USER MOD reduce.3.24.130724 H: found=0, std=0, add=920, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 920 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 47 TYR OH : rot 180:sc= 0.418 USER MOD Set 1.2: A 98 LYS NZ :NH3+ -144:sc= -0.115 (180deg=-2.17!) USER MOD Set 2.1: A 16 THR OG1 : rot -85:sc= 0.13 USER MOD Set 2.2: A 31 HIS : no HD1:sc=-0.000662 X(o=0.25,f=0.14) USER MOD Set 2.3: A 128 THR OG1 : rot 180:sc= 0.123 USER MOD Single : A 8 SER OG : rot 31:sc= -0.637 USER MOD Single : A 12 GLN : amide:sc= -0.444 K(o=-0.44,f=-2.7!) USER MOD Single : A 14 GLN : amide:sc= -5.34! K(o=-5.3!,f=-4.3) USER MOD Single : A 19 HIS : no HD1:sc= -3.31! C(o=-3.3!,f=-8.7!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 ASN : amide:sc= -3.96! C(o=-4!,f=-6.1!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 CYS SG : rot 180:sc= -0.481 USER MOD Single : A 35 ASN : amide:sc= -0.148 X(o=-0.15,f=-0.29) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot -159:sc= 0 USER MOD Single : A 50 MET CE :methyl -125:sc= -0.0234 (180deg=-0.603) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0604) USER MOD Single : A 64 THR OG1 : rot 158:sc= 0.776 USER MOD Single : A 65 HIS : no HD1:sc= -0.0739 X(o=-0.074,f=-0.084) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.56 USER MOD Single : A 72 ASN : amide:sc= -0.0676 X(o=-0.068,f=-0.53) USER MOD Single : A 77 GLN : amide:sc= -0.123 K(o=-0.12,f=-1.2) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 48:sc= 0.491 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -0.047 X(o=-0.047,f=0.099) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -4.06! K(o=-4.1!,f=-1.2) USER MOD Single : A 113 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00312) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 GLN : amide:sc= -1.17 X(o=-1.2,f=-1) USER MOD Single : A 131 TYR OH : rot 165:sc= 0.733 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N SER A 8 11.415 11.877 1.248 1.00 0.00 N ATOM 67 CA SER A 8 10.554 11.734 0.080 1.00 0.00 C ATOM 68 C SER A 8 10.114 13.098 -0.442 1.00 0.00 C ATOM 69 O SER A 8 9.113 13.665 -0.005 1.00 0.00 O ATOM 70 CB SER A 8 9.327 10.888 0.425 1.00 0.00 C ATOM 71 OG SER A 8 9.707 9.639 0.977 1.00 0.00 O ATOM 0 HA SER A 8 11.125 11.232 -0.701 1.00 0.00 H new ATOM 0 HB2 SER A 8 8.698 11.426 1.134 1.00 0.00 H new ATOM 0 HB3 SER A 8 8.729 10.726 -0.472 1.00 0.00 H new ATOM 0 HG SER A 8 10.550 9.741 1.466 1.00 0.00 H new ATOM 77 N PRO A 9 10.882 13.640 -1.400 1.00 0.00 N ATOM 78 CA PRO A 9 10.592 14.944 -2.003 1.00 0.00 C ATOM 79 C PRO A 9 9.346 14.912 -2.882 1.00 0.00 C ATOM 80 O PRO A 9 8.737 15.949 -3.150 1.00 0.00 O ATOM 81 CB PRO A 9 11.836 15.227 -2.849 1.00 0.00 C ATOM 82 CG PRO A 9 12.397 13.883 -3.161 1.00 0.00 C ATOM 83 CD PRO A 9 12.090 13.020 -1.968 1.00 0.00 C ATOM 0 HA PRO A 9 10.389 15.706 -1.250 1.00 0.00 H new ATOM 0 HB2 PRO A 9 11.581 15.770 -3.759 1.00 0.00 H new ATOM 0 HB3 PRO A 9 12.555 15.839 -2.304 1.00 0.00 H new ATOM 0 HG2 PRO A 9 11.948 13.473 -4.065 1.00 0.00 H new ATOM 0 HG3 PRO A 9 13.471 13.939 -3.336 1.00 0.00 H new ATOM 0 HD2 PRO A 9 11.912 11.984 -2.257 1.00 0.00 H new ATOM 0 HD3 PRO A 9 12.913 13.015 -1.253 1.00 0.00 H new ATOM 91 N LEU A 10 8.972 13.718 -3.328 1.00 0.00 N ATOM 92 CA LEU A 10 7.798 13.551 -4.177 1.00 0.00 C ATOM 93 C LEU A 10 6.564 13.225 -3.341 1.00 0.00 C ATOM 94 O LEU A 10 5.506 13.827 -3.517 1.00 0.00 O ATOM 95 CB LEU A 10 8.040 12.445 -5.204 1.00 0.00 C ATOM 96 CG LEU A 10 9.099 12.736 -6.268 1.00 0.00 C ATOM 97 CD1 LEU A 10 9.412 11.481 -7.068 1.00 0.00 C ATOM 98 CD2 LEU A 10 8.635 13.856 -7.189 1.00 0.00 C ATOM 0 H LEU A 10 9.465 12.851 -3.116 1.00 0.00 H new ATOM 0 HA LEU A 10 7.622 14.491 -4.700 1.00 0.00 H new ATOM 0 HB2 LEU A 10 8.329 11.539 -4.671 1.00 0.00 H new ATOM 0 HB3 LEU A 10 7.097 12.232 -5.708 1.00 0.00 H new ATOM 0 HG LEU A 10 10.011 13.059 -5.766 1.00 0.00 H new ATOM 0 HD11 LEU A 10 10.168 11.708 -7.820 1.00 0.00 H new ATOM 0 HD12 LEU A 10 9.787 10.707 -6.399 1.00 0.00 H new ATOM 0 HD13 LEU A 10 8.506 11.127 -7.559 1.00 0.00 H new ATOM 0 HD21 LEU A 10 9.401 14.050 -7.940 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.709 13.561 -7.683 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.463 14.760 -6.605 1.00 0.00 H new ATOM 110 N GLY A 11 6.709 12.268 -2.430 1.00 0.00 N ATOM 111 CA GLY A 11 5.600 11.879 -1.579 1.00 0.00 C ATOM 112 C GLY A 11 5.736 10.461 -1.061 1.00 0.00 C ATOM 113 O GLY A 11 6.522 9.674 -1.587 1.00 0.00 O ATOM 0 H GLY A 11 7.575 11.755 -2.266 1.00 0.00 H new ATOM 0 HA2 GLY A 11 5.535 12.566 -0.735 1.00 0.00 H new ATOM 0 HA3 GLY A 11 4.668 11.971 -2.137 1.00 0.00 H new ATOM 117 N GLN A 12 4.969 10.135 -0.025 1.00 0.00 N ATOM 118 CA GLN A 12 5.009 8.803 0.566 1.00 0.00 C ATOM 119 C GLN A 12 3.617 8.182 0.605 1.00 0.00 C ATOM 120 O GLN A 12 2.615 8.869 0.404 1.00 0.00 O ATOM 121 CB GLN A 12 5.592 8.866 1.978 1.00 0.00 C ATOM 122 CG GLN A 12 7.099 9.065 2.006 1.00 0.00 C ATOM 123 CD GLN A 12 7.575 9.747 3.274 1.00 0.00 C ATOM 124 OE1 GLN A 12 7.874 10.942 3.275 1.00 0.00 O ATOM 125 NE2 GLN A 12 7.647 8.990 4.363 1.00 0.00 N ATOM 0 H GLN A 12 4.313 10.775 0.422 1.00 0.00 H new ATOM 0 HA GLN A 12 5.648 8.177 -0.056 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.116 9.682 2.522 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.346 7.944 2.505 1.00 0.00 H new ATOM 0 HG2 GLN A 12 7.591 8.097 1.912 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.399 9.660 1.143 1.00 0.00 H new ATOM 0 HE21 GLN A 12 7.389 8.004 4.317 1.00 0.00 H new ATOM 0 HE22 GLN A 12 7.960 9.395 5.246 1.00 0.00 H new ATOM 134 N ILE A 13 3.562 6.880 0.864 1.00 0.00 N ATOM 135 CA ILE A 13 2.293 6.167 0.930 1.00 0.00 C ATOM 136 C ILE A 13 2.431 4.870 1.720 1.00 0.00 C ATOM 137 O ILE A 13 3.319 4.062 1.453 1.00 0.00 O ATOM 138 CB ILE A 13 1.755 5.844 -0.477 1.00 0.00 C ATOM 139 CG1 ILE A 13 0.340 5.269 -0.386 1.00 0.00 C ATOM 140 CG2 ILE A 13 2.683 4.869 -1.187 1.00 0.00 C ATOM 141 CD1 ILE A 13 -0.417 5.317 -1.695 1.00 0.00 C ATOM 0 H ILE A 13 4.382 6.297 1.032 1.00 0.00 H new ATOM 0 HA ILE A 13 1.588 6.825 1.438 1.00 0.00 H new ATOM 0 HB ILE A 13 1.716 6.767 -1.056 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.398 4.235 -0.047 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.220 5.821 0.369 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.290 4.650 -2.180 1.00 0.00 H new ATOM 0 HG22 ILE A 13 3.675 5.312 -1.279 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.750 3.946 -0.612 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.412 4.893 -1.556 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.507 6.352 -2.026 1.00 0.00 H new ATOM 0 HD13 ILE A 13 0.121 4.741 -2.448 1.00 0.00 H new ATOM 153 N GLN A 14 1.544 4.678 2.691 1.00 0.00 N ATOM 154 CA GLN A 14 1.566 3.478 3.519 1.00 0.00 C ATOM 155 C GLN A 14 0.489 2.493 3.079 1.00 0.00 C ATOM 156 O GLN A 14 -0.696 2.828 3.041 1.00 0.00 O ATOM 157 CB GLN A 14 1.368 3.845 4.991 1.00 0.00 C ATOM 158 CG GLN A 14 1.764 2.736 5.953 1.00 0.00 C ATOM 159 CD GLN A 14 1.984 3.240 7.365 1.00 0.00 C ATOM 160 OE1 GLN A 14 1.162 3.978 7.909 1.00 0.00 O ATOM 161 NE2 GLN A 14 3.099 2.844 7.969 1.00 0.00 N ATOM 0 H GLN A 14 0.802 5.338 2.924 1.00 0.00 H new ATOM 0 HA GLN A 14 2.539 3.002 3.398 1.00 0.00 H new ATOM 0 HB2 GLN A 14 1.953 4.736 5.217 1.00 0.00 H new ATOM 0 HB3 GLN A 14 0.321 4.101 5.155 1.00 0.00 H new ATOM 0 HG2 GLN A 14 0.986 1.972 5.961 1.00 0.00 H new ATOM 0 HG3 GLN A 14 2.676 2.258 5.595 1.00 0.00 H new ATOM 0 HE21 GLN A 14 3.753 2.232 7.482 1.00 0.00 H new ATOM 0 HE22 GLN A 14 3.301 3.152 8.920 1.00 0.00 H new ATOM 170 N LEU A 15 0.907 1.276 2.747 1.00 0.00 N ATOM 171 CA LEU A 15 -0.023 0.241 2.309 1.00 0.00 C ATOM 172 C LEU A 15 0.303 -1.097 2.965 1.00 0.00 C ATOM 173 O LEU A 15 1.470 -1.463 3.108 1.00 0.00 O ATOM 174 CB LEU A 15 0.022 0.099 0.786 1.00 0.00 C ATOM 175 CG LEU A 15 -0.002 1.404 -0.010 1.00 0.00 C ATOM 176 CD1 LEU A 15 0.624 1.204 -1.382 1.00 0.00 C ATOM 177 CD2 LEU A 15 -1.427 1.922 -0.143 1.00 0.00 C ATOM 0 H LEU A 15 1.883 0.982 2.773 1.00 0.00 H new ATOM 0 HA LEU A 15 -1.027 0.538 2.611 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.925 -0.450 0.519 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.826 -0.510 0.473 1.00 0.00 H new ATOM 0 HG LEU A 15 0.585 2.147 0.530 1.00 0.00 H new ATOM 0 HD11 LEU A 15 0.598 2.143 -1.934 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.658 0.880 -1.266 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.065 0.445 -1.930 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.425 2.851 -0.712 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.037 1.181 -0.660 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -1.842 2.105 0.848 1.00 0.00 H new ATOM 189 N THR A 16 -0.737 -1.824 3.363 1.00 0.00 N ATOM 190 CA THR A 16 -0.562 -3.121 4.003 1.00 0.00 C ATOM 191 C THR A 16 -0.874 -4.258 3.036 1.00 0.00 C ATOM 192 O THR A 16 -2.038 -4.535 2.745 1.00 0.00 O ATOM 193 CB THR A 16 -1.459 -3.260 5.247 1.00 0.00 C ATOM 194 OG1 THR A 16 -1.167 -2.213 6.180 1.00 0.00 O ATOM 195 CG2 THR A 16 -1.256 -4.612 5.913 1.00 0.00 C ATOM 0 H THR A 16 -1.709 -1.536 3.253 1.00 0.00 H new ATOM 0 HA THR A 16 0.482 -3.184 4.309 1.00 0.00 H new ATOM 0 HB THR A 16 -2.499 -3.183 4.929 1.00 0.00 H new ATOM 0 HG1 THR A 16 -0.410 -2.478 6.743 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.900 -4.686 6.789 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.507 -5.406 5.209 1.00 0.00 H new ATOM 0 HG23 THR A 16 -0.215 -4.714 6.219 1.00 0.00 H new ATOM 203 N ILE A 17 0.172 -4.913 2.543 1.00 0.00 N ATOM 204 CA ILE A 17 0.008 -6.021 1.610 1.00 0.00 C ATOM 205 C ILE A 17 0.107 -7.363 2.328 1.00 0.00 C ATOM 206 O ILE A 17 1.151 -7.706 2.882 1.00 0.00 O ATOM 207 CB ILE A 17 1.061 -5.973 0.488 1.00 0.00 C ATOM 208 CG1 ILE A 17 1.100 -4.581 -0.146 1.00 0.00 C ATOM 209 CG2 ILE A 17 0.764 -7.032 -0.564 1.00 0.00 C ATOM 210 CD1 ILE A 17 2.356 -4.315 -0.945 1.00 0.00 C ATOM 0 H ILE A 17 1.141 -4.696 2.774 1.00 0.00 H new ATOM 0 HA ILE A 17 -0.984 -5.919 1.170 1.00 0.00 H new ATOM 0 HB ILE A 17 2.040 -6.183 0.920 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.234 -4.463 -0.797 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.013 -3.830 0.640 1.00 0.00 H new ATOM 0 HG21 ILE A 17 1.517 -6.985 -1.350 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.783 -8.019 -0.102 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -0.221 -6.851 -0.994 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.314 -3.310 -1.365 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.226 -4.400 -0.294 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.434 -5.043 -1.753 1.00 0.00 H new ATOM 222 N ARG A 18 -0.987 -8.118 2.312 1.00 0.00 N ATOM 223 CA ARG A 18 -1.023 -9.424 2.961 1.00 0.00 C ATOM 224 C ARG A 18 -1.945 -10.379 2.210 1.00 0.00 C ATOM 225 O ARG A 18 -3.169 -10.255 2.272 1.00 0.00 O ATOM 226 CB ARG A 18 -1.489 -9.283 4.411 1.00 0.00 C ATOM 227 CG ARG A 18 -1.579 -10.607 5.153 1.00 0.00 C ATOM 228 CD ARG A 18 -2.476 -10.500 6.376 1.00 0.00 C ATOM 229 NE ARG A 18 -2.374 -11.677 7.235 1.00 0.00 N ATOM 230 CZ ARG A 18 -2.842 -11.724 8.477 1.00 0.00 C ATOM 231 NH1 ARG A 18 -3.442 -10.665 9.003 1.00 0.00 N ATOM 232 NH2 ARG A 18 -2.711 -12.832 9.195 1.00 0.00 N ATOM 0 H ARG A 18 -1.859 -7.848 1.857 1.00 0.00 H new ATOM 0 HA ARG A 18 -0.014 -9.836 2.949 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -0.802 -8.624 4.942 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -2.467 -8.801 4.424 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -1.965 -11.375 4.483 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -0.581 -10.923 5.459 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -2.207 -9.611 6.946 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -3.510 -10.373 6.057 1.00 0.00 H new ATOM 0 HE ARG A 18 -1.918 -12.509 6.860 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -3.545 -9.812 8.454 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -3.801 -10.704 9.957 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -2.251 -13.649 8.793 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -3.071 -12.867 10.149 1.00 0.00 H new ATOM 246 N HIS A 19 -1.351 -11.332 1.499 1.00 0.00 N ATOM 247 CA HIS A 19 -2.119 -12.308 0.735 1.00 0.00 C ATOM 248 C HIS A 19 -2.257 -13.616 1.509 1.00 0.00 C ATOM 249 O HIS A 19 -1.265 -14.283 1.801 1.00 0.00 O ATOM 250 CB HIS A 19 -1.452 -12.569 -0.616 1.00 0.00 C ATOM 251 CG HIS A 19 -2.013 -13.753 -1.342 1.00 0.00 C ATOM 252 ND1 HIS A 19 -1.705 -15.056 -1.009 1.00 0.00 N ATOM 253 CD2 HIS A 19 -2.869 -13.826 -2.388 1.00 0.00 C ATOM 254 CE1 HIS A 19 -2.346 -15.878 -1.820 1.00 0.00 C ATOM 255 NE2 HIS A 19 -3.059 -15.158 -2.666 1.00 0.00 N ATOM 0 H HIS A 19 -0.340 -11.449 1.436 1.00 0.00 H new ATOM 0 HA HIS A 19 -3.115 -11.899 0.566 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -1.561 -11.684 -1.243 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -0.384 -12.721 -0.461 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -3.319 -12.993 -2.907 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -2.295 -16.957 -1.795 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -3.654 -15.530 -3.406 1.00 0.00 H new ATOM 263 N SER A 20 -3.494 -13.975 1.839 1.00 0.00 N ATOM 264 CA SER A 20 -3.761 -15.200 2.582 1.00 0.00 C ATOM 265 C SER A 20 -3.821 -16.403 1.645 1.00 0.00 C ATOM 266 O SER A 20 -4.580 -16.412 0.676 1.00 0.00 O ATOM 267 CB SER A 20 -5.075 -15.076 3.355 1.00 0.00 C ATOM 268 OG SER A 20 -5.142 -16.027 4.405 1.00 0.00 O ATOM 0 H SER A 20 -4.326 -13.435 1.603 1.00 0.00 H new ATOM 0 HA SER A 20 -2.945 -15.352 3.288 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.166 -14.070 3.765 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.915 -15.220 2.676 1.00 0.00 H new ATOM 0 HG SER A 20 -5.991 -15.926 4.885 1.00 0.00 H new ATOM 274 N SER A 21 -3.014 -17.417 1.942 1.00 0.00 N ATOM 275 CA SER A 21 -2.971 -18.624 1.125 1.00 0.00 C ATOM 276 C SER A 21 -4.292 -19.384 1.208 1.00 0.00 C ATOM 277 O SER A 21 -4.907 -19.693 0.188 1.00 0.00 O ATOM 278 CB SER A 21 -1.821 -19.527 1.572 1.00 0.00 C ATOM 279 OG SER A 21 -1.728 -20.679 0.752 1.00 0.00 O ATOM 0 H SER A 21 -2.381 -17.426 2.742 1.00 0.00 H new ATOM 0 HA SER A 21 -2.808 -18.326 0.089 1.00 0.00 H new ATOM 0 HB2 SER A 21 -0.883 -18.973 1.533 1.00 0.00 H new ATOM 0 HB3 SER A 21 -1.972 -19.826 2.609 1.00 0.00 H new ATOM 0 HG SER A 21 -0.984 -21.239 1.058 1.00 0.00 H new ATOM 285 N GLN A 22 -4.719 -19.681 2.431 1.00 0.00 N ATOM 286 CA GLN A 22 -5.966 -20.405 2.648 1.00 0.00 C ATOM 287 C GLN A 22 -7.111 -19.765 1.870 1.00 0.00 C ATOM 288 O GLN A 22 -7.832 -20.443 1.138 1.00 0.00 O ATOM 289 CB GLN A 22 -6.306 -20.443 4.139 1.00 0.00 C ATOM 290 CG GLN A 22 -7.128 -21.655 4.546 1.00 0.00 C ATOM 291 CD GLN A 22 -7.609 -21.579 5.981 1.00 0.00 C ATOM 292 OE1 GLN A 22 -6.899 -21.969 6.908 1.00 0.00 O ATOM 293 NE2 GLN A 22 -8.822 -21.074 6.174 1.00 0.00 N ATOM 0 H GLN A 22 -4.221 -19.432 3.285 1.00 0.00 H new ATOM 0 HA GLN A 22 -5.831 -21.425 2.287 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -5.380 -20.433 4.714 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -6.854 -19.538 4.401 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -7.988 -21.745 3.883 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -6.529 -22.556 4.415 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -9.377 -20.762 5.377 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -9.198 -20.998 7.119 1.00 0.00 H new ATOM 302 N ARG A 23 -7.271 -18.456 2.033 1.00 0.00 N ATOM 303 CA ARG A 23 -8.329 -17.724 1.347 1.00 0.00 C ATOM 304 C ARG A 23 -7.911 -17.373 -0.078 1.00 0.00 C ATOM 305 O ARG A 23 -8.753 -17.118 -0.938 1.00 0.00 O ATOM 306 CB ARG A 23 -8.679 -16.449 2.116 1.00 0.00 C ATOM 307 CG ARG A 23 -9.611 -16.685 3.293 1.00 0.00 C ATOM 308 CD ARG A 23 -10.413 -15.436 3.627 1.00 0.00 C ATOM 309 NE ARG A 23 -9.556 -14.336 4.062 1.00 0.00 N ATOM 310 CZ ARG A 23 -10.002 -13.108 4.301 1.00 0.00 C ATOM 311 NH1 ARG A 23 -11.288 -12.824 4.148 1.00 0.00 N ATOM 312 NH2 ARG A 23 -9.160 -12.160 4.694 1.00 0.00 N ATOM 0 H ARG A 23 -6.681 -17.880 2.634 1.00 0.00 H new ATOM 0 HA ARG A 23 -9.209 -18.365 1.302 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -7.759 -15.989 2.478 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -9.143 -15.738 1.432 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -10.291 -17.505 3.061 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -9.030 -16.989 4.164 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -10.984 -15.127 2.751 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -11.133 -15.667 4.412 1.00 0.00 H new ATOM 0 HE ARG A 23 -8.561 -14.521 4.189 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -11.938 -13.550 3.846 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -11.627 -11.880 4.332 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -8.170 -12.374 4.813 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -9.503 -11.217 4.877 1.00 0.00 H new ATOM 326 N ASN A 24 -6.604 -17.361 -0.320 1.00 0.00 N ATOM 327 CA ASN A 24 -6.074 -17.039 -1.640 1.00 0.00 C ATOM 328 C ASN A 24 -6.601 -15.692 -2.125 1.00 0.00 C ATOM 329 O ASN A 24 -7.163 -15.589 -3.216 1.00 0.00 O ATOM 330 CB ASN A 24 -6.444 -18.135 -2.642 1.00 0.00 C ATOM 331 CG ASN A 24 -6.476 -19.512 -2.007 1.00 0.00 C ATOM 332 OD1 ASN A 24 -7.446 -19.880 -1.344 1.00 0.00 O ATOM 333 ND2 ASN A 24 -5.412 -20.281 -2.207 1.00 0.00 N ATOM 0 H ASN A 24 -5.893 -17.570 0.380 1.00 0.00 H new ATOM 0 HA ASN A 24 -4.988 -16.977 -1.563 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -7.420 -17.914 -3.074 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -5.725 -18.132 -3.461 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -5.377 -21.217 -1.804 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -4.630 -19.935 -2.763 1.00 0.00 H new ATOM 340 N LYS A 25 -6.416 -14.662 -1.307 1.00 0.00 N ATOM 341 CA LYS A 25 -6.871 -13.320 -1.652 1.00 0.00 C ATOM 342 C LYS A 25 -5.800 -12.283 -1.328 1.00 0.00 C ATOM 343 O LYS A 25 -4.973 -12.486 -0.438 1.00 0.00 O ATOM 344 CB LYS A 25 -8.162 -12.988 -0.900 1.00 0.00 C ATOM 345 CG LYS A 25 -9.368 -13.770 -1.388 1.00 0.00 C ATOM 346 CD LYS A 25 -10.655 -12.983 -1.205 1.00 0.00 C ATOM 347 CE LYS A 25 -11.858 -13.904 -1.068 1.00 0.00 C ATOM 348 NZ LYS A 25 -13.084 -13.159 -0.671 1.00 0.00 N ATOM 0 H LYS A 25 -5.954 -14.730 -0.400 1.00 0.00 H new ATOM 0 HA LYS A 25 -7.065 -13.293 -2.724 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.016 -13.187 0.162 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.366 -11.922 -0.999 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.239 -14.019 -2.441 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.436 -14.712 -0.844 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.575 -12.354 -0.319 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.800 -12.318 -2.056 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.034 -14.415 -2.015 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.644 -14.673 -0.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.881 -13.822 -0.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.925 -12.692 0.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.303 -12.442 -1.392 1.00 0.00 H new ATOM 362 N LEU A 26 -5.822 -11.171 -2.054 1.00 0.00 N ATOM 363 CA LEU A 26 -4.853 -10.100 -1.843 1.00 0.00 C ATOM 364 C LEU A 26 -5.526 -8.866 -1.250 1.00 0.00 C ATOM 365 O LEU A 26 -6.242 -8.144 -1.945 1.00 0.00 O ATOM 366 CB LEU A 26 -4.168 -9.737 -3.162 1.00 0.00 C ATOM 367 CG LEU A 26 -3.080 -8.666 -3.081 1.00 0.00 C ATOM 368 CD1 LEU A 26 -1.777 -9.267 -2.575 1.00 0.00 C ATOM 369 CD2 LEU A 26 -2.876 -8.010 -4.438 1.00 0.00 C ATOM 0 H LEU A 26 -6.500 -10.987 -2.794 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.103 -10.457 -1.137 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.728 -10.642 -3.581 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -4.931 -9.399 -3.863 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.401 -7.900 -2.375 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.014 -8.490 -2.524 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.932 -9.689 -1.582 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.450 -10.053 -3.256 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.098 -7.250 -4.362 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.576 -8.764 -5.165 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.807 -7.544 -4.761 1.00 0.00 H new ATOM 381 N ILE A 27 -5.290 -8.630 0.036 1.00 0.00 N ATOM 382 CA ILE A 27 -5.871 -7.482 0.720 1.00 0.00 C ATOM 383 C ILE A 27 -4.885 -6.320 0.777 1.00 0.00 C ATOM 384 O ILE A 27 -3.729 -6.490 1.166 1.00 0.00 O ATOM 385 CB ILE A 27 -6.306 -7.842 2.153 1.00 0.00 C ATOM 386 CG1 ILE A 27 -7.370 -8.941 2.125 1.00 0.00 C ATOM 387 CG2 ILE A 27 -6.831 -6.608 2.873 1.00 0.00 C ATOM 388 CD1 ILE A 27 -6.793 -10.339 2.073 1.00 0.00 C ATOM 0 H ILE A 27 -4.701 -9.218 0.625 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.749 -7.183 0.147 1.00 0.00 H new ATOM 0 HB ILE A 27 -5.439 -8.215 2.697 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -7.999 -8.849 3.010 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -8.014 -8.790 1.259 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -7.134 -6.878 3.884 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -6.047 -5.853 2.919 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -7.688 -6.208 2.332 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -7.604 -11.067 2.055 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -6.187 -10.449 1.174 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -6.172 -10.509 2.952 1.00 0.00 H new ATOM 400 N VAL A 28 -5.351 -5.136 0.389 1.00 0.00 N ATOM 401 CA VAL A 28 -4.511 -3.944 0.399 1.00 0.00 C ATOM 402 C VAL A 28 -5.229 -2.772 1.058 1.00 0.00 C ATOM 403 O VAL A 28 -6.254 -2.301 0.566 1.00 0.00 O ATOM 404 CB VAL A 28 -4.095 -3.540 -1.028 1.00 0.00 C ATOM 405 CG1 VAL A 28 -3.097 -2.392 -0.988 1.00 0.00 C ATOM 406 CG2 VAL A 28 -3.516 -4.734 -1.772 1.00 0.00 C ATOM 0 H VAL A 28 -6.305 -4.977 0.064 1.00 0.00 H new ATOM 0 HA VAL A 28 -3.618 -4.190 0.974 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.981 -3.201 -1.564 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.814 -2.120 -2.005 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -3.551 -1.532 -0.495 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.210 -2.700 -0.435 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.227 -4.431 -2.778 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.640 -5.105 -1.240 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.265 -5.524 -1.832 1.00 0.00 H new ATOM 416 N VAL A 29 -4.684 -2.305 2.177 1.00 0.00 N ATOM 417 CA VAL A 29 -5.271 -1.186 2.904 1.00 0.00 C ATOM 418 C VAL A 29 -4.505 0.105 2.637 1.00 0.00 C ATOM 419 O VAL A 29 -3.278 0.143 2.730 1.00 0.00 O ATOM 420 CB VAL A 29 -5.293 -1.452 4.421 1.00 0.00 C ATOM 421 CG1 VAL A 29 -6.089 -0.374 5.141 1.00 0.00 C ATOM 422 CG2 VAL A 29 -5.864 -2.832 4.711 1.00 0.00 C ATOM 0 H VAL A 29 -3.837 -2.684 2.600 1.00 0.00 H new ATOM 0 HA VAL A 29 -6.295 -1.078 2.546 1.00 0.00 H new ATOM 0 HB VAL A 29 -4.269 -1.422 4.793 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.093 -0.579 6.212 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.631 0.599 4.959 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -7.113 -0.368 4.769 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -5.872 -3.004 5.787 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -6.882 -2.893 4.326 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -5.247 -3.590 4.228 1.00 0.00 H new ATOM 432 N VAL A 30 -5.239 1.163 2.305 1.00 0.00 N ATOM 433 CA VAL A 30 -4.629 2.458 2.026 1.00 0.00 C ATOM 434 C VAL A 30 -4.863 3.435 3.173 1.00 0.00 C ATOM 435 O VAL A 30 -5.724 4.312 3.091 1.00 0.00 O ATOM 436 CB VAL A 30 -5.183 3.070 0.725 1.00 0.00 C ATOM 437 CG1 VAL A 30 -4.388 4.308 0.337 1.00 0.00 C ATOM 438 CG2 VAL A 30 -5.165 2.042 -0.396 1.00 0.00 C ATOM 0 H VAL A 30 -6.256 1.149 2.223 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.559 2.286 1.912 1.00 0.00 H new ATOM 0 HB VAL A 30 -6.217 3.370 0.896 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -4.793 4.727 -0.584 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.457 5.049 1.134 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.344 4.036 0.183 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.560 2.491 -1.308 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -4.141 1.710 -0.569 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.781 1.188 -0.116 1.00 0.00 H new ATOM 448 N HIS A 31 -4.091 3.277 4.244 1.00 0.00 N ATOM 449 CA HIS A 31 -4.214 4.146 5.409 1.00 0.00 C ATOM 450 C HIS A 31 -4.415 5.598 4.985 1.00 0.00 C ATOM 451 O HIS A 31 -5.518 6.135 5.079 1.00 0.00 O ATOM 452 CB HIS A 31 -2.971 4.028 6.292 1.00 0.00 C ATOM 453 CG HIS A 31 -2.784 2.664 6.882 1.00 0.00 C ATOM 454 ND1 HIS A 31 -3.550 2.183 7.923 1.00 0.00 N ATOM 455 CD2 HIS A 31 -1.911 1.677 6.571 1.00 0.00 C ATOM 456 CE1 HIS A 31 -3.155 0.959 8.227 1.00 0.00 C ATOM 457 NE2 HIS A 31 -2.163 0.628 7.421 1.00 0.00 N ATOM 0 H HIS A 31 -3.374 2.556 4.329 1.00 0.00 H new ATOM 0 HA HIS A 31 -5.087 3.828 5.979 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -2.091 4.284 5.702 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -3.038 4.758 7.099 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -1.157 1.709 5.798 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -3.573 0.335 9.003 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -1.665 -0.262 7.428 1.00 0.00 H new ATOM 465 N ALA A 32 -3.341 6.228 4.519 1.00 0.00 N ATOM 466 CA ALA A 32 -3.400 7.616 4.080 1.00 0.00 C ATOM 467 C ALA A 32 -2.071 8.059 3.479 1.00 0.00 C ATOM 468 O ALA A 32 -1.036 7.429 3.704 1.00 0.00 O ATOM 469 CB ALA A 32 -3.784 8.521 5.241 1.00 0.00 C ATOM 0 H ALA A 32 -2.420 5.798 4.436 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.163 7.694 3.305 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.824 9.555 4.898 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.761 8.227 5.624 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -3.042 8.430 6.034 1.00 0.00 H new ATOM 475 N CYS A 33 -2.105 9.145 2.715 1.00 0.00 N ATOM 476 CA CYS A 33 -0.902 9.671 2.080 1.00 0.00 C ATOM 477 C CYS A 33 -0.446 10.958 2.760 1.00 0.00 C ATOM 478 O CYS A 33 -1.223 11.612 3.457 1.00 0.00 O ATOM 479 CB CYS A 33 -1.155 9.928 0.593 1.00 0.00 C ATOM 480 SG CYS A 33 -1.310 8.424 -0.399 1.00 0.00 S ATOM 0 H CYS A 33 -2.952 9.678 2.520 1.00 0.00 H new ATOM 0 HA CYS A 33 -0.112 8.927 2.184 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -2.066 10.516 0.487 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -0.338 10.531 0.195 1.00 0.00 H new ATOM 0 HG CYS A 33 -1.524 8.743 -1.641 1.00 0.00 H new ATOM 486 N ARG A 34 0.817 11.315 2.554 1.00 0.00 N ATOM 487 CA ARG A 34 1.377 12.522 3.150 1.00 0.00 C ATOM 488 C ARG A 34 2.526 13.063 2.305 1.00 0.00 C ATOM 489 O ARG A 34 3.100 12.345 1.488 1.00 0.00 O ATOM 490 CB ARG A 34 1.866 12.236 4.571 1.00 0.00 C ATOM 491 CG ARG A 34 2.867 11.095 4.653 1.00 0.00 C ATOM 492 CD ARG A 34 3.387 10.910 6.070 1.00 0.00 C ATOM 493 NE ARG A 34 4.557 11.743 6.336 1.00 0.00 N ATOM 494 CZ ARG A 34 5.208 11.746 7.494 1.00 0.00 C ATOM 495 NH1 ARG A 34 4.805 10.965 8.487 1.00 0.00 N ATOM 496 NH2 ARG A 34 6.265 12.531 7.660 1.00 0.00 N ATOM 0 H ARG A 34 1.472 10.786 1.979 1.00 0.00 H new ATOM 0 HA ARG A 34 0.591 13.276 3.189 1.00 0.00 H new ATOM 0 HB2 ARG A 34 2.323 13.138 4.977 1.00 0.00 H new ATOM 0 HB3 ARG A 34 1.008 12.001 5.201 1.00 0.00 H new ATOM 0 HG2 ARG A 34 2.397 10.172 4.314 1.00 0.00 H new ATOM 0 HG3 ARG A 34 3.702 11.293 3.981 1.00 0.00 H new ATOM 0 HD2 ARG A 34 2.598 11.155 6.781 1.00 0.00 H new ATOM 0 HD3 ARG A 34 3.644 9.863 6.228 1.00 0.00 H new ATOM 0 HE ARG A 34 4.892 12.355 5.592 1.00 0.00 H new ATOM 0 HH11 ARG A 34 3.993 10.360 8.363 1.00 0.00 H new ATOM 0 HH12 ARG A 34 5.307 10.969 9.375 1.00 0.00 H new ATOM 0 HH21 ARG A 34 6.578 13.133 6.898 1.00 0.00 H new ATOM 0 HH22 ARG A 34 6.764 12.533 8.549 1.00 0.00 H new ATOM 510 N ASN A 35 2.855 14.335 2.508 1.00 0.00 N ATOM 511 CA ASN A 35 3.935 14.973 1.763 1.00 0.00 C ATOM 512 C ASN A 35 3.680 14.895 0.261 1.00 0.00 C ATOM 513 O ASN A 35 4.581 14.576 -0.517 1.00 0.00 O ATOM 514 CB ASN A 35 5.274 14.313 2.100 1.00 0.00 C ATOM 515 CG ASN A 35 5.844 14.800 3.418 1.00 0.00 C ATOM 516 OD1 ASN A 35 5.921 16.003 3.666 1.00 0.00 O ATOM 517 ND2 ASN A 35 6.246 13.864 4.270 1.00 0.00 N ATOM 0 H ASN A 35 2.390 14.944 3.181 1.00 0.00 H new ATOM 0 HA ASN A 35 3.972 16.023 2.053 1.00 0.00 H new ATOM 0 HB2 ASN A 35 5.143 13.232 2.142 1.00 0.00 H new ATOM 0 HB3 ASN A 35 5.987 14.517 1.301 1.00 0.00 H new ATOM 0 HD21 ASN A 35 6.638 14.131 5.173 1.00 0.00 H new ATOM 0 HD22 ASN A 35 6.163 12.878 4.021 1.00 0.00 H new ATOM 524 N LEU A 36 2.449 15.189 -0.140 1.00 0.00 N ATOM 525 CA LEU A 36 2.074 15.154 -1.550 1.00 0.00 C ATOM 526 C LEU A 36 2.101 16.553 -2.156 1.00 0.00 C ATOM 527 O LEU A 36 1.083 17.244 -2.192 1.00 0.00 O ATOM 528 CB LEU A 36 0.682 14.542 -1.713 1.00 0.00 C ATOM 529 CG LEU A 36 0.534 13.083 -1.277 1.00 0.00 C ATOM 530 CD1 LEU A 36 -0.934 12.691 -1.213 1.00 0.00 C ATOM 531 CD2 LEU A 36 1.293 12.165 -2.223 1.00 0.00 C ATOM 0 H LEU A 36 1.693 15.454 0.491 1.00 0.00 H new ATOM 0 HA LEU A 36 2.800 14.536 -2.078 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -0.026 15.144 -1.144 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.394 14.618 -2.762 1.00 0.00 H new ATOM 0 HG LEU A 36 0.960 12.976 -0.279 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.019 11.650 -0.901 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.450 13.328 -0.495 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.386 12.813 -2.197 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.177 11.131 -1.898 1.00 0.00 H new ATOM 0 HD22 LEU A 36 0.897 12.275 -3.232 1.00 0.00 H new ATOM 0 HD23 LEU A 36 2.350 12.430 -2.217 1.00 0.00 H new ATOM 543 N ILE A 37 3.272 16.963 -2.633 1.00 0.00 N ATOM 544 CA ILE A 37 3.430 18.278 -3.240 1.00 0.00 C ATOM 545 C ILE A 37 2.332 18.547 -4.264 1.00 0.00 C ATOM 546 O ILE A 37 2.037 17.702 -5.108 1.00 0.00 O ATOM 547 CB ILE A 37 4.802 18.421 -3.926 1.00 0.00 C ATOM 548 CG1 ILE A 37 4.890 17.488 -5.136 1.00 0.00 C ATOM 549 CG2 ILE A 37 5.921 18.124 -2.939 1.00 0.00 C ATOM 550 CD1 ILE A 37 4.396 18.115 -6.420 1.00 0.00 C ATOM 0 H ILE A 37 4.124 16.403 -2.611 1.00 0.00 H new ATOM 0 HA ILE A 37 3.358 19.008 -2.434 1.00 0.00 H new ATOM 0 HB ILE A 37 4.914 19.448 -4.273 1.00 0.00 H new ATOM 0 HG12 ILE A 37 5.926 17.176 -5.269 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.309 16.588 -4.934 1.00 0.00 H new ATOM 0 HG21 ILE A 37 6.884 18.229 -3.438 1.00 0.00 H new ATOM 0 HG22 ILE A 37 5.866 18.824 -2.105 1.00 0.00 H new ATOM 0 HG23 ILE A 37 5.816 17.106 -2.565 1.00 0.00 H new ATOM 0 HD11 ILE A 37 4.488 17.397 -7.235 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.351 18.402 -6.306 1.00 0.00 H new ATOM 0 HD13 ILE A 37 4.993 18.999 -6.646 1.00 0.00 H new ATOM 562 N ALA A 38 1.732 19.730 -4.183 1.00 0.00 N ATOM 563 CA ALA A 38 0.670 20.112 -5.105 1.00 0.00 C ATOM 564 C ALA A 38 1.226 20.890 -6.293 1.00 0.00 C ATOM 565 O ALA A 38 2.013 21.822 -6.124 1.00 0.00 O ATOM 566 CB ALA A 38 -0.386 20.934 -4.381 1.00 0.00 C ATOM 0 H ALA A 38 1.963 20.440 -3.488 1.00 0.00 H new ATOM 0 HA ALA A 38 0.209 19.201 -5.486 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -1.173 21.213 -5.081 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -0.814 20.344 -3.570 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.071 21.835 -3.972 1.00 0.00 H new ATOM 572 N PHE A 39 0.814 20.500 -7.495 1.00 0.00 N ATOM 573 CA PHE A 39 1.273 21.160 -8.711 1.00 0.00 C ATOM 574 C PHE A 39 1.011 22.662 -8.647 1.00 0.00 C ATOM 575 O PHE A 39 1.666 23.447 -9.333 1.00 0.00 O ATOM 576 CB PHE A 39 0.577 20.561 -9.935 1.00 0.00 C ATOM 577 CG PHE A 39 1.405 20.627 -11.187 1.00 0.00 C ATOM 578 CD1 PHE A 39 1.490 21.803 -11.916 1.00 0.00 C ATOM 579 CD2 PHE A 39 2.098 19.514 -11.635 1.00 0.00 C ATOM 580 CE1 PHE A 39 2.250 21.866 -13.069 1.00 0.00 C ATOM 581 CE2 PHE A 39 2.860 19.572 -12.787 1.00 0.00 C ATOM 582 CZ PHE A 39 2.937 20.749 -13.504 1.00 0.00 C ATOM 0 H PHE A 39 0.163 19.730 -7.653 1.00 0.00 H new ATOM 0 HA PHE A 39 2.348 21.000 -8.798 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.328 19.520 -9.728 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.363 21.087 -10.102 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.957 22.680 -11.579 1.00 0.00 H new ATOM 0 HD2 PHE A 39 2.042 18.591 -11.078 1.00 0.00 H new ATOM 0 HE1 PHE A 39 2.307 22.788 -13.629 1.00 0.00 H new ATOM 0 HE2 PHE A 39 3.395 18.697 -13.126 1.00 0.00 H new ATOM 0 HZ PHE A 39 3.533 20.797 -14.403 1.00 0.00 H new ATOM 592 N SER A 40 0.048 23.054 -7.819 1.00 0.00 N ATOM 593 CA SER A 40 -0.305 24.461 -7.668 1.00 0.00 C ATOM 594 C SER A 40 -0.774 24.754 -6.246 1.00 0.00 C ATOM 595 O SER A 40 -1.776 24.206 -5.788 1.00 0.00 O ATOM 596 CB SER A 40 -1.398 24.844 -8.667 1.00 0.00 C ATOM 597 OG SER A 40 -1.517 26.252 -8.777 1.00 0.00 O ATOM 0 H SER A 40 -0.502 22.417 -7.242 1.00 0.00 H new ATOM 0 HA SER A 40 0.585 25.057 -7.868 1.00 0.00 H new ATOM 0 HB2 SER A 40 -1.168 24.418 -9.644 1.00 0.00 H new ATOM 0 HB3 SER A 40 -2.350 24.419 -8.350 1.00 0.00 H new ATOM 0 HG SER A 40 -2.221 26.471 -9.423 1.00 0.00 H new ATOM 603 N GLU A 41 -0.041 25.621 -5.555 1.00 0.00 N ATOM 604 CA GLU A 41 -0.381 25.986 -4.185 1.00 0.00 C ATOM 605 C GLU A 41 -1.894 26.072 -4.004 1.00 0.00 C ATOM 606 O GLU A 41 -2.444 25.560 -3.029 1.00 0.00 O ATOM 607 CB GLU A 41 0.265 27.323 -3.814 1.00 0.00 C ATOM 608 CG GLU A 41 1.781 27.315 -3.915 1.00 0.00 C ATOM 609 CD GLU A 41 2.273 27.563 -5.328 1.00 0.00 C ATOM 610 OE1 GLU A 41 1.542 28.210 -6.106 1.00 0.00 O ATOM 611 OE2 GLU A 41 3.389 27.108 -5.655 1.00 0.00 O ATOM 0 H GLU A 41 0.791 26.083 -5.921 1.00 0.00 H new ATOM 0 HA GLU A 41 0.003 25.209 -3.524 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -0.130 28.101 -4.467 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -0.022 27.585 -2.796 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.190 28.078 -3.253 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.160 26.354 -3.566 1.00 0.00 H new ATOM 618 N ASP A 42 -2.560 26.723 -4.951 1.00 0.00 N ATOM 619 CA ASP A 42 -4.010 26.877 -4.898 1.00 0.00 C ATOM 620 C ASP A 42 -4.665 25.640 -4.293 1.00 0.00 C ATOM 621 O ASP A 42 -5.480 25.742 -3.377 1.00 0.00 O ATOM 622 CB ASP A 42 -4.568 27.131 -6.299 1.00 0.00 C ATOM 623 CG ASP A 42 -6.000 27.629 -6.270 1.00 0.00 C ATOM 624 OD1 ASP A 42 -6.207 28.825 -5.975 1.00 0.00 O ATOM 625 OD2 ASP A 42 -6.914 26.822 -6.542 1.00 0.00 O ATOM 0 H ASP A 42 -2.120 27.153 -5.765 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.238 27.734 -4.264 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -3.942 27.863 -6.809 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -4.518 26.210 -6.879 1.00 0.00 H new ATOM 630 N GLY A 43 -4.304 24.470 -4.812 1.00 0.00 N ATOM 631 CA GLY A 43 -4.868 23.230 -4.312 1.00 0.00 C ATOM 632 C GLY A 43 -5.003 22.176 -5.393 1.00 0.00 C ATOM 633 O GLY A 43 -5.423 22.475 -6.511 1.00 0.00 O ATOM 0 H GLY A 43 -3.631 24.359 -5.570 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -4.238 22.845 -3.511 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -5.848 23.429 -3.879 1.00 0.00 H new ATOM 637 N SER A 44 -4.645 20.940 -5.061 1.00 0.00 N ATOM 638 CA SER A 44 -4.723 19.839 -6.014 1.00 0.00 C ATOM 639 C SER A 44 -5.615 18.722 -5.481 1.00 0.00 C ATOM 640 O SER A 44 -5.974 18.708 -4.303 1.00 0.00 O ATOM 641 CB SER A 44 -3.325 19.294 -6.311 1.00 0.00 C ATOM 642 OG SER A 44 -2.565 20.221 -7.067 1.00 0.00 O ATOM 0 H SER A 44 -4.298 20.676 -4.139 1.00 0.00 H new ATOM 0 HA SER A 44 -5.160 20.220 -6.937 1.00 0.00 H new ATOM 0 HB2 SER A 44 -2.811 19.075 -5.375 1.00 0.00 H new ATOM 0 HB3 SER A 44 -3.406 18.354 -6.858 1.00 0.00 H new ATOM 0 HG SER A 44 -1.835 19.752 -7.522 1.00 0.00 H new ATOM 648 N ASP A 45 -5.968 17.788 -6.356 1.00 0.00 N ATOM 649 CA ASP A 45 -6.817 16.665 -5.975 1.00 0.00 C ATOM 650 C ASP A 45 -6.049 15.349 -6.059 1.00 0.00 C ATOM 651 O ASP A 45 -6.127 14.618 -7.047 1.00 0.00 O ATOM 652 CB ASP A 45 -8.054 16.605 -6.873 1.00 0.00 C ATOM 653 CG ASP A 45 -8.498 17.978 -7.339 1.00 0.00 C ATOM 654 OD1 ASP A 45 -8.591 18.891 -6.491 1.00 0.00 O ATOM 655 OD2 ASP A 45 -8.751 18.140 -8.551 1.00 0.00 O ATOM 0 H ASP A 45 -5.680 17.786 -7.334 1.00 0.00 H new ATOM 0 HA ASP A 45 -7.133 16.815 -4.943 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.839 15.982 -7.741 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -8.870 16.127 -6.331 1.00 0.00 H new ATOM 660 N PRO A 46 -5.287 15.040 -5.000 1.00 0.00 N ATOM 661 CA PRO A 46 -4.489 13.812 -4.930 1.00 0.00 C ATOM 662 C PRO A 46 -5.355 12.565 -4.794 1.00 0.00 C ATOM 663 O PRO A 46 -6.394 12.587 -4.133 1.00 0.00 O ATOM 664 CB PRO A 46 -3.640 14.013 -3.672 1.00 0.00 C ATOM 665 CG PRO A 46 -4.426 14.957 -2.830 1.00 0.00 C ATOM 666 CD PRO A 46 -5.146 15.865 -3.788 1.00 0.00 C ATOM 0 HA PRO A 46 -3.904 13.654 -5.836 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -3.470 13.069 -3.154 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -2.660 14.423 -3.917 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -5.132 14.420 -2.196 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -3.773 15.526 -2.169 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.116 16.174 -3.397 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -4.577 16.774 -3.985 1.00 0.00 H new ATOM 674 N TYR A 47 -4.922 11.478 -5.424 1.00 0.00 N ATOM 675 CA TYR A 47 -5.659 10.222 -5.375 1.00 0.00 C ATOM 676 C TYR A 47 -4.740 9.039 -5.666 1.00 0.00 C ATOM 677 O TYR A 47 -3.740 9.174 -6.370 1.00 0.00 O ATOM 678 CB TYR A 47 -6.813 10.244 -6.379 1.00 0.00 C ATOM 679 CG TYR A 47 -6.379 10.005 -7.807 1.00 0.00 C ATOM 680 CD1 TYR A 47 -6.310 8.718 -8.326 1.00 0.00 C ATOM 681 CD2 TYR A 47 -6.036 11.065 -8.637 1.00 0.00 C ATOM 682 CE1 TYR A 47 -5.912 8.494 -9.630 1.00 0.00 C ATOM 683 CE2 TYR A 47 -5.639 10.851 -9.942 1.00 0.00 C ATOM 684 CZ TYR A 47 -5.579 9.563 -10.435 1.00 0.00 C ATOM 685 OH TYR A 47 -5.182 9.346 -11.734 1.00 0.00 O ATOM 0 H TYR A 47 -4.064 11.442 -5.974 1.00 0.00 H new ATOM 0 HA TYR A 47 -6.063 10.106 -4.369 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.542 9.484 -6.098 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -7.318 11.208 -6.318 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -6.572 7.878 -7.699 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -6.081 12.074 -8.255 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -5.862 7.487 -10.017 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -5.377 11.687 -10.574 1.00 0.00 H new ATOM 0 HH TYR A 47 -4.985 10.204 -12.163 1.00 0.00 H new ATOM 695 N VAL A 48 -5.089 7.879 -5.119 1.00 0.00 N ATOM 696 CA VAL A 48 -4.298 6.671 -5.320 1.00 0.00 C ATOM 697 C VAL A 48 -4.913 5.784 -6.396 1.00 0.00 C ATOM 698 O VAL A 48 -6.110 5.865 -6.673 1.00 0.00 O ATOM 699 CB VAL A 48 -4.167 5.862 -4.016 1.00 0.00 C ATOM 700 CG1 VAL A 48 -3.357 4.596 -4.251 1.00 0.00 C ATOM 701 CG2 VAL A 48 -3.538 6.712 -2.923 1.00 0.00 C ATOM 0 H VAL A 48 -5.914 7.750 -4.533 1.00 0.00 H new ATOM 0 HA VAL A 48 -3.307 6.992 -5.641 1.00 0.00 H new ATOM 0 HB VAL A 48 -5.165 5.570 -3.689 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.275 4.038 -3.318 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.854 3.980 -5.000 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.360 4.862 -4.603 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.453 6.125 -2.009 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.547 7.036 -3.239 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.163 7.585 -2.736 1.00 0.00 H new ATOM 711 N ARG A 49 -4.087 4.936 -7.000 1.00 0.00 N ATOM 712 CA ARG A 49 -4.550 4.033 -8.047 1.00 0.00 C ATOM 713 C ARG A 49 -3.879 2.668 -7.925 1.00 0.00 C ATOM 714 O ARG A 49 -2.667 2.577 -7.731 1.00 0.00 O ATOM 715 CB ARG A 49 -4.267 4.630 -9.427 1.00 0.00 C ATOM 716 CG ARG A 49 -5.069 3.985 -10.546 1.00 0.00 C ATOM 717 CD ARG A 49 -6.480 4.547 -10.615 1.00 0.00 C ATOM 718 NE ARG A 49 -7.059 4.411 -11.949 1.00 0.00 N ATOM 719 CZ ARG A 49 -6.853 5.280 -12.932 1.00 0.00 C ATOM 720 NH1 ARG A 49 -6.086 6.343 -12.731 1.00 0.00 N ATOM 721 NH2 ARG A 49 -7.414 5.088 -14.119 1.00 0.00 N ATOM 0 H ARG A 49 -3.094 4.855 -6.782 1.00 0.00 H new ATOM 0 HA ARG A 49 -5.626 3.902 -7.928 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -4.486 5.698 -9.403 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -3.204 4.527 -9.647 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -4.564 4.149 -11.498 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -5.113 2.907 -10.389 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -7.111 4.031 -9.892 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -6.465 5.599 -10.332 1.00 0.00 H new ATOM 0 HE ARG A 49 -7.654 3.604 -12.136 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -5.653 6.494 -11.820 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -5.929 7.009 -13.487 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -8.005 4.272 -14.278 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -7.255 5.757 -14.873 1.00 0.00 H new ATOM 735 N MET A 50 -4.675 1.610 -8.038 1.00 0.00 N ATOM 736 CA MET A 50 -4.157 0.251 -7.940 1.00 0.00 C ATOM 737 C MET A 50 -4.419 -0.525 -9.228 1.00 0.00 C ATOM 738 O MET A 50 -5.491 -0.415 -9.822 1.00 0.00 O ATOM 739 CB MET A 50 -4.794 -0.477 -6.755 1.00 0.00 C ATOM 740 CG MET A 50 -4.128 -0.170 -5.424 1.00 0.00 C ATOM 741 SD MET A 50 -4.633 -1.303 -4.116 1.00 0.00 S ATOM 742 CE MET A 50 -6.201 -0.584 -3.632 1.00 0.00 C ATOM 0 H MET A 50 -5.681 1.668 -8.197 1.00 0.00 H new ATOM 0 HA MET A 50 -3.080 0.310 -7.784 1.00 0.00 H new ATOM 0 HB2 MET A 50 -5.848 -0.205 -6.696 1.00 0.00 H new ATOM 0 HB3 MET A 50 -4.752 -1.551 -6.934 1.00 0.00 H new ATOM 0 HG2 MET A 50 -3.046 -0.219 -5.544 1.00 0.00 H new ATOM 0 HG3 MET A 50 -4.370 0.851 -5.128 1.00 0.00 H new ATOM 0 HE1 MET A 50 -6.193 -0.381 -2.561 1.00 0.00 H new ATOM 0 HE2 MET A 50 -6.358 0.347 -4.177 1.00 0.00 H new ATOM 0 HE3 MET A 50 -7.007 -1.280 -3.864 1.00 0.00 H new ATOM 752 N TYR A 51 -3.433 -1.307 -9.653 1.00 0.00 N ATOM 753 CA TYR A 51 -3.556 -2.098 -10.871 1.00 0.00 C ATOM 754 C TYR A 51 -2.707 -3.362 -10.788 1.00 0.00 C ATOM 755 O TYR A 51 -1.488 -3.296 -10.622 1.00 0.00 O ATOM 756 CB TYR A 51 -3.139 -1.269 -12.087 1.00 0.00 C ATOM 757 CG TYR A 51 -4.283 -0.515 -12.727 1.00 0.00 C ATOM 758 CD1 TYR A 51 -4.729 0.690 -12.198 1.00 0.00 C ATOM 759 CD2 TYR A 51 -4.918 -1.008 -13.860 1.00 0.00 C ATOM 760 CE1 TYR A 51 -5.775 1.382 -12.779 1.00 0.00 C ATOM 761 CE2 TYR A 51 -5.963 -0.322 -14.448 1.00 0.00 C ATOM 762 CZ TYR A 51 -6.388 0.872 -13.904 1.00 0.00 C ATOM 763 OH TYR A 51 -7.429 1.558 -14.486 1.00 0.00 O ATOM 0 H TYR A 51 -2.540 -1.410 -9.172 1.00 0.00 H new ATOM 0 HA TYR A 51 -4.600 -2.390 -10.980 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -2.370 -0.558 -11.785 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -2.689 -1.929 -12.829 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -4.250 1.093 -11.318 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -4.589 -1.943 -14.288 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -6.110 2.317 -12.354 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -6.445 -0.719 -15.329 1.00 0.00 H new ATOM 0 HH TYR A 51 -7.749 1.064 -15.270 1.00 0.00 H new ATOM 773 N LEU A 52 -3.358 -4.514 -10.906 1.00 0.00 N ATOM 774 CA LEU A 52 -2.664 -5.796 -10.845 1.00 0.00 C ATOM 775 C LEU A 52 -1.983 -6.109 -12.173 1.00 0.00 C ATOM 776 O LEU A 52 -2.595 -6.678 -13.078 1.00 0.00 O ATOM 777 CB LEU A 52 -3.645 -6.913 -10.486 1.00 0.00 C ATOM 778 CG LEU A 52 -3.024 -8.267 -10.142 1.00 0.00 C ATOM 779 CD1 LEU A 52 -1.823 -8.086 -9.227 1.00 0.00 C ATOM 780 CD2 LEU A 52 -4.057 -9.178 -9.495 1.00 0.00 C ATOM 0 H LEU A 52 -4.366 -4.587 -11.045 1.00 0.00 H new ATOM 0 HA LEU A 52 -1.899 -5.731 -10.071 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -4.244 -6.584 -9.637 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -4.329 -7.052 -11.323 1.00 0.00 H new ATOM 0 HG LEU A 52 -2.684 -8.735 -11.066 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.394 -9.060 -8.993 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.075 -7.471 -9.726 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -2.138 -7.597 -8.305 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -3.598 -10.137 -9.257 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.427 -8.716 -8.580 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -4.887 -9.334 -10.184 1.00 0.00 H new ATOM 792 N LEU A 53 -0.713 -5.737 -12.283 1.00 0.00 N ATOM 793 CA LEU A 53 0.054 -5.980 -13.500 1.00 0.00 C ATOM 794 C LEU A 53 0.414 -7.457 -13.631 1.00 0.00 C ATOM 795 O LEU A 53 0.548 -8.178 -12.642 1.00 0.00 O ATOM 796 CB LEU A 53 1.326 -5.131 -13.503 1.00 0.00 C ATOM 797 CG LEU A 53 1.122 -3.616 -13.482 1.00 0.00 C ATOM 798 CD1 LEU A 53 2.423 -2.907 -13.138 1.00 0.00 C ATOM 799 CD2 LEU A 53 0.587 -3.131 -14.822 1.00 0.00 C ATOM 0 H LEU A 53 -0.192 -5.266 -11.544 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.565 -5.699 -14.352 1.00 0.00 H new ATOM 0 HB2 LEU A 53 1.926 -5.409 -12.636 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.908 -5.387 -14.389 1.00 0.00 H new ATOM 0 HG LEU A 53 0.388 -3.378 -12.712 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.258 -1.830 -13.128 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.765 -3.231 -12.155 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.179 -3.151 -13.884 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.448 -2.050 -14.789 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.298 -3.381 -15.610 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.368 -3.614 -15.029 1.00 0.00 H new ATOM 811 N PRO A 54 0.575 -7.918 -14.880 1.00 0.00 N ATOM 812 CA PRO A 54 0.417 -7.069 -16.064 1.00 0.00 C ATOM 813 C PRO A 54 -1.034 -6.664 -16.297 1.00 0.00 C ATOM 814 O PRO A 54 -1.312 -5.573 -16.796 1.00 0.00 O ATOM 815 CB PRO A 54 0.914 -7.958 -17.207 1.00 0.00 C ATOM 816 CG PRO A 54 0.710 -9.351 -16.719 1.00 0.00 C ATOM 817 CD PRO A 54 0.925 -9.305 -15.232 1.00 0.00 C ATOM 0 HA PRO A 54 0.962 -6.130 -15.968 1.00 0.00 H new ATOM 0 HB2 PRO A 54 0.354 -7.774 -18.124 1.00 0.00 H new ATOM 0 HB3 PRO A 54 1.964 -7.766 -17.430 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.293 -9.705 -16.957 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.411 -10.037 -17.194 1.00 0.00 H new ATOM 0 HD2 PRO A 54 0.292 -10.024 -14.712 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.956 -9.539 -14.968 1.00 0.00 H new ATOM 825 N ASP A 55 -1.956 -7.549 -15.933 1.00 0.00 N ATOM 826 CA ASP A 55 -3.380 -7.282 -16.101 1.00 0.00 C ATOM 827 C ASP A 55 -3.684 -5.802 -15.891 1.00 0.00 C ATOM 828 O ASP A 55 -3.308 -5.217 -14.875 1.00 0.00 O ATOM 829 CB ASP A 55 -4.198 -8.127 -15.123 1.00 0.00 C ATOM 830 CG ASP A 55 -4.524 -9.500 -15.677 1.00 0.00 C ATOM 831 OD1 ASP A 55 -4.716 -9.614 -16.905 1.00 0.00 O ATOM 832 OD2 ASP A 55 -4.590 -10.461 -14.881 1.00 0.00 O ATOM 0 H ASP A 55 -1.743 -8.457 -15.520 1.00 0.00 H new ATOM 0 HA ASP A 55 -3.657 -7.550 -17.121 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.644 -8.237 -14.191 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -5.125 -7.605 -14.884 1.00 0.00 H new ATOM 949 N ARG A 62 -9.031 -0.727 -9.043 1.00 0.00 N ATOM 950 CA ARG A 62 -9.614 -0.189 -7.820 1.00 0.00 C ATOM 951 C ARG A 62 -8.825 1.022 -7.329 1.00 0.00 C ATOM 952 O ARG A 62 -7.595 0.997 -7.279 1.00 0.00 O ATOM 953 CB ARG A 62 -9.649 -1.263 -6.732 1.00 0.00 C ATOM 954 CG ARG A 62 -10.837 -2.205 -6.844 1.00 0.00 C ATOM 955 CD ARG A 62 -12.103 -1.576 -6.283 1.00 0.00 C ATOM 956 NE ARG A 62 -12.845 -0.838 -7.302 1.00 0.00 N ATOM 957 CZ ARG A 62 -13.587 -1.421 -8.237 1.00 0.00 C ATOM 958 NH1 ARG A 62 -13.685 -2.742 -8.282 1.00 0.00 N ATOM 959 NH2 ARG A 62 -14.233 -0.681 -9.130 1.00 0.00 N ATOM 0 HA ARG A 62 -10.633 0.128 -8.041 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.729 -1.845 -6.778 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -9.671 -0.779 -5.756 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -10.994 -2.471 -7.889 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -10.621 -3.130 -6.309 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -12.740 -2.355 -5.864 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -11.842 -0.903 -5.466 1.00 0.00 H new ATOM 0 HE ARG A 62 -12.790 0.181 -7.295 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -13.190 -3.314 -7.598 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -14.255 -3.187 -9.001 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -14.160 0.336 -9.098 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -14.803 -1.129 -9.848 1.00 0.00 H new ATOM 973 N LYS A 63 -9.542 2.081 -6.968 1.00 0.00 N ATOM 974 CA LYS A 63 -8.911 3.302 -6.480 1.00 0.00 C ATOM 975 C LYS A 63 -9.680 3.875 -5.294 1.00 0.00 C ATOM 976 O LYS A 63 -10.813 3.474 -5.022 1.00 0.00 O ATOM 977 CB LYS A 63 -8.830 4.341 -7.600 1.00 0.00 C ATOM 978 CG LYS A 63 -10.126 5.103 -7.818 1.00 0.00 C ATOM 979 CD LYS A 63 -9.940 6.255 -8.790 1.00 0.00 C ATOM 980 CE LYS A 63 -9.871 5.766 -10.228 1.00 0.00 C ATOM 981 NZ LYS A 63 -11.209 5.359 -10.740 1.00 0.00 N ATOM 0 H LYS A 63 -10.561 2.118 -7.004 1.00 0.00 H new ATOM 0 HA LYS A 63 -7.902 3.054 -6.150 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -8.036 5.051 -7.369 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -8.551 3.842 -8.528 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -10.888 4.424 -8.199 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -10.489 5.486 -6.864 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -10.765 6.959 -8.683 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -9.026 6.796 -8.544 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -9.465 6.555 -10.861 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -9.185 4.921 -10.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -11.161 5.227 -11.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -11.496 4.467 -10.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -11.905 6.099 -10.518 1.00 0.00 H new ATOM 995 N THR A 64 -9.059 4.817 -4.591 1.00 0.00 N ATOM 996 CA THR A 64 -9.685 5.446 -3.434 1.00 0.00 C ATOM 997 C THR A 64 -10.310 6.785 -3.808 1.00 0.00 C ATOM 998 O THR A 64 -10.195 7.239 -4.947 1.00 0.00 O ATOM 999 CB THR A 64 -8.671 5.665 -2.296 1.00 0.00 C ATOM 1000 OG1 THR A 64 -7.707 6.651 -2.683 1.00 0.00 O ATOM 1001 CG2 THR A 64 -7.962 4.366 -1.945 1.00 0.00 C ATOM 0 H THR A 64 -8.123 5.161 -4.803 1.00 0.00 H new ATOM 0 HA THR A 64 -10.465 4.768 -3.089 1.00 0.00 H new ATOM 0 HB THR A 64 -9.214 6.013 -1.417 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.295 7.037 -1.882 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.251 4.546 -1.139 1.00 0.00 H new ATOM 0 HG22 THR A 64 -8.695 3.627 -1.624 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.431 3.993 -2.821 1.00 0.00 H new ATOM 1009 N HIS A 65 -10.971 7.414 -2.842 1.00 0.00 N ATOM 1010 CA HIS A 65 -11.614 8.704 -3.070 1.00 0.00 C ATOM 1011 C HIS A 65 -10.583 9.767 -3.436 1.00 0.00 C ATOM 1012 O HIS A 65 -9.405 9.646 -3.101 1.00 0.00 O ATOM 1013 CB HIS A 65 -12.391 9.137 -1.827 1.00 0.00 C ATOM 1014 CG HIS A 65 -13.356 10.254 -2.082 1.00 0.00 C ATOM 1015 ND1 HIS A 65 -13.162 11.537 -1.615 1.00 0.00 N ATOM 1016 CD2 HIS A 65 -14.526 10.275 -2.762 1.00 0.00 C ATOM 1017 CE1 HIS A 65 -14.173 12.298 -1.995 1.00 0.00 C ATOM 1018 NE2 HIS A 65 -15.014 11.556 -2.693 1.00 0.00 N ATOM 0 H HIS A 65 -11.076 7.052 -1.894 1.00 0.00 H new ATOM 0 HA HIS A 65 -12.308 8.594 -3.903 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -12.937 8.280 -1.433 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -11.685 9.447 -1.057 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -14.989 9.439 -3.265 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -14.292 13.348 -1.773 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -15.885 11.882 -3.113 1.00 0.00 H new ATOM 1026 N VAL A 66 -11.035 10.809 -4.128 1.00 0.00 N ATOM 1027 CA VAL A 66 -10.152 11.894 -4.539 1.00 0.00 C ATOM 1028 C VAL A 66 -10.402 13.150 -3.712 1.00 0.00 C ATOM 1029 O VAL A 66 -11.354 13.890 -3.960 1.00 0.00 O ATOM 1030 CB VAL A 66 -10.334 12.230 -6.031 1.00 0.00 C ATOM 1031 CG1 VAL A 66 -9.342 13.299 -6.463 1.00 0.00 C ATOM 1032 CG2 VAL A 66 -10.185 10.978 -6.882 1.00 0.00 C ATOM 0 H VAL A 66 -12.007 10.924 -4.415 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.131 11.551 -4.373 1.00 0.00 H new ATOM 0 HB VAL A 66 -11.341 12.622 -6.176 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -9.486 13.523 -7.520 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -9.502 14.203 -5.875 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -8.326 12.938 -6.304 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -10.317 11.235 -7.933 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -9.192 10.553 -6.734 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -10.939 10.247 -6.590 1.00 0.00 H new ATOM 1042 N SER A 67 -9.540 13.384 -2.728 1.00 0.00 N ATOM 1043 CA SER A 67 -9.669 14.550 -1.861 1.00 0.00 C ATOM 1044 C SER A 67 -9.232 15.818 -2.587 1.00 0.00 C ATOM 1045 O SER A 67 -8.327 15.790 -3.421 1.00 0.00 O ATOM 1046 CB SER A 67 -8.836 14.362 -0.591 1.00 0.00 C ATOM 1047 OG SER A 67 -9.364 13.325 0.217 1.00 0.00 O ATOM 0 H SER A 67 -8.745 12.782 -2.511 1.00 0.00 H new ATOM 0 HA SER A 67 -10.719 14.654 -1.586 1.00 0.00 H new ATOM 0 HB2 SER A 67 -7.806 14.129 -0.860 1.00 0.00 H new ATOM 0 HB3 SER A 67 -8.815 15.293 -0.025 1.00 0.00 H new ATOM 0 HG SER A 67 -8.813 13.224 1.021 1.00 0.00 H new ATOM 1053 N LYS A 68 -9.882 16.931 -2.263 1.00 0.00 N ATOM 1054 CA LYS A 68 -9.561 18.212 -2.882 1.00 0.00 C ATOM 1055 C LYS A 68 -9.196 19.250 -1.826 1.00 0.00 C ATOM 1056 O LYS A 68 -9.590 19.136 -0.665 1.00 0.00 O ATOM 1057 CB LYS A 68 -10.745 18.710 -3.714 1.00 0.00 C ATOM 1058 CG LYS A 68 -11.234 17.702 -4.740 1.00 0.00 C ATOM 1059 CD LYS A 68 -12.248 18.320 -5.689 1.00 0.00 C ATOM 1060 CE LYS A 68 -12.933 17.261 -6.539 1.00 0.00 C ATOM 1061 NZ LYS A 68 -12.131 16.915 -7.746 1.00 0.00 N ATOM 0 H LYS A 68 -10.634 16.972 -1.575 1.00 0.00 H new ATOM 0 HA LYS A 68 -8.701 18.066 -3.536 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -11.567 18.963 -3.045 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -10.457 19.628 -4.227 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -10.386 17.321 -5.310 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -11.684 16.851 -4.229 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -12.996 18.869 -5.117 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -11.750 19.041 -6.336 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -13.095 16.364 -5.941 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -13.915 17.621 -6.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -12.631 16.190 -8.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -11.998 17.765 -8.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -11.203 16.548 -7.453 1.00 0.00 H new ATOM 1075 N LYS A 69 -8.442 20.265 -2.236 1.00 0.00 N ATOM 1076 CA LYS A 69 -8.025 21.326 -1.327 1.00 0.00 C ATOM 1077 C LYS A 69 -7.273 20.752 -0.131 1.00 0.00 C ATOM 1078 O LYS A 69 -7.506 21.149 1.012 1.00 0.00 O ATOM 1079 CB LYS A 69 -9.242 22.119 -0.845 1.00 0.00 C ATOM 1080 CG LYS A 69 -9.603 23.286 -1.748 1.00 0.00 C ATOM 1081 CD LYS A 69 -8.792 24.525 -1.410 1.00 0.00 C ATOM 1082 CE LYS A 69 -9.422 25.781 -1.994 1.00 0.00 C ATOM 1083 NZ LYS A 69 -10.455 26.355 -1.089 1.00 0.00 N ATOM 0 H LYS A 69 -8.107 20.375 -3.193 1.00 0.00 H new ATOM 0 HA LYS A 69 -7.355 21.993 -1.869 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -10.098 21.448 -0.773 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -9.046 22.494 0.159 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -9.430 23.009 -2.788 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -10.666 23.508 -1.650 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -8.714 24.626 -0.327 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -7.778 24.413 -1.794 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -8.646 26.525 -2.178 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -9.873 25.546 -2.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -10.860 27.209 -1.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -11.208 25.655 -0.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -10.019 26.603 -0.178 1.00 0.00 H new ATOM 1097 N THR A 70 -6.367 19.817 -0.399 1.00 0.00 N ATOM 1098 CA THR A 70 -5.580 19.190 0.655 1.00 0.00 C ATOM 1099 C THR A 70 -4.366 18.469 0.080 1.00 0.00 C ATOM 1100 O THR A 70 -4.277 18.249 -1.129 1.00 0.00 O ATOM 1101 CB THR A 70 -6.423 18.186 1.463 1.00 0.00 C ATOM 1102 OG1 THR A 70 -5.579 17.433 2.342 1.00 0.00 O ATOM 1103 CG2 THR A 70 -7.173 17.239 0.538 1.00 0.00 C ATOM 0 H THR A 70 -6.160 19.477 -1.338 1.00 0.00 H new ATOM 0 HA THR A 70 -5.245 19.989 1.317 1.00 0.00 H new ATOM 0 HB THR A 70 -7.151 18.747 2.050 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.123 16.798 2.853 1.00 0.00 H new ATOM 0 HG21 THR A 70 -7.761 16.540 1.132 1.00 0.00 H new ATOM 0 HG22 THR A 70 -7.837 17.812 -0.109 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.459 16.686 -0.073 1.00 0.00 H new ATOM 1111 N LEU A 71 -3.433 18.103 0.952 1.00 0.00 N ATOM 1112 CA LEU A 71 -2.223 17.405 0.531 1.00 0.00 C ATOM 1113 C LEU A 71 -2.103 16.054 1.228 1.00 0.00 C ATOM 1114 O LEU A 71 -1.483 15.129 0.707 1.00 0.00 O ATOM 1115 CB LEU A 71 -0.989 18.258 0.829 1.00 0.00 C ATOM 1116 CG LEU A 71 -0.992 19.671 0.243 1.00 0.00 C ATOM 1117 CD1 LEU A 71 0.201 20.463 0.754 1.00 0.00 C ATOM 1118 CD2 LEU A 71 -0.987 19.617 -1.278 1.00 0.00 C ATOM 0 H LEU A 71 -3.491 18.278 1.955 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.287 17.233 -0.543 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -0.878 18.335 1.911 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -0.110 17.733 0.455 1.00 0.00 H new ATOM 0 HG LEU A 71 -1.902 20.176 0.566 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.182 21.466 0.327 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.154 20.531 1.841 1.00 0.00 H new ATOM 0 HD13 LEU A 71 1.123 19.961 0.461 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -0.989 20.631 -1.678 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -0.094 19.094 -1.621 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.874 19.088 -1.626 1.00 0.00 H new ATOM 1130 N ASN A 72 -2.702 15.949 2.410 1.00 0.00 N ATOM 1131 CA ASN A 72 -2.663 14.710 3.179 1.00 0.00 C ATOM 1132 C ASN A 72 -4.038 14.052 3.219 1.00 0.00 C ATOM 1133 O ASN A 72 -4.756 14.118 4.217 1.00 0.00 O ATOM 1134 CB ASN A 72 -2.174 14.984 4.602 1.00 0.00 C ATOM 1135 CG ASN A 72 -2.642 16.328 5.126 1.00 0.00 C ATOM 1136 OD1 ASN A 72 -3.816 16.679 5.006 1.00 0.00 O ATOM 1137 ND2 ASN A 72 -1.723 17.088 5.710 1.00 0.00 N ATOM 0 H ASN A 72 -3.220 16.706 2.856 1.00 0.00 H new ATOM 0 HA ASN A 72 -1.968 14.028 2.689 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.531 14.195 5.264 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -1.085 14.949 4.622 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -1.979 18.003 6.081 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -0.761 16.757 5.788 1.00 0.00 H new ATOM 1144 N PRO A 73 -4.415 13.400 2.110 1.00 0.00 N ATOM 1145 CA PRO A 73 -5.706 12.715 1.993 1.00 0.00 C ATOM 1146 C PRO A 73 -5.783 11.469 2.869 1.00 0.00 C ATOM 1147 O PRO A 73 -4.791 10.763 3.049 1.00 0.00 O ATOM 1148 CB PRO A 73 -5.773 12.333 0.513 1.00 0.00 C ATOM 1149 CG PRO A 73 -4.351 12.247 0.079 1.00 0.00 C ATOM 1150 CD PRO A 73 -3.610 13.280 0.883 1.00 0.00 C ATOM 0 HA PRO A 73 -6.532 13.345 2.322 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -6.288 11.383 0.372 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.319 13.080 -0.064 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -3.948 11.250 0.258 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.256 12.442 -0.989 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -2.590 12.964 1.101 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -3.543 14.230 0.352 1.00 0.00 H new ATOM 1158 N VAL A 74 -6.967 11.205 3.412 1.00 0.00 N ATOM 1159 CA VAL A 74 -7.173 10.043 4.268 1.00 0.00 C ATOM 1160 C VAL A 74 -8.331 9.188 3.765 1.00 0.00 C ATOM 1161 O VAL A 74 -9.464 9.658 3.659 1.00 0.00 O ATOM 1162 CB VAL A 74 -7.453 10.461 5.724 1.00 0.00 C ATOM 1163 CG1 VAL A 74 -7.776 9.243 6.576 1.00 0.00 C ATOM 1164 CG2 VAL A 74 -6.267 11.223 6.296 1.00 0.00 C ATOM 0 H VAL A 74 -7.798 11.780 3.274 1.00 0.00 H new ATOM 0 HA VAL A 74 -6.253 9.459 4.236 1.00 0.00 H new ATOM 0 HB VAL A 74 -8.320 11.122 5.734 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -7.971 9.557 7.601 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -8.658 8.743 6.176 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -6.931 8.555 6.562 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -6.482 11.511 7.325 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -5.382 10.588 6.274 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -6.087 12.117 5.699 1.00 0.00 H new ATOM 1174 N PHE A 75 -8.039 7.929 3.456 1.00 0.00 N ATOM 1175 CA PHE A 75 -9.056 7.007 2.963 1.00 0.00 C ATOM 1176 C PHE A 75 -9.296 5.878 3.961 1.00 0.00 C ATOM 1177 O PHE A 75 -10.437 5.577 4.311 1.00 0.00 O ATOM 1178 CB PHE A 75 -8.636 6.427 1.611 1.00 0.00 C ATOM 1179 CG PHE A 75 -7.883 7.400 0.749 1.00 0.00 C ATOM 1180 CD1 PHE A 75 -8.516 8.515 0.225 1.00 0.00 C ATOM 1181 CD2 PHE A 75 -6.542 7.198 0.464 1.00 0.00 C ATOM 1182 CE1 PHE A 75 -7.825 9.412 -0.569 1.00 0.00 C ATOM 1183 CE2 PHE A 75 -5.847 8.092 -0.328 1.00 0.00 C ATOM 1184 CZ PHE A 75 -6.489 9.200 -0.846 1.00 0.00 C ATOM 0 H PHE A 75 -7.107 7.524 3.538 1.00 0.00 H new ATOM 0 HA PHE A 75 -9.986 7.563 2.839 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -8.015 5.547 1.779 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -9.525 6.092 1.076 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -9.561 8.686 0.439 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -6.035 6.333 0.865 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -8.330 10.278 -0.972 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -4.802 7.924 -0.542 1.00 0.00 H new ATOM 0 HZ PHE A 75 -5.947 9.899 -1.466 1.00 0.00 H new ATOM 1194 N ASP A 76 -8.213 5.257 4.415 1.00 0.00 N ATOM 1195 CA ASP A 76 -8.304 4.161 5.373 1.00 0.00 C ATOM 1196 C ASP A 76 -9.244 3.073 4.865 1.00 0.00 C ATOM 1197 O ASP A 76 -10.019 2.501 5.632 1.00 0.00 O ATOM 1198 CB ASP A 76 -8.789 4.679 6.728 1.00 0.00 C ATOM 1199 CG ASP A 76 -8.828 3.592 7.783 1.00 0.00 C ATOM 1200 OD1 ASP A 76 -7.746 3.172 8.245 1.00 0.00 O ATOM 1201 OD2 ASP A 76 -9.942 3.160 8.148 1.00 0.00 O ATOM 0 H ASP A 76 -7.261 5.494 4.135 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.309 3.731 5.492 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.133 5.482 7.063 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.785 5.107 6.615 1.00 0.00 H new ATOM 1206 N GLN A 77 -9.171 2.792 3.568 1.00 0.00 N ATOM 1207 CA GLN A 77 -10.017 1.773 2.958 1.00 0.00 C ATOM 1208 C GLN A 77 -9.282 0.440 2.863 1.00 0.00 C ATOM 1209 O GLN A 77 -8.054 0.391 2.938 1.00 0.00 O ATOM 1210 CB GLN A 77 -10.468 2.221 1.566 1.00 0.00 C ATOM 1211 CG GLN A 77 -11.711 3.095 1.581 1.00 0.00 C ATOM 1212 CD GLN A 77 -11.884 3.886 0.299 1.00 0.00 C ATOM 1213 OE1 GLN A 77 -11.604 5.084 0.254 1.00 0.00 O ATOM 1214 NE2 GLN A 77 -12.346 3.218 -0.751 1.00 0.00 N ATOM 0 H GLN A 77 -8.535 3.256 2.919 1.00 0.00 H new ATOM 0 HA GLN A 77 -10.894 1.639 3.591 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -9.655 2.768 1.089 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -10.661 1.340 0.955 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -12.589 2.469 1.738 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -11.656 3.784 2.424 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -12.565 2.225 -0.668 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -12.482 3.697 -1.641 1.00 0.00 H new ATOM 1223 N SER A 78 -10.041 -0.638 2.699 1.00 0.00 N ATOM 1224 CA SER A 78 -9.462 -1.973 2.599 1.00 0.00 C ATOM 1225 C SER A 78 -10.020 -2.718 1.390 1.00 0.00 C ATOM 1226 O SER A 78 -11.195 -3.087 1.362 1.00 0.00 O ATOM 1227 CB SER A 78 -9.739 -2.769 3.876 1.00 0.00 C ATOM 1228 OG SER A 78 -9.193 -4.074 3.791 1.00 0.00 O ATOM 0 H SER A 78 -11.059 -0.614 2.632 1.00 0.00 H new ATOM 0 HA SER A 78 -8.385 -1.867 2.473 1.00 0.00 H new ATOM 0 HB2 SER A 78 -9.312 -2.248 4.733 1.00 0.00 H new ATOM 0 HB3 SER A 78 -10.814 -2.831 4.044 1.00 0.00 H new ATOM 0 HG SER A 78 -9.382 -4.562 4.619 1.00 0.00 H new ATOM 1234 N PHE A 79 -9.170 -2.936 0.393 1.00 0.00 N ATOM 1235 CA PHE A 79 -9.577 -3.635 -0.820 1.00 0.00 C ATOM 1236 C PHE A 79 -9.136 -5.096 -0.779 1.00 0.00 C ATOM 1237 O PHE A 79 -8.234 -5.462 -0.026 1.00 0.00 O ATOM 1238 CB PHE A 79 -8.988 -2.948 -2.053 1.00 0.00 C ATOM 1239 CG PHE A 79 -9.309 -1.483 -2.133 1.00 0.00 C ATOM 1240 CD1 PHE A 79 -8.753 -0.588 -1.233 1.00 0.00 C ATOM 1241 CD2 PHE A 79 -10.165 -1.000 -3.110 1.00 0.00 C ATOM 1242 CE1 PHE A 79 -9.048 0.760 -1.304 1.00 0.00 C ATOM 1243 CE2 PHE A 79 -10.463 0.348 -3.186 1.00 0.00 C ATOM 1244 CZ PHE A 79 -9.903 1.229 -2.282 1.00 0.00 C ATOM 0 H PHE A 79 -8.194 -2.639 0.401 1.00 0.00 H new ATOM 0 HA PHE A 79 -10.665 -3.603 -0.880 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -7.905 -3.075 -2.047 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -9.362 -3.443 -2.949 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -8.082 -0.948 -0.468 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -10.604 -1.685 -3.820 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -8.610 1.447 -0.595 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -11.133 0.711 -3.951 1.00 0.00 H new ATOM 0 HZ PHE A 79 -10.133 2.283 -2.340 1.00 0.00 H new ATOM 1254 N ASP A 80 -9.780 -5.925 -1.594 1.00 0.00 N ATOM 1255 CA ASP A 80 -9.455 -7.345 -1.652 1.00 0.00 C ATOM 1256 C ASP A 80 -9.571 -7.871 -3.079 1.00 0.00 C ATOM 1257 O ASP A 80 -10.278 -7.297 -3.908 1.00 0.00 O ATOM 1258 CB ASP A 80 -10.378 -8.139 -0.726 1.00 0.00 C ATOM 1259 CG ASP A 80 -11.742 -7.495 -0.576 1.00 0.00 C ATOM 1260 OD1 ASP A 80 -12.565 -7.624 -1.507 1.00 0.00 O ATOM 1261 OD2 ASP A 80 -11.987 -6.862 0.472 1.00 0.00 O ATOM 0 H ASP A 80 -10.530 -5.638 -2.223 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.424 -7.471 -1.320 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -10.498 -9.150 -1.117 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -9.912 -8.230 0.255 1.00 0.00 H new ATOM 1266 N PHE A 81 -8.872 -8.966 -3.359 1.00 0.00 N ATOM 1267 CA PHE A 81 -8.895 -9.568 -4.687 1.00 0.00 C ATOM 1268 C PHE A 81 -8.685 -11.077 -4.603 1.00 0.00 C ATOM 1269 O PHE A 81 -7.832 -11.556 -3.855 1.00 0.00 O ATOM 1270 CB PHE A 81 -7.817 -8.940 -5.574 1.00 0.00 C ATOM 1271 CG PHE A 81 -7.688 -7.454 -5.399 1.00 0.00 C ATOM 1272 CD1 PHE A 81 -8.617 -6.594 -5.961 1.00 0.00 C ATOM 1273 CD2 PHE A 81 -6.637 -6.917 -4.673 1.00 0.00 C ATOM 1274 CE1 PHE A 81 -8.502 -5.226 -5.802 1.00 0.00 C ATOM 1275 CE2 PHE A 81 -6.516 -5.550 -4.510 1.00 0.00 C ATOM 1276 CZ PHE A 81 -7.449 -4.703 -5.077 1.00 0.00 C ATOM 0 H PHE A 81 -8.283 -9.454 -2.684 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.874 -9.379 -5.128 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -6.858 -9.408 -5.353 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -8.045 -9.157 -6.618 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.441 -6.997 -6.530 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -5.904 -7.574 -4.229 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -9.234 -4.567 -6.244 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -5.693 -5.144 -3.940 1.00 0.00 H new ATOM 0 HZ PHE A 81 -7.355 -3.634 -4.954 1.00 0.00 H new ATOM 1286 N SER A 82 -9.469 -11.821 -5.376 1.00 0.00 N ATOM 1287 CA SER A 82 -9.373 -13.276 -5.387 1.00 0.00 C ATOM 1288 C SER A 82 -8.298 -13.743 -6.364 1.00 0.00 C ATOM 1289 O SER A 82 -8.571 -13.973 -7.542 1.00 0.00 O ATOM 1290 CB SER A 82 -10.722 -13.895 -5.761 1.00 0.00 C ATOM 1291 OG SER A 82 -11.208 -13.359 -6.980 1.00 0.00 O ATOM 0 H SER A 82 -10.178 -11.440 -6.003 1.00 0.00 H new ATOM 0 HA SER A 82 -9.096 -13.604 -4.385 1.00 0.00 H new ATOM 0 HB2 SER A 82 -10.617 -14.976 -5.852 1.00 0.00 H new ATOM 0 HB3 SER A 82 -11.444 -13.710 -4.965 1.00 0.00 H new ATOM 0 HG SER A 82 -10.495 -13.375 -7.652 1.00 0.00 H new ATOM 1297 N VAL A 83 -7.074 -13.881 -5.865 1.00 0.00 N ATOM 1298 CA VAL A 83 -5.956 -14.321 -6.692 1.00 0.00 C ATOM 1299 C VAL A 83 -5.006 -15.213 -5.901 1.00 0.00 C ATOM 1300 O VAL A 83 -4.695 -14.934 -4.743 1.00 0.00 O ATOM 1301 CB VAL A 83 -5.169 -13.122 -7.255 1.00 0.00 C ATOM 1302 CG1 VAL A 83 -4.781 -12.166 -6.138 1.00 0.00 C ATOM 1303 CG2 VAL A 83 -3.939 -13.601 -8.010 1.00 0.00 C ATOM 0 H VAL A 83 -6.831 -13.695 -4.892 1.00 0.00 H new ATOM 0 HA VAL A 83 -6.378 -14.890 -7.520 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.810 -12.584 -7.954 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.226 -11.326 -6.555 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.681 -11.798 -5.645 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.158 -12.688 -5.412 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.395 -12.742 -8.401 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -3.294 -14.163 -7.335 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.246 -14.242 -8.836 1.00 0.00 H new ATOM 1313 N SER A 84 -4.546 -16.287 -6.536 1.00 0.00 N ATOM 1314 CA SER A 84 -3.633 -17.223 -5.891 1.00 0.00 C ATOM 1315 C SER A 84 -2.234 -16.625 -5.776 1.00 0.00 C ATOM 1316 O SER A 84 -1.720 -16.031 -6.725 1.00 0.00 O ATOM 1317 CB SER A 84 -3.576 -18.535 -6.675 1.00 0.00 C ATOM 1318 OG SER A 84 -4.870 -18.937 -7.091 1.00 0.00 O ATOM 0 H SER A 84 -4.791 -16.530 -7.496 1.00 0.00 H new ATOM 0 HA SER A 84 -4.007 -17.424 -4.887 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.932 -18.414 -7.546 1.00 0.00 H new ATOM 0 HB3 SER A 84 -3.132 -19.314 -6.055 1.00 0.00 H new ATOM 0 HG SER A 84 -4.806 -19.777 -7.591 1.00 0.00 H new ATOM 1324 N LEU A 85 -1.623 -16.786 -4.608 1.00 0.00 N ATOM 1325 CA LEU A 85 -0.283 -16.263 -4.367 1.00 0.00 C ATOM 1326 C LEU A 85 0.632 -16.540 -5.555 1.00 0.00 C ATOM 1327 O LEU A 85 1.327 -15.655 -6.055 1.00 0.00 O ATOM 1328 CB LEU A 85 0.308 -16.882 -3.099 1.00 0.00 C ATOM 1329 CG LEU A 85 1.822 -17.092 -3.097 1.00 0.00 C ATOM 1330 CD1 LEU A 85 2.545 -15.765 -2.931 1.00 0.00 C ATOM 1331 CD2 LEU A 85 2.225 -18.062 -1.995 1.00 0.00 C ATOM 0 H LEU A 85 -2.034 -17.275 -3.813 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.360 -15.184 -4.235 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.049 -16.245 -2.253 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -0.172 -17.846 -2.931 1.00 0.00 H new ATOM 0 HG LEU A 85 2.111 -17.522 -4.056 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.622 -15.935 -2.932 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.282 -15.102 -3.755 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.251 -15.306 -1.987 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.306 -18.199 -2.009 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.923 -17.660 -1.028 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.735 -19.022 -2.158 1.00 0.00 H new ATOM 1343 N PRO A 86 0.632 -17.798 -6.022 1.00 0.00 N ATOM 1344 CA PRO A 86 1.454 -18.220 -7.159 1.00 0.00 C ATOM 1345 C PRO A 86 1.339 -17.267 -8.344 1.00 0.00 C ATOM 1346 O PRO A 86 2.305 -17.053 -9.076 1.00 0.00 O ATOM 1347 CB PRO A 86 0.882 -19.594 -7.520 1.00 0.00 C ATOM 1348 CG PRO A 86 0.285 -20.100 -6.252 1.00 0.00 C ATOM 1349 CD PRO A 86 -0.172 -18.904 -5.475 1.00 0.00 C ATOM 0 HA PRO A 86 2.515 -18.237 -6.910 1.00 0.00 H new ATOM 0 HB2 PRO A 86 0.132 -19.516 -8.307 1.00 0.00 H new ATOM 0 HB3 PRO A 86 1.661 -20.263 -7.886 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -0.551 -20.768 -6.459 1.00 0.00 H new ATOM 0 HG3 PRO A 86 1.017 -20.673 -5.683 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.239 -18.726 -5.607 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.000 -19.032 -4.406 1.00 0.00 H new ATOM 1357 N GLU A 87 0.151 -16.698 -8.526 1.00 0.00 N ATOM 1358 CA GLU A 87 -0.089 -15.768 -9.623 1.00 0.00 C ATOM 1359 C GLU A 87 0.361 -14.359 -9.250 1.00 0.00 C ATOM 1360 O GLU A 87 1.095 -13.711 -9.997 1.00 0.00 O ATOM 1361 CB GLU A 87 -1.573 -15.759 -9.998 1.00 0.00 C ATOM 1362 CG GLU A 87 -2.008 -16.981 -10.790 1.00 0.00 C ATOM 1363 CD GLU A 87 -1.445 -18.271 -10.227 1.00 0.00 C ATOM 1364 OE1 GLU A 87 -0.261 -18.567 -10.491 1.00 0.00 O ATOM 1365 OE2 GLU A 87 -2.189 -18.986 -9.524 1.00 0.00 O ATOM 0 H GLU A 87 -0.659 -16.865 -7.929 1.00 0.00 H new ATOM 0 HA GLU A 87 0.493 -16.101 -10.482 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -2.169 -15.696 -9.087 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.786 -14.863 -10.582 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -3.097 -17.036 -10.797 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -1.688 -16.871 -11.826 1.00 0.00 H new ATOM 1372 N VAL A 88 -0.084 -13.890 -8.089 1.00 0.00 N ATOM 1373 CA VAL A 88 0.273 -12.558 -7.615 1.00 0.00 C ATOM 1374 C VAL A 88 1.770 -12.452 -7.346 1.00 0.00 C ATOM 1375 O VAL A 88 2.307 -11.355 -7.197 1.00 0.00 O ATOM 1376 CB VAL A 88 -0.495 -12.195 -6.330 1.00 0.00 C ATOM 1377 CG1 VAL A 88 0.230 -12.731 -5.105 1.00 0.00 C ATOM 1378 CG2 VAL A 88 -0.685 -10.688 -6.231 1.00 0.00 C ATOM 0 H VAL A 88 -0.693 -14.413 -7.459 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.001 -11.858 -8.404 1.00 0.00 H new ATOM 0 HB VAL A 88 -1.480 -12.660 -6.372 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -0.327 -12.465 -4.207 1.00 0.00 H new ATOM 0 HG12 VAL A 88 0.309 -13.816 -5.175 1.00 0.00 H new ATOM 0 HG13 VAL A 88 1.229 -12.297 -5.054 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -1.229 -10.449 -5.317 1.00 0.00 H new ATOM 0 HG22 VAL A 88 0.289 -10.199 -6.211 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -1.251 -10.335 -7.093 1.00 0.00 H new ATOM 1388 N GLN A 89 2.437 -13.600 -7.287 1.00 0.00 N ATOM 1389 CA GLN A 89 3.873 -13.637 -7.036 1.00 0.00 C ATOM 1390 C GLN A 89 4.643 -13.004 -8.190 1.00 0.00 C ATOM 1391 O GLN A 89 5.379 -12.035 -8.001 1.00 0.00 O ATOM 1392 CB GLN A 89 4.338 -15.079 -6.826 1.00 0.00 C ATOM 1393 CG GLN A 89 4.283 -15.531 -5.376 1.00 0.00 C ATOM 1394 CD GLN A 89 5.356 -16.547 -5.039 1.00 0.00 C ATOM 1395 OE1 GLN A 89 6.518 -16.194 -4.831 1.00 0.00 O ATOM 1396 NE2 GLN A 89 4.974 -17.817 -4.985 1.00 0.00 N ATOM 0 H GLN A 89 2.006 -14.516 -7.410 1.00 0.00 H new ATOM 0 HA GLN A 89 4.074 -13.063 -6.131 1.00 0.00 H new ATOM 0 HB2 GLN A 89 3.718 -15.743 -7.429 1.00 0.00 H new ATOM 0 HB3 GLN A 89 5.360 -15.179 -7.190 1.00 0.00 H new ATOM 0 HG2 GLN A 89 4.392 -14.664 -4.725 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.303 -15.962 -5.171 1.00 0.00 H new ATOM 0 HE21 GLN A 89 4.001 -18.065 -5.164 1.00 0.00 H new ATOM 0 HE22 GLN A 89 5.653 -18.545 -4.764 1.00 0.00 H new ATOM 1405 N ARG A 90 4.469 -13.558 -9.386 1.00 0.00 N ATOM 1406 CA ARG A 90 5.150 -13.049 -10.570 1.00 0.00 C ATOM 1407 C ARG A 90 4.510 -11.749 -11.048 1.00 0.00 C ATOM 1408 O ARG A 90 4.890 -11.202 -12.083 1.00 0.00 O ATOM 1409 CB ARG A 90 5.115 -14.089 -11.691 1.00 0.00 C ATOM 1410 CG ARG A 90 3.710 -14.520 -12.079 1.00 0.00 C ATOM 1411 CD ARG A 90 3.154 -13.658 -13.202 1.00 0.00 C ATOM 1412 NE ARG A 90 3.675 -14.055 -14.507 1.00 0.00 N ATOM 1413 CZ ARG A 90 3.301 -15.159 -15.143 1.00 0.00 C ATOM 1414 NH1 ARG A 90 2.407 -15.972 -14.597 1.00 0.00 N ATOM 1415 NH2 ARG A 90 3.821 -15.452 -16.328 1.00 0.00 N ATOM 0 H ARG A 90 3.862 -14.359 -9.560 1.00 0.00 H new ATOM 0 HA ARG A 90 6.187 -12.847 -10.303 1.00 0.00 H new ATOM 0 HB2 ARG A 90 5.616 -13.681 -12.569 1.00 0.00 H new ATOM 0 HB3 ARG A 90 5.682 -14.966 -11.379 1.00 0.00 H new ATOM 0 HG2 ARG A 90 3.722 -15.564 -12.392 1.00 0.00 H new ATOM 0 HG3 ARG A 90 3.055 -14.455 -11.210 1.00 0.00 H new ATOM 0 HD2 ARG A 90 2.066 -13.729 -13.209 1.00 0.00 H new ATOM 0 HD3 ARG A 90 3.404 -12.614 -13.015 1.00 0.00 H new ATOM 0 HE ARG A 90 4.364 -13.451 -14.955 1.00 0.00 H new ATOM 0 HH11 ARG A 90 2.005 -15.750 -13.686 1.00 0.00 H new ATOM 0 HH12 ARG A 90 2.121 -16.819 -15.088 1.00 0.00 H new ATOM 0 HH21 ARG A 90 4.509 -14.829 -16.751 1.00 0.00 H new ATOM 0 HH22 ARG A 90 3.533 -16.300 -16.816 1.00 0.00 H new ATOM 1429 N ARG A 91 3.536 -11.260 -10.287 1.00 0.00 N ATOM 1430 CA ARG A 91 2.842 -10.026 -10.633 1.00 0.00 C ATOM 1431 C ARG A 91 3.418 -8.843 -9.861 1.00 0.00 C ATOM 1432 O ARG A 91 4.256 -9.014 -8.975 1.00 0.00 O ATOM 1433 CB ARG A 91 1.346 -10.158 -10.343 1.00 0.00 C ATOM 1434 CG ARG A 91 0.598 -10.992 -11.371 1.00 0.00 C ATOM 1435 CD ARG A 91 -0.888 -11.064 -11.055 1.00 0.00 C ATOM 1436 NE ARG A 91 -1.492 -12.302 -11.541 1.00 0.00 N ATOM 1437 CZ ARG A 91 -1.714 -12.556 -12.826 1.00 0.00 C ATOM 1438 NH1 ARG A 91 -1.382 -11.663 -13.749 1.00 0.00 N ATOM 1439 NH2 ARG A 91 -2.267 -13.705 -13.190 1.00 0.00 N ATOM 0 H ARG A 91 3.210 -11.700 -9.427 1.00 0.00 H new ATOM 0 HA ARG A 91 2.984 -9.846 -11.699 1.00 0.00 H new ATOM 0 HB2 ARG A 91 1.213 -10.606 -9.358 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.903 -9.163 -10.303 1.00 0.00 H new ATOM 0 HG2 ARG A 91 0.740 -10.562 -12.363 1.00 0.00 H new ATOM 0 HG3 ARG A 91 1.015 -11.999 -11.397 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -1.033 -10.988 -9.977 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -1.396 -10.212 -11.506 1.00 0.00 H new ATOM 0 HE ARG A 91 -1.758 -13.010 -10.857 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -0.955 -10.779 -13.473 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -1.554 -11.861 -14.735 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -2.522 -14.395 -12.483 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -2.437 -13.899 -14.177 1.00 0.00 H new ATOM 1453 N THR A 92 2.963 -7.641 -10.202 1.00 0.00 N ATOM 1454 CA THR A 92 3.433 -6.430 -9.543 1.00 0.00 C ATOM 1455 C THR A 92 2.279 -5.476 -9.257 1.00 0.00 C ATOM 1456 O THR A 92 1.439 -5.223 -10.122 1.00 0.00 O ATOM 1457 CB THR A 92 4.488 -5.700 -10.395 1.00 0.00 C ATOM 1458 OG1 THR A 92 5.552 -6.597 -10.733 1.00 0.00 O ATOM 1459 CG2 THR A 92 5.050 -4.499 -9.649 1.00 0.00 C ATOM 0 H THR A 92 2.269 -7.481 -10.932 1.00 0.00 H new ATOM 0 HA THR A 92 3.887 -6.739 -8.602 1.00 0.00 H new ATOM 0 HB THR A 92 4.005 -5.349 -11.307 1.00 0.00 H new ATOM 0 HG1 THR A 92 6.218 -6.125 -11.276 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.793 -4.000 -10.271 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.243 -3.804 -9.419 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.517 -4.832 -8.722 1.00 0.00 H new ATOM 1467 N LEU A 93 2.243 -4.947 -8.038 1.00 0.00 N ATOM 1468 CA LEU A 93 1.191 -4.019 -7.638 1.00 0.00 C ATOM 1469 C LEU A 93 1.522 -2.597 -8.079 1.00 0.00 C ATOM 1470 O LEU A 93 2.315 -1.907 -7.439 1.00 0.00 O ATOM 1471 CB LEU A 93 0.996 -4.062 -6.121 1.00 0.00 C ATOM 1472 CG LEU A 93 -0.409 -3.732 -5.616 1.00 0.00 C ATOM 1473 CD1 LEU A 93 -1.338 -4.921 -5.804 1.00 0.00 C ATOM 1474 CD2 LEU A 93 -0.365 -3.314 -4.153 1.00 0.00 C ATOM 0 H LEU A 93 2.930 -5.145 -7.310 1.00 0.00 H new ATOM 0 HA LEU A 93 0.266 -4.325 -8.126 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.262 -5.058 -5.769 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.698 -3.364 -5.664 1.00 0.00 H new ATOM 0 HG LEU A 93 -0.797 -2.898 -6.201 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.333 -4.667 -5.439 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.394 -5.175 -6.862 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.954 -5.775 -5.246 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.374 -3.083 -3.810 1.00 0.00 H new ATOM 0 HD22 LEU A 93 0.044 -4.128 -3.554 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.266 -2.432 -4.046 1.00 0.00 H new ATOM 1486 N ASP A 94 0.909 -2.166 -9.175 1.00 0.00 N ATOM 1487 CA ASP A 94 1.136 -0.824 -9.701 1.00 0.00 C ATOM 1488 C ASP A 94 0.449 0.224 -8.831 1.00 0.00 C ATOM 1489 O ASP A 94 -0.749 0.473 -8.970 1.00 0.00 O ATOM 1490 CB ASP A 94 0.627 -0.724 -11.139 1.00 0.00 C ATOM 1491 CG ASP A 94 1.254 0.430 -11.897 1.00 0.00 C ATOM 1492 OD1 ASP A 94 2.491 0.583 -11.826 1.00 0.00 O ATOM 1493 OD2 ASP A 94 0.507 1.179 -12.560 1.00 0.00 O ATOM 0 H ASP A 94 0.251 -2.726 -9.717 1.00 0.00 H new ATOM 0 HA ASP A 94 2.209 -0.633 -9.690 1.00 0.00 H new ATOM 0 HB2 ASP A 94 0.839 -1.656 -11.662 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -0.456 -0.603 -11.130 1.00 0.00 H new ATOM 1498 N VAL A 95 1.215 0.834 -7.932 1.00 0.00 N ATOM 1499 CA VAL A 95 0.681 1.855 -7.039 1.00 0.00 C ATOM 1500 C VAL A 95 1.204 3.238 -7.410 1.00 0.00 C ATOM 1501 O VAL A 95 2.349 3.580 -7.114 1.00 0.00 O ATOM 1502 CB VAL A 95 1.039 1.560 -5.570 1.00 0.00 C ATOM 1503 CG1 VAL A 95 0.294 2.503 -4.639 1.00 0.00 C ATOM 1504 CG2 VAL A 95 0.734 0.109 -5.229 1.00 0.00 C ATOM 0 H VAL A 95 2.208 0.639 -7.803 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.403 1.837 -7.151 1.00 0.00 H new ATOM 0 HB VAL A 95 2.108 1.724 -5.434 1.00 0.00 H new ATOM 0 HG11 VAL A 95 0.560 2.279 -3.606 1.00 0.00 H new ATOM 0 HG12 VAL A 95 0.567 3.533 -4.869 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.780 2.374 -4.774 1.00 0.00 H new ATOM 0 HG21 VAL A 95 0.993 -0.082 -4.188 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -0.328 -0.085 -5.380 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.318 -0.547 -5.874 1.00 0.00 H new ATOM 1514 N ALA A 96 0.358 4.030 -8.060 1.00 0.00 N ATOM 1515 CA ALA A 96 0.734 5.378 -8.469 1.00 0.00 C ATOM 1516 C ALA A 96 -0.259 6.409 -7.942 1.00 0.00 C ATOM 1517 O ALA A 96 -1.462 6.305 -8.180 1.00 0.00 O ATOM 1518 CB ALA A 96 0.830 5.461 -9.985 1.00 0.00 C ATOM 0 H ALA A 96 -0.592 3.762 -8.315 1.00 0.00 H new ATOM 0 HA ALA A 96 1.711 5.602 -8.041 1.00 0.00 H new ATOM 0 HB1 ALA A 96 1.111 6.473 -10.277 1.00 0.00 H new ATOM 0 HB2 ALA A 96 1.583 4.758 -10.341 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -0.136 5.212 -10.425 1.00 0.00 H new ATOM 1524 N VAL A 97 0.253 7.404 -7.225 1.00 0.00 N ATOM 1525 CA VAL A 97 -0.589 8.454 -6.665 1.00 0.00 C ATOM 1526 C VAL A 97 -0.490 9.735 -7.487 1.00 0.00 C ATOM 1527 O VAL A 97 0.508 10.453 -7.420 1.00 0.00 O ATOM 1528 CB VAL A 97 -0.205 8.763 -5.206 1.00 0.00 C ATOM 1529 CG1 VAL A 97 -1.209 9.718 -4.579 1.00 0.00 C ATOM 1530 CG2 VAL A 97 -0.104 7.477 -4.398 1.00 0.00 C ATOM 0 H VAL A 97 1.247 7.505 -7.018 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.615 8.086 -6.693 1.00 0.00 H new ATOM 0 HB VAL A 97 0.772 9.247 -5.201 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.920 9.924 -3.548 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -1.227 10.650 -5.144 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -2.200 9.265 -4.595 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.168 7.714 -3.369 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.065 6.963 -4.410 1.00 0.00 H new ATOM 0 HG23 VAL A 97 0.658 6.831 -4.835 1.00 0.00 H new ATOM 1540 N LYS A 98 -1.532 10.015 -8.262 1.00 0.00 N ATOM 1541 CA LYS A 98 -1.565 11.211 -9.096 1.00 0.00 C ATOM 1542 C LYS A 98 -2.736 12.110 -8.713 1.00 0.00 C ATOM 1543 O LYS A 98 -3.490 11.803 -7.791 1.00 0.00 O ATOM 1544 CB LYS A 98 -1.668 10.823 -10.573 1.00 0.00 C ATOM 1545 CG LYS A 98 -0.439 10.103 -11.101 1.00 0.00 C ATOM 1546 CD LYS A 98 -0.490 8.616 -10.794 1.00 0.00 C ATOM 1547 CE LYS A 98 -1.349 7.868 -11.802 1.00 0.00 C ATOM 1548 NZ LYS A 98 -2.777 7.814 -11.383 1.00 0.00 N ATOM 0 H LYS A 98 -2.365 9.430 -8.330 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.639 11.763 -8.934 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -2.540 10.184 -10.712 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -1.834 11.723 -11.165 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -0.364 10.251 -12.178 1.00 0.00 H new ATOM 0 HG3 LYS A 98 0.457 10.537 -10.657 1.00 0.00 H new ATOM 0 HD2 LYS A 98 0.520 8.207 -10.801 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -0.888 8.464 -9.791 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -1.274 8.355 -12.775 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -0.967 6.854 -11.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -3.186 6.899 -11.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -2.840 7.922 -10.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -3.303 8.583 -11.844 1.00 0.00 H new ATOM 1562 N ASN A 99 -2.882 13.220 -9.428 1.00 0.00 N ATOM 1563 CA ASN A 99 -3.962 14.164 -9.163 1.00 0.00 C ATOM 1564 C ASN A 99 -5.043 14.069 -10.235 1.00 0.00 C ATOM 1565 O ASN A 99 -4.749 13.845 -11.409 1.00 0.00 O ATOM 1566 CB ASN A 99 -3.416 15.591 -9.097 1.00 0.00 C ATOM 1567 CG ASN A 99 -2.566 15.941 -10.303 1.00 0.00 C ATOM 1568 OD1 ASN A 99 -3.082 16.158 -11.399 1.00 0.00 O ATOM 1569 ND2 ASN A 99 -1.254 15.997 -10.105 1.00 0.00 N ATOM 0 H ASN A 99 -2.266 13.488 -10.196 1.00 0.00 H new ATOM 0 HA ASN A 99 -4.406 13.908 -8.201 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -4.247 16.292 -9.026 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -2.822 15.708 -8.191 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -0.631 16.227 -10.879 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -0.870 15.810 -9.179 1.00 0.00 H new ATOM 1714 N LEU A 110 2.583 13.373 -13.414 1.00 0.00 N ATOM 1715 CA LEU A 110 2.643 12.322 -12.405 1.00 0.00 C ATOM 1716 C LEU A 110 3.334 12.820 -11.139 1.00 0.00 C ATOM 1717 O LEU A 110 4.525 13.136 -11.153 1.00 0.00 O ATOM 1718 CB LEU A 110 3.381 11.100 -12.955 1.00 0.00 C ATOM 1719 CG LEU A 110 3.847 10.075 -11.921 1.00 0.00 C ATOM 1720 CD1 LEU A 110 2.736 9.083 -11.616 1.00 0.00 C ATOM 1721 CD2 LEU A 110 5.092 9.350 -12.412 1.00 0.00 C ATOM 0 HA LEU A 110 1.622 12.038 -12.152 1.00 0.00 H new ATOM 0 HB2 LEU A 110 2.728 10.596 -13.667 1.00 0.00 H new ATOM 0 HB3 LEU A 110 4.252 11.447 -13.511 1.00 0.00 H new ATOM 0 HG LEU A 110 4.098 10.603 -11.001 1.00 0.00 H new ATOM 0 HD11 LEU A 110 3.085 8.361 -10.878 1.00 0.00 H new ATOM 0 HD12 LEU A 110 1.871 9.616 -11.221 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.454 8.560 -12.530 1.00 0.00 H new ATOM 0 HD21 LEU A 110 5.410 8.624 -11.663 1.00 0.00 H new ATOM 0 HD22 LEU A 110 4.868 8.834 -13.346 1.00 0.00 H new ATOM 0 HD23 LEU A 110 5.891 10.072 -12.579 1.00 0.00 H new ATOM 1733 N LEU A 111 2.581 12.886 -10.047 1.00 0.00 N ATOM 1734 CA LEU A 111 3.121 13.343 -8.772 1.00 0.00 C ATOM 1735 C LEU A 111 4.147 12.353 -8.228 1.00 0.00 C ATOM 1736 O LEU A 111 5.282 12.721 -7.928 1.00 0.00 O ATOM 1737 CB LEU A 111 1.993 13.535 -7.757 1.00 0.00 C ATOM 1738 CG LEU A 111 0.863 14.475 -8.179 1.00 0.00 C ATOM 1739 CD1 LEU A 111 -0.165 14.607 -7.066 1.00 0.00 C ATOM 1740 CD2 LEU A 111 1.418 15.839 -8.559 1.00 0.00 C ATOM 0 H LEU A 111 1.594 12.629 -10.019 1.00 0.00 H new ATOM 0 HA LEU A 111 3.618 14.299 -8.938 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.562 12.559 -7.534 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.425 13.912 -6.830 1.00 0.00 H new ATOM 0 HG LEU A 111 0.370 14.050 -9.053 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.961 15.280 -7.384 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -0.586 13.627 -6.841 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.315 15.009 -6.174 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.600 16.495 -8.857 1.00 0.00 H new ATOM 0 HD22 LEU A 111 1.937 16.272 -7.704 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.116 15.730 -9.389 1.00 0.00 H new ATOM 1752 N GLY A 112 3.739 11.094 -8.106 1.00 0.00 N ATOM 1753 CA GLY A 112 4.635 10.070 -7.601 1.00 0.00 C ATOM 1754 C GLY A 112 4.068 8.673 -7.761 1.00 0.00 C ATOM 1755 O GLY A 112 2.861 8.465 -7.629 1.00 0.00 O ATOM 0 H GLY A 112 2.804 10.765 -8.348 1.00 0.00 H new ATOM 0 HA2 GLY A 112 5.588 10.134 -8.126 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.839 10.258 -6.547 1.00 0.00 H new ATOM 1759 N LYS A 113 4.939 7.711 -8.047 1.00 0.00 N ATOM 1760 CA LYS A 113 4.519 6.327 -8.226 1.00 0.00 C ATOM 1761 C LYS A 113 5.566 5.365 -7.672 1.00 0.00 C ATOM 1762 O LYS A 113 6.747 5.702 -7.580 1.00 0.00 O ATOM 1763 CB LYS A 113 4.276 6.033 -9.708 1.00 0.00 C ATOM 1764 CG LYS A 113 5.544 6.030 -10.544 1.00 0.00 C ATOM 1765 CD LYS A 113 5.293 5.477 -11.936 1.00 0.00 C ATOM 1766 CE LYS A 113 5.272 3.956 -11.936 1.00 0.00 C ATOM 1767 NZ LYS A 113 5.403 3.400 -13.312 1.00 0.00 N ATOM 0 H LYS A 113 5.941 7.865 -8.160 1.00 0.00 H new ATOM 0 HA LYS A 113 3.589 6.182 -7.676 1.00 0.00 H new ATOM 0 HB2 LYS A 113 3.787 5.063 -9.802 1.00 0.00 H new ATOM 0 HB3 LYS A 113 3.588 6.777 -10.109 1.00 0.00 H new ATOM 0 HG2 LYS A 113 5.933 7.045 -10.620 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.308 5.432 -10.046 1.00 0.00 H new ATOM 0 HD2 LYS A 113 4.343 5.855 -12.313 1.00 0.00 H new ATOM 0 HD3 LYS A 113 6.069 5.831 -12.615 1.00 0.00 H new ATOM 0 HE2 LYS A 113 6.085 3.581 -11.314 1.00 0.00 H new ATOM 0 HE3 LYS A 113 4.341 3.605 -11.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 5.350 2.362 -13.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 4.633 3.764 -13.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 6.318 3.685 -13.716 1.00 0.00 H new ATOM 1781 N VAL A 114 5.126 4.166 -7.304 1.00 0.00 N ATOM 1782 CA VAL A 114 6.025 3.155 -6.761 1.00 0.00 C ATOM 1783 C VAL A 114 5.502 1.750 -7.037 1.00 0.00 C ATOM 1784 O VAL A 114 4.306 1.485 -6.911 1.00 0.00 O ATOM 1785 CB VAL A 114 6.216 3.331 -5.243 1.00 0.00 C ATOM 1786 CG1 VAL A 114 4.887 3.191 -4.517 1.00 0.00 C ATOM 1787 CG2 VAL A 114 7.229 2.327 -4.714 1.00 0.00 C ATOM 0 H VAL A 114 4.152 3.871 -7.372 1.00 0.00 H new ATOM 0 HA VAL A 114 6.986 3.286 -7.258 1.00 0.00 H new ATOM 0 HB VAL A 114 6.600 4.334 -5.057 1.00 0.00 H new ATOM 0 HG11 VAL A 114 5.042 3.318 -3.446 1.00 0.00 H new ATOM 0 HG12 VAL A 114 4.194 3.952 -4.876 1.00 0.00 H new ATOM 0 HG13 VAL A 114 4.470 2.202 -4.708 1.00 0.00 H new ATOM 0 HG21 VAL A 114 7.352 2.466 -3.640 1.00 0.00 H new ATOM 0 HG22 VAL A 114 6.875 1.315 -4.911 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.187 2.480 -5.211 1.00 0.00 H new ATOM 1797 N LEU A 115 6.406 0.851 -7.412 1.00 0.00 N ATOM 1798 CA LEU A 115 6.037 -0.529 -7.706 1.00 0.00 C ATOM 1799 C LEU A 115 6.435 -1.455 -6.561 1.00 0.00 C ATOM 1800 O LEU A 115 7.518 -1.322 -5.990 1.00 0.00 O ATOM 1801 CB LEU A 115 6.701 -0.990 -9.005 1.00 0.00 C ATOM 1802 CG LEU A 115 6.051 -0.504 -10.300 1.00 0.00 C ATOM 1803 CD1 LEU A 115 4.546 -0.722 -10.257 1.00 0.00 C ATOM 1804 CD2 LEU A 115 6.372 0.964 -10.540 1.00 0.00 C ATOM 0 H LEU A 115 7.400 1.053 -7.520 1.00 0.00 H new ATOM 0 HA LEU A 115 4.954 -0.572 -7.824 1.00 0.00 H new ATOM 0 HB2 LEU A 115 7.739 -0.658 -8.996 1.00 0.00 H new ATOM 0 HB3 LEU A 115 6.715 -2.080 -9.016 1.00 0.00 H new ATOM 0 HG LEU A 115 6.458 -1.085 -11.128 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.101 -0.370 -11.187 1.00 0.00 H new ATOM 0 HD12 LEU A 115 4.336 -1.784 -10.133 1.00 0.00 H new ATOM 0 HD13 LEU A 115 4.122 -0.168 -9.419 1.00 0.00 H new ATOM 0 HD21 LEU A 115 5.901 1.293 -11.466 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.994 1.560 -9.709 1.00 0.00 H new ATOM 0 HD23 LEU A 115 7.452 1.093 -10.616 1.00 0.00 H new ATOM 1816 N VAL A 116 5.554 -2.393 -6.231 1.00 0.00 N ATOM 1817 CA VAL A 116 5.815 -3.344 -5.157 1.00 0.00 C ATOM 1818 C VAL A 116 5.765 -4.779 -5.668 1.00 0.00 C ATOM 1819 O VAL A 116 4.755 -5.219 -6.216 1.00 0.00 O ATOM 1820 CB VAL A 116 4.802 -3.184 -4.008 1.00 0.00 C ATOM 1821 CG1 VAL A 116 5.039 -4.238 -2.937 1.00 0.00 C ATOM 1822 CG2 VAL A 116 4.882 -1.784 -3.418 1.00 0.00 C ATOM 0 H VAL A 116 4.652 -2.515 -6.692 1.00 0.00 H new ATOM 0 HA VAL A 116 6.816 -3.131 -4.782 1.00 0.00 H new ATOM 0 HB VAL A 116 3.798 -3.327 -4.409 1.00 0.00 H new ATOM 0 HG11 VAL A 116 4.314 -4.109 -2.133 1.00 0.00 H new ATOM 0 HG12 VAL A 116 4.926 -5.231 -3.372 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.047 -4.130 -2.537 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.159 -1.689 -2.608 1.00 0.00 H new ATOM 0 HG22 VAL A 116 5.886 -1.609 -3.031 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.658 -1.050 -4.192 1.00 0.00 H new ATOM 1832 N ALA A 117 6.863 -5.505 -5.486 1.00 0.00 N ATOM 1833 CA ALA A 117 6.944 -6.892 -5.927 1.00 0.00 C ATOM 1834 C ALA A 117 6.291 -7.828 -4.916 1.00 0.00 C ATOM 1835 O ALA A 117 6.786 -7.997 -3.800 1.00 0.00 O ATOM 1836 CB ALA A 117 8.395 -7.289 -6.156 1.00 0.00 C ATOM 0 H ALA A 117 7.709 -5.156 -5.036 1.00 0.00 H new ATOM 0 HA ALA A 117 6.402 -6.981 -6.868 1.00 0.00 H new ATOM 0 HB1 ALA A 117 8.441 -8.327 -6.485 1.00 0.00 H new ATOM 0 HB2 ALA A 117 8.832 -6.647 -6.921 1.00 0.00 H new ATOM 0 HB3 ALA A 117 8.954 -7.178 -5.227 1.00 0.00 H new ATOM 1842 N LEU A 118 5.177 -8.434 -5.311 1.00 0.00 N ATOM 1843 CA LEU A 118 4.455 -9.353 -4.439 1.00 0.00 C ATOM 1844 C LEU A 118 4.964 -10.781 -4.611 1.00 0.00 C ATOM 1845 O LEU A 118 4.274 -11.742 -4.272 1.00 0.00 O ATOM 1846 CB LEU A 118 2.955 -9.296 -4.734 1.00 0.00 C ATOM 1847 CG LEU A 118 2.416 -7.946 -5.211 1.00 0.00 C ATOM 1848 CD1 LEU A 118 0.924 -8.036 -5.491 1.00 0.00 C ATOM 1849 CD2 LEU A 118 2.703 -6.864 -4.181 1.00 0.00 C ATOM 0 H LEU A 118 4.754 -8.305 -6.230 1.00 0.00 H new ATOM 0 HA LEU A 118 4.628 -9.047 -3.407 1.00 0.00 H new ATOM 0 HB2 LEU A 118 2.725 -10.045 -5.492 1.00 0.00 H new ATOM 0 HB3 LEU A 118 2.416 -9.581 -3.830 1.00 0.00 H new ATOM 0 HG LEU A 118 2.923 -7.681 -6.139 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.558 -7.067 -5.829 1.00 0.00 H new ATOM 0 HD12 LEU A 118 0.743 -8.782 -6.265 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.400 -8.324 -4.580 1.00 0.00 H new ATOM 0 HD21 LEU A 118 2.313 -5.910 -4.537 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.223 -7.123 -3.237 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.779 -6.782 -4.030 1.00 0.00 H new ATOM 1861 N ALA A 119 6.177 -10.911 -5.138 1.00 0.00 N ATOM 1862 CA ALA A 119 6.780 -12.221 -5.351 1.00 0.00 C ATOM 1863 C ALA A 119 7.446 -12.732 -4.078 1.00 0.00 C ATOM 1864 O ALA A 119 8.178 -13.721 -4.104 1.00 0.00 O ATOM 1865 CB ALA A 119 7.790 -12.158 -6.488 1.00 0.00 C ATOM 0 H ALA A 119 6.761 -10.126 -5.425 1.00 0.00 H new ATOM 0 HA ALA A 119 5.988 -12.919 -5.621 1.00 0.00 H new ATOM 0 HB1 ALA A 119 8.233 -13.143 -6.636 1.00 0.00 H new ATOM 0 HB2 ALA A 119 7.288 -11.844 -7.403 1.00 0.00 H new ATOM 0 HB3 ALA A 119 8.573 -11.442 -6.240 1.00 0.00 H new ATOM 1871 N SER A 120 7.187 -12.052 -2.966 1.00 0.00 N ATOM 1872 CA SER A 120 7.764 -12.435 -1.683 1.00 0.00 C ATOM 1873 C SER A 120 7.127 -13.720 -1.163 1.00 0.00 C ATOM 1874 O SER A 120 6.098 -14.164 -1.670 1.00 0.00 O ATOM 1875 CB SER A 120 7.582 -11.312 -0.662 1.00 0.00 C ATOM 1876 OG SER A 120 8.550 -10.293 -0.845 1.00 0.00 O ATOM 0 H SER A 120 6.581 -11.232 -2.928 1.00 0.00 H new ATOM 0 HA SER A 120 8.829 -12.612 -1.830 1.00 0.00 H new ATOM 0 HB2 SER A 120 6.582 -10.889 -0.757 1.00 0.00 H new ATOM 0 HB3 SER A 120 7.662 -11.717 0.347 1.00 0.00 H new ATOM 0 HG SER A 120 8.410 -9.586 -0.181 1.00 0.00 H new ATOM 1882 N GLU A 121 7.748 -14.312 -0.147 1.00 0.00 N ATOM 1883 CA GLU A 121 7.242 -15.546 0.442 1.00 0.00 C ATOM 1884 C GLU A 121 6.647 -15.286 1.823 1.00 0.00 C ATOM 1885 O GLU A 121 6.102 -16.190 2.456 1.00 0.00 O ATOM 1886 CB GLU A 121 8.361 -16.585 0.545 1.00 0.00 C ATOM 1887 CG GLU A 121 9.511 -16.154 1.439 1.00 0.00 C ATOM 1888 CD GLU A 121 10.541 -17.249 1.633 1.00 0.00 C ATOM 1889 OE1 GLU A 121 10.332 -18.113 2.509 1.00 0.00 O ATOM 1890 OE2 GLU A 121 11.557 -17.242 0.906 1.00 0.00 O ATOM 0 H GLU A 121 8.601 -13.957 0.285 1.00 0.00 H new ATOM 0 HA GLU A 121 6.456 -15.932 -0.207 1.00 0.00 H new ATOM 0 HB2 GLU A 121 7.945 -17.518 0.926 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.746 -16.792 -0.453 1.00 0.00 H new ATOM 0 HG2 GLU A 121 9.994 -15.278 1.006 1.00 0.00 H new ATOM 0 HG3 GLU A 121 9.118 -15.854 2.410 1.00 0.00 H new ATOM 1897 N GLU A 122 6.755 -14.043 2.283 1.00 0.00 N ATOM 1898 CA GLU A 122 6.229 -13.664 3.590 1.00 0.00 C ATOM 1899 C GLU A 122 4.964 -12.823 3.444 1.00 0.00 C ATOM 1900 O GLU A 122 4.827 -11.773 4.073 1.00 0.00 O ATOM 1901 CB GLU A 122 7.283 -12.888 4.383 1.00 0.00 C ATOM 1902 CG GLU A 122 8.427 -13.753 4.884 1.00 0.00 C ATOM 1903 CD GLU A 122 9.169 -13.123 6.047 1.00 0.00 C ATOM 1904 OE1 GLU A 122 8.577 -13.022 7.142 1.00 0.00 O ATOM 1905 OE2 GLU A 122 10.340 -12.731 5.862 1.00 0.00 O ATOM 0 H GLU A 122 7.201 -13.282 1.771 1.00 0.00 H new ATOM 0 HA GLU A 122 5.977 -14.576 4.131 1.00 0.00 H new ATOM 0 HB2 GLU A 122 7.687 -12.095 3.754 1.00 0.00 H new ATOM 0 HB3 GLU A 122 6.803 -12.406 5.235 1.00 0.00 H new ATOM 0 HG2 GLU A 122 8.037 -14.724 5.190 1.00 0.00 H new ATOM 0 HG3 GLU A 122 9.126 -13.934 4.067 1.00 0.00 H new ATOM 1912 N LEU A 123 4.043 -13.292 2.609 1.00 0.00 N ATOM 1913 CA LEU A 123 2.788 -12.583 2.379 1.00 0.00 C ATOM 1914 C LEU A 123 1.720 -13.032 3.371 1.00 0.00 C ATOM 1915 O LEU A 123 1.105 -12.210 4.050 1.00 0.00 O ATOM 1916 CB LEU A 123 2.303 -12.818 0.948 1.00 0.00 C ATOM 1917 CG LEU A 123 2.847 -11.858 -0.111 1.00 0.00 C ATOM 1918 CD1 LEU A 123 2.545 -12.378 -1.508 1.00 0.00 C ATOM 1919 CD2 LEU A 123 2.263 -10.466 0.080 1.00 0.00 C ATOM 0 H LEU A 123 4.141 -14.159 2.081 1.00 0.00 H new ATOM 0 HA LEU A 123 2.968 -11.518 2.525 1.00 0.00 H new ATOM 0 HB2 LEU A 123 2.568 -13.835 0.658 1.00 0.00 H new ATOM 0 HB3 LEU A 123 1.215 -12.757 0.940 1.00 0.00 H new ATOM 0 HG LEU A 123 3.929 -11.795 0.005 1.00 0.00 H new ATOM 0 HD11 LEU A 123 2.939 -11.682 -2.248 1.00 0.00 H new ATOM 0 HD12 LEU A 123 3.012 -13.354 -1.642 1.00 0.00 H new ATOM 0 HD13 LEU A 123 1.467 -12.471 -1.636 1.00 0.00 H new ATOM 0 HD21 LEU A 123 2.661 -9.797 -0.682 1.00 0.00 H new ATOM 0 HD22 LEU A 123 1.178 -10.512 -0.008 1.00 0.00 H new ATOM 0 HD23 LEU A 123 2.531 -10.091 1.068 1.00 0.00 H new ATOM 1931 N ALA A 124 1.506 -14.341 3.450 1.00 0.00 N ATOM 1932 CA ALA A 124 0.515 -14.899 4.362 1.00 0.00 C ATOM 1933 C ALA A 124 0.481 -14.126 5.676 1.00 0.00 C ATOM 1934 O ALA A 124 -0.580 -13.940 6.271 1.00 0.00 O ATOM 1935 CB ALA A 124 0.805 -16.371 4.620 1.00 0.00 C ATOM 0 H ALA A 124 2.005 -15.035 2.894 1.00 0.00 H new ATOM 0 HA ALA A 124 -0.465 -14.810 3.893 1.00 0.00 H new ATOM 0 HB1 ALA A 124 0.057 -16.775 5.303 1.00 0.00 H new ATOM 0 HB2 ALA A 124 0.771 -16.919 3.678 1.00 0.00 H new ATOM 0 HB3 ALA A 124 1.795 -16.474 5.064 1.00 0.00 H new ATOM 1941 N LYS A 125 1.649 -13.679 6.125 1.00 0.00 N ATOM 1942 CA LYS A 125 1.754 -12.926 7.368 1.00 0.00 C ATOM 1943 C LYS A 125 1.407 -11.457 7.146 1.00 0.00 C ATOM 1944 O LYS A 125 0.656 -10.863 7.918 1.00 0.00 O ATOM 1945 CB LYS A 125 3.167 -13.046 7.944 1.00 0.00 C ATOM 1946 CG LYS A 125 3.424 -14.361 8.658 1.00 0.00 C ATOM 1947 CD LYS A 125 4.760 -14.351 9.383 1.00 0.00 C ATOM 1948 CE LYS A 125 5.197 -15.757 9.765 1.00 0.00 C ATOM 1949 NZ LYS A 125 5.870 -16.455 8.635 1.00 0.00 N ATOM 0 H LYS A 125 2.537 -13.826 5.645 1.00 0.00 H new ATOM 0 HA LYS A 125 1.042 -13.346 8.078 1.00 0.00 H new ATOM 0 HB2 LYS A 125 3.890 -12.934 7.136 1.00 0.00 H new ATOM 0 HB3 LYS A 125 3.337 -12.225 8.640 1.00 0.00 H new ATOM 0 HG2 LYS A 125 2.623 -14.551 9.372 1.00 0.00 H new ATOM 0 HG3 LYS A 125 3.407 -15.177 7.936 1.00 0.00 H new ATOM 0 HD2 LYS A 125 5.517 -13.894 8.746 1.00 0.00 H new ATOM 0 HD3 LYS A 125 4.684 -13.736 10.280 1.00 0.00 H new ATOM 0 HE2 LYS A 125 5.875 -15.708 10.617 1.00 0.00 H new ATOM 0 HE3 LYS A 125 4.328 -16.334 10.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 6.153 -17.410 8.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 5.215 -16.525 7.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 6.714 -15.918 8.349 1.00 0.00 H new ATOM 1963 N GLY A 126 1.959 -10.878 6.084 1.00 0.00 N ATOM 1964 CA GLY A 126 1.695 -9.484 5.778 1.00 0.00 C ATOM 1965 C GLY A 126 2.693 -8.548 6.430 1.00 0.00 C ATOM 1966 O GLY A 126 3.292 -8.883 7.452 1.00 0.00 O ATOM 0 H GLY A 126 2.584 -11.349 5.430 1.00 0.00 H new ATOM 0 HA2 GLY A 126 1.720 -9.341 4.698 1.00 0.00 H new ATOM 0 HA3 GLY A 126 0.689 -9.226 6.110 1.00 0.00 H new ATOM 1970 N TRP A 127 2.874 -7.373 5.838 1.00 0.00 N ATOM 1971 CA TRP A 127 3.808 -6.387 6.367 1.00 0.00 C ATOM 1972 C TRP A 127 3.303 -4.970 6.119 1.00 0.00 C ATOM 1973 O TRP A 127 2.509 -4.733 5.207 1.00 0.00 O ATOM 1974 CB TRP A 127 5.188 -6.567 5.731 1.00 0.00 C ATOM 1975 CG TRP A 127 5.232 -6.171 4.286 1.00 0.00 C ATOM 1976 CD1 TRP A 127 5.447 -4.919 3.786 1.00 0.00 C ATOM 1977 CD2 TRP A 127 5.055 -7.032 3.156 1.00 0.00 C ATOM 1978 NE1 TRP A 127 5.414 -4.949 2.413 1.00 0.00 N ATOM 1979 CE2 TRP A 127 5.177 -6.234 2.002 1.00 0.00 C ATOM 1980 CE3 TRP A 127 4.809 -8.399 3.006 1.00 0.00 C ATOM 1981 CZ2 TRP A 127 5.058 -6.759 0.718 1.00 0.00 C ATOM 1982 CZ3 TRP A 127 4.691 -8.919 1.731 1.00 0.00 C ATOM 1983 CH2 TRP A 127 4.817 -8.101 0.601 1.00 0.00 C ATOM 0 H TRP A 127 2.386 -7.080 4.991 1.00 0.00 H new ATOM 0 HA TRP A 127 3.888 -6.542 7.443 1.00 0.00 H new ATOM 0 HB2 TRP A 127 5.916 -5.974 6.285 1.00 0.00 H new ATOM 0 HB3 TRP A 127 5.490 -7.610 5.824 1.00 0.00 H new ATOM 0 HD1 TRP A 127 5.618 -4.035 4.382 1.00 0.00 H new ATOM 0 HE1 TRP A 127 5.545 -4.145 1.799 1.00 0.00 H new ATOM 0 HE3 TRP A 127 4.713 -9.038 3.871 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 5.153 -6.130 -0.155 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 4.498 -9.974 1.604 1.00 0.00 H new ATOM 0 HH2 TRP A 127 4.722 -8.538 -0.382 1.00 0.00 H new ATOM 1994 N THR A 128 3.766 -4.029 6.936 1.00 0.00 N ATOM 1995 CA THR A 128 3.360 -2.635 6.805 1.00 0.00 C ATOM 1996 C THR A 128 4.572 -1.713 6.741 1.00 0.00 C ATOM 1997 O THR A 128 5.453 -1.772 7.598 1.00 0.00 O ATOM 1998 CB THR A 128 2.459 -2.201 7.977 1.00 0.00 C ATOM 1999 OG1 THR A 128 1.293 -3.029 8.031 1.00 0.00 O ATOM 2000 CG2 THR A 128 2.046 -0.744 7.830 1.00 0.00 C ATOM 0 H THR A 128 4.423 -4.207 7.696 1.00 0.00 H new ATOM 0 HA THR A 128 2.798 -2.555 5.875 1.00 0.00 H new ATOM 0 HB THR A 128 3.025 -2.311 8.902 1.00 0.00 H new ATOM 0 HG1 THR A 128 0.726 -2.748 8.779 1.00 0.00 H new ATOM 0 HG21 THR A 128 1.410 -0.460 8.669 1.00 0.00 H new ATOM 0 HG22 THR A 128 2.935 -0.113 7.818 1.00 0.00 H new ATOM 0 HG23 THR A 128 1.496 -0.614 6.898 1.00 0.00 H new ATOM 2008 N GLN A 129 4.609 -0.862 5.721 1.00 0.00 N ATOM 2009 CA GLN A 129 5.714 0.074 5.547 1.00 0.00 C ATOM 2010 C GLN A 129 5.321 1.211 4.610 1.00 0.00 C ATOM 2011 O GLN A 129 4.297 1.143 3.930 1.00 0.00 O ATOM 2012 CB GLN A 129 6.943 -0.653 4.999 1.00 0.00 C ATOM 2013 CG GLN A 129 6.913 -0.848 3.492 1.00 0.00 C ATOM 2014 CD GLN A 129 8.223 -1.382 2.946 1.00 0.00 C ATOM 2015 OE1 GLN A 129 9.209 -0.653 2.842 1.00 0.00 O ATOM 2016 NE2 GLN A 129 8.239 -2.663 2.594 1.00 0.00 N ATOM 0 H GLN A 129 3.887 -0.801 5.003 1.00 0.00 H new ATOM 0 HA GLN A 129 5.956 0.498 6.522 1.00 0.00 H new ATOM 0 HB2 GLN A 129 7.837 -0.090 5.266 1.00 0.00 H new ATOM 0 HB3 GLN A 129 7.024 -1.627 5.481 1.00 0.00 H new ATOM 0 HG2 GLN A 129 6.109 -1.537 3.235 1.00 0.00 H new ATOM 0 HG3 GLN A 129 6.684 0.103 3.011 1.00 0.00 H new ATOM 0 HE21 GLN A 129 7.398 -3.231 2.697 1.00 0.00 H new ATOM 0 HE22 GLN A 129 9.092 -3.079 2.220 1.00 0.00 H new ATOM 2025 N TRP A 130 6.142 2.255 4.580 1.00 0.00 N ATOM 2026 CA TRP A 130 5.880 3.408 3.726 1.00 0.00 C ATOM 2027 C TRP A 130 6.687 3.325 2.435 1.00 0.00 C ATOM 2028 O TRP A 130 7.914 3.227 2.465 1.00 0.00 O ATOM 2029 CB TRP A 130 6.212 4.704 4.468 1.00 0.00 C ATOM 2030 CG TRP A 130 5.228 5.040 5.547 1.00 0.00 C ATOM 2031 CD1 TRP A 130 5.252 4.605 6.841 1.00 0.00 C ATOM 2032 CD2 TRP A 130 4.076 5.881 5.424 1.00 0.00 C ATOM 2033 NE1 TRP A 130 4.182 5.125 7.531 1.00 0.00 N ATOM 2034 CE2 TRP A 130 3.446 5.911 6.684 1.00 0.00 C ATOM 2035 CE3 TRP A 130 3.515 6.612 4.374 1.00 0.00 C ATOM 2036 CZ2 TRP A 130 2.285 6.643 6.918 1.00 0.00 C ATOM 2037 CZ3 TRP A 130 2.362 7.337 4.608 1.00 0.00 C ATOM 2038 CH2 TRP A 130 1.758 7.349 5.872 1.00 0.00 C ATOM 0 H TRP A 130 6.994 2.327 5.137 1.00 0.00 H new ATOM 0 HA TRP A 130 4.821 3.405 3.470 1.00 0.00 H new ATOM 0 HB2 TRP A 130 7.206 4.618 4.907 1.00 0.00 H new ATOM 0 HB3 TRP A 130 6.249 5.525 3.752 1.00 0.00 H new ATOM 0 HD1 TRP A 130 6.001 3.949 7.261 1.00 0.00 H new ATOM 0 HE1 TRP A 130 3.971 4.953 8.514 1.00 0.00 H new ATOM 0 HE3 TRP A 130 3.974 6.611 3.397 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 1.817 6.653 7.891 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 1.919 7.904 3.803 1.00 0.00 H new ATOM 0 HH2 TRP A 130 0.858 7.927 6.023 1.00 0.00 H new ATOM 2049 N TYR A 131 5.992 3.364 1.304 1.00 0.00 N ATOM 2050 CA TYR A 131 6.645 3.290 0.003 1.00 0.00 C ATOM 2051 C TYR A 131 6.870 4.685 -0.574 1.00 0.00 C ATOM 2052 O TYR A 131 5.940 5.322 -1.068 1.00 0.00 O ATOM 2053 CB TYR A 131 5.806 2.455 -0.966 1.00 0.00 C ATOM 2054 CG TYR A 131 5.491 1.068 -0.453 1.00 0.00 C ATOM 2055 CD1 TYR A 131 6.496 0.237 0.026 1.00 0.00 C ATOM 2056 CD2 TYR A 131 4.186 0.590 -0.446 1.00 0.00 C ATOM 2057 CE1 TYR A 131 6.212 -1.031 0.494 1.00 0.00 C ATOM 2058 CE2 TYR A 131 3.893 -0.677 0.023 1.00 0.00 C ATOM 2059 CZ TYR A 131 4.909 -1.483 0.491 1.00 0.00 C ATOM 2060 OH TYR A 131 4.622 -2.745 0.959 1.00 0.00 O ATOM 0 H TYR A 131 4.976 3.446 1.262 1.00 0.00 H new ATOM 0 HA TYR A 131 7.615 2.811 0.139 1.00 0.00 H new ATOM 0 HB2 TYR A 131 4.872 2.979 -1.169 1.00 0.00 H new ATOM 0 HB3 TYR A 131 6.337 2.371 -1.914 1.00 0.00 H new ATOM 0 HD1 TYR A 131 7.517 0.589 0.033 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.388 1.218 -0.813 1.00 0.00 H new ATOM 0 HE1 TYR A 131 7.006 -1.665 0.860 1.00 0.00 H new ATOM 0 HE2 TYR A 131 2.874 -1.034 0.023 1.00 0.00 H new ATOM 0 HH TYR A 131 3.658 -2.825 1.115 1.00 0.00 H new ATOM 2070 N ASP A 132 8.112 5.153 -0.506 1.00 0.00 N ATOM 2071 CA ASP A 132 8.461 6.471 -1.022 1.00 0.00 C ATOM 2072 C ASP A 132 8.264 6.532 -2.534 1.00 0.00 C ATOM 2073 O ASP A 132 8.923 5.813 -3.286 1.00 0.00 O ATOM 2074 CB ASP A 132 9.910 6.812 -0.670 1.00 0.00 C ATOM 2075 CG ASP A 132 10.248 6.484 0.771 1.00 0.00 C ATOM 2076 OD1 ASP A 132 9.368 6.656 1.640 1.00 0.00 O ATOM 2077 OD2 ASP A 132 11.392 6.056 1.030 1.00 0.00 O ATOM 0 H ASP A 132 8.893 4.639 -0.099 1.00 0.00 H new ATOM 0 HA ASP A 132 7.800 7.203 -0.558 1.00 0.00 H new ATOM 0 HB2 ASP A 132 10.580 6.263 -1.331 1.00 0.00 H new ATOM 0 HB3 ASP A 132 10.084 7.873 -0.849 1.00 0.00 H new ATOM 2082 N LEU A 133 7.354 7.395 -2.972 1.00 0.00 N ATOM 2083 CA LEU A 133 7.069 7.550 -4.394 1.00 0.00 C ATOM 2084 C LEU A 133 8.285 8.094 -5.137 1.00 0.00 C ATOM 2085 O LEU A 133 9.128 8.778 -4.555 1.00 0.00 O ATOM 2086 CB LEU A 133 5.874 8.483 -4.596 1.00 0.00 C ATOM 2087 CG LEU A 133 4.549 8.017 -3.993 1.00 0.00 C ATOM 2088 CD1 LEU A 133 3.547 9.161 -3.957 1.00 0.00 C ATOM 2089 CD2 LEU A 133 3.989 6.840 -4.778 1.00 0.00 C ATOM 0 H LEU A 133 6.801 7.998 -2.363 1.00 0.00 H new ATOM 0 HA LEU A 133 6.828 6.568 -4.800 1.00 0.00 H new ATOM 0 HB2 LEU A 133 6.122 9.455 -4.170 1.00 0.00 H new ATOM 0 HB3 LEU A 133 5.731 8.631 -5.666 1.00 0.00 H new ATOM 0 HG LEU A 133 4.734 7.690 -2.970 1.00 0.00 H new ATOM 0 HD11 LEU A 133 2.610 8.810 -3.525 1.00 0.00 H new ATOM 0 HD12 LEU A 133 3.945 9.974 -3.350 1.00 0.00 H new ATOM 0 HD13 LEU A 133 3.367 9.519 -4.971 1.00 0.00 H new ATOM 0 HD21 LEU A 133 3.046 6.522 -4.334 1.00 0.00 H new ATOM 0 HD22 LEU A 133 3.820 7.140 -5.812 1.00 0.00 H new ATOM 0 HD23 LEU A 133 4.699 6.014 -4.751 1.00 0.00 H new ATOM 2101 N THR A 134 8.369 7.788 -6.428 1.00 0.00 N ATOM 2102 CA THR A 134 9.481 8.246 -7.251 1.00 0.00 C ATOM 2103 C THR A 134 9.004 8.660 -8.639 1.00 0.00 C ATOM 2104 O THR A 134 7.822 8.540 -8.959 1.00 0.00 O ATOM 2105 CB THR A 134 10.560 7.156 -7.396 1.00 0.00 C ATOM 2106 OG1 THR A 134 10.021 6.021 -8.082 1.00 0.00 O ATOM 2107 CG2 THR A 134 11.084 6.729 -6.033 1.00 0.00 C ATOM 0 H THR A 134 7.680 7.225 -6.926 1.00 0.00 H new ATOM 0 HA THR A 134 9.913 9.109 -6.745 1.00 0.00 H new ATOM 0 HB THR A 134 11.387 7.569 -7.973 1.00 0.00 H new ATOM 0 HG1 THR A 134 10.714 5.333 -8.171 1.00 0.00 H new ATOM 0 HG21 THR A 134 11.845 5.959 -6.161 1.00 0.00 H new ATOM 0 HG22 THR A 134 11.520 7.589 -5.525 1.00 0.00 H new ATOM 0 HG23 THR A 134 10.263 6.333 -5.435 1.00 0.00 H new ATOM 2115 N GLU A 135 9.931 9.147 -9.458 1.00 0.00 N ATOM 2116 CA GLU A 135 9.603 9.578 -10.811 1.00 0.00 C ATOM 2117 C GLU A 135 9.397 8.377 -11.730 1.00 0.00 C ATOM 2118 O GLU A 135 9.770 7.254 -11.394 1.00 0.00 O ATOM 2119 CB GLU A 135 10.712 10.475 -11.367 1.00 0.00 C ATOM 2120 CG GLU A 135 10.949 11.730 -10.545 1.00 0.00 C ATOM 2121 CD GLU A 135 12.219 12.457 -10.943 1.00 0.00 C ATOM 2122 OE1 GLU A 135 12.454 12.618 -12.159 1.00 0.00 O ATOM 2123 OE2 GLU A 135 12.977 12.865 -10.039 1.00 0.00 O ATOM 0 H GLU A 135 10.914 9.253 -9.208 1.00 0.00 H new ATOM 0 HA GLU A 135 8.673 10.145 -10.769 1.00 0.00 H new ATOM 0 HB2 GLU A 135 11.639 9.904 -11.418 1.00 0.00 H new ATOM 0 HB3 GLU A 135 10.458 10.762 -12.388 1.00 0.00 H new ATOM 0 HG2 GLU A 135 10.099 12.402 -10.661 1.00 0.00 H new ATOM 0 HG3 GLU A 135 11.003 11.464 -9.489 1.00 0.00 H new ATOM 2130 N ASP A 136 8.799 8.624 -12.890 1.00 0.00 N ATOM 2131 CA ASP A 136 8.542 7.564 -13.859 1.00 0.00 C ATOM 2132 C ASP A 136 9.850 6.969 -14.372 1.00 0.00 C ATOM 2133 O ASP A 136 10.934 7.442 -14.033 1.00 0.00 O ATOM 2134 CB ASP A 136 7.718 8.102 -15.029 1.00 0.00 C ATOM 2135 CG ASP A 136 8.430 9.214 -15.776 1.00 0.00 C ATOM 2136 OD1 ASP A 136 8.437 10.356 -15.272 1.00 0.00 O ATOM 2137 OD2 ASP A 136 8.979 8.941 -16.864 1.00 0.00 O ATOM 0 H ASP A 136 8.483 9.549 -13.183 1.00 0.00 H new ATOM 0 HA ASP A 136 7.977 6.777 -13.359 1.00 0.00 H new ATOM 0 HB2 ASP A 136 7.498 7.288 -15.719 1.00 0.00 H new ATOM 0 HB3 ASP A 136 6.763 8.472 -14.657 1.00 0.00 H new