USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 773 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 143 THR OG1 : rot -62:sc= 0.597 USER MOD Set 1.2: A 148 GLN : amide:sc= -8.66! C(o=-10!,f=-18!) USER MOD Set 1.3: A 149 ASN : amide:sc= -2.34 K(o=-10,f=-14!) USER MOD Single : A 90 HIS : no HD1:sc= -0.31 X(o=-0.31,f=0.068) USER MOD Single : A 97 ASN : amide:sc= -0.143 X(o=-0.14,f=0) USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 CYS SG : rot 82:sc= 1.12 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 61:sc= 1.1 USER MOD Single : A 115 GLN : amide:sc= -0.247 X(o=-0.25,f=-0.13) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= -0.0201 X(o=-0.02,f=-0.084) USER MOD Single : A 125 SER OG : rot -46:sc= 0.429 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot 180:sc= -0.181 USER MOD Single : A 130 THR OG1 : rot -88:sc= 1.3 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 136 CYS SG : rot 100:sc= -1.16 USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 THR OG1 : rot 180:sc= 0 USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 151 HIS : no HD1:sc= -2.48! K(o=-2.5!,f=-0.9) USER MOD Single : A 152 MET CE :methyl -127:sc= -3.15 (180deg=-7.81!) USER MOD Single : A 157 GLN : amide:sc= -0.157 K(o=-0.16,f=-1.6) USER MOD Single : A 159 SER OG : rot 110:sc= -0.0549 USER MOD Single : A 162 HIS : no HD1:sc= -1.81 K(o=-1.8,f=-0.69) USER MOD Single : A 163 MET CE :methyl -179:sc= -0.722 (180deg=-0.754) USER MOD Single : A 165 HIS : no HE2:sc= 0.0193 X(o=0.019,f=-0.16) USER MOD Single : A 168 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 169 SER OG : rot 180:sc= 0 USER MOD Single : A 170 GLN : amide:sc= -0.127 K(o=-0.13,f=-1.2) USER MOD Single : A 171 GLN : amide:sc=-0.00506 X(o=-0.0051,f=-0.28) USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 175 ASN : amide:sc= -0.0567 K(o=-0.057,f=-3.8!) USER MOD Single : A 183 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD ----------------------------------------------------------------- ATOM 112 N GLU A 88 17.058 -17.370 3.057 1.00 0.00 N ATOM 113 CA GLU A 88 16.997 -15.922 3.219 1.00 0.00 C ATOM 114 C GLU A 88 15.557 -15.425 3.139 1.00 0.00 C ATOM 115 O GLU A 88 15.113 -14.636 3.973 1.00 0.00 O ATOM 116 CB GLU A 88 17.847 -15.230 2.151 1.00 0.00 C ATOM 117 CG GLU A 88 19.307 -15.651 2.169 1.00 0.00 C ATOM 118 CD GLU A 88 20.097 -14.968 3.269 1.00 0.00 C ATOM 119 OE1 GLU A 88 20.031 -13.725 3.364 1.00 0.00 O ATOM 120 OE2 GLU A 88 20.783 -15.679 4.034 1.00 0.00 O ATOM 0 HA GLU A 88 17.394 -15.676 4.204 1.00 0.00 H new ATOM 0 HB2 GLU A 88 17.427 -15.446 1.168 1.00 0.00 H new ATOM 0 HB3 GLU A 88 17.787 -14.151 2.293 1.00 0.00 H new ATOM 0 HG2 GLU A 88 19.368 -16.731 2.300 1.00 0.00 H new ATOM 0 HG3 GLU A 88 19.760 -15.421 1.205 1.00 0.00 H new ATOM 127 N ASP A 89 14.832 -15.893 2.129 1.00 0.00 N ATOM 128 CA ASP A 89 13.441 -15.497 1.939 1.00 0.00 C ATOM 129 C ASP A 89 12.730 -15.346 3.280 1.00 0.00 C ATOM 130 O ASP A 89 12.053 -14.348 3.527 1.00 0.00 O ATOM 131 CB ASP A 89 12.710 -16.525 1.073 1.00 0.00 C ATOM 132 CG ASP A 89 13.039 -16.381 -0.400 1.00 0.00 C ATOM 133 OD1 ASP A 89 12.925 -15.254 -0.925 1.00 0.00 O ATOM 134 OD2 ASP A 89 13.411 -17.395 -1.027 1.00 0.00 O ATOM 0 H ASP A 89 15.184 -16.547 1.429 1.00 0.00 H new ATOM 0 HA ASP A 89 13.430 -14.532 1.432 1.00 0.00 H new ATOM 0 HB2 ASP A 89 12.975 -17.529 1.405 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.635 -16.416 1.214 1.00 0.00 H new ATOM 139 N HIS A 90 12.888 -16.345 4.143 1.00 0.00 N ATOM 140 CA HIS A 90 12.261 -16.323 5.460 1.00 0.00 C ATOM 141 C HIS A 90 12.793 -15.163 6.296 1.00 0.00 C ATOM 142 O HIS A 90 12.043 -14.517 7.027 1.00 0.00 O ATOM 143 CB HIS A 90 12.507 -17.646 6.187 1.00 0.00 C ATOM 144 CG HIS A 90 11.484 -17.951 7.238 1.00 0.00 C ATOM 145 ND1 HIS A 90 11.045 -19.229 7.512 1.00 0.00 N ATOM 146 CD2 HIS A 90 10.815 -17.135 8.085 1.00 0.00 C ATOM 147 CE1 HIS A 90 10.148 -19.185 8.481 1.00 0.00 C ATOM 148 NE2 HIS A 90 9.991 -17.926 8.847 1.00 0.00 N ATOM 0 H HIS A 90 13.444 -17.179 3.954 1.00 0.00 H new ATOM 0 HA HIS A 90 11.188 -16.186 5.322 1.00 0.00 H new ATOM 0 HB2 HIS A 90 12.519 -18.455 5.457 1.00 0.00 H new ATOM 0 HB3 HIS A 90 13.494 -17.619 6.649 1.00 0.00 H new ATOM 0 HD2 HIS A 90 10.911 -16.061 8.150 1.00 0.00 H new ATOM 0 HE1 HIS A 90 9.631 -20.034 8.902 1.00 0.00 H new ATOM 0 HE2 HIS A 90 9.360 -17.595 9.577 1.00 0.00 H new ATOM 156 N ALA A 91 14.092 -14.906 6.183 1.00 0.00 N ATOM 157 CA ALA A 91 14.724 -13.823 6.928 1.00 0.00 C ATOM 158 C ALA A 91 14.229 -12.464 6.446 1.00 0.00 C ATOM 159 O ALA A 91 13.876 -11.601 7.250 1.00 0.00 O ATOM 160 CB ALA A 91 16.238 -13.910 6.803 1.00 0.00 C ATOM 0 H ALA A 91 14.727 -15.432 5.583 1.00 0.00 H new ATOM 0 HA ALA A 91 14.450 -13.929 7.978 1.00 0.00 H new ATOM 0 HB1 ALA A 91 16.697 -13.096 7.364 1.00 0.00 H new ATOM 0 HB2 ALA A 91 16.582 -14.864 7.202 1.00 0.00 H new ATOM 0 HB3 ALA A 91 16.521 -13.832 5.753 1.00 0.00 H new ATOM 166 N ARG A 92 14.206 -12.280 5.130 1.00 0.00 N ATOM 167 CA ARG A 92 13.756 -11.024 4.542 1.00 0.00 C ATOM 168 C ARG A 92 12.248 -10.858 4.704 1.00 0.00 C ATOM 169 O ARG A 92 11.747 -9.741 4.846 1.00 0.00 O ATOM 170 CB ARG A 92 14.129 -10.968 3.059 1.00 0.00 C ATOM 171 CG ARG A 92 14.159 -9.558 2.492 1.00 0.00 C ATOM 172 CD ARG A 92 14.315 -9.570 0.979 1.00 0.00 C ATOM 173 NE ARG A 92 13.679 -8.413 0.354 1.00 0.00 N ATOM 174 CZ ARG A 92 13.566 -8.257 -0.960 1.00 0.00 C ATOM 175 NH1 ARG A 92 14.043 -9.180 -1.784 1.00 0.00 N ATOM 176 NH2 ARG A 92 12.975 -7.176 -1.453 1.00 0.00 N ATOM 0 H ARG A 92 14.494 -12.985 4.451 1.00 0.00 H new ATOM 0 HA ARG A 92 14.253 -10.208 5.066 1.00 0.00 H new ATOM 0 HB2 ARG A 92 15.108 -11.427 2.922 1.00 0.00 H new ATOM 0 HB3 ARG A 92 13.415 -11.564 2.491 1.00 0.00 H new ATOM 0 HG2 ARG A 92 13.240 -9.037 2.760 1.00 0.00 H new ATOM 0 HG3 ARG A 92 14.983 -9.002 2.940 1.00 0.00 H new ATOM 0 HD2 ARG A 92 15.375 -9.583 0.724 1.00 0.00 H new ATOM 0 HD3 ARG A 92 13.879 -10.485 0.577 1.00 0.00 H new ATOM 0 HE ARG A 92 13.301 -7.685 0.960 1.00 0.00 H new ATOM 0 HH11 ARG A 92 14.498 -10.012 -1.409 1.00 0.00 H new ATOM 0 HH12 ARG A 92 13.955 -9.058 -2.793 1.00 0.00 H new ATOM 0 HH21 ARG A 92 12.607 -6.464 -0.823 1.00 0.00 H new ATOM 0 HH22 ARG A 92 12.889 -7.057 -2.462 1.00 0.00 H new ATOM 190 N LEU A 93 11.529 -11.975 4.681 1.00 0.00 N ATOM 191 CA LEU A 93 10.077 -11.953 4.825 1.00 0.00 C ATOM 192 C LEU A 93 9.675 -11.466 6.214 1.00 0.00 C ATOM 193 O LEU A 93 8.775 -10.638 6.355 1.00 0.00 O ATOM 194 CB LEU A 93 9.499 -13.347 4.573 1.00 0.00 C ATOM 195 CG LEU A 93 9.337 -13.751 3.108 1.00 0.00 C ATOM 196 CD1 LEU A 93 9.088 -15.247 2.991 1.00 0.00 C ATOM 197 CD2 LEU A 93 8.203 -12.968 2.461 1.00 0.00 C ATOM 0 H LEU A 93 11.927 -12.907 4.564 1.00 0.00 H new ATOM 0 HA LEU A 93 9.673 -11.260 4.087 1.00 0.00 H new ATOM 0 HB2 LEU A 93 10.142 -14.079 5.062 1.00 0.00 H new ATOM 0 HB3 LEU A 93 8.523 -13.407 5.056 1.00 0.00 H new ATOM 0 HG LEU A 93 10.262 -13.515 2.582 1.00 0.00 H new ATOM 0 HD11 LEU A 93 8.975 -15.516 1.941 1.00 0.00 H new ATOM 0 HD12 LEU A 93 9.932 -15.791 3.416 1.00 0.00 H new ATOM 0 HD13 LEU A 93 8.178 -15.508 3.532 1.00 0.00 H new ATOM 0 HD21 LEU A 93 8.102 -13.269 1.418 1.00 0.00 H new ATOM 0 HD22 LEU A 93 7.272 -13.173 2.989 1.00 0.00 H new ATOM 0 HD23 LEU A 93 8.422 -11.901 2.512 1.00 0.00 H new ATOM 209 N ARG A 94 10.348 -11.985 7.235 1.00 0.00 N ATOM 210 CA ARG A 94 10.062 -11.603 8.612 1.00 0.00 C ATOM 211 C ARG A 94 10.555 -10.187 8.898 1.00 0.00 C ATOM 212 O ARG A 94 9.870 -9.401 9.550 1.00 0.00 O ATOM 213 CB ARG A 94 10.715 -12.588 9.584 1.00 0.00 C ATOM 214 CG ARG A 94 10.256 -12.419 11.023 1.00 0.00 C ATOM 215 CD ARG A 94 11.120 -11.414 11.769 1.00 0.00 C ATOM 216 NE ARG A 94 10.601 -11.132 13.105 1.00 0.00 N ATOM 217 CZ ARG A 94 9.656 -10.231 13.350 1.00 0.00 C ATOM 218 NH1 ARG A 94 9.129 -9.530 12.356 1.00 0.00 N ATOM 219 NH2 ARG A 94 9.235 -10.031 14.593 1.00 0.00 N ATOM 0 H ARG A 94 11.096 -12.672 7.134 1.00 0.00 H new ATOM 0 HA ARG A 94 8.981 -11.628 8.752 1.00 0.00 H new ATOM 0 HB2 ARG A 94 10.496 -13.605 9.259 1.00 0.00 H new ATOM 0 HB3 ARG A 94 11.797 -12.465 9.540 1.00 0.00 H new ATOM 0 HG2 ARG A 94 9.217 -12.089 11.038 1.00 0.00 H new ATOM 0 HG3 ARG A 94 10.293 -13.382 11.533 1.00 0.00 H new ATOM 0 HD2 ARG A 94 12.137 -11.799 11.849 1.00 0.00 H new ATOM 0 HD3 ARG A 94 11.174 -10.487 11.198 1.00 0.00 H new ATOM 0 HE ARG A 94 10.985 -11.655 13.892 1.00 0.00 H new ATOM 0 HH11 ARG A 94 9.449 -9.682 11.399 1.00 0.00 H new ATOM 0 HH12 ARG A 94 8.404 -8.839 12.548 1.00 0.00 H new ATOM 0 HH21 ARG A 94 9.637 -10.569 15.360 1.00 0.00 H new ATOM 0 HH22 ARG A 94 8.509 -9.339 14.781 1.00 0.00 H new ATOM 233 N ALA A 95 11.747 -9.871 8.404 1.00 0.00 N ATOM 234 CA ALA A 95 12.331 -8.551 8.604 1.00 0.00 C ATOM 235 C ALA A 95 11.527 -7.479 7.878 1.00 0.00 C ATOM 236 O ALA A 95 11.230 -6.423 8.439 1.00 0.00 O ATOM 237 CB ALA A 95 13.778 -8.537 8.133 1.00 0.00 C ATOM 0 H ALA A 95 12.327 -10.511 7.862 1.00 0.00 H new ATOM 0 HA ALA A 95 12.305 -8.328 9.671 1.00 0.00 H new ATOM 0 HB1 ALA A 95 14.202 -7.545 8.288 1.00 0.00 H new ATOM 0 HB2 ALA A 95 14.352 -9.270 8.700 1.00 0.00 H new ATOM 0 HB3 ALA A 95 13.818 -8.787 7.073 1.00 0.00 H new ATOM 243 N LEU A 96 11.177 -7.755 6.626 1.00 0.00 N ATOM 244 CA LEU A 96 10.406 -6.813 5.822 1.00 0.00 C ATOM 245 C LEU A 96 8.991 -6.658 6.371 1.00 0.00 C ATOM 246 O LEU A 96 8.494 -5.543 6.527 1.00 0.00 O ATOM 247 CB LEU A 96 10.352 -7.280 4.366 1.00 0.00 C ATOM 248 CG LEU A 96 10.017 -6.207 3.329 1.00 0.00 C ATOM 249 CD1 LEU A 96 10.442 -6.657 1.940 1.00 0.00 C ATOM 250 CD2 LEU A 96 8.530 -5.885 3.356 1.00 0.00 C ATOM 0 H LEU A 96 11.415 -8.623 6.146 1.00 0.00 H new ATOM 0 HA LEU A 96 10.902 -5.843 5.868 1.00 0.00 H new ATOM 0 HB2 LEU A 96 11.317 -7.716 4.109 1.00 0.00 H new ATOM 0 HB3 LEU A 96 9.612 -8.076 4.288 1.00 0.00 H new ATOM 0 HG LEU A 96 10.569 -5.301 3.580 1.00 0.00 H new ATOM 0 HD11 LEU A 96 10.196 -5.881 1.215 1.00 0.00 H new ATOM 0 HD12 LEU A 96 11.517 -6.836 1.929 1.00 0.00 H new ATOM 0 HD13 LEU A 96 9.918 -7.577 1.679 1.00 0.00 H new ATOM 0 HD21 LEU A 96 8.310 -5.120 2.612 1.00 0.00 H new ATOM 0 HD22 LEU A 96 7.959 -6.785 3.131 1.00 0.00 H new ATOM 0 HD23 LEU A 96 8.255 -5.519 4.345 1.00 0.00 H new ATOM 262 N ASN A 97 8.349 -7.784 6.663 1.00 0.00 N ATOM 263 CA ASN A 97 6.992 -7.773 7.197 1.00 0.00 C ATOM 264 C ASN A 97 6.936 -7.025 8.525 1.00 0.00 C ATOM 265 O ASN A 97 6.074 -6.172 8.734 1.00 0.00 O ATOM 266 CB ASN A 97 6.484 -9.204 7.383 1.00 0.00 C ATOM 267 CG ASN A 97 5.320 -9.283 8.353 1.00 0.00 C ATOM 268 OD1 ASN A 97 4.165 -9.102 7.970 1.00 0.00 O ATOM 269 ND2 ASN A 97 5.622 -9.555 9.617 1.00 0.00 N ATOM 0 H ASN A 97 8.746 -8.715 6.539 1.00 0.00 H new ATOM 0 HA ASN A 97 6.351 -7.257 6.482 1.00 0.00 H new ATOM 0 HB2 ASN A 97 6.177 -9.606 6.418 1.00 0.00 H new ATOM 0 HB3 ASN A 97 7.298 -9.832 7.745 1.00 0.00 H new ATOM 0 HD21 ASN A 97 4.882 -9.621 10.315 1.00 0.00 H new ATOM 0 HD22 ASN A 97 6.594 -9.698 9.890 1.00 0.00 H new ATOM 276 N GLY A 98 7.862 -7.351 9.422 1.00 0.00 N ATOM 277 CA GLY A 98 7.901 -6.701 10.719 1.00 0.00 C ATOM 278 C GLY A 98 8.346 -5.255 10.629 1.00 0.00 C ATOM 279 O GLY A 98 7.850 -4.398 11.363 1.00 0.00 O ATOM 0 H GLY A 98 8.586 -8.054 9.273 1.00 0.00 H new ATOM 0 HA2 GLY A 98 6.912 -6.746 11.174 1.00 0.00 H new ATOM 0 HA3 GLY A 98 8.579 -7.247 11.375 1.00 0.00 H new ATOM 283 N LEU A 99 9.284 -4.981 9.729 1.00 0.00 N ATOM 284 CA LEU A 99 9.798 -3.628 9.547 1.00 0.00 C ATOM 285 C LEU A 99 8.700 -2.690 9.057 1.00 0.00 C ATOM 286 O LEU A 99 8.508 -1.602 9.603 1.00 0.00 O ATOM 287 CB LEU A 99 10.962 -3.632 8.554 1.00 0.00 C ATOM 288 CG LEU A 99 12.315 -4.077 9.109 1.00 0.00 C ATOM 289 CD1 LEU A 99 13.239 -4.509 7.980 1.00 0.00 C ATOM 290 CD2 LEU A 99 12.951 -2.959 9.923 1.00 0.00 C ATOM 0 H LEU A 99 9.704 -5.678 9.114 1.00 0.00 H new ATOM 0 HA LEU A 99 10.154 -3.268 10.512 1.00 0.00 H new ATOM 0 HB2 LEU A 99 10.701 -4.285 7.721 1.00 0.00 H new ATOM 0 HB3 LEU A 99 11.071 -2.626 8.148 1.00 0.00 H new ATOM 0 HG LEU A 99 12.154 -4.932 9.766 1.00 0.00 H new ATOM 0 HD11 LEU A 99 14.197 -4.822 8.394 1.00 0.00 H new ATOM 0 HD12 LEU A 99 12.788 -5.341 7.439 1.00 0.00 H new ATOM 0 HD13 LEU A 99 13.394 -3.674 7.297 1.00 0.00 H new ATOM 0 HD21 LEU A 99 13.913 -3.293 10.310 1.00 0.00 H new ATOM 0 HD22 LEU A 99 13.099 -2.085 9.288 1.00 0.00 H new ATOM 0 HD23 LEU A 99 12.297 -2.697 10.754 1.00 0.00 H new ATOM 302 N LEU A 100 7.980 -3.118 8.025 1.00 0.00 N ATOM 303 CA LEU A 100 6.899 -2.317 7.462 1.00 0.00 C ATOM 304 C LEU A 100 5.774 -2.131 8.476 1.00 0.00 C ATOM 305 O LEU A 100 5.175 -1.059 8.564 1.00 0.00 O ATOM 306 CB LEU A 100 6.354 -2.979 6.195 1.00 0.00 C ATOM 307 CG LEU A 100 7.168 -2.758 4.920 1.00 0.00 C ATOM 308 CD1 LEU A 100 6.552 -3.517 3.755 1.00 0.00 C ATOM 309 CD2 LEU A 100 7.266 -1.273 4.600 1.00 0.00 C ATOM 0 H LEU A 100 8.126 -4.015 7.562 1.00 0.00 H new ATOM 0 HA LEU A 100 7.301 -1.336 7.208 1.00 0.00 H new ATOM 0 HB2 LEU A 100 6.279 -4.052 6.373 1.00 0.00 H new ATOM 0 HB3 LEU A 100 5.342 -2.613 6.024 1.00 0.00 H new ATOM 0 HG LEU A 100 8.175 -3.141 5.084 1.00 0.00 H new ATOM 0 HD11 LEU A 100 7.145 -3.348 2.856 1.00 0.00 H new ATOM 0 HD12 LEU A 100 6.535 -4.583 3.983 1.00 0.00 H new ATOM 0 HD13 LEU A 100 5.534 -3.165 3.589 1.00 0.00 H new ATOM 0 HD21 LEU A 100 7.849 -1.135 3.689 1.00 0.00 H new ATOM 0 HD22 LEU A 100 6.266 -0.865 4.456 1.00 0.00 H new ATOM 0 HD23 LEU A 100 7.754 -0.754 5.425 1.00 0.00 H new ATOM 321 N TYR A 101 5.495 -3.181 9.240 1.00 0.00 N ATOM 322 CA TYR A 101 4.442 -3.133 10.248 1.00 0.00 C ATOM 323 C TYR A 101 4.791 -2.142 11.355 1.00 0.00 C ATOM 324 O TYR A 101 3.943 -1.372 11.805 1.00 0.00 O ATOM 325 CB TYR A 101 4.216 -4.523 10.846 1.00 0.00 C ATOM 326 CG TYR A 101 3.288 -4.526 12.039 1.00 0.00 C ATOM 327 CD1 TYR A 101 1.932 -4.261 11.890 1.00 0.00 C ATOM 328 CD2 TYR A 101 3.767 -4.792 13.316 1.00 0.00 C ATOM 329 CE1 TYR A 101 1.080 -4.261 12.977 1.00 0.00 C ATOM 330 CE2 TYR A 101 2.922 -4.796 14.409 1.00 0.00 C ATOM 331 CZ TYR A 101 1.580 -4.530 14.235 1.00 0.00 C ATOM 332 OH TYR A 101 0.735 -4.532 15.321 1.00 0.00 O ATOM 0 H TYR A 101 5.983 -4.075 9.181 1.00 0.00 H new ATOM 0 HA TYR A 101 3.525 -2.799 9.763 1.00 0.00 H new ATOM 0 HB2 TYR A 101 3.807 -5.178 10.077 1.00 0.00 H new ATOM 0 HB3 TYR A 101 5.177 -4.942 11.143 1.00 0.00 H new ATOM 0 HD1 TYR A 101 1.537 -4.051 10.907 1.00 0.00 H new ATOM 0 HD2 TYR A 101 4.818 -4.999 13.456 1.00 0.00 H new ATOM 0 HE1 TYR A 101 0.029 -4.052 12.843 1.00 0.00 H new ATOM 0 HE2 TYR A 101 3.310 -5.006 15.395 1.00 0.00 H new ATOM 0 HH TYR A 101 1.245 -4.740 16.132 1.00 0.00 H new ATOM 342 N LYS A 102 6.047 -2.168 11.788 1.00 0.00 N ATOM 343 CA LYS A 102 6.512 -1.272 12.840 1.00 0.00 C ATOM 344 C LYS A 102 6.665 0.152 12.314 1.00 0.00 C ATOM 345 O LYS A 102 6.336 1.117 13.003 1.00 0.00 O ATOM 346 CB LYS A 102 7.846 -1.764 13.405 1.00 0.00 C ATOM 347 CG LYS A 102 8.063 -1.396 14.862 1.00 0.00 C ATOM 348 CD LYS A 102 8.689 -0.019 15.003 1.00 0.00 C ATOM 349 CE LYS A 102 8.711 0.438 16.453 1.00 0.00 C ATOM 350 NZ LYS A 102 9.901 -0.084 17.181 1.00 0.00 N ATOM 0 H LYS A 102 6.761 -2.800 11.426 1.00 0.00 H new ATOM 0 HA LYS A 102 5.767 -1.269 13.635 1.00 0.00 H new ATOM 0 HB2 LYS A 102 7.897 -2.848 13.301 1.00 0.00 H new ATOM 0 HB3 LYS A 102 8.659 -1.348 12.809 1.00 0.00 H new ATOM 0 HG2 LYS A 102 7.109 -1.419 15.390 1.00 0.00 H new ATOM 0 HG3 LYS A 102 8.706 -2.139 15.334 1.00 0.00 H new ATOM 0 HD2 LYS A 102 9.706 -0.039 14.611 1.00 0.00 H new ATOM 0 HD3 LYS A 102 8.130 0.699 14.403 1.00 0.00 H new ATOM 0 HE2 LYS A 102 8.711 1.527 16.490 1.00 0.00 H new ATOM 0 HE3 LYS A 102 7.803 0.102 16.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 9.879 0.250 18.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 9.888 -1.124 17.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 10.768 0.257 16.719 1.00 0.00 H new ATOM 364 N ALA A 103 7.165 0.274 11.089 1.00 0.00 N ATOM 365 CA ALA A 103 7.358 1.580 10.469 1.00 0.00 C ATOM 366 C ALA A 103 6.020 2.234 10.139 1.00 0.00 C ATOM 367 O ALA A 103 5.831 3.430 10.364 1.00 0.00 O ATOM 368 CB ALA A 103 8.207 1.448 9.214 1.00 0.00 C ATOM 0 H ALA A 103 7.444 -0.515 10.506 1.00 0.00 H new ATOM 0 HA ALA A 103 7.879 2.220 11.181 1.00 0.00 H new ATOM 0 HB1 ALA A 103 8.343 2.430 8.762 1.00 0.00 H new ATOM 0 HB2 ALA A 103 9.180 1.031 9.475 1.00 0.00 H new ATOM 0 HB3 ALA A 103 7.708 0.788 8.505 1.00 0.00 H new ATOM 374 N LEU A 104 5.096 1.443 9.605 1.00 0.00 N ATOM 375 CA LEU A 104 3.776 1.946 9.243 1.00 0.00 C ATOM 376 C LEU A 104 3.024 2.439 10.476 1.00 0.00 C ATOM 377 O LEU A 104 2.501 3.554 10.492 1.00 0.00 O ATOM 378 CB LEU A 104 2.967 0.852 8.543 1.00 0.00 C ATOM 379 CG LEU A 104 3.291 0.619 7.067 1.00 0.00 C ATOM 380 CD1 LEU A 104 2.801 -0.750 6.622 1.00 0.00 C ATOM 381 CD2 LEU A 104 2.675 1.713 6.206 1.00 0.00 C ATOM 0 H LEU A 104 5.237 0.451 9.413 1.00 0.00 H new ATOM 0 HA LEU A 104 3.909 2.786 8.561 1.00 0.00 H new ATOM 0 HB2 LEU A 104 3.119 -0.084 9.080 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.909 1.100 8.627 1.00 0.00 H new ATOM 0 HG LEU A 104 4.373 0.653 6.943 1.00 0.00 H new ATOM 0 HD11 LEU A 104 3.041 -0.898 5.569 1.00 0.00 H new ATOM 0 HD12 LEU A 104 3.289 -1.522 7.217 1.00 0.00 H new ATOM 0 HD13 LEU A 104 1.722 -0.813 6.761 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.916 1.531 5.159 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.593 1.711 6.335 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.075 2.681 6.507 1.00 0.00 H new ATOM 393 N THR A 105 2.976 1.603 11.508 1.00 0.00 N ATOM 394 CA THR A 105 2.291 1.954 12.745 1.00 0.00 C ATOM 395 C THR A 105 2.956 3.146 13.423 1.00 0.00 C ATOM 396 O THR A 105 2.296 3.938 14.096 1.00 0.00 O ATOM 397 CB THR A 105 2.263 0.769 13.728 1.00 0.00 C ATOM 398 OG1 THR A 105 1.676 1.175 14.969 1.00 0.00 O ATOM 399 CG2 THR A 105 3.667 0.238 13.975 1.00 0.00 C ATOM 0 H THR A 105 3.404 0.677 11.511 1.00 0.00 H new ATOM 0 HA THR A 105 1.268 2.217 12.475 1.00 0.00 H new ATOM 0 HB THR A 105 1.663 -0.027 13.286 1.00 0.00 H new ATOM 0 HG1 THR A 105 1.661 0.415 15.588 1.00 0.00 H new ATOM 0 HG21 THR A 105 3.622 -0.599 14.672 1.00 0.00 H new ATOM 0 HG22 THR A 105 4.100 -0.098 13.033 1.00 0.00 H new ATOM 0 HG23 THR A 105 4.286 1.029 14.397 1.00 0.00 H new ATOM 407 N ASP A 106 4.266 3.269 13.240 1.00 0.00 N ATOM 408 CA ASP A 106 5.021 4.367 13.833 1.00 0.00 C ATOM 409 C ASP A 106 4.633 5.699 13.198 1.00 0.00 C ATOM 410 O ASP A 106 4.548 6.722 13.878 1.00 0.00 O ATOM 411 CB ASP A 106 6.523 4.128 13.671 1.00 0.00 C ATOM 412 CG ASP A 106 7.328 5.407 13.785 1.00 0.00 C ATOM 413 OD1 ASP A 106 7.420 5.953 14.904 1.00 0.00 O ATOM 414 OD2 ASP A 106 7.867 5.862 12.754 1.00 0.00 O ATOM 0 H ASP A 106 4.827 2.622 12.686 1.00 0.00 H new ATOM 0 HA ASP A 106 4.781 4.408 14.895 1.00 0.00 H new ATOM 0 HB2 ASP A 106 6.859 3.421 14.430 1.00 0.00 H new ATOM 0 HB3 ASP A 106 6.712 3.668 12.701 1.00 0.00 H new ATOM 419 N LEU A 107 4.401 5.679 11.890 1.00 0.00 N ATOM 420 CA LEU A 107 4.024 6.885 11.161 1.00 0.00 C ATOM 421 C LEU A 107 2.617 7.333 11.543 1.00 0.00 C ATOM 422 O LEU A 107 2.334 8.530 11.620 1.00 0.00 O ATOM 423 CB LEU A 107 4.102 6.639 9.654 1.00 0.00 C ATOM 424 CG LEU A 107 5.508 6.554 9.059 1.00 0.00 C ATOM 425 CD1 LEU A 107 5.445 6.152 7.594 1.00 0.00 C ATOM 426 CD2 LEU A 107 6.236 7.880 9.220 1.00 0.00 C ATOM 0 H LEU A 107 4.467 4.841 11.313 1.00 0.00 H new ATOM 0 HA LEU A 107 4.723 7.677 11.430 1.00 0.00 H new ATOM 0 HB2 LEU A 107 3.578 5.710 9.430 1.00 0.00 H new ATOM 0 HB3 LEU A 107 3.563 7.439 9.147 1.00 0.00 H new ATOM 0 HG LEU A 107 6.065 5.789 9.600 1.00 0.00 H new ATOM 0 HD11 LEU A 107 6.455 6.097 7.188 1.00 0.00 H new ATOM 0 HD12 LEU A 107 4.964 5.178 7.504 1.00 0.00 H new ATOM 0 HD13 LEU A 107 4.870 6.893 7.038 1.00 0.00 H new ATOM 0 HD21 LEU A 107 7.235 7.801 8.791 1.00 0.00 H new ATOM 0 HD22 LEU A 107 5.681 8.665 8.706 1.00 0.00 H new ATOM 0 HD23 LEU A 107 6.314 8.126 10.279 1.00 0.00 H new ATOM 438 N LEU A 108 1.738 6.367 11.782 1.00 0.00 N ATOM 439 CA LEU A 108 0.359 6.662 12.158 1.00 0.00 C ATOM 440 C LEU A 108 0.277 7.114 13.613 1.00 0.00 C ATOM 441 O LEU A 108 -0.813 7.315 14.150 1.00 0.00 O ATOM 442 CB LEU A 108 -0.523 5.431 11.944 1.00 0.00 C ATOM 443 CG LEU A 108 -0.988 5.180 10.510 1.00 0.00 C ATOM 444 CD1 LEU A 108 0.132 5.477 9.525 1.00 0.00 C ATOM 445 CD2 LEU A 108 -1.475 3.747 10.349 1.00 0.00 C ATOM 0 H LEU A 108 1.955 5.372 11.722 1.00 0.00 H new ATOM 0 HA LEU A 108 0.000 7.473 11.524 1.00 0.00 H new ATOM 0 HB2 LEU A 108 0.024 4.553 12.286 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -1.404 5.525 12.579 1.00 0.00 H new ATOM 0 HG LEU A 108 -1.820 5.852 10.297 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -0.218 5.292 8.509 1.00 0.00 H new ATOM 0 HD12 LEU A 108 0.434 6.520 9.621 1.00 0.00 H new ATOM 0 HD13 LEU A 108 0.984 4.832 9.738 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -1.802 3.587 9.322 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -0.663 3.058 10.583 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -2.309 3.568 11.027 1.00 0.00 H new ATOM 457 N CYS A 109 1.435 7.275 14.243 1.00 0.00 N ATOM 458 CA CYS A 109 1.494 7.705 15.636 1.00 0.00 C ATOM 459 C CYS A 109 1.719 9.211 15.730 1.00 0.00 C ATOM 460 O CYS A 109 1.302 9.853 16.695 1.00 0.00 O ATOM 461 CB CYS A 109 2.609 6.963 16.374 1.00 0.00 C ATOM 462 SG CYS A 109 2.279 5.204 16.632 1.00 0.00 S ATOM 0 H CYS A 109 2.345 7.114 13.812 1.00 0.00 H new ATOM 0 HA CYS A 109 0.539 7.468 16.105 1.00 0.00 H new ATOM 0 HB2 CYS A 109 3.536 7.069 15.811 1.00 0.00 H new ATOM 0 HB3 CYS A 109 2.768 7.438 17.342 1.00 0.00 H new ATOM 0 HG CYS A 109 2.586 4.543 15.556 1.00 0.00 H new ATOM 468 N THR A 110 2.383 9.769 14.723 1.00 0.00 N ATOM 469 CA THR A 110 2.667 11.198 14.693 1.00 0.00 C ATOM 470 C THR A 110 1.889 11.890 13.580 1.00 0.00 C ATOM 471 O THR A 110 2.090 11.629 12.394 1.00 0.00 O ATOM 472 CB THR A 110 4.171 11.468 14.498 1.00 0.00 C ATOM 473 OG1 THR A 110 4.940 10.445 15.140 1.00 0.00 O ATOM 474 CG2 THR A 110 4.554 12.828 15.062 1.00 0.00 C ATOM 0 H THR A 110 2.734 9.252 13.917 1.00 0.00 H new ATOM 0 HA THR A 110 2.355 11.602 15.656 1.00 0.00 H new ATOM 0 HB THR A 110 4.383 11.463 13.429 1.00 0.00 H new ATOM 0 HG1 THR A 110 5.895 10.623 15.010 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.621 12.997 14.913 1.00 0.00 H new ATOM 0 HG22 THR A 110 3.989 13.607 14.550 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.328 12.857 16.128 1.00 0.00 H new ATOM 482 N PRO A 111 0.978 12.795 13.968 1.00 0.00 N ATOM 483 CA PRO A 111 0.152 13.545 13.016 1.00 0.00 C ATOM 484 C PRO A 111 0.964 14.559 12.217 1.00 0.00 C ATOM 485 O PRO A 111 0.414 15.312 11.414 1.00 0.00 O ATOM 486 CB PRO A 111 -0.862 14.259 13.913 1.00 0.00 C ATOM 487 CG PRO A 111 -0.182 14.379 15.233 1.00 0.00 C ATOM 488 CD PRO A 111 0.685 13.157 15.364 1.00 0.00 C ATOM 0 HA PRO A 111 -0.303 12.894 12.269 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -1.124 15.238 13.512 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -1.788 13.690 13.995 1.00 0.00 H new ATOM 0 HG2 PRO A 111 0.416 15.289 15.283 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -0.909 14.431 16.043 1.00 0.00 H new ATOM 0 HD2 PRO A 111 1.596 13.369 15.924 1.00 0.00 H new ATOM 0 HD3 PRO A 111 0.169 12.352 15.888 1.00 0.00 H new ATOM 496 N GLU A 112 2.274 14.571 12.443 1.00 0.00 N ATOM 497 CA GLU A 112 3.160 15.494 11.743 1.00 0.00 C ATOM 498 C GLU A 112 3.060 15.304 10.233 1.00 0.00 C ATOM 499 O GLU A 112 2.848 16.261 9.488 1.00 0.00 O ATOM 500 CB GLU A 112 4.607 15.292 12.199 1.00 0.00 C ATOM 501 CG GLU A 112 4.994 16.147 13.394 1.00 0.00 C ATOM 502 CD GLU A 112 5.129 17.615 13.041 1.00 0.00 C ATOM 503 OE1 GLU A 112 6.074 17.962 12.302 1.00 0.00 O ATOM 504 OE2 GLU A 112 4.291 18.417 13.504 1.00 0.00 O ATOM 0 H GLU A 112 2.745 13.953 13.104 1.00 0.00 H new ATOM 0 HA GLU A 112 2.849 16.510 11.985 1.00 0.00 H new ATOM 0 HB2 GLU A 112 4.756 14.242 12.451 1.00 0.00 H new ATOM 0 HB3 GLU A 112 5.276 15.519 11.369 1.00 0.00 H new ATOM 0 HG2 GLU A 112 4.243 16.033 14.176 1.00 0.00 H new ATOM 0 HG3 GLU A 112 5.938 15.787 13.803 1.00 0.00 H new ATOM 511 N VAL A 113 3.216 14.062 9.787 1.00 0.00 N ATOM 512 CA VAL A 113 3.143 13.745 8.365 1.00 0.00 C ATOM 513 C VAL A 113 1.724 13.362 7.960 1.00 0.00 C ATOM 514 O VAL A 113 1.150 13.949 7.042 1.00 0.00 O ATOM 515 CB VAL A 113 4.098 12.594 7.997 1.00 0.00 C ATOM 516 CG1 VAL A 113 3.727 11.329 8.755 1.00 0.00 C ATOM 517 CG2 VAL A 113 4.083 12.349 6.496 1.00 0.00 C ATOM 0 H VAL A 113 3.394 13.258 10.390 1.00 0.00 H new ATOM 0 HA VAL A 113 3.443 14.643 7.825 1.00 0.00 H new ATOM 0 HB VAL A 113 5.110 12.878 8.286 1.00 0.00 H new ATOM 0 HG11 VAL A 113 4.413 10.527 8.482 1.00 0.00 H new ATOM 0 HG12 VAL A 113 3.794 11.514 9.827 1.00 0.00 H new ATOM 0 HG13 VAL A 113 2.708 11.038 8.500 1.00 0.00 H new ATOM 0 HG21 VAL A 113 4.763 11.533 6.254 1.00 0.00 H new ATOM 0 HG22 VAL A 113 3.073 12.086 6.180 1.00 0.00 H new ATOM 0 HG23 VAL A 113 4.401 13.253 5.977 1.00 0.00 H new ATOM 527 N SER A 114 1.162 12.375 8.650 1.00 0.00 N ATOM 528 CA SER A 114 -0.189 11.912 8.360 1.00 0.00 C ATOM 529 C SER A 114 -1.213 12.654 9.214 1.00 0.00 C ATOM 530 O SER A 114 -1.885 12.057 10.054 1.00 0.00 O ATOM 531 CB SER A 114 -0.299 10.406 8.607 1.00 0.00 C ATOM 532 OG SER A 114 -0.238 10.110 9.992 1.00 0.00 O ATOM 0 H SER A 114 1.622 11.880 9.414 1.00 0.00 H new ATOM 0 HA SER A 114 -0.399 12.118 7.310 1.00 0.00 H new ATOM 0 HB2 SER A 114 -1.236 10.034 8.193 1.00 0.00 H new ATOM 0 HB3 SER A 114 0.507 9.889 8.086 1.00 0.00 H new ATOM 0 HG SER A 114 -0.983 10.549 10.454 1.00 0.00 H new ATOM 538 N GLN A 115 -1.326 13.959 8.990 1.00 0.00 N ATOM 539 CA GLN A 115 -2.267 14.784 9.739 1.00 0.00 C ATOM 540 C GLN A 115 -3.699 14.305 9.526 1.00 0.00 C ATOM 541 O GLN A 115 -4.463 14.163 10.480 1.00 0.00 O ATOM 542 CB GLN A 115 -2.139 16.249 9.319 1.00 0.00 C ATOM 543 CG GLN A 115 -2.885 17.210 10.231 1.00 0.00 C ATOM 544 CD GLN A 115 -2.385 17.164 11.661 1.00 0.00 C ATOM 545 OE1 GLN A 115 -1.309 17.675 11.972 1.00 0.00 O ATOM 546 NE2 GLN A 115 -3.166 16.550 12.542 1.00 0.00 N ATOM 0 H GLN A 115 -0.778 14.468 8.296 1.00 0.00 H new ATOM 0 HA GLN A 115 -2.027 14.695 10.799 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -1.084 16.523 9.301 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -2.514 16.361 8.302 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -2.781 18.225 9.846 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -3.948 16.970 10.214 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -4.050 16.140 12.241 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -2.882 16.488 13.520 1.00 0.00 H new ATOM 555 N GLU A 116 -4.055 14.057 8.269 1.00 0.00 N ATOM 556 CA GLU A 116 -5.396 13.595 7.933 1.00 0.00 C ATOM 557 C GLU A 116 -5.657 12.209 8.517 1.00 0.00 C ATOM 558 O GLU A 116 -6.752 11.924 9.004 1.00 0.00 O ATOM 559 CB GLU A 116 -5.583 13.564 6.414 1.00 0.00 C ATOM 560 CG GLU A 116 -5.081 12.285 5.765 1.00 0.00 C ATOM 561 CD GLU A 116 -3.568 12.237 5.665 1.00 0.00 C ATOM 562 OE1 GLU A 116 -3.002 12.999 4.854 1.00 0.00 O ATOM 563 OE2 GLU A 116 -2.951 11.436 6.398 1.00 0.00 O ATOM 0 H GLU A 116 -3.434 14.168 7.468 1.00 0.00 H new ATOM 0 HA GLU A 116 -6.112 14.293 8.366 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -6.641 13.687 6.184 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -5.061 14.414 5.975 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -5.431 11.428 6.341 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -5.511 12.195 4.767 1.00 0.00 H new ATOM 570 N LEU A 117 -4.644 11.352 8.464 1.00 0.00 N ATOM 571 CA LEU A 117 -4.762 9.995 8.987 1.00 0.00 C ATOM 572 C LEU A 117 -4.982 10.010 10.496 1.00 0.00 C ATOM 573 O LEU A 117 -5.909 9.380 11.005 1.00 0.00 O ATOM 574 CB LEU A 117 -3.507 9.187 8.652 1.00 0.00 C ATOM 575 CG LEU A 117 -3.659 7.666 8.687 1.00 0.00 C ATOM 576 CD1 LEU A 117 -4.933 7.240 7.974 1.00 0.00 C ATOM 577 CD2 LEU A 117 -2.445 6.994 8.062 1.00 0.00 C ATOM 0 H LEU A 117 -3.732 11.572 8.064 1.00 0.00 H new ATOM 0 HA LEU A 117 -5.626 9.525 8.517 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -3.168 9.475 7.657 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.720 9.470 9.351 1.00 0.00 H new ATOM 0 HG LEU A 117 -3.728 7.351 9.728 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -5.024 6.154 8.009 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -5.794 7.692 8.466 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -4.895 7.567 6.935 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -2.571 5.912 8.096 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -2.345 7.316 7.025 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.549 7.273 8.617 1.00 0.00 H new ATOM 589 N TYR A 118 -4.125 10.736 11.207 1.00 0.00 N ATOM 590 CA TYR A 118 -4.226 10.834 12.658 1.00 0.00 C ATOM 591 C TYR A 118 -5.629 11.259 13.079 1.00 0.00 C ATOM 592 O TYR A 118 -6.244 10.639 13.947 1.00 0.00 O ATOM 593 CB TYR A 118 -3.196 11.828 13.196 1.00 0.00 C ATOM 594 CG TYR A 118 -2.996 11.743 14.692 1.00 0.00 C ATOM 595 CD1 TYR A 118 -2.115 10.821 15.244 1.00 0.00 C ATOM 596 CD2 TYR A 118 -3.689 12.585 15.554 1.00 0.00 C ATOM 597 CE1 TYR A 118 -1.930 10.739 16.610 1.00 0.00 C ATOM 598 CE2 TYR A 118 -3.508 12.511 16.922 1.00 0.00 C ATOM 599 CZ TYR A 118 -2.628 11.587 17.445 1.00 0.00 C ATOM 600 OH TYR A 118 -2.447 11.509 18.807 1.00 0.00 O ATOM 0 H TYR A 118 -3.353 11.265 10.801 1.00 0.00 H new ATOM 0 HA TYR A 118 -4.024 9.849 13.078 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -2.241 11.653 12.700 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -3.510 12.839 12.937 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -1.565 10.157 14.593 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -4.380 13.309 15.148 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -1.243 10.015 17.022 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -4.053 13.173 17.578 1.00 0.00 H new ATOM 0 HH TYR A 118 -3.012 12.176 19.251 1.00 0.00 H new ATOM 610 N ASP A 119 -6.129 12.321 12.458 1.00 0.00 N ATOM 611 CA ASP A 119 -7.461 12.831 12.765 1.00 0.00 C ATOM 612 C ASP A 119 -8.455 11.686 12.936 1.00 0.00 C ATOM 613 O ASP A 119 -9.412 11.790 13.703 1.00 0.00 O ATOM 614 CB ASP A 119 -7.937 13.775 11.661 1.00 0.00 C ATOM 615 CG ASP A 119 -9.284 14.398 11.972 1.00 0.00 C ATOM 616 OD1 ASP A 119 -9.350 15.238 12.893 1.00 0.00 O ATOM 617 OD2 ASP A 119 -10.272 14.044 11.295 1.00 0.00 O ATOM 0 H ASP A 119 -5.632 12.846 11.738 1.00 0.00 H new ATOM 0 HA ASP A 119 -7.404 13.383 13.703 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -7.199 14.565 11.519 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -8.002 13.227 10.721 1.00 0.00 H new ATOM 622 N LEU A 120 -8.221 10.594 12.215 1.00 0.00 N ATOM 623 CA LEU A 120 -9.096 9.429 12.286 1.00 0.00 C ATOM 624 C LEU A 120 -8.668 8.494 13.412 1.00 0.00 C ATOM 625 O LEU A 120 -9.500 7.837 14.036 1.00 0.00 O ATOM 626 CB LEU A 120 -9.087 8.679 10.953 1.00 0.00 C ATOM 627 CG LEU A 120 -9.448 9.503 9.716 1.00 0.00 C ATOM 628 CD1 LEU A 120 -8.956 8.813 8.454 1.00 0.00 C ATOM 629 CD2 LEU A 120 -10.951 9.734 9.649 1.00 0.00 C ATOM 0 H LEU A 120 -7.433 10.491 11.575 1.00 0.00 H new ATOM 0 HA LEU A 120 -10.108 9.777 12.493 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -8.094 8.254 10.805 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -9.784 7.844 11.024 1.00 0.00 H new ATOM 0 HG LEU A 120 -8.955 10.472 9.791 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -9.222 9.413 7.584 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -7.873 8.700 8.500 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -9.420 7.830 8.372 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -11.190 10.322 8.763 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -11.465 8.774 9.597 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -11.277 10.272 10.539 1.00 0.00 H new ATOM 641 N ASN A 121 -7.365 8.442 13.668 1.00 0.00 N ATOM 642 CA ASN A 121 -6.827 7.588 14.721 1.00 0.00 C ATOM 643 C ASN A 121 -6.901 6.118 14.320 1.00 0.00 C ATOM 644 O ASN A 121 -7.457 5.293 15.045 1.00 0.00 O ATOM 645 CB ASN A 121 -7.590 7.812 16.028 1.00 0.00 C ATOM 646 CG ASN A 121 -6.827 7.306 17.237 1.00 0.00 C ATOM 647 OD1 ASN A 121 -7.069 6.200 17.720 1.00 0.00 O ATOM 648 ND2 ASN A 121 -5.899 8.117 17.732 1.00 0.00 N ATOM 0 H ASN A 121 -6.662 8.981 13.161 1.00 0.00 H new ATOM 0 HA ASN A 121 -5.780 7.853 14.870 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -7.793 8.876 16.149 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -8.555 7.308 15.973 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -5.353 7.831 18.545 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -5.732 9.025 17.299 1.00 0.00 H new ATOM 655 N VAL A 122 -6.336 5.797 13.161 1.00 0.00 N ATOM 656 CA VAL A 122 -6.336 4.426 12.664 1.00 0.00 C ATOM 657 C VAL A 122 -5.254 3.595 13.343 1.00 0.00 C ATOM 658 O VAL A 122 -4.225 4.123 13.765 1.00 0.00 O ATOM 659 CB VAL A 122 -6.120 4.382 11.139 1.00 0.00 C ATOM 660 CG1 VAL A 122 -4.890 5.187 10.750 1.00 0.00 C ATOM 661 CG2 VAL A 122 -5.999 2.943 10.661 1.00 0.00 C ATOM 0 H VAL A 122 -5.872 6.468 12.548 1.00 0.00 H new ATOM 0 HA VAL A 122 -7.314 4.005 12.898 1.00 0.00 H new ATOM 0 HB VAL A 122 -6.986 4.831 10.653 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -4.754 5.144 9.669 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -5.022 6.224 11.058 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -4.012 4.771 11.243 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -5.847 2.930 9.582 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -5.151 2.466 11.153 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -6.912 2.400 10.905 1.00 0.00 H new ATOM 671 N GLU A 123 -5.493 2.291 13.445 1.00 0.00 N ATOM 672 CA GLU A 123 -4.537 1.387 14.074 1.00 0.00 C ATOM 673 C GLU A 123 -4.396 0.099 13.269 1.00 0.00 C ATOM 674 O GLU A 123 -5.383 -0.585 12.992 1.00 0.00 O ATOM 675 CB GLU A 123 -4.974 1.063 15.505 1.00 0.00 C ATOM 676 CG GLU A 123 -4.618 2.144 16.510 1.00 0.00 C ATOM 677 CD GLU A 123 -5.480 2.090 17.756 1.00 0.00 C ATOM 678 OE1 GLU A 123 -6.686 1.790 17.631 1.00 0.00 O ATOM 679 OE2 GLU A 123 -4.949 2.348 18.856 1.00 0.00 O ATOM 0 H GLU A 123 -6.339 1.838 13.101 1.00 0.00 H new ATOM 0 HA GLU A 123 -3.568 1.885 14.102 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -6.053 0.906 15.520 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -4.511 0.125 15.814 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -3.570 2.041 16.793 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -4.726 3.121 16.040 1.00 0.00 H new ATOM 686 N LEU A 124 -3.163 -0.227 12.896 1.00 0.00 N ATOM 687 CA LEU A 124 -2.891 -1.433 12.122 1.00 0.00 C ATOM 688 C LEU A 124 -3.301 -2.681 12.897 1.00 0.00 C ATOM 689 O LEU A 124 -3.376 -2.665 14.126 1.00 0.00 O ATOM 690 CB LEU A 124 -1.407 -1.507 11.761 1.00 0.00 C ATOM 691 CG LEU A 124 -0.955 -0.626 10.596 1.00 0.00 C ATOM 692 CD1 LEU A 124 0.558 -0.471 10.600 1.00 0.00 C ATOM 693 CD2 LEU A 124 -1.429 -1.206 9.272 1.00 0.00 C ATOM 0 H LEU A 124 -2.336 0.327 13.117 1.00 0.00 H new ATOM 0 HA LEU A 124 -3.479 -1.388 11.206 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -0.825 -1.236 12.642 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -1.163 -2.542 11.524 1.00 0.00 H new ATOM 0 HG LEU A 124 -1.402 0.361 10.718 1.00 0.00 H new ATOM 0 HD11 LEU A 124 0.861 0.159 9.764 1.00 0.00 H new ATOM 0 HD12 LEU A 124 0.874 -0.009 11.536 1.00 0.00 H new ATOM 0 HD13 LEU A 124 1.024 -1.451 10.503 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -1.098 -0.565 8.455 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -1.012 -2.205 9.142 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -2.517 -1.264 9.269 1.00 0.00 H new ATOM 705 N SER A 125 -3.563 -3.763 12.171 1.00 0.00 N ATOM 706 CA SER A 125 -3.967 -5.020 12.790 1.00 0.00 C ATOM 707 C SER A 125 -3.098 -6.173 12.295 1.00 0.00 C ATOM 708 O SER A 125 -2.724 -7.059 13.064 1.00 0.00 O ATOM 709 CB SER A 125 -5.439 -5.311 12.491 1.00 0.00 C ATOM 710 OG SER A 125 -5.620 -5.686 11.136 1.00 0.00 O ATOM 0 H SER A 125 -3.503 -3.794 11.153 1.00 0.00 H new ATOM 0 HA SER A 125 -3.835 -4.925 13.868 1.00 0.00 H new ATOM 0 HB2 SER A 125 -5.795 -6.109 13.143 1.00 0.00 H new ATOM 0 HB3 SER A 125 -6.039 -4.428 12.711 1.00 0.00 H new ATOM 0 HG SER A 125 -5.123 -5.071 10.557 1.00 0.00 H new ATOM 716 N LYS A 126 -2.781 -6.155 11.005 1.00 0.00 N ATOM 717 CA LYS A 126 -1.955 -7.196 10.405 1.00 0.00 C ATOM 718 C LYS A 126 -1.495 -6.788 9.009 1.00 0.00 C ATOM 719 O LYS A 126 -2.183 -6.043 8.310 1.00 0.00 O ATOM 720 CB LYS A 126 -2.731 -8.513 10.333 1.00 0.00 C ATOM 721 CG LYS A 126 -1.931 -9.659 9.740 1.00 0.00 C ATOM 722 CD LYS A 126 -2.838 -10.741 9.178 1.00 0.00 C ATOM 723 CE LYS A 126 -3.229 -10.447 7.737 1.00 0.00 C ATOM 724 NZ LYS A 126 -4.200 -11.446 7.211 1.00 0.00 N ATOM 0 H LYS A 126 -3.084 -5.430 10.354 1.00 0.00 H new ATOM 0 HA LYS A 126 -1.075 -7.334 11.033 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -3.056 -8.789 11.336 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -3.631 -8.363 9.737 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -1.282 -9.280 8.950 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -1.284 -10.087 10.506 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -2.332 -11.705 9.229 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -3.736 -10.820 9.791 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -3.665 -9.450 7.675 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -2.336 -10.444 7.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -4.441 -11.211 6.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -3.775 -12.395 7.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -5.062 -11.431 7.792 1.00 0.00 H new ATOM 738 N VAL A 127 -0.329 -7.283 8.607 1.00 0.00 N ATOM 739 CA VAL A 127 0.222 -6.972 7.293 1.00 0.00 C ATOM 740 C VAL A 127 0.530 -8.244 6.512 1.00 0.00 C ATOM 741 O VAL A 127 1.232 -9.130 7.000 1.00 0.00 O ATOM 742 CB VAL A 127 1.506 -6.129 7.407 1.00 0.00 C ATOM 743 CG1 VAL A 127 2.219 -6.058 6.066 1.00 0.00 C ATOM 744 CG2 VAL A 127 1.183 -4.734 7.923 1.00 0.00 C ATOM 0 H VAL A 127 0.253 -7.901 9.172 1.00 0.00 H new ATOM 0 HA VAL A 127 -0.535 -6.396 6.761 1.00 0.00 H new ATOM 0 HB VAL A 127 2.174 -6.610 8.121 1.00 0.00 H new ATOM 0 HG11 VAL A 127 3.124 -5.458 6.166 1.00 0.00 H new ATOM 0 HG12 VAL A 127 2.485 -7.064 5.741 1.00 0.00 H new ATOM 0 HG13 VAL A 127 1.561 -5.601 5.328 1.00 0.00 H new ATOM 0 HG21 VAL A 127 2.102 -4.152 7.997 1.00 0.00 H new ATOM 0 HG22 VAL A 127 0.496 -4.242 7.235 1.00 0.00 H new ATOM 0 HG23 VAL A 127 0.720 -4.808 8.907 1.00 0.00 H new ATOM 754 N SER A 128 0.002 -8.327 5.295 1.00 0.00 N ATOM 755 CA SER A 128 0.218 -9.493 4.446 1.00 0.00 C ATOM 756 C SER A 128 1.141 -9.153 3.280 1.00 0.00 C ATOM 757 O SER A 128 0.823 -8.302 2.448 1.00 0.00 O ATOM 758 CB SER A 128 -1.118 -10.019 3.916 1.00 0.00 C ATOM 759 OG SER A 128 -1.697 -10.944 4.821 1.00 0.00 O ATOM 0 H SER A 128 -0.578 -7.601 4.875 1.00 0.00 H new ATOM 0 HA SER A 128 0.693 -10.267 5.049 1.00 0.00 H new ATOM 0 HB2 SER A 128 -1.802 -9.186 3.755 1.00 0.00 H new ATOM 0 HB3 SER A 128 -0.966 -10.498 2.949 1.00 0.00 H new ATOM 0 HG SER A 128 -2.550 -11.264 4.460 1.00 0.00 H new ATOM 765 N LEU A 129 2.287 -9.822 3.227 1.00 0.00 N ATOM 766 CA LEU A 129 3.259 -9.592 2.164 1.00 0.00 C ATOM 767 C LEU A 129 3.335 -10.793 1.226 1.00 0.00 C ATOM 768 O LEU A 129 3.274 -11.942 1.665 1.00 0.00 O ATOM 769 CB LEU A 129 4.639 -9.308 2.760 1.00 0.00 C ATOM 770 CG LEU A 129 5.802 -9.263 1.769 1.00 0.00 C ATOM 771 CD1 LEU A 129 5.853 -7.915 1.066 1.00 0.00 C ATOM 772 CD2 LEU A 129 7.118 -9.547 2.478 1.00 0.00 C ATOM 0 H LEU A 129 2.566 -10.528 3.908 1.00 0.00 H new ATOM 0 HA LEU A 129 2.933 -8.725 1.589 1.00 0.00 H new ATOM 0 HB2 LEU A 129 4.597 -8.353 3.283 1.00 0.00 H new ATOM 0 HB3 LEU A 129 4.854 -10.072 3.507 1.00 0.00 H new ATOM 0 HG LEU A 129 5.643 -10.036 1.017 1.00 0.00 H new ATOM 0 HD11 LEU A 129 6.687 -7.902 0.365 1.00 0.00 H new ATOM 0 HD12 LEU A 129 4.921 -7.751 0.525 1.00 0.00 H new ATOM 0 HD13 LEU A 129 5.987 -7.124 1.804 1.00 0.00 H new ATOM 0 HD21 LEU A 129 7.935 -9.511 1.757 1.00 0.00 H new ATOM 0 HD22 LEU A 129 7.284 -8.797 3.252 1.00 0.00 H new ATOM 0 HD23 LEU A 129 7.080 -10.536 2.934 1.00 0.00 H new ATOM 784 N THR A 130 3.471 -10.519 -0.068 1.00 0.00 N ATOM 785 CA THR A 130 3.557 -11.576 -1.067 1.00 0.00 C ATOM 786 C THR A 130 4.876 -12.333 -0.956 1.00 0.00 C ATOM 787 O THR A 130 5.884 -11.806 -0.485 1.00 0.00 O ATOM 788 CB THR A 130 3.421 -11.012 -2.494 1.00 0.00 C ATOM 789 OG1 THR A 130 4.373 -9.962 -2.699 1.00 0.00 O ATOM 790 CG2 THR A 130 2.015 -10.483 -2.736 1.00 0.00 C ATOM 0 H THR A 130 3.524 -9.574 -0.448 1.00 0.00 H new ATOM 0 HA THR A 130 2.731 -12.261 -0.874 1.00 0.00 H new ATOM 0 HB THR A 130 3.614 -11.820 -3.200 1.00 0.00 H new ATOM 0 HG1 THR A 130 3.985 -9.108 -2.414 1.00 0.00 H new ATOM 0 HG21 THR A 130 1.944 -10.090 -3.750 1.00 0.00 H new ATOM 0 HG22 THR A 130 1.295 -11.291 -2.609 1.00 0.00 H new ATOM 0 HG23 THR A 130 1.798 -9.688 -2.023 1.00 0.00 H new ATOM 798 N PRO A 131 4.872 -13.599 -1.399 1.00 0.00 N ATOM 799 CA PRO A 131 6.061 -14.455 -1.361 1.00 0.00 C ATOM 800 C PRO A 131 7.130 -14.007 -2.352 1.00 0.00 C ATOM 801 O PRO A 131 8.312 -14.304 -2.180 1.00 0.00 O ATOM 802 CB PRO A 131 5.518 -15.834 -1.746 1.00 0.00 C ATOM 803 CG PRO A 131 4.297 -15.549 -2.549 1.00 0.00 C ATOM 804 CD PRO A 131 3.706 -14.292 -1.973 1.00 0.00 C ATOM 0 HA PRO A 131 6.549 -14.431 -0.387 1.00 0.00 H new ATOM 0 HB2 PRO A 131 6.249 -16.400 -2.324 1.00 0.00 H new ATOM 0 HB3 PRO A 131 5.281 -16.427 -0.863 1.00 0.00 H new ATOM 0 HG2 PRO A 131 4.545 -15.417 -3.602 1.00 0.00 H new ATOM 0 HG3 PRO A 131 3.589 -16.376 -2.490 1.00 0.00 H new ATOM 0 HD2 PRO A 131 3.218 -13.690 -2.739 1.00 0.00 H new ATOM 0 HD3 PRO A 131 2.955 -14.512 -1.214 1.00 0.00 H new ATOM 812 N ASP A 132 6.706 -13.292 -3.388 1.00 0.00 N ATOM 813 CA ASP A 132 7.628 -12.802 -4.407 1.00 0.00 C ATOM 814 C ASP A 132 8.176 -11.430 -4.029 1.00 0.00 C ATOM 815 O ASP A 132 8.927 -10.818 -4.789 1.00 0.00 O ATOM 816 CB ASP A 132 6.929 -12.730 -5.765 1.00 0.00 C ATOM 817 CG ASP A 132 7.058 -14.019 -6.552 1.00 0.00 C ATOM 818 OD1 ASP A 132 8.202 -14.419 -6.854 1.00 0.00 O ATOM 819 OD2 ASP A 132 6.014 -14.629 -6.865 1.00 0.00 O ATOM 0 H ASP A 132 5.730 -13.039 -3.545 1.00 0.00 H new ATOM 0 HA ASP A 132 8.462 -13.500 -4.474 1.00 0.00 H new ATOM 0 HB2 ASP A 132 5.873 -12.503 -5.615 1.00 0.00 H new ATOM 0 HB3 ASP A 132 7.352 -11.910 -6.345 1.00 0.00 H new ATOM 824 N PHE A 133 7.794 -10.950 -2.850 1.00 0.00 N ATOM 825 CA PHE A 133 8.245 -9.648 -2.371 1.00 0.00 C ATOM 826 C PHE A 133 7.844 -8.543 -3.343 1.00 0.00 C ATOM 827 O PHE A 133 8.510 -7.512 -3.437 1.00 0.00 O ATOM 828 CB PHE A 133 9.763 -9.649 -2.181 1.00 0.00 C ATOM 829 CG PHE A 133 10.205 -10.267 -0.885 1.00 0.00 C ATOM 830 CD1 PHE A 133 9.761 -9.759 0.326 1.00 0.00 C ATOM 831 CD2 PHE A 133 11.062 -11.355 -0.877 1.00 0.00 C ATOM 832 CE1 PHE A 133 10.166 -10.324 1.520 1.00 0.00 C ATOM 833 CE2 PHE A 133 11.471 -11.925 0.314 1.00 0.00 C ATOM 834 CZ PHE A 133 11.021 -11.409 1.514 1.00 0.00 C ATOM 0 H PHE A 133 7.173 -11.443 -2.208 1.00 0.00 H new ATOM 0 HA PHE A 133 7.766 -9.456 -1.411 1.00 0.00 H new ATOM 0 HB2 PHE A 133 10.224 -10.189 -3.008 1.00 0.00 H new ATOM 0 HB3 PHE A 133 10.128 -8.623 -2.228 1.00 0.00 H new ATOM 0 HD1 PHE A 133 9.091 -8.912 0.336 1.00 0.00 H new ATOM 0 HD2 PHE A 133 11.415 -11.763 -1.813 1.00 0.00 H new ATOM 0 HE1 PHE A 133 9.815 -9.918 2.457 1.00 0.00 H new ATOM 0 HE2 PHE A 133 12.141 -12.772 0.307 1.00 0.00 H new ATOM 0 HZ PHE A 133 11.337 -11.853 2.446 1.00 0.00 H new ATOM 844 N SER A 134 6.750 -8.766 -4.066 1.00 0.00 N ATOM 845 CA SER A 134 6.262 -7.791 -5.034 1.00 0.00 C ATOM 846 C SER A 134 5.279 -6.824 -4.382 1.00 0.00 C ATOM 847 O SER A 134 5.623 -5.681 -4.082 1.00 0.00 O ATOM 848 CB SER A 134 5.591 -8.503 -6.211 1.00 0.00 C ATOM 849 OG SER A 134 6.525 -9.284 -6.935 1.00 0.00 O ATOM 0 H SER A 134 6.186 -9.613 -3.999 1.00 0.00 H new ATOM 0 HA SER A 134 7.115 -7.221 -5.402 1.00 0.00 H new ATOM 0 HB2 SER A 134 4.787 -9.140 -5.844 1.00 0.00 H new ATOM 0 HB3 SER A 134 5.137 -7.767 -6.874 1.00 0.00 H new ATOM 0 HG SER A 134 6.071 -9.730 -7.680 1.00 0.00 H new ATOM 855 N ALA A 135 4.054 -7.291 -4.166 1.00 0.00 N ATOM 856 CA ALA A 135 3.021 -6.469 -3.548 1.00 0.00 C ATOM 857 C ALA A 135 3.020 -6.635 -2.032 1.00 0.00 C ATOM 858 O ALA A 135 3.391 -7.689 -1.514 1.00 0.00 O ATOM 859 CB ALA A 135 1.655 -6.819 -4.120 1.00 0.00 C ATOM 0 H ALA A 135 3.753 -8.234 -4.410 1.00 0.00 H new ATOM 0 HA ALA A 135 3.240 -5.425 -3.773 1.00 0.00 H new ATOM 0 HB1 ALA A 135 0.893 -6.197 -3.649 1.00 0.00 H new ATOM 0 HB2 ALA A 135 1.655 -6.642 -5.195 1.00 0.00 H new ATOM 0 HB3 ALA A 135 1.437 -7.869 -3.926 1.00 0.00 H new ATOM 865 N CYS A 136 2.602 -5.590 -1.327 1.00 0.00 N ATOM 866 CA CYS A 136 2.555 -5.620 0.130 1.00 0.00 C ATOM 867 C CYS A 136 1.192 -5.163 0.640 1.00 0.00 C ATOM 868 O CYS A 136 0.901 -3.967 0.676 1.00 0.00 O ATOM 869 CB CYS A 136 3.656 -4.733 0.715 1.00 0.00 C ATOM 870 SG CYS A 136 3.557 -4.520 2.508 1.00 0.00 S ATOM 0 H CYS A 136 2.291 -4.711 -1.741 1.00 0.00 H new ATOM 0 HA CYS A 136 2.717 -6.648 0.453 1.00 0.00 H new ATOM 0 HB2 CYS A 136 4.626 -5.163 0.464 1.00 0.00 H new ATOM 0 HB3 CYS A 136 3.609 -3.753 0.240 1.00 0.00 H new ATOM 0 HG CYS A 136 4.405 -5.317 3.087 1.00 0.00 H new ATOM 876 N ARG A 137 0.360 -6.123 1.030 1.00 0.00 N ATOM 877 CA ARG A 137 -0.973 -5.819 1.535 1.00 0.00 C ATOM 878 C ARG A 137 -0.940 -5.562 3.038 1.00 0.00 C ATOM 879 O ARG A 137 -0.219 -6.231 3.777 1.00 0.00 O ATOM 880 CB ARG A 137 -1.934 -6.969 1.224 1.00 0.00 C ATOM 881 CG ARG A 137 -2.535 -6.900 -0.170 1.00 0.00 C ATOM 882 CD ARG A 137 -1.658 -7.609 -1.191 1.00 0.00 C ATOM 883 NE ARG A 137 -2.424 -8.066 -2.347 1.00 0.00 N ATOM 884 CZ ARG A 137 -2.857 -7.258 -3.308 1.00 0.00 C ATOM 885 NH1 ARG A 137 -2.600 -5.959 -3.252 1.00 0.00 N ATOM 886 NH2 ARG A 137 -3.548 -7.750 -4.329 1.00 0.00 N ATOM 0 H ARG A 137 0.586 -7.117 1.006 1.00 0.00 H new ATOM 0 HA ARG A 137 -1.325 -4.915 1.037 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -1.404 -7.915 1.335 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -2.740 -6.967 1.958 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -3.526 -7.353 -0.163 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -2.664 -5.857 -0.461 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -0.869 -6.934 -1.523 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -1.170 -8.462 -0.719 1.00 0.00 H new ATOM 0 HE ARG A 137 -2.638 -9.061 -2.421 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -2.068 -5.578 -2.469 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -2.934 -5.341 -3.991 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -3.747 -8.749 -4.376 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -3.880 -7.129 -5.067 1.00 0.00 H new ATOM 900 N ALA A 138 -1.727 -4.587 3.484 1.00 0.00 N ATOM 901 CA ALA A 138 -1.788 -4.243 4.899 1.00 0.00 C ATOM 902 C ALA A 138 -3.232 -4.070 5.360 1.00 0.00 C ATOM 903 O ALA A 138 -3.985 -3.279 4.790 1.00 0.00 O ATOM 904 CB ALA A 138 -0.990 -2.976 5.169 1.00 0.00 C ATOM 0 H ALA A 138 -2.330 -4.022 2.886 1.00 0.00 H new ATOM 0 HA ALA A 138 -1.349 -5.063 5.467 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -1.044 -2.731 6.230 1.00 0.00 H new ATOM 0 HB2 ALA A 138 0.051 -3.134 4.886 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -1.404 -2.154 4.585 1.00 0.00 H new ATOM 910 N TYR A 139 -3.612 -4.813 6.393 1.00 0.00 N ATOM 911 CA TYR A 139 -4.966 -4.744 6.927 1.00 0.00 C ATOM 912 C TYR A 139 -5.012 -3.882 8.186 1.00 0.00 C ATOM 913 O TYR A 139 -4.189 -4.039 9.088 1.00 0.00 O ATOM 914 CB TYR A 139 -5.487 -6.148 7.238 1.00 0.00 C ATOM 915 CG TYR A 139 -5.604 -7.034 6.018 1.00 0.00 C ATOM 916 CD1 TYR A 139 -4.521 -7.781 5.572 1.00 0.00 C ATOM 917 CD2 TYR A 139 -6.797 -7.122 5.311 1.00 0.00 C ATOM 918 CE1 TYR A 139 -4.623 -8.591 4.457 1.00 0.00 C ATOM 919 CE2 TYR A 139 -6.908 -7.931 4.197 1.00 0.00 C ATOM 920 CZ TYR A 139 -5.819 -8.663 3.774 1.00 0.00 C ATOM 921 OH TYR A 139 -5.925 -9.469 2.663 1.00 0.00 O ATOM 0 H TYR A 139 -3.001 -5.470 6.877 1.00 0.00 H new ATOM 0 HA TYR A 139 -5.604 -4.286 6.171 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -4.821 -6.622 7.959 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -6.465 -6.067 7.713 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -3.584 -7.728 6.106 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -7.652 -6.548 5.638 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -3.771 -9.164 4.122 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -7.843 -7.990 3.660 1.00 0.00 H new ATOM 0 HH TYR A 139 -6.833 -9.407 2.299 1.00 0.00 H new ATOM 931 N TRP A 140 -5.979 -2.974 8.238 1.00 0.00 N ATOM 932 CA TRP A 140 -6.133 -2.087 9.386 1.00 0.00 C ATOM 933 C TRP A 140 -7.530 -2.211 9.985 1.00 0.00 C ATOM 934 O TRP A 140 -8.459 -2.680 9.328 1.00 0.00 O ATOM 935 CB TRP A 140 -5.867 -0.638 8.976 1.00 0.00 C ATOM 936 CG TRP A 140 -6.648 -0.208 7.771 1.00 0.00 C ATOM 937 CD1 TRP A 140 -6.398 -0.542 6.471 1.00 0.00 C ATOM 938 CD2 TRP A 140 -7.804 0.637 7.756 1.00 0.00 C ATOM 939 NE1 TRP A 140 -7.329 0.044 5.648 1.00 0.00 N ATOM 940 CE2 TRP A 140 -8.203 0.772 6.411 1.00 0.00 C ATOM 941 CE3 TRP A 140 -8.542 1.290 8.746 1.00 0.00 C ATOM 942 CZ2 TRP A 140 -9.306 1.534 6.036 1.00 0.00 C ATOM 943 CZ3 TRP A 140 -9.636 2.047 8.372 1.00 0.00 C ATOM 944 CH2 TRP A 140 -10.010 2.163 7.026 1.00 0.00 C ATOM 0 H TRP A 140 -6.668 -2.832 7.500 1.00 0.00 H new ATOM 0 HA TRP A 140 -5.406 -2.382 10.143 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -6.111 0.019 9.811 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -4.803 -0.515 8.773 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -5.588 -1.174 6.139 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -7.364 -0.048 4.633 1.00 0.00 H new ATOM 0 HE3 TRP A 140 -8.262 1.205 9.786 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -9.596 1.625 5.000 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 -10.212 2.558 9.129 1.00 0.00 H new ATOM 0 HH2 TRP A 140 -10.871 2.761 6.765 1.00 0.00 H new ATOM 955 N LYS A 141 -7.672 -1.787 11.236 1.00 0.00 N ATOM 956 CA LYS A 141 -8.956 -1.848 11.924 1.00 0.00 C ATOM 957 C LYS A 141 -9.966 -0.906 11.277 1.00 0.00 C ATOM 958 O LYS A 141 -9.754 0.306 11.220 1.00 0.00 O ATOM 959 CB LYS A 141 -8.784 -1.490 13.402 1.00 0.00 C ATOM 960 CG LYS A 141 -7.869 -2.440 14.155 1.00 0.00 C ATOM 961 CD LYS A 141 -7.615 -1.962 15.575 1.00 0.00 C ATOM 962 CE LYS A 141 -6.379 -2.617 16.172 1.00 0.00 C ATOM 963 NZ LYS A 141 -6.204 -2.266 17.608 1.00 0.00 N ATOM 0 H LYS A 141 -6.913 -1.397 11.795 1.00 0.00 H new ATOM 0 HA LYS A 141 -9.333 -2.867 11.845 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -8.386 -0.478 13.478 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -9.763 -1.484 13.882 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -8.316 -3.434 14.179 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -6.921 -2.530 13.625 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -7.492 -0.879 15.579 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -8.482 -2.186 16.196 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -6.456 -3.699 16.070 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -5.497 -2.306 15.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -5.351 -2.732 17.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -6.105 -1.235 17.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -7.034 -2.585 18.147 1.00 0.00 H new ATOM 977 N THR A 142 -11.067 -1.470 10.789 1.00 0.00 N ATOM 978 CA THR A 142 -12.110 -0.681 10.146 1.00 0.00 C ATOM 979 C THR A 142 -13.398 -0.705 10.960 1.00 0.00 C ATOM 980 O THR A 142 -13.496 -1.407 11.968 1.00 0.00 O ATOM 981 CB THR A 142 -12.405 -1.193 8.723 1.00 0.00 C ATOM 982 OG1 THR A 142 -12.563 -2.616 8.738 1.00 0.00 O ATOM 983 CG2 THR A 142 -11.284 -0.811 7.768 1.00 0.00 C ATOM 0 H THR A 142 -11.259 -2.471 10.827 1.00 0.00 H new ATOM 0 HA THR A 142 -11.741 0.343 10.086 1.00 0.00 H new ATOM 0 HB THR A 142 -13.329 -0.729 8.377 1.00 0.00 H new ATOM 0 HG1 THR A 142 -12.752 -2.934 7.830 1.00 0.00 H new ATOM 0 HG21 THR A 142 -11.514 -1.183 6.770 1.00 0.00 H new ATOM 0 HG22 THR A 142 -11.186 0.274 7.737 1.00 0.00 H new ATOM 0 HG23 THR A 142 -10.348 -1.250 8.112 1.00 0.00 H new ATOM 991 N THR A 143 -14.388 0.064 10.517 1.00 0.00 N ATOM 992 CA THR A 143 -15.671 0.131 11.204 1.00 0.00 C ATOM 993 C THR A 143 -16.633 -0.928 10.678 1.00 0.00 C ATOM 994 O THR A 143 -16.278 -1.727 9.811 1.00 0.00 O ATOM 995 CB THR A 143 -16.319 1.520 11.049 1.00 0.00 C ATOM 996 OG1 THR A 143 -16.660 1.751 9.678 1.00 0.00 O ATOM 997 CG2 THR A 143 -15.380 2.613 11.535 1.00 0.00 C ATOM 0 H THR A 143 -14.325 0.650 9.684 1.00 0.00 H new ATOM 0 HA THR A 143 -15.474 -0.054 12.260 1.00 0.00 H new ATOM 0 HB THR A 143 -17.223 1.544 11.657 1.00 0.00 H new ATOM 0 HG1 THR A 143 -15.846 1.737 9.132 1.00 0.00 H new ATOM 0 HG21 THR A 143 -15.860 3.584 11.415 1.00 0.00 H new ATOM 0 HG22 THR A 143 -15.146 2.451 12.587 1.00 0.00 H new ATOM 0 HG23 THR A 143 -14.460 2.588 10.951 1.00 0.00 H new ATOM 1005 N LEU A 144 -17.851 -0.929 11.207 1.00 0.00 N ATOM 1006 CA LEU A 144 -18.866 -1.890 10.789 1.00 0.00 C ATOM 1007 C LEU A 144 -19.528 -1.452 9.487 1.00 0.00 C ATOM 1008 O LEU A 144 -20.063 -2.275 8.744 1.00 0.00 O ATOM 1009 CB LEU A 144 -19.923 -2.053 11.883 1.00 0.00 C ATOM 1010 CG LEU A 144 -21.199 -2.792 11.478 1.00 0.00 C ATOM 1011 CD1 LEU A 144 -20.898 -4.252 11.179 1.00 0.00 C ATOM 1012 CD2 LEU A 144 -22.252 -2.675 12.570 1.00 0.00 C ATOM 0 H LEU A 144 -18.160 -0.275 11.926 1.00 0.00 H new ATOM 0 HA LEU A 144 -18.376 -2.849 10.620 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -19.471 -2.583 12.721 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -20.200 -1.062 12.244 1.00 0.00 H new ATOM 0 HG LEU A 144 -21.591 -2.331 10.572 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -21.818 -4.762 10.893 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -20.179 -4.315 10.363 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -20.481 -4.727 12.067 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -23.153 -3.207 12.265 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -21.869 -3.110 13.493 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -22.489 -1.624 12.736 1.00 0.00 H new ATOM 1024 N SER A 145 -19.486 -0.152 9.216 1.00 0.00 N ATOM 1025 CA SER A 145 -20.083 0.396 8.004 1.00 0.00 C ATOM 1026 C SER A 145 -19.071 0.419 6.862 1.00 0.00 C ATOM 1027 O SER A 145 -17.949 0.897 7.023 1.00 0.00 O ATOM 1028 CB SER A 145 -20.609 1.809 8.262 1.00 0.00 C ATOM 1029 OG SER A 145 -21.827 1.775 8.987 1.00 0.00 O ATOM 0 H SER A 145 -19.045 0.542 9.820 1.00 0.00 H new ATOM 0 HA SER A 145 -20.915 -0.247 7.717 1.00 0.00 H new ATOM 0 HB2 SER A 145 -19.867 2.381 8.819 1.00 0.00 H new ATOM 0 HB3 SER A 145 -20.761 2.323 7.313 1.00 0.00 H new ATOM 0 HG SER A 145 -22.142 2.690 9.141 1.00 0.00 H new ATOM 1035 N ALA A 146 -19.478 -0.101 5.709 1.00 0.00 N ATOM 1036 CA ALA A 146 -18.608 -0.139 4.539 1.00 0.00 C ATOM 1037 C ALA A 146 -18.303 1.268 4.036 1.00 0.00 C ATOM 1038 O ALA A 146 -17.195 1.545 3.578 1.00 0.00 O ATOM 1039 CB ALA A 146 -19.246 -0.970 3.435 1.00 0.00 C ATOM 0 H ALA A 146 -20.404 -0.502 5.560 1.00 0.00 H new ATOM 0 HA ALA A 146 -17.666 -0.604 4.831 1.00 0.00 H new ATOM 0 HB1 ALA A 146 -18.586 -0.990 2.567 1.00 0.00 H new ATOM 0 HB2 ALA A 146 -19.407 -1.987 3.792 1.00 0.00 H new ATOM 0 HB3 ALA A 146 -20.202 -0.529 3.154 1.00 0.00 H new ATOM 1045 N GLU A 147 -19.293 2.151 4.125 1.00 0.00 N ATOM 1046 CA GLU A 147 -19.129 3.529 3.677 1.00 0.00 C ATOM 1047 C GLU A 147 -17.945 4.191 4.376 1.00 0.00 C ATOM 1048 O GLU A 147 -17.104 4.818 3.733 1.00 0.00 O ATOM 1049 CB GLU A 147 -20.405 4.330 3.942 1.00 0.00 C ATOM 1050 CG GLU A 147 -21.504 4.078 2.924 1.00 0.00 C ATOM 1051 CD GLU A 147 -21.406 4.995 1.720 1.00 0.00 C ATOM 1052 OE1 GLU A 147 -21.881 6.147 1.811 1.00 0.00 O ATOM 1053 OE2 GLU A 147 -20.854 4.561 0.688 1.00 0.00 O ATOM 0 H GLU A 147 -20.216 1.937 4.503 1.00 0.00 H new ATOM 0 HA GLU A 147 -18.934 3.515 2.605 1.00 0.00 H new ATOM 0 HB2 GLU A 147 -20.779 4.084 4.936 1.00 0.00 H new ATOM 0 HB3 GLU A 147 -20.162 5.393 3.947 1.00 0.00 H new ATOM 0 HG2 GLU A 147 -21.455 3.041 2.591 1.00 0.00 H new ATOM 0 HG3 GLU A 147 -22.474 4.214 3.401 1.00 0.00 H new ATOM 1060 N GLN A 148 -17.888 4.045 5.696 1.00 0.00 N ATOM 1061 CA GLN A 148 -16.808 4.630 6.482 1.00 0.00 C ATOM 1062 C GLN A 148 -15.457 4.060 6.061 1.00 0.00 C ATOM 1063 O GLN A 148 -14.459 4.777 6.010 1.00 0.00 O ATOM 1064 CB GLN A 148 -17.039 4.376 7.973 1.00 0.00 C ATOM 1065 CG GLN A 148 -15.898 4.855 8.856 1.00 0.00 C ATOM 1066 CD GLN A 148 -14.687 3.946 8.788 1.00 0.00 C ATOM 1067 OE1 GLN A 148 -14.796 2.773 8.431 1.00 0.00 O ATOM 1068 NE2 GLN A 148 -13.523 4.484 9.133 1.00 0.00 N ATOM 0 H GLN A 148 -18.576 3.527 6.243 1.00 0.00 H new ATOM 0 HA GLN A 148 -16.801 5.705 6.300 1.00 0.00 H new ATOM 0 HB2 GLN A 148 -17.959 4.874 8.280 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -17.187 3.308 8.132 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -15.609 5.862 8.555 1.00 0.00 H new ATOM 0 HG3 GLN A 148 -16.244 4.917 9.888 1.00 0.00 H new ATOM 0 HE21 GLN A 148 -13.479 5.461 9.423 1.00 0.00 H new ATOM 0 HE22 GLN A 148 -12.673 3.920 9.108 1.00 0.00 H new ATOM 1077 N ASN A 149 -15.434 2.766 5.759 1.00 0.00 N ATOM 1078 CA ASN A 149 -14.206 2.100 5.343 1.00 0.00 C ATOM 1079 C ASN A 149 -13.696 2.673 4.024 1.00 0.00 C ATOM 1080 O ASN A 149 -12.490 2.811 3.820 1.00 0.00 O ATOM 1081 CB ASN A 149 -14.440 0.595 5.201 1.00 0.00 C ATOM 1082 CG ASN A 149 -15.147 0.004 6.405 1.00 0.00 C ATOM 1083 OD1 ASN A 149 -15.368 0.686 7.406 1.00 0.00 O ATOM 1084 ND2 ASN A 149 -15.506 -1.272 6.314 1.00 0.00 N ATOM 0 H ASN A 149 -16.252 2.158 5.795 1.00 0.00 H new ATOM 0 HA ASN A 149 -13.451 2.273 6.110 1.00 0.00 H new ATOM 0 HB2 ASN A 149 -15.032 0.405 4.306 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -13.483 0.093 5.062 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -15.985 -1.724 7.093 1.00 0.00 H new ATOM 0 HD22 ASN A 149 -15.303 -1.800 5.465 1.00 0.00 H new ATOM 1091 N ALA A 150 -14.624 3.006 3.132 1.00 0.00 N ATOM 1092 CA ALA A 150 -14.269 3.567 1.834 1.00 0.00 C ATOM 1093 C ALA A 150 -13.618 4.937 1.988 1.00 0.00 C ATOM 1094 O ALA A 150 -12.577 5.212 1.389 1.00 0.00 O ATOM 1095 CB ALA A 150 -15.501 3.662 0.946 1.00 0.00 C ATOM 0 H ALA A 150 -15.627 2.897 3.285 1.00 0.00 H new ATOM 0 HA ALA A 150 -13.546 2.901 1.363 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -15.222 4.083 -0.020 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -15.922 2.667 0.801 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -16.243 4.304 1.420 1.00 0.00 H new ATOM 1101 N HIS A 151 -14.237 5.795 2.793 1.00 0.00 N ATOM 1102 CA HIS A 151 -13.717 7.138 3.024 1.00 0.00 C ATOM 1103 C HIS A 151 -12.327 7.081 3.651 1.00 0.00 C ATOM 1104 O HIS A 151 -11.393 7.722 3.170 1.00 0.00 O ATOM 1105 CB HIS A 151 -14.665 7.926 3.929 1.00 0.00 C ATOM 1106 CG HIS A 151 -14.026 9.117 4.573 1.00 0.00 C ATOM 1107 ND1 HIS A 151 -14.422 10.413 4.317 1.00 0.00 N ATOM 1108 CD2 HIS A 151 -13.015 9.204 5.468 1.00 0.00 C ATOM 1109 CE1 HIS A 151 -13.680 11.246 5.026 1.00 0.00 C ATOM 1110 NE2 HIS A 151 -12.819 10.537 5.734 1.00 0.00 N ATOM 0 H HIS A 151 -15.099 5.584 3.296 1.00 0.00 H new ATOM 0 HA HIS A 151 -13.642 7.643 2.061 1.00 0.00 H new ATOM 0 HB2 HIS A 151 -15.523 8.257 3.343 1.00 0.00 H new ATOM 0 HB3 HIS A 151 -15.046 7.264 4.706 1.00 0.00 H new ATOM 0 HD2 HIS A 151 -12.464 8.378 5.894 1.00 0.00 H new ATOM 0 HE1 HIS A 151 -13.763 12.323 5.026 1.00 0.00 H new ATOM 0 HE2 HIS A 151 -12.122 10.918 6.374 1.00 0.00 H new ATOM 1118 N MET A 152 -12.199 6.311 4.727 1.00 0.00 N ATOM 1119 CA MET A 152 -10.923 6.172 5.418 1.00 0.00 C ATOM 1120 C MET A 152 -9.892 5.487 4.526 1.00 0.00 C ATOM 1121 O MET A 152 -8.735 5.901 4.470 1.00 0.00 O ATOM 1122 CB MET A 152 -11.104 5.374 6.712 1.00 0.00 C ATOM 1123 CG MET A 152 -11.408 6.242 7.922 1.00 0.00 C ATOM 1124 SD MET A 152 -10.830 5.509 9.465 1.00 0.00 S ATOM 1125 CE MET A 152 -9.068 5.417 9.156 1.00 0.00 C ATOM 0 H MET A 152 -12.963 5.775 5.139 1.00 0.00 H new ATOM 0 HA MET A 152 -10.560 7.171 5.662 1.00 0.00 H new ATOM 0 HB2 MET A 152 -11.913 4.657 6.577 1.00 0.00 H new ATOM 0 HB3 MET A 152 -10.198 4.800 6.905 1.00 0.00 H new ATOM 0 HG2 MET A 152 -10.941 7.218 7.791 1.00 0.00 H new ATOM 0 HG3 MET A 152 -12.483 6.409 7.984 1.00 0.00 H new ATOM 0 HE1 MET A 152 -8.720 4.399 9.332 1.00 0.00 H new ATOM 0 HE2 MET A 152 -8.865 5.696 8.122 1.00 0.00 H new ATOM 0 HE3 MET A 152 -8.545 6.100 9.826 1.00 0.00 H new ATOM 1135 N GLU A 153 -10.322 4.439 3.830 1.00 0.00 N ATOM 1136 CA GLU A 153 -9.435 3.698 2.941 1.00 0.00 C ATOM 1137 C GLU A 153 -8.919 4.592 1.817 1.00 0.00 C ATOM 1138 O GLU A 153 -7.756 4.506 1.426 1.00 0.00 O ATOM 1139 CB GLU A 153 -10.162 2.488 2.351 1.00 0.00 C ATOM 1140 CG GLU A 153 -9.459 1.881 1.149 1.00 0.00 C ATOM 1141 CD GLU A 153 -9.849 2.549 -0.155 1.00 0.00 C ATOM 1142 OE1 GLU A 153 -9.227 3.574 -0.505 1.00 0.00 O ATOM 1143 OE2 GLU A 153 -10.777 2.049 -0.824 1.00 0.00 O ATOM 0 H GLU A 153 -11.278 4.085 3.865 1.00 0.00 H new ATOM 0 HA GLU A 153 -8.583 3.352 3.527 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -10.266 1.726 3.123 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -11.169 2.787 2.060 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -8.381 1.961 1.285 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -9.695 0.818 1.093 1.00 0.00 H new ATOM 1150 N ALA A 154 -9.794 5.450 1.303 1.00 0.00 N ATOM 1151 CA ALA A 154 -9.428 6.361 0.226 1.00 0.00 C ATOM 1152 C ALA A 154 -8.354 7.344 0.680 1.00 0.00 C ATOM 1153 O ALA A 154 -7.383 7.593 -0.036 1.00 0.00 O ATOM 1154 CB ALA A 154 -10.655 7.110 -0.272 1.00 0.00 C ATOM 0 H ALA A 154 -10.761 5.533 1.615 1.00 0.00 H new ATOM 0 HA ALA A 154 -9.020 5.770 -0.594 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -10.367 7.787 -1.076 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -11.390 6.397 -0.644 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -11.088 7.684 0.547 1.00 0.00 H new ATOM 1160 N VAL A 155 -8.534 7.902 1.873 1.00 0.00 N ATOM 1161 CA VAL A 155 -7.580 8.857 2.423 1.00 0.00 C ATOM 1162 C VAL A 155 -6.284 8.167 2.831 1.00 0.00 C ATOM 1163 O VAL A 155 -5.191 8.683 2.593 1.00 0.00 O ATOM 1164 CB VAL A 155 -8.164 9.594 3.643 1.00 0.00 C ATOM 1165 CG1 VAL A 155 -8.652 8.599 4.684 1.00 0.00 C ATOM 1166 CG2 VAL A 155 -7.131 10.538 4.239 1.00 0.00 C ATOM 0 H VAL A 155 -9.333 7.709 2.477 1.00 0.00 H new ATOM 0 HA VAL A 155 -7.369 9.582 1.637 1.00 0.00 H new ATOM 0 HB VAL A 155 -9.017 10.187 3.314 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -9.061 9.138 5.539 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -9.426 7.967 4.249 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -7.819 7.978 5.012 1.00 0.00 H new ATOM 0 HG21 VAL A 155 -7.560 11.050 5.100 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -6.257 9.968 4.555 1.00 0.00 H new ATOM 0 HG23 VAL A 155 -6.835 11.273 3.490 1.00 0.00 H new ATOM 1176 N LEU A 156 -6.412 6.997 3.447 1.00 0.00 N ATOM 1177 CA LEU A 156 -5.250 6.234 3.890 1.00 0.00 C ATOM 1178 C LEU A 156 -4.442 5.733 2.697 1.00 0.00 C ATOM 1179 O LEU A 156 -3.215 5.825 2.684 1.00 0.00 O ATOM 1180 CB LEU A 156 -5.691 5.052 4.755 1.00 0.00 C ATOM 1181 CG LEU A 156 -4.595 4.059 5.143 1.00 0.00 C ATOM 1182 CD1 LEU A 156 -3.539 4.738 6.001 1.00 0.00 C ATOM 1183 CD2 LEU A 156 -5.192 2.865 5.873 1.00 0.00 C ATOM 0 H LEU A 156 -7.309 6.556 3.651 1.00 0.00 H new ATOM 0 HA LEU A 156 -4.617 6.894 4.483 1.00 0.00 H new ATOM 0 HB2 LEU A 156 -6.139 5.443 5.668 1.00 0.00 H new ATOM 0 HB3 LEU A 156 -6.473 4.510 4.223 1.00 0.00 H new ATOM 0 HG LEU A 156 -4.117 3.700 4.232 1.00 0.00 H new ATOM 0 HD11 LEU A 156 -2.767 4.016 6.267 1.00 0.00 H new ATOM 0 HD12 LEU A 156 -3.090 5.560 5.443 1.00 0.00 H new ATOM 0 HD13 LEU A 156 -4.002 5.126 6.908 1.00 0.00 H new ATOM 0 HD21 LEU A 156 -4.398 2.168 6.142 1.00 0.00 H new ATOM 0 HD22 LEU A 156 -5.696 3.206 6.777 1.00 0.00 H new ATOM 0 HD23 LEU A 156 -5.910 2.364 5.224 1.00 0.00 H new ATOM 1195 N GLN A 157 -5.139 5.204 1.697 1.00 0.00 N ATOM 1196 CA GLN A 157 -4.486 4.689 0.499 1.00 0.00 C ATOM 1197 C GLN A 157 -3.676 5.782 -0.191 1.00 0.00 C ATOM 1198 O GLN A 157 -2.501 5.593 -0.506 1.00 0.00 O ATOM 1199 CB GLN A 157 -5.524 4.118 -0.469 1.00 0.00 C ATOM 1200 CG GLN A 157 -5.832 2.649 -0.233 1.00 0.00 C ATOM 1201 CD GLN A 157 -6.242 1.928 -1.502 1.00 0.00 C ATOM 1202 OE1 GLN A 157 -7.327 1.350 -1.578 1.00 0.00 O ATOM 1203 NE2 GLN A 157 -5.375 1.957 -2.507 1.00 0.00 N ATOM 0 H GLN A 157 -6.156 5.121 1.692 1.00 0.00 H new ATOM 0 HA GLN A 157 -3.805 3.893 0.800 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -6.446 4.693 -0.381 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -5.165 4.246 -1.490 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -4.954 2.161 0.190 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -6.631 2.563 0.504 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -4.487 2.448 -2.401 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -5.597 1.488 -3.385 1.00 0.00 H new ATOM 1212 N ARG A 158 -4.313 6.925 -0.424 1.00 0.00 N ATOM 1213 CA ARG A 158 -3.652 8.048 -1.079 1.00 0.00 C ATOM 1214 C ARG A 158 -2.479 8.551 -0.243 1.00 0.00 C ATOM 1215 O ARG A 158 -1.507 9.086 -0.777 1.00 0.00 O ATOM 1216 CB ARG A 158 -4.647 9.185 -1.316 1.00 0.00 C ATOM 1217 CG ARG A 158 -4.976 9.978 -0.062 1.00 0.00 C ATOM 1218 CD ARG A 158 -5.539 11.350 -0.401 1.00 0.00 C ATOM 1219 NE ARG A 158 -6.836 11.260 -1.066 1.00 0.00 N ATOM 1220 CZ ARG A 158 -7.608 12.312 -1.316 1.00 0.00 C ATOM 1221 NH1 ARG A 158 -7.215 13.527 -0.958 1.00 0.00 N ATOM 1222 NH2 ARG A 158 -8.775 12.150 -1.926 1.00 0.00 N ATOM 0 H ARG A 158 -5.285 7.098 -0.169 1.00 0.00 H new ATOM 0 HA ARG A 158 -3.270 7.702 -2.039 1.00 0.00 H new ATOM 0 HB2 ARG A 158 -4.240 9.862 -2.067 1.00 0.00 H new ATOM 0 HB3 ARG A 158 -5.568 8.771 -1.726 1.00 0.00 H new ATOM 0 HG2 ARG A 158 -5.698 9.426 0.540 1.00 0.00 H new ATOM 0 HG3 ARG A 158 -4.077 10.092 0.544 1.00 0.00 H new ATOM 0 HD2 ARG A 158 -5.640 11.936 0.512 1.00 0.00 H new ATOM 0 HD3 ARG A 158 -4.838 11.881 -1.045 1.00 0.00 H new ATOM 0 HE ARG A 158 -7.167 10.339 -1.354 1.00 0.00 H new ATOM 0 HH11 ARG A 158 -6.318 13.656 -0.490 1.00 0.00 H new ATOM 0 HH12 ARG A 158 -7.810 14.333 -1.151 1.00 0.00 H new ATOM 0 HH21 ARG A 158 -9.080 11.217 -2.203 1.00 0.00 H new ATOM 0 HH22 ARG A 158 -9.367 12.958 -2.117 1.00 0.00 H new ATOM 1236 N SER A 159 -2.576 8.375 1.071 1.00 0.00 N ATOM 1237 CA SER A 159 -1.525 8.815 1.981 1.00 0.00 C ATOM 1238 C SER A 159 -0.452 7.741 2.131 1.00 0.00 C ATOM 1239 O SER A 159 0.331 7.759 3.080 1.00 0.00 O ATOM 1240 CB SER A 159 -2.117 9.156 3.350 1.00 0.00 C ATOM 1241 OG SER A 159 -2.536 10.509 3.402 1.00 0.00 O ATOM 0 H SER A 159 -3.372 7.931 1.529 1.00 0.00 H new ATOM 0 HA SER A 159 -1.064 9.708 1.560 1.00 0.00 H new ATOM 0 HB2 SER A 159 -2.964 8.502 3.557 1.00 0.00 H new ATOM 0 HB3 SER A 159 -1.375 8.972 4.127 1.00 0.00 H new ATOM 0 HG SER A 159 -3.515 10.548 3.429 1.00 0.00 H new ATOM 1247 N ALA A 160 -0.423 6.807 1.187 1.00 0.00 N ATOM 1248 CA ALA A 160 0.554 5.725 1.211 1.00 0.00 C ATOM 1249 C ALA A 160 1.842 6.133 0.504 1.00 0.00 C ATOM 1250 O ALA A 160 2.939 5.911 1.015 1.00 0.00 O ATOM 1251 CB ALA A 160 -0.028 4.473 0.572 1.00 0.00 C ATOM 0 H ALA A 160 -1.065 6.777 0.395 1.00 0.00 H new ATOM 0 HA ALA A 160 0.795 5.509 2.252 1.00 0.00 H new ATOM 0 HB1 ALA A 160 0.713 3.674 0.597 1.00 0.00 H new ATOM 0 HB2 ALA A 160 -0.916 4.162 1.123 1.00 0.00 H new ATOM 0 HB3 ALA A 160 -0.298 4.685 -0.462 1.00 0.00 H new ATOM 1257 N ALA A 161 1.701 6.730 -0.675 1.00 0.00 N ATOM 1258 CA ALA A 161 2.853 7.169 -1.452 1.00 0.00 C ATOM 1259 C ALA A 161 3.898 7.828 -0.558 1.00 0.00 C ATOM 1260 O ALA A 161 5.036 7.364 -0.470 1.00 0.00 O ATOM 1261 CB ALA A 161 2.415 8.127 -2.550 1.00 0.00 C ATOM 0 H ALA A 161 0.800 6.921 -1.113 1.00 0.00 H new ATOM 0 HA ALA A 161 3.307 6.291 -1.911 1.00 0.00 H new ATOM 0 HB1 ALA A 161 3.286 8.447 -3.122 1.00 0.00 H new ATOM 0 HB2 ALA A 161 1.710 7.624 -3.212 1.00 0.00 H new ATOM 0 HB3 ALA A 161 1.935 8.998 -2.103 1.00 0.00 H new ATOM 1267 N HIS A 162 3.506 8.912 0.104 1.00 0.00 N ATOM 1268 CA HIS A 162 4.410 9.635 0.991 1.00 0.00 C ATOM 1269 C HIS A 162 4.963 8.712 2.073 1.00 0.00 C ATOM 1270 O HIS A 162 6.146 8.771 2.408 1.00 0.00 O ATOM 1271 CB HIS A 162 3.688 10.819 1.635 1.00 0.00 C ATOM 1272 CG HIS A 162 4.613 11.809 2.274 1.00 0.00 C ATOM 1273 ND1 HIS A 162 5.819 12.180 1.718 1.00 0.00 N ATOM 1274 CD2 HIS A 162 4.502 12.507 3.429 1.00 0.00 C ATOM 1275 CE1 HIS A 162 6.411 13.062 2.503 1.00 0.00 C ATOM 1276 NE2 HIS A 162 5.632 13.278 3.548 1.00 0.00 N ATOM 0 H HIS A 162 2.568 9.309 0.043 1.00 0.00 H new ATOM 0 HA HIS A 162 5.243 10.008 0.395 1.00 0.00 H new ATOM 0 HB2 HIS A 162 3.093 11.327 0.876 1.00 0.00 H new ATOM 0 HB3 HIS A 162 2.993 10.445 2.387 1.00 0.00 H new ATOM 0 HD2 HIS A 162 3.678 12.465 4.126 1.00 0.00 H new ATOM 0 HE1 HIS A 162 7.369 13.527 2.322 1.00 0.00 H new ATOM 0 HE2 HIS A 162 5.837 13.914 4.318 1.00 0.00 H new ATOM 1284 N MET A 163 4.099 7.860 2.616 1.00 0.00 N ATOM 1285 CA MET A 163 4.502 6.924 3.659 1.00 0.00 C ATOM 1286 C MET A 163 5.654 6.044 3.185 1.00 0.00 C ATOM 1287 O MET A 163 6.648 5.874 3.890 1.00 0.00 O ATOM 1288 CB MET A 163 3.316 6.052 4.077 1.00 0.00 C ATOM 1289 CG MET A 163 2.487 6.653 5.201 1.00 0.00 C ATOM 1290 SD MET A 163 1.591 5.405 6.145 1.00 0.00 S ATOM 1291 CE MET A 163 -0.097 5.968 5.934 1.00 0.00 C ATOM 0 H MET A 163 3.116 7.799 2.351 1.00 0.00 H new ATOM 0 HA MET A 163 4.840 7.501 4.520 1.00 0.00 H new ATOM 0 HB2 MET A 163 2.674 5.886 3.212 1.00 0.00 H new ATOM 0 HB3 MET A 163 3.686 5.076 4.391 1.00 0.00 H new ATOM 0 HG2 MET A 163 3.141 7.211 5.872 1.00 0.00 H new ATOM 0 HG3 MET A 163 1.777 7.366 4.782 1.00 0.00 H new ATOM 0 HE1 MET A 163 -0.772 5.306 6.477 1.00 0.00 H new ATOM 0 HE2 MET A 163 -0.193 6.982 6.322 1.00 0.00 H new ATOM 0 HE3 MET A 163 -0.354 5.959 4.875 1.00 0.00 H new ATOM 1301 N ARG A 164 5.512 5.486 1.987 1.00 0.00 N ATOM 1302 CA ARG A 164 6.540 4.622 1.420 1.00 0.00 C ATOM 1303 C ARG A 164 7.885 5.340 1.367 1.00 0.00 C ATOM 1304 O ARG A 164 8.915 4.780 1.743 1.00 0.00 O ATOM 1305 CB ARG A 164 6.137 4.167 0.016 1.00 0.00 C ATOM 1306 CG ARG A 164 6.773 2.852 -0.404 1.00 0.00 C ATOM 1307 CD ARG A 164 6.540 2.568 -1.880 1.00 0.00 C ATOM 1308 NE ARG A 164 7.371 3.410 -2.737 1.00 0.00 N ATOM 1309 CZ ARG A 164 7.127 3.613 -4.027 1.00 0.00 C ATOM 1310 NH1 ARG A 164 6.081 3.039 -4.605 1.00 0.00 N ATOM 1311 NH2 ARG A 164 7.929 4.393 -4.740 1.00 0.00 N ATOM 0 H ARG A 164 4.695 5.617 1.391 1.00 0.00 H new ATOM 0 HA ARG A 164 6.639 3.748 2.063 1.00 0.00 H new ATOM 0 HB2 ARG A 164 5.053 4.066 -0.027 1.00 0.00 H new ATOM 0 HB3 ARG A 164 6.414 4.940 -0.701 1.00 0.00 H new ATOM 0 HG2 ARG A 164 7.844 2.884 -0.203 1.00 0.00 H new ATOM 0 HG3 ARG A 164 6.360 2.039 0.194 1.00 0.00 H new ATOM 0 HD2 ARG A 164 6.754 1.519 -2.085 1.00 0.00 H new ATOM 0 HD3 ARG A 164 5.489 2.732 -2.119 1.00 0.00 H new ATOM 0 HE ARG A 164 8.183 3.867 -2.322 1.00 0.00 H new ATOM 0 HH11 ARG A 164 5.462 2.440 -4.059 1.00 0.00 H new ATOM 0 HH12 ARG A 164 5.896 3.196 -5.596 1.00 0.00 H new ATOM 0 HH21 ARG A 164 8.734 4.837 -4.298 1.00 0.00 H new ATOM 0 HH22 ARG A 164 7.741 4.548 -5.730 1.00 0.00 H new ATOM 1325 N HIS A 165 7.868 6.583 0.896 1.00 0.00 N ATOM 1326 CA HIS A 165 9.087 7.379 0.794 1.00 0.00 C ATOM 1327 C HIS A 165 9.671 7.658 2.175 1.00 0.00 C ATOM 1328 O HIS A 165 10.883 7.572 2.378 1.00 0.00 O ATOM 1329 CB HIS A 165 8.802 8.696 0.071 1.00 0.00 C ATOM 1330 CG HIS A 165 10.013 9.560 -0.097 1.00 0.00 C ATOM 1331 ND1 HIS A 165 11.141 9.153 -0.779 1.00 0.00 N ATOM 1332 CD2 HIS A 165 10.269 10.819 0.332 1.00 0.00 C ATOM 1333 CE1 HIS A 165 12.038 10.122 -0.761 1.00 0.00 C ATOM 1334 NE2 HIS A 165 11.534 11.145 -0.093 1.00 0.00 N ATOM 0 H HIS A 165 7.024 7.061 0.579 1.00 0.00 H new ATOM 0 HA HIS A 165 9.817 6.809 0.220 1.00 0.00 H new ATOM 0 HB2 HIS A 165 8.382 8.479 -0.911 1.00 0.00 H new ATOM 0 HB3 HIS A 165 8.045 9.250 0.626 1.00 0.00 H new ATOM 0 HD1 HIS A 165 11.263 8.245 -1.227 1.00 0.00 H new ATOM 0 HD2 HIS A 165 9.603 11.449 0.902 1.00 0.00 H new ATOM 0 HE1 HIS A 165 13.017 10.085 -1.215 1.00 0.00 H new ATOM 1342 N LEU A 166 8.802 7.995 3.122 1.00 0.00 N ATOM 1343 CA LEU A 166 9.231 8.289 4.485 1.00 0.00 C ATOM 1344 C LEU A 166 10.026 7.125 5.068 1.00 0.00 C ATOM 1345 O LEU A 166 10.992 7.326 5.806 1.00 0.00 O ATOM 1346 CB LEU A 166 8.020 8.587 5.369 1.00 0.00 C ATOM 1347 CG LEU A 166 7.381 9.965 5.190 1.00 0.00 C ATOM 1348 CD1 LEU A 166 6.080 10.057 5.973 1.00 0.00 C ATOM 1349 CD2 LEU A 166 8.345 11.060 5.624 1.00 0.00 C ATOM 0 H LEU A 166 7.796 8.071 2.971 1.00 0.00 H new ATOM 0 HA LEU A 166 9.876 9.167 4.455 1.00 0.00 H new ATOM 0 HB2 LEU A 166 7.261 7.829 5.178 1.00 0.00 H new ATOM 0 HB3 LEU A 166 8.321 8.481 6.411 1.00 0.00 H new ATOM 0 HG LEU A 166 7.155 10.105 4.133 1.00 0.00 H new ATOM 0 HD11 LEU A 166 5.640 11.045 5.833 1.00 0.00 H new ATOM 0 HD12 LEU A 166 5.386 9.297 5.615 1.00 0.00 H new ATOM 0 HD13 LEU A 166 6.281 9.896 7.032 1.00 0.00 H new ATOM 0 HD21 LEU A 166 7.874 12.034 5.490 1.00 0.00 H new ATOM 0 HD22 LEU A 166 8.602 10.923 6.674 1.00 0.00 H new ATOM 0 HD23 LEU A 166 9.250 11.009 5.019 1.00 0.00 H new ATOM 1361 N LEU A 167 9.616 5.907 4.731 1.00 0.00 N ATOM 1362 CA LEU A 167 10.291 4.709 5.219 1.00 0.00 C ATOM 1363 C LEU A 167 11.639 4.525 4.529 1.00 0.00 C ATOM 1364 O LEU A 167 12.626 4.155 5.164 1.00 0.00 O ATOM 1365 CB LEU A 167 9.414 3.477 4.990 1.00 0.00 C ATOM 1366 CG LEU A 167 8.033 3.504 5.645 1.00 0.00 C ATOM 1367 CD1 LEU A 167 7.351 2.152 5.509 1.00 0.00 C ATOM 1368 CD2 LEU A 167 8.146 3.901 7.110 1.00 0.00 C ATOM 0 H LEU A 167 8.819 5.723 4.122 1.00 0.00 H new ATOM 0 HA LEU A 167 10.465 4.829 6.288 1.00 0.00 H new ATOM 0 HB2 LEU A 167 9.282 3.345 3.916 1.00 0.00 H new ATOM 0 HB3 LEU A 167 9.950 2.601 5.356 1.00 0.00 H new ATOM 0 HG LEU A 167 7.423 4.248 5.133 1.00 0.00 H new ATOM 0 HD11 LEU A 167 6.369 2.191 5.981 1.00 0.00 H new ATOM 0 HD12 LEU A 167 7.236 1.907 4.453 1.00 0.00 H new ATOM 0 HD13 LEU A 167 7.958 1.388 5.995 1.00 0.00 H new ATOM 0 HD21 LEU A 167 7.154 3.915 7.561 1.00 0.00 H new ATOM 0 HD22 LEU A 167 8.773 3.180 7.635 1.00 0.00 H new ATOM 0 HD23 LEU A 167 8.593 4.892 7.185 1.00 0.00 H new ATOM 1380 N MET A 168 11.671 4.786 3.227 1.00 0.00 N ATOM 1381 CA MET A 168 12.899 4.652 2.451 1.00 0.00 C ATOM 1382 C MET A 168 14.097 5.180 3.234 1.00 0.00 C ATOM 1383 O MET A 168 15.182 4.600 3.194 1.00 0.00 O ATOM 1384 CB MET A 168 12.774 5.401 1.123 1.00 0.00 C ATOM 1385 CG MET A 168 11.827 4.735 0.138 1.00 0.00 C ATOM 1386 SD MET A 168 11.779 5.576 -1.457 1.00 0.00 S ATOM 1387 CE MET A 168 11.538 4.189 -2.564 1.00 0.00 C ATOM 0 H MET A 168 10.862 5.091 2.687 1.00 0.00 H new ATOM 0 HA MET A 168 13.057 3.593 2.249 1.00 0.00 H new ATOM 0 HB2 MET A 168 12.427 6.416 1.319 1.00 0.00 H new ATOM 0 HB3 MET A 168 13.761 5.483 0.667 1.00 0.00 H new ATOM 0 HG2 MET A 168 12.133 3.699 -0.011 1.00 0.00 H new ATOM 0 HG3 MET A 168 10.824 4.713 0.563 1.00 0.00 H new ATOM 0 HE1 MET A 168 11.488 4.548 -3.592 1.00 0.00 H new ATOM 0 HE2 MET A 168 12.371 3.494 -2.463 1.00 0.00 H new ATOM 0 HE3 MET A 168 10.608 3.680 -2.312 1.00 0.00 H new ATOM 1397 N SER A 169 13.893 6.284 3.946 1.00 0.00 N ATOM 1398 CA SER A 169 14.958 6.892 4.736 1.00 0.00 C ATOM 1399 C SER A 169 15.840 5.823 5.374 1.00 0.00 C ATOM 1400 O SER A 169 17.065 5.934 5.374 1.00 0.00 O ATOM 1401 CB SER A 169 14.366 7.795 5.819 1.00 0.00 C ATOM 1402 OG SER A 169 15.326 8.727 6.287 1.00 0.00 O ATOM 0 H SER A 169 13.000 6.776 3.992 1.00 0.00 H new ATOM 0 HA SER A 169 15.574 7.494 4.068 1.00 0.00 H new ATOM 0 HB2 SER A 169 13.502 8.327 5.421 1.00 0.00 H new ATOM 0 HB3 SER A 169 14.010 7.186 6.650 1.00 0.00 H new ATOM 0 HG SER A 169 14.922 9.294 6.977 1.00 0.00 H new ATOM 1408 N GLN A 170 15.205 4.789 5.917 1.00 0.00 N ATOM 1409 CA GLN A 170 15.932 3.700 6.560 1.00 0.00 C ATOM 1410 C GLN A 170 17.017 3.152 5.639 1.00 0.00 C ATOM 1411 O GLN A 170 17.158 3.595 4.500 1.00 0.00 O ATOM 1412 CB GLN A 170 14.968 2.580 6.956 1.00 0.00 C ATOM 1413 CG GLN A 170 14.066 2.939 8.126 1.00 0.00 C ATOM 1414 CD GLN A 170 14.840 3.174 9.409 1.00 0.00 C ATOM 1415 OE1 GLN A 170 15.983 2.738 9.546 1.00 0.00 O ATOM 1416 NE2 GLN A 170 14.218 3.865 10.357 1.00 0.00 N ATOM 0 H GLN A 170 14.191 4.682 5.925 1.00 0.00 H new ATOM 0 HA GLN A 170 16.408 4.094 7.458 1.00 0.00 H new ATOM 0 HB2 GLN A 170 14.349 2.324 6.096 1.00 0.00 H new ATOM 0 HB3 GLN A 170 15.543 1.690 7.211 1.00 0.00 H new ATOM 0 HG2 GLN A 170 13.497 3.836 7.880 1.00 0.00 H new ATOM 0 HG3 GLN A 170 13.345 2.137 8.283 1.00 0.00 H new ATOM 0 HE21 GLN A 170 13.270 4.207 10.200 1.00 0.00 H new ATOM 0 HE22 GLN A 170 14.688 4.054 11.242 1.00 0.00 H new ATOM 1425 N GLN A 171 17.779 2.186 6.141 1.00 0.00 N ATOM 1426 CA GLN A 171 18.852 1.578 5.363 1.00 0.00 C ATOM 1427 C GLN A 171 18.738 0.057 5.374 1.00 0.00 C ATOM 1428 O GLN A 171 18.661 -0.578 4.322 1.00 0.00 O ATOM 1429 CB GLN A 171 20.214 2.003 5.915 1.00 0.00 C ATOM 1430 CG GLN A 171 21.355 1.818 4.927 1.00 0.00 C ATOM 1431 CD GLN A 171 21.494 2.986 3.971 1.00 0.00 C ATOM 1432 OE1 GLN A 171 21.515 4.145 4.386 1.00 0.00 O ATOM 1433 NE2 GLN A 171 21.590 2.686 2.680 1.00 0.00 N ATOM 0 H GLN A 171 17.674 1.808 7.082 1.00 0.00 H new ATOM 0 HA GLN A 171 18.761 1.923 4.333 1.00 0.00 H new ATOM 0 HB2 GLN A 171 20.166 3.051 6.210 1.00 0.00 H new ATOM 0 HB3 GLN A 171 20.427 1.428 6.816 1.00 0.00 H new ATOM 0 HG2 GLN A 171 22.288 1.689 5.475 1.00 0.00 H new ATOM 0 HG3 GLN A 171 21.192 0.904 4.356 1.00 0.00 H new ATOM 0 HE21 GLN A 171 21.568 1.711 2.380 1.00 0.00 H new ATOM 0 HE22 GLN A 171 21.686 3.430 1.989 1.00 0.00 H new ATOM 1442 N THR A 172 18.729 -0.522 6.570 1.00 0.00 N ATOM 1443 CA THR A 172 18.625 -1.969 6.718 1.00 0.00 C ATOM 1444 C THR A 172 17.691 -2.563 5.671 1.00 0.00 C ATOM 1445 O THR A 172 17.919 -3.667 5.175 1.00 0.00 O ATOM 1446 CB THR A 172 18.119 -2.355 8.121 1.00 0.00 C ATOM 1447 OG1 THR A 172 16.948 -1.599 8.445 1.00 0.00 O ATOM 1448 CG2 THR A 172 19.193 -2.111 9.170 1.00 0.00 C ATOM 0 H THR A 172 18.792 -0.011 7.451 1.00 0.00 H new ATOM 0 HA THR A 172 19.627 -2.374 6.577 1.00 0.00 H new ATOM 0 HB THR A 172 17.874 -3.417 8.115 1.00 0.00 H new ATOM 0 HG1 THR A 172 16.632 -1.852 9.338 1.00 0.00 H new ATOM 0 HG21 THR A 172 18.812 -2.391 10.152 1.00 0.00 H new ATOM 0 HG22 THR A 172 20.072 -2.711 8.937 1.00 0.00 H new ATOM 0 HG23 THR A 172 19.465 -1.055 9.174 1.00 0.00 H new ATOM 1456 N LEU A 173 16.637 -1.825 5.339 1.00 0.00 N ATOM 1457 CA LEU A 173 15.667 -2.280 4.349 1.00 0.00 C ATOM 1458 C LEU A 173 16.267 -2.256 2.947 1.00 0.00 C ATOM 1459 O LEU A 173 16.933 -1.295 2.562 1.00 0.00 O ATOM 1460 CB LEU A 173 14.414 -1.403 4.394 1.00 0.00 C ATOM 1461 CG LEU A 173 13.314 -1.853 5.356 1.00 0.00 C ATOM 1462 CD1 LEU A 173 13.578 -1.318 6.755 1.00 0.00 C ATOM 1463 CD2 LEU A 173 11.950 -1.398 4.858 1.00 0.00 C ATOM 0 H LEU A 173 16.433 -0.910 5.740 1.00 0.00 H new ATOM 0 HA LEU A 173 15.394 -3.307 4.590 1.00 0.00 H new ATOM 0 HB2 LEU A 173 14.713 -0.390 4.664 1.00 0.00 H new ATOM 0 HB3 LEU A 173 13.993 -1.354 3.390 1.00 0.00 H new ATOM 0 HG LEU A 173 13.318 -2.942 5.398 1.00 0.00 H new ATOM 0 HD11 LEU A 173 12.785 -1.648 7.426 1.00 0.00 H new ATOM 0 HD12 LEU A 173 14.537 -1.693 7.113 1.00 0.00 H new ATOM 0 HD13 LEU A 173 13.602 -0.229 6.729 1.00 0.00 H new ATOM 0 HD21 LEU A 173 11.180 -1.727 5.555 1.00 0.00 H new ATOM 0 HD22 LEU A 173 11.933 -0.311 4.786 1.00 0.00 H new ATOM 0 HD23 LEU A 173 11.759 -1.830 3.876 1.00 0.00 H new ATOM 1475 N ARG A 174 16.026 -3.320 2.187 1.00 0.00 N ATOM 1476 CA ARG A 174 16.542 -3.421 0.827 1.00 0.00 C ATOM 1477 C ARG A 174 15.555 -2.827 -0.174 1.00 0.00 C ATOM 1478 O ARG A 174 15.774 -1.740 -0.706 1.00 0.00 O ATOM 1479 CB ARG A 174 16.827 -4.882 0.474 1.00 0.00 C ATOM 1480 CG ARG A 174 18.168 -5.382 0.986 1.00 0.00 C ATOM 1481 CD ARG A 174 18.059 -5.913 2.407 1.00 0.00 C ATOM 1482 NE ARG A 174 17.564 -7.287 2.440 1.00 0.00 N ATOM 1483 CZ ARG A 174 18.317 -8.346 2.163 1.00 0.00 C ATOM 1484 NH1 ARG A 174 19.592 -8.190 1.834 1.00 0.00 N ATOM 1485 NH2 ARG A 174 17.794 -9.565 2.216 1.00 0.00 N ATOM 0 H ARG A 174 15.477 -4.124 2.490 1.00 0.00 H new ATOM 0 HA ARG A 174 17.472 -2.854 0.774 1.00 0.00 H new ATOM 0 HB2 ARG A 174 16.035 -5.507 0.885 1.00 0.00 H new ATOM 0 HB3 ARG A 174 16.795 -4.998 -0.609 1.00 0.00 H new ATOM 0 HG2 ARG A 174 18.539 -6.169 0.330 1.00 0.00 H new ATOM 0 HG3 ARG A 174 18.896 -4.571 0.954 1.00 0.00 H new ATOM 0 HD2 ARG A 174 19.037 -5.868 2.887 1.00 0.00 H new ATOM 0 HD3 ARG A 174 17.391 -5.273 2.983 1.00 0.00 H new ATOM 0 HE ARG A 174 16.587 -7.442 2.689 1.00 0.00 H new ATOM 0 HH11 ARG A 174 19.997 -7.255 1.793 1.00 0.00 H new ATOM 0 HH12 ARG A 174 20.167 -9.005 1.622 1.00 0.00 H new ATOM 0 HH21 ARG A 174 16.814 -9.689 2.469 1.00 0.00 H new ATOM 0 HH22 ARG A 174 18.372 -10.378 2.003 1.00 0.00 H new ATOM 1499 N ASN A 175 14.469 -3.550 -0.426 1.00 0.00 N ATOM 1500 CA ASN A 175 13.449 -3.096 -1.364 1.00 0.00 C ATOM 1501 C ASN A 175 12.123 -2.853 -0.651 1.00 0.00 C ATOM 1502 O ASN A 175 11.713 -3.637 0.205 1.00 0.00 O ATOM 1503 CB ASN A 175 13.259 -4.125 -2.481 1.00 0.00 C ATOM 1504 CG ASN A 175 12.558 -3.541 -3.692 1.00 0.00 C ATOM 1505 OD1 ASN A 175 12.220 -2.357 -3.717 1.00 0.00 O ATOM 1506 ND2 ASN A 175 12.336 -4.371 -4.704 1.00 0.00 N ATOM 0 H ASN A 175 14.273 -4.453 0.006 1.00 0.00 H new ATOM 0 HA ASN A 175 13.785 -2.155 -1.799 1.00 0.00 H new ATOM 0 HB2 ASN A 175 14.232 -4.515 -2.781 1.00 0.00 H new ATOM 0 HB3 ASN A 175 12.681 -4.967 -2.101 1.00 0.00 H new ATOM 0 HD21 ASN A 175 11.868 -4.035 -5.546 1.00 0.00 H new ATOM 0 HD22 ASN A 175 12.633 -5.345 -4.640 1.00 0.00 H new ATOM 1513 N VAL A 176 11.456 -1.760 -1.009 1.00 0.00 N ATOM 1514 CA VAL A 176 10.175 -1.414 -0.405 1.00 0.00 C ATOM 1515 C VAL A 176 9.056 -1.434 -1.440 1.00 0.00 C ATOM 1516 O VAL A 176 8.866 -0.488 -2.205 1.00 0.00 O ATOM 1517 CB VAL A 176 10.224 -0.023 0.255 1.00 0.00 C ATOM 1518 CG1 VAL A 176 8.863 0.346 0.825 1.00 0.00 C ATOM 1519 CG2 VAL A 176 11.292 0.016 1.337 1.00 0.00 C ATOM 0 H VAL A 176 11.782 -1.099 -1.714 1.00 0.00 H new ATOM 0 HA VAL A 176 9.972 -2.164 0.359 1.00 0.00 H new ATOM 0 HB VAL A 176 10.484 0.712 -0.507 1.00 0.00 H new ATOM 0 HG11 VAL A 176 8.917 1.332 1.287 1.00 0.00 H new ATOM 0 HG12 VAL A 176 8.125 0.361 0.023 1.00 0.00 H new ATOM 0 HG13 VAL A 176 8.570 -0.390 1.574 1.00 0.00 H new ATOM 0 HG21 VAL A 176 11.313 1.006 1.792 1.00 0.00 H new ATOM 0 HG22 VAL A 176 11.065 -0.729 2.099 1.00 0.00 H new ATOM 0 HG23 VAL A 176 12.265 -0.201 0.896 1.00 0.00 H new ATOM 1529 N PRO A 177 8.294 -2.538 -1.466 1.00 0.00 N ATOM 1530 CA PRO A 177 7.179 -2.709 -2.402 1.00 0.00 C ATOM 1531 C PRO A 177 6.006 -1.789 -2.080 1.00 0.00 C ATOM 1532 O PRO A 177 5.963 -1.140 -1.034 1.00 0.00 O ATOM 1533 CB PRO A 177 6.777 -4.173 -2.212 1.00 0.00 C ATOM 1534 CG PRO A 177 7.218 -4.511 -0.829 1.00 0.00 C ATOM 1535 CD PRO A 177 8.463 -3.705 -0.583 1.00 0.00 C ATOM 0 HA PRO A 177 7.464 -2.460 -3.424 1.00 0.00 H new ATOM 0 HB2 PRO A 177 5.701 -4.306 -2.328 1.00 0.00 H new ATOM 0 HB3 PRO A 177 7.259 -4.815 -2.949 1.00 0.00 H new ATOM 0 HG2 PRO A 177 6.444 -4.266 -0.102 1.00 0.00 H new ATOM 0 HG3 PRO A 177 7.419 -5.578 -0.733 1.00 0.00 H new ATOM 0 HD2 PRO A 177 8.550 -3.409 0.462 1.00 0.00 H new ATOM 0 HD3 PRO A 177 9.362 -4.269 -0.830 1.00 0.00 H new ATOM 1543 N PRO A 178 5.031 -1.729 -2.999 1.00 0.00 N ATOM 1544 CA PRO A 178 3.839 -0.892 -2.834 1.00 0.00 C ATOM 1545 C PRO A 178 2.912 -1.411 -1.741 1.00 0.00 C ATOM 1546 O PRO A 178 2.584 -2.598 -1.705 1.00 0.00 O ATOM 1547 CB PRO A 178 3.154 -0.976 -4.201 1.00 0.00 C ATOM 1548 CG PRO A 178 3.615 -2.271 -4.775 1.00 0.00 C ATOM 1549 CD PRO A 178 5.016 -2.474 -4.269 1.00 0.00 C ATOM 0 HA PRO A 178 4.094 0.124 -2.531 1.00 0.00 H new ATOM 0 HB2 PRO A 178 2.069 -0.950 -4.103 1.00 0.00 H new ATOM 0 HB3 PRO A 178 3.436 -0.138 -4.838 1.00 0.00 H new ATOM 0 HG2 PRO A 178 2.965 -3.089 -4.463 1.00 0.00 H new ATOM 0 HG3 PRO A 178 3.594 -2.244 -5.864 1.00 0.00 H new ATOM 0 HD2 PRO A 178 5.240 -3.530 -4.118 1.00 0.00 H new ATOM 0 HD3 PRO A 178 5.756 -2.088 -4.970 1.00 0.00 H new ATOM 1557 N ILE A 179 2.492 -0.517 -0.853 1.00 0.00 N ATOM 1558 CA ILE A 179 1.601 -0.886 0.240 1.00 0.00 C ATOM 1559 C ILE A 179 0.140 -0.695 -0.153 1.00 0.00 C ATOM 1560 O ILE A 179 -0.266 0.391 -0.566 1.00 0.00 O ATOM 1561 CB ILE A 179 1.892 -0.061 1.508 1.00 0.00 C ATOM 1562 CG1 ILE A 179 3.310 -0.340 2.010 1.00 0.00 C ATOM 1563 CG2 ILE A 179 0.870 -0.374 2.590 1.00 0.00 C ATOM 1564 CD1 ILE A 179 3.853 0.739 2.920 1.00 0.00 C ATOM 0 H ILE A 179 2.754 0.469 -0.869 1.00 0.00 H new ATOM 0 HA ILE A 179 1.783 -1.939 0.453 1.00 0.00 H new ATOM 0 HB ILE A 179 1.816 0.998 1.260 1.00 0.00 H new ATOM 0 HG12 ILE A 179 3.317 -1.291 2.543 1.00 0.00 H new ATOM 0 HG13 ILE A 179 3.975 -0.450 1.153 1.00 0.00 H new ATOM 0 HG21 ILE A 179 1.089 0.217 3.479 1.00 0.00 H new ATOM 0 HG22 ILE A 179 -0.129 -0.129 2.229 1.00 0.00 H new ATOM 0 HG23 ILE A 179 0.916 -1.434 2.838 1.00 0.00 H new ATOM 0 HD11 ILE A 179 4.862 0.474 3.237 1.00 0.00 H new ATOM 0 HD12 ILE A 179 3.878 1.688 2.384 1.00 0.00 H new ATOM 0 HD13 ILE A 179 3.211 0.834 3.796 1.00 0.00 H new ATOM 1576 N VAL A 180 -0.647 -1.758 -0.019 1.00 0.00 N ATOM 1577 CA VAL A 180 -2.064 -1.707 -0.358 1.00 0.00 C ATOM 1578 C VAL A 180 -2.931 -2.016 0.858 1.00 0.00 C ATOM 1579 O VAL A 180 -2.879 -3.117 1.407 1.00 0.00 O ATOM 1580 CB VAL A 180 -2.408 -2.698 -1.485 1.00 0.00 C ATOM 1581 CG1 VAL A 180 -3.880 -2.597 -1.855 1.00 0.00 C ATOM 1582 CG2 VAL A 180 -1.527 -2.450 -2.700 1.00 0.00 C ATOM 0 H VAL A 180 -0.327 -2.665 0.322 1.00 0.00 H new ATOM 0 HA VAL A 180 -2.271 -0.693 -0.701 1.00 0.00 H new ATOM 0 HB VAL A 180 -2.217 -3.709 -1.126 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -4.104 -3.305 -2.653 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -4.491 -2.828 -0.983 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -4.101 -1.585 -2.195 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -1.784 -3.159 -3.487 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -1.684 -1.434 -3.062 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -0.481 -2.579 -2.423 1.00 0.00 H new ATOM 1592 N PHE A 181 -3.728 -1.038 1.274 1.00 0.00 N ATOM 1593 CA PHE A 181 -4.607 -1.205 2.426 1.00 0.00 C ATOM 1594 C PHE A 181 -5.890 -1.929 2.030 1.00 0.00 C ATOM 1595 O PHE A 181 -6.603 -1.502 1.121 1.00 0.00 O ATOM 1596 CB PHE A 181 -4.944 0.156 3.039 1.00 0.00 C ATOM 1597 CG PHE A 181 -3.748 0.877 3.591 1.00 0.00 C ATOM 1598 CD1 PHE A 181 -3.154 0.458 4.771 1.00 0.00 C ATOM 1599 CD2 PHE A 181 -3.216 1.973 2.931 1.00 0.00 C ATOM 1600 CE1 PHE A 181 -2.054 1.121 5.283 1.00 0.00 C ATOM 1601 CE2 PHE A 181 -2.116 2.639 3.437 1.00 0.00 C ATOM 1602 CZ PHE A 181 -1.533 2.211 4.614 1.00 0.00 C ATOM 0 H PHE A 181 -3.784 -0.121 0.831 1.00 0.00 H new ATOM 0 HA PHE A 181 -4.083 -1.809 3.167 1.00 0.00 H new ATOM 0 HB2 PHE A 181 -5.417 0.780 2.281 1.00 0.00 H new ATOM 0 HB3 PHE A 181 -5.674 0.016 3.836 1.00 0.00 H new ATOM 0 HD1 PHE A 181 -3.555 -0.396 5.297 1.00 0.00 H new ATOM 0 HD2 PHE A 181 -3.667 2.311 2.010 1.00 0.00 H new ATOM 0 HE1 PHE A 181 -1.603 0.787 6.205 1.00 0.00 H new ATOM 0 HE2 PHE A 181 -1.713 3.493 2.913 1.00 0.00 H new ATOM 0 HZ PHE A 181 -0.671 2.728 5.010 1.00 0.00 H new ATOM 1612 N VAL A 182 -6.179 -3.028 2.719 1.00 0.00 N ATOM 1613 CA VAL A 182 -7.376 -3.812 2.441 1.00 0.00 C ATOM 1614 C VAL A 182 -8.272 -3.903 3.672 1.00 0.00 C ATOM 1615 O VAL A 182 -7.786 -3.988 4.799 1.00 0.00 O ATOM 1616 CB VAL A 182 -7.019 -5.236 1.973 1.00 0.00 C ATOM 1617 CG1 VAL A 182 -8.279 -6.068 1.784 1.00 0.00 C ATOM 1618 CG2 VAL A 182 -6.206 -5.186 0.689 1.00 0.00 C ATOM 0 H VAL A 182 -5.600 -3.396 3.474 1.00 0.00 H new ATOM 0 HA VAL A 182 -7.912 -3.299 1.642 1.00 0.00 H new ATOM 0 HB VAL A 182 -6.411 -5.711 2.743 1.00 0.00 H new ATOM 0 HG11 VAL A 182 -8.007 -7.070 1.453 1.00 0.00 H new ATOM 0 HG12 VAL A 182 -8.818 -6.132 2.729 1.00 0.00 H new ATOM 0 HG13 VAL A 182 -8.916 -5.599 1.034 1.00 0.00 H new ATOM 0 HG21 VAL A 182 -5.963 -6.200 0.373 1.00 0.00 H new ATOM 0 HG22 VAL A 182 -6.787 -4.692 -0.090 1.00 0.00 H new ATOM 0 HG23 VAL A 182 -5.285 -4.629 0.863 1.00 0.00 H new ATOM 1628 N GLN A 183 -9.581 -3.885 3.446 1.00 0.00 N ATOM 1629 CA GLN A 183 -10.545 -3.966 4.538 1.00 0.00 C ATOM 1630 C GLN A 183 -10.553 -5.360 5.155 1.00 0.00 C ATOM 1631 O GLN A 183 -10.580 -6.364 4.444 1.00 0.00 O ATOM 1632 CB GLN A 183 -11.945 -3.608 4.037 1.00 0.00 C ATOM 1633 CG GLN A 183 -12.081 -2.161 3.591 1.00 0.00 C ATOM 1634 CD GLN A 183 -13.363 -1.905 2.824 1.00 0.00 C ATOM 1635 OE1 GLN A 183 -14.264 -2.745 2.798 1.00 0.00 O ATOM 1636 NE2 GLN A 183 -13.454 -0.740 2.193 1.00 0.00 N ATOM 0 H GLN A 183 -9.999 -3.815 2.518 1.00 0.00 H new ATOM 0 HA GLN A 183 -10.248 -3.252 5.306 1.00 0.00 H new ATOM 0 HB2 GLN A 183 -12.202 -4.262 3.203 1.00 0.00 H new ATOM 0 HB3 GLN A 183 -12.667 -3.804 4.830 1.00 0.00 H new ATOM 0 HG2 GLN A 183 -12.049 -1.511 4.465 1.00 0.00 H new ATOM 0 HG3 GLN A 183 -11.229 -1.896 2.965 1.00 0.00 H new ATOM 0 HE21 GLN A 183 -12.684 -0.073 2.241 1.00 0.00 H new ATOM 0 HE22 GLN A 183 -14.294 -0.513 1.661 1.00 0.00 H new ATOM 1645 N ASP A 184 -10.530 -5.414 6.482 1.00 0.00 N ATOM 1646 CA ASP A 184 -10.535 -6.686 7.196 1.00 0.00 C ATOM 1647 C ASP A 184 -11.924 -7.316 7.172 1.00 0.00 C ATOM 1648 O ASP A 184 -12.449 -7.729 8.207 1.00 0.00 O ATOM 1649 CB ASP A 184 -10.077 -6.486 8.641 1.00 0.00 C ATOM 1650 CG ASP A 184 -8.592 -6.196 8.743 1.00 0.00 C ATOM 1651 OD1 ASP A 184 -8.200 -5.029 8.531 1.00 0.00 O ATOM 1652 OD2 ASP A 184 -7.823 -7.135 9.035 1.00 0.00 O ATOM 0 H ASP A 184 -10.508 -4.592 7.085 1.00 0.00 H new ATOM 0 HA ASP A 184 -9.841 -7.360 6.694 1.00 0.00 H new ATOM 0 HB2 ASP A 184 -10.636 -5.663 9.086 1.00 0.00 H new ATOM 0 HB3 ASP A 184 -10.310 -7.380 9.220 1.00 0.00 H new