USER MOD reduce.3.24.130724 H: found=0, std=0, add=1078, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1077 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 76 TYR OH : rot 13:sc= 0.422 USER MOD Set 1.2: A 103 HIS : no HD1:sc= -1.72 K(o=-7.8,f=-15!) USER MOD Set 1.3: A 104 CYS SG : rot -4:sc= 0.588 USER MOD Set 1.4: A 107 ASN : amide:sc= -7.1! C(o=-7.8!,f=-16!) USER MOD Set 2.1: A 100 MET CE :methyl -165:sc= -1.69 (180deg=-1.52) USER MOD Set 2.2: A 114 MET CE :methyl -116:sc= -0.152 (180deg=-3.06!) USER MOD Set 3.1: A 90 TYR OH : rot -90:sc= 1.16 USER MOD Set 3.2: A 128 ASN :FLIP amide:sc= 0.988 F(o=0.14,f=2.1) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 CYS SG : rot 125:sc= 0.15 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 HIS : no HD1:sc= -1.16 X(o=-1.2,f=-1.2) USER MOD Single : A 30 CYS SG : rot 29:sc= 0.106 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 CYS SG : rot 7:sc= -0.71 USER MOD Single : A 37 MET CE :methyl -165:sc= -0.0823 (180deg=-0.443) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ -118:sc= -0.694 (180deg=-2.09) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc= -0.026 X(o=-0.026,f=-0.41) USER MOD Single : A 57 ASN : amide:sc= -0.198 K(o=-0.2,f=-1.3!) USER MOD Single : A 58 GLN : amide:sc= -0.735 K(o=-0.74,f=-9.3!) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ -127:sc= 0.188 (180deg=0.00302) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 172:sc= -0.008 (180deg=-0.112) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 177:sc= 1.56 USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 155:sc= -0.103 (180deg=-0.546) USER MOD Single : A 82 LYS NZ :NH3+ 150:sc= -0.253 (180deg=-0.991) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 HIS : no HD1:sc= 0.00845 K(o=0.0084,f=-1.5!) USER MOD Single : A 87 LYS NZ :NH3+ 175:sc= 0.639 (180deg=0.622) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -0.0748 K(o=-0.075,f=-1.6!) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 74:sc= 0.488 USER MOD Single : A 101 LYS NZ :NH3+ -137:sc= -0.0235 (180deg=-2.28!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ -157:sc= -0.129 (180deg=-0.574) USER MOD Single : A 110 THR OG1 : rot 60:sc= 0.0154 USER MOD Single : A 113 SER OG : rot -60:sc= -1.1! USER MOD Single : A 125 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 130 SER OG : rot -87:sc= 1.2 USER MOD Single : A 132 MET CE :methyl 145:sc= -1.26 (180deg=-3.25) USER MOD Single : A 140 THR OG1 : rot -29:sc= 1.01 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 THR OG1 : rot 29:sc= 0.846 USER MOD ----------------------------------------------------------------- ATOM 108 N ILE A 11 11.325 -4.294 5.167 1.00 0.00 N ATOM 109 CA ILE A 11 11.319 -3.106 4.323 1.00 0.00 C ATOM 110 C ILE A 11 12.717 -2.803 3.793 1.00 0.00 C ATOM 111 O ILE A 11 13.673 -2.688 4.560 1.00 0.00 O ATOM 112 CB ILE A 11 10.793 -1.876 5.085 1.00 0.00 C ATOM 113 CG1 ILE A 11 9.368 -2.128 5.582 1.00 0.00 C ATOM 114 CG2 ILE A 11 10.839 -0.642 4.196 1.00 0.00 C ATOM 115 CD1 ILE A 11 8.857 -1.057 6.520 1.00 0.00 C ATOM 0 HA ILE A 11 10.653 -3.316 3.486 1.00 0.00 H new ATOM 0 HB ILE A 11 11.434 -1.701 5.949 1.00 0.00 H new ATOM 0 HG12 ILE A 11 8.699 -2.197 4.724 1.00 0.00 H new ATOM 0 HG13 ILE A 11 9.334 -3.091 6.091 1.00 0.00 H new ATOM 0 HG21 ILE A 11 10.464 0.219 4.749 1.00 0.00 H new ATOM 0 HG22 ILE A 11 11.867 -0.455 3.887 1.00 0.00 H new ATOM 0 HG23 ILE A 11 10.219 -0.805 3.315 1.00 0.00 H new ATOM 0 HD11 ILE A 11 7.842 -1.301 6.832 1.00 0.00 H new ATOM 0 HD12 ILE A 11 9.503 -1.003 7.396 1.00 0.00 H new ATOM 0 HD13 ILE A 11 8.858 -0.095 6.008 1.00 0.00 H new ATOM 127 N THR A 12 12.828 -2.671 2.474 1.00 0.00 N ATOM 128 CA THR A 12 14.108 -2.380 1.840 1.00 0.00 C ATOM 129 C THR A 12 14.008 -1.156 0.938 1.00 0.00 C ATOM 130 O THR A 12 13.023 -0.979 0.221 1.00 0.00 O ATOM 131 CB THR A 12 14.609 -3.577 1.010 1.00 0.00 C ATOM 132 OG1 THR A 12 14.780 -4.721 1.854 1.00 0.00 O ATOM 133 CG2 THR A 12 15.925 -3.245 0.323 1.00 0.00 C ATOM 0 H THR A 12 12.047 -2.761 1.825 1.00 0.00 H new ATOM 0 HA THR A 12 14.820 -2.180 2.641 1.00 0.00 H new ATOM 0 HB THR A 12 13.864 -3.799 0.246 1.00 0.00 H new ATOM 0 HG1 THR A 12 15.097 -5.478 1.319 1.00 0.00 H new ATOM 0 HG21 THR A 12 16.260 -4.105 -0.257 1.00 0.00 H new ATOM 0 HG22 THR A 12 15.784 -2.392 -0.341 1.00 0.00 H new ATOM 0 HG23 THR A 12 16.676 -3.000 1.074 1.00 0.00 H new ATOM 141 N TYR A 13 15.034 -0.313 0.977 1.00 0.00 N ATOM 142 CA TYR A 13 15.061 0.896 0.163 1.00 0.00 C ATOM 143 C TYR A 13 16.013 0.736 -1.019 1.00 0.00 C ATOM 144 O TYR A 13 17.196 0.446 -0.844 1.00 0.00 O ATOM 145 CB TYR A 13 15.481 2.098 1.011 1.00 0.00 C ATOM 146 CG TYR A 13 14.756 2.187 2.335 1.00 0.00 C ATOM 147 CD1 TYR A 13 13.443 2.638 2.401 1.00 0.00 C ATOM 148 CD2 TYR A 13 15.383 1.822 3.519 1.00 0.00 C ATOM 149 CE1 TYR A 13 12.777 2.723 3.608 1.00 0.00 C ATOM 150 CE2 TYR A 13 14.724 1.902 4.731 1.00 0.00 C ATOM 151 CZ TYR A 13 13.421 2.353 4.770 1.00 0.00 C ATOM 152 OH TYR A 13 12.762 2.435 5.975 1.00 0.00 O ATOM 0 H TYR A 13 15.858 -0.445 1.564 1.00 0.00 H new ATOM 0 HA TYR A 13 14.056 1.066 -0.223 1.00 0.00 H new ATOM 0 HB2 TYR A 13 16.554 2.044 1.196 1.00 0.00 H new ATOM 0 HB3 TYR A 13 15.301 3.012 0.445 1.00 0.00 H new ATOM 0 HD1 TYR A 13 12.935 2.927 1.493 1.00 0.00 H new ATOM 0 HD2 TYR A 13 16.403 1.469 3.492 1.00 0.00 H new ATOM 0 HE1 TYR A 13 11.757 3.077 3.642 1.00 0.00 H new ATOM 0 HE2 TYR A 13 15.226 1.613 5.642 1.00 0.00 H new ATOM 0 HH TYR A 13 13.357 2.136 6.694 1.00 0.00 H new ATOM 162 N VAL A 14 15.487 0.930 -2.225 1.00 0.00 N ATOM 163 CA VAL A 14 16.288 0.809 -3.437 1.00 0.00 C ATOM 164 C VAL A 14 16.345 2.133 -4.191 1.00 0.00 C ATOM 165 O VAL A 14 15.458 2.976 -4.058 1.00 0.00 O ATOM 166 CB VAL A 14 15.729 -0.279 -4.373 1.00 0.00 C ATOM 167 CG1 VAL A 14 16.512 -0.315 -5.676 1.00 0.00 C ATOM 168 CG2 VAL A 14 15.755 -1.636 -3.687 1.00 0.00 C ATOM 0 H VAL A 14 14.510 1.172 -2.388 1.00 0.00 H new ATOM 0 HA VAL A 14 17.294 0.527 -3.126 1.00 0.00 H new ATOM 0 HB VAL A 14 14.692 -0.036 -4.607 1.00 0.00 H new ATOM 0 HG11 VAL A 14 16.103 -1.090 -6.325 1.00 0.00 H new ATOM 0 HG12 VAL A 14 16.436 0.652 -6.173 1.00 0.00 H new ATOM 0 HG13 VAL A 14 17.559 -0.533 -5.465 1.00 0.00 H new ATOM 0 HG21 VAL A 14 15.357 -2.393 -4.363 1.00 0.00 H new ATOM 0 HG22 VAL A 14 16.781 -1.890 -3.422 1.00 0.00 H new ATOM 0 HG23 VAL A 14 15.146 -1.599 -2.784 1.00 0.00 H new ATOM 178 N LYS A 15 17.396 2.310 -4.985 1.00 0.00 N ATOM 179 CA LYS A 15 17.571 3.530 -5.763 1.00 0.00 C ATOM 180 C LYS A 15 17.381 3.258 -7.252 1.00 0.00 C ATOM 181 O LYS A 15 17.978 2.335 -7.805 1.00 0.00 O ATOM 182 CB LYS A 15 18.960 4.123 -5.516 1.00 0.00 C ATOM 183 CG LYS A 15 19.220 5.405 -6.288 1.00 0.00 C ATOM 184 CD LYS A 15 20.185 6.316 -5.548 1.00 0.00 C ATOM 185 CE LYS A 15 20.366 7.641 -6.271 1.00 0.00 C ATOM 186 NZ LYS A 15 19.304 8.621 -5.910 1.00 0.00 N ATOM 0 H LYS A 15 18.140 1.623 -5.106 1.00 0.00 H new ATOM 0 HA LYS A 15 16.815 4.246 -5.443 1.00 0.00 H new ATOM 0 HB2 LYS A 15 19.077 4.320 -4.450 1.00 0.00 H new ATOM 0 HB3 LYS A 15 19.715 3.385 -5.789 1.00 0.00 H new ATOM 0 HG2 LYS A 15 19.627 5.163 -7.270 1.00 0.00 H new ATOM 0 HG3 LYS A 15 18.278 5.929 -6.453 1.00 0.00 H new ATOM 0 HD2 LYS A 15 19.814 6.498 -4.539 1.00 0.00 H new ATOM 0 HD3 LYS A 15 21.151 5.820 -5.448 1.00 0.00 H new ATOM 0 HE2 LYS A 15 21.343 8.058 -6.026 1.00 0.00 H new ATOM 0 HE3 LYS A 15 20.353 7.472 -7.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 19.464 9.511 -6.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 18.373 8.235 -6.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 19.333 8.803 -4.886 1.00 0.00 H new ATOM 200 N GLY A 16 16.546 4.068 -7.896 1.00 0.00 N ATOM 201 CA GLY A 16 16.294 3.899 -9.315 1.00 0.00 C ATOM 202 C GLY A 16 14.817 3.771 -9.630 1.00 0.00 C ATOM 203 O GLY A 16 13.969 3.996 -8.766 1.00 0.00 O ATOM 0 H GLY A 16 16.039 4.838 -7.460 1.00 0.00 H new ATOM 0 HA2 GLY A 16 16.706 4.750 -9.858 1.00 0.00 H new ATOM 0 HA3 GLY A 16 16.817 3.011 -9.670 1.00 0.00 H new ATOM 207 N ASP A 17 14.507 3.411 -10.870 1.00 0.00 N ATOM 208 CA ASP A 17 13.122 3.255 -11.298 1.00 0.00 C ATOM 209 C ASP A 17 12.314 2.489 -10.255 1.00 0.00 C ATOM 210 O ASP A 17 12.875 1.890 -9.337 1.00 0.00 O ATOM 211 CB ASP A 17 13.059 2.529 -12.643 1.00 0.00 C ATOM 212 CG ASP A 17 14.170 2.955 -13.583 1.00 0.00 C ATOM 213 OD1 ASP A 17 13.997 3.976 -14.280 1.00 0.00 O ATOM 214 OD2 ASP A 17 15.212 2.267 -13.622 1.00 0.00 O ATOM 0 H ASP A 17 15.197 3.222 -11.597 1.00 0.00 H new ATOM 0 HA ASP A 17 12.689 4.249 -11.410 1.00 0.00 H new ATOM 0 HB2 ASP A 17 13.121 1.454 -12.476 1.00 0.00 H new ATOM 0 HB3 ASP A 17 12.095 2.723 -13.113 1.00 0.00 H new ATOM 219 N LEU A 18 10.994 2.514 -10.401 1.00 0.00 N ATOM 220 CA LEU A 18 10.108 1.822 -9.471 1.00 0.00 C ATOM 221 C LEU A 18 9.252 0.791 -10.199 1.00 0.00 C ATOM 222 O LEU A 18 8.787 -0.179 -9.600 1.00 0.00 O ATOM 223 CB LEU A 18 9.210 2.828 -8.748 1.00 0.00 C ATOM 224 CG LEU A 18 7.925 2.265 -8.141 1.00 0.00 C ATOM 225 CD1 LEU A 18 8.236 1.093 -7.224 1.00 0.00 C ATOM 226 CD2 LEU A 18 7.172 3.350 -7.385 1.00 0.00 C ATOM 0 H LEU A 18 10.513 3.006 -11.154 1.00 0.00 H new ATOM 0 HA LEU A 18 10.725 1.302 -8.738 1.00 0.00 H new ATOM 0 HB2 LEU A 18 9.790 3.296 -7.952 1.00 0.00 H new ATOM 0 HB3 LEU A 18 8.941 3.616 -9.452 1.00 0.00 H new ATOM 0 HG LEU A 18 7.290 1.907 -8.952 1.00 0.00 H new ATOM 0 HD11 LEU A 18 7.309 0.706 -6.801 1.00 0.00 H new ATOM 0 HD12 LEU A 18 8.731 0.307 -7.794 1.00 0.00 H new ATOM 0 HD13 LEU A 18 8.891 1.425 -6.419 1.00 0.00 H new ATOM 0 HD21 LEU A 18 6.260 2.931 -6.960 1.00 0.00 H new ATOM 0 HD22 LEU A 18 7.801 3.739 -6.584 1.00 0.00 H new ATOM 0 HD23 LEU A 18 6.915 4.159 -8.069 1.00 0.00 H new ATOM 238 N PHE A 19 9.050 1.005 -11.494 1.00 0.00 N ATOM 239 CA PHE A 19 8.251 0.093 -12.305 1.00 0.00 C ATOM 240 C PHE A 19 9.129 -0.663 -13.297 1.00 0.00 C ATOM 241 O PHE A 19 8.842 -1.807 -13.649 1.00 0.00 O ATOM 242 CB PHE A 19 7.162 0.864 -13.054 1.00 0.00 C ATOM 243 CG PHE A 19 6.608 2.025 -12.279 1.00 0.00 C ATOM 244 CD1 PHE A 19 6.071 1.838 -11.015 1.00 0.00 C ATOM 245 CD2 PHE A 19 6.624 3.303 -12.814 1.00 0.00 C ATOM 246 CE1 PHE A 19 5.559 2.905 -10.300 1.00 0.00 C ATOM 247 CE2 PHE A 19 6.114 4.374 -12.103 1.00 0.00 C ATOM 248 CZ PHE A 19 5.582 4.174 -10.844 1.00 0.00 C ATOM 0 H PHE A 19 9.428 1.802 -12.005 1.00 0.00 H new ATOM 0 HA PHE A 19 7.781 -0.630 -11.638 1.00 0.00 H new ATOM 0 HB2 PHE A 19 7.569 1.228 -13.997 1.00 0.00 H new ATOM 0 HB3 PHE A 19 6.349 0.181 -13.301 1.00 0.00 H new ATOM 0 HD1 PHE A 19 6.052 0.848 -10.584 1.00 0.00 H new ATOM 0 HD2 PHE A 19 7.040 3.465 -13.798 1.00 0.00 H new ATOM 0 HE1 PHE A 19 5.141 2.746 -9.317 1.00 0.00 H new ATOM 0 HE2 PHE A 19 6.132 5.365 -12.531 1.00 0.00 H new ATOM 0 HZ PHE A 19 5.185 5.009 -10.286 1.00 0.00 H new ATOM 258 N ALA A 20 10.199 -0.016 -13.745 1.00 0.00 N ATOM 259 CA ALA A 20 11.120 -0.627 -14.695 1.00 0.00 C ATOM 260 C ALA A 20 12.081 -1.580 -13.993 1.00 0.00 C ATOM 261 O ALA A 20 12.666 -2.462 -14.623 1.00 0.00 O ATOM 262 CB ALA A 20 11.893 0.447 -15.446 1.00 0.00 C ATOM 0 H ALA A 20 10.450 0.932 -13.465 1.00 0.00 H new ATOM 0 HA ALA A 20 10.535 -1.205 -15.410 1.00 0.00 H new ATOM 0 HB1 ALA A 20 12.577 -0.024 -16.152 1.00 0.00 H new ATOM 0 HB2 ALA A 20 11.195 1.086 -15.988 1.00 0.00 H new ATOM 0 HB3 ALA A 20 12.461 1.049 -14.737 1.00 0.00 H new ATOM 268 N CYS A 21 12.239 -1.397 -12.687 1.00 0.00 N ATOM 269 CA CYS A 21 13.131 -2.241 -11.899 1.00 0.00 C ATOM 270 C CYS A 21 12.557 -3.645 -11.747 1.00 0.00 C ATOM 271 O CYS A 21 13.160 -4.637 -12.158 1.00 0.00 O ATOM 272 CB CYS A 21 13.368 -1.621 -10.521 1.00 0.00 C ATOM 273 SG CYS A 21 14.846 -0.584 -10.422 1.00 0.00 S ATOM 0 H CYS A 21 11.761 -0.672 -12.151 1.00 0.00 H new ATOM 0 HA CYS A 21 14.083 -2.313 -12.425 1.00 0.00 H new ATOM 0 HB2 CYS A 21 12.498 -1.022 -10.249 1.00 0.00 H new ATOM 0 HB3 CYS A 21 13.448 -2.420 -9.784 1.00 0.00 H new ATOM 0 HG CYS A 21 14.517 0.601 -10.000 1.00 0.00 H new ATOM 279 N PRO A 22 11.364 -3.735 -11.140 1.00 0.00 N ATOM 280 CA PRO A 22 10.683 -5.014 -10.918 1.00 0.00 C ATOM 281 C PRO A 22 10.179 -5.635 -12.216 1.00 0.00 C ATOM 282 O PRO A 22 9.976 -4.940 -13.212 1.00 0.00 O ATOM 283 CB PRO A 22 9.507 -4.637 -10.014 1.00 0.00 C ATOM 284 CG PRO A 22 9.249 -3.200 -10.307 1.00 0.00 C ATOM 285 CD PRO A 22 10.588 -2.595 -10.625 1.00 0.00 C ATOM 0 HA PRO A 22 11.349 -5.761 -10.485 1.00 0.00 H new ATOM 0 HB2 PRO A 22 8.631 -5.248 -10.229 1.00 0.00 H new ATOM 0 HB3 PRO A 22 9.751 -4.789 -8.963 1.00 0.00 H new ATOM 0 HG2 PRO A 22 8.562 -3.090 -11.146 1.00 0.00 H new ATOM 0 HG3 PRO A 22 8.790 -2.704 -9.452 1.00 0.00 H new ATOM 0 HD2 PRO A 22 10.504 -1.799 -11.365 1.00 0.00 H new ATOM 0 HD3 PRO A 22 11.053 -2.160 -9.740 1.00 0.00 H new ATOM 293 N LYS A 23 9.979 -6.949 -12.200 1.00 0.00 N ATOM 294 CA LYS A 23 9.497 -7.665 -13.375 1.00 0.00 C ATOM 295 C LYS A 23 8.158 -8.338 -13.090 1.00 0.00 C ATOM 296 O LYS A 23 7.348 -8.542 -13.996 1.00 0.00 O ATOM 297 CB LYS A 23 10.522 -8.711 -13.816 1.00 0.00 C ATOM 298 CG LYS A 23 10.378 -9.129 -15.269 1.00 0.00 C ATOM 299 CD LYS A 23 11.051 -10.466 -15.534 1.00 0.00 C ATOM 300 CE LYS A 23 10.570 -11.082 -16.839 1.00 0.00 C ATOM 301 NZ LYS A 23 9.240 -11.735 -16.686 1.00 0.00 N ATOM 0 H LYS A 23 10.144 -7.540 -11.385 1.00 0.00 H new ATOM 0 HA LYS A 23 9.357 -6.942 -14.178 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.525 -8.314 -13.659 1.00 0.00 H new ATOM 0 HB3 LYS A 23 10.425 -9.592 -13.182 1.00 0.00 H new ATOM 0 HG2 LYS A 23 9.321 -9.195 -15.526 1.00 0.00 H new ATOM 0 HG3 LYS A 23 10.816 -8.366 -15.913 1.00 0.00 H new ATOM 0 HD2 LYS A 23 12.132 -10.330 -15.571 1.00 0.00 H new ATOM 0 HD3 LYS A 23 10.844 -11.149 -14.710 1.00 0.00 H new ATOM 0 HE2 LYS A 23 10.509 -10.309 -17.605 1.00 0.00 H new ATOM 0 HE3 LYS A 23 11.298 -11.816 -17.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 8.947 -12.143 -17.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 9.304 -12.490 -15.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 8.540 -11.029 -16.381 1.00 0.00 H new ATOM 315 N THR A 24 7.929 -8.680 -11.826 1.00 0.00 N ATOM 316 CA THR A 24 6.688 -9.330 -11.423 1.00 0.00 C ATOM 317 C THR A 24 6.057 -8.617 -10.232 1.00 0.00 C ATOM 318 O THR A 24 4.834 -8.585 -10.093 1.00 0.00 O ATOM 319 CB THR A 24 6.921 -10.808 -11.058 1.00 0.00 C ATOM 320 OG1 THR A 24 7.871 -10.906 -9.990 1.00 0.00 O ATOM 321 CG2 THR A 24 7.423 -11.590 -12.262 1.00 0.00 C ATOM 0 H THR A 24 8.587 -8.518 -11.064 1.00 0.00 H new ATOM 0 HA THR A 24 6.011 -9.277 -12.276 1.00 0.00 H new ATOM 0 HB THR A 24 5.970 -11.234 -10.738 1.00 0.00 H new ATOM 0 HG1 THR A 24 8.012 -11.849 -9.763 1.00 0.00 H new ATOM 0 HG21 THR A 24 7.580 -12.631 -11.980 1.00 0.00 H new ATOM 0 HG22 THR A 24 6.685 -11.539 -13.063 1.00 0.00 H new ATOM 0 HG23 THR A 24 8.364 -11.162 -12.608 1.00 0.00 H new ATOM 329 N ASP A 25 6.898 -8.047 -9.376 1.00 0.00 N ATOM 330 CA ASP A 25 6.421 -7.333 -8.197 1.00 0.00 C ATOM 331 C ASP A 25 5.241 -6.432 -8.547 1.00 0.00 C ATOM 332 O ASP A 25 5.212 -5.817 -9.612 1.00 0.00 O ATOM 333 CB ASP A 25 7.551 -6.501 -7.587 1.00 0.00 C ATOM 334 CG ASP A 25 8.406 -7.303 -6.626 1.00 0.00 C ATOM 335 OD1 ASP A 25 8.999 -8.313 -7.059 1.00 0.00 O ATOM 336 OD2 ASP A 25 8.483 -6.919 -5.440 1.00 0.00 O ATOM 0 H ASP A 25 7.913 -8.065 -9.476 1.00 0.00 H new ATOM 0 HA ASP A 25 6.087 -8.070 -7.467 1.00 0.00 H new ATOM 0 HB2 ASP A 25 8.179 -6.106 -8.385 1.00 0.00 H new ATOM 0 HB3 ASP A 25 7.126 -5.645 -7.063 1.00 0.00 H new ATOM 341 N SER A 26 4.269 -6.361 -7.644 1.00 0.00 N ATOM 342 CA SER A 26 3.083 -5.540 -7.859 1.00 0.00 C ATOM 343 C SER A 26 3.285 -4.136 -7.296 1.00 0.00 C ATOM 344 O SER A 26 4.281 -3.861 -6.624 1.00 0.00 O ATOM 345 CB SER A 26 1.861 -6.191 -7.210 1.00 0.00 C ATOM 346 OG SER A 26 1.880 -7.598 -7.382 1.00 0.00 O ATOM 0 H SER A 26 4.279 -6.862 -6.756 1.00 0.00 H new ATOM 0 HA SER A 26 2.916 -5.462 -8.933 1.00 0.00 H new ATOM 0 HB2 SER A 26 1.839 -5.952 -6.147 1.00 0.00 H new ATOM 0 HB3 SER A 26 0.951 -5.780 -7.648 1.00 0.00 H new ATOM 0 HG SER A 26 1.089 -7.990 -6.957 1.00 0.00 H new ATOM 352 N LEU A 27 2.334 -3.252 -7.574 1.00 0.00 N ATOM 353 CA LEU A 27 2.406 -1.876 -7.095 1.00 0.00 C ATOM 354 C LEU A 27 1.323 -1.603 -6.056 1.00 0.00 C ATOM 355 O LEU A 27 0.285 -2.263 -6.040 1.00 0.00 O ATOM 356 CB LEU A 27 2.263 -0.900 -8.265 1.00 0.00 C ATOM 357 CG LEU A 27 3.077 -1.229 -9.517 1.00 0.00 C ATOM 358 CD1 LEU A 27 2.835 -0.189 -10.600 1.00 0.00 C ATOM 359 CD2 LEU A 27 4.558 -1.318 -9.181 1.00 0.00 C ATOM 0 H LEU A 27 1.504 -3.463 -8.128 1.00 0.00 H new ATOM 0 HA LEU A 27 3.379 -1.732 -6.625 1.00 0.00 H new ATOM 0 HB2 LEU A 27 1.210 -0.849 -8.543 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.550 0.094 -7.920 1.00 0.00 H new ATOM 0 HG LEU A 27 2.752 -2.198 -9.895 1.00 0.00 H new ATOM 0 HD11 LEU A 27 3.423 -0.440 -11.483 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.777 -0.174 -10.860 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.132 0.794 -10.234 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.122 -1.553 -10.083 1.00 0.00 H new ATOM 0 HD22 LEU A 27 4.898 -0.364 -8.779 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.717 -2.101 -8.440 1.00 0.00 H new ATOM 371 N ALA A 28 1.573 -0.626 -5.191 1.00 0.00 N ATOM 372 CA ALA A 28 0.618 -0.263 -4.151 1.00 0.00 C ATOM 373 C ALA A 28 0.816 1.181 -3.703 1.00 0.00 C ATOM 374 O ALA A 28 1.942 1.618 -3.464 1.00 0.00 O ATOM 375 CB ALA A 28 0.746 -1.208 -2.965 1.00 0.00 C ATOM 0 H ALA A 28 2.429 -0.071 -5.190 1.00 0.00 H new ATOM 0 HA ALA A 28 -0.386 -0.352 -4.567 1.00 0.00 H new ATOM 0 HB1 ALA A 28 0.027 -0.926 -2.196 1.00 0.00 H new ATOM 0 HB2 ALA A 28 0.547 -2.229 -3.290 1.00 0.00 H new ATOM 0 HB3 ALA A 28 1.755 -1.147 -2.558 1.00 0.00 H new ATOM 381 N HIS A 29 -0.284 1.917 -3.592 1.00 0.00 N ATOM 382 CA HIS A 29 -0.231 3.313 -3.173 1.00 0.00 C ATOM 383 C HIS A 29 -1.480 3.691 -2.382 1.00 0.00 C ATOM 384 O HIS A 29 -2.447 2.930 -2.329 1.00 0.00 O ATOM 385 CB HIS A 29 -0.089 4.228 -4.390 1.00 0.00 C ATOM 386 CG HIS A 29 0.217 5.651 -4.037 1.00 0.00 C ATOM 387 ND1 HIS A 29 -0.626 6.700 -4.338 1.00 0.00 N ATOM 388 CD2 HIS A 29 1.282 6.197 -3.403 1.00 0.00 C ATOM 389 CE1 HIS A 29 -0.093 7.829 -3.906 1.00 0.00 C ATOM 390 NE2 HIS A 29 1.064 7.551 -3.334 1.00 0.00 N ATOM 0 H HIS A 29 -1.223 1.570 -3.786 1.00 0.00 H new ATOM 0 HA HIS A 29 0.639 3.440 -2.528 1.00 0.00 H new ATOM 0 HB2 HIS A 29 0.703 3.843 -5.033 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -1.013 4.196 -4.968 1.00 0.00 H new ATOM 0 HD2 HIS A 29 2.142 5.666 -3.023 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -0.529 8.812 -4.004 1.00 0.00 H new ATOM 0 HE2 HIS A 29 1.694 8.232 -2.910 1.00 0.00 H new ATOM 398 N CYS A 30 -1.451 4.868 -1.767 1.00 0.00 N ATOM 399 CA CYS A 30 -2.580 5.346 -0.976 1.00 0.00 C ATOM 400 C CYS A 30 -3.284 6.502 -1.678 1.00 0.00 C ATOM 401 O CYS A 30 -2.638 7.424 -2.176 1.00 0.00 O ATOM 402 CB CYS A 30 -2.109 5.785 0.411 1.00 0.00 C ATOM 403 SG CYS A 30 -0.872 7.104 0.386 1.00 0.00 S ATOM 0 H CYS A 30 -0.658 5.509 -1.801 1.00 0.00 H new ATOM 0 HA CYS A 30 -3.289 4.525 -0.867 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -2.972 6.121 0.987 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -1.694 4.922 0.932 1.00 0.00 H new ATOM 0 HG CYS A 30 -1.035 7.832 -0.679 1.00 0.00 H new ATOM 409 N ILE A 31 -4.611 6.446 -1.713 1.00 0.00 N ATOM 410 CA ILE A 31 -5.403 7.489 -2.354 1.00 0.00 C ATOM 411 C ILE A 31 -6.724 7.703 -1.624 1.00 0.00 C ATOM 412 O ILE A 31 -7.026 7.014 -0.650 1.00 0.00 O ATOM 413 CB ILE A 31 -5.693 7.149 -3.828 1.00 0.00 C ATOM 414 CG1 ILE A 31 -6.444 5.820 -3.930 1.00 0.00 C ATOM 415 CG2 ILE A 31 -4.398 7.094 -4.624 1.00 0.00 C ATOM 416 CD1 ILE A 31 -7.095 5.595 -5.276 1.00 0.00 C ATOM 0 H ILE A 31 -5.161 5.690 -1.305 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.814 8.405 -2.310 1.00 0.00 H new ATOM 0 HB ILE A 31 -6.322 7.933 -4.249 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -5.750 5.004 -3.730 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.210 5.784 -3.155 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -4.620 6.853 -5.664 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -3.899 8.062 -4.575 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.746 6.328 -4.205 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -7.609 4.634 -5.275 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -7.814 6.391 -5.470 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -6.332 5.598 -6.054 1.00 0.00 H new ATOM 428 N SER A 32 -7.509 8.663 -2.102 1.00 0.00 N ATOM 429 CA SER A 32 -8.798 8.971 -1.494 1.00 0.00 C ATOM 430 C SER A 32 -9.932 8.280 -2.245 1.00 0.00 C ATOM 431 O SER A 32 -9.793 7.935 -3.418 1.00 0.00 O ATOM 432 CB SER A 32 -9.030 10.483 -1.475 1.00 0.00 C ATOM 433 OG SER A 32 -7.805 11.185 -1.354 1.00 0.00 O ATOM 0 H SER A 32 -7.275 9.241 -2.909 1.00 0.00 H new ATOM 0 HA SER A 32 -8.785 8.600 -0.469 1.00 0.00 H new ATOM 0 HB2 SER A 32 -9.539 10.788 -2.390 1.00 0.00 H new ATOM 0 HB3 SER A 32 -9.686 10.743 -0.644 1.00 0.00 H new ATOM 0 HG SER A 32 -7.980 12.149 -1.346 1.00 0.00 H new ATOM 439 N GLU A 33 -11.054 8.083 -1.560 1.00 0.00 N ATOM 440 CA GLU A 33 -12.212 7.434 -2.163 1.00 0.00 C ATOM 441 C GLU A 33 -12.609 8.126 -3.463 1.00 0.00 C ATOM 442 O GLU A 33 -13.357 7.574 -4.270 1.00 0.00 O ATOM 443 CB GLU A 33 -13.392 7.439 -1.189 1.00 0.00 C ATOM 444 CG GLU A 33 -13.155 6.605 0.059 1.00 0.00 C ATOM 445 CD GLU A 33 -14.332 6.637 1.015 1.00 0.00 C ATOM 446 OE1 GLU A 33 -15.281 7.408 0.760 1.00 0.00 O ATOM 447 OE2 GLU A 33 -14.305 5.892 2.016 1.00 0.00 O ATOM 0 H GLU A 33 -11.186 8.363 -0.588 1.00 0.00 H new ATOM 0 HA GLU A 33 -11.941 6.403 -2.389 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -13.604 8.467 -0.894 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -14.278 7.065 -1.703 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -12.955 5.573 -0.231 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -12.265 6.970 0.572 1.00 0.00 H new ATOM 454 N ASP A 34 -12.103 9.339 -3.659 1.00 0.00 N ATOM 455 CA ASP A 34 -12.404 10.108 -4.861 1.00 0.00 C ATOM 456 C ASP A 34 -11.302 9.940 -5.903 1.00 0.00 C ATOM 457 O ASP A 34 -11.053 10.839 -6.707 1.00 0.00 O ATOM 458 CB ASP A 34 -12.575 11.588 -4.516 1.00 0.00 C ATOM 459 CG ASP A 34 -13.993 11.924 -4.098 1.00 0.00 C ATOM 460 OD1 ASP A 34 -14.467 11.353 -3.093 1.00 0.00 O ATOM 461 OD2 ASP A 34 -14.628 12.760 -4.774 1.00 0.00 O ATOM 0 H ASP A 34 -11.483 9.811 -3.001 1.00 0.00 H new ATOM 0 HA ASP A 34 -13.337 9.731 -5.280 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -11.890 11.852 -3.711 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -12.301 12.194 -5.380 1.00 0.00 H new ATOM 466 N CYS A 35 -10.647 8.785 -5.882 1.00 0.00 N ATOM 467 CA CYS A 35 -9.570 8.500 -6.824 1.00 0.00 C ATOM 468 C CYS A 35 -8.768 9.761 -7.131 1.00 0.00 C ATOM 469 O CYS A 35 -8.432 10.029 -8.285 1.00 0.00 O ATOM 470 CB CYS A 35 -10.138 7.914 -8.118 1.00 0.00 C ATOM 471 SG CYS A 35 -11.324 8.990 -8.956 1.00 0.00 S ATOM 0 H CYS A 35 -10.842 8.031 -5.224 1.00 0.00 H new ATOM 0 HA CYS A 35 -8.903 7.770 -6.365 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -9.315 7.699 -8.799 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -10.622 6.964 -7.892 1.00 0.00 H new ATOM 0 HG CYS A 35 -11.355 10.146 -8.363 1.00 0.00 H new ATOM 477 N ARG A 36 -8.467 10.532 -6.091 1.00 0.00 N ATOM 478 CA ARG A 36 -7.707 11.766 -6.250 1.00 0.00 C ATOM 479 C ARG A 36 -6.253 11.468 -6.603 1.00 0.00 C ATOM 480 O ARG A 36 -5.452 11.124 -5.735 1.00 0.00 O ATOM 481 CB ARG A 36 -7.772 12.599 -4.969 1.00 0.00 C ATOM 482 CG ARG A 36 -9.039 13.429 -4.845 1.00 0.00 C ATOM 483 CD ARG A 36 -8.865 14.807 -5.465 1.00 0.00 C ATOM 484 NE ARG A 36 -10.140 15.385 -5.879 1.00 0.00 N ATOM 485 CZ ARG A 36 -10.741 15.094 -7.028 1.00 0.00 C ATOM 486 NH1 ARG A 36 -10.184 14.235 -7.871 1.00 0.00 N ATOM 487 NH2 ARG A 36 -11.900 15.661 -7.335 1.00 0.00 N ATOM 0 H ARG A 36 -8.738 10.324 -5.130 1.00 0.00 H new ATOM 0 HA ARG A 36 -8.152 12.334 -7.067 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -7.698 11.933 -4.109 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -6.908 13.263 -4.933 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -9.864 12.911 -5.333 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -9.306 13.533 -3.793 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -8.383 15.470 -4.746 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -8.202 14.736 -6.327 1.00 0.00 H new ATOM 0 HE ARG A 36 -10.595 16.049 -5.252 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -9.293 13.797 -7.638 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -10.647 14.013 -8.752 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -12.332 16.322 -6.689 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -12.360 15.436 -8.217 1.00 0.00 H new ATOM 501 N MET A 37 -5.920 11.602 -7.883 1.00 0.00 N ATOM 502 CA MET A 37 -4.563 11.348 -8.350 1.00 0.00 C ATOM 503 C MET A 37 -4.152 12.367 -9.408 1.00 0.00 C ATOM 504 O MET A 37 -4.720 12.407 -10.498 1.00 0.00 O ATOM 505 CB MET A 37 -4.453 9.932 -8.919 1.00 0.00 C ATOM 506 CG MET A 37 -4.121 8.880 -7.873 1.00 0.00 C ATOM 507 SD MET A 37 -3.596 7.317 -8.602 1.00 0.00 S ATOM 508 CE MET A 37 -4.941 7.007 -9.744 1.00 0.00 C ATOM 0 H MET A 37 -6.572 11.885 -8.615 1.00 0.00 H new ATOM 0 HA MET A 37 -3.889 11.443 -7.499 1.00 0.00 H new ATOM 0 HB2 MET A 37 -5.395 9.669 -9.401 1.00 0.00 H new ATOM 0 HB3 MET A 37 -3.685 9.919 -9.692 1.00 0.00 H new ATOM 0 HG2 MET A 37 -3.331 9.256 -7.223 1.00 0.00 H new ATOM 0 HG3 MET A 37 -4.996 8.708 -7.246 1.00 0.00 H new ATOM 0 HE1 MET A 37 -4.907 5.968 -10.073 1.00 0.00 H new ATOM 0 HE2 MET A 37 -5.892 7.199 -9.247 1.00 0.00 H new ATOM 0 HE3 MET A 37 -4.844 7.664 -10.608 1.00 0.00 H new ATOM 518 N GLY A 38 -3.161 13.189 -9.078 1.00 0.00 N ATOM 519 CA GLY A 38 -2.691 14.198 -10.010 1.00 0.00 C ATOM 520 C GLY A 38 -1.635 15.101 -9.405 1.00 0.00 C ATOM 521 O GLY A 38 -1.529 16.272 -9.767 1.00 0.00 O ATOM 0 H GLY A 38 -2.675 13.175 -8.181 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -2.283 13.709 -10.894 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -3.535 14.803 -10.341 1.00 0.00 H new ATOM 525 N ALA A 39 -0.853 14.556 -8.479 1.00 0.00 N ATOM 526 CA ALA A 39 0.200 15.320 -7.822 1.00 0.00 C ATOM 527 C ALA A 39 1.339 14.412 -7.373 1.00 0.00 C ATOM 528 O ALA A 39 1.130 13.464 -6.618 1.00 0.00 O ATOM 529 CB ALA A 39 -0.366 16.086 -6.635 1.00 0.00 C ATOM 0 H ALA A 39 -0.929 13.588 -8.167 1.00 0.00 H new ATOM 0 HA ALA A 39 0.601 16.032 -8.543 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.431 16.652 -6.154 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -1.140 16.771 -6.980 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.795 15.384 -5.920 1.00 0.00 H new ATOM 535 N GLY A 40 2.547 14.708 -7.844 1.00 0.00 N ATOM 536 CA GLY A 40 3.702 13.907 -7.481 1.00 0.00 C ATOM 537 C GLY A 40 3.775 12.609 -8.260 1.00 0.00 C ATOM 538 O GLY A 40 3.554 12.590 -9.471 1.00 0.00 O ATOM 0 H GLY A 40 2.746 15.488 -8.470 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.610 14.484 -7.656 1.00 0.00 H new ATOM 0 HA3 GLY A 40 3.666 13.686 -6.414 1.00 0.00 H new ATOM 542 N ILE A 41 4.088 11.521 -7.564 1.00 0.00 N ATOM 543 CA ILE A 41 4.190 10.212 -8.199 1.00 0.00 C ATOM 544 C ILE A 41 2.820 9.703 -8.631 1.00 0.00 C ATOM 545 O ILE A 41 2.708 8.913 -9.569 1.00 0.00 O ATOM 546 CB ILE A 41 4.836 9.179 -7.257 1.00 0.00 C ATOM 547 CG1 ILE A 41 5.176 7.900 -8.024 1.00 0.00 C ATOM 548 CG2 ILE A 41 3.908 8.873 -6.091 1.00 0.00 C ATOM 549 CD1 ILE A 41 6.307 7.107 -7.406 1.00 0.00 C ATOM 0 H ILE A 41 4.275 11.520 -6.561 1.00 0.00 H new ATOM 0 HA ILE A 41 4.823 10.335 -9.078 1.00 0.00 H new ATOM 0 HB ILE A 41 5.760 9.599 -6.860 1.00 0.00 H new ATOM 0 HG12 ILE A 41 4.288 7.270 -8.076 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.443 8.160 -9.048 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.378 8.141 -5.434 1.00 0.00 H new ATOM 0 HG22 ILE A 41 3.711 9.788 -5.533 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.969 8.470 -6.470 1.00 0.00 H new ATOM 0 HD11 ILE A 41 6.493 6.214 -8.002 1.00 0.00 H new ATOM 0 HD12 ILE A 41 7.208 7.719 -7.378 1.00 0.00 H new ATOM 0 HD13 ILE A 41 6.035 6.816 -6.391 1.00 0.00 H new ATOM 561 N ALA A 42 1.779 10.161 -7.943 1.00 0.00 N ATOM 562 CA ALA A 42 0.416 9.754 -8.258 1.00 0.00 C ATOM 563 C ALA A 42 0.144 9.858 -9.755 1.00 0.00 C ATOM 564 O ALA A 42 -0.388 8.931 -10.366 1.00 0.00 O ATOM 565 CB ALA A 42 -0.581 10.600 -7.479 1.00 0.00 C ATOM 0 H ALA A 42 1.854 10.815 -7.163 1.00 0.00 H new ATOM 0 HA ALA A 42 0.298 8.711 -7.965 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -1.595 10.285 -7.724 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -0.410 10.472 -6.410 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -0.453 11.650 -7.744 1.00 0.00 H new ATOM 571 N VAL A 43 0.512 10.993 -10.341 1.00 0.00 N ATOM 572 CA VAL A 43 0.309 11.218 -11.767 1.00 0.00 C ATOM 573 C VAL A 43 0.759 10.013 -12.584 1.00 0.00 C ATOM 574 O VAL A 43 0.084 9.600 -13.528 1.00 0.00 O ATOM 575 CB VAL A 43 1.069 12.467 -12.253 1.00 0.00 C ATOM 576 CG1 VAL A 43 1.046 12.549 -13.772 1.00 0.00 C ATOM 577 CG2 VAL A 43 0.479 13.724 -11.633 1.00 0.00 C ATOM 0 H VAL A 43 0.952 11.771 -9.850 1.00 0.00 H new ATOM 0 HA VAL A 43 -0.760 11.373 -11.913 1.00 0.00 H new ATOM 0 HB VAL A 43 2.108 12.386 -11.934 1.00 0.00 H new ATOM 0 HG11 VAL A 43 1.588 13.437 -14.097 1.00 0.00 H new ATOM 0 HG12 VAL A 43 1.520 11.662 -14.191 1.00 0.00 H new ATOM 0 HG13 VAL A 43 0.014 12.607 -14.118 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.028 14.597 -11.987 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -0.569 13.814 -11.919 1.00 0.00 H new ATOM 0 HG23 VAL A 43 0.554 13.664 -10.547 1.00 0.00 H new ATOM 587 N LEU A 44 1.905 9.450 -12.215 1.00 0.00 N ATOM 588 CA LEU A 44 2.447 8.289 -12.913 1.00 0.00 C ATOM 589 C LEU A 44 1.464 7.124 -12.876 1.00 0.00 C ATOM 590 O LEU A 44 1.305 6.401 -13.860 1.00 0.00 O ATOM 591 CB LEU A 44 3.778 7.869 -12.287 1.00 0.00 C ATOM 592 CG LEU A 44 4.949 8.832 -12.489 1.00 0.00 C ATOM 593 CD1 LEU A 44 6.178 8.342 -11.740 1.00 0.00 C ATOM 594 CD2 LEU A 44 5.255 8.995 -13.971 1.00 0.00 C ATOM 0 H LEU A 44 2.476 9.779 -11.437 1.00 0.00 H new ATOM 0 HA LEU A 44 2.614 8.566 -13.954 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.626 7.733 -11.216 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.058 6.898 -12.695 1.00 0.00 H new ATOM 0 HG LEU A 44 4.668 9.805 -12.087 1.00 0.00 H new ATOM 0 HD11 LEU A 44 7.001 9.040 -11.895 1.00 0.00 H new ATOM 0 HD12 LEU A 44 5.953 8.277 -10.675 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.462 7.357 -12.112 1.00 0.00 H new ATOM 0 HD21 LEU A 44 6.091 9.683 -14.096 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.516 8.026 -14.397 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.378 9.392 -14.482 1.00 0.00 H new ATOM 606 N PHE A 45 0.805 6.948 -11.736 1.00 0.00 N ATOM 607 CA PHE A 45 -0.163 5.870 -11.571 1.00 0.00 C ATOM 608 C PHE A 45 -1.434 6.155 -12.366 1.00 0.00 C ATOM 609 O PHE A 45 -2.239 5.258 -12.615 1.00 0.00 O ATOM 610 CB PHE A 45 -0.506 5.686 -10.091 1.00 0.00 C ATOM 611 CG PHE A 45 0.495 4.850 -9.344 1.00 0.00 C ATOM 612 CD1 PHE A 45 1.627 5.429 -8.795 1.00 0.00 C ATOM 613 CD2 PHE A 45 0.302 3.487 -9.191 1.00 0.00 C ATOM 614 CE1 PHE A 45 2.550 4.663 -8.108 1.00 0.00 C ATOM 615 CE2 PHE A 45 1.221 2.715 -8.504 1.00 0.00 C ATOM 616 CZ PHE A 45 2.346 3.304 -7.961 1.00 0.00 C ATOM 0 H PHE A 45 0.924 7.538 -10.912 1.00 0.00 H new ATOM 0 HA PHE A 45 0.285 4.952 -11.950 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.575 6.665 -9.618 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.489 5.222 -10.009 1.00 0.00 H new ATOM 0 HD1 PHE A 45 1.790 6.491 -8.905 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -0.576 3.022 -9.613 1.00 0.00 H new ATOM 0 HE1 PHE A 45 3.430 5.126 -7.686 1.00 0.00 H new ATOM 0 HE2 PHE A 45 1.059 1.653 -8.392 1.00 0.00 H new ATOM 0 HZ PHE A 45 3.065 2.704 -7.423 1.00 0.00 H new ATOM 626 N LYS A 46 -1.607 7.411 -12.763 1.00 0.00 N ATOM 627 CA LYS A 46 -2.778 7.817 -13.531 1.00 0.00 C ATOM 628 C LYS A 46 -2.479 7.803 -15.027 1.00 0.00 C ATOM 629 O LYS A 46 -3.392 7.770 -15.853 1.00 0.00 O ATOM 630 CB LYS A 46 -3.235 9.214 -13.105 1.00 0.00 C ATOM 631 CG LYS A 46 -4.488 9.689 -13.820 1.00 0.00 C ATOM 632 CD LYS A 46 -4.697 11.184 -13.644 1.00 0.00 C ATOM 633 CE LYS A 46 -3.821 11.985 -14.595 1.00 0.00 C ATOM 634 NZ LYS A 46 -4.360 13.354 -14.825 1.00 0.00 N ATOM 0 H LYS A 46 -0.950 8.166 -12.565 1.00 0.00 H new ATOM 0 HA LYS A 46 -3.577 7.104 -13.331 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -3.418 9.215 -12.030 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -2.429 9.924 -13.292 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -4.414 9.453 -14.882 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -5.354 9.152 -13.434 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -5.745 11.429 -13.819 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -4.471 11.465 -12.615 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -2.812 12.055 -14.188 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -3.744 11.460 -15.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -3.735 13.868 -15.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -5.312 13.287 -15.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -4.410 13.864 -13.920 1.00 0.00 H new ATOM 648 N LYS A 47 -1.196 7.826 -15.370 1.00 0.00 N ATOM 649 CA LYS A 47 -0.776 7.814 -16.766 1.00 0.00 C ATOM 650 C LYS A 47 -0.369 6.409 -17.199 1.00 0.00 C ATOM 651 O LYS A 47 -0.649 5.988 -18.321 1.00 0.00 O ATOM 652 CB LYS A 47 0.391 8.782 -16.977 1.00 0.00 C ATOM 653 CG LYS A 47 1.755 8.141 -16.791 1.00 0.00 C ATOM 654 CD LYS A 47 2.873 9.163 -16.910 1.00 0.00 C ATOM 655 CE LYS A 47 2.586 10.402 -16.075 1.00 0.00 C ATOM 656 NZ LYS A 47 1.832 11.429 -16.847 1.00 0.00 N ATOM 0 H LYS A 47 -0.428 7.853 -14.699 1.00 0.00 H new ATOM 0 HA LYS A 47 -1.620 8.134 -17.377 1.00 0.00 H new ATOM 0 HB2 LYS A 47 0.329 9.199 -17.982 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.292 9.614 -16.280 1.00 0.00 H new ATOM 0 HG2 LYS A 47 1.802 7.661 -15.813 1.00 0.00 H new ATOM 0 HG3 LYS A 47 1.895 7.359 -17.537 1.00 0.00 H new ATOM 0 HD2 LYS A 47 3.813 8.715 -16.587 1.00 0.00 H new ATOM 0 HD3 LYS A 47 2.998 9.448 -17.955 1.00 0.00 H new ATOM 0 HE2 LYS A 47 2.014 10.120 -15.191 1.00 0.00 H new ATOM 0 HE3 LYS A 47 3.525 10.829 -15.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 2.403 12.295 -16.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 1.627 11.066 -17.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 0.939 11.644 -16.359 1.00 0.00 H new ATOM 670 N LYS A 48 0.293 5.686 -16.301 1.00 0.00 N ATOM 671 CA LYS A 48 0.736 4.327 -16.588 1.00 0.00 C ATOM 672 C LYS A 48 -0.456 3.401 -16.805 1.00 0.00 C ATOM 673 O LYS A 48 -0.514 2.667 -17.792 1.00 0.00 O ATOM 674 CB LYS A 48 1.604 3.799 -15.444 1.00 0.00 C ATOM 675 CG LYS A 48 2.684 2.832 -15.896 1.00 0.00 C ATOM 676 CD LYS A 48 3.655 3.491 -16.861 1.00 0.00 C ATOM 677 CE LYS A 48 5.048 2.893 -16.746 1.00 0.00 C ATOM 678 NZ LYS A 48 6.103 3.858 -17.163 1.00 0.00 N ATOM 0 H LYS A 48 0.534 6.019 -15.368 1.00 0.00 H new ATOM 0 HA LYS A 48 1.327 4.350 -17.503 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.072 4.642 -14.936 1.00 0.00 H new ATOM 0 HB3 LYS A 48 0.965 3.302 -14.714 1.00 0.00 H new ATOM 0 HG2 LYS A 48 3.228 2.461 -15.027 1.00 0.00 H new ATOM 0 HG3 LYS A 48 2.223 1.969 -16.376 1.00 0.00 H new ATOM 0 HD2 LYS A 48 3.291 3.374 -17.882 1.00 0.00 H new ATOM 0 HD3 LYS A 48 3.700 4.561 -16.659 1.00 0.00 H new ATOM 0 HE2 LYS A 48 5.226 2.583 -15.716 1.00 0.00 H new ATOM 0 HE3 LYS A 48 5.111 1.997 -17.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 7.038 3.412 -17.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 5.948 4.135 -18.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 6.060 4.702 -16.557 1.00 0.00 H new ATOM 692 N PHE A 49 -1.407 3.440 -15.877 1.00 0.00 N ATOM 693 CA PHE A 49 -2.598 2.604 -15.968 1.00 0.00 C ATOM 694 C PHE A 49 -3.863 3.458 -15.976 1.00 0.00 C ATOM 695 O PHE A 49 -4.801 3.190 -16.725 1.00 0.00 O ATOM 696 CB PHE A 49 -2.644 1.616 -14.800 1.00 0.00 C ATOM 697 CG PHE A 49 -3.292 2.177 -13.566 1.00 0.00 C ATOM 698 CD1 PHE A 49 -4.671 2.194 -13.438 1.00 0.00 C ATOM 699 CD2 PHE A 49 -2.521 2.687 -12.534 1.00 0.00 C ATOM 700 CE1 PHE A 49 -5.269 2.710 -12.304 1.00 0.00 C ATOM 701 CE2 PHE A 49 -3.113 3.205 -11.397 1.00 0.00 C ATOM 702 CZ PHE A 49 -4.489 3.215 -11.282 1.00 0.00 C ATOM 0 H PHE A 49 -1.376 4.041 -15.054 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.550 2.048 -16.904 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -3.186 0.723 -15.111 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -1.628 1.304 -14.558 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -5.286 1.800 -14.233 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -1.444 2.680 -12.619 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -6.345 2.718 -12.217 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -2.501 3.601 -10.600 1.00 0.00 H new ATOM 0 HZ PHE A 49 -4.955 3.617 -10.394 1.00 0.00 H new ATOM 712 N GLY A 50 -3.879 4.489 -15.136 1.00 0.00 N ATOM 713 CA GLY A 50 -5.033 5.366 -15.062 1.00 0.00 C ATOM 714 C GLY A 50 -6.343 4.612 -15.167 1.00 0.00 C ATOM 715 O GLY A 50 -6.843 4.373 -16.266 1.00 0.00 O ATOM 0 H GLY A 50 -3.114 4.732 -14.506 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -5.008 5.915 -14.121 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -4.977 6.103 -15.863 1.00 0.00 H new ATOM 719 N GLY A 51 -6.901 4.234 -14.021 1.00 0.00 N ATOM 720 CA GLY A 51 -8.155 3.504 -14.011 1.00 0.00 C ATOM 721 C GLY A 51 -9.142 4.061 -13.005 1.00 0.00 C ATOM 722 O GLY A 51 -9.876 3.310 -12.362 1.00 0.00 O ATOM 0 H GLY A 51 -6.507 4.420 -13.099 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.598 3.536 -15.006 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -7.960 2.456 -13.782 1.00 0.00 H new ATOM 726 N VAL A 52 -9.160 5.383 -12.865 1.00 0.00 N ATOM 727 CA VAL A 52 -10.064 6.040 -11.929 1.00 0.00 C ATOM 728 C VAL A 52 -11.463 5.438 -12.000 1.00 0.00 C ATOM 729 O VAL A 52 -12.052 5.092 -10.977 1.00 0.00 O ATOM 730 CB VAL A 52 -10.154 7.553 -12.204 1.00 0.00 C ATOM 731 CG1 VAL A 52 -8.928 8.269 -11.659 1.00 0.00 C ATOM 732 CG2 VAL A 52 -10.316 7.814 -13.694 1.00 0.00 C ATOM 0 H VAL A 52 -8.559 6.020 -13.388 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.655 5.883 -10.931 1.00 0.00 H new ATOM 0 HB VAL A 52 -11.032 7.947 -11.692 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -9.010 9.337 -11.863 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -8.862 8.109 -10.583 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -8.033 7.875 -12.140 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -10.378 8.888 -13.871 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -9.459 7.407 -14.230 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -11.228 7.334 -14.050 1.00 0.00 H new ATOM 742 N GLN A 53 -11.987 5.314 -13.215 1.00 0.00 N ATOM 743 CA GLN A 53 -13.317 4.752 -13.419 1.00 0.00 C ATOM 744 C GLN A 53 -13.339 3.267 -13.076 1.00 0.00 C ATOM 745 O GLN A 53 -14.356 2.740 -12.627 1.00 0.00 O ATOM 746 CB GLN A 53 -13.764 4.960 -14.867 1.00 0.00 C ATOM 747 CG GLN A 53 -15.223 4.608 -15.110 1.00 0.00 C ATOM 748 CD GLN A 53 -16.155 5.777 -14.861 1.00 0.00 C ATOM 749 OE1 GLN A 53 -15.903 6.894 -15.314 1.00 0.00 O ATOM 750 NE2 GLN A 53 -17.240 5.526 -14.138 1.00 0.00 N ATOM 0 H GLN A 53 -11.511 5.595 -14.072 1.00 0.00 H new ATOM 0 HA GLN A 53 -14.009 5.269 -12.754 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -13.599 6.001 -15.143 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -13.139 4.354 -15.522 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -15.344 4.265 -16.137 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -15.505 3.779 -14.462 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -17.409 4.585 -13.782 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -17.904 6.274 -13.938 1.00 0.00 H new ATOM 759 N GLU A 54 -12.211 2.597 -13.291 1.00 0.00 N ATOM 760 CA GLU A 54 -12.103 1.172 -13.006 1.00 0.00 C ATOM 761 C GLU A 54 -12.005 0.924 -11.503 1.00 0.00 C ATOM 762 O GLU A 54 -12.420 -0.124 -11.006 1.00 0.00 O ATOM 763 CB GLU A 54 -10.882 0.578 -13.712 1.00 0.00 C ATOM 764 CG GLU A 54 -11.157 0.147 -15.143 1.00 0.00 C ATOM 765 CD GLU A 54 -9.886 -0.120 -15.926 1.00 0.00 C ATOM 766 OE1 GLU A 54 -8.841 0.470 -15.581 1.00 0.00 O ATOM 767 OE2 GLU A 54 -9.937 -0.919 -16.884 1.00 0.00 O ATOM 0 H GLU A 54 -11.359 3.019 -13.662 1.00 0.00 H new ATOM 0 HA GLU A 54 -13.003 0.684 -13.380 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -10.078 1.314 -13.711 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -10.527 -0.282 -13.144 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.771 -0.754 -15.136 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -11.734 0.922 -15.647 1.00 0.00 H new ATOM 774 N LEU A 55 -11.452 1.895 -10.784 1.00 0.00 N ATOM 775 CA LEU A 55 -11.298 1.783 -9.338 1.00 0.00 C ATOM 776 C LEU A 55 -12.597 2.139 -8.623 1.00 0.00 C ATOM 777 O LEU A 55 -13.064 1.399 -7.756 1.00 0.00 O ATOM 778 CB LEU A 55 -10.170 2.696 -8.854 1.00 0.00 C ATOM 779 CG LEU A 55 -8.789 2.433 -9.456 1.00 0.00 C ATOM 780 CD1 LEU A 55 -7.833 3.566 -9.114 1.00 0.00 C ATOM 781 CD2 LEU A 55 -8.238 1.102 -8.966 1.00 0.00 C ATOM 0 H LEU A 55 -11.103 2.768 -11.179 1.00 0.00 H new ATOM 0 HA LEU A 55 -11.047 0.749 -9.103 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -10.447 3.728 -9.069 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -10.095 2.605 -7.770 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.890 2.385 -10.540 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.855 3.362 -9.551 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -8.221 4.503 -9.515 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.737 3.647 -8.031 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.255 0.932 -9.405 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.152 1.122 -7.880 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -8.912 0.298 -9.262 1.00 0.00 H new ATOM 793 N LEU A 56 -13.178 3.275 -8.994 1.00 0.00 N ATOM 794 CA LEU A 56 -14.426 3.728 -8.389 1.00 0.00 C ATOM 795 C LEU A 56 -15.499 2.648 -8.480 1.00 0.00 C ATOM 796 O LEU A 56 -16.346 2.524 -7.596 1.00 0.00 O ATOM 797 CB LEU A 56 -14.913 5.006 -9.075 1.00 0.00 C ATOM 798 CG LEU A 56 -14.007 6.230 -8.935 1.00 0.00 C ATOM 799 CD1 LEU A 56 -14.332 7.259 -10.007 1.00 0.00 C ATOM 800 CD2 LEU A 56 -14.146 6.840 -7.548 1.00 0.00 C ATOM 0 H LEU A 56 -12.805 3.899 -9.710 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.236 3.937 -7.336 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -15.046 4.797 -10.136 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.895 5.258 -8.674 1.00 0.00 H new ATOM 0 HG LEU A 56 -12.973 5.911 -9.068 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.678 8.123 -9.892 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.181 6.818 -10.992 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -15.371 7.574 -9.906 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -13.494 7.710 -7.466 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -15.180 7.145 -7.387 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.863 6.103 -6.796 1.00 0.00 H new ATOM 812 N ASN A 57 -15.456 1.867 -9.555 1.00 0.00 N ATOM 813 CA ASN A 57 -16.424 0.795 -9.761 1.00 0.00 C ATOM 814 C ASN A 57 -16.404 -0.187 -8.593 1.00 0.00 C ATOM 815 O ASN A 57 -17.339 -0.965 -8.410 1.00 0.00 O ATOM 816 CB ASN A 57 -16.128 0.057 -11.068 1.00 0.00 C ATOM 817 CG ASN A 57 -16.799 0.707 -12.263 1.00 0.00 C ATOM 818 OD1 ASN A 57 -17.895 1.256 -12.151 1.00 0.00 O ATOM 819 ND2 ASN A 57 -16.142 0.646 -13.415 1.00 0.00 N ATOM 0 H ASN A 57 -14.761 1.956 -10.297 1.00 0.00 H new ATOM 0 HA ASN A 57 -17.417 1.241 -9.821 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -15.051 0.029 -11.230 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -16.465 -0.976 -10.983 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -16.544 1.065 -14.254 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -15.236 0.181 -13.461 1.00 0.00 H new ATOM 826 N GLN A 58 -15.333 -0.143 -7.808 1.00 0.00 N ATOM 827 CA GLN A 58 -15.192 -1.029 -6.659 1.00 0.00 C ATOM 828 C GLN A 58 -15.986 -0.505 -5.467 1.00 0.00 C ATOM 829 O GLN A 58 -16.269 -1.245 -4.525 1.00 0.00 O ATOM 830 CB GLN A 58 -13.717 -1.176 -6.279 1.00 0.00 C ATOM 831 CG GLN A 58 -12.861 -1.771 -7.386 1.00 0.00 C ATOM 832 CD GLN A 58 -11.442 -2.057 -6.935 1.00 0.00 C ATOM 833 OE1 GLN A 58 -11.222 -2.742 -5.935 1.00 0.00 O ATOM 834 NE2 GLN A 58 -10.469 -1.535 -7.672 1.00 0.00 N ATOM 0 H GLN A 58 -14.550 0.496 -7.946 1.00 0.00 H new ATOM 0 HA GLN A 58 -15.588 -2.006 -6.935 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -13.320 -0.197 -6.010 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -13.640 -1.806 -5.393 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -13.320 -2.695 -7.738 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -12.838 -1.084 -8.232 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -10.696 -0.974 -8.493 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -9.494 -1.695 -7.418 1.00 0.00 H new ATOM 843 N GLN A 59 -16.342 0.774 -5.515 1.00 0.00 N ATOM 844 CA GLN A 59 -17.102 1.397 -4.438 1.00 0.00 C ATOM 845 C GLN A 59 -16.455 1.121 -3.085 1.00 0.00 C ATOM 846 O GLN A 59 -17.138 0.796 -2.113 1.00 0.00 O ATOM 847 CB GLN A 59 -18.544 0.884 -4.442 1.00 0.00 C ATOM 848 CG GLN A 59 -19.281 1.149 -5.744 1.00 0.00 C ATOM 849 CD GLN A 59 -20.782 0.987 -5.609 1.00 0.00 C ATOM 850 OE1 GLN A 59 -21.492 1.934 -5.271 1.00 0.00 O ATOM 851 NE2 GLN A 59 -21.274 -0.218 -5.874 1.00 0.00 N ATOM 0 H GLN A 59 -16.116 1.400 -6.288 1.00 0.00 H new ATOM 0 HA GLN A 59 -17.106 2.474 -4.605 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -18.540 -0.189 -4.249 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -19.090 1.353 -3.623 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -19.058 2.160 -6.084 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -18.913 0.467 -6.510 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -20.649 -0.975 -6.151 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -22.277 -0.387 -5.801 1.00 0.00 H new ATOM 860 N LYS A 60 -15.134 1.252 -3.029 1.00 0.00 N ATOM 861 CA LYS A 60 -14.394 1.018 -1.795 1.00 0.00 C ATOM 862 C LYS A 60 -14.576 2.179 -0.823 1.00 0.00 C ATOM 863 O LYS A 60 -14.956 3.281 -1.219 1.00 0.00 O ATOM 864 CB LYS A 60 -12.906 0.822 -2.098 1.00 0.00 C ATOM 865 CG LYS A 60 -12.619 -0.383 -2.978 1.00 0.00 C ATOM 866 CD LYS A 60 -12.825 -1.686 -2.224 1.00 0.00 C ATOM 867 CE LYS A 60 -13.249 -2.809 -3.158 1.00 0.00 C ATOM 868 NZ LYS A 60 -13.408 -4.101 -2.435 1.00 0.00 N ATOM 0 H LYS A 60 -14.554 1.519 -3.824 1.00 0.00 H new ATOM 0 HA LYS A 60 -14.787 0.113 -1.331 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -12.522 1.718 -2.586 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -12.364 0.713 -1.159 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -13.271 -0.360 -3.852 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -11.594 -0.332 -3.344 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -11.902 -1.963 -1.715 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -13.583 -1.546 -1.454 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -14.190 -2.544 -3.640 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -12.507 -2.924 -3.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -13.698 -4.841 -3.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -12.504 -4.367 -1.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -14.134 -3.999 -1.698 1.00 0.00 H new ATOM 882 N LYS A 61 -14.301 1.926 0.452 1.00 0.00 N ATOM 883 CA LYS A 61 -14.432 2.950 1.482 1.00 0.00 C ATOM 884 C LYS A 61 -13.267 2.885 2.465 1.00 0.00 C ATOM 885 O LYS A 61 -12.505 1.919 2.476 1.00 0.00 O ATOM 886 CB LYS A 61 -15.756 2.783 2.231 1.00 0.00 C ATOM 887 CG LYS A 61 -16.980 2.955 1.349 1.00 0.00 C ATOM 888 CD LYS A 61 -17.067 4.363 0.785 1.00 0.00 C ATOM 889 CE LYS A 61 -18.283 4.530 -0.113 1.00 0.00 C ATOM 890 NZ LYS A 61 -18.055 3.956 -1.468 1.00 0.00 N ATOM 0 H LYS A 61 -13.986 1.019 0.797 1.00 0.00 H new ATOM 0 HA LYS A 61 -14.419 3.925 0.994 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -15.783 1.793 2.687 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -15.799 3.509 3.043 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -16.944 2.236 0.531 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -17.879 2.737 1.926 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -17.116 5.081 1.603 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -16.162 4.586 0.219 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -19.144 4.044 0.347 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -18.525 5.589 -0.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -18.270 4.673 -2.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -17.062 3.662 -1.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -18.674 3.131 -1.604 1.00 0.00 H new ATOM 904 N SER A 62 -13.137 3.918 3.291 1.00 0.00 N ATOM 905 CA SER A 62 -12.064 3.979 4.276 1.00 0.00 C ATOM 906 C SER A 62 -11.920 2.647 5.005 1.00 0.00 C ATOM 907 O SER A 62 -12.910 1.985 5.314 1.00 0.00 O ATOM 908 CB SER A 62 -12.331 5.099 5.284 1.00 0.00 C ATOM 909 OG SER A 62 -13.625 4.977 5.850 1.00 0.00 O ATOM 0 H SER A 62 -13.762 4.724 3.298 1.00 0.00 H new ATOM 0 HA SER A 62 -11.133 4.188 3.750 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.581 5.068 6.074 1.00 0.00 H new ATOM 0 HB3 SER A 62 -12.236 6.067 4.791 1.00 0.00 H new ATOM 0 HG SER A 62 -13.771 5.703 6.492 1.00 0.00 H new ATOM 915 N GLY A 63 -10.677 2.260 5.277 1.00 0.00 N ATOM 916 CA GLY A 63 -10.425 1.008 5.968 1.00 0.00 C ATOM 917 C GLY A 63 -10.273 -0.160 5.014 1.00 0.00 C ATOM 918 O GLY A 63 -9.686 -1.183 5.364 1.00 0.00 O ATOM 0 H GLY A 63 -9.841 2.790 5.032 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -9.520 1.103 6.568 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -11.245 0.806 6.658 1.00 0.00 H new ATOM 922 N GLU A 64 -10.806 -0.008 3.805 1.00 0.00 N ATOM 923 CA GLU A 64 -10.729 -1.061 2.799 1.00 0.00 C ATOM 924 C GLU A 64 -9.643 -0.754 1.773 1.00 0.00 C ATOM 925 O GLU A 64 -9.071 0.336 1.764 1.00 0.00 O ATOM 926 CB GLU A 64 -12.078 -1.226 2.097 1.00 0.00 C ATOM 927 CG GLU A 64 -13.152 -1.841 2.979 1.00 0.00 C ATOM 928 CD GLU A 64 -14.237 -2.536 2.178 1.00 0.00 C ATOM 929 OE1 GLU A 64 -13.905 -3.466 1.414 1.00 0.00 O ATOM 930 OE2 GLU A 64 -15.416 -2.150 2.316 1.00 0.00 O ATOM 0 H GLU A 64 -11.295 0.833 3.499 1.00 0.00 H new ATOM 0 HA GLU A 64 -10.475 -1.993 3.304 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -12.419 -0.251 1.750 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -11.944 -1.850 1.213 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -12.692 -2.558 3.659 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -13.602 -1.062 3.594 1.00 0.00 H new ATOM 937 N VAL A 65 -9.362 -1.724 0.908 1.00 0.00 N ATOM 938 CA VAL A 65 -8.345 -1.559 -0.124 1.00 0.00 C ATOM 939 C VAL A 65 -8.879 -1.969 -1.492 1.00 0.00 C ATOM 940 O VAL A 65 -9.597 -2.960 -1.618 1.00 0.00 O ATOM 941 CB VAL A 65 -7.085 -2.386 0.193 1.00 0.00 C ATOM 942 CG1 VAL A 65 -7.433 -3.861 0.323 1.00 0.00 C ATOM 943 CG2 VAL A 65 -6.026 -2.172 -0.878 1.00 0.00 C ATOM 0 H VAL A 65 -9.825 -2.633 0.902 1.00 0.00 H new ATOM 0 HA VAL A 65 -8.081 -0.502 -0.143 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.679 -2.048 1.147 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.530 -4.429 0.547 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.155 -3.995 1.128 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.863 -4.217 -0.613 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -5.142 -2.763 -0.639 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -6.419 -2.482 -1.846 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -5.757 -1.117 -0.917 1.00 0.00 H new ATOM 953 N ALA A 66 -8.523 -1.198 -2.515 1.00 0.00 N ATOM 954 CA ALA A 66 -8.963 -1.483 -3.875 1.00 0.00 C ATOM 955 C ALA A 66 -7.959 -2.369 -4.603 1.00 0.00 C ATOM 956 O ALA A 66 -6.751 -2.265 -4.386 1.00 0.00 O ATOM 957 CB ALA A 66 -9.179 -0.186 -4.641 1.00 0.00 C ATOM 0 H ALA A 66 -7.931 -0.372 -2.427 1.00 0.00 H new ATOM 0 HA ALA A 66 -9.909 -2.022 -3.820 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -9.507 -0.413 -5.655 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -9.940 0.411 -4.138 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -8.245 0.374 -4.679 1.00 0.00 H new ATOM 963 N VAL A 67 -8.465 -3.242 -5.468 1.00 0.00 N ATOM 964 CA VAL A 67 -7.612 -4.147 -6.229 1.00 0.00 C ATOM 965 C VAL A 67 -7.929 -4.079 -7.719 1.00 0.00 C ATOM 966 O VAL A 67 -9.075 -4.268 -8.130 1.00 0.00 O ATOM 967 CB VAL A 67 -7.767 -5.602 -5.749 1.00 0.00 C ATOM 968 CG1 VAL A 67 -6.819 -6.519 -6.507 1.00 0.00 C ATOM 969 CG2 VAL A 67 -7.528 -5.696 -4.249 1.00 0.00 C ATOM 0 H VAL A 67 -9.462 -3.342 -5.659 1.00 0.00 H new ATOM 0 HA VAL A 67 -6.584 -3.825 -6.064 1.00 0.00 H new ATOM 0 HB VAL A 67 -8.787 -5.927 -5.953 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -6.943 -7.543 -6.154 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -7.043 -6.473 -7.573 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -5.791 -6.199 -6.338 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -7.642 -6.731 -3.927 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -6.519 -5.353 -4.019 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -8.252 -5.071 -3.725 1.00 0.00 H new ATOM 979 N LEU A 68 -6.907 -3.808 -8.524 1.00 0.00 N ATOM 980 CA LEU A 68 -7.076 -3.715 -9.970 1.00 0.00 C ATOM 981 C LEU A 68 -6.149 -4.689 -10.690 1.00 0.00 C ATOM 982 O LEU A 68 -4.932 -4.655 -10.507 1.00 0.00 O ATOM 983 CB LEU A 68 -6.803 -2.287 -10.444 1.00 0.00 C ATOM 984 CG LEU A 68 -7.521 -1.855 -11.723 1.00 0.00 C ATOM 985 CD1 LEU A 68 -9.029 -1.923 -11.537 1.00 0.00 C ATOM 986 CD2 LEU A 68 -7.095 -0.451 -12.127 1.00 0.00 C ATOM 0 H LEU A 68 -5.953 -3.649 -8.200 1.00 0.00 H new ATOM 0 HA LEU A 68 -8.106 -3.979 -10.209 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -7.083 -1.601 -9.645 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -5.730 -2.176 -10.599 1.00 0.00 H new ATOM 0 HG LEU A 68 -7.242 -2.541 -12.522 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -9.523 -1.612 -12.457 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -9.320 -2.945 -11.296 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -9.326 -1.260 -10.724 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -7.616 -0.161 -13.039 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -7.344 0.248 -11.329 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -6.019 -0.434 -12.303 1.00 0.00 H new ATOM 998 N LYS A 69 -6.732 -5.555 -11.511 1.00 0.00 N ATOM 999 CA LYS A 69 -5.959 -6.537 -12.262 1.00 0.00 C ATOM 1000 C LYS A 69 -5.444 -5.940 -13.568 1.00 0.00 C ATOM 1001 O LYS A 69 -6.191 -5.808 -14.538 1.00 0.00 O ATOM 1002 CB LYS A 69 -6.813 -7.773 -12.556 1.00 0.00 C ATOM 1003 CG LYS A 69 -6.010 -9.058 -12.652 1.00 0.00 C ATOM 1004 CD LYS A 69 -5.228 -9.131 -13.953 1.00 0.00 C ATOM 1005 CE LYS A 69 -4.526 -10.472 -14.107 1.00 0.00 C ATOM 1006 NZ LYS A 69 -4.387 -10.864 -15.537 1.00 0.00 N ATOM 0 H LYS A 69 -7.738 -5.597 -11.674 1.00 0.00 H new ATOM 0 HA LYS A 69 -5.103 -6.831 -11.654 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -7.563 -7.881 -11.772 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -7.350 -7.619 -13.492 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -5.322 -9.122 -11.809 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -6.681 -9.914 -12.581 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -5.903 -8.974 -14.794 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -4.491 -8.328 -13.982 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -3.539 -10.420 -13.647 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.087 -11.239 -13.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -3.788 -11.711 -15.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.326 -11.070 -15.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -3.950 -10.085 -16.070 1.00 0.00 H new ATOM 1020 N ARG A 70 -4.164 -5.583 -13.586 1.00 0.00 N ATOM 1021 CA ARG A 70 -3.550 -5.000 -14.773 1.00 0.00 C ATOM 1022 C ARG A 70 -3.207 -6.081 -15.794 1.00 0.00 C ATOM 1023 O ARG A 70 -3.550 -7.250 -15.614 1.00 0.00 O ATOM 1024 CB ARG A 70 -2.288 -4.224 -14.392 1.00 0.00 C ATOM 1025 CG ARG A 70 -2.572 -2.859 -13.787 1.00 0.00 C ATOM 1026 CD ARG A 70 -3.081 -1.881 -14.835 1.00 0.00 C ATOM 1027 NE ARG A 70 -1.999 -1.345 -15.655 1.00 0.00 N ATOM 1028 CZ ARG A 70 -2.194 -0.705 -16.803 1.00 0.00 C ATOM 1029 NH1 ARG A 70 -3.424 -0.524 -17.264 1.00 0.00 N ATOM 1030 NH2 ARG A 70 -1.158 -0.246 -17.493 1.00 0.00 N ATOM 0 H ARG A 70 -3.532 -5.687 -12.792 1.00 0.00 H new ATOM 0 HA ARG A 70 -4.268 -4.314 -15.223 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -1.710 -4.814 -13.681 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -1.668 -4.097 -15.279 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -3.310 -2.959 -12.991 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -1.663 -2.466 -13.331 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -3.807 -2.382 -15.475 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -3.603 -1.061 -14.342 1.00 0.00 H new ATOM 0 HE ARG A 70 -1.040 -1.469 -15.329 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -4.223 -0.876 -16.737 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -3.571 -0.032 -18.146 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -0.210 -0.384 -17.142 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -1.309 0.245 -18.374 1.00 0.00 H new ATOM 1044 N ASP A 71 -2.528 -5.683 -16.864 1.00 0.00 N ATOM 1045 CA ASP A 71 -2.138 -6.617 -17.913 1.00 0.00 C ATOM 1046 C ASP A 71 -1.876 -8.005 -17.335 1.00 0.00 C ATOM 1047 O ASP A 71 -2.225 -9.017 -17.942 1.00 0.00 O ATOM 1048 CB ASP A 71 -0.891 -6.110 -18.639 1.00 0.00 C ATOM 1049 CG ASP A 71 -0.753 -6.695 -20.031 1.00 0.00 C ATOM 1050 OD1 ASP A 71 -1.631 -6.426 -20.877 1.00 0.00 O ATOM 1051 OD2 ASP A 71 0.233 -7.423 -20.274 1.00 0.00 O ATOM 0 H ASP A 71 -2.236 -4.719 -17.028 1.00 0.00 H new ATOM 0 HA ASP A 71 -2.960 -6.689 -18.625 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.931 -5.023 -18.707 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.006 -6.360 -18.054 1.00 0.00 H new ATOM 1056 N GLY A 72 -1.259 -8.044 -16.158 1.00 0.00 N ATOM 1057 CA GLY A 72 -0.960 -9.312 -15.519 1.00 0.00 C ATOM 1058 C GLY A 72 -0.417 -9.139 -14.115 1.00 0.00 C ATOM 1059 O GLY A 72 0.463 -9.887 -13.686 1.00 0.00 O ATOM 0 H GLY A 72 -0.961 -7.220 -15.636 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -1.864 -9.920 -15.483 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -0.233 -9.857 -16.122 1.00 0.00 H new ATOM 1063 N ARG A 73 -0.939 -8.150 -13.397 1.00 0.00 N ATOM 1064 CA ARG A 73 -0.498 -7.880 -12.034 1.00 0.00 C ATOM 1065 C ARG A 73 -1.639 -7.308 -11.197 1.00 0.00 C ATOM 1066 O ARG A 73 -2.553 -6.675 -11.725 1.00 0.00 O ATOM 1067 CB ARG A 73 0.682 -6.907 -12.040 1.00 0.00 C ATOM 1068 CG ARG A 73 0.327 -5.523 -12.559 1.00 0.00 C ATOM 1069 CD ARG A 73 1.475 -4.544 -12.365 1.00 0.00 C ATOM 1070 NE ARG A 73 2.380 -4.529 -13.510 1.00 0.00 N ATOM 1071 CZ ARG A 73 2.128 -3.874 -14.638 1.00 0.00 C ATOM 1072 NH1 ARG A 73 1.003 -3.185 -14.771 1.00 0.00 N ATOM 1073 NH2 ARG A 73 3.001 -3.908 -15.636 1.00 0.00 N ATOM 0 H ARG A 73 -1.668 -7.522 -13.737 1.00 0.00 H new ATOM 0 HA ARG A 73 -0.180 -8.823 -11.588 1.00 0.00 H new ATOM 0 HB2 ARG A 73 1.073 -6.817 -11.026 1.00 0.00 H new ATOM 0 HB3 ARG A 73 1.481 -7.322 -12.654 1.00 0.00 H new ATOM 0 HG2 ARG A 73 0.074 -5.584 -13.618 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -0.558 -5.155 -12.041 1.00 0.00 H new ATOM 0 HD2 ARG A 73 1.075 -3.543 -12.206 1.00 0.00 H new ATOM 0 HD3 ARG A 73 2.031 -4.811 -11.467 1.00 0.00 H new ATOM 0 HE ARG A 73 3.254 -5.050 -13.440 1.00 0.00 H new ATOM 0 HH11 ARG A 73 0.329 -3.157 -14.006 1.00 0.00 H new ATOM 0 HH12 ARG A 73 0.812 -2.683 -15.638 1.00 0.00 H new ATOM 0 HH21 ARG A 73 3.867 -4.438 -15.538 1.00 0.00 H new ATOM 0 HH22 ARG A 73 2.806 -3.405 -16.501 1.00 0.00 H new ATOM 1087 N TYR A 74 -1.578 -7.536 -9.890 1.00 0.00 N ATOM 1088 CA TYR A 74 -2.607 -7.046 -8.980 1.00 0.00 C ATOM 1089 C TYR A 74 -2.112 -5.831 -8.201 1.00 0.00 C ATOM 1090 O TYR A 74 -1.258 -5.949 -7.322 1.00 0.00 O ATOM 1091 CB TYR A 74 -3.027 -8.151 -8.009 1.00 0.00 C ATOM 1092 CG TYR A 74 -3.375 -9.456 -8.691 1.00 0.00 C ATOM 1093 CD1 TYR A 74 -4.494 -9.559 -9.508 1.00 0.00 C ATOM 1094 CD2 TYR A 74 -2.584 -10.585 -8.517 1.00 0.00 C ATOM 1095 CE1 TYR A 74 -4.815 -10.749 -10.132 1.00 0.00 C ATOM 1096 CE2 TYR A 74 -2.897 -11.778 -9.138 1.00 0.00 C ATOM 1097 CZ TYR A 74 -4.014 -11.855 -9.944 1.00 0.00 C ATOM 1098 OH TYR A 74 -4.330 -13.043 -10.564 1.00 0.00 O ATOM 0 H TYR A 74 -0.827 -8.057 -9.437 1.00 0.00 H new ATOM 0 HA TYR A 74 -3.470 -6.747 -9.575 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -2.219 -8.326 -7.299 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -3.888 -7.810 -7.434 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -5.123 -8.694 -9.658 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -1.710 -10.529 -7.885 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -5.689 -10.812 -10.764 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -2.271 -12.646 -8.994 1.00 0.00 H new ATOM 0 HH TYR A 74 -3.664 -13.722 -10.328 1.00 0.00 H new ATOM 1108 N ILE A 75 -2.655 -4.664 -8.531 1.00 0.00 N ATOM 1109 CA ILE A 75 -2.271 -3.427 -7.862 1.00 0.00 C ATOM 1110 C ILE A 75 -3.227 -3.100 -6.720 1.00 0.00 C ATOM 1111 O ILE A 75 -4.442 -3.250 -6.852 1.00 0.00 O ATOM 1112 CB ILE A 75 -2.238 -2.242 -8.845 1.00 0.00 C ATOM 1113 CG1 ILE A 75 -1.381 -2.587 -10.065 1.00 0.00 C ATOM 1114 CG2 ILE A 75 -1.708 -0.995 -8.154 1.00 0.00 C ATOM 1115 CD1 ILE A 75 -1.421 -1.533 -11.149 1.00 0.00 C ATOM 0 H ILE A 75 -3.362 -4.549 -9.257 1.00 0.00 H new ATOM 0 HA ILE A 75 -1.270 -3.583 -7.461 1.00 0.00 H new ATOM 0 HB ILE A 75 -3.254 -2.041 -9.184 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.349 -2.729 -9.745 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.719 -3.536 -10.480 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -1.691 -0.166 -8.862 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -2.355 -0.742 -7.314 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.698 -1.182 -7.790 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -0.791 -1.844 -11.982 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.446 -1.407 -11.496 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -1.054 -0.587 -10.750 1.00 0.00 H new ATOM 1127 N TYR A 76 -2.671 -2.650 -5.601 1.00 0.00 N ATOM 1128 CA TYR A 76 -3.474 -2.301 -4.435 1.00 0.00 C ATOM 1129 C TYR A 76 -3.539 -0.788 -4.251 1.00 0.00 C ATOM 1130 O TYR A 76 -2.599 -0.069 -4.591 1.00 0.00 O ATOM 1131 CB TYR A 76 -2.896 -2.954 -3.178 1.00 0.00 C ATOM 1132 CG TYR A 76 -2.748 -4.455 -3.289 1.00 0.00 C ATOM 1133 CD1 TYR A 76 -3.854 -5.291 -3.197 1.00 0.00 C ATOM 1134 CD2 TYR A 76 -1.501 -5.037 -3.486 1.00 0.00 C ATOM 1135 CE1 TYR A 76 -3.722 -6.663 -3.297 1.00 0.00 C ATOM 1136 CE2 TYR A 76 -1.361 -6.407 -3.588 1.00 0.00 C ATOM 1137 CZ TYR A 76 -2.474 -7.216 -3.493 1.00 0.00 C ATOM 1138 OH TYR A 76 -2.338 -8.581 -3.594 1.00 0.00 O ATOM 0 H TYR A 76 -1.667 -2.518 -5.477 1.00 0.00 H new ATOM 0 HA TYR A 76 -4.486 -2.673 -4.598 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -1.921 -2.516 -2.967 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -3.540 -2.723 -2.330 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -4.833 -4.861 -3.045 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -0.627 -4.407 -3.561 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -4.592 -7.299 -3.222 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -0.385 -6.843 -3.741 1.00 0.00 H new ATOM 0 HH TYR A 76 -3.221 -8.990 -3.713 1.00 0.00 H new ATOM 1148 N TYR A 77 -4.655 -0.312 -3.711 1.00 0.00 N ATOM 1149 CA TYR A 77 -4.846 1.115 -3.482 1.00 0.00 C ATOM 1150 C TYR A 77 -5.379 1.376 -2.077 1.00 0.00 C ATOM 1151 O TYR A 77 -6.587 1.326 -1.839 1.00 0.00 O ATOM 1152 CB TYR A 77 -5.808 1.695 -4.521 1.00 0.00 C ATOM 1153 CG TYR A 77 -5.369 1.462 -5.949 1.00 0.00 C ATOM 1154 CD1 TYR A 77 -5.487 0.208 -6.537 1.00 0.00 C ATOM 1155 CD2 TYR A 77 -4.836 2.495 -6.710 1.00 0.00 C ATOM 1156 CE1 TYR A 77 -5.087 -0.009 -7.841 1.00 0.00 C ATOM 1157 CE2 TYR A 77 -4.435 2.287 -8.016 1.00 0.00 C ATOM 1158 CZ TYR A 77 -4.562 1.033 -8.577 1.00 0.00 C ATOM 1159 OH TYR A 77 -4.163 0.821 -9.876 1.00 0.00 O ATOM 0 H TYR A 77 -5.442 -0.894 -3.423 1.00 0.00 H new ATOM 0 HA TYR A 77 -3.877 1.605 -3.579 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -6.794 1.254 -4.376 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -5.910 2.767 -4.351 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -5.898 -0.610 -5.965 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -4.733 3.477 -6.273 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -5.185 -0.990 -8.282 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -4.024 3.102 -8.594 1.00 0.00 H new ATOM 0 HH TYR A 77 -3.862 1.667 -10.268 1.00 0.00 H new ATOM 1169 N LEU A 78 -4.471 1.655 -1.149 1.00 0.00 N ATOM 1170 CA LEU A 78 -4.848 1.925 0.234 1.00 0.00 C ATOM 1171 C LEU A 78 -5.720 3.173 0.327 1.00 0.00 C ATOM 1172 O LEU A 78 -5.364 4.231 -0.193 1.00 0.00 O ATOM 1173 CB LEU A 78 -3.598 2.097 1.100 1.00 0.00 C ATOM 1174 CG LEU A 78 -2.580 0.958 1.042 1.00 0.00 C ATOM 1175 CD1 LEU A 78 -1.198 1.457 1.436 1.00 0.00 C ATOM 1176 CD2 LEU A 78 -3.012 -0.190 1.943 1.00 0.00 C ATOM 0 H LEU A 78 -3.468 1.700 -1.329 1.00 0.00 H new ATOM 0 HA LEU A 78 -5.423 1.074 0.601 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.099 3.019 0.803 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -3.913 2.224 2.136 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.532 0.590 0.017 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.486 0.633 1.389 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -0.886 2.245 0.750 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.230 1.852 2.452 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -2.276 -0.992 1.889 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -3.089 0.164 2.971 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -3.981 -0.565 1.615 1.00 0.00 H new ATOM 1188 N ILE A 79 -6.862 3.041 0.993 1.00 0.00 N ATOM 1189 CA ILE A 79 -7.784 4.159 1.157 1.00 0.00 C ATOM 1190 C ILE A 79 -8.000 4.482 2.632 1.00 0.00 C ATOM 1191 O ILE A 79 -8.616 3.707 3.365 1.00 0.00 O ATOM 1192 CB ILE A 79 -9.146 3.866 0.502 1.00 0.00 C ATOM 1193 CG1 ILE A 79 -8.969 3.589 -0.993 1.00 0.00 C ATOM 1194 CG2 ILE A 79 -10.100 5.031 0.721 1.00 0.00 C ATOM 1195 CD1 ILE A 79 -10.083 2.758 -1.589 1.00 0.00 C ATOM 0 H ILE A 79 -7.171 2.172 1.428 1.00 0.00 H new ATOM 0 HA ILE A 79 -7.330 5.018 0.663 1.00 0.00 H new ATOM 0 HB ILE A 79 -9.574 2.978 0.968 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -8.910 4.538 -1.526 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -8.020 3.076 -1.149 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -11.059 4.809 0.252 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -10.246 5.186 1.790 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -9.680 5.934 0.278 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -9.892 2.601 -2.651 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -10.129 1.794 -1.082 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -11.032 3.279 -1.464 1.00 0.00 H new ATOM 1207 N THR A 80 -7.490 5.632 3.061 1.00 0.00 N ATOM 1208 CA THR A 80 -7.628 6.058 4.448 1.00 0.00 C ATOM 1209 C THR A 80 -8.664 7.168 4.582 1.00 0.00 C ATOM 1210 O THR A 80 -9.390 7.238 5.573 1.00 0.00 O ATOM 1211 CB THR A 80 -6.286 6.553 5.020 1.00 0.00 C ATOM 1212 OG1 THR A 80 -5.847 7.714 4.306 1.00 0.00 O ATOM 1213 CG2 THR A 80 -5.226 5.465 4.930 1.00 0.00 C ATOM 0 H THR A 80 -6.978 6.285 2.468 1.00 0.00 H new ATOM 0 HA THR A 80 -7.957 5.187 5.014 1.00 0.00 H new ATOM 0 HB THR A 80 -6.435 6.808 6.069 1.00 0.00 H new ATOM 0 HG1 THR A 80 -4.994 8.023 4.677 1.00 0.00 H new ATOM 0 HG21 THR A 80 -4.287 5.837 5.340 1.00 0.00 H new ATOM 0 HG22 THR A 80 -5.550 4.593 5.499 1.00 0.00 H new ATOM 0 HG23 THR A 80 -5.081 5.184 3.887 1.00 0.00 H new ATOM 1221 N LYS A 81 -8.728 8.035 3.577 1.00 0.00 N ATOM 1222 CA LYS A 81 -9.677 9.142 3.581 1.00 0.00 C ATOM 1223 C LYS A 81 -10.620 9.054 2.385 1.00 0.00 C ATOM 1224 O LYS A 81 -10.439 8.220 1.498 1.00 0.00 O ATOM 1225 CB LYS A 81 -8.933 10.479 3.559 1.00 0.00 C ATOM 1226 CG LYS A 81 -8.217 10.756 2.248 1.00 0.00 C ATOM 1227 CD LYS A 81 -7.187 11.863 2.398 1.00 0.00 C ATOM 1228 CE LYS A 81 -5.865 11.326 2.925 1.00 0.00 C ATOM 1229 NZ LYS A 81 -5.221 10.392 1.960 1.00 0.00 N ATOM 0 H LYS A 81 -8.134 7.992 2.749 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.269 9.077 4.494 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.643 11.283 3.752 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.206 10.494 4.371 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -7.727 9.846 1.901 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -8.945 11.036 1.487 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -7.027 12.345 1.434 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -7.568 12.626 3.077 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.191 12.158 3.130 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.033 10.811 3.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -4.194 10.378 2.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -5.606 9.435 2.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.413 10.710 0.989 1.00 0.00 H new ATOM 1243 N LYS A 82 -11.627 9.921 2.367 1.00 0.00 N ATOM 1244 CA LYS A 82 -12.598 9.944 1.279 1.00 0.00 C ATOM 1245 C LYS A 82 -12.365 11.144 0.367 1.00 0.00 C ATOM 1246 O LYS A 82 -12.544 11.056 -0.848 1.00 0.00 O ATOM 1247 CB LYS A 82 -14.022 9.984 1.839 1.00 0.00 C ATOM 1248 CG LYS A 82 -14.282 8.942 2.913 1.00 0.00 C ATOM 1249 CD LYS A 82 -13.989 9.486 4.301 1.00 0.00 C ATOM 1250 CE LYS A 82 -15.222 10.126 4.921 1.00 0.00 C ATOM 1251 NZ LYS A 82 -16.354 9.164 5.023 1.00 0.00 N ATOM 0 H LYS A 82 -11.792 10.617 3.094 1.00 0.00 H new ATOM 0 HA LYS A 82 -12.470 9.034 0.693 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -14.214 10.975 2.252 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -14.729 9.836 1.023 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -15.321 8.616 2.861 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -13.663 8.064 2.727 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -13.636 8.679 4.942 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -13.186 10.221 4.243 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -14.975 10.503 5.913 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -15.527 10.983 4.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -16.946 9.410 5.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -16.926 9.208 4.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -15.981 8.201 5.143 1.00 0.00 H new ATOM 1265 N ARG A 83 -11.964 12.263 0.961 1.00 0.00 N ATOM 1266 CA ARG A 83 -11.707 13.481 0.201 1.00 0.00 C ATOM 1267 C ARG A 83 -10.544 14.263 0.805 1.00 0.00 C ATOM 1268 O ARG A 83 -10.044 13.922 1.876 1.00 0.00 O ATOM 1269 CB ARG A 83 -12.960 14.358 0.163 1.00 0.00 C ATOM 1270 CG ARG A 83 -14.188 13.643 -0.378 1.00 0.00 C ATOM 1271 CD ARG A 83 -15.326 14.615 -0.645 1.00 0.00 C ATOM 1272 NE ARG A 83 -15.227 15.223 -1.970 1.00 0.00 N ATOM 1273 CZ ARG A 83 -14.576 16.356 -2.211 1.00 0.00 C ATOM 1274 NH1 ARG A 83 -13.970 17.000 -1.224 1.00 0.00 N ATOM 1275 NH2 ARG A 83 -14.530 16.846 -3.444 1.00 0.00 N ATOM 0 H ARG A 83 -11.810 12.352 1.965 1.00 0.00 H new ATOM 0 HA ARG A 83 -11.441 13.195 -0.817 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -13.173 14.716 1.170 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -12.761 15.235 -0.452 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -13.930 13.121 -1.300 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -14.514 12.887 0.336 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -16.278 14.092 -0.556 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -15.320 15.397 0.114 1.00 0.00 H new ATOM 0 HE ARG A 83 -15.682 14.752 -2.752 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -14.002 16.626 -0.276 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -13.471 17.869 -1.413 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -14.994 16.353 -4.206 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -14.030 17.716 -3.629 1.00 0.00 H new ATOM 1289 N ALA A 84 -10.119 15.313 0.109 1.00 0.00 N ATOM 1290 CA ALA A 84 -9.017 16.144 0.577 1.00 0.00 C ATOM 1291 C ALA A 84 -9.402 16.906 1.841 1.00 0.00 C ATOM 1292 O ALA A 84 -8.541 17.284 2.636 1.00 0.00 O ATOM 1293 CB ALA A 84 -8.585 17.111 -0.514 1.00 0.00 C ATOM 0 H ALA A 84 -10.521 15.608 -0.781 1.00 0.00 H new ATOM 0 HA ALA A 84 -8.179 15.490 0.820 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -7.761 17.725 -0.150 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -8.260 16.550 -1.390 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -9.424 17.752 -0.785 1.00 0.00 H new ATOM 1299 N SER A 85 -10.700 17.129 2.019 1.00 0.00 N ATOM 1300 CA SER A 85 -11.199 17.850 3.185 1.00 0.00 C ATOM 1301 C SER A 85 -10.930 17.066 4.465 1.00 0.00 C ATOM 1302 O SER A 85 -10.794 17.644 5.544 1.00 0.00 O ATOM 1303 CB SER A 85 -12.698 18.118 3.042 1.00 0.00 C ATOM 1304 OG SER A 85 -12.957 19.016 1.977 1.00 0.00 O ATOM 0 H SER A 85 -11.425 16.821 1.371 1.00 0.00 H new ATOM 0 HA SER A 85 -10.672 18.802 3.246 1.00 0.00 H new ATOM 0 HB2 SER A 85 -13.223 17.179 2.866 1.00 0.00 H new ATOM 0 HB3 SER A 85 -13.087 18.531 3.973 1.00 0.00 H new ATOM 0 HG SER A 85 -13.922 19.169 1.906 1.00 0.00 H new ATOM 1310 N HIS A 86 -10.854 15.745 4.338 1.00 0.00 N ATOM 1311 CA HIS A 86 -10.601 14.880 5.485 1.00 0.00 C ATOM 1312 C HIS A 86 -9.131 14.474 5.545 1.00 0.00 C ATOM 1313 O HIS A 86 -8.558 14.029 4.550 1.00 0.00 O ATOM 1314 CB HIS A 86 -11.484 13.634 5.415 1.00 0.00 C ATOM 1315 CG HIS A 86 -12.848 13.897 4.857 1.00 0.00 C ATOM 1316 ND1 HIS A 86 -13.330 13.278 3.723 1.00 0.00 N ATOM 1317 CD2 HIS A 86 -13.836 14.718 5.284 1.00 0.00 C ATOM 1318 CE1 HIS A 86 -14.555 13.707 3.476 1.00 0.00 C ATOM 1319 NE2 HIS A 86 -14.886 14.582 4.409 1.00 0.00 N ATOM 0 H HIS A 86 -10.964 15.250 3.453 1.00 0.00 H new ATOM 0 HA HIS A 86 -10.843 15.437 6.390 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -10.988 12.882 4.801 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -11.585 13.214 6.416 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -13.804 15.361 6.151 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -15.179 13.395 2.652 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -15.776 15.076 4.470 1.00 0.00 H new ATOM 1327 N LYS A 87 -8.526 14.631 6.717 1.00 0.00 N ATOM 1328 CA LYS A 87 -7.124 14.280 6.908 1.00 0.00 C ATOM 1329 C LYS A 87 -6.974 12.799 7.239 1.00 0.00 C ATOM 1330 O LYS A 87 -7.830 12.192 7.883 1.00 0.00 O ATOM 1331 CB LYS A 87 -6.513 15.128 8.026 1.00 0.00 C ATOM 1332 CG LYS A 87 -6.714 16.622 7.836 1.00 0.00 C ATOM 1333 CD LYS A 87 -5.965 17.135 6.618 1.00 0.00 C ATOM 1334 CE LYS A 87 -6.826 17.070 5.366 1.00 0.00 C ATOM 1335 NZ LYS A 87 -7.669 18.287 5.209 1.00 0.00 N ATOM 0 H LYS A 87 -8.985 14.999 7.550 1.00 0.00 H new ATOM 0 HA LYS A 87 -6.595 14.481 5.977 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -6.951 14.829 8.978 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.445 14.919 8.087 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -7.777 16.836 7.727 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -6.371 17.152 8.725 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -5.649 18.164 6.791 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -5.061 16.544 6.470 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -6.186 16.956 4.491 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -7.466 16.188 5.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -8.177 18.243 4.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -8.356 18.337 5.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -7.064 19.133 5.226 1.00 0.00 H new ATOM 1349 N PRO A 88 -5.859 12.202 6.792 1.00 0.00 N ATOM 1350 CA PRO A 88 -5.569 10.785 7.031 1.00 0.00 C ATOM 1351 C PRO A 88 -5.254 10.496 8.494 1.00 0.00 C ATOM 1352 O PRO A 88 -4.519 11.244 9.141 1.00 0.00 O ATOM 1353 CB PRO A 88 -4.341 10.522 6.157 1.00 0.00 C ATOM 1354 CG PRO A 88 -3.684 11.851 6.016 1.00 0.00 C ATOM 1355 CD PRO A 88 -4.795 12.864 6.019 1.00 0.00 C ATOM 0 HA PRO A 88 -6.422 10.149 6.794 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -3.672 9.797 6.622 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -4.626 10.116 5.186 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -2.989 12.032 6.836 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -3.108 11.906 5.092 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -4.484 13.800 6.483 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -5.123 13.104 5.007 1.00 0.00 H new ATOM 1363 N THR A 89 -5.813 9.407 9.013 1.00 0.00 N ATOM 1364 CA THR A 89 -5.592 9.021 10.400 1.00 0.00 C ATOM 1365 C THR A 89 -4.833 7.701 10.489 1.00 0.00 C ATOM 1366 O THR A 89 -5.140 6.748 9.772 1.00 0.00 O ATOM 1367 CB THR A 89 -6.922 8.888 11.165 1.00 0.00 C ATOM 1368 OG1 THR A 89 -7.851 8.111 10.401 1.00 0.00 O ATOM 1369 CG2 THR A 89 -7.517 10.257 11.458 1.00 0.00 C ATOM 0 H THR A 89 -6.423 8.777 8.492 1.00 0.00 H new ATOM 0 HA THR A 89 -4.996 9.811 10.857 1.00 0.00 H new ATOM 0 HB THR A 89 -6.723 8.386 12.112 1.00 0.00 H new ATOM 0 HG1 THR A 89 -8.694 8.030 10.895 1.00 0.00 H new ATOM 0 HG21 THR A 89 -8.456 10.138 11.999 1.00 0.00 H new ATOM 0 HG22 THR A 89 -6.820 10.835 12.065 1.00 0.00 H new ATOM 0 HG23 THR A 89 -7.703 10.781 10.521 1.00 0.00 H new ATOM 1377 N TYR A 90 -3.843 7.652 11.372 1.00 0.00 N ATOM 1378 CA TYR A 90 -3.039 6.449 11.553 1.00 0.00 C ATOM 1379 C TYR A 90 -3.928 5.225 11.752 1.00 0.00 C ATOM 1380 O TYR A 90 -3.644 4.148 11.230 1.00 0.00 O ATOM 1381 CB TYR A 90 -2.101 6.613 12.751 1.00 0.00 C ATOM 1382 CG TYR A 90 -1.010 7.636 12.530 1.00 0.00 C ATOM 1383 CD1 TYR A 90 -0.186 7.573 11.414 1.00 0.00 C ATOM 1384 CD2 TYR A 90 -0.805 8.667 13.439 1.00 0.00 C ATOM 1385 CE1 TYR A 90 0.812 8.505 11.209 1.00 0.00 C ATOM 1386 CE2 TYR A 90 0.191 9.605 13.242 1.00 0.00 C ATOM 1387 CZ TYR A 90 0.997 9.519 12.126 1.00 0.00 C ATOM 1388 OH TYR A 90 1.989 10.451 11.924 1.00 0.00 O ATOM 0 H TYR A 90 -3.577 8.431 11.974 1.00 0.00 H new ATOM 0 HA TYR A 90 -2.444 6.301 10.652 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -2.687 6.902 13.624 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.644 5.650 12.978 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.328 6.781 10.694 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -1.434 8.737 14.314 1.00 0.00 H new ATOM 0 HE1 TYR A 90 1.444 8.441 10.336 1.00 0.00 H new ATOM 0 HE2 TYR A 90 0.337 10.401 13.958 1.00 0.00 H new ATOM 0 HH TYR A 90 2.819 10.142 12.344 1.00 0.00 H new ATOM 1398 N GLU A 91 -5.005 5.401 12.511 1.00 0.00 N ATOM 1399 CA GLU A 91 -5.935 4.311 12.780 1.00 0.00 C ATOM 1400 C GLU A 91 -6.412 3.670 11.480 1.00 0.00 C ATOM 1401 O GLU A 91 -6.271 2.465 11.281 1.00 0.00 O ATOM 1402 CB GLU A 91 -7.135 4.821 13.580 1.00 0.00 C ATOM 1403 CG GLU A 91 -8.134 3.733 13.940 1.00 0.00 C ATOM 1404 CD GLU A 91 -9.503 4.288 14.282 1.00 0.00 C ATOM 1405 OE1 GLU A 91 -10.191 4.779 13.363 1.00 0.00 O ATOM 1406 OE2 GLU A 91 -9.886 4.230 15.469 1.00 0.00 O ATOM 0 H GLU A 91 -5.255 6.287 12.950 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.411 3.556 13.366 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.777 5.291 14.496 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -7.644 5.593 13.003 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -8.226 3.039 13.105 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -7.755 3.163 14.788 1.00 0.00 H new ATOM 1413 N ASN A 92 -6.979 4.487 10.598 1.00 0.00 N ATOM 1414 CA ASN A 92 -7.479 4.001 9.317 1.00 0.00 C ATOM 1415 C ASN A 92 -6.344 3.432 8.471 1.00 0.00 C ATOM 1416 O ASN A 92 -6.504 2.409 7.804 1.00 0.00 O ATOM 1417 CB ASN A 92 -8.180 5.129 8.557 1.00 0.00 C ATOM 1418 CG ASN A 92 -9.569 5.413 9.096 1.00 0.00 C ATOM 1419 OD1 ASN A 92 -10.195 4.552 9.714 1.00 0.00 O ATOM 1420 ND2 ASN A 92 -10.058 6.625 8.862 1.00 0.00 N ATOM 0 H ASN A 92 -7.104 5.488 10.747 1.00 0.00 H new ATOM 0 HA ASN A 92 -8.197 3.205 9.514 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -7.577 6.035 8.619 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -8.250 4.864 7.502 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -10.988 6.874 9.199 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -9.504 7.308 8.345 1.00 0.00 H new ATOM 1427 N LEU A 93 -5.197 4.101 8.503 1.00 0.00 N ATOM 1428 CA LEU A 93 -4.033 3.662 7.740 1.00 0.00 C ATOM 1429 C LEU A 93 -3.699 2.206 8.046 1.00 0.00 C ATOM 1430 O LEU A 93 -3.786 1.343 7.172 1.00 0.00 O ATOM 1431 CB LEU A 93 -2.828 4.551 8.054 1.00 0.00 C ATOM 1432 CG LEU A 93 -1.462 3.995 7.653 1.00 0.00 C ATOM 1433 CD1 LEU A 93 -1.169 4.300 6.192 1.00 0.00 C ATOM 1434 CD2 LEU A 93 -0.370 4.564 8.548 1.00 0.00 C ATOM 0 H LEU A 93 -5.048 4.950 9.049 1.00 0.00 H new ATOM 0 HA LEU A 93 -4.272 3.745 6.680 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.969 5.509 7.554 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -2.817 4.749 9.126 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.481 2.913 7.780 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.192 3.896 5.925 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.934 3.843 5.564 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.170 5.379 6.038 1.00 0.00 H new ATOM 0 HD21 LEU A 93 0.595 4.157 8.248 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.351 5.650 8.454 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.571 4.293 9.584 1.00 0.00 H new ATOM 1446 N GLN A 94 -3.319 1.940 9.291 1.00 0.00 N ATOM 1447 CA GLN A 94 -2.973 0.588 9.712 1.00 0.00 C ATOM 1448 C GLN A 94 -3.940 -0.431 9.117 1.00 0.00 C ATOM 1449 O GLN A 94 -3.527 -1.371 8.438 1.00 0.00 O ATOM 1450 CB GLN A 94 -2.984 0.488 11.239 1.00 0.00 C ATOM 1451 CG GLN A 94 -2.022 -0.555 11.786 1.00 0.00 C ATOM 1452 CD GLN A 94 -2.362 -0.974 13.203 1.00 0.00 C ATOM 1453 OE1 GLN A 94 -2.959 -0.211 13.963 1.00 0.00 O ATOM 1454 NE2 GLN A 94 -1.982 -2.194 13.567 1.00 0.00 N ATOM 0 H GLN A 94 -3.243 2.643 10.026 1.00 0.00 H new ATOM 0 HA GLN A 94 -1.970 0.366 9.348 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -2.731 1.461 11.661 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -3.994 0.249 11.572 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -2.036 -1.432 11.138 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -1.008 -0.157 11.762 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -1.489 -2.793 12.905 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -2.183 -2.531 14.508 1.00 0.00 H new ATOM 1463 N LYS A 95 -5.229 -0.238 9.377 1.00 0.00 N ATOM 1464 CA LYS A 95 -6.255 -1.139 8.867 1.00 0.00 C ATOM 1465 C LYS A 95 -6.063 -1.394 7.376 1.00 0.00 C ATOM 1466 O LYS A 95 -6.053 -2.541 6.929 1.00 0.00 O ATOM 1467 CB LYS A 95 -7.647 -0.555 9.121 1.00 0.00 C ATOM 1468 CG LYS A 95 -7.985 -0.406 10.594 1.00 0.00 C ATOM 1469 CD LYS A 95 -9.487 -0.357 10.819 1.00 0.00 C ATOM 1470 CE LYS A 95 -9.825 -0.206 12.295 1.00 0.00 C ATOM 1471 NZ LYS A 95 -11.295 -0.172 12.527 1.00 0.00 N ATOM 0 H LYS A 95 -5.588 0.535 9.938 1.00 0.00 H new ATOM 0 HA LYS A 95 -6.164 -2.089 9.394 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -7.715 0.421 8.641 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -8.392 -1.195 8.649 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -7.560 -1.240 11.152 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -7.528 0.504 10.983 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -9.913 0.476 10.260 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -9.944 -1.267 10.431 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -9.388 -1.034 12.854 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -9.376 0.710 12.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -11.484 -0.068 13.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -11.709 0.633 12.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -11.721 -1.057 12.184 1.00 0.00 H new ATOM 1485 N SER A 96 -5.911 -0.318 6.611 1.00 0.00 N ATOM 1486 CA SER A 96 -5.721 -0.426 5.169 1.00 0.00 C ATOM 1487 C SER A 96 -4.635 -1.445 4.839 1.00 0.00 C ATOM 1488 O SER A 96 -4.774 -2.239 3.907 1.00 0.00 O ATOM 1489 CB SER A 96 -5.355 0.937 4.578 1.00 0.00 C ATOM 1490 OG SER A 96 -6.335 1.910 4.894 1.00 0.00 O ATOM 0 H SER A 96 -5.916 0.638 6.965 1.00 0.00 H new ATOM 0 HA SER A 96 -6.658 -0.765 4.728 1.00 0.00 H new ATOM 0 HB2 SER A 96 -4.386 1.255 4.962 1.00 0.00 H new ATOM 0 HB3 SER A 96 -5.257 0.853 3.496 1.00 0.00 H new ATOM 0 HG SER A 96 -6.253 2.162 5.838 1.00 0.00 H new ATOM 1496 N LEU A 97 -3.552 -1.417 5.608 1.00 0.00 N ATOM 1497 CA LEU A 97 -2.440 -2.338 5.399 1.00 0.00 C ATOM 1498 C LEU A 97 -2.855 -3.772 5.710 1.00 0.00 C ATOM 1499 O LEU A 97 -2.461 -4.707 5.014 1.00 0.00 O ATOM 1500 CB LEU A 97 -1.250 -1.938 6.272 1.00 0.00 C ATOM 1501 CG LEU A 97 -0.574 -0.612 5.920 1.00 0.00 C ATOM 1502 CD1 LEU A 97 0.118 -0.026 7.140 1.00 0.00 C ATOM 1503 CD2 LEU A 97 0.418 -0.805 4.782 1.00 0.00 C ATOM 0 H LEU A 97 -3.420 -0.766 6.382 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.147 -2.284 4.350 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -1.586 -1.888 7.308 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.503 -2.730 6.217 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.341 0.089 5.591 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.593 0.917 6.871 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.617 0.149 7.926 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.874 -0.724 7.500 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.890 0.149 4.545 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.181 -1.523 5.083 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.106 -1.180 3.902 1.00 0.00 H new ATOM 1515 N GLU A 98 -3.655 -3.937 6.759 1.00 0.00 N ATOM 1516 CA GLU A 98 -4.125 -5.258 7.160 1.00 0.00 C ATOM 1517 C GLU A 98 -5.128 -5.809 6.152 1.00 0.00 C ATOM 1518 O GLU A 98 -5.325 -7.020 6.054 1.00 0.00 O ATOM 1519 CB GLU A 98 -4.763 -5.196 8.550 1.00 0.00 C ATOM 1520 CG GLU A 98 -3.753 -5.084 9.679 1.00 0.00 C ATOM 1521 CD GLU A 98 -4.251 -5.703 10.971 1.00 0.00 C ATOM 1522 OE1 GLU A 98 -4.347 -6.947 11.035 1.00 0.00 O ATOM 1523 OE2 GLU A 98 -4.544 -4.943 11.918 1.00 0.00 O ATOM 0 H GLU A 98 -3.991 -3.173 7.346 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.265 -5.927 7.192 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -5.439 -4.342 8.592 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -5.368 -6.089 8.703 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -2.825 -5.572 9.381 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -3.520 -4.033 9.850 1.00 0.00 H new ATOM 1530 N ALA A 99 -5.760 -4.910 5.404 1.00 0.00 N ATOM 1531 CA ALA A 99 -6.742 -5.305 4.402 1.00 0.00 C ATOM 1532 C ALA A 99 -6.075 -5.587 3.060 1.00 0.00 C ATOM 1533 O ALA A 99 -6.534 -6.432 2.293 1.00 0.00 O ATOM 1534 CB ALA A 99 -7.804 -4.226 4.249 1.00 0.00 C ATOM 0 H ALA A 99 -5.609 -3.904 5.473 1.00 0.00 H new ATOM 0 HA ALA A 99 -7.220 -6.224 4.741 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -8.531 -4.535 3.497 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -8.310 -4.076 5.203 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.333 -3.294 3.937 1.00 0.00 H new ATOM 1540 N MET A 100 -4.988 -4.873 2.783 1.00 0.00 N ATOM 1541 CA MET A 100 -4.258 -5.047 1.533 1.00 0.00 C ATOM 1542 C MET A 100 -3.519 -6.382 1.517 1.00 0.00 C ATOM 1543 O MET A 100 -3.750 -7.220 0.645 1.00 0.00 O ATOM 1544 CB MET A 100 -3.266 -3.900 1.334 1.00 0.00 C ATOM 1545 CG MET A 100 -2.428 -4.033 0.072 1.00 0.00 C ATOM 1546 SD MET A 100 -1.454 -2.556 -0.274 1.00 0.00 S ATOM 1547 CE MET A 100 -0.352 -2.538 1.137 1.00 0.00 C ATOM 0 H MET A 100 -4.594 -4.169 3.407 1.00 0.00 H new ATOM 0 HA MET A 100 -4.979 -5.041 0.716 1.00 0.00 H new ATOM 0 HB2 MET A 100 -3.814 -2.958 1.299 1.00 0.00 H new ATOM 0 HB3 MET A 100 -2.602 -3.850 2.197 1.00 0.00 H new ATOM 0 HG2 MET A 100 -1.760 -4.889 0.173 1.00 0.00 H new ATOM 0 HG3 MET A 100 -3.083 -4.238 -0.775 1.00 0.00 H new ATOM 0 HE1 MET A 100 0.125 -1.561 1.214 1.00 0.00 H new ATOM 0 HE2 MET A 100 -0.921 -2.737 2.045 1.00 0.00 H new ATOM 0 HE3 MET A 100 0.412 -3.305 1.012 1.00 0.00 H new ATOM 1557 N LYS A 101 -2.630 -6.573 2.486 1.00 0.00 N ATOM 1558 CA LYS A 101 -1.858 -7.806 2.584 1.00 0.00 C ATOM 1559 C LYS A 101 -2.766 -9.027 2.474 1.00 0.00 C ATOM 1560 O LYS A 101 -2.482 -9.958 1.721 1.00 0.00 O ATOM 1561 CB LYS A 101 -1.089 -7.846 3.906 1.00 0.00 C ATOM 1562 CG LYS A 101 -1.985 -7.941 5.129 1.00 0.00 C ATOM 1563 CD LYS A 101 -1.189 -7.805 6.416 1.00 0.00 C ATOM 1564 CE LYS A 101 -1.876 -8.513 7.573 1.00 0.00 C ATOM 1565 NZ LYS A 101 -1.512 -9.955 7.636 1.00 0.00 N ATOM 0 H LYS A 101 -2.426 -5.889 3.215 1.00 0.00 H new ATOM 0 HA LYS A 101 -1.148 -7.828 1.757 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -0.410 -8.699 3.896 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -0.474 -6.950 3.986 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -2.745 -7.161 5.086 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -2.509 -8.897 5.124 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -0.192 -8.221 6.274 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -1.063 -6.750 6.657 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.602 -8.028 8.510 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -2.957 -8.416 7.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -2.364 -10.520 7.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -1.100 -10.249 6.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -0.818 -10.105 8.396 1.00 0.00 H new ATOM 1579 N SER A 102 -3.860 -9.015 3.229 1.00 0.00 N ATOM 1580 CA SER A 102 -4.809 -10.122 3.218 1.00 0.00 C ATOM 1581 C SER A 102 -4.954 -10.699 1.813 1.00 0.00 C ATOM 1582 O SER A 102 -4.935 -11.916 1.624 1.00 0.00 O ATOM 1583 CB SER A 102 -6.172 -9.659 3.735 1.00 0.00 C ATOM 1584 OG SER A 102 -7.047 -10.758 3.922 1.00 0.00 O ATOM 0 H SER A 102 -4.111 -8.251 3.856 1.00 0.00 H new ATOM 0 HA SER A 102 -4.426 -10.903 3.875 1.00 0.00 H new ATOM 0 HB2 SER A 102 -6.045 -9.127 4.678 1.00 0.00 H new ATOM 0 HB3 SER A 102 -6.613 -8.956 3.029 1.00 0.00 H new ATOM 0 HG SER A 102 -7.911 -10.436 4.254 1.00 0.00 H new ATOM 1590 N HIS A 103 -5.099 -9.816 0.830 1.00 0.00 N ATOM 1591 CA HIS A 103 -5.247 -10.237 -0.559 1.00 0.00 C ATOM 1592 C HIS A 103 -4.008 -10.989 -1.034 1.00 0.00 C ATOM 1593 O HIS A 103 -4.108 -12.096 -1.565 1.00 0.00 O ATOM 1594 CB HIS A 103 -5.498 -9.025 -1.457 1.00 0.00 C ATOM 1595 CG HIS A 103 -6.127 -9.372 -2.770 1.00 0.00 C ATOM 1596 ND1 HIS A 103 -5.441 -9.338 -3.966 1.00 0.00 N ATOM 1597 CD2 HIS A 103 -7.387 -9.765 -3.072 1.00 0.00 C ATOM 1598 CE1 HIS A 103 -6.252 -9.692 -4.947 1.00 0.00 C ATOM 1599 NE2 HIS A 103 -7.439 -9.957 -4.431 1.00 0.00 N ATOM 0 H HIS A 103 -5.117 -8.806 0.969 1.00 0.00 H new ATOM 0 HA HIS A 103 -6.103 -10.909 -0.620 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -6.141 -8.320 -0.930 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -4.551 -8.517 -1.640 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -8.200 -9.902 -2.374 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -5.989 -9.754 -5.993 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -8.261 -10.256 -4.957 1.00 0.00 H new ATOM 1607 N CYS A 104 -2.843 -10.382 -0.840 1.00 0.00 N ATOM 1608 CA CYS A 104 -1.584 -10.994 -1.251 1.00 0.00 C ATOM 1609 C CYS A 104 -1.593 -12.494 -0.975 1.00 0.00 C ATOM 1610 O CYS A 104 -1.474 -13.306 -1.893 1.00 0.00 O ATOM 1611 CB CYS A 104 -0.412 -10.336 -0.522 1.00 0.00 C ATOM 1612 SG CYS A 104 -0.105 -8.623 -1.012 1.00 0.00 S ATOM 0 H CYS A 104 -2.743 -9.467 -0.401 1.00 0.00 H new ATOM 0 HA CYS A 104 -1.467 -10.841 -2.324 1.00 0.00 H new ATOM 0 HB2 CYS A 104 -0.602 -10.367 0.551 1.00 0.00 H new ATOM 0 HB3 CYS A 104 0.489 -10.921 -0.703 1.00 0.00 H new ATOM 0 HG CYS A 104 -0.917 -8.294 -1.972 1.00 0.00 H new ATOM 1618 N LEU A 105 -1.734 -12.855 0.296 1.00 0.00 N ATOM 1619 CA LEU A 105 -1.757 -14.258 0.694 1.00 0.00 C ATOM 1620 C LEU A 105 -2.831 -15.024 -0.071 1.00 0.00 C ATOM 1621 O LEU A 105 -2.546 -16.025 -0.729 1.00 0.00 O ATOM 1622 CB LEU A 105 -2.004 -14.377 2.199 1.00 0.00 C ATOM 1623 CG LEU A 105 -1.163 -13.464 3.092 1.00 0.00 C ATOM 1624 CD1 LEU A 105 -1.856 -12.125 3.289 1.00 0.00 C ATOM 1625 CD2 LEU A 105 -0.894 -14.130 4.434 1.00 0.00 C ATOM 0 H LEU A 105 -1.834 -12.196 1.068 1.00 0.00 H new ATOM 0 HA LEU A 105 -0.787 -14.694 0.455 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -3.057 -14.170 2.391 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.822 -15.410 2.496 1.00 0.00 H new ATOM 0 HG LEU A 105 -0.207 -13.286 2.599 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.243 -11.488 3.927 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -1.996 -11.642 2.322 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -2.826 -12.283 3.759 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -0.294 -13.466 5.056 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -1.840 -14.338 4.933 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.354 -15.064 4.275 1.00 0.00 H new ATOM 1637 N LYS A 106 -4.068 -14.545 0.017 1.00 0.00 N ATOM 1638 CA LYS A 106 -5.186 -15.181 -0.670 1.00 0.00 C ATOM 1639 C LYS A 106 -4.754 -15.717 -2.031 1.00 0.00 C ATOM 1640 O LYS A 106 -4.854 -16.914 -2.297 1.00 0.00 O ATOM 1641 CB LYS A 106 -6.337 -14.188 -0.842 1.00 0.00 C ATOM 1642 CG LYS A 106 -7.269 -14.123 0.356 1.00 0.00 C ATOM 1643 CD LYS A 106 -8.052 -12.821 0.383 1.00 0.00 C ATOM 1644 CE LYS A 106 -9.247 -12.909 1.320 1.00 0.00 C ATOM 1645 NZ LYS A 106 -10.236 -13.925 0.863 1.00 0.00 N ATOM 0 H LYS A 106 -4.321 -13.718 0.558 1.00 0.00 H new ATOM 0 HA LYS A 106 -5.526 -16.019 -0.061 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -5.925 -13.196 -1.025 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -6.913 -14.462 -1.726 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -7.961 -14.964 0.326 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -6.690 -14.220 1.274 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -7.398 -12.009 0.700 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -8.394 -12.580 -0.623 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -8.904 -13.161 2.323 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -9.731 -11.934 1.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -11.171 -13.703 1.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -10.290 -13.914 -0.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -9.938 -14.868 1.184 1.00 0.00 H new ATOM 1659 N ASN A 107 -4.274 -14.823 -2.889 1.00 0.00 N ATOM 1660 CA ASN A 107 -3.826 -15.206 -4.223 1.00 0.00 C ATOM 1661 C ASN A 107 -2.471 -15.905 -4.162 1.00 0.00 C ATOM 1662 O ASN A 107 -2.359 -17.092 -4.464 1.00 0.00 O ATOM 1663 CB ASN A 107 -3.738 -13.976 -5.127 1.00 0.00 C ATOM 1664 CG ASN A 107 -3.394 -12.715 -4.357 1.00 0.00 C ATOM 1665 OD1 ASN A 107 -2.228 -12.454 -4.061 1.00 0.00 O ATOM 1666 ND2 ASN A 107 -4.411 -11.928 -4.028 1.00 0.00 N ATOM 0 H ASN A 107 -4.185 -13.828 -2.684 1.00 0.00 H new ATOM 0 HA ASN A 107 -4.555 -15.902 -4.638 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.984 -14.146 -5.895 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -4.690 -13.837 -5.640 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.242 -11.067 -3.509 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -5.361 -12.185 -4.295 1.00 0.00 H new ATOM 1673 N GLY A 108 -1.444 -15.159 -3.768 1.00 0.00 N ATOM 1674 CA GLY A 108 -0.110 -15.723 -3.673 1.00 0.00 C ATOM 1675 C GLY A 108 0.973 -14.704 -3.966 1.00 0.00 C ATOM 1676 O GLY A 108 2.013 -15.037 -4.533 1.00 0.00 O ATOM 0 H GLY A 108 -1.512 -14.174 -3.513 1.00 0.00 H new ATOM 0 HA2 GLY A 108 0.039 -16.129 -2.673 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -0.020 -16.555 -4.371 1.00 0.00 H new ATOM 1680 N VAL A 109 0.728 -13.455 -3.580 1.00 0.00 N ATOM 1681 CA VAL A 109 1.691 -12.383 -3.804 1.00 0.00 C ATOM 1682 C VAL A 109 2.671 -12.272 -2.642 1.00 0.00 C ATOM 1683 O VAL A 109 2.364 -11.672 -1.611 1.00 0.00 O ATOM 1684 CB VAL A 109 0.985 -11.028 -3.998 1.00 0.00 C ATOM 1685 CG1 VAL A 109 2.005 -9.903 -4.086 1.00 0.00 C ATOM 1686 CG2 VAL A 109 0.105 -11.058 -5.238 1.00 0.00 C ATOM 0 H VAL A 109 -0.129 -13.161 -3.111 1.00 0.00 H new ATOM 0 HA VAL A 109 2.238 -12.633 -4.713 1.00 0.00 H new ATOM 0 HB VAL A 109 0.348 -10.843 -3.133 1.00 0.00 H new ATOM 0 HG11 VAL A 109 1.488 -8.953 -4.223 1.00 0.00 H new ATOM 0 HG12 VAL A 109 2.589 -9.869 -3.166 1.00 0.00 H new ATOM 0 HG13 VAL A 109 2.670 -10.080 -4.932 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -0.386 -10.092 -5.359 1.00 0.00 H new ATOM 0 HG22 VAL A 109 0.719 -11.266 -6.115 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -0.649 -11.837 -5.130 1.00 0.00 H new ATOM 1696 N THR A 110 3.854 -12.854 -2.815 1.00 0.00 N ATOM 1697 CA THR A 110 4.880 -12.821 -1.780 1.00 0.00 C ATOM 1698 C THR A 110 5.708 -11.544 -1.868 1.00 0.00 C ATOM 1699 O THR A 110 6.341 -11.136 -0.894 1.00 0.00 O ATOM 1700 CB THR A 110 5.820 -14.037 -1.883 1.00 0.00 C ATOM 1701 OG1 THR A 110 6.914 -13.888 -0.971 1.00 0.00 O ATOM 1702 CG2 THR A 110 6.351 -14.193 -3.300 1.00 0.00 C ATOM 0 H THR A 110 4.125 -13.354 -3.662 1.00 0.00 H new ATOM 0 HA THR A 110 4.363 -12.850 -0.821 1.00 0.00 H new ATOM 0 HB THR A 110 5.252 -14.931 -1.626 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.570 -13.825 -0.055 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.012 -15.058 -3.348 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.517 -14.335 -3.987 1.00 0.00 H new ATOM 0 HG23 THR A 110 6.905 -13.297 -3.582 1.00 0.00 H new ATOM 1710 N ASP A 111 5.699 -10.918 -3.039 1.00 0.00 N ATOM 1711 CA ASP A 111 6.448 -9.685 -3.253 1.00 0.00 C ATOM 1712 C ASP A 111 5.505 -8.507 -3.475 1.00 0.00 C ATOM 1713 O ASP A 111 4.361 -8.685 -3.895 1.00 0.00 O ATOM 1714 CB ASP A 111 7.387 -9.835 -4.451 1.00 0.00 C ATOM 1715 CG ASP A 111 6.638 -9.928 -5.766 1.00 0.00 C ATOM 1716 OD1 ASP A 111 5.391 -9.866 -5.743 1.00 0.00 O ATOM 1717 OD2 ASP A 111 7.299 -10.064 -6.817 1.00 0.00 O ATOM 0 H ASP A 111 5.181 -11.244 -3.855 1.00 0.00 H new ATOM 0 HA ASP A 111 7.040 -9.489 -2.359 1.00 0.00 H new ATOM 0 HB2 ASP A 111 8.068 -8.985 -4.484 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.998 -10.728 -4.320 1.00 0.00 H new ATOM 1722 N LEU A 112 5.991 -7.305 -3.188 1.00 0.00 N ATOM 1723 CA LEU A 112 5.191 -6.096 -3.356 1.00 0.00 C ATOM 1724 C LEU A 112 6.084 -4.868 -3.505 1.00 0.00 C ATOM 1725 O LEU A 112 7.207 -4.840 -3.001 1.00 0.00 O ATOM 1726 CB LEU A 112 4.251 -5.914 -2.163 1.00 0.00 C ATOM 1727 CG LEU A 112 3.011 -5.054 -2.411 1.00 0.00 C ATOM 1728 CD1 LEU A 112 2.260 -5.542 -3.639 1.00 0.00 C ATOM 1729 CD2 LEU A 112 2.103 -5.062 -1.189 1.00 0.00 C ATOM 0 H LEU A 112 6.935 -7.141 -2.838 1.00 0.00 H new ATOM 0 HA LEU A 112 4.599 -6.205 -4.265 1.00 0.00 H new ATOM 0 HB2 LEU A 112 3.925 -6.899 -1.829 1.00 0.00 H new ATOM 0 HB3 LEU A 112 4.818 -5.472 -1.344 1.00 0.00 H new ATOM 0 HG LEU A 112 3.334 -4.029 -2.592 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.381 -4.918 -3.800 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.911 -5.483 -4.511 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.949 -6.576 -3.488 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.226 -4.445 -1.383 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.788 -6.084 -0.976 1.00 0.00 H new ATOM 0 HD23 LEU A 112 2.644 -4.663 -0.331 1.00 0.00 H new ATOM 1741 N SER A 113 5.577 -3.855 -4.200 1.00 0.00 N ATOM 1742 CA SER A 113 6.329 -2.625 -4.418 1.00 0.00 C ATOM 1743 C SER A 113 5.443 -1.402 -4.202 1.00 0.00 C ATOM 1744 O SER A 113 4.313 -1.347 -4.686 1.00 0.00 O ATOM 1745 CB SER A 113 6.913 -2.603 -5.831 1.00 0.00 C ATOM 1746 OG SER A 113 6.012 -2.004 -6.746 1.00 0.00 O ATOM 0 H SER A 113 4.648 -3.862 -4.622 1.00 0.00 H new ATOM 0 HA SER A 113 7.145 -2.594 -3.696 1.00 0.00 H new ATOM 0 HB2 SER A 113 7.854 -2.053 -5.830 1.00 0.00 H new ATOM 0 HB3 SER A 113 7.138 -3.620 -6.151 1.00 0.00 H new ATOM 0 HG SER A 113 5.175 -2.513 -6.761 1.00 0.00 H new ATOM 1752 N MET A 114 5.965 -0.422 -3.471 1.00 0.00 N ATOM 1753 CA MET A 114 5.223 0.802 -3.192 1.00 0.00 C ATOM 1754 C MET A 114 6.168 1.933 -2.801 1.00 0.00 C ATOM 1755 O MET A 114 7.022 1.787 -1.926 1.00 0.00 O ATOM 1756 CB MET A 114 4.206 0.563 -2.075 1.00 0.00 C ATOM 1757 CG MET A 114 4.841 0.222 -0.736 1.00 0.00 C ATOM 1758 SD MET A 114 3.621 -0.160 0.535 1.00 0.00 S ATOM 1759 CE MET A 114 2.979 -1.719 -0.070 1.00 0.00 C ATOM 0 H MET A 114 6.899 -0.452 -3.061 1.00 0.00 H new ATOM 0 HA MET A 114 4.694 1.092 -4.100 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.590 1.455 -1.959 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.540 -0.248 -2.369 1.00 0.00 H new ATOM 0 HG2 MET A 114 5.508 -0.631 -0.862 1.00 0.00 H new ATOM 0 HG3 MET A 114 5.454 1.060 -0.405 1.00 0.00 H new ATOM 0 HE1 MET A 114 1.925 -1.605 -0.323 1.00 0.00 H new ATOM 0 HE2 MET A 114 3.534 -2.021 -0.958 1.00 0.00 H new ATOM 0 HE3 MET A 114 3.086 -2.481 0.702 1.00 0.00 H new ATOM 1769 N PRO A 115 6.015 3.089 -3.464 1.00 0.00 N ATOM 1770 CA PRO A 115 6.846 4.268 -3.202 1.00 0.00 C ATOM 1771 C PRO A 115 6.551 4.895 -1.844 1.00 0.00 C ATOM 1772 O PRO A 115 5.907 4.281 -0.993 1.00 0.00 O ATOM 1773 CB PRO A 115 6.462 5.230 -4.329 1.00 0.00 C ATOM 1774 CG PRO A 115 5.083 4.823 -4.721 1.00 0.00 C ATOM 1775 CD PRO A 115 5.018 3.335 -4.519 1.00 0.00 C ATOM 0 HA PRO A 115 7.907 4.021 -3.177 1.00 0.00 H new ATOM 0 HB2 PRO A 115 6.488 6.266 -3.991 1.00 0.00 H new ATOM 0 HB3 PRO A 115 7.152 5.151 -5.169 1.00 0.00 H new ATOM 0 HG2 PRO A 115 4.337 5.333 -4.111 1.00 0.00 H new ATOM 0 HG3 PRO A 115 4.879 5.085 -5.759 1.00 0.00 H new ATOM 0 HD2 PRO A 115 4.022 3.014 -4.213 1.00 0.00 H new ATOM 0 HD3 PRO A 115 5.260 2.794 -5.434 1.00 0.00 H new ATOM 1783 N ARG A 116 7.027 6.120 -1.647 1.00 0.00 N ATOM 1784 CA ARG A 116 6.815 6.829 -0.391 1.00 0.00 C ATOM 1785 C ARG A 116 5.330 7.096 -0.161 1.00 0.00 C ATOM 1786 O ARG A 116 4.639 7.613 -1.039 1.00 0.00 O ATOM 1787 CB ARG A 116 7.587 8.150 -0.390 1.00 0.00 C ATOM 1788 CG ARG A 116 9.090 7.977 -0.534 1.00 0.00 C ATOM 1789 CD ARG A 116 9.508 7.931 -1.996 1.00 0.00 C ATOM 1790 NE ARG A 116 10.866 8.430 -2.193 1.00 0.00 N ATOM 1791 CZ ARG A 116 11.200 9.711 -2.093 1.00 0.00 C ATOM 1792 NH1 ARG A 116 10.279 10.619 -1.799 1.00 0.00 N ATOM 1793 NH2 ARG A 116 12.457 10.088 -2.287 1.00 0.00 N ATOM 0 H ARG A 116 7.562 6.642 -2.341 1.00 0.00 H new ATOM 0 HA ARG A 116 7.183 6.199 0.419 1.00 0.00 H new ATOM 0 HB2 ARG A 116 7.222 8.775 -1.205 1.00 0.00 H new ATOM 0 HB3 ARG A 116 7.378 8.682 0.538 1.00 0.00 H new ATOM 0 HG2 ARG A 116 9.602 8.799 -0.034 1.00 0.00 H new ATOM 0 HG3 ARG A 116 9.401 7.058 -0.036 1.00 0.00 H new ATOM 0 HD2 ARG A 116 9.442 6.906 -2.360 1.00 0.00 H new ATOM 0 HD3 ARG A 116 8.814 8.525 -2.590 1.00 0.00 H new ATOM 0 HE ARG A 116 11.598 7.757 -2.420 1.00 0.00 H new ATOM 0 HH11 ARG A 116 9.311 10.334 -1.649 1.00 0.00 H new ATOM 0 HH12 ARG A 116 10.538 11.602 -1.723 1.00 0.00 H new ATOM 0 HH21 ARG A 116 13.169 9.393 -2.513 1.00 0.00 H new ATOM 0 HH22 ARG A 116 12.712 11.073 -2.210 1.00 0.00 H new ATOM 1807 N ILE A 117 4.847 6.738 1.024 1.00 0.00 N ATOM 1808 CA ILE A 117 3.445 6.939 1.370 1.00 0.00 C ATOM 1809 C ILE A 117 3.306 7.784 2.631 1.00 0.00 C ATOM 1810 O ILE A 117 4.015 7.574 3.614 1.00 0.00 O ATOM 1811 CB ILE A 117 2.720 5.597 1.581 1.00 0.00 C ATOM 1812 CG1 ILE A 117 3.493 4.725 2.573 1.00 0.00 C ATOM 1813 CG2 ILE A 117 2.547 4.873 0.254 1.00 0.00 C ATOM 1814 CD1 ILE A 117 2.805 3.416 2.890 1.00 0.00 C ATOM 0 H ILE A 117 5.406 6.307 1.761 1.00 0.00 H new ATOM 0 HA ILE A 117 2.985 7.463 0.532 1.00 0.00 H new ATOM 0 HB ILE A 117 1.732 5.797 1.995 1.00 0.00 H new ATOM 0 HG12 ILE A 117 4.483 4.517 2.167 1.00 0.00 H new ATOM 0 HG13 ILE A 117 3.639 5.283 3.498 1.00 0.00 H new ATOM 0 HG21 ILE A 117 2.033 3.926 0.420 1.00 0.00 H new ATOM 0 HG22 ILE A 117 1.958 5.491 -0.424 1.00 0.00 H new ATOM 0 HG23 ILE A 117 3.526 4.682 -0.187 1.00 0.00 H new ATOM 0 HD11 ILE A 117 3.409 2.850 3.599 1.00 0.00 H new ATOM 0 HD12 ILE A 117 1.826 3.616 3.326 1.00 0.00 H new ATOM 0 HD13 ILE A 117 2.683 2.838 1.974 1.00 0.00 H new ATOM 1925 N GLN A 125 3.954 10.949 9.223 1.00 0.00 N ATOM 1926 CA GLN A 125 5.407 10.924 9.103 1.00 0.00 C ATOM 1927 C GLN A 125 5.907 9.508 8.837 1.00 0.00 C ATOM 1928 O GLN A 125 5.617 8.584 9.597 1.00 0.00 O ATOM 1929 CB GLN A 125 6.054 11.476 10.374 1.00 0.00 C ATOM 1930 CG GLN A 125 5.851 12.971 10.561 1.00 0.00 C ATOM 1931 CD GLN A 125 6.912 13.796 9.859 1.00 0.00 C ATOM 1932 OE1 GLN A 125 7.046 13.745 8.636 1.00 0.00 O ATOM 1933 NE2 GLN A 125 7.674 14.562 10.631 1.00 0.00 N ATOM 0 HA GLN A 125 5.688 11.553 8.258 1.00 0.00 H new ATOM 0 HB2 GLN A 125 5.644 10.952 11.237 1.00 0.00 H new ATOM 0 HB3 GLN A 125 7.123 11.263 10.349 1.00 0.00 H new ATOM 0 HG2 GLN A 125 4.868 13.251 10.181 1.00 0.00 H new ATOM 0 HG3 GLN A 125 5.860 13.205 11.626 1.00 0.00 H new ATOM 0 HE21 GLN A 125 7.528 14.574 11.640 1.00 0.00 H new ATOM 0 HE22 GLN A 125 8.405 15.139 10.215 1.00 0.00 H new ATOM 1942 N TRP A 126 6.659 9.345 7.755 1.00 0.00 N ATOM 1943 CA TRP A 126 7.199 8.041 7.388 1.00 0.00 C ATOM 1944 C TRP A 126 7.605 7.252 8.628 1.00 0.00 C ATOM 1945 O TRP A 126 7.425 6.036 8.687 1.00 0.00 O ATOM 1946 CB TRP A 126 8.402 8.207 6.458 1.00 0.00 C ATOM 1947 CG TRP A 126 9.022 6.905 6.051 1.00 0.00 C ATOM 1948 CD1 TRP A 126 10.292 6.481 6.322 1.00 0.00 C ATOM 1949 CD2 TRP A 126 8.401 5.858 5.297 1.00 0.00 C ATOM 1950 NE1 TRP A 126 10.497 5.234 5.783 1.00 0.00 N ATOM 1951 CE2 TRP A 126 9.352 4.830 5.150 1.00 0.00 C ATOM 1952 CE3 TRP A 126 7.133 5.689 4.735 1.00 0.00 C ATOM 1953 CZ2 TRP A 126 9.073 3.651 4.462 1.00 0.00 C ATOM 1954 CZ3 TRP A 126 6.858 4.519 4.052 1.00 0.00 C ATOM 1955 CH2 TRP A 126 7.824 3.512 3.921 1.00 0.00 C ATOM 0 H TRP A 126 6.909 10.100 7.116 1.00 0.00 H new ATOM 0 HA TRP A 126 6.419 7.487 6.866 1.00 0.00 H new ATOM 0 HB2 TRP A 126 8.090 8.747 5.564 1.00 0.00 H new ATOM 0 HB3 TRP A 126 9.154 8.820 6.955 1.00 0.00 H new ATOM 0 HD1 TRP A 126 11.027 7.044 6.878 1.00 0.00 H new ATOM 0 HE1 TRP A 126 11.362 4.696 5.844 1.00 0.00 H new ATOM 0 HE3 TRP A 126 6.381 6.458 4.832 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 9.816 2.874 4.359 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 5.882 4.378 3.612 1.00 0.00 H new ATOM 0 HH2 TRP A 126 7.578 2.609 3.383 1.00 0.00 H new ATOM 1966 N GLU A 127 8.153 7.952 9.617 1.00 0.00 N ATOM 1967 CA GLU A 127 8.584 7.315 10.856 1.00 0.00 C ATOM 1968 C GLU A 127 7.481 6.426 11.423 1.00 0.00 C ATOM 1969 O GLU A 127 7.718 5.270 11.770 1.00 0.00 O ATOM 1970 CB GLU A 127 8.984 8.372 11.887 1.00 0.00 C ATOM 1971 CG GLU A 127 9.981 7.870 12.918 1.00 0.00 C ATOM 1972 CD GLU A 127 10.791 8.991 13.540 1.00 0.00 C ATOM 1973 OE1 GLU A 127 10.183 9.996 13.966 1.00 0.00 O ATOM 1974 OE2 GLU A 127 12.031 8.865 13.601 1.00 0.00 O ATOM 0 H GLU A 127 8.309 8.960 9.584 1.00 0.00 H new ATOM 0 HA GLU A 127 9.450 6.692 10.632 1.00 0.00 H new ATOM 0 HB2 GLU A 127 9.412 9.230 11.368 1.00 0.00 H new ATOM 0 HB3 GLU A 127 8.089 8.724 12.400 1.00 0.00 H new ATOM 0 HG2 GLU A 127 9.448 7.334 13.703 1.00 0.00 H new ATOM 0 HG3 GLU A 127 10.657 7.156 12.447 1.00 0.00 H new ATOM 1981 N ASN A 128 6.275 6.976 11.515 1.00 0.00 N ATOM 1982 CA ASN A 128 5.135 6.235 12.041 1.00 0.00 C ATOM 1983 C ASN A 128 4.645 5.202 11.031 1.00 0.00 C ATOM 1984 O ASN A 128 4.610 4.005 11.318 1.00 0.00 O ATOM 1985 CB ASN A 128 3.998 7.194 12.399 1.00 0.00 C ATOM 1986 CG ASN A 128 4.398 8.191 13.469 1.00 0.00 C ATOM 1987 OD1 ASN A 128 4.285 9.476 13.151 1.00 0.00 O flip ATOM 1988 ND2 ASN A 128 4.804 7.812 14.567 1.00 0.00 N flip ATOM 0 H ASN A 128 6.062 7.933 11.232 1.00 0.00 H new ATOM 0 HA ASN A 128 5.457 5.712 12.941 1.00 0.00 H new ATOM 0 HB2 ASN A 128 3.685 7.732 11.504 1.00 0.00 H new ATOM 0 HB3 ASN A 128 3.138 6.620 12.744 1.00 0.00 H new ATOM 0 HD21 ASN A 128 4.875 6.815 14.768 1.00 0.00 H new ATOM 0 HD22 ASN A 128 5.070 8.495 15.276 1.00 0.00 H new ATOM 1995 N VAL A 129 4.267 5.672 9.847 1.00 0.00 N ATOM 1996 CA VAL A 129 3.780 4.790 8.793 1.00 0.00 C ATOM 1997 C VAL A 129 4.679 3.569 8.640 1.00 0.00 C ATOM 1998 O VAL A 129 4.254 2.438 8.876 1.00 0.00 O ATOM 1999 CB VAL A 129 3.695 5.524 7.442 1.00 0.00 C ATOM 2000 CG1 VAL A 129 3.211 4.580 6.351 1.00 0.00 C ATOM 2001 CG2 VAL A 129 2.785 6.738 7.551 1.00 0.00 C ATOM 0 H VAL A 129 4.289 6.660 9.593 1.00 0.00 H new ATOM 0 HA VAL A 129 2.781 4.468 9.086 1.00 0.00 H new ATOM 0 HB VAL A 129 4.693 5.870 7.173 1.00 0.00 H new ATOM 0 HG11 VAL A 129 3.157 5.116 5.404 1.00 0.00 H new ATOM 0 HG12 VAL A 129 3.906 3.746 6.257 1.00 0.00 H new ATOM 0 HG13 VAL A 129 2.222 4.201 6.610 1.00 0.00 H new ATOM 0 HG21 VAL A 129 2.737 7.244 6.587 1.00 0.00 H new ATOM 0 HG22 VAL A 129 1.785 6.418 7.843 1.00 0.00 H new ATOM 0 HG23 VAL A 129 3.180 7.423 8.301 1.00 0.00 H new ATOM 2011 N SER A 130 5.927 3.804 8.245 1.00 0.00 N ATOM 2012 CA SER A 130 6.886 2.723 8.058 1.00 0.00 C ATOM 2013 C SER A 130 6.768 1.691 9.175 1.00 0.00 C ATOM 2014 O SER A 130 6.795 0.486 8.928 1.00 0.00 O ATOM 2015 CB SER A 130 8.311 3.279 8.011 1.00 0.00 C ATOM 2016 OG SER A 130 8.656 3.900 9.237 1.00 0.00 O ATOM 0 H SER A 130 6.297 4.734 8.049 1.00 0.00 H new ATOM 0 HA SER A 130 6.663 2.233 7.110 1.00 0.00 H new ATOM 0 HB2 SER A 130 9.013 2.473 7.798 1.00 0.00 H new ATOM 0 HB3 SER A 130 8.397 4.000 7.198 1.00 0.00 H new ATOM 0 HG SER A 130 8.368 4.837 9.222 1.00 0.00 H new ATOM 2022 N ALA A 131 6.635 2.174 10.406 1.00 0.00 N ATOM 2023 CA ALA A 131 6.510 1.295 11.562 1.00 0.00 C ATOM 2024 C ALA A 131 5.265 0.421 11.455 1.00 0.00 C ATOM 2025 O ALA A 131 5.309 -0.775 11.740 1.00 0.00 O ATOM 2026 CB ALA A 131 6.474 2.113 12.845 1.00 0.00 C ATOM 0 H ALA A 131 6.611 3.169 10.628 1.00 0.00 H new ATOM 0 HA ALA A 131 7.381 0.640 11.585 1.00 0.00 H new ATOM 0 HB1 ALA A 131 6.380 1.444 13.700 1.00 0.00 H new ATOM 0 HB2 ALA A 131 7.394 2.690 12.935 1.00 0.00 H new ATOM 0 HB3 ALA A 131 5.621 2.792 12.820 1.00 0.00 H new ATOM 2032 N MET A 132 4.156 1.027 11.043 1.00 0.00 N ATOM 2033 CA MET A 132 2.899 0.302 10.899 1.00 0.00 C ATOM 2034 C MET A 132 3.050 -0.860 9.922 1.00 0.00 C ATOM 2035 O MET A 132 2.529 -1.951 10.156 1.00 0.00 O ATOM 2036 CB MET A 132 1.794 1.245 10.419 1.00 0.00 C ATOM 2037 CG MET A 132 1.046 1.930 11.551 1.00 0.00 C ATOM 2038 SD MET A 132 1.995 3.266 12.302 1.00 0.00 S ATOM 2039 CE MET A 132 0.864 4.640 12.102 1.00 0.00 C ATOM 0 H MET A 132 4.102 2.017 10.803 1.00 0.00 H new ATOM 0 HA MET A 132 2.627 -0.100 11.875 1.00 0.00 H new ATOM 0 HB2 MET A 132 2.232 2.005 9.772 1.00 0.00 H new ATOM 0 HB3 MET A 132 1.084 0.681 9.814 1.00 0.00 H new ATOM 0 HG2 MET A 132 0.105 2.327 11.171 1.00 0.00 H new ATOM 0 HG3 MET A 132 0.796 1.193 12.314 1.00 0.00 H new ATOM 0 HE1 MET A 132 0.947 5.307 12.960 1.00 0.00 H new ATOM 0 HE2 MET A 132 1.113 5.186 11.192 1.00 0.00 H new ATOM 0 HE3 MET A 132 -0.157 4.264 12.032 1.00 0.00 H new ATOM 2049 N ILE A 133 3.767 -0.619 8.829 1.00 0.00 N ATOM 2050 CA ILE A 133 3.987 -1.647 7.819 1.00 0.00 C ATOM 2051 C ILE A 133 4.795 -2.810 8.385 1.00 0.00 C ATOM 2052 O ILE A 133 4.646 -3.951 7.949 1.00 0.00 O ATOM 2053 CB ILE A 133 4.719 -1.079 6.589 1.00 0.00 C ATOM 2054 CG1 ILE A 133 3.964 0.130 6.032 1.00 0.00 C ATOM 2055 CG2 ILE A 133 4.871 -2.152 5.521 1.00 0.00 C ATOM 2056 CD1 ILE A 133 4.757 0.923 5.017 1.00 0.00 C ATOM 0 H ILE A 133 4.205 0.278 8.621 1.00 0.00 H new ATOM 0 HA ILE A 133 3.004 -2.005 7.514 1.00 0.00 H new ATOM 0 HB ILE A 133 5.713 -0.754 6.895 1.00 0.00 H new ATOM 0 HG12 ILE A 133 3.038 -0.212 5.570 1.00 0.00 H new ATOM 0 HG13 ILE A 133 3.686 0.786 6.857 1.00 0.00 H new ATOM 0 HG21 ILE A 133 5.390 -1.735 4.658 1.00 0.00 H new ATOM 0 HG22 ILE A 133 5.446 -2.986 5.923 1.00 0.00 H new ATOM 0 HG23 ILE A 133 3.886 -2.504 5.216 1.00 0.00 H new ATOM 0 HD11 ILE A 133 4.160 1.764 4.666 1.00 0.00 H new ATOM 0 HD12 ILE A 133 5.671 1.295 5.480 1.00 0.00 H new ATOM 0 HD13 ILE A 133 5.012 0.282 4.173 1.00 0.00 H new ATOM 2068 N GLU A 134 5.648 -2.512 9.360 1.00 0.00 N ATOM 2069 CA GLU A 134 6.479 -3.534 9.986 1.00 0.00 C ATOM 2070 C GLU A 134 5.636 -4.463 10.855 1.00 0.00 C ATOM 2071 O GLU A 134 5.663 -5.681 10.685 1.00 0.00 O ATOM 2072 CB GLU A 134 7.576 -2.883 10.831 1.00 0.00 C ATOM 2073 CG GLU A 134 8.477 -1.947 10.043 1.00 0.00 C ATOM 2074 CD GLU A 134 9.874 -1.856 10.624 1.00 0.00 C ATOM 2075 OE1 GLU A 134 9.998 -1.761 11.863 1.00 0.00 O ATOM 2076 OE2 GLU A 134 10.845 -1.881 9.839 1.00 0.00 O ATOM 0 H GLU A 134 5.782 -1.572 9.733 1.00 0.00 H new ATOM 0 HA GLU A 134 6.942 -4.125 9.195 1.00 0.00 H new ATOM 0 HB2 GLU A 134 7.113 -2.327 11.646 1.00 0.00 H new ATOM 0 HB3 GLU A 134 8.186 -3.665 11.284 1.00 0.00 H new ATOM 0 HG2 GLU A 134 8.539 -2.292 9.011 1.00 0.00 H new ATOM 0 HG3 GLU A 134 8.031 -0.953 10.021 1.00 0.00 H new ATOM 2083 N GLU A 135 4.888 -3.877 11.785 1.00 0.00 N ATOM 2084 CA GLU A 135 4.039 -4.652 12.682 1.00 0.00 C ATOM 2085 C GLU A 135 2.967 -5.406 11.899 1.00 0.00 C ATOM 2086 O GLU A 135 2.662 -6.561 12.197 1.00 0.00 O ATOM 2087 CB GLU A 135 3.381 -3.737 13.716 1.00 0.00 C ATOM 2088 CG GLU A 135 2.566 -2.611 13.101 1.00 0.00 C ATOM 2089 CD GLU A 135 2.147 -1.570 14.121 1.00 0.00 C ATOM 2090 OE1 GLU A 135 2.970 -0.687 14.441 1.00 0.00 O ATOM 2091 OE2 GLU A 135 0.995 -1.638 14.599 1.00 0.00 O ATOM 0 H GLU A 135 4.853 -2.869 11.937 1.00 0.00 H new ATOM 0 HA GLU A 135 4.667 -5.378 13.198 1.00 0.00 H new ATOM 0 HB2 GLU A 135 2.733 -4.334 14.358 1.00 0.00 H new ATOM 0 HB3 GLU A 135 4.154 -3.308 14.354 1.00 0.00 H new ATOM 0 HG2 GLU A 135 3.151 -2.131 12.316 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.678 -3.028 12.627 1.00 0.00 H new ATOM 2098 N VAL A 136 2.399 -4.744 10.896 1.00 0.00 N ATOM 2099 CA VAL A 136 1.362 -5.350 10.070 1.00 0.00 C ATOM 2100 C VAL A 136 1.907 -6.542 9.291 1.00 0.00 C ATOM 2101 O VAL A 136 1.287 -7.605 9.247 1.00 0.00 O ATOM 2102 CB VAL A 136 0.768 -4.332 9.078 1.00 0.00 C ATOM 2103 CG1 VAL A 136 -0.212 -5.014 8.136 1.00 0.00 C ATOM 2104 CG2 VAL A 136 0.095 -3.191 9.827 1.00 0.00 C ATOM 0 H VAL A 136 2.640 -3.788 10.636 1.00 0.00 H new ATOM 0 HA VAL A 136 0.577 -5.689 10.746 1.00 0.00 H new ATOM 0 HB VAL A 136 1.579 -3.916 8.480 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -0.621 -4.279 7.443 1.00 0.00 H new ATOM 0 HG12 VAL A 136 0.304 -5.793 7.576 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -1.022 -5.459 8.714 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -0.319 -2.481 9.112 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -0.706 -3.588 10.450 1.00 0.00 H new ATOM 0 HG23 VAL A 136 0.828 -2.686 10.456 1.00 0.00 H new ATOM 2114 N PHE A 137 3.072 -6.359 8.678 1.00 0.00 N ATOM 2115 CA PHE A 137 3.702 -7.420 7.900 1.00 0.00 C ATOM 2116 C PHE A 137 4.637 -8.252 8.772 1.00 0.00 C ATOM 2117 O PHE A 137 5.240 -9.219 8.307 1.00 0.00 O ATOM 2118 CB PHE A 137 4.477 -6.826 6.723 1.00 0.00 C ATOM 2119 CG PHE A 137 3.595 -6.318 5.618 1.00 0.00 C ATOM 2120 CD1 PHE A 137 2.874 -5.145 5.774 1.00 0.00 C ATOM 2121 CD2 PHE A 137 3.486 -7.014 4.425 1.00 0.00 C ATOM 2122 CE1 PHE A 137 2.061 -4.677 4.759 1.00 0.00 C ATOM 2123 CE2 PHE A 137 2.675 -6.550 3.407 1.00 0.00 C ATOM 2124 CZ PHE A 137 1.962 -5.379 3.574 1.00 0.00 C ATOM 0 H PHE A 137 3.599 -5.486 8.705 1.00 0.00 H new ATOM 0 HA PHE A 137 2.916 -8.071 7.517 1.00 0.00 H new ATOM 0 HB2 PHE A 137 5.100 -6.008 7.085 1.00 0.00 H new ATOM 0 HB3 PHE A 137 5.149 -7.585 6.321 1.00 0.00 H new ATOM 0 HD1 PHE A 137 2.948 -4.591 6.698 1.00 0.00 H new ATOM 0 HD2 PHE A 137 4.042 -7.930 4.289 1.00 0.00 H new ATOM 0 HE1 PHE A 137 1.503 -3.762 4.893 1.00 0.00 H new ATOM 0 HE2 PHE A 137 2.599 -7.102 2.482 1.00 0.00 H new ATOM 0 HZ PHE A 137 1.328 -5.013 2.780 1.00 0.00 H new ATOM 2134 N GLU A 138 4.754 -7.868 10.040 1.00 0.00 N ATOM 2135 CA GLU A 138 5.617 -8.577 10.976 1.00 0.00 C ATOM 2136 C GLU A 138 5.297 -10.069 10.988 1.00 0.00 C ATOM 2137 O GLU A 138 6.193 -10.908 10.899 1.00 0.00 O ATOM 2138 CB GLU A 138 5.462 -8.000 12.385 1.00 0.00 C ATOM 2139 CG GLU A 138 6.116 -8.846 13.465 1.00 0.00 C ATOM 2140 CD GLU A 138 7.557 -8.450 13.723 1.00 0.00 C ATOM 2141 OE1 GLU A 138 7.860 -7.241 13.656 1.00 0.00 O ATOM 2142 OE2 GLU A 138 8.381 -9.350 13.991 1.00 0.00 O ATOM 0 H GLU A 138 4.262 -7.070 10.442 1.00 0.00 H new ATOM 0 HA GLU A 138 6.649 -8.447 10.649 1.00 0.00 H new ATOM 0 HB2 GLU A 138 5.894 -6.999 12.408 1.00 0.00 H new ATOM 0 HB3 GLU A 138 4.401 -7.895 12.611 1.00 0.00 H new ATOM 0 HG2 GLU A 138 5.546 -8.752 14.389 1.00 0.00 H new ATOM 0 HG3 GLU A 138 6.078 -9.895 13.172 1.00 0.00 H new ATOM 2149 N ALA A 139 4.012 -10.392 11.099 1.00 0.00 N ATOM 2150 CA ALA A 139 3.573 -11.782 11.121 1.00 0.00 C ATOM 2151 C ALA A 139 3.023 -12.205 9.763 1.00 0.00 C ATOM 2152 O ALA A 139 1.887 -12.670 9.659 1.00 0.00 O ATOM 2153 CB ALA A 139 2.525 -11.986 12.205 1.00 0.00 C ATOM 0 H ALA A 139 3.257 -9.710 11.175 1.00 0.00 H new ATOM 0 HA ALA A 139 4.437 -12.408 11.344 1.00 0.00 H new ATOM 0 HB1 ALA A 139 2.206 -13.028 12.211 1.00 0.00 H new ATOM 0 HB2 ALA A 139 2.951 -11.732 13.175 1.00 0.00 H new ATOM 0 HB3 ALA A 139 1.666 -11.344 12.006 1.00 0.00 H new ATOM 2159 N THR A 140 3.834 -12.040 8.723 1.00 0.00 N ATOM 2160 CA THR A 140 3.428 -12.404 7.372 1.00 0.00 C ATOM 2161 C THR A 140 4.604 -12.955 6.574 1.00 0.00 C ATOM 2162 O THR A 140 5.738 -12.972 7.053 1.00 0.00 O ATOM 2163 CB THR A 140 2.833 -11.198 6.621 1.00 0.00 C ATOM 2164 OG1 THR A 140 3.808 -10.154 6.520 1.00 0.00 O ATOM 2165 CG2 THR A 140 1.594 -10.675 7.332 1.00 0.00 C ATOM 0 H THR A 140 4.777 -11.656 8.791 1.00 0.00 H new ATOM 0 HA THR A 140 2.665 -13.176 7.468 1.00 0.00 H new ATOM 0 HB THR A 140 2.547 -11.526 5.621 1.00 0.00 H new ATOM 0 HG1 THR A 140 4.417 -10.200 7.286 1.00 0.00 H new ATOM 0 HG21 THR A 140 1.192 -9.824 6.783 1.00 0.00 H new ATOM 0 HG22 THR A 140 0.843 -11.463 7.381 1.00 0.00 H new ATOM 0 HG23 THR A 140 1.859 -10.363 8.342 1.00 0.00 H new ATOM 2173 N ASP A 141 4.327 -13.404 5.355 1.00 0.00 N ATOM 2174 CA ASP A 141 5.363 -13.954 4.489 1.00 0.00 C ATOM 2175 C ASP A 141 5.493 -13.136 3.208 1.00 0.00 C ATOM 2176 O ASP A 141 5.795 -13.675 2.143 1.00 0.00 O ATOM 2177 CB ASP A 141 5.051 -15.412 4.147 1.00 0.00 C ATOM 2178 CG ASP A 141 6.273 -16.168 3.665 1.00 0.00 C ATOM 2179 OD1 ASP A 141 7.383 -15.884 4.163 1.00 0.00 O ATOM 2180 OD2 ASP A 141 6.120 -17.045 2.789 1.00 0.00 O ATOM 0 H ASP A 141 3.393 -13.398 4.944 1.00 0.00 H new ATOM 0 HA ASP A 141 6.311 -13.909 5.025 1.00 0.00 H new ATOM 0 HB2 ASP A 141 4.644 -15.909 5.027 1.00 0.00 H new ATOM 0 HB3 ASP A 141 4.280 -15.445 3.377 1.00 0.00 H new ATOM 2185 N ILE A 142 5.261 -11.832 3.319 1.00 0.00 N ATOM 2186 CA ILE A 142 5.352 -10.940 2.170 1.00 0.00 C ATOM 2187 C ILE A 142 6.492 -9.942 2.338 1.00 0.00 C ATOM 2188 O ILE A 142 6.792 -9.505 3.450 1.00 0.00 O ATOM 2189 CB ILE A 142 4.037 -10.168 1.952 1.00 0.00 C ATOM 2190 CG1 ILE A 142 2.858 -11.139 1.866 1.00 0.00 C ATOM 2191 CG2 ILE A 142 4.124 -9.319 0.692 1.00 0.00 C ATOM 2192 CD1 ILE A 142 1.545 -10.536 2.313 1.00 0.00 C ATOM 0 H ILE A 142 5.009 -11.370 4.193 1.00 0.00 H new ATOM 0 HA ILE A 142 5.546 -11.566 1.299 1.00 0.00 H new ATOM 0 HB ILE A 142 3.876 -9.506 2.803 1.00 0.00 H new ATOM 0 HG12 ILE A 142 2.758 -11.486 0.838 1.00 0.00 H new ATOM 0 HG13 ILE A 142 3.074 -12.015 2.478 1.00 0.00 H new ATOM 0 HG21 ILE A 142 3.187 -8.780 0.551 1.00 0.00 H new ATOM 0 HG22 ILE A 142 4.942 -8.606 0.790 1.00 0.00 H new ATOM 0 HG23 ILE A 142 4.305 -9.963 -0.169 1.00 0.00 H new ATOM 0 HD11 ILE A 142 0.754 -11.281 2.225 1.00 0.00 H new ATOM 0 HD12 ILE A 142 1.627 -10.214 3.351 1.00 0.00 H new ATOM 0 HD13 ILE A 142 1.306 -9.678 1.685 1.00 0.00 H new ATOM 2204 N LYS A 143 7.125 -9.582 1.227 1.00 0.00 N ATOM 2205 CA LYS A 143 8.232 -8.633 1.248 1.00 0.00 C ATOM 2206 C LYS A 143 7.879 -7.369 0.471 1.00 0.00 C ATOM 2207 O LYS A 143 7.251 -7.435 -0.586 1.00 0.00 O ATOM 2208 CB LYS A 143 9.491 -9.273 0.660 1.00 0.00 C ATOM 2209 CG LYS A 143 9.311 -9.774 -0.763 1.00 0.00 C ATOM 2210 CD LYS A 143 9.667 -8.703 -1.781 1.00 0.00 C ATOM 2211 CE LYS A 143 11.173 -8.556 -1.930 1.00 0.00 C ATOM 2212 NZ LYS A 143 11.752 -9.622 -2.794 1.00 0.00 N ATOM 0 H LYS A 143 6.890 -9.934 0.299 1.00 0.00 H new ATOM 0 HA LYS A 143 8.423 -8.358 2.285 1.00 0.00 H new ATOM 0 HB2 LYS A 143 10.302 -8.545 0.680 1.00 0.00 H new ATOM 0 HB3 LYS A 143 9.795 -10.106 1.294 1.00 0.00 H new ATOM 0 HG2 LYS A 143 9.938 -10.652 -0.923 1.00 0.00 H new ATOM 0 HG3 LYS A 143 8.278 -10.089 -0.911 1.00 0.00 H new ATOM 0 HD2 LYS A 143 9.228 -8.956 -2.746 1.00 0.00 H new ATOM 0 HD3 LYS A 143 9.236 -7.750 -1.474 1.00 0.00 H new ATOM 0 HE2 LYS A 143 11.402 -7.579 -2.356 1.00 0.00 H new ATOM 0 HE3 LYS A 143 11.640 -8.592 -0.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 12.780 -9.486 -2.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 11.556 -10.553 -2.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 11.325 -9.572 -3.741 1.00 0.00 H new ATOM 2226 N ILE A 144 8.289 -6.221 0.999 1.00 0.00 N ATOM 2227 CA ILE A 144 8.018 -4.943 0.352 1.00 0.00 C ATOM 2228 C ILE A 144 9.312 -4.190 0.059 1.00 0.00 C ATOM 2229 O ILE A 144 10.289 -4.300 0.801 1.00 0.00 O ATOM 2230 CB ILE A 144 7.106 -4.055 1.219 1.00 0.00 C ATOM 2231 CG1 ILE A 144 5.725 -4.697 1.367 1.00 0.00 C ATOM 2232 CG2 ILE A 144 6.988 -2.665 0.613 1.00 0.00 C ATOM 2233 CD1 ILE A 144 4.958 -4.209 2.576 1.00 0.00 C ATOM 0 H ILE A 144 8.810 -6.149 1.873 1.00 0.00 H new ATOM 0 HA ILE A 144 7.509 -5.166 -0.586 1.00 0.00 H new ATOM 0 HB ILE A 144 7.551 -3.961 2.210 1.00 0.00 H new ATOM 0 HG12 ILE A 144 5.141 -4.493 0.470 1.00 0.00 H new ATOM 0 HG13 ILE A 144 5.841 -5.779 1.433 1.00 0.00 H new ATOM 0 HG21 ILE A 144 6.340 -2.050 1.237 1.00 0.00 H new ATOM 0 HG22 ILE A 144 7.976 -2.208 0.555 1.00 0.00 H new ATOM 0 HG23 ILE A 144 6.563 -2.739 -0.388 1.00 0.00 H new ATOM 0 HD11 ILE A 144 3.989 -4.706 2.617 1.00 0.00 H new ATOM 0 HD12 ILE A 144 5.522 -4.437 3.481 1.00 0.00 H new ATOM 0 HD13 ILE A 144 4.810 -3.132 2.502 1.00 0.00 H new ATOM 2245 N THR A 145 9.311 -3.423 -1.026 1.00 0.00 N ATOM 2246 CA THR A 145 10.483 -2.651 -1.417 1.00 0.00 C ATOM 2247 C THR A 145 10.110 -1.208 -1.738 1.00 0.00 C ATOM 2248 O THR A 145 9.330 -0.948 -2.655 1.00 0.00 O ATOM 2249 CB THR A 145 11.183 -3.273 -2.641 1.00 0.00 C ATOM 2250 OG1 THR A 145 11.537 -4.632 -2.365 1.00 0.00 O ATOM 2251 CG2 THR A 145 12.430 -2.484 -3.010 1.00 0.00 C ATOM 0 H THR A 145 8.511 -3.320 -1.650 1.00 0.00 H new ATOM 0 HA THR A 145 11.168 -2.666 -0.569 1.00 0.00 H new ATOM 0 HB THR A 145 10.490 -3.242 -3.482 1.00 0.00 H new ATOM 0 HG1 THR A 145 11.980 -5.020 -3.148 1.00 0.00 H new ATOM 0 HG21 THR A 145 12.907 -2.942 -3.877 1.00 0.00 H new ATOM 0 HG22 THR A 145 12.153 -1.457 -3.248 1.00 0.00 H new ATOM 0 HG23 THR A 145 13.124 -2.487 -2.170 1.00 0.00 H new ATOM 2259 N VAL A 146 10.671 -0.273 -0.979 1.00 0.00 N ATOM 2260 CA VAL A 146 10.398 1.144 -1.184 1.00 0.00 C ATOM 2261 C VAL A 146 11.455 1.784 -2.078 1.00 0.00 C ATOM 2262 O VAL A 146 12.574 2.051 -1.640 1.00 0.00 O ATOM 2263 CB VAL A 146 10.345 1.905 0.154 1.00 0.00 C ATOM 2264 CG1 VAL A 146 10.137 3.393 -0.085 1.00 0.00 C ATOM 2265 CG2 VAL A 146 9.247 1.341 1.043 1.00 0.00 C ATOM 0 H VAL A 146 11.318 -0.471 -0.216 1.00 0.00 H new ATOM 0 HA VAL A 146 9.425 1.211 -1.671 1.00 0.00 H new ATOM 0 HB VAL A 146 11.299 1.774 0.665 1.00 0.00 H new ATOM 0 HG11 VAL A 146 10.102 3.914 0.872 1.00 0.00 H new ATOM 0 HG12 VAL A 146 10.961 3.784 -0.681 1.00 0.00 H new ATOM 0 HG13 VAL A 146 9.198 3.548 -0.617 1.00 0.00 H new ATOM 0 HG21 VAL A 146 9.223 1.890 1.984 1.00 0.00 H new ATOM 0 HG22 VAL A 146 8.285 1.441 0.540 1.00 0.00 H new ATOM 0 HG23 VAL A 146 9.445 0.288 1.242 1.00 0.00 H new ATOM 2275 N TYR A 147 11.092 2.027 -3.332 1.00 0.00 N ATOM 2276 CA TYR A 147 12.010 2.634 -4.289 1.00 0.00 C ATOM 2277 C TYR A 147 12.076 4.146 -4.097 1.00 0.00 C ATOM 2278 O TYR A 147 11.059 4.800 -3.862 1.00 0.00 O ATOM 2279 CB TYR A 147 11.577 2.309 -5.720 1.00 0.00 C ATOM 2280 CG TYR A 147 11.777 0.859 -6.098 1.00 0.00 C ATOM 2281 CD1 TYR A 147 10.895 -0.122 -5.661 1.00 0.00 C ATOM 2282 CD2 TYR A 147 12.847 0.470 -6.894 1.00 0.00 C ATOM 2283 CE1 TYR A 147 11.075 -1.448 -6.004 1.00 0.00 C ATOM 2284 CE2 TYR A 147 13.034 -0.854 -7.243 1.00 0.00 C ATOM 2285 CZ TYR A 147 12.146 -1.809 -6.796 1.00 0.00 C ATOM 2286 OH TYR A 147 12.327 -3.129 -7.141 1.00 0.00 O ATOM 0 H TYR A 147 10.169 1.813 -3.710 1.00 0.00 H new ATOM 0 HA TYR A 147 13.003 2.220 -4.114 1.00 0.00 H new ATOM 0 HB2 TYR A 147 10.524 2.565 -5.839 1.00 0.00 H new ATOM 0 HB3 TYR A 147 12.138 2.937 -6.412 1.00 0.00 H new ATOM 0 HD1 TYR A 147 10.055 0.157 -5.043 1.00 0.00 H new ATOM 0 HD2 TYR A 147 13.545 1.215 -7.246 1.00 0.00 H new ATOM 0 HE1 TYR A 147 10.381 -2.198 -5.654 1.00 0.00 H new ATOM 0 HE2 TYR A 147 13.871 -1.139 -7.863 1.00 0.00 H new ATOM 0 HH TYR A 147 13.126 -3.214 -7.702 1.00 0.00 H new ATOM 2296 N THR A 148 13.282 4.697 -4.199 1.00 0.00 N ATOM 2297 CA THR A 148 13.483 6.131 -4.036 1.00 0.00 C ATOM 2298 C THR A 148 14.424 6.678 -5.104 1.00 0.00 C ATOM 2299 O THR A 148 15.604 6.330 -5.144 1.00 0.00 O ATOM 2300 CB THR A 148 14.054 6.464 -2.645 1.00 0.00 C ATOM 2301 OG1 THR A 148 15.349 5.872 -2.493 1.00 0.00 O ATOM 2302 CG2 THR A 148 13.130 5.962 -1.546 1.00 0.00 C ATOM 0 H THR A 148 14.134 4.171 -4.394 1.00 0.00 H new ATOM 0 HA THR A 148 12.505 6.602 -4.141 1.00 0.00 H new ATOM 0 HB THR A 148 14.137 7.548 -2.561 1.00 0.00 H new ATOM 0 HG1 THR A 148 15.781 5.800 -3.370 1.00 0.00 H new ATOM 0 HG21 THR A 148 13.554 6.209 -0.573 1.00 0.00 H new ATOM 0 HG22 THR A 148 12.154 6.436 -1.647 1.00 0.00 H new ATOM 0 HG23 THR A 148 13.019 4.881 -1.630 1.00 0.00 H new ATOM 2310 N LEU A 149 13.894 7.538 -5.967 1.00 0.00 N ATOM 2311 CA LEU A 149 14.688 8.136 -7.036 1.00 0.00 C ATOM 2312 C LEU A 149 14.731 9.654 -6.898 1.00 0.00 C ATOM 2313 O LEU A 149 15.778 10.275 -7.079 1.00 0.00 O ATOM 2314 CB LEU A 149 14.112 7.752 -8.400 1.00 0.00 C ATOM 2315 CG LEU A 149 12.962 8.620 -8.912 1.00 0.00 C ATOM 2316 CD1 LEU A 149 12.827 8.491 -10.421 1.00 0.00 C ATOM 2317 CD2 LEU A 149 11.660 8.240 -8.223 1.00 0.00 C ATOM 0 H LEU A 149 12.919 7.837 -5.948 1.00 0.00 H new ATOM 0 HA LEU A 149 15.706 7.754 -6.957 1.00 0.00 H new ATOM 0 HB2 LEU A 149 14.918 7.782 -9.134 1.00 0.00 H new ATOM 0 HB3 LEU A 149 13.766 6.720 -8.348 1.00 0.00 H new ATOM 0 HG LEU A 149 13.184 9.661 -8.676 1.00 0.00 H new ATOM 0 HD11 LEU A 149 12.004 9.116 -10.767 1.00 0.00 H new ATOM 0 HD12 LEU A 149 13.753 8.813 -10.898 1.00 0.00 H new ATOM 0 HD13 LEU A 149 12.628 7.451 -10.681 1.00 0.00 H new ATOM 0 HD21 LEU A 149 10.852 8.868 -8.600 1.00 0.00 H new ATOM 0 HD22 LEU A 149 11.432 7.194 -8.428 1.00 0.00 H new ATOM 0 HD23 LEU A 149 11.761 8.386 -7.148 1.00 0.00 H new