THR A 59 8.109 -4.050 -15.232 1.00 0.00 C ATOM 907 OG1 THR A 59 9.204 -4.934 -15.402 1.00 0.00 O ATOM 908 CG2 THR A 59 7.389 -4.371 -13.924 1.00 0.00 C ATOM 0 H THR A 59 8.168 -2.499 -17.165 1.00 0.00 H new ATOM 0 HA THR A 59 7.249 -5.219 -16.808 1.00 0.00 H new ATOM 0 HB THR A 59 8.466 -3.021 -15.192 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.878 -5.858 -15.422 1.00 0.00 H new ATOM 0 HG21 THR A 59 8.081 -4.255 -13.090 1.00 0.00 H new ATOM 0 HG22 THR A 59 6.548 -3.690 -13.795 1.00 0.00 H new ATOM 0 HG23 THR A 59 7.024 -5.398 -13.952 1.00 0.00 H new ATOM 916 N ALA A 60 5.349 -2.725 -15.775 1.00 0.00 N ATOM 917 CA ALA A 60 3.952 -2.429 -15.370 1.00 0.00 C ATOM 918 C ALA A 60 3.049 -2.889 -16.501 1.00 0.00 C ATOM 919 O ALA A 60 2.047 -3.544 -16.291 1.00 0.00 O ATOM 920 CB ALA A 60 3.779 -0.923 -15.160 1.00 0.00 C ATOM 0 H ALA A 60 5.955 -1.912 -15.884 1.00 0.00 H new ATOM 0 HA ALA A 60 3.705 -2.939 -14.439 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.752 -0.713 -14.863 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.459 -0.584 -14.379 1.00 0.00 H new ATOM 0 HB3 ALA A 60 4.003 -0.398 -16.089 1.00 0.00 H new ATOM 926 N LEU A 61 3.427 -2.577 -17.709 1.00 0.00 N ATOM 927 CA LEU A 61 2.630 -3.019 -18.878 1.00 0.00 C ATOM 928 C LEU A 61 2.667 -4.545 -18.925 1.00 0.00 C ATOM 929 O LEU A 61 1.706 -5.195 -19.276 1.00 0.00 O ATOM 930 CB LEU A 61 3.242 -2.434 -20.156 1.00 0.00 C ATOM 931 CG LEU A 61 2.952 -0.932 -20.216 1.00 0.00 C ATOM 932 CD1 LEU A 61 3.868 -0.260 -21.243 1.00 0.00 C ATOM 933 CD2 LEU A 61 1.495 -0.721 -20.625 1.00 0.00 C ATOM 0 H LEU A 61 4.259 -2.032 -17.934 1.00 0.00 H new ATOM 0 HA LEU A 61 1.599 -2.676 -18.797 1.00 0.00 H new ATOM 0 HB2 LEU A 61 4.318 -2.609 -20.171 1.00 0.00 H new ATOM 0 HB3 LEU A 61 2.826 -2.931 -21.032 1.00 0.00 H new ATOM 0 HG LEU A 61 3.133 -0.491 -19.236 1.00 0.00 H new ATOM 0 HD11 LEU A 61 3.654 0.808 -21.278 1.00 0.00 H new ATOM 0 HD12 LEU A 61 4.909 -0.412 -20.957 1.00 0.00 H new ATOM 0 HD13 LEU A 61 3.695 -0.697 -22.226 1.00 0.00 H new ATOM 0 HD21 LEU A 61 1.281 0.347 -20.670 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.324 -1.167 -21.605 1.00 0.00 H new ATOM 0 HD23 LEU A 61 0.840 -1.192 -19.892 1.00 0.00 H new ATOM 945 N ARG A 62 3.779 -5.113 -18.547 1.00 0.00 N ATOM 946 CA ARG A 62 3.907 -6.597 -18.535 1.00 0.00 C ATOM 947 C ARG A 62 2.899 -7.187 -17.547 1.00 0.00 C ATOM 948 O ARG A 62 2.175 -8.112 -17.861 1.00 0.00 O ATOM 949 CB ARG A 62 5.331 -6.959 -18.096 1.00 0.00 C ATOM 950 CG ARG A 62 5.519 -8.474 -18.102 1.00 0.00 C ATOM 951 CD ARG A 62 6.881 -8.803 -17.487 1.00 0.00 C ATOM 952 NE ARG A 62 7.111 -10.277 -17.509 1.00 0.00 N ATOM 953 CZ ARG A 62 7.542 -10.894 -16.440 1.00 0.00 C ATOM 954 NH1 ARG A 62 7.745 -10.232 -15.331 1.00 0.00 N ATOM 955 NH2 ARG A 62 7.776 -12.176 -16.478 1.00 0.00 N ATOM 0 H ARG A 62 4.611 -4.608 -18.243 1.00 0.00 H new ATOM 0 HA ARG A 62 3.709 -7.000 -19.528 1.00 0.00 H new ATOM 0 HB2 ARG A 62 6.054 -6.493 -18.765 1.00 0.00 H new ATOM 0 HB3 ARG A 62 5.522 -6.566 -17.097 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.722 -8.956 -17.535 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.462 -8.858 -19.121 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.671 -8.296 -18.041 1.00 0.00 H new ATOM 0 HD3 ARG A 62 6.924 -8.436 -16.462 1.00 0.00 H new ATOM 0 HE ARG A 62 6.931 -10.806 -18.362 1.00 0.00 H new ATOM 0 HH11 ARG A 62 7.567 -9.228 -15.296 1.00 0.00 H new ATOM 0 HH12 ARG A 62 8.081 -10.719 -14.500 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.623 -12.697 -17.341 1.00 0.00 H new ATOM 0 HH22 ARG A 62 8.112 -12.658 -15.644 1.00 0.00 H new ATOM 969 N ALA A 63 2.844 -6.659 -16.353 1.00 0.00 N ATOM 970 CA ALA A 63 1.883 -7.181 -15.340 1.00 0.00 C ATOM 971 C ALA A 63 0.461 -6.750 -15.700 1.00 0.00 C ATOM 972 O ALA A 63 -0.496 -7.451 -15.437 1.00 0.00 O ATOM 973 CB ALA A 63 2.239 -6.633 -13.958 1.00 0.00 C ATOM 0 H ALA A 63 3.427 -5.885 -16.035 1.00 0.00 H new ATOM 0 HA ALA A 63 1.941 -8.269 -15.328 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.534 -7.018 -13.221 1.00 0.00 H new ATOM 0 HB2 ALA A 63 3.249 -6.946 -13.692 1.00 0.00 H new ATOM 0 HB3 ALA A 63 2.189 -5.544 -13.974 1.00 0.00 H new ATOM 979 N THR A 64 0.314 -5.595 -16.283 1.00 0.00 N ATOM 980 CA THR A 64 -1.046 -5.114 -16.638 1.00 0.00 C ATOM 981 C THR A 64 -1.773 -6.184 -17.451 1.00 0.00 C ATOM 982 O THR A 64 -2.922 -6.492 -17.204 1.00 0.00 O ATOM 983 CB THR A 64 -0.917 -3.836 -17.460 1.00 0.00 C ATOM 984 OG1 THR A 64 -0.091 -2.920 -16.761 1.00 0.00 O ATOM 985 CG2 THR A 64 -2.298 -3.219 -17.671 1.00 0.00 C ATOM 0 H THR A 64 1.077 -4.964 -16.529 1.00 0.00 H new ATOM 0 HA THR A 64 -1.617 -4.911 -15.732 1.00 0.00 H new ATOM 0 HB THR A 64 -0.476 -4.066 -18.430 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.843 -3.211 -16.819 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.203 -2.306 -18.259 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.936 -3.927 -18.201 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.743 -2.983 -16.704 1.00 0.00 H new ATOM 993 N GLN A 65 -1.115 -6.760 -18.415 1.00 0.00 N ATOM 994 CA GLN A 65 -1.774 -7.814 -19.230 1.00 0.00 C ATOM 995 C GLN A 65 -1.828 -9.128 -18.443 1.00 0.00 C ATOM 996 O GLN A 65 -2.865 -9.730 -18.288 1.00 0.00 O ATOM 997 CB GLN A 65 -0.990 -8.032 -20.524 1.00 0.00 C ATOM 998 CG GLN A 65 0.093 -6.960 -20.660 1.00 0.00 C ATOM 999 CD GLN A 65 0.697 -7.024 -22.066 1.00 0.00 C ATOM 1000 OE1 GLN A 65 0.418 -7.937 -22.818 1.00 0.00 O ATOM 1001 NE2 GLN A 65 1.523 -6.093 -22.456 1.00 0.00 N ATOM 0 H GLN A 65 -0.152 -6.547 -18.673 1.00 0.00 H new ATOM 0 HA GLN A 65 -2.788 -7.494 -19.467 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.536 -9.023 -20.522 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -1.664 -7.992 -21.380 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -0.332 -5.973 -20.479 1.00 0.00 H new ATOM 0 HG3 GLN A 65 0.870 -7.115 -19.911 1.00 0.00 H new ATOM 0 HE21 GLN A 65 1.760 -5.325 -21.828 1.00 0.00 H new ATOM 0 HE22 GLN A 65 1.932 -6.133 -23.389 1.00 0.00 H new ATOM 1010 N GLU A 66 -0.709 -9.592 -17.971 1.00 0.00 N ATOM 1011 CA GLU A 66 -0.691 -10.886 -17.231 1.00 0.00 C ATOM 1012 C GLU A 66 -1.523 -10.819 -15.940 1.00 0.00 C ATOM 1013 O GLU A 66 -2.204 -11.763 -15.594 1.00 0.00 O ATOM 1014 CB GLU A 66 0.755 -11.238 -16.879 1.00 0.00 C ATOM 1015 CG GLU A 66 0.804 -12.632 -16.252 1.00 0.00 C ATOM 1016 CD GLU A 66 2.239 -12.959 -15.837 1.00 0.00 C ATOM 1017 OE1 GLU A 66 2.446 -14.028 -15.285 1.00 0.00 O ATOM 1018 OE2 GLU A 66 3.107 -12.137 -16.080 1.00 0.00 O ATOM 0 H GLU A 66 0.197 -9.133 -18.064 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.130 -11.649 -17.873 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.376 -11.209 -17.775 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.161 -10.502 -16.186 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.145 -12.675 -15.385 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.443 -13.374 -16.963 1.00 0.00 H new ATOM 1026 N GLU A 67 -1.459 -9.741 -15.207 1.00 0.00 N ATOM 1027 CA GLU A 67 -2.235 -9.678 -13.930 1.00 0.00 C ATOM 1028 C GLU A 67 -3.735 -9.483 -14.195 1.00 0.00 C ATOM 1029 O GLU A 67 -4.562 -10.132 -13.585 1.00 0.00 O ATOM 1030 CB GLU A 67 -1.712 -8.529 -13.067 1.00 0.00 C ATOM 1031 CG GLU A 67 -0.243 -8.772 -12.711 1.00 0.00 C ATOM 1032 CD GLU A 67 -0.108 -10.075 -11.920 1.00 0.00 C ATOM 1033 OE1 GLU A 67 -1.114 -10.554 -11.423 1.00 0.00 O ATOM 1034 OE2 GLU A 67 1.001 -10.572 -11.824 1.00 0.00 O ATOM 0 H GLU A 67 -0.911 -8.910 -15.431 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.104 -10.625 -13.407 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.814 -7.585 -13.602 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -2.307 -8.446 -12.157 1.00 0.00 H new ATOM 0 HG2 GLU A 67 0.357 -8.824 -13.620 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.141 -7.938 -12.123 1.00 0.00 H new ATOM 1042 N ALA A 68 -4.104 -8.597 -15.086 1.00 0.00 N ATOM 1043 CA ALA A 68 -5.563 -8.383 -15.353 1.00 0.00 C ATOM 1044 C ALA A 68 -5.931 -8.930 -16.727 1.00 0.00 C ATOM 1045 O ALA A 68 -7.079 -9.205 -17.007 1.00 0.00 O ATOM 1046 CB ALA A 68 -5.893 -6.892 -15.319 1.00 0.00 C ATOM 0 H ALA A 68 -3.468 -8.018 -15.635 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.130 -8.905 -14.582 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -6.956 -6.750 -15.514 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.647 -6.487 -14.337 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.312 -6.373 -16.081 1.00 0.00 H new ATOM 1052 N GLY A 69 -4.975 -9.089 -17.593 1.00 0.00 N ATOM 1053 CA GLY A 69 -5.302 -9.615 -18.943 1.00 0.00 C ATOM 1054 C GLY A 69 -5.430 -8.454 -19.923 1.00 0.00 C ATOM 1055 O GLY A 69 -5.874 -8.627 -21.045 1.00 0.00 O ATOM 0 H GLY A 69 -3.990 -8.880 -17.428 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.524 -10.302 -19.276 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -6.233 -10.181 -18.909 1.00 0.00 H new ATOM 1059 N ILE A 70 -5.056 -7.270 -19.520 1.00 0.00 N ATOM 1060 CA ILE A 70 -5.178 -6.121 -20.451 1.00 0.00 C ATOM 1061 C ILE A 70 -3.809 -5.779 -21.037 1.00 0.00 C ATOM 1062 O ILE A 70 -2.869 -5.484 -20.324 1.00 0.00 O ATOM 1063 CB ILE A 70 -5.711 -4.900 -19.708 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -6.861 -5.312 -18.796 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -6.226 -3.887 -20.728 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -7.294 -4.107 -17.965 1.00 0.00 C ATOM 0 H ILE A 70 -4.677 -7.054 -18.598 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.866 -6.394 -21.251 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.913 -4.462 -19.109 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -7.698 -5.680 -19.389 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -6.550 -6.127 -18.143 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.610 -3.010 -20.208 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.412 -3.590 -21.389 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.025 -4.338 -21.317 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -8.117 -4.394 -17.310 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.454 -3.760 -17.363 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.621 -3.306 -18.628 1.00 0.00 H new ATOM 1078 N GLU A 71 -3.699 -5.794 -22.335 1.00 0.00 N ATOM 1079 CA GLU A 71 -2.402 -5.453 -22.971 1.00 0.00 C ATOM 1080 C GLU A 71 -2.346 -3.944 -23.188 1.00 0.00 C ATOM 1081 O GLU A 71 -3.353 -3.267 -23.159 1.00 0.00 O ATOM 1082 CB GLU A 71 -2.284 -6.160 -24.320 1.00 0.00 C ATOM 1083 CG GLU A 71 -3.378 -5.654 -25.260 1.00 0.00 C ATOM 1084 CD GLU A 71 -3.303 -6.420 -26.577 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -4.166 -6.210 -27.413 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -2.382 -7.206 -26.732 1.00 0.00 O ATOM 0 H GLU A 71 -4.453 -6.028 -22.981 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.583 -5.773 -22.327 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.302 -5.974 -24.755 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -2.375 -7.238 -24.186 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -4.358 -5.789 -24.802 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -3.254 -4.586 -25.439 1.00 0.00 H new ATOM 1094 N ALA A 72 -1.183 -3.414 -23.410 1.00 0.00 N ATOM 1095 CA ALA A 72 -1.076 -1.950 -23.638 1.00 0.00 C ATOM 1096 C ALA A 72 -1.757 -1.607 -24.965 1.00 0.00 C ATOM 1097 O ALA A 72 -2.220 -0.503 -25.174 1.00 0.00 O ATOM 1098 CB ALA A 72 0.395 -1.543 -23.692 1.00 0.00 C ATOM 0 H ALA A 72 -0.302 -3.928 -23.444 1.00 0.00 H new ATOM 0 HA ALA A 72 -1.561 -1.412 -22.824 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.469 -0.468 -23.859 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.878 -1.798 -22.748 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.889 -2.072 -24.507 1.00 0.00 H new ATOM 1104 N GLY A 73 -1.819 -2.556 -25.860 1.00 0.00 N ATOM 1105 CA GLY A 73 -2.465 -2.300 -27.178 1.00 0.00 C ATOM 1106 C GLY A 73 -3.874 -1.744 -26.965 1.00 0.00 C ATOM 1107 O GLY A 73 -4.351 -0.935 -27.735 1.00 0.00 O ATOM 0 H GLY A 73 -1.449 -3.498 -25.734 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -1.868 -1.593 -27.755 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -2.512 -3.223 -27.756 1.00 0.00 H new ATOM 1111 N GLN A 74 -4.543 -2.162 -25.925 1.00 0.00 N ATOM 1112 CA GLN A 74 -5.915 -1.637 -25.675 1.00 0.00 C ATOM 1113 C GLN A 74 -5.857 -0.537 -24.611 1.00 0.00 C ATOM 1114 O GLN A 74 -6.862 0.043 -24.253 1.00 0.00 O ATOM 1115 CB GLN A 74 -6.843 -2.770 -25.223 1.00 0.00 C ATOM 1116 CG GLN A 74 -6.196 -3.565 -24.092 1.00 0.00 C ATOM 1117 CD GLN A 74 -6.961 -4.875 -23.905 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -6.491 -5.778 -23.244 1.00 0.00 O ATOM 1119 NE2 GLN A 74 -8.131 -5.018 -24.464 1.00 0.00 N ATOM 0 H GLN A 74 -4.202 -2.839 -25.243 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.312 -1.217 -26.599 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.795 -2.358 -24.889 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -7.059 -3.430 -26.063 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.151 -3.769 -24.325 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -6.210 -2.986 -23.169 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -8.527 -4.260 -25.020 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -8.650 -5.888 -24.345 1.00 0.00 H new ATOM 1128 N LEU A 75 -4.685 -0.238 -24.110 1.00 0.00 N ATOM 1129 CA LEU A 75 -4.571 0.835 -23.078 1.00 0.00 C ATOM 1130 C LEU A 75 -3.747 1.997 -23.610 1.00 0.00 C ATOM 1131 O LEU A 75 -2.776 1.817 -24.317 1.00 0.00 O ATOM 1132 CB LEU A 75 -3.838 0.317 -21.842 1.00 0.00 C ATOM 1133 CG LEU A 75 -4.564 -0.877 -21.248 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -3.595 -1.653 -20.362 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -5.729 -0.373 -20.400 1.00 0.00 C ATOM 0 H LEU A 75 -3.807 -0.688 -24.370 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.585 1.150 -22.829 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -2.820 0.034 -22.109 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.763 1.110 -21.098 1.00 0.00 H new ATOM 0 HG LEU A 75 -4.937 -1.524 -22.042 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.106 -2.513 -19.930 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.750 -1.995 -20.960 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.235 -1.006 -19.562 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -6.258 -1.222 -19.968 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -5.349 0.263 -19.600 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.413 0.201 -21.026 1.00 0.00 H new ATOM 1147 N THR A 76 -4.093 3.182 -23.213 1.00 0.00 N ATOM 1148 CA THR A 76 -3.299 4.363 -23.617 1.00 0.00 C ATOM 1149 C THR A 76 -2.728 4.937 -22.327 1.00 0.00 C ATOM 1150 O THR A 76 -3.455 5.202 -21.391 1.00 0.00 O ATOM 1151 CB THR A 76 -4.198 5.387 -24.320 1.00 0.00 C ATOM 1152 OG1 THR A 76 -3.482 5.978 -25.397 1.00 0.00 O ATOM 1153 CG2 THR A 76 -4.628 6.478 -23.335 1.00 0.00 C ATOM 0 H THR A 76 -4.899 3.384 -22.621 1.00 0.00 H new ATOM 0 HA THR A 76 -2.506 4.102 -24.318 1.00 0.00 H new ATOM 0 HB THR A 76 -5.087 4.882 -24.698 1.00 0.00 H new ATOM 0 HG1 THR A 76 -4.054 6.632 -25.850 1.00 0.00 H new ATOM 0 HG21 THR A 76 -5.266 7.199 -23.846 1.00 0.00 H new ATOM 0 HG22 THR A 76 -5.179 6.027 -22.510 1.00 0.00 H new ATOM 0 HG23 THR A 76 -3.745 6.986 -22.947 1.00 0.00 H new ATOM 1161 N ILE A 77 -1.442 5.100 -22.231 1.00 0.00 N ATOM 1162 CA ILE A 77 -0.896 5.620 -20.951 1.00 0.00 C ATOM 1163 C ILE A 77 -1.024 7.130 -20.896 1.00 0.00 C ATOM 1164 O ILE A 77 -0.325 7.853 -21.579 1.00 0.00 O ATOM 1165 CB ILE A 77 0.578 5.252 -20.790 1.00 0.00 C ATOM 1166 CG1 ILE A 77 0.755 3.745 -20.993 1.00 0.00 C ATOM 1167 CG2 ILE A 77 1.034 5.647 -19.380 1.00 0.00 C ATOM 1168 CD1 ILE A 77 1.190 3.085 -19.683 1.00 0.00 C ATOM 0 H ILE A 77 -0.759 4.902 -22.963 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.471 5.166 -20.144 1.00 0.00 H new ATOM 0 HB ILE A 77 1.178 5.780 -21.531 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.180 3.304 -21.338 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.499 3.560 -21.767 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.085 5.389 -19.252 1.00 0.00 H new ATOM 0 HG22 ILE A 77 0.904 6.721 -19.243 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.437 5.112 -18.641 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.313 2.013 -19.839 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.137 3.515 -19.356 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.431 3.256 -18.920 1.00 0.00 H new ATOM 1180 N ILE A 78 -1.880 7.614 -20.050 1.00 0.00 N ATOM 1181 CA ILE A 78 -2.017 9.081 -19.901 1.00 0.00 C ATOM 1182 C ILE A 78 -0.697 9.599 -19.378 1.00 0.00 C ATOM 1183 O ILE A 78 -0.313 10.728 -19.605 1.00 0.00 O ATOM 1184 CB ILE A 78 -3.082 9.400 -18.861 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -4.468 9.232 -19.479 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -2.890 10.836 -18.367 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -4.662 7.774 -19.891 1.00 0.00 C ATOM 0 H ILE A 78 -2.492 7.056 -19.454 1.00 0.00 H new ATOM 0 HA ILE A 78 -2.291 9.531 -20.855 1.00 0.00 H new ATOM 0 HB ILE A 78 -2.991 8.717 -18.016 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -5.236 9.525 -18.763 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -4.574 9.884 -20.346 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.651 11.069 -17.622 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -1.901 10.938 -17.920 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -2.982 11.525 -19.207 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -5.651 7.649 -20.333 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.901 7.498 -20.621 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.573 7.133 -19.014 1.00 0.00 H new ATOM 1199 N GLU A 79 -0.022 8.767 -18.642 1.00 0.00 N ATOM 1200 CA GLU A 79 1.268 9.175 -18.042 1.00 0.00 C ATOM 1201 C GLU A 79 1.002 10.359 -17.131 1.00 0.00 C ATOM 1202 O GLU A 79 0.202 10.285 -16.223 1.00 0.00 O ATOM 1203 CB GLU A 79 2.254 9.575 -19.141 1.00 0.00 C ATOM 1204 CG GLU A 79 2.585 8.349 -19.986 1.00 0.00 C ATOM 1205 CD GLU A 79 3.665 8.709 -21.008 1.00 0.00 C ATOM 1206 OE1 GLU A 79 3.958 9.887 -21.137 1.00 0.00 O ATOM 1207 OE2 GLU A 79 4.179 7.803 -21.644 1.00 0.00 O ATOM 0 H GLU A 79 -0.314 7.813 -18.430 1.00 0.00 H new ATOM 0 HA GLU A 79 1.702 8.349 -17.478 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.823 10.357 -19.766 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.163 9.984 -18.700 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.931 7.536 -19.347 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.690 7.994 -20.497 1.00 0.00 H new ATOM 1215 N GLY A 80 1.649 11.452 -17.373 1.00 0.00 N ATOM 1216 CA GLY A 80 1.413 12.644 -16.520 1.00 0.00 C ATOM 1217 C GLY A 80 1.762 12.305 -15.073 1.00 0.00 C ATOM 1218 O GLY A 80 2.613 12.929 -14.471 1.00 0.00 O ATOM 0 H GLY A 80 2.331 11.576 -18.122 1.00 0.00 H new ATOM 0 HA2 GLY A 80 2.021 13.480 -16.867 1.00 0.00 H new ATOM 0 HA3 GLY A 80 0.371 12.956 -16.591 1.00 0.00 H new ATOM 1222 N PHE A 81 1.112 11.323 -14.501 1.00 0.00 N ATOM 1223 CA PHE A 81 1.421 10.962 -13.090 1.00 0.00 C ATOM 1224 C PHE A 81 2.221 9.658 -13.043 1.00 0.00 C ATOM 1225 O PHE A 81 1.769 8.621 -13.489 1.00 0.00 O ATOM 1226 CB PHE A 81 0.119 10.770 -12.316 1.00 0.00 C ATOM 1227 CG PHE A 81 0.430 10.686 -10.844 1.00 0.00 C ATOM 1228 CD1 PHE A 81 0.715 9.449 -10.258 1.00 0.00 C ATOM 1229 CD2 PHE A 81 0.438 11.851 -10.071 1.00 0.00 C ATOM 1230 CE1 PHE A 81 1.006 9.377 -8.893 1.00 0.00 C ATOM 1231 CE2 PHE A 81 0.729 11.780 -8.706 1.00 0.00 C ATOM 1232 CZ PHE A 81 1.014 10.542 -8.116 1.00 0.00 C ATOM 0 H PHE A 81 0.387 10.762 -14.948 1.00 0.00 H new ATOM 0 HA PHE A 81 2.008 11.764 -12.643 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -0.560 11.600 -12.510 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -0.385 9.862 -12.647 1.00 0.00 H new ATOM 0 HD1 PHE A 81 0.710 8.551 -10.859 1.00 0.00 H new ATOM 0 HD2 PHE A 81 0.220 12.805 -10.528 1.00 0.00 H new ATOM 0 HE1 PHE A 81 1.225 8.423 -8.437 1.00 0.00 H new ATOM 0 HE2 PHE A 81 0.734 12.679 -8.107 1.00 0.00 H new ATOM 0 HZ PHE A 81 1.240 10.486 -7.061 1.00 0.00 H new ATOM 1242 N LYS A 82 3.396 9.698 -12.477 1.00 0.00 N ATOM 1243 CA LYS A 82 4.220 8.462 -12.363 1.00 0.00 C ATOM 1244 C LYS A 82 5.099 8.565 -11.132 1.00 0.00 C ATOM 1245 O LYS A 82 5.936 9.436 -11.037 1.00 0.00 O ATOM 1246 CB LYS A 82 5.137 8.296 -13.575 1.00 0.00 C ATOM 1247 CG LYS A 82 6.082 7.107 -13.326 1.00 0.00 C ATOM 1248 CD LYS A 82 7.426 7.588 -12.755 1.00 0.00 C ATOM 1249 CE LYS A 82 8.433 6.433 -12.769 1.00 0.00 C ATOM 1250 NZ LYS A 82 8.813 6.080 -11.368 1.00 0.00 N ATOM 0 H LYS A 82 3.823 10.538 -12.087 1.00 0.00 H new ATOM 0 HA LYS A 82 3.543 7.610 -12.301 1.00 0.00 H new ATOM 0 HB2 LYS A 82 4.546 8.125 -14.475 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.713 9.207 -13.740 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.617 6.406 -12.633 1.00 0.00 H new ATOM 0 HG3 LYS A 82 6.250 6.569 -14.259 1.00 0.00 H new ATOM 0 HD2 LYS A 82 7.806 8.422 -13.345 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.290 7.953 -11.737 1.00 0.00 H new ATOM 0 HE2 LYS A 82 8.000 5.566 -13.268 1.00 0.00 H new ATOM 0 HE3 LYS A 82 9.319 6.717 -13.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 9.359 5.195 -11.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 9.391 6.843 -10.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 7.953 5.956 -10.796 1.00 0.00 H new ATOM 1264 N ARG A 83 4.947 7.673 -10.203 1.00 0.00 N ATOM 1265 CA ARG A 83 5.813 7.714 -9.001 1.00 0.00 C ATOM 1266 C ARG A 83 5.997 6.294 -8.488 1.00 0.00 C ATOM 1267 O ARG A 83 5.240 5.403 -8.815 1.00 0.00 O ATOM 1268 CB ARG A 83 5.184 8.596 -7.917 1.00 0.00 C ATOM 1269 CG ARG A 83 5.223 10.064 -8.354 1.00 0.00 C ATOM 1270 CD ARG A 83 6.674 10.494 -8.597 1.00 0.00 C ATOM 1271 NE ARG A 83 6.938 11.783 -7.906 1.00 0.00 N ATOM 1272 CZ ARG A 83 8.084 12.384 -8.076 1.00 0.00 C ATOM 1273 NH1 ARG A 83 8.987 11.854 -8.855 1.00 0.00 N ATOM 1274 NH2 ARG A 83 8.326 13.510 -7.467 1.00 0.00 N ATOM 0 H ARG A 83 4.262 6.918 -10.223 1.00 0.00 H new ATOM 0 HA ARG A 83 6.782 8.142 -9.260 1.00 0.00 H new ATOM 0 HB2 ARG A 83 4.154 8.288 -7.737 1.00 0.00 H new ATOM 0 HB3 ARG A 83 5.722 8.472 -6.977 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.637 10.198 -9.263 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.771 10.693 -7.588 1.00 0.00 H new ATOM 0 HD2 ARG A 83 7.357 9.727 -8.230 1.00 0.00 H new ATOM 0 HD3 ARG A 83 6.858 10.599 -9.666 1.00 0.00 H new ATOM 0 HE ARG A 83 6.227 12.196 -7.302 1.00 0.00 H new ATOM 0 HH11 ARG A 83 8.797 10.972 -9.330 1.00 0.00 H new ATOM 0 HH12 ARG A 83 9.883 12.322 -8.989 1.00 0.00 H new ATOM 0 HH21 ARG A 83 7.620 13.922 -6.857 1.00 0.00 H new ATOM 0 HH22 ARG A 83 9.222 13.979 -7.600 1.00 0.00 H new ATOM 1288 N GLU A 84 7.001 6.066 -7.695 1.00 0.00 N ATOM 1289 CA GLU A 84 7.225 4.695 -7.180 1.00 0.00 C ATOM 1290 C GLU A 84 6.276 4.433 -6.016 1.00 0.00 C ATOM 1291 O GLU A 84 6.489 4.888 -4.911 1.00 0.00 O ATOM 1292 CB GLU A 84 8.671 4.563 -6.705 1.00 0.00 C ATOM 1293 CG GLU A 84 9.607 4.791 -7.893 1.00 0.00 C ATOM 1294 CD GLU A 84 9.889 6.287 -8.043 1.00 0.00 C ATOM 1295 OE1 GLU A 84 9.485 7.038 -7.172 1.00 0.00 O ATOM 1296 OE2 GLU A 84 10.504 6.656 -9.030 1.00 0.00 O ATOM 0 H GLU A 84 7.673 6.767 -7.383 1.00 0.00 H new ATOM 0 HA GLU A 84 7.037 3.969 -7.971 1.00 0.00 H new ATOM 0 HB2 GLU A 84 8.877 5.289 -5.918 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.838 3.574 -6.278 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.540 4.248 -7.743 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.155 4.402 -8.805 1.00 0.00 H new ATOM 1304 N LEU A 85 5.240 3.681 -6.248 1.00 0.00 N ATOM 1305 CA LEU A 85 4.299 3.373 -5.144 1.00 0.00 C ATOM 1306 C LEU A 85 5.018 2.426 -4.194 1.00 0.00 C ATOM 1307 O LEU A 85 5.557 1.423 -4.608 1.00 0.00 O ATOM 1308 CB LEU A 85 3.045 2.681 -5.693 1.00 0.00 C ATOM 1309 CG LEU A 85 1.843 3.056 -4.822 1.00 0.00 C ATOM 1310 CD1 LEU A 85 0.947 4.062 -5.549 1.00 0.00 C ATOM 1311 CD2 LEU A 85 1.024 1.809 -4.489 1.00 0.00 C ATOM 0 H LEU A 85 5.006 3.268 -7.151 1.00 0.00 H new ATOM 0 HA LEU A 85 3.993 4.289 -4.638 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.870 2.984 -6.725 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.184 1.600 -5.697 1.00 0.00 H new ATOM 0 HG LEU A 85 2.217 3.505 -3.902 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.098 4.317 -4.915 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.518 4.964 -5.771 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.587 3.622 -6.479 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.172 2.088 -3.869 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.667 1.351 -5.412 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.648 1.097 -3.948 1.00 0.00 H new ATOM 1323 N ASN A 86 5.059 2.735 -2.935 1.00 0.00 N ATOM 1324 CA ASN A 86 5.771 1.836 -1.992 1.00 0.00 C ATOM 1325 C ASN A 86 4.848 1.479 -0.837 1.00 0.00 C ATOM 1326 O ASN A 86 4.384 2.327 -0.102 1.00 0.00 O ATOM 1327 CB ASN A 86 7.027 2.540 -1.487 1.00 0.00 C ATOM 1328 CG ASN A 86 7.986 2.708 -2.669 1.00 0.00 C ATOM 1329 OD1 ASN A 86 7.639 2.233 -3.837 1.00 0.00 O flip ATOM 1330 ND2 ASN A 86 9.056 3.270 -2.532 1.00 0.00 N flip ATOM 0 H ASN A 86 4.635 3.564 -2.518 1.00 0.00 H new ATOM 0 HA ASN A 86 6.062 0.915 -2.496 1.00 0.00 H new ATOM 0 HB2 ASN A 86 6.774 3.511 -1.061 1.00 0.00 H new ATOM 0 HB3 ASN A 86 7.497 1.957 -0.695 1.00 0.00 H new ATOM 0 HD21 ASN A 86 9.325 3.640 -1.620 1.00 0.00 H new ATOM 0 HD22 ASN A 86 9.684 3.372 -3.329 1.00 0.00 H new ATOM 1480 N THR A 95 9.525 -1.680 -3.898 1.00 0.00 N ATOM 1481 CA THR A 95 9.022 -0.453 -4.576 1.00 0.00 C ATOM 1482 C THR A 95 8.037 -0.838 -5.674 1.00 0.00 C ATOM 1483 O THR A 95 8.144 -1.881 -6.287 1.00 0.00 O ATOM 1484 CB THR A 95 10.187 0.325 -5.194 1.00 0.00 C ATOM 1485 OG1 THR A 95 10.656 1.292 -4.267 1.00 0.00 O ATOM 1486 CG2 THR A 95 9.709 1.027 -6.466 1.00 0.00 C ATOM 0 HA THR A 95 8.522 0.174 -3.838 1.00 0.00 H new ATOM 0 HB THR A 95 10.996 -0.363 -5.439 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.403 1.789 -4.662 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.536 1.582 -6.908 1.00 0.00 H new ATOM 0 HG22 THR A 95 9.348 0.284 -7.178 1.00 0.00 H new ATOM 0 HG23 THR A 95 8.901 1.716 -6.220 1.00 0.00 H new ATOM 1494 N VAL A 96 7.082 0.007 -5.923 1.00 0.00 N ATOM 1495 CA VAL A 96 6.080 -0.281 -6.977 1.00 0.00 C ATOM 1496 C VAL A 96 5.801 1.000 -7.763 1.00 0.00 C ATOM 1497 O VAL A 96 5.582 2.041 -7.190 1.00 0.00 O ATOM 1498 CB VAL A 96 4.803 -0.779 -6.304 1.00 0.00 C ATOM 1499 CG1 VAL A 96 3.650 -0.787 -7.309 1.00 0.00 C ATOM 1500 CG2 VAL A 96 5.040 -2.199 -5.778 1.00 0.00 C ATOM 0 H VAL A 96 6.952 0.894 -5.436 1.00 0.00 H new ATOM 0 HA VAL A 96 6.450 -1.042 -7.664 1.00 0.00 H new ATOM 0 HB VAL A 96 4.544 -0.116 -5.478 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.744 -1.144 -6.820 1.00 0.00 H new ATOM 0 HG12 VAL A 96 3.487 0.224 -7.683 1.00 0.00 H new ATOM 0 HG13 VAL A 96 3.897 -1.447 -8.141 1.00 0.00 H new ATOM 0 HG21 VAL A 96 4.134 -2.564 -5.295 1.00 0.00 H new ATOM 0 HG22 VAL A 96 5.299 -2.856 -6.608 1.00 0.00 H new ATOM 0 HG23 VAL A 96 5.856 -2.188 -5.056 1.00 0.00 H new ATOM 1510 N ILE A 97 5.801 0.943 -9.066 1.00 0.00 N ATOM 1511 CA ILE A 97 5.527 2.183 -9.847 1.00 0.00 C ATOM 1512 C ILE A 97 4.130 2.093 -10.449 1.00 0.00 C ATOM 1513 O ILE A 97 3.746 1.086 -11.009 1.00 0.00 O ATOM 1514 CB ILE A 97 6.564 2.345 -10.953 1.00 0.00 C ATOM 1515 CG1 ILE A 97 7.917 1.833 -10.453 1.00 0.00 C ATOM 1516 CG2 ILE A 97 6.677 3.831 -11.307 1.00 0.00 C ATOM 1517 CD1 ILE A 97 9.043 2.456 -11.278 1.00 0.00 C ATOM 0 H ILE A 97 5.976 0.104 -9.618 1.00 0.00 H new ATOM 0 HA ILE A 97 5.585 3.049 -9.188 1.00 0.00 H new ATOM 0 HB ILE A 97 6.266 1.777 -11.834 1.00 0.00 H new ATOM 0 HG12 ILE A 97 8.044 2.083 -9.400 1.00 0.00 H new ATOM 0 HG13 ILE A 97 7.956 0.746 -10.530 1.00 0.00 H new ATOM 0 HG21 ILE A 97 7.416 3.962 -12.098 1.00 0.00 H new ATOM 0 HG22 ILE A 97 5.710 4.198 -11.650 1.00 0.00 H new ATOM 0 HG23 ILE A 97 6.986 4.393 -10.425 1.00 0.00 H new ATOM 0 HD11 ILE A 97 10.004 2.088 -10.918 1.00 0.00 H new ATOM 0 HD12 ILE A 97 8.920 2.184 -12.326 1.00 0.00 H new ATOM 0 HD13 ILE A 97 9.009 3.541 -11.179 1.00 0.00 H new ATOM 1529 N TYR A 98 3.362 3.133 -10.307 1.00 0.00 N ATOM 1530 CA TYR A 98 1.966 3.117 -10.829 1.00 0.00 C ATOM 1531 C TYR A 98 1.791 4.182 -11.924 1.00 0.00 C ATOM 1532 O TYR A 98 2.069 5.348 -11.724 1.00 0.00 O ATOM 1533 CB TYR A 98 1.035 3.426 -9.647 1.00 0.00 C ATOM 1534 CG TYR A 98 0.666 2.162 -8.881 1.00 0.00 C ATOM 1535 CD1 TYR A 98 1.311 0.935 -9.126 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.341 2.228 -7.907 1.00 0.00 C ATOM 1537 CE1 TYR A 98 0.948 -0.206 -8.402 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.700 1.087 -7.187 1.00 0.00 C ATOM 1539 CZ TYR A 98 -0.057 -0.130 -7.432 1.00 0.00 C ATOM 1540 OH TYR A 98 -0.411 -1.256 -6.714 1.00 0.00 O ATOM 0 H TYR A 98 3.641 4.001 -9.849 1.00 0.00 H new ATOM 0 HA TYR A 98 1.733 2.146 -11.266 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.522 4.131 -8.974 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.129 3.908 -10.013 1.00 0.00 H new ATOM 0 HD1 TYR A 98 2.087 0.874 -9.874 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.841 3.166 -7.713 1.00 0.00 H new ATOM 0 HE1 TYR A 98 1.444 -1.146 -8.592 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.477 1.145 -6.439 1.00 0.00 H new ATOM 0 HH TYR A 98 -1.187 -1.054 -6.150 1.00 0.00 H new ATOM 1550 N TRP A 99 1.324 3.778 -13.079 1.00 0.00 N ATOM 1551 CA TRP A 99 1.117 4.744 -14.202 1.00 0.00 C ATOM 1552 C TRP A 99 -0.377 4.885 -14.488 1.00 0.00 C ATOM 1553 O TRP A 99 -1.159 4.012 -14.178 1.00 0.00 O ATOM 1554 CB TRP A 99 1.786 4.217 -15.470 1.00 0.00 C ATOM 1555 CG TRP A 99 3.202 4.668 -15.545 1.00 0.00 C ATOM 1556 CD1 TRP A 99 3.612 5.871 -16.001 1.00 0.00 C ATOM 1557 CD2 TRP A 99 4.398 3.934 -15.183 1.00 0.00 C ATOM 1558 NE1 TRP A 99 4.992 5.920 -15.942 1.00 0.00 N ATOM 1559 CE2 TRP A 99 5.520 4.750 -15.441 1.00 0.00 C ATOM 1560 CE3 TRP A 99 4.617 2.653 -14.656 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 6.814 4.310 -15.191 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 5.921 2.208 -14.404 1.00 0.00 C ATOM 1563 CH2 TRP A 99 7.018 3.035 -14.672 1.00 0.00 C ATOM 0 H TRP A 99 1.075 2.812 -13.294 1.00 0.00 H new ATOM 0 HA TRP A 99 1.546 5.705 -13.917 1.00 0.00 H new ATOM 0 HB2 TRP A 99 1.745 3.128 -15.483 1.00 0.00 H new ATOM 0 HB3 TRP A 99 1.241 4.567 -16.347 1.00 0.00 H new ATOM 0 HD1 TRP A 99 2.968 6.663 -16.353 1.00 0.00 H new ATOM 0 HE1 TRP A 99 5.550 6.723 -16.233 1.00 0.00 H new ATOM 0 HE3 TRP A 99 3.778 2.008 -14.444 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.656 4.953 -15.398 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 6.081 1.219 -14.000 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.021 2.684 -14.476 1.00 0.00 H new ATOM 1574 N LEU A 100 -0.774 5.960 -15.110 1.00 0.00 N ATOM 1575 CA LEU A 100 -2.213 6.125 -15.446 1.00 0.00 C ATOM 1576 C LEU A 100 -2.481 5.429 -16.780 1.00 0.00 C ATOM 1577 O LEU A 100 -1.722 5.554 -17.720 1.00 0.00 O ATOM 1578 CB LEU A 100 -2.554 7.616 -15.554 1.00 0.00 C ATOM 1579 CG LEU A 100 -2.616 8.234 -14.156 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -2.875 9.740 -14.275 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -3.764 7.589 -13.374 1.00 0.00 C ATOM 0 H LEU A 100 -0.167 6.727 -15.398 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.833 5.683 -14.666 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.803 8.128 -16.155 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.510 7.744 -16.061 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.672 8.065 -13.639 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.919 10.181 -13.279 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.068 10.204 -14.842 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.822 9.907 -14.788 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.814 8.025 -12.376 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.705 7.767 -13.895 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.591 6.516 -13.293 1.00 0.00 H new ATOM 1593 N ALA A 101 -3.547 4.683 -16.869 1.00 0.00 N ATOM 1594 CA ALA A 101 -3.845 3.968 -18.144 1.00 0.00 C ATOM 1595 C ALA A 101 -5.358 3.935 -18.384 1.00 0.00 C ATOM 1596 O ALA A 101 -6.139 3.780 -17.467 1.00 0.00 O ATOM 1597 CB ALA A 101 -3.319 2.530 -18.050 1.00 0.00 C ATOM 0 H ALA A 101 -4.222 4.537 -16.119 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.361 4.490 -18.970 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.534 2.002 -18.979 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.242 2.547 -17.883 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -3.807 2.018 -17.221 1.00 0.00 H new ATOM 1603 N GLU A 102 -5.774 4.069 -19.617 1.00 0.00 N ATOM 1604 CA GLU A 102 -7.235 4.034 -19.926 1.00 0.00 C ATOM 1605 C GLU A 102 -7.515 2.944 -20.963 1.00 0.00 C ATOM 1606 O GLU A 102 -6.784 2.787 -21.917 1.00 0.00 O ATOM 1607 CB GLU A 102 -7.673 5.390 -20.490 1.00 0.00 C ATOM 1608 CG GLU A 102 -9.173 5.357 -20.796 1.00 0.00 C ATOM 1609 CD GLU A 102 -9.585 6.663 -21.477 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -8.753 7.549 -21.568 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -10.726 6.751 -21.903 1.00 0.00 O ATOM 0 H GLU A 102 -5.164 4.201 -20.424 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.790 3.821 -19.012 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -7.455 6.181 -19.773 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.111 5.617 -21.396 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.404 4.510 -21.441 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.740 5.221 -19.875 1.00 0.00 H new ATOM 1619 N VAL A 103 -8.572 2.195 -20.794 1.00 0.00 N ATOM 1620 CA VAL A 103 -8.883 1.133 -21.793 1.00 0.00 C ATOM 1621 C VAL A 103 -9.773 1.710 -22.891 1.00 0.00 C ATOM 1622 O VAL A 103 -10.870 2.173 -22.640 1.00 0.00 O ATOM 1623 CB VAL A 103 -9.624 -0.034 -21.125 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -8.707 -0.754 -20.141 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -10.848 0.493 -20.381 1.00 0.00 C ATOM 0 H VAL A 103 -9.227 2.271 -20.016 1.00 0.00 H new ATOM 0 HA VAL A 103 -7.945 0.772 -22.215 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.936 -0.736 -21.898 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.248 -1.578 -19.676 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.838 -1.143 -20.672 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.379 -0.055 -19.371 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.372 -0.338 -19.908 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.532 1.204 -19.618 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -11.516 0.989 -21.085 1.00 0.00 H new ATOM 1635 N LYS A 104 -9.324 1.661 -24.113 1.00 0.00 N ATOM 1636 CA LYS A 104 -10.156 2.177 -25.233 1.00 0.00 C ATOM 1637 C LYS A 104 -11.294 1.185 -25.460 1.00 0.00 C ATOM 1638 O LYS A 104 -12.214 1.430 -26.215 1.00 0.00 O ATOM 1639 CB LYS A 104 -9.296 2.292 -26.491 1.00 0.00 C ATOM 1640 CG LYS A 104 -8.715 0.920 -26.837 1.00 0.00 C ATOM 1641 CD LYS A 104 -7.603 1.088 -27.876 1.00 0.00 C ATOM 1642 CE LYS A 104 -6.416 1.822 -27.244 1.00 0.00 C ATOM 1643 NZ LYS A 104 -5.149 1.340 -27.864 1.00 0.00 N ATOM 0 H LYS A 104 -8.415 1.285 -24.385 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.559 3.162 -24.999 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -9.895 2.665 -27.321 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -8.492 3.010 -26.330 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.321 0.443 -25.940 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -9.497 0.269 -27.227 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -7.286 0.113 -28.245 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -7.975 1.648 -28.734 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -6.519 2.897 -27.390 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.397 1.647 -26.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -4.352 1.907 -27.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -5.000 0.341 -27.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -5.210 1.435 -28.898 1.00 0.00 H new ATOM 1657 N ASP A 105 -11.232 0.065 -24.791 1.00 0.00 N ATOM 1658 CA ASP A 105 -12.297 -0.961 -24.931 1.00 0.00 C ATOM 1659 C ASP A 105 -13.172 -0.952 -23.680 1.00 0.00 C ATOM 1660 O ASP A 105 -12.815 -1.488 -22.651 1.00 0.00 O ATOM 1661 CB ASP A 105 -11.667 -2.348 -25.096 1.00 0.00 C ATOM 1662 CG ASP A 105 -11.248 -2.554 -26.554 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -10.679 -3.594 -26.846 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -11.501 -1.667 -27.354 1.00 0.00 O ATOM 0 H ASP A 105 -10.480 -0.182 -24.148 1.00 0.00 H new ATOM 0 HA ASP A 105 -12.902 -0.734 -25.809 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.801 -2.445 -24.441 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -12.378 -3.119 -24.800 1.00 0.00 H new ATOM 1670 N TYR A 106 -14.323 -0.355 -23.767 1.00 0.00 N ATOM 1671 CA TYR A 106 -15.235 -0.318 -22.595 1.00 0.00 C ATOM 1672 C TYR A 106 -15.521 -1.751 -22.153 1.00 0.00 C ATOM 1673 O TYR A 106 -15.747 -2.024 -20.991 1.00 0.00 O ATOM 1674 CB TYR A 106 -16.538 0.373 -23.000 1.00 0.00 C ATOM 1675 CG TYR A 106 -17.438 0.514 -21.800 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -18.257 -0.552 -21.408 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -17.456 1.713 -21.081 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -19.096 -0.416 -20.298 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -18.297 1.849 -19.972 1.00 0.00 C ATOM 1680 CZ TYR A 106 -19.116 0.784 -19.578 1.00 0.00 C ATOM 1681 OH TYR A 106 -19.948 0.918 -18.487 1.00 0.00 O ATOM 0 H TYR A 106 -14.674 0.112 -24.604 1.00 0.00 H new ATOM 0 HA TYR A 106 -14.778 0.232 -21.773 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -16.323 1.355 -23.422 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -17.040 -0.204 -23.776 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -18.241 -1.479 -21.963 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -16.821 2.533 -21.382 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -19.729 -1.237 -19.996 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -18.315 2.776 -19.419 1.00 0.00 H new ATOM 0 HH TYR A 106 -19.839 1.812 -18.100 1.00 0.00 H new ATOM 1691 N ASP A 107 -15.511 -2.666 -23.083 1.00 0.00 N ATOM 1692 CA ASP A 107 -15.777 -4.093 -22.750 1.00 0.00 C ATOM 1693 C ASP A 107 -14.457 -4.870 -22.729 1.00 0.00 C ATOM 1694 O ASP A 107 -14.439 -6.073 -22.902 1.00 0.00 O ATOM 1695 CB ASP A 107 -16.705 -4.695 -23.806 1.00 0.00 C ATOM 1696 CG ASP A 107 -16.002 -4.697 -25.165 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -16.692 -4.799 -26.166 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -14.784 -4.598 -25.185 1.00 0.00 O ATOM 0 H ASP A 107 -15.328 -2.483 -24.070 1.00 0.00 H new ATOM 0 HA ASP A 107 -16.249 -4.155 -21.770 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -16.980 -5.712 -23.526 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -17.629 -4.119 -23.864 1.00 0.00 H new ATOM 1704 N VAL A 108 -13.355 -4.195 -22.535 1.00 0.00 N ATOM 1705 CA VAL A 108 -12.044 -4.909 -22.524 1.00 0.00 C ATOM 1706 C VAL A 108 -12.195 -6.221 -21.766 1.00 0.00 C ATOM 1707 O VAL A 108 -12.985 -6.333 -20.850 1.00 0.00 O ATOM 1708 CB VAL A 108 -10.977 -4.045 -21.846 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -11.418 -3.695 -20.424 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -9.655 -4.810 -21.793 1.00 0.00 C ATOM 0 H VAL A 108 -13.305 -3.187 -22.385 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.735 -5.108 -23.550 1.00 0.00 H new ATOM 0 HB VAL A 108 -10.845 -3.127 -22.419 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -10.655 -3.080 -19.947 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -12.358 -3.144 -20.460 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -11.557 -4.611 -19.850 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.897 -4.193 -21.310 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -9.790 -5.730 -21.225 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -9.334 -5.053 -22.806 1.00 0.00 H new ATOM 1720 N GLU A 109 -11.449 -7.217 -22.143 1.00 0.00 N ATOM 1721 CA GLU A 109 -11.560 -8.520 -21.447 1.00 0.00 C ATOM 1722 C GLU A 109 -10.496 -8.601 -20.358 1.00 0.00 C ATOM 1723 O GLU A 109 -9.324 -8.775 -20.621 1.00 0.00 O ATOM 1724 CB GLU A 109 -11.359 -9.659 -22.449 1.00 0.00 C ATOM 1725 CG GLU A 109 -11.619 -10.994 -21.755 1.00 0.00 C ATOM 1726 CD GLU A 109 -13.112 -11.125 -21.450 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -13.891 -10.468 -22.122 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -13.449 -11.877 -20.552 1.00 0.00 O ATOM 0 H GLU A 109 -10.769 -7.184 -22.902 1.00 0.00 H new ATOM 0 HA GLU A 109 -12.549 -8.610 -20.998 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -12.036 -9.538 -23.295 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -10.344 -9.634 -22.846 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -11.293 -11.817 -22.391 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -11.041 -11.056 -20.833 1.00 0.00 H new ATOM 1736 N ILE A 110 -10.910 -8.485 -19.140 1.00 0.00 N ATOM 1737 CA ILE A 110 -9.955 -8.560 -18.006 1.00 0.00 C ATOM 1738 C ILE A 110 -9.567 -10.020 -17.768 1.00 0.00 C ATOM 1739 O ILE A 110 -10.223 -10.728 -17.031 1.00 0.00 O ATOM 1740 CB ILE A 110 -10.644 -8.022 -16.762 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -11.038 -6.556 -16.979 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -9.711 -8.140 -15.558 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -9.805 -5.732 -17.292 1.00 0.00 C ATOM 0 H ILE A 110 -11.883 -8.339 -18.873 1.00 0.00 H new ATOM 0 HA ILE A 110 -9.062 -7.977 -18.229 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.544 -8.607 -16.571 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -11.754 -6.480 -17.797 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.530 -6.167 -16.088 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -10.211 -7.753 -14.671 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -9.451 -9.187 -15.400 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -8.804 -7.565 -15.743 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.092 -4.692 -17.445 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.104 -5.796 -16.460 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.332 -6.115 -18.196 1.00 0.00 H new ATOM 1755 N ARG A 111 -8.513 -10.483 -18.374 1.00 0.00 N ATOM 1756 CA ARG A 111 -8.119 -11.904 -18.151 1.00 0.00 C ATOM 1757 C ARG A 111 -7.123 -11.973 -17.005 1.00 0.00 C ATOM 1758 O ARG A 111 -6.093 -11.336 -17.017 1.00 0.00 O ATOM 1759 CB ARG A 111 -7.506 -12.485 -19.421 1.00 0.00 C ATOM 1760 CG ARG A 111 -8.623 -13.089 -20.272 1.00 0.00 C ATOM 1761 CD ARG A 111 -8.144 -13.216 -21.717 1.00 0.00 C ATOM 1762 NE ARG A 111 -7.822 -11.863 -22.255 1.00 0.00 N ATOM 1763 CZ ARG A 111 -7.743 -11.677 -23.543 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -7.956 -12.673 -24.359 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -7.455 -10.496 -24.019 1.00 0.00 N ATOM 0 H ARG A 111 -7.914 -9.951 -19.005 1.00 0.00 H new ATOM 0 HA ARG A 111 -9.002 -12.490 -17.897 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -6.984 -11.707 -19.979 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -6.768 -13.247 -19.170 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -8.904 -14.068 -19.883 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -9.512 -12.460 -20.225 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -7.264 -13.857 -21.764 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -8.915 -13.688 -22.327 1.00 0.00 H new ATOM 0 HE ARG A 111 -7.664 -11.084 -21.616 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -8.184 -13.596 -23.989 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -7.894 -12.529 -25.367 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -7.291 -9.716 -23.383 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -7.394 -10.353 -25.027 1.00 0.00 H new ATOM 1779 N LEU A 112 -7.434 -12.736 -16.003 1.00 0.00 N ATOM 1780 CA LEU A 112 -6.518 -12.833 -14.842 1.00 0.00 C ATOM 1781 C LEU A 112 -5.640 -14.073 -14.986 1.00 0.00 C ATOM 1782 O LEU A 112 -6.091 -15.190 -14.818 1.00 0.00 O ATOM 1783 CB LEU A 112 -7.347 -12.947 -13.563 1.00 0.00 C ATOM 1784 CG LEU A 112 -8.540 -11.994 -13.641 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -9.339 -12.071 -12.339 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -8.035 -10.566 -13.846 1.00 0.00 C ATOM 0 H LEU A 112 -8.283 -13.297 -15.937 1.00 0.00 H new ATOM 0 HA LEU A 112 -5.886 -11.946 -14.798 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.695 -13.972 -13.433 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.732 -12.706 -12.696 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.180 -12.277 -14.477 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.190 -11.392 -12.394 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.697 -13.090 -12.191 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.700 -11.786 -11.503 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.884 -9.884 -13.902 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.396 -10.282 -13.009 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.464 -10.511 -14.773 1.00 0.00 H new ATOM 1798 N SER A 113 -4.386 -13.892 -15.284 1.00 0.00 N ATOM 1799 CA SER A 113 -3.484 -15.064 -15.423 1.00 0.00 C ATOM 1800 C SER A 113 -3.247 -15.673 -14.041 1.00 0.00 C ATOM 1801 O SER A 113 -3.605 -15.100 -13.030 1.00 0.00 O ATOM 1802 CB SER A 113 -2.149 -14.616 -16.017 1.00 0.00 C ATOM 1803 OG SER A 113 -2.379 -13.977 -17.266 1.00 0.00 O ATOM 0 H SER A 113 -3.948 -12.984 -15.437 1.00 0.00 H new ATOM 0 HA SER A 113 -3.940 -15.803 -16.082 1.00 0.00 H new ATOM 0 HB2 SER A 113 -1.645 -13.932 -15.334 1.00 0.00 H new ATOM 0 HB3 SER A 113 -1.491 -15.475 -16.151 1.00 0.00 H new ATOM 0 HG SER A 113 -2.545 -13.022 -17.119 1.00 0.00 H new ATOM 1809 N HIS A 114 -2.651 -16.830 -13.986 1.00 0.00 N ATOM 1810 CA HIS A 114 -2.397 -17.475 -12.666 1.00 0.00 C ATOM 1811 C HIS A 114 -1.867 -16.432 -11.682 1.00 0.00 C ATOM 1812 O HIS A 114 -0.683 -16.167 -11.620 1.00 0.00 O ATOM 1813 CB HIS A 114 -1.371 -18.596 -12.834 1.00 0.00 C ATOM 1814 CG HIS A 114 -0.006 -18.002 -13.055 1.00 0.00 C ATOM 1815 ND1 HIS A 114 1.074 -18.301 -12.235 1.00 0.00 N ATOM 1816 CD2 HIS A 114 0.471 -17.117 -13.993 1.00 0.00 C ATOM 1817 CE1 HIS A 114 2.134 -17.607 -12.690 1.00 0.00 C ATOM 1818 NE2 HIS A 114 1.817 -16.873 -13.758 1.00 0.00 N ATOM 0 H HIS A 114 -2.328 -17.358 -14.797 1.00 0.00 H new ATOM 0 HA HIS A 114 -3.327 -17.894 -12.280 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -1.363 -19.231 -11.948 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -1.644 -19.229 -13.678 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -0.112 -16.679 -14.790 1.00 0.00 H new ATOM 0 HE1 HIS A 114 3.118 -17.640 -12.246 1.00 0.00 H new ATOM 0 HE2 HIS A 114 2.435 -16.260 -14.291 1.00 0.00 H new ATOM 1827 N GLU A 115 -2.735 -15.841 -10.912 1.00 0.00 N ATOM 1828 CA GLU A 115 -2.288 -14.815 -9.928 1.00 0.00 C ATOM 1829 C GLU A 115 -3.509 -14.177 -9.271 1.00 0.00 C ATOM 1830 O GLU A 115 -3.608 -14.091 -8.063 1.00 0.00 O ATOM 1831 CB GLU A 115 -1.493 -13.715 -10.646 1.00 0.00 C ATOM 1832 CG GLU A 115 0.016 -13.979 -10.544 1.00 0.00 C ATOM 1833 CD GLU A 115 0.726 -12.734 -10.003 1.00 0.00 C ATOM 1834 OE1 GLU A 115 1.831 -12.468 -10.448 1.00 0.00 O ATOM 1835 OE2 GLU A 115 0.158 -12.072 -9.150 1.00 0.00 O ATOM 0 H GLU A 115 -3.738 -16.024 -10.921 1.00 0.00 H new ATOM 0 HA GLU A 115 -1.661 -15.295 -9.177 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -1.789 -13.671 -11.694 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -1.728 -12.745 -10.207 1.00 0.00 H new ATOM 0 HG2 GLU A 115 0.202 -14.829 -9.887 1.00 0.00 H new ATOM 0 HG3 GLU A 115 0.416 -14.240 -11.524 1.00 0.00 H new ATOM 1843 N HIS A 116 -4.434 -13.709 -10.064 1.00 0.00 N ATOM 1844 CA HIS A 116 -5.644 -13.055 -9.497 1.00 0.00 C ATOM 1845 C HIS A 116 -6.904 -13.771 -9.980 1.00 0.00 C ATOM 1846 O HIS A 116 -6.985 -14.221 -11.106 1.00 0.00 O ATOM 1847 CB HIS A 116 -5.682 -11.598 -9.956 1.00 0.00 C ATOM 1848 CG HIS A 116 -4.520 -10.855 -9.352 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -3.227 -10.974 -9.847 1.00 0.00 N ATOM 1850 CD2 HIS A 116 -4.434 -9.985 -8.290 1.00 0.00 C ATOM 1851 CE1 HIS A 116 -2.427 -10.199 -9.089 1.00 0.00 C ATOM 1852 NE2 HIS A 116 -3.114 -9.576 -8.131 1.00 0.00 N ATOM 0 H HIS A 116 -4.402 -13.752 -11.083 1.00 0.00 H new ATOM 0 HA HIS A 116 -5.604 -13.104 -8.409 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -5.636 -11.546 -11.044 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -6.621 -11.134 -9.655 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -5.263 -9.668 -7.675 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -1.362 -10.095 -9.239 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -2.748 -8.934 -7.428 1.00 0.00 H new ATOM 1861 N GLN A 117 -7.892 -13.877 -9.135 1.00 0.00 N ATOM 1862 CA GLN A 117 -9.151 -14.555 -9.541 1.00 0.00 C ATOM 1863 C GLN A 117 -10.325 -13.593 -9.320 1.00 0.00 C ATOM 1864 O GLN A 117 -11.476 -13.984 -9.336 1.00 0.00 O ATOM 1865 CB GLN A 117 -9.347 -15.815 -8.694 1.00 0.00 C ATOM 1866 CG GLN A 117 -10.357 -16.737 -9.378 1.00 0.00 C ATOM 1867 CD GLN A 117 -10.537 -18.003 -8.538 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -9.814 -18.222 -7.586 1.00 0.00 O ATOM 1869 NE2 GLN A 117 -11.476 -18.854 -8.852 1.00 0.00 N ATOM 0 H GLN A 117 -7.880 -13.522 -8.179 1.00 0.00 H new ATOM 0 HA GLN A 117 -9.101 -14.837 -10.593 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -8.396 -16.331 -8.566 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -9.700 -15.546 -7.699 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -11.312 -16.226 -9.495 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -10.010 -16.997 -10.378 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -12.083 -18.671 -9.651 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -11.602 -19.701 -8.299 1.00 0.00 H new ATOM 1878 N ALA A 118 -10.037 -12.333 -9.105 1.00 0.00 N ATOM 1879 CA ALA A 118 -11.129 -11.343 -8.874 1.00 0.00 C ATOM 1880 C ALA A 118 -10.739 -9.983 -9.456 1.00 0.00 C ATOM 1881 O ALA A 118 -9.642 -9.504 -9.256 1.00 0.00 O ATOM 1882 CB ALA A 118 -11.345 -11.175 -7.372 1.00 0.00 C ATOM 0 H ALA A 118 -9.092 -11.949 -9.080 1.00 0.00 H new ATOM 0 HA ALA A 118 -12.038 -11.704 -9.356 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -12.142 -10.452 -7.198 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.623 -12.134 -6.935 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -10.425 -10.818 -6.910 1.00 0.00 H new ATOM 1888 N TYR A 119 -11.641 -9.346 -10.154 1.00 0.00 N ATOM 1889 CA TYR A 119 -11.330 -8.006 -10.720 1.00 0.00 C ATOM 1890 C TYR A 119 -12.629 -7.216 -10.881 1.00 0.00 C ATOM 1891 O TYR A 119 -13.628 -7.736 -11.332 1.00 0.00 O ATOM 1892 CB TYR A 119 -10.633 -8.180 -12.063 1.00 0.00 C ATOM 1893 CG TYR A 119 -11.625 -8.556 -13.125 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -12.067 -9.877 -13.223 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -12.074 -7.592 -14.031 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -12.961 -10.238 -14.231 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -12.975 -7.947 -15.036 1.00 0.00 C ATOM 1898 CZ TYR A 119 -13.418 -9.275 -15.139 1.00 0.00 C ATOM 1899 OH TYR A 119 -14.297 -9.634 -16.140 1.00 0.00 O ATOM 0 H TYR A 119 -12.577 -9.697 -10.355 1.00 0.00 H new ATOM 0 HA TYR A 119 -10.667 -7.457 -10.051 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -10.128 -7.255 -12.340 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -9.866 -8.950 -11.984 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -11.717 -10.618 -12.519 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -11.724 -6.573 -13.954 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -13.301 -11.260 -14.311 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -13.330 -7.202 -15.733 1.00 0.00 H new ATOM 0 HH TYR A 119 -14.515 -8.847 -16.682 1.00 0.00 H new ATOM 1909 N ARG A 120 -12.633 -5.967 -10.494 1.00 0.00 N ATOM 1910 CA ARG A 120 -13.885 -5.162 -10.604 1.00 0.00 C ATOM 1911 C ARG A 120 -13.578 -3.745 -11.087 1.00 0.00 C ATOM 1912 O ARG A 120 -12.549 -3.180 -10.776 1.00 0.00 O ATOM 1913 CB ARG A 120 -14.534 -5.044 -9.225 1.00 0.00 C ATOM 1914 CG ARG A 120 -14.835 -6.427 -8.655 1.00 0.00 C ATOM 1915 CD ARG A 120 -14.844 -6.339 -7.128 1.00 0.00 C ATOM 1916 NE ARG A 120 -15.069 -7.692 -6.552 1.00 0.00 N ATOM 1917 CZ ARG A 120 -15.795 -7.833 -5.476 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -16.298 -6.786 -4.881 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -16.007 -9.023 -4.989 1.00 0.00 N ATOM 0 H ARG A 120 -11.829 -5.472 -10.109 1.00 0.00 H new ATOM 0 HA ARG A 120 -14.546 -5.661 -11.313 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -13.871 -4.503 -8.550 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.455 -4.466 -9.299 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -15.799 -6.783 -9.018 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -14.084 -7.144 -8.987 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -13.897 -5.934 -6.771 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -15.627 -5.657 -6.797 1.00 0.00 H new ATOM 0 HE ARG A 120 -14.656 -8.511 -6.998 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -16.124 -5.854 -5.256 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -16.865 -6.900 -4.041 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -15.606 -9.841 -5.448 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -16.574 -9.137 -4.149 1.00 0.00 H new ATOM 1933 N TRP A 121 -14.499 -3.150 -11.790 1.00 0.00 N ATOM 1934 CA TRP A 121 -14.313 -1.745 -12.245 1.00 0.00 C ATOM 1935 C TRP A 121 -15.141 -0.860 -11.306 1.00 0.00 C ATOM 1936 O TRP A 121 -16.355 -0.839 -11.383 1.00 0.00 O ATOM 1937 CB TRP A 121 -14.834 -1.592 -13.678 1.00 0.00 C ATOM 1938 CG TRP A 121 -13.863 -2.175 -14.654 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -13.894 -3.443 -15.131 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -12.731 -1.527 -15.296 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -12.850 -3.610 -16.023 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -12.107 -2.457 -16.159 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -12.189 -0.237 -15.214 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -10.988 -2.116 -16.914 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -11.063 0.106 -15.974 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -10.465 -0.830 -16.821 1.00 0.00 C ATOM 0 H TRP A 121 -15.380 -3.580 -12.071 1.00 0.00 H new ATOM 0 HA TRP A 121 -13.260 -1.465 -12.227 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -15.799 -2.089 -13.775 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -14.995 -0.537 -13.902 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -14.616 -4.199 -14.859 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -12.654 -4.479 -16.519 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -12.641 0.496 -14.562 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -10.529 -2.844 -17.567 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -10.654 1.103 -15.904 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -9.598 -0.556 -17.403 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.514 -0.163 -10.392 1.00 0.00 N ATOM 1958 CA LEU A 122 -15.300 0.668 -9.429 1.00 0.00 C ATOM 1959 C LEU A 122 -14.852 2.129 -9.466 1.00 0.00 C ATOM 1960 O LEU A 122 -13.923 2.493 -10.155 1.00 0.00 O ATOM 1961 CB LEU A 122 -15.102 0.139 -8.006 1.00 0.00 C ATOM 1962 CG LEU A 122 -14.648 -1.321 -8.030 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -13.294 -1.433 -7.334 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -15.675 -2.193 -7.300 1.00 0.00 C ATOM 0 H LEU A 122 -13.502 -0.133 -10.271 1.00 0.00 H new ATOM 0 HA LEU A 122 -16.349 0.608 -9.718 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -14.361 0.747 -7.487 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -16.034 0.226 -7.447 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.561 -1.661 -9.062 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.963 -2.471 -7.347 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.565 -0.813 -7.855 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -13.386 -1.094 -6.302 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -15.348 -3.233 -7.319 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -15.766 -1.860 -6.266 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -16.642 -2.107 -7.795 1.00 0.00 H new ATOM 1976 N GLY A 123 -15.518 2.964 -8.710 1.00 0.00 N ATOM 1977 CA GLY A 123 -15.159 4.409 -8.671 1.00 0.00 C ATOM 1978 C GLY A 123 -14.029 4.637 -7.662 1.00 0.00 C ATOM 1979 O GLY A 123 -13.566 3.721 -7.013 1.00 0.00 O ATOM 0 H GLY A 123 -16.302 2.701 -8.113 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -14.847 4.742 -9.661 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -16.031 5.002 -8.395 1.00 0.00 H new ATOM 1983 N LEU A 124 -13.584 5.859 -7.531 1.00 0.00 N ATOM 1984 CA LEU A 124 -12.482 6.170 -6.572 1.00 0.00 C ATOM 1985 C LEU A 124 -12.842 5.717 -5.158 1.00 0.00 C ATOM 1986 O LEU A 124 -12.069 5.058 -4.491 1.00 0.00 O ATOM 1987 CB LEU A 124 -12.255 7.683 -6.567 1.00 0.00 C ATOM 1988 CG LEU A 124 -11.345 8.085 -5.400 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -10.074 7.236 -5.404 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -10.965 9.559 -5.553 1.00 0.00 C ATOM 0 H LEU A 124 -13.939 6.661 -8.051 1.00 0.00 H new ATOM 0 HA LEU A 124 -11.581 5.642 -6.885 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -11.805 7.992 -7.510 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -13.211 8.200 -6.485 1.00 0.00 H new ATOM 0 HG LEU A 124 -11.874 7.926 -4.460 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -9.437 7.531 -4.571 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -10.339 6.184 -5.303 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -9.539 7.387 -6.341 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -10.318 9.855 -4.728 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -10.439 9.703 -6.497 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -11.867 10.170 -5.544 1.00 0.00 H new ATOM 2002 N GLU A 125 -13.995 6.082 -4.684 1.00 0.00 N ATOM 2003 CA GLU A 125 -14.377 5.693 -3.299 1.00 0.00 C ATOM 2004 C GLU A 125 -14.367 4.171 -3.158 1.00 0.00 C ATOM 2005 O GLU A 125 -13.751 3.634 -2.263 1.00 0.00 O ATOM 2006 CB GLU A 125 -15.767 6.246 -2.980 1.00 0.00 C ATOM 2007 CG GLU A 125 -16.844 5.349 -3.589 1.00 0.00 C ATOM 2008 CD GLU A 125 -18.203 6.036 -3.450 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -19.155 5.545 -4.035 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -18.270 7.040 -2.760 1.00 0.00 O ATOM 0 H GLU A 125 -14.689 6.631 -5.191 1.00 0.00 H new ATOM 0 HA GLU A 125 -13.656 6.109 -2.596 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -15.903 6.308 -1.900 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -15.862 7.259 -3.372 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -16.625 5.158 -4.639 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -16.858 4.382 -3.085 1.00 0.00 H new ATOM 2018 N GLU A 126 -15.029 3.464 -4.033 1.00 0.00 N ATOM 2019 CA GLU A 126 -15.026 1.978 -3.922 1.00 0.00 C ATOM 2020 C GLU A 126 -13.602 1.464 -4.111 1.00 0.00 C ATOM 2021 O GLU A 126 -13.182 0.519 -3.480 1.00 0.00 O ATOM 2022 CB GLU A 126 -15.922 1.364 -4.990 1.00 0.00 C ATOM 2023 CG GLU A 126 -15.957 -0.146 -4.792 1.00 0.00 C ATOM 2024 CD GLU A 126 -17.235 -0.716 -5.407 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -17.926 0.023 -6.090 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -17.501 -1.886 -5.185 1.00 0.00 O ATOM 0 H GLU A 126 -15.566 3.846 -4.812 1.00 0.00 H new ATOM 0 HA GLU A 126 -15.401 1.697 -2.938 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -16.928 1.777 -4.922 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.545 1.606 -5.984 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -15.083 -0.604 -5.256 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -15.916 -0.384 -3.729 1.00 0.00 H new ATOM 2034 N ALA A 127 -12.856 2.084 -4.974 1.00 0.00 N ATOM 2035 CA ALA A 127 -11.456 1.644 -5.195 1.00 0.00 C ATOM 2036 C ALA A 127 -10.636 1.977 -3.947 1.00 0.00 C ATOM 2037 O ALA A 127 -9.662 1.323 -3.632 1.00 0.00 O ATOM 2038 CB ALA A 127 -10.885 2.388 -6.401 1.00 0.00 C ATOM 0 H ALA A 127 -13.156 2.879 -5.538 1.00 0.00 H new ATOM 0 HA ALA A 127 -11.420 0.571 -5.383 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.856 2.071 -6.571 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.484 2.164 -7.284 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.907 3.461 -6.210 1.00 0.00 H new ATOM 2044 N CYS A 128 -11.033 3.000 -3.239 1.00 0.00 N ATOM 2045 CA CYS A 128 -10.292 3.403 -2.010 1.00 0.00 C ATOM 2046 C CYS A 128 -10.488 2.357 -0.906 1.00 0.00 C ATOM 2047 O CYS A 128 -9.567 2.029 -0.185 1.00 0.00 O ATOM 2048 CB CYS A 128 -10.813 4.759 -1.530 1.00 0.00 C ATOM 2049 SG CYS A 128 -11.091 4.703 0.257 1.00 0.00 S ATOM 0 H CYS A 128 -11.844 3.577 -3.461 1.00 0.00 H new ATOM 0 HA CYS A 128 -9.229 3.476 -2.240 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -10.095 5.542 -1.772 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -11.741 5.007 -2.045 1.00 0.00 H new ATOM 0 HG CYS A 128 -12.250 4.166 0.499 1.00 0.00 H new ATOM 2055 N GLN A 129 -11.673 1.825 -0.759 1.00 0.00 N ATOM 2056 CA GLN A 129 -11.888 0.804 0.310 1.00 0.00 C ATOM 2057 C GLN A 129 -11.105 -0.462 -0.029 1.00 0.00 C ATOM 2058 O GLN A 129 -10.449 -1.048 0.808 1.00 0.00 O ATOM 2059 CB GLN A 129 -13.375 0.436 0.433 1.00 0.00 C ATOM 2060 CG GLN A 129 -14.146 0.888 -0.805 1.00 0.00 C ATOM 2061 CD GLN A 129 -14.830 2.226 -0.523 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -14.209 3.146 -0.027 1.00 0.00 O ATOM 2063 NE2 GLN A 129 -16.093 2.373 -0.820 1.00 0.00 N ATOM 0 H GLN A 129 -12.492 2.049 -1.324 1.00 0.00 H new ATOM 0 HA GLN A 129 -11.546 1.228 1.254 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -13.479 -0.642 0.559 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -13.798 0.903 1.322 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -13.468 0.986 -1.652 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -14.889 0.138 -1.077 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -16.612 1.600 -1.236 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -16.560 3.261 -0.636 1.00 0.00 H new ATOM 2072 N LEU A 130 -11.188 -0.895 -1.250 1.00 0.00 N ATOM 2073 CA LEU A 130 -10.473 -2.134 -1.656 1.00 0.00 C ATOM 2074 C LEU A 130 -8.959 -1.941 -1.550 1.00 0.00 C ATOM 2075 O LEU A 130 -8.251 -2.800 -1.062 1.00 0.00 O ATOM 2076 CB LEU A 130 -10.843 -2.447 -3.098 1.00 0.00 C ATOM 2077 CG LEU A 130 -12.362 -2.481 -3.236 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -12.712 -2.740 -4.691 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -12.941 -3.596 -2.372 1.00 0.00 C ATOM 0 H LEU A 130 -11.723 -0.442 -1.991 1.00 0.00 H new ATOM 0 HA LEU A 130 -10.762 -2.953 -0.998 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -10.423 -1.694 -3.764 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -10.418 -3.406 -3.394 1.00 0.00 H new ATOM 0 HG LEU A 130 -12.780 -1.528 -2.910 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -13.796 -2.767 -4.805 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -12.301 -1.943 -5.311 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -12.290 -3.696 -5.002 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -14.026 -3.612 -2.477 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -12.531 -4.554 -2.692 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -12.680 -3.420 -1.328 1.00 0.00 H new ATOM 2091 N ALA A 131 -8.450 -0.831 -2.002 1.00 0.00 N ATOM 2092 CA ALA A 131 -6.981 -0.616 -1.920 1.00 0.00 C ATOM 2093 C ALA A 131 -6.544 -0.633 -0.455 1.00 0.00 C ATOM 2094 O ALA A 131 -5.661 -1.369 -0.070 1.00 0.00 O ATOM 2095 CB ALA A 131 -6.624 0.731 -2.537 1.00 0.00 C ATOM 0 H ALA A 131 -8.983 -0.069 -2.421 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.470 -1.411 -2.464 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.547 0.885 -2.475 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -6.933 0.746 -3.582 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -7.136 1.526 -1.996 1.00 0.00 H new ATOM 2101 N GLN A 132 -7.170 0.162 0.370 1.00 0.00 N ATOM 2102 CA GLN A 132 -6.802 0.181 1.818 1.00 0.00 C ATOM 2103 C GLN A 132 -5.361 0.670 1.999 1.00 0.00 C ATOM 2104 O GLN A 132 -4.892 0.835 3.106 1.00 0.00 O ATOM 2105 CB GLN A 132 -6.955 -1.237 2.386 1.00 0.00 C ATOM 2106 CG GLN A 132 -5.586 -1.814 2.766 1.00 0.00 C ATOM 2107 CD GLN A 132 -5.740 -3.285 3.161 1.00 0.00 C ATOM 2108 OE1 GLN A 132 -6.820 -3.727 3.501 1.00 0.00 O ATOM 2109 NE2 GLN A 132 -4.695 -4.065 3.127 1.00 0.00 N ATOM 0 H GLN A 132 -7.921 0.800 0.105 1.00 0.00 H new ATOM 0 HA GLN A 132 -7.461 0.866 2.352 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -7.603 -1.216 3.262 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -7.436 -1.880 1.649 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -4.896 -1.723 1.927 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -5.158 -1.248 3.593 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -3.790 -3.692 2.841 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -4.783 -5.048 3.386 1.00 0.00 H new ATOM 2118 N PHE A 133 -4.649 0.907 0.931 1.00 0.00 N ATOM 2119 CA PHE A 133 -3.243 1.381 1.081 1.00 0.00 C ATOM 2120 C PHE A 133 -3.199 2.903 0.898 1.00 0.00 C ATOM 2121 O PHE A 133 -3.785 3.446 -0.018 1.00 0.00 O ATOM 2122 CB PHE A 133 -2.355 0.716 0.027 1.00 0.00 C ATOM 2123 CG PHE A 133 -2.738 -0.741 -0.128 1.00 0.00 C ATOM 2124 CD1 PHE A 133 -2.342 -1.683 0.833 1.00 0.00 C ATOM 2125 CD2 PHE A 133 -3.484 -1.152 -1.243 1.00 0.00 C ATOM 2126 CE1 PHE A 133 -2.697 -3.030 0.679 1.00 0.00 C ATOM 2127 CE2 PHE A 133 -3.837 -2.497 -1.393 1.00 0.00 C ATOM 2128 CZ PHE A 133 -3.443 -3.436 -0.434 1.00 0.00 C ATOM 0 H PHE A 133 -4.975 0.795 -0.029 1.00 0.00 H new ATOM 0 HA PHE A 133 -2.878 1.119 2.074 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -2.461 1.232 -0.927 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -1.308 0.796 0.319 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -1.764 -1.371 1.690 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -3.786 -0.429 -1.986 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -2.395 -3.756 1.420 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -4.414 -2.811 -2.250 1.00 0.00 H new ATOM 0 HZ PHE A 133 -3.714 -4.475 -0.552 1.00 0.00 H new ATOM 2138 N LYS A 134 -2.514 3.598 1.767 1.00 0.00 N ATOM 2139 CA LYS A 134 -2.445 5.084 1.643 1.00 0.00 C ATOM 2140 C LYS A 134 -1.905 5.464 0.267 1.00 0.00 C ATOM 2141 O LYS A 134 -2.410 6.355 -0.383 1.00 0.00 O ATOM 2142 CB LYS A 134 -1.517 5.649 2.723 1.00 0.00 C ATOM 2143 CG LYS A 134 -1.599 7.178 2.718 1.00 0.00 C ATOM 2144 CD LYS A 134 -0.671 7.746 3.795 1.00 0.00 C ATOM 2145 CE LYS A 134 -0.974 9.230 4.006 1.00 0.00 C ATOM 2146 NZ LYS A 134 -0.110 9.762 5.098 1.00 0.00 N ATOM 0 H LYS A 134 -2.001 3.203 2.555 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.446 5.498 1.767 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -1.802 5.262 3.701 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -0.491 5.329 2.540 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -1.315 7.564 1.739 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -2.625 7.498 2.902 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -0.806 7.201 4.729 1.00 0.00 H new ATOM 0 HD3 LYS A 134 0.370 7.616 3.498 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -0.796 9.783 3.084 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -2.025 9.365 4.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -0.315 10.771 5.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -0.301 9.240 5.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 0.890 9.646 4.837 1.00 0.00 H new ATOM 2160 N GLU A 135 -0.883 4.797 -0.189 1.00 0.00 N ATOM 2161 CA GLU A 135 -0.328 5.138 -1.525 1.00 0.00 C ATOM 2162 C GLU A 135 -1.381 4.855 -2.590 1.00 0.00 C ATOM 2163 O GLU A 135 -1.663 5.685 -3.427 1.00 0.00 O ATOM 2164 CB GLU A 135 0.908 4.287 -1.796 1.00 0.00 C ATOM 2165 CG GLU A 135 1.976 4.568 -0.737 1.00 0.00 C ATOM 2166 CD GLU A 135 2.309 6.062 -0.726 1.00 0.00 C ATOM 2167 OE1 GLU A 135 2.575 6.598 -1.788 1.00 0.00 O ATOM 2168 OE2 GLU A 135 2.285 6.645 0.347 1.00 0.00 O ATOM 0 H GLU A 135 -0.412 4.037 0.301 1.00 0.00 H new ATOM 0 HA GLU A 135 -0.053 6.192 -1.549 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.642 3.230 -1.785 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.301 4.507 -2.789 1.00 0.00 H new ATOM 0 HG2 GLU A 135 1.619 4.258 0.245 1.00 0.00 H new ATOM 0 HG3 GLU A 135 2.874 3.987 -0.948 1.00 0.00 H new ATOM 2176 N MET A 136 -1.973 3.691 -2.561 1.00 0.00 N ATOM 2177 CA MET A 136 -3.011 3.363 -3.578 1.00 0.00 C ATOM 2178 C MET A 136 -4.166 4.351 -3.483 1.00 0.00 C ATOM 2179 O MET A 136 -4.635 4.866 -4.480 1.00 0.00 O ATOM 2180 CB MET A 136 -3.569 1.972 -3.318 1.00 0.00 C ATOM 2181 CG MET A 136 -2.582 0.906 -3.783 1.00 0.00 C ATOM 2182 SD MET A 136 -3.452 -0.297 -4.810 1.00 0.00 S ATOM 2183 CE MET A 136 -4.117 0.887 -6.006 1.00 0.00 C ATOM 0 H MET A 136 -1.783 2.956 -1.879 1.00 0.00 H new ATOM 0 HA MET A 136 -2.550 3.412 -4.564 1.00 0.00 H new ATOM 0 HB2 MET A 136 -3.773 1.848 -2.254 1.00 0.00 H new ATOM 0 HB3 MET A 136 -4.518 1.851 -3.841 1.00 0.00 H new ATOM 0 HG2 MET A 136 -1.771 1.365 -4.348 1.00 0.00 H new ATOM 0 HG3 MET A 136 -2.131 0.410 -2.923 1.00 0.00 H new ATOM 0 HE1 MET A 136 -4.174 0.419 -6.989 1.00 0.00 H new ATOM 0 HE2 MET A 136 -5.114 1.198 -5.694 1.00 0.00 H new ATOM 0 HE3 MET A 136 -3.464 1.759 -6.057 1.00 0.00 H new ATOM 2193 N LYS A 137 -4.632 4.617 -2.298 1.00 0.00 N ATOM 2194 CA LYS A 137 -5.758 5.571 -2.168 1.00 0.00 C ATOM 2195 C LYS A 137 -5.324 6.889 -2.804 1.00 0.00 C ATOM 2196 O LYS A 137 -6.046 7.487 -3.576 1.00 0.00 O ATOM 2197 CB LYS A 137 -6.099 5.769 -0.684 1.00 0.00 C ATOM 2198 CG LYS A 137 -6.677 4.464 -0.119 1.00 0.00 C ATOM 2199 CD LYS A 137 -6.936 4.624 1.382 1.00 0.00 C ATOM 2200 CE LYS A 137 -8.140 5.540 1.600 1.00 0.00 C ATOM 2201 NZ LYS A 137 -9.128 4.860 2.486 1.00 0.00 N ATOM 0 H LYS A 137 -4.286 4.220 -1.425 1.00 0.00 H new ATOM 0 HA LYS A 137 -6.649 5.193 -2.669 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -5.206 6.055 -0.129 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -6.819 6.579 -0.569 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -7.604 4.212 -0.633 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -5.983 3.642 -0.293 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -7.121 3.650 1.835 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -6.056 5.041 1.871 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -7.819 6.480 2.049 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -8.602 5.785 0.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -10.021 4.725 1.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -8.754 3.935 2.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -9.299 5.445 3.329 1.00 0.00 H new ATOM 2215 N ALA A 138 -4.130 7.328 -2.507 1.00 0.00 N ATOM 2216 CA ALA A 138 -3.625 8.584 -3.119 1.00 0.00 C ATOM 2217 C ALA A 138 -3.278 8.327 -4.588 1.00 0.00 C ATOM 2218 O ALA A 138 -3.565 9.131 -5.453 1.00 0.00 O ATOM 2219 CB ALA A 138 -2.380 9.059 -2.369 1.00 0.00 C ATOM 0 H ALA A 138 -3.484 6.868 -1.866 1.00 0.00 H new ATOM 0 HA ALA A 138 -4.394 9.354 -3.057 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -2.013 9.980 -2.821 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -2.632 9.242 -1.325 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -1.606 8.293 -2.426 1.00 0.00 H new ATOM 2225 N ALA A 139 -2.666 7.207 -4.881 1.00 0.00 N ATOM 2226 CA ALA A 139 -2.316 6.910 -6.296 1.00 0.00 C ATOM 2227 C ALA A 139 -3.592 6.975 -7.121 1.00 0.00 C ATOM 2228 O ALA A 139 -3.621 7.505 -8.214 1.00 0.00 O ATOM 2229 CB ALA A 139 -1.714 5.506 -6.396 1.00 0.00 C ATOM 0 H ALA A 139 -2.397 6.493 -4.204 1.00 0.00 H new ATOM 0 HA ALA A 139 -1.587 7.632 -6.664 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.459 5.293 -7.434 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -0.814 5.451 -5.783 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -2.439 4.773 -6.042 1.00 0.00 H new ATOM 2235 N LEU A 140 -4.655 6.452 -6.585 1.00 0.00 N ATOM 2236 CA LEU A 140 -5.953 6.488 -7.304 1.00 0.00 C ATOM 2237 C LEU A 140 -6.506 7.913 -7.267 1.00 0.00 C ATOM 2238 O LEU A 140 -7.049 8.408 -8.233 1.00 0.00 O ATOM 2239 CB LEU A 140 -6.931 5.548 -6.604 1.00 0.00 C ATOM 2240 CG LEU A 140 -6.571 4.099 -6.935 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -6.980 3.186 -5.777 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -7.318 3.681 -8.198 1.00 0.00 C ATOM 0 H LEU A 140 -4.680 5.998 -5.672 1.00 0.00 H new ATOM 0 HA LEU A 140 -5.816 6.176 -8.339 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -6.895 5.706 -5.526 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -7.951 5.763 -6.924 1.00 0.00 H new ATOM 0 HG LEU A 140 -5.496 4.016 -7.093 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -6.721 2.155 -6.018 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -6.455 3.490 -4.871 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -8.055 3.262 -5.616 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -7.069 2.649 -8.443 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -8.392 3.765 -8.030 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -7.028 4.331 -9.024 1.00 0.00 H new ATOM 2254 N GLN A 141 -6.376 8.572 -6.149 1.00 0.00 N ATOM 2255 CA GLN A 141 -6.897 9.962 -6.032 1.00 0.00 C ATOM 2256 C GLN A 141 -6.040 10.911 -6.867 1.00 0.00 C ATOM 2257 O GLN A 141 -6.549 11.682 -7.654 1.00 0.00 O ATOM 2258 CB GLN A 141 -6.886 10.377 -4.556 1.00 0.00 C ATOM 2259 CG GLN A 141 -6.225 11.751 -4.384 1.00 0.00 C ATOM 2260 CD GLN A 141 -6.335 12.184 -2.919 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -6.955 11.410 -2.072 1.00 0.00 O flip ATOM 2262 NE2 GLN A 141 -5.848 13.232 -2.544 1.00 0.00 N flip ATOM 0 H GLN A 141 -5.929 8.206 -5.308 1.00 0.00 H new ATOM 0 HA GLN A 141 -7.919 10.008 -6.408 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.907 10.408 -4.174 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -6.349 9.633 -3.968 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -5.178 11.704 -4.684 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -6.709 12.484 -5.029 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -5.364 13.836 -3.208 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -5.924 13.508 -1.565 1.00 0.00 H new ATOM 2271 N GLU A 142 -4.745 10.858 -6.720 1.00 0.00 N ATOM 2272 CA GLU A 142 -3.882 11.760 -7.528 1.00 0.00 C ATOM 2273 C GLU A 142 -4.047 11.390 -8.996 1.00 0.00 C ATOM 2274 O GLU A 142 -4.052 12.237 -9.867 1.00 0.00 O ATOM 2275 CB GLU A 142 -2.417 11.592 -7.115 1.00 0.00 C ATOM 2276 CG GLU A 142 -2.237 12.042 -5.663 1.00 0.00 C ATOM 2277 CD GLU A 142 -2.564 13.533 -5.542 1.00 0.00 C ATOM 2278 OE1 GLU A 142 -2.577 14.202 -6.561 1.00 0.00 O ATOM 2279 OE2 GLU A 142 -2.794 13.978 -4.430 1.00 0.00 O ATOM 0 H GLU A 142 -4.252 10.235 -6.081 1.00 0.00 H new ATOM 0 HA GLU A 142 -4.172 12.798 -7.365 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -2.116 10.550 -7.223 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -1.774 12.180 -7.771 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -2.888 11.462 -5.009 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -1.213 11.857 -5.339 1.00 0.00 H new ATOM 2287 N GLY A 143 -4.203 10.123 -9.271 1.00 0.00 N ATOM 2288 CA GLY A 143 -4.390 9.684 -10.678 1.00 0.00 C ATOM 2289 C GLY A 143 -5.673 10.309 -11.223 1.00 0.00 C ATOM 2290 O GLY A 143 -5.720 10.781 -12.339 1.00 0.00 O ATOM 0 H GLY A 143 -4.209 9.374 -8.579 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.536 9.986 -11.284 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.449 8.597 -10.729 1.00 0.00 H new ATOM 2294 N HIS A 144 -6.712 10.326 -10.431 1.00 0.00 N ATOM 2295 CA HIS A 144 -7.995 10.931 -10.889 1.00 0.00 C ATOM 2296 C HIS A 144 -7.788 12.425 -11.150 1.00 0.00 C ATOM 2297 O HIS A 144 -8.365 12.996 -12.054 1.00 0.00 O ATOM 2298 CB HIS A 144 -9.056 10.759 -9.799 1.00 0.00 C ATOM 2299 CG HIS A 144 -10.056 9.714 -10.216 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -10.526 8.746 -9.338 1.00 0.00 N ATOM 2301 CD2 HIS A 144 -10.685 9.474 -11.413 1.00 0.00 C ATOM 2302 CE1 HIS A 144 -11.399 7.975 -10.018 1.00 0.00 C ATOM 2303 NE2 HIS A 144 -11.527 8.378 -11.281 1.00 0.00 N ATOM 0 H HIS A 144 -6.727 9.946 -9.485 1.00 0.00 H new ATOM 0 HA HIS A 144 -8.322 10.437 -11.804 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -8.582 10.468 -8.861 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -9.562 11.708 -9.619 1.00 0.00 H new ATOM 0 HD1 HIS A 144 -10.260 8.638 -8.359 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -10.546 10.049 -12.317 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -11.928 7.136 -9.592 1.00 0.00 H new ATOM 2312 N GLN A 145 -6.980 13.063 -10.349 1.00 0.00 N ATOM 2313 CA GLN A 145 -6.740 14.522 -10.526 1.00 0.00 C ATOM 2314 C GLN A 145 -6.258 14.815 -11.950 1.00 0.00 C ATOM 2315 O GLN A 145 -6.746 15.715 -12.604 1.00 0.00 O ATOM 2316 CB GLN A 145 -5.674 14.973 -9.523 1.00 0.00 C ATOM 2317 CG GLN A 145 -5.459 16.483 -9.630 1.00 0.00 C ATOM 2318 CD GLN A 145 -6.636 17.216 -8.986 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -6.824 17.151 -7.788 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -7.442 17.915 -9.738 1.00 0.00 N ATOM 0 H GLN A 145 -6.473 12.633 -9.575 1.00 0.00 H new ATOM 0 HA GLN A 145 -7.671 15.063 -10.355 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -5.982 14.712 -8.511 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -4.737 14.450 -9.716 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -4.529 16.764 -9.136 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -5.365 16.774 -10.676 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -7.283 17.969 -10.744 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -8.231 18.408 -9.320 1.00 0.00 H new ATOM 2329 N PHE A 146 -5.303 14.071 -12.436 1.00 0.00 N ATOM 2330 CA PHE A 146 -4.798 14.327 -13.816 1.00 0.00 C ATOM 2331 C PHE A 146 -5.926 14.095 -14.817 1.00 0.00 C ATOM 2332 O PHE A 146 -6.156 14.891 -15.702 1.00 0.00 O ATOM 2333 CB PHE A 146 -3.643 13.372 -14.133 1.00 0.00 C ATOM 2334 CG PHE A 146 -2.951 13.806 -15.407 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.519 13.512 -16.655 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.735 14.499 -15.341 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -2.870 13.912 -17.829 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -1.090 14.895 -16.519 1.00 0.00 C ATOM 2339 CZ PHE A 146 -1.661 14.597 -17.762 1.00 0.00 C ATOM 0 H PHE A 146 -4.852 13.301 -11.941 1.00 0.00 H new ATOM 0 HA PHE A 146 -4.446 15.356 -13.884 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -2.931 13.362 -13.308 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -4.020 12.355 -14.242 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.456 12.978 -16.710 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -1.295 14.728 -14.381 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -3.309 13.688 -18.790 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -0.153 15.430 -16.469 1.00 0.00 H new ATOM 0 HZ PHE A 146 -1.162 14.899 -18.671 1.00 0.00 H new ATOM 2349 N LEU A 147 -6.631 13.004 -14.685 1.00 0.00 N ATOM 2350 CA LEU A 147 -7.736 12.718 -15.638 1.00 0.00 C ATOM 2351 C LEU A 147 -8.647 13.940 -15.733 1.00 0.00 C ATOM 2352 O LEU A 147 -9.036 14.351 -16.807 1.00 0.00 O ATOM 2353 CB LEU A 147 -8.517 11.501 -15.143 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.541 10.339 -14.940 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.302 9.084 -14.513 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -6.790 10.066 -16.248 1.00 0.00 C ATOM 0 H LEU A 147 -6.488 12.301 -13.960 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.336 12.503 -16.629 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -9.026 11.734 -14.208 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -9.286 11.227 -15.865 1.00 0.00 H new ATOM 0 HG LEU A 147 -6.828 10.604 -14.159 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -7.599 8.263 -14.371 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.827 9.278 -13.578 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -9.023 8.815 -15.285 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -6.095 9.239 -16.103 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -7.504 9.808 -17.030 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.236 10.957 -16.542 1.00 0.00 H new ATOM 2368 N CYS A 148 -8.960 14.546 -14.622 1.00 0.00 N ATOM 2369 CA CYS A 148 -9.818 15.763 -14.658 1.00 0.00 C ATOM 2370 C CYS A 148 -9.077 16.863 -15.430 1.00 0.00 C ATOM 2371 O CYS A 148 -9.675 17.685 -16.097 1.00 0.00 O ATOM 2372 CB CYS A 148 -10.095 16.238 -13.229 1.00 0.00 C ATOM 2373 SG CYS A 148 -11.064 14.989 -12.344 1.00 0.00 S ATOM 0 H CYS A 148 -8.660 14.252 -13.693 1.00 0.00 H new ATOM 0 HA CYS A 148 -10.765 15.537 -15.148 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -9.155 16.419 -12.708 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -10.636 17.184 -13.249 1.00 0.00 H new ATOM 0 HG CYS A 148 -10.311 13.963 -12.079 1.00 0.00 H new ATOM 2379 N SER A 149 -7.774 16.879 -15.330 1.00 0.00 N ATOM 2380 CA SER A 149 -6.966 17.912 -16.041 1.00 0.00 C ATOM 2381 C SER A 149 -6.998 17.670 -17.554 1.00 0.00 C ATOM 2382 O SER A 149 -6.847 18.584 -18.341 1.00 0.00 O ATOM 2383 CB SER A 149 -5.516 17.830 -15.560 1.00 0.00 C ATOM 2384 OG SER A 149 -5.484 17.902 -14.140 1.00 0.00 O ATOM 0 H SER A 149 -7.230 16.214 -14.780 1.00 0.00 H new ATOM 0 HA SER A 149 -7.385 18.895 -15.828 1.00 0.00 H new ATOM 0 HB2 SER A 149 -5.061 16.899 -15.898 1.00 0.00 H new ATOM 0 HB3 SER A 149 -4.932 18.644 -15.990 1.00 0.00 H new ATOM 0 HG SER A 149 -5.791 17.051 -13.762 1.00 0.00 H new ATOM 2390 N ILE A 150 -7.167 16.444 -17.965 1.00 0.00 N ATOM 2391 CA ILE A 150 -7.184 16.132 -19.420 1.00 0.00 C ATOM 2392 C ILE A 150 -8.499 16.581 -20.033 1.00 0.00 C ATOM 2393 O ILE A 150 -9.044 17.614 -19.699 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.049 14.622 -19.602 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -5.997 14.102 -18.631 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -6.628 14.313 -21.039 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -5.639 12.657 -18.979 1.00 0.00 C ATOM 0 H ILE A 150 -7.295 15.640 -17.350 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.360 16.652 -19.909 1.00 0.00 H new ATOM 0 HB ILE A 150 -8.005 14.137 -19.403 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -5.106 14.728 -18.677 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -6.373 14.157 -17.609 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -6.532 13.235 -21.166 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -7.381 14.694 -21.729 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -5.670 14.789 -21.248 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -4.886 12.291 -18.281 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.531 12.034 -18.910 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -5.244 12.614 -19.994 1.00 0.00 H new ATOM 2409 N GLU A 151 -9.012 15.793 -20.920 1.00 0.00 N ATOM 2410 CA GLU A 151 -10.307 16.135 -21.566 1.00 0.00 C ATOM 2411 C GLU A 151 -11.412 15.375 -20.836 1.00 0.00 C ATOM 2412 O GLU A 151 -12.512 15.208 -21.323 1.00 0.00 O ATOM 2413 CB GLU A 151 -10.267 15.739 -23.046 1.00 0.00 C ATOM 2414 CG GLU A 151 -10.271 14.215 -23.180 1.00 0.00 C ATOM 2415 CD GLU A 151 -10.077 13.839 -24.649 1.00 0.00 C ATOM 2416 OE1 GLU A 151 -10.076 14.739 -25.474 1.00 0.00 O ATOM 2417 OE2 GLU A 151 -9.927 12.661 -24.927 1.00 0.00 O ATOM 0 H GLU A 151 -8.591 14.918 -21.232 1.00 0.00 H new ATOM 0 HA GLU A 151 -10.495 17.207 -21.508 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -11.127 16.160 -23.567 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -9.375 16.151 -23.517 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -9.475 13.783 -22.573 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -11.212 13.808 -22.809 1.00 0.00 H new ATOM 2425 N ALA A 152 -11.106 14.912 -19.657 1.00 0.00 N ATOM 2426 CA ALA A 152 -12.111 14.155 -18.859 1.00 0.00 C ATOM 2427 C ALA A 152 -13.199 15.114 -18.384 1.00 0.00 C ATOM 2428 O ALA A 152 -14.364 14.771 -18.325 1.00 0.00 O ATOM 2429 CB ALA A 152 -11.424 13.525 -17.647 1.00 0.00 C ATOM 0 H ALA A 152 -10.197 15.026 -19.208 1.00 0.00 H new ATOM 0 HA ALA A 152 -12.555 13.372 -19.473 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -12.157 12.970 -17.061 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -10.641 12.846 -17.985 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -10.984 14.309 -17.030 1.00 0.00 H new ATOM 2435 N LEU A 153 -12.826 16.319 -18.046 1.00 0.00 N ATOM 2436 CA LEU A 153 -13.835 17.308 -17.577 1.00 0.00 C ATOM 2437 C LEU A 153 -14.804 16.629 -16.607 1.00 0.00 C ATOM 2438 O LEU A 153 -14.667 15.444 -16.309 1.00 0.00 O ATOM 2439 CB LEU A 153 -14.610 17.839 -18.783 1.00 0.00 C ATOM 2440 CG LEU A 153 -15.514 18.996 -18.350 1.00 0.00 C ATOM 2441 CD1 LEU A 153 -14.658 20.215 -17.992 1.00 0.00 C ATOM 2442 CD2 LEU A 153 -16.455 19.357 -19.500 1.00 0.00 C ATOM 0 H LEU A 153 -11.865 16.660 -18.075 1.00 0.00 H new ATOM 0 HA LEU A 153 -13.334 18.132 -17.068 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -13.916 18.176 -19.553 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -15.210 17.041 -19.221 1.00 0.00 H new ATOM 0 HG LEU A 153 -16.095 18.696 -17.478 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -15.305 21.036 -17.684 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -13.984 19.959 -17.175 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -14.075 20.518 -18.862 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -17.101 20.181 -19.197 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -15.869 19.656 -20.369 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -17.066 18.491 -19.755 1.00 0.00 H new