USER MOD reduce.3.24.130724 H: found=0, std=0, add=1078, rem=0, adj=36 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 105:sc= -0.469 USER MOD Set 1.2: A 103 HIS : no HD1:sc= -12.8! C(o=-15!,f=-13!) USER MOD Set 1.3: A 104 CYS SG : rot -150:sc= -1.52 USER MOD Set 1.4: A 107 ASN : amide:sc= 0.0739 K(o=-15,f=-13) USER MOD Set 2.1: A 100 MET CE :methyl 162:sc= -0.253 (180deg=-0.644) USER MOD Set 2.2: A 114 MET CE :methyl -132:sc= -2.42 (180deg=-6.54!) USER MOD Set 3.1: A 90 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 128 ASN : amide:sc= -0.583 K(o=-0.58,f=0.049) USER MOD Set 4.1: A 53 GLN : amide:sc= -0.114 X(o=-0.42,f=-0.42) USER MOD Set 4.2: A 57 ASN : amide:sc= -0.307 X(o=-0.42,f=-0.54) 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+ -99:sc= -0.0473 (180deg=-1.17) USER MOD Single : A 21 CYS SG : rot 129:sc= 1.08 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot -39:sc= 0.197 USER MOD Single : A 26 SER OG : rot -126:sc= 0.165 USER MOD Single : A 29 HIS : no HE2:sc= -5.17 K(o=-5.2,f=-6.4!) USER MOD Single : A 30 CYS SG : rot 30:sc= 0.104 USER MOD Single : A 32 SER OG : rot 110:sc= 0.611 USER MOD Single : A 35 CYS SG : rot -130:sc= -0.942 USER MOD Single : A 37 MET CE :methyl 179:sc= -0.236 (180deg=-0.244) USER MOD Single : A 46 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.108) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ -148:sc= -0.626 (180deg=-2.02!) USER MOD Single : A 58 GLN : amide:sc= -3.45! C(o=-3.5!,f=-9.1!) USER MOD Single : A 59 GLN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 35:sc= 0.0122 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 180:sc= -0.848 USER MOD Single : A 81 LYS NZ :NH3+ 165:sc= -0.524 (180deg=-0.854) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 HIS : no HD1:sc= -2.41! C(o=-2.4!,f=-3.7!) USER MOD Single : A 87 LYS NZ :NH3+ -162:sc= -0.0454 (180deg=-0.299) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -0.0182 K(o=-0.018,f=-1.5!) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot -79:sc= 0.956 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 100:sc= 0.312 USER MOD Single : A 125 GLN : amide:sc= -0.115 X(o=-0.11,f=0) USER MOD Single : A 130 SER OG : rot -57:sc= -0.0513 USER MOD Single : A 132 MET CE :methyl 138:sc= -3.27 (180deg=-8.41!) USER MOD Single : A 140 THR OG1 : rot -53:sc= 1.22 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 33:sc= 0.208 USER MOD ----------------------------------------------------------------- ATOM 108 N ILE A 11 11.573 -4.270 5.048 1.00 0.00 N ATOM 109 CA ILE A 11 11.482 -3.212 4.048 1.00 0.00 C ATOM 110 C ILE A 11 12.856 -2.872 3.481 1.00 0.00 C ATOM 111 O ILE A 11 13.773 -2.510 4.219 1.00 0.00 O ATOM 112 CB ILE A 11 10.851 -1.936 4.635 1.00 0.00 C ATOM 113 CG1 ILE A 11 9.462 -2.241 5.200 1.00 0.00 C ATOM 114 CG2 ILE A 11 10.770 -0.849 3.574 1.00 0.00 C ATOM 115 CD1 ILE A 11 8.835 -1.071 5.926 1.00 0.00 C ATOM 0 HA ILE A 11 10.844 -3.588 3.248 1.00 0.00 H new ATOM 0 HB ILE A 11 11.482 -1.577 5.448 1.00 0.00 H new ATOM 0 HG12 ILE A 11 8.806 -2.546 4.385 1.00 0.00 H new ATOM 0 HG13 ILE A 11 9.535 -3.086 5.884 1.00 0.00 H new ATOM 0 HG21 ILE A 11 10.322 0.047 4.004 1.00 0.00 H new ATOM 0 HG22 ILE A 11 11.772 -0.616 3.214 1.00 0.00 H new ATOM 0 HG23 ILE A 11 10.158 -1.197 2.742 1.00 0.00 H new ATOM 0 HD11 ILE A 11 7.852 -1.359 6.300 1.00 0.00 H new ATOM 0 HD12 ILE A 11 9.470 -0.779 6.762 1.00 0.00 H new ATOM 0 HD13 ILE A 11 8.730 -0.231 5.240 1.00 0.00 H new ATOM 127 N THR A 12 12.992 -2.989 2.164 1.00 0.00 N ATOM 128 CA THR A 12 14.254 -2.694 1.497 1.00 0.00 C ATOM 129 C THR A 12 14.158 -1.407 0.685 1.00 0.00 C ATOM 130 O THR A 12 13.219 -1.218 -0.089 1.00 0.00 O ATOM 131 CB THR A 12 14.680 -3.844 0.565 1.00 0.00 C ATOM 132 OG1 THR A 12 14.763 -5.068 1.305 1.00 0.00 O ATOM 133 CG2 THR A 12 16.023 -3.546 -0.084 1.00 0.00 C ATOM 0 H THR A 12 12.243 -3.286 1.538 1.00 0.00 H new ATOM 0 HA THR A 12 15.004 -2.573 2.279 1.00 0.00 H new ATOM 0 HB THR A 12 13.930 -3.944 -0.220 1.00 0.00 H new ATOM 0 HG1 THR A 12 15.033 -5.795 0.706 1.00 0.00 H new ATOM 0 HG21 THR A 12 16.303 -4.372 -0.737 1.00 0.00 H new ATOM 0 HG22 THR A 12 15.949 -2.630 -0.669 1.00 0.00 H new ATOM 0 HG23 THR A 12 16.781 -3.422 0.689 1.00 0.00 H new ATOM 141 N TYR A 13 15.135 -0.525 0.865 1.00 0.00 N ATOM 142 CA TYR A 13 15.159 0.745 0.150 1.00 0.00 C ATOM 143 C TYR A 13 16.131 0.690 -1.025 1.00 0.00 C ATOM 144 O TYR A 13 17.306 0.364 -0.859 1.00 0.00 O ATOM 145 CB TYR A 13 15.551 1.880 1.098 1.00 0.00 C ATOM 146 CG TYR A 13 14.647 2.001 2.304 1.00 0.00 C ATOM 147 CD1 TYR A 13 13.378 2.556 2.193 1.00 0.00 C ATOM 148 CD2 TYR A 13 15.063 1.562 3.555 1.00 0.00 C ATOM 149 CE1 TYR A 13 12.549 2.669 3.292 1.00 0.00 C ATOM 150 CE2 TYR A 13 14.240 1.670 4.660 1.00 0.00 C ATOM 151 CZ TYR A 13 12.985 2.224 4.523 1.00 0.00 C ATOM 152 OH TYR A 13 12.163 2.335 5.621 1.00 0.00 O ATOM 0 H TYR A 13 15.921 -0.666 1.500 1.00 0.00 H new ATOM 0 HA TYR A 13 14.158 0.934 -0.238 1.00 0.00 H new ATOM 0 HB2 TYR A 13 16.575 1.722 1.436 1.00 0.00 H new ATOM 0 HB3 TYR A 13 15.538 2.822 0.549 1.00 0.00 H new ATOM 0 HD1 TYR A 13 13.034 2.905 1.231 1.00 0.00 H new ATOM 0 HD2 TYR A 13 16.046 1.129 3.666 1.00 0.00 H new ATOM 0 HE1 TYR A 13 11.566 3.103 3.188 1.00 0.00 H new ATOM 0 HE2 TYR A 13 14.578 1.322 5.625 1.00 0.00 H new ATOM 0 HH TYR A 13 12.620 1.974 6.409 1.00 0.00 H new ATOM 162 N VAL A 14 15.631 1.013 -2.213 1.00 0.00 N ATOM 163 CA VAL A 14 16.453 1.002 -3.417 1.00 0.00 C ATOM 164 C VAL A 14 16.465 2.372 -4.086 1.00 0.00 C ATOM 165 O VAL A 14 15.534 3.162 -3.926 1.00 0.00 O ATOM 166 CB VAL A 14 15.954 -0.047 -4.428 1.00 0.00 C ATOM 167 CG1 VAL A 14 16.806 -0.021 -5.689 1.00 0.00 C ATOM 168 CG2 VAL A 14 15.956 -1.433 -3.802 1.00 0.00 C ATOM 0 H VAL A 14 14.660 1.286 -2.368 1.00 0.00 H new ATOM 0 HA VAL A 14 17.465 0.743 -3.107 1.00 0.00 H new ATOM 0 HB VAL A 14 14.929 0.200 -4.705 1.00 0.00 H new ATOM 0 HG11 VAL A 14 16.439 -0.769 -6.392 1.00 0.00 H new ATOM 0 HG12 VAL A 14 16.748 0.967 -6.147 1.00 0.00 H new ATOM 0 HG13 VAL A 14 17.842 -0.242 -5.433 1.00 0.00 H new ATOM 0 HG21 VAL A 14 15.601 -2.162 -4.530 1.00 0.00 H new ATOM 0 HG22 VAL A 14 16.969 -1.692 -3.494 1.00 0.00 H new ATOM 0 HG23 VAL A 14 15.300 -1.440 -2.932 1.00 0.00 H new ATOM 178 N LYS A 15 17.525 2.648 -4.839 1.00 0.00 N ATOM 179 CA LYS A 15 17.658 3.922 -5.535 1.00 0.00 C ATOM 180 C LYS A 15 17.573 3.728 -7.046 1.00 0.00 C ATOM 181 O LYS A 15 18.420 3.067 -7.645 1.00 0.00 O ATOM 182 CB LYS A 15 18.987 4.589 -5.171 1.00 0.00 C ATOM 183 CG LYS A 15 19.206 5.924 -5.860 1.00 0.00 C ATOM 184 CD LYS A 15 20.579 6.495 -5.546 1.00 0.00 C ATOM 185 CE LYS A 15 20.576 7.264 -4.233 1.00 0.00 C ATOM 186 NZ LYS A 15 20.841 6.374 -3.069 1.00 0.00 N ATOM 0 H LYS A 15 18.304 2.006 -4.983 1.00 0.00 H new ATOM 0 HA LYS A 15 16.836 4.566 -5.222 1.00 0.00 H new ATOM 0 HB2 LYS A 15 19.027 4.736 -4.092 1.00 0.00 H new ATOM 0 HB3 LYS A 15 19.805 3.917 -5.431 1.00 0.00 H new ATOM 0 HG2 LYS A 15 19.100 5.800 -6.938 1.00 0.00 H new ATOM 0 HG3 LYS A 15 18.437 6.628 -5.543 1.00 0.00 H new ATOM 0 HD2 LYS A 15 21.307 5.686 -5.493 1.00 0.00 H new ATOM 0 HD3 LYS A 15 20.893 7.155 -6.355 1.00 0.00 H new ATOM 0 HE2 LYS A 15 21.332 8.049 -4.270 1.00 0.00 H new ATOM 0 HE3 LYS A 15 19.612 7.756 -4.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 19.941 6.125 -2.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 21.315 5.508 -3.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 21.452 6.867 -2.387 1.00 0.00 H new ATOM 200 N GLY A 16 16.544 4.309 -7.655 1.00 0.00 N ATOM 201 CA GLY A 16 16.368 4.189 -9.091 1.00 0.00 C ATOM 202 C GLY A 16 14.922 3.955 -9.480 1.00 0.00 C ATOM 203 O GLY A 16 14.019 4.102 -8.656 1.00 0.00 O ATOM 0 H GLY A 16 15.829 4.860 -7.180 1.00 0.00 H new ATOM 0 HA2 GLY A 16 16.729 5.096 -9.575 1.00 0.00 H new ATOM 0 HA3 GLY A 16 16.979 3.365 -9.461 1.00 0.00 H new ATOM 207 N ASP A 17 14.701 3.592 -10.739 1.00 0.00 N ATOM 208 CA ASP A 17 13.354 3.338 -11.236 1.00 0.00 C ATOM 209 C ASP A 17 12.537 2.552 -10.215 1.00 0.00 C ATOM 210 O ASP A 17 13.092 1.870 -9.352 1.00 0.00 O ATOM 211 CB ASP A 17 13.412 2.574 -12.559 1.00 0.00 C ATOM 212 CG ASP A 17 14.554 3.032 -13.444 1.00 0.00 C ATOM 213 OD1 ASP A 17 15.665 2.476 -13.315 1.00 0.00 O ATOM 214 OD2 ASP A 17 14.337 3.947 -14.266 1.00 0.00 O ATOM 0 H ASP A 17 15.437 3.467 -11.434 1.00 0.00 H new ATOM 0 HA ASP A 17 12.867 4.299 -11.401 1.00 0.00 H new ATOM 0 HB2 ASP A 17 13.519 1.509 -12.355 1.00 0.00 H new ATOM 0 HB3 ASP A 17 12.470 2.703 -13.091 1.00 0.00 H new ATOM 219 N LEU A 18 11.217 2.652 -10.319 1.00 0.00 N ATOM 220 CA LEU A 18 10.322 1.951 -9.404 1.00 0.00 C ATOM 221 C LEU A 18 9.496 0.905 -10.145 1.00 0.00 C ATOM 222 O LEU A 18 9.275 -0.197 -9.642 1.00 0.00 O ATOM 223 CB LEU A 18 9.396 2.946 -8.702 1.00 0.00 C ATOM 224 CG LEU A 18 8.085 2.375 -8.160 1.00 0.00 C ATOM 225 CD1 LEU A 18 8.361 1.263 -7.160 1.00 0.00 C ATOM 226 CD2 LEU A 18 7.249 3.474 -7.521 1.00 0.00 C ATOM 0 H LEU A 18 10.742 3.211 -11.027 1.00 0.00 H new ATOM 0 HA LEU A 18 10.932 1.443 -8.657 1.00 0.00 H new ATOM 0 HB2 LEU A 18 9.942 3.398 -7.874 1.00 0.00 H new ATOM 0 HB3 LEU A 18 9.158 3.747 -9.402 1.00 0.00 H new ATOM 0 HG LEU A 18 7.521 1.955 -8.993 1.00 0.00 H new ATOM 0 HD11 LEU A 18 7.417 0.869 -6.785 1.00 0.00 H new ATOM 0 HD12 LEU A 18 8.919 0.464 -7.649 1.00 0.00 H new ATOM 0 HD13 LEU A 18 8.945 1.658 -6.329 1.00 0.00 H new ATOM 0 HD21 LEU A 18 6.320 3.050 -7.141 1.00 0.00 H new ATOM 0 HD22 LEU A 18 7.806 3.923 -6.699 1.00 0.00 H new ATOM 0 HD23 LEU A 18 7.022 4.237 -8.265 1.00 0.00 H new ATOM 238 N PHE A 19 9.044 1.256 -11.344 1.00 0.00 N ATOM 239 CA PHE A 19 8.243 0.347 -12.156 1.00 0.00 C ATOM 240 C PHE A 19 9.125 -0.450 -13.111 1.00 0.00 C ATOM 241 O PHE A 19 8.902 -1.640 -13.333 1.00 0.00 O ATOM 242 CB PHE A 19 7.191 1.128 -12.946 1.00 0.00 C ATOM 243 CG PHE A 19 6.561 2.245 -12.165 1.00 0.00 C ATOM 244 CD1 PHE A 19 5.921 1.992 -10.962 1.00 0.00 C ATOM 245 CD2 PHE A 19 6.608 3.548 -12.633 1.00 0.00 C ATOM 246 CE1 PHE A 19 5.340 3.018 -10.241 1.00 0.00 C ATOM 247 CE2 PHE A 19 6.029 4.579 -11.917 1.00 0.00 C ATOM 248 CZ PHE A 19 5.395 4.314 -10.719 1.00 0.00 C ATOM 0 H PHE A 19 9.219 2.164 -11.775 1.00 0.00 H new ATOM 0 HA PHE A 19 7.740 -0.351 -11.487 1.00 0.00 H new ATOM 0 HB2 PHE A 19 7.653 1.539 -13.843 1.00 0.00 H new ATOM 0 HB3 PHE A 19 6.411 0.441 -13.275 1.00 0.00 H new ATOM 0 HD1 PHE A 19 5.876 0.981 -10.584 1.00 0.00 H new ATOM 0 HD2 PHE A 19 7.103 3.761 -13.569 1.00 0.00 H new ATOM 0 HE1 PHE A 19 4.844 2.808 -9.305 1.00 0.00 H new ATOM 0 HE2 PHE A 19 6.072 5.590 -12.294 1.00 0.00 H new ATOM 0 HZ PHE A 19 4.943 5.118 -10.157 1.00 0.00 H new ATOM 258 N ALA A 20 10.128 0.215 -13.675 1.00 0.00 N ATOM 259 CA ALA A 20 11.046 -0.430 -14.605 1.00 0.00 C ATOM 260 C ALA A 20 11.970 -1.402 -13.880 1.00 0.00 C ATOM 261 O ALA A 20 12.410 -2.400 -14.452 1.00 0.00 O ATOM 262 CB ALA A 20 11.859 0.614 -15.355 1.00 0.00 C ATOM 0 H ALA A 20 10.325 1.201 -13.504 1.00 0.00 H new ATOM 0 HA ALA A 20 10.455 -0.999 -15.323 1.00 0.00 H new ATOM 0 HB1 ALA A 20 12.540 0.117 -16.046 1.00 0.00 H new ATOM 0 HB2 ALA A 20 11.187 1.266 -15.913 1.00 0.00 H new ATOM 0 HB3 ALA A 20 12.433 1.208 -14.644 1.00 0.00 H new ATOM 268 N CYS A 21 12.261 -1.104 -12.619 1.00 0.00 N ATOM 269 CA CYS A 21 13.135 -1.951 -11.815 1.00 0.00 C ATOM 270 C CYS A 21 12.558 -3.357 -11.682 1.00 0.00 C ATOM 271 O CYS A 21 13.170 -4.346 -12.086 1.00 0.00 O ATOM 272 CB CYS A 21 13.341 -1.339 -10.429 1.00 0.00 C ATOM 273 SG CYS A 21 14.816 -0.302 -10.291 1.00 0.00 S ATOM 0 H CYS A 21 11.905 -0.282 -12.131 1.00 0.00 H new ATOM 0 HA CYS A 21 14.098 -2.019 -12.321 1.00 0.00 H new ATOM 0 HB2 CYS A 21 12.465 -0.742 -10.173 1.00 0.00 H new ATOM 0 HB3 CYS A 21 13.405 -2.142 -9.695 1.00 0.00 H new ATOM 0 HG CYS A 21 14.491 0.850 -9.784 1.00 0.00 H new ATOM 279 N PRO A 22 11.353 -3.450 -11.102 1.00 0.00 N ATOM 280 CA PRO A 22 10.667 -4.730 -10.901 1.00 0.00 C ATOM 281 C PRO A 22 10.191 -5.344 -12.213 1.00 0.00 C ATOM 282 O PRO A 22 10.333 -4.744 -13.279 1.00 0.00 O ATOM 283 CB PRO A 22 9.472 -4.358 -10.020 1.00 0.00 C ATOM 284 CG PRO A 22 9.220 -2.918 -10.312 1.00 0.00 C ATOM 285 CD PRO A 22 10.566 -2.312 -10.597 1.00 0.00 C ATOM 0 HA PRO A 22 11.323 -5.479 -10.458 1.00 0.00 H new ATOM 0 HB2 PRO A 22 8.600 -4.968 -10.257 1.00 0.00 H new ATOM 0 HB3 PRO A 22 9.694 -4.515 -8.964 1.00 0.00 H new ATOM 0 HG2 PRO A 22 8.552 -2.804 -11.166 1.00 0.00 H new ATOM 0 HG3 PRO A 22 8.742 -2.426 -9.465 1.00 0.00 H new ATOM 0 HD2 PRO A 22 10.498 -1.512 -11.334 1.00 0.00 H new ATOM 0 HD3 PRO A 22 11.011 -1.882 -9.700 1.00 0.00 H new ATOM 293 N LYS A 23 9.625 -6.543 -12.129 1.00 0.00 N ATOM 294 CA LYS A 23 9.126 -7.239 -13.309 1.00 0.00 C ATOM 295 C LYS A 23 7.701 -7.734 -13.086 1.00 0.00 C ATOM 296 O LYS A 23 6.856 -7.648 -13.978 1.00 0.00 O ATOM 297 CB LYS A 23 10.038 -8.419 -13.655 1.00 0.00 C ATOM 298 CG LYS A 23 9.705 -9.076 -14.983 1.00 0.00 C ATOM 299 CD LYS A 23 10.491 -10.361 -15.181 1.00 0.00 C ATOM 300 CE LYS A 23 10.271 -10.940 -16.570 1.00 0.00 C ATOM 301 NZ LYS A 23 11.224 -12.045 -16.868 1.00 0.00 N ATOM 0 H LYS A 23 9.500 -7.054 -11.255 1.00 0.00 H new ATOM 0 HA LYS A 23 9.122 -6.534 -14.141 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.072 -8.074 -13.679 1.00 0.00 H new ATOM 0 HB3 LYS A 23 9.970 -9.165 -12.863 1.00 0.00 H new ATOM 0 HG2 LYS A 23 8.637 -9.291 -15.026 1.00 0.00 H new ATOM 0 HG3 LYS A 23 9.924 -8.385 -15.797 1.00 0.00 H new ATOM 0 HD2 LYS A 23 11.553 -10.166 -15.031 1.00 0.00 H new ATOM 0 HD3 LYS A 23 10.192 -11.091 -14.429 1.00 0.00 H new ATOM 0 HE2 LYS A 23 9.249 -11.310 -16.651 1.00 0.00 H new ATOM 0 HE3 LYS A 23 10.385 -10.152 -17.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 11.041 -12.413 -17.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 12.199 -11.686 -16.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 11.098 -12.809 -16.173 1.00 0.00 H new ATOM 315 N THR A 24 7.438 -8.251 -11.890 1.00 0.00 N ATOM 316 CA THR A 24 6.115 -8.758 -11.550 1.00 0.00 C ATOM 317 C THR A 24 5.609 -8.148 -10.248 1.00 0.00 C ATOM 318 O THR A 24 4.449 -8.327 -9.877 1.00 0.00 O ATOM 319 CB THR A 24 6.119 -10.293 -11.418 1.00 0.00 C ATOM 320 OG1 THR A 24 4.775 -10.787 -11.406 1.00 0.00 O ATOM 321 CG2 THR A 24 6.834 -10.724 -10.146 1.00 0.00 C ATOM 0 H THR A 24 8.125 -8.330 -11.140 1.00 0.00 H new ATOM 0 HA THR A 24 5.449 -8.472 -12.364 1.00 0.00 H new ATOM 0 HB THR A 24 6.651 -10.708 -12.274 1.00 0.00 H new ATOM 0 HG1 THR A 24 4.209 -10.183 -10.881 1.00 0.00 H new ATOM 0 HG21 THR A 24 6.824 -11.812 -10.074 1.00 0.00 H new ATOM 0 HG22 THR A 24 7.865 -10.371 -10.171 1.00 0.00 H new ATOM 0 HG23 THR A 24 6.326 -10.299 -9.281 1.00 0.00 H new ATOM 329 N ASP A 25 6.487 -7.428 -9.558 1.00 0.00 N ATOM 330 CA ASP A 25 6.129 -6.789 -8.297 1.00 0.00 C ATOM 331 C ASP A 25 4.942 -5.849 -8.482 1.00 0.00 C ATOM 332 O ASP A 25 4.867 -5.114 -9.467 1.00 0.00 O ATOM 333 CB ASP A 25 7.323 -6.018 -7.734 1.00 0.00 C ATOM 334 CG ASP A 25 8.549 -6.894 -7.562 1.00 0.00 C ATOM 335 OD1 ASP A 25 8.941 -7.565 -8.540 1.00 0.00 O ATOM 336 OD2 ASP A 25 9.116 -6.909 -6.449 1.00 0.00 O ATOM 0 H ASP A 25 7.452 -7.272 -9.851 1.00 0.00 H new ATOM 0 HA ASP A 25 5.845 -7.569 -7.591 1.00 0.00 H new ATOM 0 HB2 ASP A 25 7.563 -5.189 -8.400 1.00 0.00 H new ATOM 0 HB3 ASP A 25 7.051 -5.585 -6.771 1.00 0.00 H new ATOM 341 N SER A 26 4.016 -5.878 -7.529 1.00 0.00 N ATOM 342 CA SER A 26 2.830 -5.032 -7.589 1.00 0.00 C ATOM 343 C SER A 26 3.116 -3.653 -7.000 1.00 0.00 C ATOM 344 O SER A 26 4.151 -3.438 -6.368 1.00 0.00 O ATOM 345 CB SER A 26 1.670 -5.689 -6.838 1.00 0.00 C ATOM 346 OG SER A 26 1.237 -6.866 -7.499 1.00 0.00 O ATOM 0 H SER A 26 4.064 -6.478 -6.706 1.00 0.00 H new ATOM 0 HA SER A 26 2.553 -4.911 -8.636 1.00 0.00 H new ATOM 0 HB2 SER A 26 1.981 -5.932 -5.822 1.00 0.00 H new ATOM 0 HB3 SER A 26 0.840 -4.987 -6.758 1.00 0.00 H new ATOM 0 HG SER A 26 0.273 -6.812 -7.664 1.00 0.00 H new ATOM 352 N LEU A 27 2.191 -2.724 -7.212 1.00 0.00 N ATOM 353 CA LEU A 27 2.342 -1.365 -6.702 1.00 0.00 C ATOM 354 C LEU A 27 1.341 -1.088 -5.585 1.00 0.00 C ATOM 355 O LEU A 27 0.184 -1.499 -5.659 1.00 0.00 O ATOM 356 CB LEU A 27 2.153 -0.352 -7.833 1.00 0.00 C ATOM 357 CG LEU A 27 3.055 -0.533 -9.054 1.00 0.00 C ATOM 358 CD1 LEU A 27 2.833 0.591 -10.054 1.00 0.00 C ATOM 359 CD2 LEU A 27 4.517 -0.594 -8.633 1.00 0.00 C ATOM 0 H LEU A 27 1.329 -2.886 -7.733 1.00 0.00 H new ATOM 0 HA LEU A 27 3.349 -1.265 -6.296 1.00 0.00 H new ATOM 0 HB2 LEU A 27 1.115 -0.396 -8.163 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.317 0.647 -7.430 1.00 0.00 H new ATOM 0 HG LEU A 27 2.796 -1.476 -9.536 1.00 0.00 H new ATOM 0 HD11 LEU A 27 3.484 0.445 -10.916 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.793 0.588 -10.380 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.063 1.547 -9.584 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.144 -0.723 -9.515 1.00 0.00 H new ATOM 0 HD22 LEU A 27 4.789 0.332 -8.127 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.666 -1.435 -7.956 1.00 0.00 H new ATOM 371 N ALA A 28 1.796 -0.388 -4.551 1.00 0.00 N ATOM 372 CA ALA A 28 0.940 -0.052 -3.420 1.00 0.00 C ATOM 373 C ALA A 28 1.028 1.433 -3.086 1.00 0.00 C ATOM 374 O ALA A 28 2.086 1.932 -2.703 1.00 0.00 O ATOM 375 CB ALA A 28 1.316 -0.891 -2.207 1.00 0.00 C ATOM 0 H ALA A 28 2.753 -0.043 -4.473 1.00 0.00 H new ATOM 0 HA ALA A 28 -0.090 -0.274 -3.697 1.00 0.00 H new ATOM 0 HB1 ALA A 28 0.669 -0.630 -1.369 1.00 0.00 H new ATOM 0 HB2 ALA A 28 1.194 -1.948 -2.444 1.00 0.00 H new ATOM 0 HB3 ALA A 28 2.354 -0.697 -1.938 1.00 0.00 H new ATOM 381 N HIS A 29 -0.091 2.135 -3.235 1.00 0.00 N ATOM 382 CA HIS A 29 -0.140 3.565 -2.949 1.00 0.00 C ATOM 383 C HIS A 29 -1.443 3.934 -2.248 1.00 0.00 C ATOM 384 O HIS A 29 -2.425 3.194 -2.311 1.00 0.00 O ATOM 385 CB HIS A 29 0.003 4.369 -4.242 1.00 0.00 C ATOM 386 CG HIS A 29 -0.341 5.819 -4.086 1.00 0.00 C ATOM 387 ND1 HIS A 29 0.386 6.684 -3.296 1.00 0.00 N ATOM 388 CD2 HIS A 29 -1.340 6.555 -4.626 1.00 0.00 C ATOM 389 CE1 HIS A 29 -0.152 7.889 -3.355 1.00 0.00 C ATOM 390 NE2 HIS A 29 -1.201 7.837 -4.156 1.00 0.00 N ATOM 0 H HIS A 29 -0.975 1.738 -3.552 1.00 0.00 H new ATOM 0 HA HIS A 29 0.690 3.807 -2.285 1.00 0.00 H new ATOM 0 HB2 HIS A 29 1.028 4.284 -4.602 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -0.640 3.931 -5.006 1.00 0.00 H new ATOM 0 HD1 HIS A 29 1.211 6.433 -2.751 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -2.104 6.200 -5.301 1.00 0.00 H new ATOM 0 HE1 HIS A 29 0.205 8.767 -2.837 1.00 0.00 H new ATOM 398 N CYS A 30 -1.445 5.082 -1.579 1.00 0.00 N ATOM 399 CA CYS A 30 -2.627 5.549 -0.864 1.00 0.00 C ATOM 400 C CYS A 30 -3.298 6.696 -1.613 1.00 0.00 C ATOM 401 O CYS A 30 -2.648 7.676 -1.979 1.00 0.00 O ATOM 402 CB CYS A 30 -2.250 5.998 0.549 1.00 0.00 C ATOM 403 SG CYS A 30 -1.022 7.323 0.599 1.00 0.00 S ATOM 0 H CYS A 30 -0.641 5.706 -1.517 1.00 0.00 H new ATOM 0 HA CYS A 30 -3.332 4.720 -0.798 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -3.150 6.332 1.065 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -1.866 5.140 1.101 1.00 0.00 H new ATOM 0 HG CYS A 30 -1.145 8.069 -0.458 1.00 0.00 H new ATOM 409 N ILE A 31 -4.601 6.567 -1.839 1.00 0.00 N ATOM 410 CA ILE A 31 -5.359 7.592 -2.544 1.00 0.00 C ATOM 411 C ILE A 31 -6.691 7.864 -1.854 1.00 0.00 C ATOM 412 O ILE A 31 -6.990 7.286 -0.809 1.00 0.00 O ATOM 413 CB ILE A 31 -5.625 7.189 -4.007 1.00 0.00 C ATOM 414 CG1 ILE A 31 -6.487 5.926 -4.062 1.00 0.00 C ATOM 415 CG2 ILE A 31 -4.312 6.973 -4.744 1.00 0.00 C ATOM 416 CD1 ILE A 31 -7.232 5.759 -5.368 1.00 0.00 C ATOM 0 H ILE A 31 -5.154 5.762 -1.544 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.753 8.498 -2.529 1.00 0.00 H new ATOM 0 HB ILE A 31 -6.166 7.997 -4.499 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -5.852 5.055 -3.902 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.206 5.951 -3.243 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -4.517 6.689 -5.776 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -3.731 7.895 -4.730 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.746 6.180 -4.255 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -7.822 4.843 -5.336 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -7.894 6.612 -5.521 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -6.518 5.702 -6.190 1.00 0.00 H new ATOM 428 N SER A 32 -7.489 8.748 -2.445 1.00 0.00 N ATOM 429 CA SER A 32 -8.789 9.098 -1.886 1.00 0.00 C ATOM 430 C SER A 32 -9.897 8.269 -2.527 1.00 0.00 C ATOM 431 O SER A 32 -9.685 7.611 -3.545 1.00 0.00 O ATOM 432 CB SER A 32 -9.069 10.589 -2.088 1.00 0.00 C ATOM 433 OG SER A 32 -9.487 10.853 -3.417 1.00 0.00 O ATOM 0 H SER A 32 -7.258 9.235 -3.311 1.00 0.00 H new ATOM 0 HA SER A 32 -8.769 8.881 -0.818 1.00 0.00 H new ATOM 0 HB2 SER A 32 -9.839 10.916 -1.389 1.00 0.00 H new ATOM 0 HB3 SER A 32 -8.171 11.165 -1.865 1.00 0.00 H new ATOM 0 HG SER A 32 -10.436 11.096 -3.419 1.00 0.00 H new ATOM 439 N GLU A 33 -11.081 8.307 -1.923 1.00 0.00 N ATOM 440 CA GLU A 33 -12.223 7.558 -2.434 1.00 0.00 C ATOM 441 C GLU A 33 -12.592 8.021 -3.840 1.00 0.00 C ATOM 442 O GLU A 33 -12.960 7.214 -4.694 1.00 0.00 O ATOM 443 CB GLU A 33 -13.425 7.718 -1.500 1.00 0.00 C ATOM 444 CG GLU A 33 -13.359 6.834 -0.266 1.00 0.00 C ATOM 445 CD GLU A 33 -14.005 5.480 -0.482 1.00 0.00 C ATOM 446 OE1 GLU A 33 -13.408 4.643 -1.191 1.00 0.00 O ATOM 447 OE2 GLU A 33 -15.109 5.257 0.058 1.00 0.00 O ATOM 0 H GLU A 33 -11.274 8.848 -1.080 1.00 0.00 H new ATOM 0 HA GLU A 33 -11.944 6.505 -2.479 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -13.495 8.760 -1.187 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -14.336 7.489 -2.052 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -12.317 6.693 0.020 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -13.852 7.339 0.565 1.00 0.00 H new ATOM 454 N ASP A 34 -12.492 9.325 -4.072 1.00 0.00 N ATOM 455 CA ASP A 34 -12.814 9.897 -5.374 1.00 0.00 C ATOM 456 C ASP A 34 -11.626 9.788 -6.325 1.00 0.00 C ATOM 457 O ASP A 34 -11.548 10.508 -7.321 1.00 0.00 O ATOM 458 CB ASP A 34 -13.230 11.361 -5.223 1.00 0.00 C ATOM 459 CG ASP A 34 -14.722 11.519 -5.002 1.00 0.00 C ATOM 460 OD1 ASP A 34 -15.162 11.429 -3.836 1.00 0.00 O ATOM 461 OD2 ASP A 34 -15.449 11.733 -5.994 1.00 0.00 O ATOM 0 H ASP A 34 -12.190 10.006 -3.375 1.00 0.00 H new ATOM 0 HA ASP A 34 -13.646 9.333 -5.795 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -12.693 11.804 -4.384 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -12.937 11.913 -6.116 1.00 0.00 H new ATOM 466 N CYS A 35 -10.703 8.886 -6.009 1.00 0.00 N ATOM 467 CA CYS A 35 -9.517 8.685 -6.834 1.00 0.00 C ATOM 468 C CYS A 35 -8.870 10.019 -7.191 1.00 0.00 C ATOM 469 O CYS A 35 -8.509 10.256 -8.344 1.00 0.00 O ATOM 470 CB CYS A 35 -9.881 7.923 -8.110 1.00 0.00 C ATOM 471 SG CYS A 35 -10.373 6.206 -7.829 1.00 0.00 S ATOM 0 H CYS A 35 -10.753 8.283 -5.188 1.00 0.00 H new ATOM 0 HA CYS A 35 -8.801 8.097 -6.260 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -10.695 8.445 -8.613 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -9.026 7.939 -8.786 1.00 0.00 H new ATOM 0 HG CYS A 35 -9.708 5.427 -8.630 1.00 0.00 H new ATOM 477 N ARG A 36 -8.729 10.888 -6.195 1.00 0.00 N ATOM 478 CA ARG A 36 -8.129 12.199 -6.405 1.00 0.00 C ATOM 479 C ARG A 36 -6.626 12.078 -6.644 1.00 0.00 C ATOM 480 O ARG A 36 -5.824 12.303 -5.738 1.00 0.00 O ATOM 481 CB ARG A 36 -8.393 13.103 -5.199 1.00 0.00 C ATOM 482 CG ARG A 36 -9.862 13.438 -4.999 1.00 0.00 C ATOM 483 CD ARG A 36 -10.359 14.417 -6.051 1.00 0.00 C ATOM 484 NE ARG A 36 -9.904 15.780 -5.787 1.00 0.00 N ATOM 485 CZ ARG A 36 -8.772 16.282 -6.268 1.00 0.00 C ATOM 486 NH1 ARG A 36 -7.984 15.539 -7.032 1.00 0.00 N ATOM 487 NH2 ARG A 36 -8.426 17.532 -5.984 1.00 0.00 N ATOM 0 H ARG A 36 -9.022 10.707 -5.235 1.00 0.00 H new ATOM 0 HA ARG A 36 -8.586 12.642 -7.290 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -8.015 12.616 -4.300 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -7.831 14.029 -5.320 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -10.454 12.524 -5.043 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -10.007 13.864 -4.006 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -10.009 14.102 -7.034 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -11.448 14.397 -6.079 1.00 0.00 H new ATOM 0 HE ARG A 36 -10.487 16.378 -5.202 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -8.246 14.578 -7.253 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -7.116 15.928 -7.399 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -9.029 18.107 -5.396 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -7.557 17.917 -6.354 1.00 0.00 H new ATOM 501 N MET A 37 -6.254 11.720 -7.868 1.00 0.00 N ATOM 502 CA MET A 37 -4.848 11.570 -8.226 1.00 0.00 C ATOM 503 C MET A 37 -4.435 12.615 -9.257 1.00 0.00 C ATOM 504 O MET A 37 -5.097 12.790 -10.279 1.00 0.00 O ATOM 505 CB MET A 37 -4.587 10.165 -8.774 1.00 0.00 C ATOM 506 CG MET A 37 -4.685 9.074 -7.720 1.00 0.00 C ATOM 507 SD MET A 37 -3.992 7.506 -8.278 1.00 0.00 S ATOM 508 CE MET A 37 -5.135 7.077 -9.588 1.00 0.00 C ATOM 0 H MET A 37 -6.906 11.528 -8.629 1.00 0.00 H new ATOM 0 HA MET A 37 -4.252 11.718 -7.326 1.00 0.00 H new ATOM 0 HB2 MET A 37 -5.302 9.956 -9.570 1.00 0.00 H new ATOM 0 HB3 MET A 37 -3.594 10.137 -9.223 1.00 0.00 H new ATOM 0 HG2 MET A 37 -4.164 9.397 -6.819 1.00 0.00 H new ATOM 0 HG3 MET A 37 -5.731 8.929 -7.449 1.00 0.00 H new ATOM 0 HE1 MET A 37 -4.828 6.136 -10.045 1.00 0.00 H new ATOM 0 HE2 MET A 37 -6.138 6.970 -9.175 1.00 0.00 H new ATOM 0 HE3 MET A 37 -5.135 7.864 -10.343 1.00 0.00 H new ATOM 518 N GLY A 38 -3.334 13.309 -8.981 1.00 0.00 N ATOM 519 CA GLY A 38 -2.852 14.329 -9.893 1.00 0.00 C ATOM 520 C GLY A 38 -1.758 15.183 -9.283 1.00 0.00 C ATOM 521 O GLY A 38 -1.654 16.373 -9.577 1.00 0.00 O ATOM 0 H GLY A 38 -2.768 13.182 -8.142 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -2.475 13.853 -10.798 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -3.683 14.968 -10.191 1.00 0.00 H new ATOM 525 N ALA A 39 -0.942 14.574 -8.429 1.00 0.00 N ATOM 526 CA ALA A 39 0.149 15.287 -7.776 1.00 0.00 C ATOM 527 C ALA A 39 1.238 14.322 -7.317 1.00 0.00 C ATOM 528 O ALA A 39 0.969 13.371 -6.584 1.00 0.00 O ATOM 529 CB ALA A 39 -0.377 16.092 -6.597 1.00 0.00 C ATOM 0 H ALA A 39 -1.016 13.589 -8.173 1.00 0.00 H new ATOM 0 HA ALA A 39 0.589 15.972 -8.501 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.449 16.619 -6.119 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -1.113 16.814 -6.949 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.844 15.420 -5.877 1.00 0.00 H new ATOM 535 N GLY A 40 2.468 14.574 -7.753 1.00 0.00 N ATOM 536 CA GLY A 40 3.578 13.718 -7.378 1.00 0.00 C ATOM 537 C GLY A 40 3.576 12.402 -8.129 1.00 0.00 C ATOM 538 O GLY A 40 3.022 12.307 -9.225 1.00 0.00 O ATOM 0 H GLY A 40 2.716 15.356 -8.359 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.516 14.240 -7.569 1.00 0.00 H new ATOM 0 HA3 GLY A 40 3.535 13.521 -6.307 1.00 0.00 H new ATOM 542 N ILE A 41 4.198 11.386 -7.541 1.00 0.00 N ATOM 543 CA ILE A 41 4.266 10.069 -8.164 1.00 0.00 C ATOM 544 C ILE A 41 2.871 9.524 -8.450 1.00 0.00 C ATOM 545 O ILE A 41 2.704 8.612 -9.259 1.00 0.00 O ATOM 546 CB ILE A 41 5.025 9.066 -7.276 1.00 0.00 C ATOM 547 CG1 ILE A 41 5.176 7.725 -7.998 1.00 0.00 C ATOM 548 CG2 ILE A 41 4.303 8.880 -5.949 1.00 0.00 C ATOM 549 CD1 ILE A 41 6.322 6.885 -7.480 1.00 0.00 C ATOM 0 H ILE A 41 4.662 11.449 -6.635 1.00 0.00 H new ATOM 0 HA ILE A 41 4.805 10.191 -9.103 1.00 0.00 H new ATOM 0 HB ILE A 41 6.020 9.463 -7.074 1.00 0.00 H new ATOM 0 HG12 ILE A 41 4.249 7.161 -7.897 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.323 7.909 -9.062 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.852 8.168 -5.333 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.242 9.837 -5.431 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.297 8.502 -6.132 1.00 0.00 H new ATOM 0 HD11 ILE A 41 6.369 5.950 -8.038 1.00 0.00 H new ATOM 0 HD12 ILE A 41 7.258 7.429 -7.606 1.00 0.00 H new ATOM 0 HD13 ILE A 41 6.167 6.670 -6.423 1.00 0.00 H new ATOM 561 N ALA A 42 1.871 10.090 -7.781 1.00 0.00 N ATOM 562 CA ALA A 42 0.490 9.664 -7.966 1.00 0.00 C ATOM 563 C ALA A 42 0.043 9.862 -9.411 1.00 0.00 C ATOM 564 O ALA A 42 -0.798 9.120 -9.919 1.00 0.00 O ATOM 565 CB ALA A 42 -0.428 10.422 -7.019 1.00 0.00 C ATOM 0 H ALA A 42 1.992 10.845 -7.106 1.00 0.00 H new ATOM 0 HA ALA A 42 0.431 8.600 -7.737 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -1.456 10.093 -7.168 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -0.130 10.226 -5.989 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -0.356 11.491 -7.220 1.00 0.00 H new ATOM 571 N VAL A 43 0.611 10.868 -10.068 1.00 0.00 N ATOM 572 CA VAL A 43 0.271 11.164 -11.455 1.00 0.00 C ATOM 573 C VAL A 43 0.701 10.031 -12.380 1.00 0.00 C ATOM 574 O VAL A 43 -0.096 9.525 -13.172 1.00 0.00 O ATOM 575 CB VAL A 43 0.928 12.475 -11.926 1.00 0.00 C ATOM 576 CG1 VAL A 43 0.642 12.716 -13.401 1.00 0.00 C ATOM 577 CG2 VAL A 43 0.446 13.646 -11.083 1.00 0.00 C ATOM 0 H VAL A 43 1.309 11.492 -9.662 1.00 0.00 H new ATOM 0 HA VAL A 43 -0.813 11.273 -11.499 1.00 0.00 H new ATOM 0 HB VAL A 43 2.007 12.386 -11.799 1.00 0.00 H new ATOM 0 HG11 VAL A 43 1.114 13.647 -13.716 1.00 0.00 H new ATOM 0 HG12 VAL A 43 1.041 11.890 -13.989 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.435 12.785 -13.556 1.00 0.00 H new ATOM 0 HG21 VAL A 43 0.921 14.564 -11.430 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -0.636 13.740 -11.175 1.00 0.00 H new ATOM 0 HG23 VAL A 43 0.708 13.475 -10.039 1.00 0.00 H new ATOM 587 N LEU A 44 1.965 9.637 -12.275 1.00 0.00 N ATOM 588 CA LEU A 44 2.502 8.562 -13.102 1.00 0.00 C ATOM 589 C LEU A 44 1.572 7.353 -13.095 1.00 0.00 C ATOM 590 O LEU A 44 1.409 6.676 -14.111 1.00 0.00 O ATOM 591 CB LEU A 44 3.890 8.154 -12.604 1.00 0.00 C ATOM 592 CG LEU A 44 4.928 9.274 -12.520 1.00 0.00 C ATOM 593 CD1 LEU A 44 6.125 8.831 -11.692 1.00 0.00 C ATOM 594 CD2 LEU A 44 5.369 9.699 -13.913 1.00 0.00 C ATOM 0 H LEU A 44 2.637 10.046 -11.626 1.00 0.00 H new ATOM 0 HA LEU A 44 2.583 8.930 -14.125 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.783 7.710 -11.614 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.276 7.376 -13.263 1.00 0.00 H new ATOM 0 HG LEU A 44 4.469 10.132 -12.029 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.853 9.641 -11.643 1.00 0.00 H new ATOM 0 HD12 LEU A 44 5.796 8.577 -10.684 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.584 7.957 -12.155 1.00 0.00 H new ATOM 0 HD21 LEU A 44 6.108 10.497 -13.833 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.809 8.847 -14.431 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.506 10.058 -14.474 1.00 0.00 H new ATOM 606 N PHE A 45 0.962 7.088 -11.945 1.00 0.00 N ATOM 607 CA PHE A 45 0.047 5.962 -11.806 1.00 0.00 C ATOM 608 C PHE A 45 -1.123 6.089 -12.778 1.00 0.00 C ATOM 609 O PHE A 45 -1.636 5.090 -13.284 1.00 0.00 O ATOM 610 CB PHE A 45 -0.475 5.875 -10.370 1.00 0.00 C ATOM 611 CG PHE A 45 0.406 5.069 -9.460 1.00 0.00 C ATOM 612 CD1 PHE A 45 0.223 3.702 -9.328 1.00 0.00 C ATOM 613 CD2 PHE A 45 1.417 5.679 -8.735 1.00 0.00 C ATOM 614 CE1 PHE A 45 1.033 2.957 -8.491 1.00 0.00 C ATOM 615 CE2 PHE A 45 2.230 4.939 -7.897 1.00 0.00 C ATOM 616 CZ PHE A 45 2.037 3.577 -7.774 1.00 0.00 C ATOM 0 H PHE A 45 1.085 7.638 -11.095 1.00 0.00 H new ATOM 0 HA PHE A 45 0.595 5.050 -12.041 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.575 6.883 -9.967 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.472 5.435 -10.380 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.562 3.212 -9.886 1.00 0.00 H new ATOM 0 HD2 PHE A 45 1.571 6.744 -8.826 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.881 1.892 -8.398 1.00 0.00 H new ATOM 0 HE2 PHE A 45 3.016 5.426 -7.339 1.00 0.00 H new ATOM 0 HZ PHE A 45 2.670 2.998 -7.118 1.00 0.00 H new ATOM 626 N LYS A 46 -1.540 7.324 -13.033 1.00 0.00 N ATOM 627 CA LYS A 46 -2.649 7.584 -13.944 1.00 0.00 C ATOM 628 C LYS A 46 -2.235 7.332 -15.391 1.00 0.00 C ATOM 629 O LYS A 46 -3.073 7.045 -16.246 1.00 0.00 O ATOM 630 CB LYS A 46 -3.137 9.026 -13.787 1.00 0.00 C ATOM 631 CG LYS A 46 -3.893 9.274 -12.493 1.00 0.00 C ATOM 632 CD LYS A 46 -3.838 10.737 -12.086 1.00 0.00 C ATOM 633 CE LYS A 46 -4.627 11.613 -13.048 1.00 0.00 C ATOM 634 NZ LYS A 46 -6.094 11.392 -12.923 1.00 0.00 N ATOM 0 H LYS A 46 -1.127 8.161 -12.622 1.00 0.00 H new ATOM 0 HA LYS A 46 -3.461 6.902 -13.692 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -2.280 9.698 -13.832 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -3.782 9.276 -14.629 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -4.932 8.968 -12.613 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -3.469 8.659 -11.699 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -4.237 10.851 -11.078 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.800 11.069 -12.057 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -4.400 12.661 -12.854 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -4.314 11.403 -14.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -6.602 12.129 -13.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -6.338 10.458 -13.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -6.367 11.435 -11.920 1.00 0.00 H new ATOM 648 N LYS A 47 -0.938 7.439 -15.658 1.00 0.00 N ATOM 649 CA LYS A 47 -0.412 7.220 -17.000 1.00 0.00 C ATOM 650 C LYS A 47 -0.139 5.739 -17.242 1.00 0.00 C ATOM 651 O LYS A 47 -0.514 5.189 -18.278 1.00 0.00 O ATOM 652 CB LYS A 47 0.872 8.026 -17.204 1.00 0.00 C ATOM 653 CG LYS A 47 0.670 9.528 -17.103 1.00 0.00 C ATOM 654 CD LYS A 47 1.924 10.288 -17.503 1.00 0.00 C ATOM 655 CE LYS A 47 1.846 11.749 -17.089 1.00 0.00 C ATOM 656 NZ LYS A 47 3.165 12.430 -17.208 1.00 0.00 N ATOM 0 H LYS A 47 -0.231 7.676 -14.962 1.00 0.00 H new ATOM 0 HA LYS A 47 -1.162 7.555 -17.717 1.00 0.00 H new ATOM 0 HB2 LYS A 47 1.607 7.716 -16.462 1.00 0.00 H new ATOM 0 HB3 LYS A 47 1.288 7.789 -18.183 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -0.159 9.828 -17.744 1.00 0.00 H new ATOM 0 HG3 LYS A 47 0.394 9.791 -16.082 1.00 0.00 H new ATOM 0 HD2 LYS A 47 2.795 9.824 -17.041 1.00 0.00 H new ATOM 0 HD3 LYS A 47 2.062 10.221 -18.582 1.00 0.00 H new ATOM 0 HE2 LYS A 47 1.114 12.264 -17.711 1.00 0.00 H new ATOM 0 HE3 LYS A 47 1.494 11.817 -16.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 3.070 13.424 -16.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 3.858 11.954 -16.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 3.490 12.388 -18.195 1.00 0.00 H new ATOM 670 N LYS A 48 0.515 5.097 -16.279 1.00 0.00 N ATOM 671 CA LYS A 48 0.836 3.679 -16.386 1.00 0.00 C ATOM 672 C LYS A 48 -0.400 2.821 -16.136 1.00 0.00 C ATOM 673 O LYS A 48 -0.747 1.963 -16.949 1.00 0.00 O ATOM 674 CB LYS A 48 1.937 3.308 -15.389 1.00 0.00 C ATOM 675 CG LYS A 48 3.340 3.447 -15.954 1.00 0.00 C ATOM 676 CD LYS A 48 3.658 4.889 -16.311 1.00 0.00 C ATOM 677 CE LYS A 48 4.271 5.633 -15.134 1.00 0.00 C ATOM 678 NZ LYS A 48 5.188 6.717 -15.581 1.00 0.00 N ATOM 0 H LYS A 48 0.833 5.537 -15.415 1.00 0.00 H new ATOM 0 HA LYS A 48 1.191 3.488 -17.399 1.00 0.00 H new ATOM 0 HB2 LYS A 48 1.845 3.941 -14.507 1.00 0.00 H new ATOM 0 HB3 LYS A 48 1.787 2.280 -15.060 1.00 0.00 H new ATOM 0 HG2 LYS A 48 4.064 3.084 -15.225 1.00 0.00 H new ATOM 0 HG3 LYS A 48 3.439 2.821 -16.841 1.00 0.00 H new ATOM 0 HD2 LYS A 48 4.346 4.912 -17.156 1.00 0.00 H new ATOM 0 HD3 LYS A 48 2.747 5.396 -16.628 1.00 0.00 H new ATOM 0 HE2 LYS A 48 3.477 6.059 -14.520 1.00 0.00 H new ATOM 0 HE3 LYS A 48 4.818 4.931 -14.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 5.955 6.831 -14.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 5.592 6.470 -16.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 4.659 7.609 -15.661 1.00 0.00 H new ATOM 692 N PHE A 49 -1.062 3.059 -15.009 1.00 0.00 N ATOM 693 CA PHE A 49 -2.260 2.308 -14.653 1.00 0.00 C ATOM 694 C PHE A 49 -3.449 3.243 -14.455 1.00 0.00 C ATOM 695 O PHE A 49 -4.102 3.223 -13.412 1.00 0.00 O ATOM 696 CB PHE A 49 -2.019 1.494 -13.380 1.00 0.00 C ATOM 697 CG PHE A 49 -0.601 1.022 -13.230 1.00 0.00 C ATOM 698 CD1 PHE A 49 0.362 1.846 -12.669 1.00 0.00 C ATOM 699 CD2 PHE A 49 -0.231 -0.245 -13.649 1.00 0.00 C ATOM 700 CE1 PHE A 49 1.667 1.415 -12.531 1.00 0.00 C ATOM 701 CE2 PHE A 49 1.073 -0.683 -13.513 1.00 0.00 C ATOM 702 CZ PHE A 49 2.023 0.148 -12.952 1.00 0.00 C ATOM 0 H PHE A 49 -0.789 3.766 -14.326 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.488 1.627 -15.473 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -2.285 2.101 -12.514 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -2.683 0.630 -13.380 1.00 0.00 H new ATOM 0 HD1 PHE A 49 0.089 2.836 -12.336 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -0.970 -0.899 -14.087 1.00 0.00 H new ATOM 0 HE1 PHE A 49 2.408 2.068 -12.094 1.00 0.00 H new ATOM 0 HE2 PHE A 49 1.348 -1.673 -13.845 1.00 0.00 H new ATOM 0 HZ PHE A 49 3.042 -0.192 -12.843 1.00 0.00 H new ATOM 712 N GLY A 50 -3.725 4.063 -15.465 1.00 0.00 N ATOM 713 CA GLY A 50 -4.834 4.996 -15.382 1.00 0.00 C ATOM 714 C GLY A 50 -6.178 4.296 -15.349 1.00 0.00 C ATOM 715 O GLY A 50 -6.855 4.188 -16.370 1.00 0.00 O ATOM 0 H GLY A 50 -3.200 4.098 -16.339 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -4.724 5.608 -14.487 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -4.801 5.672 -16.236 1.00 0.00 H new ATOM 719 N GLY A 51 -6.565 3.816 -14.170 1.00 0.00 N ATOM 720 CA GLY A 51 -7.835 3.127 -14.031 1.00 0.00 C ATOM 721 C GLY A 51 -8.622 3.601 -12.825 1.00 0.00 C ATOM 722 O GLY A 51 -8.949 2.811 -11.939 1.00 0.00 O ATOM 0 H GLY A 51 -6.022 3.892 -13.310 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.429 3.281 -14.932 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -7.656 2.055 -13.946 1.00 0.00 H new ATOM 726 N VAL A 52 -8.926 4.894 -12.789 1.00 0.00 N ATOM 727 CA VAL A 52 -9.679 5.473 -11.683 1.00 0.00 C ATOM 728 C VAL A 52 -11.130 5.004 -11.701 1.00 0.00 C ATOM 729 O VAL A 52 -11.687 4.640 -10.666 1.00 0.00 O ATOM 730 CB VAL A 52 -9.648 7.012 -11.726 1.00 0.00 C ATOM 731 CG1 VAL A 52 -8.227 7.523 -11.546 1.00 0.00 C ATOM 732 CG2 VAL A 52 -10.244 7.520 -13.031 1.00 0.00 C ATOM 0 H VAL A 52 -8.662 5.561 -13.514 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.201 5.134 -10.764 1.00 0.00 H new ATOM 0 HB VAL A 52 -10.253 7.393 -10.903 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -8.225 8.612 -11.579 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -7.839 7.189 -10.584 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -7.597 7.135 -12.346 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -10.214 8.610 -13.045 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -9.668 7.131 -13.870 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -11.278 7.184 -13.114 1.00 0.00 H new ATOM 742 N GLN A 53 -11.735 5.015 -12.884 1.00 0.00 N ATOM 743 CA GLN A 53 -13.121 4.591 -13.037 1.00 0.00 C ATOM 744 C GLN A 53 -13.287 3.124 -12.656 1.00 0.00 C ATOM 745 O GLN A 53 -14.347 2.710 -12.187 1.00 0.00 O ATOM 746 CB GLN A 53 -13.589 4.813 -14.476 1.00 0.00 C ATOM 747 CG GLN A 53 -15.030 4.394 -14.719 1.00 0.00 C ATOM 748 CD GLN A 53 -15.998 5.044 -13.750 1.00 0.00 C ATOM 749 OE1 GLN A 53 -16.012 6.265 -13.593 1.00 0.00 O ATOM 750 NE2 GLN A 53 -16.815 4.229 -13.092 1.00 0.00 N ATOM 0 H GLN A 53 -11.287 5.313 -13.751 1.00 0.00 H new ATOM 0 HA GLN A 53 -13.734 5.193 -12.366 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -13.479 5.868 -14.726 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -12.939 4.256 -15.151 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -15.313 4.654 -15.739 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -15.109 3.310 -14.633 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -16.770 3.223 -13.253 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -17.488 4.609 -12.426 1.00 0.00 H new ATOM 759 N GLU A 54 -12.232 2.341 -12.861 1.00 0.00 N ATOM 760 CA GLU A 54 -12.262 0.919 -12.540 1.00 0.00 C ATOM 761 C GLU A 54 -12.226 0.702 -11.031 1.00 0.00 C ATOM 762 O GLU A 54 -12.860 -0.217 -10.509 1.00 0.00 O ATOM 763 CB GLU A 54 -11.082 0.200 -13.198 1.00 0.00 C ATOM 764 CG GLU A 54 -11.333 -0.181 -14.648 1.00 0.00 C ATOM 765 CD GLU A 54 -12.255 -1.377 -14.785 1.00 0.00 C ATOM 766 OE1 GLU A 54 -13.475 -1.213 -14.572 1.00 0.00 O ATOM 767 OE2 GLU A 54 -11.757 -2.477 -15.104 1.00 0.00 O ATOM 0 H GLU A 54 -11.346 2.668 -13.248 1.00 0.00 H new ATOM 0 HA GLU A 54 -13.193 0.504 -12.928 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -10.202 0.841 -13.147 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -10.853 -0.701 -12.629 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.767 0.670 -15.174 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.382 -0.403 -15.131 1.00 0.00 H new ATOM 774 N LEU A 55 -11.480 1.552 -10.334 1.00 0.00 N ATOM 775 CA LEU A 55 -11.360 1.453 -8.883 1.00 0.00 C ATOM 776 C LEU A 55 -12.647 1.904 -8.199 1.00 0.00 C ATOM 777 O LEU A 55 -13.179 1.208 -7.333 1.00 0.00 O ATOM 778 CB LEU A 55 -10.184 2.298 -8.390 1.00 0.00 C ATOM 779 CG LEU A 55 -8.797 1.855 -8.859 1.00 0.00 C ATOM 780 CD1 LEU A 55 -7.768 2.939 -8.578 1.00 0.00 C ATOM 781 CD2 LEU A 55 -8.398 0.551 -8.186 1.00 0.00 C ATOM 0 H LEU A 55 -10.949 2.317 -10.750 1.00 0.00 H new ATOM 0 HA LEU A 55 -11.181 0.409 -8.628 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -10.342 3.328 -8.711 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -10.194 2.298 -7.300 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.834 1.688 -9.935 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.787 2.607 -8.918 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -8.046 3.850 -9.107 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.732 3.138 -7.507 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.409 0.251 -8.532 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.378 0.691 -7.105 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -9.121 -0.225 -8.438 1.00 0.00 H new ATOM 793 N LEU A 56 -13.143 3.072 -8.593 1.00 0.00 N ATOM 794 CA LEU A 56 -14.369 3.615 -8.019 1.00 0.00 C ATOM 795 C LEU A 56 -15.498 2.591 -8.078 1.00 0.00 C ATOM 796 O LEU A 56 -16.320 2.506 -7.166 1.00 0.00 O ATOM 797 CB LEU A 56 -14.781 4.889 -8.760 1.00 0.00 C ATOM 798 CG LEU A 56 -13.778 6.042 -8.721 1.00 0.00 C ATOM 799 CD1 LEU A 56 -14.214 7.161 -9.654 1.00 0.00 C ATOM 800 CD2 LEU A 56 -13.619 6.563 -7.299 1.00 0.00 C ATOM 0 H LEU A 56 -12.715 3.661 -9.307 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.176 3.856 -6.974 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.970 4.634 -9.803 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.724 5.240 -8.341 1.00 0.00 H new ATOM 0 HG LEU A 56 -12.812 5.669 -9.061 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.488 7.973 -9.613 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.276 6.781 -10.674 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -15.191 7.532 -9.345 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -12.901 7.383 -7.290 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -14.582 6.919 -6.932 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.260 5.760 -6.655 1.00 0.00 H new ATOM 812 N ASN A 57 -15.530 1.814 -9.156 1.00 0.00 N ATOM 813 CA ASN A 57 -16.557 0.794 -9.332 1.00 0.00 C ATOM 814 C ASN A 57 -16.588 -0.158 -8.141 1.00 0.00 C ATOM 815 O ASN A 57 -17.643 -0.679 -7.778 1.00 0.00 O ATOM 816 CB ASN A 57 -16.309 0.009 -10.621 1.00 0.00 C ATOM 817 CG ASN A 57 -16.981 0.644 -11.824 1.00 0.00 C ATOM 818 OD1 ASN A 57 -18.150 1.025 -11.767 1.00 0.00 O ATOM 819 ND2 ASN A 57 -16.241 0.762 -12.921 1.00 0.00 N ATOM 0 H ASN A 57 -14.857 1.871 -9.920 1.00 0.00 H new ATOM 0 HA ASN A 57 -17.523 1.294 -9.399 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -15.236 -0.058 -10.801 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -16.676 -1.010 -10.499 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -16.638 1.182 -13.761 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -15.276 0.432 -12.923 1.00 0.00 H new ATOM 826 N GLN A 58 -15.425 -0.381 -7.537 1.00 0.00 N ATOM 827 CA GLN A 58 -15.320 -1.271 -6.387 1.00 0.00 C ATOM 828 C GLN A 58 -16.131 -0.738 -5.211 1.00 0.00 C ATOM 829 O GLN A 58 -16.538 -1.498 -4.332 1.00 0.00 O ATOM 830 CB GLN A 58 -13.855 -1.438 -5.978 1.00 0.00 C ATOM 831 CG GLN A 58 -13.028 -2.222 -6.984 1.00 0.00 C ATOM 832 CD GLN A 58 -11.643 -2.556 -6.467 1.00 0.00 C ATOM 833 OE1 GLN A 58 -11.491 -3.090 -5.367 1.00 0.00 O ATOM 834 NE2 GLN A 58 -10.624 -2.244 -7.259 1.00 0.00 N ATOM 0 H GLN A 58 -14.543 0.042 -7.825 1.00 0.00 H new ATOM 0 HA GLN A 58 -15.724 -2.243 -6.672 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -13.409 -0.452 -5.843 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -13.811 -1.942 -5.013 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -13.550 -3.145 -7.237 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -12.939 -1.644 -7.904 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -10.797 -1.803 -8.162 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -9.669 -2.446 -6.964 1.00 0.00 H new ATOM 843 N GLN A 59 -16.362 0.571 -5.201 1.00 0.00 N ATOM 844 CA GLN A 59 -17.124 1.204 -4.132 1.00 0.00 C ATOM 845 C GLN A 59 -16.530 0.868 -2.768 1.00 0.00 C ATOM 846 O GLN A 59 -17.248 0.491 -1.841 1.00 0.00 O ATOM 847 CB GLN A 59 -18.587 0.760 -4.187 1.00 0.00 C ATOM 848 CG GLN A 59 -19.278 1.103 -5.497 1.00 0.00 C ATOM 849 CD GLN A 59 -20.694 0.567 -5.568 1.00 0.00 C ATOM 850 OE1 GLN A 59 -21.206 0.005 -4.600 1.00 0.00 O ATOM 851 NE2 GLN A 59 -21.335 0.739 -6.718 1.00 0.00 N ATOM 0 H GLN A 59 -16.032 1.213 -5.921 1.00 0.00 H new ATOM 0 HA GLN A 59 -17.074 2.283 -4.275 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -18.637 -0.318 -4.031 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -19.131 1.227 -3.366 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -19.297 2.186 -5.621 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -18.698 0.698 -6.326 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -20.872 1.211 -7.495 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -22.291 0.399 -6.825 1.00 0.00 H new ATOM 860 N LYS A 60 -15.214 1.007 -2.651 1.00 0.00 N ATOM 861 CA LYS A 60 -14.521 0.720 -1.400 1.00 0.00 C ATOM 862 C LYS A 60 -14.707 1.858 -0.402 1.00 0.00 C ATOM 863 O LYS A 60 -15.396 2.838 -0.683 1.00 0.00 O ATOM 864 CB LYS A 60 -13.030 0.492 -1.659 1.00 0.00 C ATOM 865 CG LYS A 60 -12.741 -0.725 -2.521 1.00 0.00 C ATOM 866 CD LYS A 60 -12.995 -2.017 -1.763 1.00 0.00 C ATOM 867 CE LYS A 60 -13.427 -3.136 -2.699 1.00 0.00 C ATOM 868 NZ LYS A 60 -13.274 -4.476 -2.068 1.00 0.00 N ATOM 0 H LYS A 60 -14.605 1.317 -3.408 1.00 0.00 H new ATOM 0 HA LYS A 60 -14.952 -0.187 -0.975 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -12.615 1.376 -2.143 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -12.517 0.380 -0.704 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -13.366 -0.697 -3.414 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -11.704 -0.697 -2.857 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -12.090 -2.313 -1.233 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -13.766 -1.853 -1.010 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -14.468 -2.987 -2.987 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -12.834 -3.095 -3.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -13.579 -5.212 -2.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -12.277 -4.629 -1.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -13.860 -4.525 -1.210 1.00 0.00 H new ATOM 882 N LYS A 61 -14.086 1.722 0.765 1.00 0.00 N ATOM 883 CA LYS A 61 -14.180 2.740 1.805 1.00 0.00 C ATOM 884 C LYS A 61 -13.019 2.623 2.787 1.00 0.00 C ATOM 885 O LYS A 61 -12.304 1.621 2.801 1.00 0.00 O ATOM 886 CB LYS A 61 -15.509 2.613 2.553 1.00 0.00 C ATOM 887 CG LYS A 61 -16.728 2.784 1.663 1.00 0.00 C ATOM 888 CD LYS A 61 -18.006 2.878 2.478 1.00 0.00 C ATOM 889 CE LYS A 61 -19.197 3.245 1.607 1.00 0.00 C ATOM 890 NZ LYS A 61 -20.477 3.197 2.367 1.00 0.00 N ATOM 0 H LYS A 61 -13.512 0.916 1.014 1.00 0.00 H new ATOM 0 HA LYS A 61 -14.131 3.718 1.327 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -15.554 1.635 3.032 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -15.542 3.359 3.347 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -16.614 3.684 1.058 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -16.797 1.943 0.973 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -18.195 1.925 2.971 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -17.884 3.625 3.263 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -19.054 4.246 1.200 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -19.252 2.561 0.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -21.264 3.454 1.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -20.627 2.236 2.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -20.435 3.868 3.160 1.00 0.00 H new ATOM 904 N SER A 62 -12.838 3.652 3.608 1.00 0.00 N ATOM 905 CA SER A 62 -11.762 3.666 4.592 1.00 0.00 C ATOM 906 C SER A 62 -11.616 2.300 5.256 1.00 0.00 C ATOM 907 O SER A 62 -12.598 1.702 5.693 1.00 0.00 O ATOM 908 CB SER A 62 -12.026 4.736 5.653 1.00 0.00 C ATOM 909 OG SER A 62 -13.353 4.652 6.143 1.00 0.00 O ATOM 0 H SER A 62 -13.423 4.488 3.611 1.00 0.00 H new ATOM 0 HA SER A 62 -10.832 3.900 4.074 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.323 4.617 6.477 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.854 5.725 5.228 1.00 0.00 H new ATOM 0 HG SER A 62 -13.631 3.713 6.174 1.00 0.00 H new ATOM 915 N GLY A 63 -10.381 1.812 5.327 1.00 0.00 N ATOM 916 CA GLY A 63 -10.128 0.521 5.939 1.00 0.00 C ATOM 917 C GLY A 63 -10.097 -0.605 4.924 1.00 0.00 C ATOM 918 O GLY A 63 -9.628 -1.703 5.221 1.00 0.00 O ATOM 0 H GLY A 63 -9.552 2.288 4.972 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -9.177 0.554 6.470 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -10.900 0.316 6.681 1.00 0.00 H new ATOM 922 N GLU A 64 -10.599 -0.332 3.724 1.00 0.00 N ATOM 923 CA GLU A 64 -10.629 -1.332 2.663 1.00 0.00 C ATOM 924 C GLU A 64 -9.553 -1.050 1.618 1.00 0.00 C ATOM 925 O GLU A 64 -9.042 0.066 1.523 1.00 0.00 O ATOM 926 CB GLU A 64 -12.006 -1.362 1.998 1.00 0.00 C ATOM 927 CG GLU A 64 -12.390 -2.727 1.453 1.00 0.00 C ATOM 928 CD GLU A 64 -12.797 -3.698 2.544 1.00 0.00 C ATOM 929 OE1 GLU A 64 -11.911 -4.141 3.305 1.00 0.00 O ATOM 930 OE2 GLU A 64 -14.002 -4.013 2.638 1.00 0.00 O ATOM 0 H GLU A 64 -10.990 0.573 3.462 1.00 0.00 H new ATOM 0 HA GLU A 64 -10.429 -2.305 3.111 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -12.757 -1.045 2.722 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -12.023 -0.637 1.184 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -13.213 -2.614 0.747 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -11.549 -3.142 0.898 1.00 0.00 H new ATOM 937 N VAL A 65 -9.214 -2.070 0.836 1.00 0.00 N ATOM 938 CA VAL A 65 -8.199 -1.932 -0.202 1.00 0.00 C ATOM 939 C VAL A 65 -8.734 -2.386 -1.556 1.00 0.00 C ATOM 940 O VAL A 65 -9.390 -3.421 -1.660 1.00 0.00 O ATOM 941 CB VAL A 65 -6.935 -2.745 0.137 1.00 0.00 C ATOM 942 CG1 VAL A 65 -7.215 -4.236 0.033 1.00 0.00 C ATOM 943 CG2 VAL A 65 -5.785 -2.345 -0.775 1.00 0.00 C ATOM 0 H VAL A 65 -9.627 -3.000 0.901 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.939 -0.875 -0.253 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.647 -2.525 1.165 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.311 -4.794 0.276 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.007 -4.507 0.731 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.528 -4.477 -0.983 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -4.900 -2.929 -0.522 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -6.060 -2.535 -1.812 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -5.569 -1.284 -0.645 1.00 0.00 H new ATOM 953 N ALA A 66 -8.448 -1.603 -2.591 1.00 0.00 N ATOM 954 CA ALA A 66 -8.898 -1.925 -3.940 1.00 0.00 C ATOM 955 C ALA A 66 -7.786 -2.588 -4.746 1.00 0.00 C ATOM 956 O ALA A 66 -6.679 -2.058 -4.848 1.00 0.00 O ATOM 957 CB ALA A 66 -9.389 -0.671 -4.646 1.00 0.00 C ATOM 0 H ALA A 66 -7.907 -0.741 -2.521 1.00 0.00 H new ATOM 0 HA ALA A 66 -9.725 -2.631 -3.862 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -9.722 -0.927 -5.652 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -10.220 -0.241 -4.087 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -8.578 0.054 -4.706 1.00 0.00 H new ATOM 963 N VAL A 67 -8.086 -3.750 -5.316 1.00 0.00 N ATOM 964 CA VAL A 67 -7.111 -4.485 -6.113 1.00 0.00 C ATOM 965 C VAL A 67 -7.491 -4.477 -7.590 1.00 0.00 C ATOM 966 O VAL A 67 -8.569 -4.940 -7.967 1.00 0.00 O ATOM 967 CB VAL A 67 -6.981 -5.944 -5.636 1.00 0.00 C ATOM 968 CG1 VAL A 67 -6.091 -6.737 -6.580 1.00 0.00 C ATOM 969 CG2 VAL A 67 -6.441 -5.993 -4.214 1.00 0.00 C ATOM 0 H VAL A 67 -8.997 -4.203 -5.241 1.00 0.00 H new ATOM 0 HA VAL A 67 -6.153 -3.982 -5.984 1.00 0.00 H new ATOM 0 HB VAL A 67 -7.971 -6.399 -5.641 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -6.011 -7.765 -6.227 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -6.524 -6.730 -7.580 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -5.099 -6.286 -6.610 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -6.355 -7.031 -3.893 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -5.459 -5.521 -4.181 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -7.121 -5.462 -3.548 1.00 0.00 H new ATOM 979 N LEU A 68 -6.600 -3.949 -8.421 1.00 0.00 N ATOM 980 CA LEU A 68 -6.841 -3.881 -9.858 1.00 0.00 C ATOM 981 C LEU A 68 -5.794 -4.683 -10.625 1.00 0.00 C ATOM 982 O LEU A 68 -4.596 -4.567 -10.366 1.00 0.00 O ATOM 983 CB LEU A 68 -6.831 -2.426 -10.329 1.00 0.00 C ATOM 984 CG LEU A 68 -7.715 -2.103 -11.534 1.00 0.00 C ATOM 985 CD1 LEU A 68 -9.175 -2.387 -11.215 1.00 0.00 C ATOM 986 CD2 LEU A 68 -7.532 -0.653 -11.957 1.00 0.00 C ATOM 0 H LEU A 68 -5.704 -3.562 -8.125 1.00 0.00 H new ATOM 0 HA LEU A 68 -7.821 -4.314 -10.057 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -7.141 -1.794 -9.497 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -5.805 -2.151 -10.573 1.00 0.00 H new ATOM 0 HG LEU A 68 -7.414 -2.743 -12.364 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -9.790 -2.151 -12.084 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -9.294 -3.440 -10.961 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -9.489 -1.773 -10.371 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -8.169 -0.441 -12.816 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -7.806 0.004 -11.132 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -6.490 -0.482 -12.227 1.00 0.00 H new ATOM 998 N LYS A 69 -6.253 -5.494 -11.571 1.00 0.00 N ATOM 999 CA LYS A 69 -5.357 -6.313 -12.379 1.00 0.00 C ATOM 1000 C LYS A 69 -4.914 -5.563 -13.631 1.00 0.00 C ATOM 1001 O LYS A 69 -5.600 -5.584 -14.653 1.00 0.00 O ATOM 1002 CB LYS A 69 -6.045 -7.622 -12.773 1.00 0.00 C ATOM 1003 CG LYS A 69 -5.078 -8.711 -13.204 1.00 0.00 C ATOM 1004 CD LYS A 69 -4.568 -8.477 -14.616 1.00 0.00 C ATOM 1005 CE LYS A 69 -4.103 -9.772 -15.263 1.00 0.00 C ATOM 1006 NZ LYS A 69 -5.207 -10.454 -15.994 1.00 0.00 N ATOM 0 H LYS A 69 -7.242 -5.602 -11.798 1.00 0.00 H new ATOM 0 HA LYS A 69 -4.474 -6.539 -11.781 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -6.632 -7.983 -11.929 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -6.744 -7.425 -13.586 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -4.236 -8.745 -12.513 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -5.573 -9.681 -13.151 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -5.358 -8.031 -15.220 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -3.744 -7.764 -14.593 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -3.287 -9.560 -15.953 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -3.708 -10.439 -14.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -4.850 -11.333 -16.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.976 -10.679 -15.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -5.567 -9.827 -16.742 1.00 0.00 H new ATOM 1020 N ARG A 70 -3.765 -4.902 -13.544 1.00 0.00 N ATOM 1021 CA ARG A 70 -3.231 -4.145 -14.670 1.00 0.00 C ATOM 1022 C ARG A 70 -1.773 -4.513 -14.930 1.00 0.00 C ATOM 1023 O ARG A 70 -1.108 -5.099 -14.075 1.00 0.00 O ATOM 1024 CB ARG A 70 -3.350 -2.643 -14.405 1.00 0.00 C ATOM 1025 CG ARG A 70 -4.749 -2.204 -14.005 1.00 0.00 C ATOM 1026 CD ARG A 70 -5.586 -1.837 -15.221 1.00 0.00 C ATOM 1027 NE ARG A 70 -5.964 -3.012 -16.000 1.00 0.00 N ATOM 1028 CZ ARG A 70 -6.595 -2.948 -17.167 1.00 0.00 C ATOM 1029 NH1 ARG A 70 -6.917 -1.772 -17.687 1.00 0.00 N ATOM 1030 NH2 ARG A 70 -6.905 -4.063 -17.817 1.00 0.00 N ATOM 0 H ARG A 70 -3.185 -4.875 -12.705 1.00 0.00 H new ATOM 0 HA ARG A 70 -3.815 -4.398 -15.555 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -2.652 -2.366 -13.615 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -3.050 -2.100 -15.301 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -5.239 -3.006 -13.453 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -4.685 -1.348 -13.334 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -6.485 -1.312 -14.897 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -5.025 -1.148 -15.853 1.00 0.00 H new ATOM 0 HE ARG A 70 -5.731 -3.933 -15.628 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -6.680 -0.913 -17.191 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -7.402 -1.726 -18.583 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -6.659 -4.970 -17.420 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -7.390 -4.013 -18.713 1.00 0.00 H new ATOM 1044 N ASP A 71 -1.283 -4.166 -16.115 1.00 0.00 N ATOM 1045 CA ASP A 71 0.096 -4.459 -16.488 1.00 0.00 C ATOM 1046 C ASP A 71 0.541 -5.800 -15.912 1.00 0.00 C ATOM 1047 O ASP A 71 1.646 -5.924 -15.385 1.00 0.00 O ATOM 1048 CB ASP A 71 1.025 -3.346 -16.001 1.00 0.00 C ATOM 1049 CG ASP A 71 2.252 -3.192 -16.878 1.00 0.00 C ATOM 1050 OD1 ASP A 71 2.123 -3.343 -18.111 1.00 0.00 O ATOM 1051 OD2 ASP A 71 3.342 -2.920 -16.332 1.00 0.00 O ATOM 0 H ASP A 71 -1.820 -3.681 -16.834 1.00 0.00 H new ATOM 0 HA ASP A 71 0.149 -4.516 -17.575 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.478 -2.404 -15.978 1.00 0.00 H new ATOM 0 HB3 ASP A 71 1.337 -3.558 -14.978 1.00 0.00 H new ATOM 1056 N GLY A 72 -0.327 -6.801 -16.017 1.00 0.00 N ATOM 1057 CA GLY A 72 -0.005 -8.119 -15.501 1.00 0.00 C ATOM 1058 C GLY A 72 0.409 -8.086 -14.044 1.00 0.00 C ATOM 1059 O GLY A 72 1.408 -8.696 -13.662 1.00 0.00 O ATOM 0 H GLY A 72 -1.247 -6.723 -16.450 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -0.871 -8.772 -15.615 1.00 0.00 H new ATOM 0 HA3 GLY A 72 0.800 -8.551 -16.095 1.00 0.00 H new ATOM 1063 N ARG A 73 -0.358 -7.370 -13.228 1.00 0.00 N ATOM 1064 CA ARG A 73 -0.063 -7.257 -11.805 1.00 0.00 C ATOM 1065 C ARG A 73 -1.250 -6.668 -11.049 1.00 0.00 C ATOM 1066 O ARG A 73 -2.042 -5.910 -11.609 1.00 0.00 O ATOM 1067 CB ARG A 73 1.177 -6.388 -11.586 1.00 0.00 C ATOM 1068 CG ARG A 73 0.903 -4.897 -11.701 1.00 0.00 C ATOM 1069 CD ARG A 73 2.153 -4.078 -11.418 1.00 0.00 C ATOM 1070 NE ARG A 73 3.042 -4.019 -12.575 1.00 0.00 N ATOM 1071 CZ ARG A 73 3.957 -4.943 -12.847 1.00 0.00 C ATOM 1072 NH1 ARG A 73 4.102 -5.991 -12.049 1.00 0.00 N ATOM 1073 NH2 ARG A 73 4.729 -4.819 -13.919 1.00 0.00 N ATOM 0 H ARG A 73 -1.188 -6.860 -13.528 1.00 0.00 H new ATOM 0 HA ARG A 73 0.131 -8.258 -11.420 1.00 0.00 H new ATOM 0 HB2 ARG A 73 1.588 -6.598 -10.599 1.00 0.00 H new ATOM 0 HB3 ARG A 73 1.939 -6.666 -12.314 1.00 0.00 H new ATOM 0 HG2 ARG A 73 0.536 -4.669 -12.702 1.00 0.00 H new ATOM 0 HG3 ARG A 73 0.116 -4.615 -11.001 1.00 0.00 H new ATOM 0 HD2 ARG A 73 1.866 -3.067 -11.129 1.00 0.00 H new ATOM 0 HD3 ARG A 73 2.687 -4.512 -10.572 1.00 0.00 H new ATOM 0 HE ARG A 73 2.956 -3.225 -13.209 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.510 -6.089 -11.224 1.00 0.00 H new ATOM 0 HH12 ARG A 73 4.805 -6.699 -12.260 1.00 0.00 H new ATOM 0 HH21 ARG A 73 4.620 -4.014 -14.535 1.00 0.00 H new ATOM 0 HH22 ARG A 73 5.431 -5.529 -14.127 1.00 0.00 H new ATOM 1087 N TYR A 74 -1.368 -7.023 -9.774 1.00 0.00 N ATOM 1088 CA TYR A 74 -2.460 -6.532 -8.942 1.00 0.00 C ATOM 1089 C TYR A 74 -2.041 -5.280 -8.177 1.00 0.00 C ATOM 1090 O TYR A 74 -1.284 -5.355 -7.209 1.00 0.00 O ATOM 1091 CB TYR A 74 -2.908 -7.617 -7.960 1.00 0.00 C ATOM 1092 CG TYR A 74 -3.157 -8.958 -8.613 1.00 0.00 C ATOM 1093 CD1 TYR A 74 -3.835 -9.050 -9.821 1.00 0.00 C ATOM 1094 CD2 TYR A 74 -2.713 -10.134 -8.020 1.00 0.00 C ATOM 1095 CE1 TYR A 74 -4.065 -10.273 -10.421 1.00 0.00 C ATOM 1096 CE2 TYR A 74 -2.937 -11.361 -8.612 1.00 0.00 C ATOM 1097 CZ TYR A 74 -3.614 -11.426 -9.813 1.00 0.00 C ATOM 1098 OH TYR A 74 -3.841 -12.647 -10.405 1.00 0.00 O ATOM 0 H TYR A 74 -0.721 -7.649 -9.294 1.00 0.00 H new ATOM 0 HA TYR A 74 -3.294 -6.275 -9.595 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -2.147 -7.734 -7.188 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -3.820 -7.290 -7.461 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -4.189 -8.149 -10.300 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -2.184 -10.087 -7.080 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -4.595 -10.326 -11.361 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -2.584 -12.265 -8.138 1.00 0.00 H new ATOM 0 HH TYR A 74 -3.458 -13.357 -9.848 1.00 0.00 H new ATOM 1108 N ILE A 75 -2.541 -4.131 -8.618 1.00 0.00 N ATOM 1109 CA ILE A 75 -2.221 -2.862 -7.975 1.00 0.00 C ATOM 1110 C ILE A 75 -3.138 -2.603 -6.785 1.00 0.00 C ATOM 1111 O ILE A 75 -4.361 -2.684 -6.900 1.00 0.00 O ATOM 1112 CB ILE A 75 -2.336 -1.686 -8.963 1.00 0.00 C ATOM 1113 CG1 ILE A 75 -1.430 -1.918 -10.173 1.00 0.00 C ATOM 1114 CG2 ILE A 75 -1.981 -0.378 -8.271 1.00 0.00 C ATOM 1115 CD1 ILE A 75 -1.451 -0.781 -11.171 1.00 0.00 C ATOM 0 H ILE A 75 -3.169 -4.052 -9.418 1.00 0.00 H new ATOM 0 HA ILE A 75 -1.190 -2.935 -7.628 1.00 0.00 H new ATOM 0 HB ILE A 75 -3.367 -1.622 -9.312 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.407 -2.068 -9.827 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.735 -2.836 -10.674 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.067 0.444 -8.981 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -2.663 -0.210 -7.438 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.958 -0.430 -7.898 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -0.786 -1.014 -12.002 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.466 -0.644 -11.545 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -1.117 0.136 -10.685 1.00 0.00 H new ATOM 1127 N TYR A 76 -2.539 -2.290 -5.641 1.00 0.00 N ATOM 1128 CA TYR A 76 -3.301 -2.019 -4.428 1.00 0.00 C ATOM 1129 C TYR A 76 -3.499 -0.519 -4.232 1.00 0.00 C ATOM 1130 O TYR A 76 -2.610 0.279 -4.527 1.00 0.00 O ATOM 1131 CB TYR A 76 -2.591 -2.614 -3.211 1.00 0.00 C ATOM 1132 CG TYR A 76 -2.216 -4.069 -3.380 1.00 0.00 C ATOM 1133 CD1 TYR A 76 -0.997 -4.433 -3.937 1.00 0.00 C ATOM 1134 CD2 TYR A 76 -3.082 -5.081 -2.981 1.00 0.00 C ATOM 1135 CE1 TYR A 76 -0.651 -5.762 -4.093 1.00 0.00 C ATOM 1136 CE2 TYR A 76 -2.744 -6.411 -3.132 1.00 0.00 C ATOM 1137 CZ TYR A 76 -1.528 -6.747 -3.689 1.00 0.00 C ATOM 1138 OH TYR A 76 -1.186 -8.071 -3.843 1.00 0.00 O ATOM 0 H TYR A 76 -1.528 -2.218 -5.529 1.00 0.00 H new ATOM 0 HA TYR A 76 -4.280 -2.486 -4.533 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -1.689 -2.036 -3.009 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -3.237 -2.513 -2.339 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -0.308 -3.664 -4.254 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -4.036 -4.822 -2.545 1.00 0.00 H new ATOM 0 HE1 TYR A 76 0.301 -6.028 -4.529 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -3.428 -7.184 -2.816 1.00 0.00 H new ATOM 0 HH TYR A 76 -0.944 -8.450 -2.972 1.00 0.00 H new ATOM 1148 N TYR A 77 -4.672 -0.144 -3.733 1.00 0.00 N ATOM 1149 CA TYR A 77 -4.989 1.259 -3.499 1.00 0.00 C ATOM 1150 C TYR A 77 -5.491 1.474 -2.075 1.00 0.00 C ATOM 1151 O TYR A 77 -6.697 1.474 -1.822 1.00 0.00 O ATOM 1152 CB TYR A 77 -6.040 1.740 -4.501 1.00 0.00 C ATOM 1153 CG TYR A 77 -5.508 1.901 -5.907 1.00 0.00 C ATOM 1154 CD1 TYR A 77 -4.945 3.100 -6.325 1.00 0.00 C ATOM 1155 CD2 TYR A 77 -5.568 0.853 -6.817 1.00 0.00 C ATOM 1156 CE1 TYR A 77 -4.459 3.252 -7.609 1.00 0.00 C ATOM 1157 CE2 TYR A 77 -5.082 0.995 -8.103 1.00 0.00 C ATOM 1158 CZ TYR A 77 -4.529 2.196 -8.494 1.00 0.00 C ATOM 1159 OH TYR A 77 -4.044 2.343 -9.773 1.00 0.00 O ATOM 0 H TYR A 77 -5.419 -0.793 -3.483 1.00 0.00 H new ATOM 0 HA TYR A 77 -4.076 1.839 -3.634 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -6.868 1.032 -4.514 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -6.442 2.695 -4.162 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -4.886 3.928 -5.634 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -6.002 -0.089 -6.514 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -4.027 4.192 -7.918 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -5.135 0.170 -8.798 1.00 0.00 H new ATOM 0 HH TYR A 77 -4.168 1.506 -10.268 1.00 0.00 H new ATOM 1169 N LEU A 78 -4.559 1.657 -1.147 1.00 0.00 N ATOM 1170 CA LEU A 78 -4.905 1.874 0.254 1.00 0.00 C ATOM 1171 C LEU A 78 -5.791 3.106 0.411 1.00 0.00 C ATOM 1172 O LEU A 78 -5.330 4.238 0.262 1.00 0.00 O ATOM 1173 CB LEU A 78 -3.636 2.035 1.094 1.00 0.00 C ATOM 1174 CG LEU A 78 -2.607 0.910 0.977 1.00 0.00 C ATOM 1175 CD1 LEU A 78 -1.255 1.367 1.502 1.00 0.00 C ATOM 1176 CD2 LEU A 78 -3.082 -0.328 1.725 1.00 0.00 C ATOM 0 H LEU A 78 -3.557 1.660 -1.339 1.00 0.00 H new ATOM 0 HA LEU A 78 -5.458 1.003 0.605 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.154 2.972 0.813 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -3.926 2.128 2.141 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.496 0.653 -0.076 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.535 0.553 1.411 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -0.910 2.223 0.922 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.349 1.652 2.550 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -2.337 -1.118 1.631 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -3.222 -0.085 2.778 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -4.027 -0.668 1.302 1.00 0.00 H new ATOM 1188 N ILE A 79 -7.064 2.877 0.714 1.00 0.00 N ATOM 1189 CA ILE A 79 -8.014 3.967 0.895 1.00 0.00 C ATOM 1190 C ILE A 79 -8.177 4.315 2.371 1.00 0.00 C ATOM 1191 O ILE A 79 -8.700 3.521 3.154 1.00 0.00 O ATOM 1192 CB ILE A 79 -9.394 3.616 0.307 1.00 0.00 C ATOM 1193 CG1 ILE A 79 -9.305 3.488 -1.216 1.00 0.00 C ATOM 1194 CG2 ILE A 79 -10.420 4.670 0.696 1.00 0.00 C ATOM 1195 CD1 ILE A 79 -10.300 2.509 -1.798 1.00 0.00 C ATOM 0 H ILE A 79 -7.461 1.946 0.839 1.00 0.00 H new ATOM 0 HA ILE A 79 -7.610 4.828 0.363 1.00 0.00 H new ATOM 0 HB ILE A 79 -9.714 2.658 0.716 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -9.466 4.468 -1.665 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -8.297 3.175 -1.488 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -11.390 4.408 0.273 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -10.499 4.718 1.782 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -10.108 5.641 0.312 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -10.180 2.469 -2.881 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -10.125 1.519 -1.377 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -11.313 2.832 -1.557 1.00 0.00 H new ATOM 1207 N THR A 80 -7.729 5.509 2.745 1.00 0.00 N ATOM 1208 CA THR A 80 -7.825 5.964 4.126 1.00 0.00 C ATOM 1209 C THR A 80 -8.720 7.193 4.240 1.00 0.00 C ATOM 1210 O THR A 80 -9.486 7.330 5.193 1.00 0.00 O ATOM 1211 CB THR A 80 -6.438 6.297 4.706 1.00 0.00 C ATOM 1212 OG1 THR A 80 -5.775 7.253 3.871 1.00 0.00 O ATOM 1213 CG2 THR A 80 -5.585 5.043 4.826 1.00 0.00 C ATOM 0 H THR A 80 -7.296 6.179 2.110 1.00 0.00 H new ATOM 0 HA THR A 80 -8.262 5.146 4.698 1.00 0.00 H new ATOM 0 HB THR A 80 -6.577 6.718 5.702 1.00 0.00 H new ATOM 0 HG1 THR A 80 -4.894 7.461 4.247 1.00 0.00 H new ATOM 0 HG21 THR A 80 -4.610 5.304 5.238 1.00 0.00 H new ATOM 0 HG22 THR A 80 -6.078 4.329 5.486 1.00 0.00 H new ATOM 0 HG23 THR A 80 -5.454 4.596 3.840 1.00 0.00 H new ATOM 1221 N LYS A 81 -8.617 8.085 3.261 1.00 0.00 N ATOM 1222 CA LYS A 81 -9.419 9.304 3.249 1.00 0.00 C ATOM 1223 C LYS A 81 -10.338 9.338 2.032 1.00 0.00 C ATOM 1224 O LYS A 81 -10.028 8.761 0.990 1.00 0.00 O ATOM 1225 CB LYS A 81 -8.511 10.536 3.250 1.00 0.00 C ATOM 1226 CG LYS A 81 -7.714 10.705 1.968 1.00 0.00 C ATOM 1227 CD LYS A 81 -7.434 12.170 1.675 1.00 0.00 C ATOM 1228 CE LYS A 81 -6.127 12.346 0.917 1.00 0.00 C ATOM 1229 NZ LYS A 81 -6.308 12.163 -0.550 1.00 0.00 N ATOM 0 H LYS A 81 -7.986 7.987 2.465 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.035 9.313 4.148 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.120 11.426 3.409 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -7.821 10.468 4.091 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -6.772 10.163 2.050 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -8.264 10.265 1.136 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -8.254 12.589 1.091 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -7.391 12.728 2.611 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.725 13.340 1.112 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -5.394 11.628 1.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -5.475 12.533 -1.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -6.419 11.151 -0.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -7.157 12.677 -0.862 1.00 0.00 H new ATOM 1243 N LYS A 82 -11.471 10.019 2.171 1.00 0.00 N ATOM 1244 CA LYS A 82 -12.435 10.131 1.083 1.00 0.00 C ATOM 1245 C LYS A 82 -12.030 11.233 0.109 1.00 0.00 C ATOM 1246 O LYS A 82 -12.030 11.031 -1.106 1.00 0.00 O ATOM 1247 CB LYS A 82 -13.832 10.417 1.640 1.00 0.00 C ATOM 1248 CG LYS A 82 -14.322 9.367 2.621 1.00 0.00 C ATOM 1249 CD LYS A 82 -15.324 9.947 3.604 1.00 0.00 C ATOM 1250 CE LYS A 82 -15.926 8.867 4.490 1.00 0.00 C ATOM 1251 NZ LYS A 82 -15.040 8.533 5.639 1.00 0.00 N ATOM 0 H LYS A 82 -11.744 10.502 3.027 1.00 0.00 H new ATOM 0 HA LYS A 82 -12.451 9.183 0.546 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -13.825 11.389 2.134 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -14.537 10.486 0.812 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -14.782 8.544 2.074 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -13.474 8.953 3.166 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -14.834 10.697 4.225 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -16.118 10.455 3.058 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -16.894 9.202 4.863 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -16.106 7.970 3.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -15.486 7.793 6.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -14.125 8.189 5.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -14.889 9.383 6.219 1.00 0.00 H new ATOM 1265 N ARG A 83 -11.683 12.396 0.649 1.00 0.00 N ATOM 1266 CA ARG A 83 -11.275 13.529 -0.173 1.00 0.00 C ATOM 1267 C ARG A 83 -10.342 14.455 0.601 1.00 0.00 C ATOM 1268 O ARG A 83 -10.281 14.406 1.829 1.00 0.00 O ATOM 1269 CB ARG A 83 -12.502 14.307 -0.652 1.00 0.00 C ATOM 1270 CG ARG A 83 -13.352 14.860 0.481 1.00 0.00 C ATOM 1271 CD ARG A 83 -14.499 15.708 -0.047 1.00 0.00 C ATOM 1272 NE ARG A 83 -15.468 14.913 -0.795 1.00 0.00 N ATOM 1273 CZ ARG A 83 -15.362 14.656 -2.094 1.00 0.00 C ATOM 1274 NH1 ARG A 83 -14.335 15.130 -2.785 1.00 0.00 N ATOM 1275 NH2 ARG A 83 -16.286 13.924 -2.705 1.00 0.00 N ATOM 0 H ARG A 83 -11.676 12.579 1.652 1.00 0.00 H new ATOM 0 HA ARG A 83 -10.738 13.142 -1.039 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -12.175 15.131 -1.285 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -13.117 13.654 -1.271 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -13.750 14.037 1.074 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -12.730 15.460 1.145 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -15.000 16.200 0.787 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -14.103 16.495 -0.689 1.00 0.00 H new ATOM 0 HE ARG A 83 -16.271 14.534 -0.293 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -13.624 15.694 -2.319 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -14.256 14.931 -3.782 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -17.078 13.558 -2.177 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -16.203 13.727 -3.702 1.00 0.00 H new ATOM 1289 N ALA A 84 -9.616 15.298 -0.126 1.00 0.00 N ATOM 1290 CA ALA A 84 -8.687 16.236 0.493 1.00 0.00 C ATOM 1291 C ALA A 84 -9.263 16.807 1.785 1.00 0.00 C ATOM 1292 O ALA A 84 -8.653 16.699 2.848 1.00 0.00 O ATOM 1293 CB ALA A 84 -8.347 17.358 -0.476 1.00 0.00 C ATOM 0 H ALA A 84 -9.653 15.351 -1.144 1.00 0.00 H new ATOM 0 HA ALA A 84 -7.774 15.695 0.741 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -7.653 18.051 -0.001 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -7.886 16.939 -1.371 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -9.258 17.889 -0.752 1.00 0.00 H new ATOM 1299 N SER A 85 -10.440 17.416 1.684 1.00 0.00 N ATOM 1300 CA SER A 85 -11.096 18.008 2.845 1.00 0.00 C ATOM 1301 C SER A 85 -10.867 17.158 4.091 1.00 0.00 C ATOM 1302 O SER A 85 -10.558 17.678 5.163 1.00 0.00 O ATOM 1303 CB SER A 85 -12.596 18.161 2.586 1.00 0.00 C ATOM 1304 OG SER A 85 -12.887 19.419 2.002 1.00 0.00 O ATOM 0 H SER A 85 -10.959 17.513 0.811 1.00 0.00 H new ATOM 0 HA SER A 85 -10.661 18.993 3.014 1.00 0.00 H new ATOM 0 HB2 SER A 85 -12.938 17.363 1.927 1.00 0.00 H new ATOM 0 HB3 SER A 85 -13.143 18.056 3.523 1.00 0.00 H new ATOM 0 HG SER A 85 -13.852 19.491 1.845 1.00 0.00 H new ATOM 1310 N HIS A 86 -11.022 15.846 3.941 1.00 0.00 N ATOM 1311 CA HIS A 86 -10.832 14.922 5.053 1.00 0.00 C ATOM 1312 C HIS A 86 -9.452 14.273 4.991 1.00 0.00 C ATOM 1313 O HIS A 86 -9.032 13.783 3.942 1.00 0.00 O ATOM 1314 CB HIS A 86 -11.917 13.844 5.040 1.00 0.00 C ATOM 1315 CG HIS A 86 -13.245 14.338 4.554 1.00 0.00 C ATOM 1316 ND1 HIS A 86 -13.824 13.907 3.380 1.00 0.00 N ATOM 1317 CD2 HIS A 86 -14.109 15.230 5.093 1.00 0.00 C ATOM 1318 CE1 HIS A 86 -14.986 14.514 3.216 1.00 0.00 C ATOM 1319 NE2 HIS A 86 -15.183 15.321 4.242 1.00 0.00 N ATOM 0 H HIS A 86 -11.279 15.399 3.061 1.00 0.00 H new ATOM 0 HA HIS A 86 -10.906 15.489 5.981 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -11.591 13.019 4.406 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -12.033 13.445 6.048 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -13.978 15.769 6.019 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -15.660 14.374 2.384 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -16.000 15.916 4.380 1.00 0.00 H new ATOM 1327 N LYS A 87 -8.752 14.273 6.120 1.00 0.00 N ATOM 1328 CA LYS A 87 -7.420 13.684 6.195 1.00 0.00 C ATOM 1329 C LYS A 87 -7.453 12.360 6.951 1.00 0.00 C ATOM 1330 O LYS A 87 -8.224 12.174 7.893 1.00 0.00 O ATOM 1331 CB LYS A 87 -6.451 14.651 6.879 1.00 0.00 C ATOM 1332 CG LYS A 87 -6.560 16.080 6.376 1.00 0.00 C ATOM 1333 CD LYS A 87 -6.614 16.134 4.858 1.00 0.00 C ATOM 1334 CE LYS A 87 -5.280 15.746 4.239 1.00 0.00 C ATOM 1335 NZ LYS A 87 -4.200 16.706 4.601 1.00 0.00 N ATOM 0 H LYS A 87 -9.085 14.675 6.996 1.00 0.00 H new ATOM 0 HA LYS A 87 -7.076 13.493 5.179 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -6.636 14.638 7.953 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.431 14.298 6.727 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -7.455 16.545 6.790 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -5.707 16.658 6.732 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -7.393 15.463 4.496 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -6.886 17.140 4.538 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -5.003 14.746 4.571 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -5.381 15.705 3.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -3.404 16.598 3.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -4.566 17.678 4.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -3.875 16.513 5.570 1.00 0.00 H new ATOM 1349 N PRO A 88 -6.596 11.417 6.533 1.00 0.00 N ATOM 1350 CA PRO A 88 -6.506 10.094 7.159 1.00 0.00 C ATOM 1351 C PRO A 88 -5.907 10.155 8.559 1.00 0.00 C ATOM 1352 O PRO A 88 -5.434 11.204 8.999 1.00 0.00 O ATOM 1353 CB PRO A 88 -5.584 9.317 6.216 1.00 0.00 C ATOM 1354 CG PRO A 88 -4.761 10.362 5.545 1.00 0.00 C ATOM 1355 CD PRO A 88 -5.648 11.569 5.416 1.00 0.00 C ATOM 0 HA PRO A 88 -7.487 9.637 7.290 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -4.959 8.613 6.765 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -6.156 8.738 5.491 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -3.871 10.593 6.130 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -4.420 10.022 4.567 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -5.079 12.496 5.495 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -6.160 11.590 4.454 1.00 0.00 H new ATOM 1363 N THR A 89 -5.930 9.024 9.258 1.00 0.00 N ATOM 1364 CA THR A 89 -5.390 8.950 10.609 1.00 0.00 C ATOM 1365 C THR A 89 -4.676 7.623 10.844 1.00 0.00 C ATOM 1366 O THR A 89 -5.168 6.565 10.451 1.00 0.00 O ATOM 1367 CB THR A 89 -6.497 9.118 11.667 1.00 0.00 C ATOM 1368 OG1 THR A 89 -7.636 8.325 11.315 1.00 0.00 O ATOM 1369 CG2 THR A 89 -6.908 10.577 11.793 1.00 0.00 C ATOM 0 H THR A 89 -6.317 8.147 8.910 1.00 0.00 H new ATOM 0 HA THR A 89 -4.675 9.767 10.708 1.00 0.00 H new ATOM 0 HB THR A 89 -6.105 8.783 12.627 1.00 0.00 H new ATOM 0 HG1 THR A 89 -8.334 8.436 11.993 1.00 0.00 H new ATOM 0 HG21 THR A 89 -7.691 10.671 12.546 1.00 0.00 H new ATOM 0 HG22 THR A 89 -6.045 11.174 12.090 1.00 0.00 H new ATOM 0 HG23 THR A 89 -7.283 10.934 10.834 1.00 0.00 H new ATOM 1377 N TYR A 90 -3.516 7.687 11.486 1.00 0.00 N ATOM 1378 CA TYR A 90 -2.733 6.490 11.772 1.00 0.00 C ATOM 1379 C TYR A 90 -3.644 5.303 12.071 1.00 0.00 C ATOM 1380 O TYR A 90 -3.348 4.170 11.694 1.00 0.00 O ATOM 1381 CB TYR A 90 -1.795 6.738 12.954 1.00 0.00 C ATOM 1382 CG TYR A 90 -0.711 7.752 12.664 1.00 0.00 C ATOM 1383 CD1 TYR A 90 -0.031 7.744 11.452 1.00 0.00 C ATOM 1384 CD2 TYR A 90 -0.369 8.719 13.601 1.00 0.00 C ATOM 1385 CE1 TYR A 90 0.960 8.668 11.184 1.00 0.00 C ATOM 1386 CE2 TYR A 90 0.620 9.648 13.340 1.00 0.00 C ATOM 1387 CZ TYR A 90 1.282 9.618 12.131 1.00 0.00 C ATOM 1388 OH TYR A 90 2.268 10.541 11.866 1.00 0.00 O ATOM 0 H TYR A 90 -3.096 8.555 11.819 1.00 0.00 H new ATOM 0 HA TYR A 90 -2.138 6.256 10.889 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -2.381 7.079 13.807 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.331 5.795 13.243 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.282 7.003 10.707 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -0.885 8.745 14.549 1.00 0.00 H new ATOM 0 HE1 TYR A 90 1.480 8.647 10.238 1.00 0.00 H new ATOM 0 HE2 TYR A 90 0.873 10.394 14.079 1.00 0.00 H new ATOM 0 HH TYR A 90 2.371 11.139 12.635 1.00 0.00 H new ATOM 1398 N GLU A 91 -4.753 5.573 12.753 1.00 0.00 N ATOM 1399 CA GLU A 91 -5.707 4.527 13.103 1.00 0.00 C ATOM 1400 C GLU A 91 -6.243 3.838 11.852 1.00 0.00 C ATOM 1401 O GLU A 91 -6.200 2.614 11.739 1.00 0.00 O ATOM 1402 CB GLU A 91 -6.866 5.114 13.912 1.00 0.00 C ATOM 1403 CG GLU A 91 -7.914 4.087 14.306 1.00 0.00 C ATOM 1404 CD GLU A 91 -7.620 3.436 15.643 1.00 0.00 C ATOM 1405 OE1 GLU A 91 -6.427 3.312 15.992 1.00 0.00 O ATOM 1406 OE2 GLU A 91 -8.581 3.050 16.341 1.00 0.00 O ATOM 0 H GLU A 91 -5.013 6.506 13.074 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.188 3.785 13.710 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.469 5.580 14.814 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -7.343 5.902 13.329 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -8.891 4.568 14.348 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -7.970 3.317 13.536 1.00 0.00 H new ATOM 1413 N ASN A 92 -6.748 4.634 10.915 1.00 0.00 N ATOM 1414 CA ASN A 92 -7.294 4.101 9.672 1.00 0.00 C ATOM 1415 C ASN A 92 -6.207 3.416 8.850 1.00 0.00 C ATOM 1416 O ASN A 92 -6.358 2.266 8.436 1.00 0.00 O ATOM 1417 CB ASN A 92 -7.939 5.221 8.853 1.00 0.00 C ATOM 1418 CG ASN A 92 -9.270 5.666 9.429 1.00 0.00 C ATOM 1419 OD1 ASN A 92 -9.915 4.927 10.173 1.00 0.00 O ATOM 1420 ND2 ASN A 92 -9.686 6.880 9.087 1.00 0.00 N ATOM 0 H ASN A 92 -6.790 5.650 10.993 1.00 0.00 H new ATOM 0 HA ASN A 92 -8.053 3.361 9.925 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -7.261 6.074 8.811 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -8.086 4.880 7.828 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -10.573 7.234 9.444 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -9.118 7.458 8.467 1.00 0.00 H new ATOM 1427 N LEU A 93 -5.111 4.129 8.618 1.00 0.00 N ATOM 1428 CA LEU A 93 -3.996 3.591 7.846 1.00 0.00 C ATOM 1429 C LEU A 93 -3.732 2.134 8.214 1.00 0.00 C ATOM 1430 O LEU A 93 -3.761 1.253 7.356 1.00 0.00 O ATOM 1431 CB LEU A 93 -2.736 4.425 8.082 1.00 0.00 C ATOM 1432 CG LEU A 93 -1.426 3.818 7.580 1.00 0.00 C ATOM 1433 CD1 LEU A 93 -1.334 3.923 6.065 1.00 0.00 C ATOM 1434 CD2 LEU A 93 -0.235 4.501 8.237 1.00 0.00 C ATOM 0 H LEU A 93 -4.970 5.082 8.954 1.00 0.00 H new ATOM 0 HA LEU A 93 -4.262 3.638 6.790 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.871 5.395 7.603 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -2.641 4.609 9.152 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.410 2.763 7.852 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.395 3.486 5.726 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -2.168 3.387 5.612 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.373 4.972 5.770 1.00 0.00 H new ATOM 0 HD21 LEU A 93 0.689 4.056 7.868 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.247 5.564 7.997 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.293 4.373 9.318 1.00 0.00 H new ATOM 1446 N GLN A 94 -3.478 1.890 9.496 1.00 0.00 N ATOM 1447 CA GLN A 94 -3.210 0.540 9.978 1.00 0.00 C ATOM 1448 C GLN A 94 -4.152 -0.467 9.326 1.00 0.00 C ATOM 1449 O GLN A 94 -3.713 -1.469 8.761 1.00 0.00 O ATOM 1450 CB GLN A 94 -3.355 0.481 11.499 1.00 0.00 C ATOM 1451 CG GLN A 94 -2.497 -0.592 12.150 1.00 0.00 C ATOM 1452 CD GLN A 94 -3.078 -1.089 13.459 1.00 0.00 C ATOM 1453 OE1 GLN A 94 -3.492 -0.299 14.308 1.00 0.00 O ATOM 1454 NE2 GLN A 94 -3.113 -2.406 13.629 1.00 0.00 N ATOM 0 H GLN A 94 -3.452 2.609 10.219 1.00 0.00 H new ATOM 0 HA GLN A 94 -2.186 0.281 9.708 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -3.090 1.451 11.919 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -4.400 0.300 11.749 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -2.388 -1.431 11.463 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -1.498 -0.194 12.328 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -2.759 -3.024 12.899 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -3.494 -2.799 14.490 1.00 0.00 H new ATOM 1463 N LYS A 95 -5.450 -0.194 9.408 1.00 0.00 N ATOM 1464 CA LYS A 95 -6.456 -1.075 8.826 1.00 0.00 C ATOM 1465 C LYS A 95 -6.191 -1.296 7.340 1.00 0.00 C ATOM 1466 O LYS A 95 -6.072 -2.433 6.883 1.00 0.00 O ATOM 1467 CB LYS A 95 -7.855 -0.487 9.024 1.00 0.00 C ATOM 1468 CG LYS A 95 -8.198 -0.211 10.477 1.00 0.00 C ATOM 1469 CD LYS A 95 -8.642 -1.474 11.195 1.00 0.00 C ATOM 1470 CE LYS A 95 -8.594 -1.303 12.706 1.00 0.00 C ATOM 1471 NZ LYS A 95 -9.500 -2.258 13.402 1.00 0.00 N ATOM 0 H LYS A 95 -5.830 0.631 9.872 1.00 0.00 H new ATOM 0 HA LYS A 95 -6.398 -2.037 9.334 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -7.933 0.441 8.458 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -8.591 -1.176 8.610 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -7.329 0.210 10.983 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -8.990 0.536 10.529 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -9.656 -1.730 10.889 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -8.001 -2.305 10.901 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -7.572 -1.451 13.056 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -8.875 -0.282 12.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -9.438 -2.109 14.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -10.479 -2.100 13.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -9.217 -3.233 13.176 1.00 0.00 H new ATOM 1485 N SER A 96 -6.099 -0.202 6.591 1.00 0.00 N ATOM 1486 CA SER A 96 -5.850 -0.276 5.156 1.00 0.00 C ATOM 1487 C SER A 96 -4.761 -1.299 4.846 1.00 0.00 C ATOM 1488 O SER A 96 -4.888 -2.095 3.914 1.00 0.00 O ATOM 1489 CB SER A 96 -5.445 1.096 4.615 1.00 0.00 C ATOM 1490 OG SER A 96 -4.086 1.377 4.902 1.00 0.00 O ATOM 0 H SER A 96 -6.193 0.747 6.954 1.00 0.00 H new ATOM 0 HA SER A 96 -6.772 -0.593 4.668 1.00 0.00 H new ATOM 0 HB2 SER A 96 -5.606 1.127 3.537 1.00 0.00 H new ATOM 0 HB3 SER A 96 -6.079 1.866 5.055 1.00 0.00 H new ATOM 0 HG SER A 96 -4.001 1.662 5.836 1.00 0.00 H new ATOM 1496 N LEU A 97 -3.692 -1.272 5.633 1.00 0.00 N ATOM 1497 CA LEU A 97 -2.579 -2.196 5.444 1.00 0.00 C ATOM 1498 C LEU A 97 -3.020 -3.636 5.686 1.00 0.00 C ATOM 1499 O LEU A 97 -2.608 -4.550 4.972 1.00 0.00 O ATOM 1500 CB LEU A 97 -1.427 -1.838 6.384 1.00 0.00 C ATOM 1501 CG LEU A 97 -0.713 -0.517 6.098 1.00 0.00 C ATOM 1502 CD1 LEU A 97 0.182 -0.130 7.266 1.00 0.00 C ATOM 1503 CD2 LEU A 97 0.096 -0.615 4.813 1.00 0.00 C ATOM 0 H LEU A 97 -3.572 -0.620 6.408 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.238 -2.108 4.413 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -1.813 -1.806 7.403 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.691 -2.641 6.347 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.466 0.261 5.971 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.682 0.813 7.044 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.423 -0.017 8.166 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.929 -0.908 7.426 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.597 0.335 4.625 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.840 -1.405 4.911 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.569 -0.845 3.981 1.00 0.00 H new ATOM 1515 N GLU A 98 -3.861 -3.830 6.697 1.00 0.00 N ATOM 1516 CA GLU A 98 -4.359 -5.159 7.032 1.00 0.00 C ATOM 1517 C GLU A 98 -5.230 -5.713 5.909 1.00 0.00 C ATOM 1518 O GLU A 98 -5.179 -6.903 5.599 1.00 0.00 O ATOM 1519 CB GLU A 98 -5.157 -5.115 8.337 1.00 0.00 C ATOM 1520 CG GLU A 98 -4.295 -5.230 9.583 1.00 0.00 C ATOM 1521 CD GLU A 98 -5.023 -5.893 10.736 1.00 0.00 C ATOM 1522 OE1 GLU A 98 -6.195 -5.537 10.980 1.00 0.00 O ATOM 1523 OE2 GLU A 98 -4.421 -6.765 11.396 1.00 0.00 O ATOM 0 H GLU A 98 -4.212 -3.084 7.298 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.501 -5.818 7.161 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -5.718 -4.181 8.379 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -5.886 -5.925 8.334 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -3.397 -5.802 9.348 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -3.969 -4.236 9.888 1.00 0.00 H new ATOM 1530 N ALA A 99 -6.029 -4.841 5.302 1.00 0.00 N ATOM 1531 CA ALA A 99 -6.910 -5.242 4.212 1.00 0.00 C ATOM 1532 C ALA A 99 -6.110 -5.614 2.969 1.00 0.00 C ATOM 1533 O ALA A 99 -6.456 -6.556 2.256 1.00 0.00 O ATOM 1534 CB ALA A 99 -7.896 -4.127 3.894 1.00 0.00 C ATOM 0 H ALA A 99 -6.084 -3.852 5.547 1.00 0.00 H new ATOM 0 HA ALA A 99 -7.466 -6.124 4.531 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -8.548 -4.440 3.078 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -8.498 -3.911 4.777 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.350 -3.231 3.599 1.00 0.00 H new ATOM 1540 N MET A 100 -5.040 -4.869 2.714 1.00 0.00 N ATOM 1541 CA MET A 100 -4.191 -5.122 1.555 1.00 0.00 C ATOM 1542 C MET A 100 -3.577 -6.517 1.626 1.00 0.00 C ATOM 1543 O MET A 100 -3.915 -7.396 0.834 1.00 0.00 O ATOM 1544 CB MET A 100 -3.084 -4.069 1.467 1.00 0.00 C ATOM 1545 CG MET A 100 -2.033 -4.379 0.413 1.00 0.00 C ATOM 1546 SD MET A 100 -0.822 -3.056 0.231 1.00 0.00 S ATOM 1547 CE MET A 100 -0.042 -3.087 1.843 1.00 0.00 C ATOM 0 H MET A 100 -4.740 -4.085 3.294 1.00 0.00 H new ATOM 0 HA MET A 100 -4.812 -5.062 0.661 1.00 0.00 H new ATOM 0 HB2 MET A 100 -3.532 -3.100 1.247 1.00 0.00 H new ATOM 0 HB3 MET A 100 -2.598 -3.983 2.439 1.00 0.00 H new ATOM 0 HG2 MET A 100 -1.519 -5.303 0.678 1.00 0.00 H new ATOM 0 HG3 MET A 100 -2.524 -4.551 -0.545 1.00 0.00 H new ATOM 0 HE1 MET A 100 0.916 -2.569 1.794 1.00 0.00 H new ATOM 0 HE2 MET A 100 -0.686 -2.590 2.568 1.00 0.00 H new ATOM 0 HE3 MET A 100 0.119 -4.121 2.149 1.00 0.00 H new ATOM 1557 N LYS A 101 -2.672 -6.712 2.580 1.00 0.00 N ATOM 1558 CA LYS A 101 -2.011 -8.000 2.755 1.00 0.00 C ATOM 1559 C LYS A 101 -3.004 -9.147 2.598 1.00 0.00 C ATOM 1560 O LYS A 101 -2.732 -10.126 1.902 1.00 0.00 O ATOM 1561 CB LYS A 101 -1.346 -8.072 4.132 1.00 0.00 C ATOM 1562 CG LYS A 101 -2.310 -7.850 5.285 1.00 0.00 C ATOM 1563 CD LYS A 101 -1.573 -7.689 6.604 1.00 0.00 C ATOM 1564 CE LYS A 101 -2.412 -8.180 7.774 1.00 0.00 C ATOM 1565 NZ LYS A 101 -2.363 -9.663 7.908 1.00 0.00 N ATOM 0 H LYS A 101 -2.380 -5.994 3.243 1.00 0.00 H new ATOM 0 HA LYS A 101 -1.247 -8.096 1.983 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -0.873 -9.047 4.247 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -0.553 -7.325 4.183 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -2.911 -6.961 5.092 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -2.999 -8.692 5.352 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -0.636 -8.244 6.569 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -1.317 -6.640 6.753 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -2.055 -7.720 8.695 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -3.446 -7.861 7.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -2.947 -9.958 8.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -2.728 -10.102 7.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -1.380 -9.965 8.063 1.00 0.00 H new ATOM 1579 N SER A 102 -4.156 -9.020 3.248 1.00 0.00 N ATOM 1580 CA SER A 102 -5.189 -10.048 3.182 1.00 0.00 C ATOM 1581 C SER A 102 -5.309 -10.607 1.768 1.00 0.00 C ATOM 1582 O SER A 102 -5.421 -11.818 1.574 1.00 0.00 O ATOM 1583 CB SER A 102 -6.535 -9.477 3.633 1.00 0.00 C ATOM 1584 OG SER A 102 -7.512 -10.499 3.738 1.00 0.00 O ATOM 0 H SER A 102 -4.398 -8.216 3.827 1.00 0.00 H new ATOM 0 HA SER A 102 -4.904 -10.859 3.852 1.00 0.00 H new ATOM 0 HB2 SER A 102 -6.419 -8.980 4.596 1.00 0.00 H new ATOM 0 HB3 SER A 102 -6.870 -8.721 2.923 1.00 0.00 H new ATOM 0 HG SER A 102 -8.363 -10.110 4.029 1.00 0.00 H new ATOM 1590 N HIS A 103 -5.285 -9.716 0.782 1.00 0.00 N ATOM 1591 CA HIS A 103 -5.391 -10.119 -0.616 1.00 0.00 C ATOM 1592 C HIS A 103 -4.184 -10.956 -1.032 1.00 0.00 C ATOM 1593 O HIS A 103 -4.334 -12.059 -1.559 1.00 0.00 O ATOM 1594 CB HIS A 103 -5.508 -8.889 -1.516 1.00 0.00 C ATOM 1595 CG HIS A 103 -5.222 -9.173 -2.959 1.00 0.00 C ATOM 1596 ND1 HIS A 103 -6.164 -9.031 -3.955 1.00 0.00 N ATOM 1597 CD2 HIS A 103 -4.089 -9.591 -3.570 1.00 0.00 C ATOM 1598 CE1 HIS A 103 -5.624 -9.352 -5.118 1.00 0.00 C ATOM 1599 NE2 HIS A 103 -4.365 -9.694 -4.912 1.00 0.00 N ATOM 0 H HIS A 103 -5.193 -8.710 0.925 1.00 0.00 H new ATOM 0 HA HIS A 103 -6.289 -10.727 -0.727 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -6.514 -8.479 -1.427 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -4.819 -8.123 -1.161 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -3.144 -9.804 -3.092 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -6.127 -9.337 -6.074 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -3.705 -9.987 -5.632 1.00 0.00 H new ATOM 1607 N CYS A 104 -2.991 -10.423 -0.795 1.00 0.00 N ATOM 1608 CA CYS A 104 -1.759 -11.120 -1.147 1.00 0.00 C ATOM 1609 C CYS A 104 -1.882 -12.615 -0.870 1.00 0.00 C ATOM 1610 O CYS A 104 -1.778 -13.436 -1.782 1.00 0.00 O ATOM 1611 CB CYS A 104 -0.579 -10.540 -0.365 1.00 0.00 C ATOM 1612 SG CYS A 104 -0.467 -8.736 -0.429 1.00 0.00 S ATOM 0 H CYS A 104 -2.850 -9.511 -0.361 1.00 0.00 H new ATOM 0 HA CYS A 104 -1.583 -10.979 -2.214 1.00 0.00 H new ATOM 0 HB2 CYS A 104 -0.659 -10.852 0.676 1.00 0.00 H new ATOM 0 HB3 CYS A 104 0.346 -10.965 -0.755 1.00 0.00 H new ATOM 0 HG CYS A 104 0.778 -8.375 -0.332 1.00 0.00 H new ATOM 1618 N LEU A 105 -2.101 -12.961 0.393 1.00 0.00 N ATOM 1619 CA LEU A 105 -2.236 -14.358 0.791 1.00 0.00 C ATOM 1620 C LEU A 105 -3.394 -15.024 0.055 1.00 0.00 C ATOM 1621 O LEU A 105 -3.225 -16.069 -0.575 1.00 0.00 O ATOM 1622 CB LEU A 105 -2.451 -14.460 2.302 1.00 0.00 C ATOM 1623 CG LEU A 105 -1.531 -13.602 3.170 1.00 0.00 C ATOM 1624 CD1 LEU A 105 -2.148 -12.234 3.413 1.00 0.00 C ATOM 1625 CD2 LEU A 105 -1.241 -14.300 4.491 1.00 0.00 C ATOM 0 H LEU A 105 -2.189 -12.294 1.159 1.00 0.00 H new ATOM 0 HA LEU A 105 -1.315 -14.876 0.526 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -3.483 -14.187 2.521 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -2.328 -15.502 2.597 1.00 0.00 H new ATOM 0 HG LEU A 105 -0.589 -13.463 2.640 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.478 -11.638 4.033 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.304 -11.730 2.459 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.105 -12.352 3.922 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -0.585 -13.675 5.096 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.176 -14.469 5.026 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.755 -15.256 4.298 1.00 0.00 H new ATOM 1637 N LYS A 106 -4.571 -14.413 0.137 1.00 0.00 N ATOM 1638 CA LYS A 106 -5.757 -14.943 -0.524 1.00 0.00 C ATOM 1639 C LYS A 106 -5.428 -15.415 -1.937 1.00 0.00 C ATOM 1640 O LYS A 106 -5.758 -16.537 -2.318 1.00 0.00 O ATOM 1641 CB LYS A 106 -6.857 -13.880 -0.573 1.00 0.00 C ATOM 1642 CG LYS A 106 -7.611 -13.724 0.736 1.00 0.00 C ATOM 1643 CD LYS A 106 -8.595 -12.568 0.679 1.00 0.00 C ATOM 1644 CE LYS A 106 -9.865 -12.952 -0.066 1.00 0.00 C ATOM 1645 NZ LYS A 106 -10.948 -11.950 0.132 1.00 0.00 N ATOM 0 H LYS A 106 -4.729 -13.549 0.656 1.00 0.00 H new ATOM 0 HA LYS A 106 -6.112 -15.798 0.052 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -6.413 -12.922 -0.843 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -7.564 -14.137 -1.362 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -8.145 -14.647 0.961 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -6.902 -13.560 1.548 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -8.847 -12.253 1.692 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -8.127 -11.715 0.187 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -9.648 -13.046 -1.130 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -10.206 -13.929 0.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -11.796 -12.248 -0.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -11.173 -11.878 1.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -10.632 -11.023 -0.219 1.00 0.00 H new ATOM 1659 N ASN A 107 -4.776 -14.551 -2.707 1.00 0.00 N ATOM 1660 CA ASN A 107 -4.401 -14.880 -4.078 1.00 0.00 C ATOM 1661 C ASN A 107 -3.079 -15.641 -4.112 1.00 0.00 C ATOM 1662 O ASN A 107 -3.037 -16.818 -4.466 1.00 0.00 O ATOM 1663 CB ASN A 107 -4.293 -13.607 -4.919 1.00 0.00 C ATOM 1664 CG ASN A 107 -5.617 -12.878 -5.037 1.00 0.00 C ATOM 1665 OD1 ASN A 107 -6.288 -12.949 -6.067 1.00 0.00 O ATOM 1666 ND2 ASN A 107 -6.000 -12.171 -3.980 1.00 0.00 N ATOM 0 H ASN A 107 -4.496 -13.618 -2.406 1.00 0.00 H new ATOM 0 HA ASN A 107 -5.178 -15.519 -4.498 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.554 -12.942 -4.473 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -3.932 -13.863 -5.915 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -6.882 -11.659 -4.001 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -5.412 -12.140 -3.147 1.00 0.00 H new ATOM 1673 N GLY A 108 -2.000 -14.958 -3.742 1.00 0.00 N ATOM 1674 CA GLY A 108 -0.691 -15.584 -3.738 1.00 0.00 C ATOM 1675 C GLY A 108 0.416 -14.617 -4.109 1.00 0.00 C ATOM 1676 O GLY A 108 1.228 -14.900 -4.990 1.00 0.00 O ATOM 0 H GLY A 108 -2.009 -13.982 -3.445 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -0.492 -15.997 -2.749 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -0.689 -16.419 -4.438 1.00 0.00 H new ATOM 1680 N VAL A 109 0.449 -13.471 -3.437 1.00 0.00 N ATOM 1681 CA VAL A 109 1.464 -12.458 -3.701 1.00 0.00 C ATOM 1682 C VAL A 109 2.526 -12.446 -2.608 1.00 0.00 C ATOM 1683 O VAL A 109 2.209 -12.399 -1.418 1.00 0.00 O ATOM 1684 CB VAL A 109 0.841 -11.054 -3.811 1.00 0.00 C ATOM 1685 CG1 VAL A 109 1.909 -10.019 -4.130 1.00 0.00 C ATOM 1686 CG2 VAL A 109 -0.258 -11.041 -4.864 1.00 0.00 C ATOM 0 H VAL A 109 -0.216 -13.221 -2.705 1.00 0.00 H new ATOM 0 HA VAL A 109 1.929 -12.717 -4.652 1.00 0.00 H new ATOM 0 HB VAL A 109 0.396 -10.796 -2.850 1.00 0.00 H new ATOM 0 HG11 VAL A 109 1.450 -9.033 -4.204 1.00 0.00 H new ATOM 0 HG12 VAL A 109 2.657 -10.012 -3.338 1.00 0.00 H new ATOM 0 HG13 VAL A 109 2.386 -10.269 -5.078 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -0.688 -10.041 -4.929 1.00 0.00 H new ATOM 0 HG22 VAL A 109 0.161 -11.319 -5.831 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -1.036 -11.753 -4.587 1.00 0.00 H new ATOM 1696 N THR A 110 3.790 -12.489 -3.017 1.00 0.00 N ATOM 1697 CA THR A 110 4.900 -12.484 -2.073 1.00 0.00 C ATOM 1698 C THR A 110 5.808 -11.280 -2.298 1.00 0.00 C ATOM 1699 O THR A 110 6.637 -10.949 -1.451 1.00 0.00 O ATOM 1700 CB THR A 110 5.738 -13.772 -2.184 1.00 0.00 C ATOM 1701 OG1 THR A 110 6.692 -13.646 -3.244 1.00 0.00 O ATOM 1702 CG2 THR A 110 4.846 -14.978 -2.438 1.00 0.00 C ATOM 0 H THR A 110 4.070 -12.528 -3.997 1.00 0.00 H new ATOM 0 HA THR A 110 4.465 -12.427 -1.075 1.00 0.00 H new ATOM 0 HB THR A 110 6.262 -13.920 -1.240 1.00 0.00 H new ATOM 0 HG1 THR A 110 7.222 -14.468 -3.307 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.460 -15.875 -2.513 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.140 -15.089 -1.615 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.298 -14.835 -3.369 1.00 0.00 H new ATOM 1710 N ASP A 111 5.646 -10.629 -3.445 1.00 0.00 N ATOM 1711 CA ASP A 111 6.450 -9.460 -3.781 1.00 0.00 C ATOM 1712 C ASP A 111 5.571 -8.222 -3.933 1.00 0.00 C ATOM 1713 O ASP A 111 4.620 -8.215 -4.716 1.00 0.00 O ATOM 1714 CB ASP A 111 7.233 -9.707 -5.071 1.00 0.00 C ATOM 1715 CG ASP A 111 8.257 -10.816 -4.924 1.00 0.00 C ATOM 1716 OD1 ASP A 111 8.975 -10.828 -3.902 1.00 0.00 O ATOM 1717 OD2 ASP A 111 8.340 -11.671 -5.830 1.00 0.00 O ATOM 0 H ASP A 111 4.965 -10.891 -4.158 1.00 0.00 H new ATOM 0 HA ASP A 111 7.153 -9.286 -2.967 1.00 0.00 H new ATOM 0 HB2 ASP A 111 6.538 -9.962 -5.871 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.738 -8.788 -5.368 1.00 0.00 H new ATOM 1722 N LEU A 112 5.896 -7.177 -3.180 1.00 0.00 N ATOM 1723 CA LEU A 112 5.136 -5.933 -3.230 1.00 0.00 C ATOM 1724 C LEU A 112 6.068 -4.727 -3.299 1.00 0.00 C ATOM 1725 O LEU A 112 7.090 -4.681 -2.615 1.00 0.00 O ATOM 1726 CB LEU A 112 4.225 -5.818 -2.006 1.00 0.00 C ATOM 1727 CG LEU A 112 3.171 -4.712 -2.055 1.00 0.00 C ATOM 1728 CD1 LEU A 112 2.207 -4.944 -3.209 1.00 0.00 C ATOM 1729 CD2 LEU A 112 2.417 -4.635 -0.735 1.00 0.00 C ATOM 0 H LEU A 112 6.680 -7.166 -2.528 1.00 0.00 H new ATOM 0 HA LEU A 112 4.523 -5.948 -4.131 1.00 0.00 H new ATOM 0 HB2 LEU A 112 3.716 -6.772 -1.866 1.00 0.00 H new ATOM 0 HB3 LEU A 112 4.850 -5.658 -1.127 1.00 0.00 H new ATOM 0 HG LEU A 112 3.678 -3.761 -2.217 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.464 -4.147 -3.228 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.759 -4.948 -4.149 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.707 -5.903 -3.078 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.671 -3.842 -0.788 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.922 -5.587 -0.543 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.117 -4.421 0.072 1.00 0.00 H new ATOM 1741 N SER A 113 5.707 -3.753 -4.128 1.00 0.00 N ATOM 1742 CA SER A 113 6.512 -2.548 -4.287 1.00 0.00 C ATOM 1743 C SER A 113 5.678 -1.298 -4.022 1.00 0.00 C ATOM 1744 O SER A 113 4.528 -1.204 -4.449 1.00 0.00 O ATOM 1745 CB SER A 113 7.106 -2.488 -5.696 1.00 0.00 C ATOM 1746 OG SER A 113 8.129 -1.511 -5.777 1.00 0.00 O ATOM 0 H SER A 113 4.863 -3.775 -4.700 1.00 0.00 H new ATOM 0 HA SER A 113 7.323 -2.584 -3.559 1.00 0.00 H new ATOM 0 HB2 SER A 113 7.509 -3.464 -5.966 1.00 0.00 H new ATOM 0 HB3 SER A 113 6.321 -2.257 -6.416 1.00 0.00 H new ATOM 0 HG SER A 113 9.004 -1.947 -5.711 1.00 0.00 H new ATOM 1752 N MET A 114 6.267 -0.341 -3.313 1.00 0.00 N ATOM 1753 CA MET A 114 5.579 0.904 -2.991 1.00 0.00 C ATOM 1754 C MET A 114 6.578 1.998 -2.625 1.00 0.00 C ATOM 1755 O MET A 114 7.445 1.819 -1.770 1.00 0.00 O ATOM 1756 CB MET A 114 4.598 0.686 -1.837 1.00 0.00 C ATOM 1757 CG MET A 114 5.269 0.255 -0.543 1.00 0.00 C ATOM 1758 SD MET A 114 4.082 -0.199 0.736 1.00 0.00 S ATOM 1759 CE MET A 114 3.499 -1.774 0.113 1.00 0.00 C ATOM 0 H MET A 114 7.218 -0.403 -2.951 1.00 0.00 H new ATOM 0 HA MET A 114 5.025 1.223 -3.874 1.00 0.00 H new ATOM 0 HB2 MET A 114 4.046 1.609 -1.661 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.869 -0.070 -2.128 1.00 0.00 H new ATOM 0 HG2 MET A 114 5.924 -0.593 -0.743 1.00 0.00 H new ATOM 0 HG3 MET A 114 5.899 1.066 -0.177 1.00 0.00 H new ATOM 0 HE1 MET A 114 2.410 -1.796 0.143 1.00 0.00 H new ATOM 0 HE2 MET A 114 3.837 -1.906 -0.915 1.00 0.00 H new ATOM 0 HE3 MET A 114 3.895 -2.579 0.732 1.00 0.00 H new ATOM 1769 N PRO A 115 6.454 3.158 -3.286 1.00 0.00 N ATOM 1770 CA PRO A 115 7.338 4.304 -3.047 1.00 0.00 C ATOM 1771 C PRO A 115 7.101 4.943 -1.683 1.00 0.00 C ATOM 1772 O PRO A 115 6.432 4.367 -0.825 1.00 0.00 O ATOM 1773 CB PRO A 115 6.965 5.279 -4.166 1.00 0.00 C ATOM 1774 CG PRO A 115 5.563 4.927 -4.525 1.00 0.00 C ATOM 1775 CD PRO A 115 5.443 3.442 -4.318 1.00 0.00 C ATOM 0 HA PRO A 115 8.389 4.015 -3.047 1.00 0.00 H new ATOM 0 HB2 PRO A 115 7.040 6.313 -3.831 1.00 0.00 H new ATOM 0 HB3 PRO A 115 7.631 5.172 -5.022 1.00 0.00 H new ATOM 0 HG2 PRO A 115 4.853 5.467 -3.899 1.00 0.00 H new ATOM 0 HG3 PRO A 115 5.346 5.196 -5.559 1.00 0.00 H new ATOM 0 HD2 PRO A 115 4.443 3.162 -3.988 1.00 0.00 H new ATOM 0 HD3 PRO A 115 5.641 2.891 -5.237 1.00 0.00 H new ATOM 1783 N ARG A 116 7.653 6.136 -1.490 1.00 0.00 N ATOM 1784 CA ARG A 116 7.502 6.853 -0.229 1.00 0.00 C ATOM 1785 C ARG A 116 6.083 7.392 -0.077 1.00 0.00 C ATOM 1786 O ARG A 116 5.586 8.114 -0.943 1.00 0.00 O ATOM 1787 CB ARG A 116 8.507 8.003 -0.149 1.00 0.00 C ATOM 1788 CG ARG A 116 9.957 7.548 -0.180 1.00 0.00 C ATOM 1789 CD ARG A 116 10.909 8.699 0.108 1.00 0.00 C ATOM 1790 NE ARG A 116 11.311 9.395 -1.111 1.00 0.00 N ATOM 1791 CZ ARG A 116 11.825 10.620 -1.122 1.00 0.00 C ATOM 1792 NH1 ARG A 116 11.998 11.281 0.014 1.00 0.00 N ATOM 1793 NH2 ARG A 116 12.167 11.187 -2.272 1.00 0.00 N ATOM 0 H ARG A 116 8.209 6.627 -2.190 1.00 0.00 H new ATOM 0 HA ARG A 116 7.695 6.153 0.584 1.00 0.00 H new ATOM 0 HB2 ARG A 116 8.332 8.686 -0.980 1.00 0.00 H new ATOM 0 HB3 ARG A 116 8.331 8.565 0.768 1.00 0.00 H new ATOM 0 HG2 ARG A 116 10.107 6.758 0.555 1.00 0.00 H new ATOM 0 HG3 ARG A 116 10.185 7.122 -1.157 1.00 0.00 H new ATOM 0 HD2 ARG A 116 10.430 9.404 0.787 1.00 0.00 H new ATOM 0 HD3 ARG A 116 11.795 8.318 0.617 1.00 0.00 H new ATOM 0 HE ARG A 116 11.191 8.915 -2.003 1.00 0.00 H new ATOM 0 HH11 ARG A 116 11.736 10.849 0.900 1.00 0.00 H new ATOM 0 HH12 ARG A 116 12.393 12.221 0.002 1.00 0.00 H new ATOM 0 HH21 ARG A 116 12.035 10.682 -3.149 1.00 0.00 H new ATOM 0 HH22 ARG A 116 12.562 12.128 -2.279 1.00 0.00 H new ATOM 1807 N ILE A 117 5.436 7.037 1.028 1.00 0.00 N ATOM 1808 CA ILE A 117 4.074 7.486 1.293 1.00 0.00 C ATOM 1809 C ILE A 117 3.970 8.145 2.664 1.00 0.00 C ATOM 1810 O ILE A 117 4.693 7.787 3.593 1.00 0.00 O ATOM 1811 CB ILE A 117 3.073 6.318 1.220 1.00 0.00 C ATOM 1812 CG1 ILE A 117 3.508 5.184 2.150 1.00 0.00 C ATOM 1813 CG2 ILE A 117 2.947 5.817 -0.211 1.00 0.00 C ATOM 1814 CD1 ILE A 117 2.527 4.035 2.203 1.00 0.00 C ATOM 0 H ILE A 117 5.832 6.440 1.754 1.00 0.00 H new ATOM 0 HA ILE A 117 3.826 8.216 0.522 1.00 0.00 H new ATOM 0 HB ILE A 117 2.097 6.676 1.547 1.00 0.00 H new ATOM 0 HG12 ILE A 117 4.477 4.808 1.822 1.00 0.00 H new ATOM 0 HG13 ILE A 117 3.644 5.582 3.156 1.00 0.00 H new ATOM 0 HG21 ILE A 117 2.236 4.992 -0.246 1.00 0.00 H new ATOM 0 HG22 ILE A 117 2.595 6.627 -0.850 1.00 0.00 H new ATOM 0 HG23 ILE A 117 3.920 5.473 -0.563 1.00 0.00 H new ATOM 0 HD11 ILE A 117 2.901 3.268 2.882 1.00 0.00 H new ATOM 0 HD12 ILE A 117 1.562 4.396 2.560 1.00 0.00 H new ATOM 0 HD13 ILE A 117 2.409 3.611 1.206 1.00 0.00 H new ATOM 1925 N GLN A 125 3.165 10.795 8.451 1.00 0.00 N ATOM 1926 CA GLN A 125 4.619 10.804 8.337 1.00 0.00 C ATOM 1927 C GLN A 125 5.156 9.393 8.120 1.00 0.00 C ATOM 1928 O GLN A 125 4.843 8.475 8.878 1.00 0.00 O ATOM 1929 CB GLN A 125 5.245 11.413 9.593 1.00 0.00 C ATOM 1930 CG GLN A 125 4.859 12.865 9.822 1.00 0.00 C ATOM 1931 CD GLN A 125 5.804 13.835 9.140 1.00 0.00 C ATOM 1932 OE1 GLN A 125 6.658 14.444 9.784 1.00 0.00 O ATOM 1933 NE2 GLN A 125 5.655 13.983 7.829 1.00 0.00 N ATOM 0 HA GLN A 125 4.888 11.412 7.473 1.00 0.00 H new ATOM 0 HB2 GLN A 125 4.945 10.825 10.460 1.00 0.00 H new ATOM 0 HB3 GLN A 125 6.330 11.341 9.519 1.00 0.00 H new ATOM 0 HG2 GLN A 125 3.847 13.030 9.453 1.00 0.00 H new ATOM 0 HG3 GLN A 125 4.846 13.069 10.893 1.00 0.00 H new ATOM 0 HE21 GLN A 125 4.933 13.458 7.335 1.00 0.00 H new ATOM 0 HE22 GLN A 125 6.262 14.622 7.316 1.00 0.00 H new ATOM 1942 N TRP A 126 5.966 9.228 7.081 1.00 0.00 N ATOM 1943 CA TRP A 126 6.547 7.929 6.763 1.00 0.00 C ATOM 1944 C TRP A 126 7.124 7.270 8.012 1.00 0.00 C ATOM 1945 O TRP A 126 6.905 6.084 8.255 1.00 0.00 O ATOM 1946 CB TRP A 126 7.638 8.080 5.702 1.00 0.00 C ATOM 1947 CG TRP A 126 8.385 6.809 5.432 1.00 0.00 C ATOM 1948 CD1 TRP A 126 9.680 6.532 5.768 1.00 0.00 C ATOM 1949 CD2 TRP A 126 7.883 5.644 4.769 1.00 0.00 C ATOM 1950 NE1 TRP A 126 10.013 5.265 5.353 1.00 0.00 N ATOM 1951 CE2 TRP A 126 8.927 4.699 4.739 1.00 0.00 C ATOM 1952 CE3 TRP A 126 6.652 5.306 4.201 1.00 0.00 C ATOM 1953 CZ2 TRP A 126 8.776 3.441 4.161 1.00 0.00 C ATOM 1954 CZ3 TRP A 126 6.504 4.057 3.627 1.00 0.00 C ATOM 1955 CH2 TRP A 126 7.560 3.137 3.612 1.00 0.00 C ATOM 0 H TRP A 126 6.236 9.978 6.444 1.00 0.00 H new ATOM 0 HA TRP A 126 5.755 7.292 6.371 1.00 0.00 H new ATOM 0 HB2 TRP A 126 7.186 8.431 4.774 1.00 0.00 H new ATOM 0 HB3 TRP A 126 8.343 8.846 6.023 1.00 0.00 H new ATOM 0 HD1 TRP A 126 10.344 7.209 6.284 1.00 0.00 H new ATOM 0 HE1 TRP A 126 10.921 4.819 5.481 1.00 0.00 H new ATOM 0 HE3 TRP A 126 5.831 6.008 4.210 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 9.589 2.731 4.147 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 5.558 3.786 3.182 1.00 0.00 H new ATOM 0 HH2 TRP A 126 7.412 2.168 3.158 1.00 0.00 H new ATOM 1966 N GLU A 127 7.859 8.048 8.800 1.00 0.00 N ATOM 1967 CA GLU A 127 8.467 7.538 10.024 1.00 0.00 C ATOM 1968 C GLU A 127 7.520 6.582 10.744 1.00 0.00 C ATOM 1969 O GLU A 127 7.910 5.484 11.136 1.00 0.00 O ATOM 1970 CB GLU A 127 8.845 8.694 10.952 1.00 0.00 C ATOM 1971 CG GLU A 127 9.889 8.323 11.992 1.00 0.00 C ATOM 1972 CD GLU A 127 10.646 9.529 12.515 1.00 0.00 C ATOM 1973 OE1 GLU A 127 10.043 10.330 13.259 1.00 0.00 O ATOM 1974 OE2 GLU A 127 11.840 9.672 12.179 1.00 0.00 O ATOM 0 H GLU A 127 8.048 9.033 8.613 1.00 0.00 H new ATOM 0 HA GLU A 127 9.369 6.991 9.751 1.00 0.00 H new ATOM 0 HB2 GLU A 127 9.221 9.523 10.352 1.00 0.00 H new ATOM 0 HB3 GLU A 127 7.948 9.049 11.460 1.00 0.00 H new ATOM 0 HG2 GLU A 127 9.402 7.815 12.825 1.00 0.00 H new ATOM 0 HG3 GLU A 127 10.595 7.616 11.556 1.00 0.00 H new ATOM 1981 N ASN A 128 6.274 7.011 10.914 1.00 0.00 N ATOM 1982 CA ASN A 128 5.270 6.194 11.588 1.00 0.00 C ATOM 1983 C ASN A 128 4.729 5.116 10.654 1.00 0.00 C ATOM 1984 O ASN A 128 4.614 3.951 11.034 1.00 0.00 O ATOM 1985 CB ASN A 128 4.123 7.072 12.092 1.00 0.00 C ATOM 1986 CG ASN A 128 4.580 8.087 13.121 1.00 0.00 C ATOM 1987 OD1 ASN A 128 4.411 7.888 14.324 1.00 0.00 O ATOM 1988 ND2 ASN A 128 5.163 9.184 12.652 1.00 0.00 N ATOM 0 H ASN A 128 5.935 7.919 10.595 1.00 0.00 H new ATOM 0 HA ASN A 128 5.746 5.706 12.439 1.00 0.00 H new ATOM 0 HB2 ASN A 128 3.670 7.593 11.248 1.00 0.00 H new ATOM 0 HB3 ASN A 128 3.350 6.440 12.528 1.00 0.00 H new ATOM 0 HD21 ASN A 128 5.491 9.903 13.297 1.00 0.00 H new ATOM 0 HD22 ASN A 128 5.283 9.308 11.647 1.00 0.00 H new ATOM 1995 N VAL A 129 4.399 5.514 9.429 1.00 0.00 N ATOM 1996 CA VAL A 129 3.871 4.582 8.440 1.00 0.00 C ATOM 1997 C VAL A 129 4.747 3.339 8.333 1.00 0.00 C ATOM 1998 O VAL A 129 4.307 2.229 8.633 1.00 0.00 O ATOM 1999 CB VAL A 129 3.762 5.241 7.051 1.00 0.00 C ATOM 2000 CG1 VAL A 129 3.205 4.255 6.035 1.00 0.00 C ATOM 2001 CG2 VAL A 129 2.899 6.491 7.122 1.00 0.00 C ATOM 0 H VAL A 129 4.488 6.475 9.098 1.00 0.00 H new ATOM 0 HA VAL A 129 2.875 4.293 8.777 1.00 0.00 H new ATOM 0 HB VAL A 129 4.760 5.534 6.727 1.00 0.00 H new ATOM 0 HG11 VAL A 129 3.135 4.738 5.060 1.00 0.00 H new ATOM 0 HG12 VAL A 129 3.866 3.391 5.966 1.00 0.00 H new ATOM 0 HG13 VAL A 129 2.214 3.929 6.350 1.00 0.00 H new ATOM 0 HG21 VAL A 129 2.833 6.944 6.133 1.00 0.00 H new ATOM 0 HG22 VAL A 129 1.900 6.224 7.467 1.00 0.00 H new ATOM 0 HG23 VAL A 129 3.345 7.202 7.817 1.00 0.00 H new ATOM 2011 N SER A 130 5.991 3.533 7.904 1.00 0.00 N ATOM 2012 CA SER A 130 6.929 2.427 7.754 1.00 0.00 C ATOM 2013 C SER A 130 6.774 1.425 8.894 1.00 0.00 C ATOM 2014 O SER A 130 6.784 0.214 8.676 1.00 0.00 O ATOM 2015 CB SER A 130 8.366 2.952 7.713 1.00 0.00 C ATOM 2016 OG SER A 130 8.768 3.436 8.983 1.00 0.00 O ATOM 0 H SER A 130 6.372 4.446 7.654 1.00 0.00 H new ATOM 0 HA SER A 130 6.708 1.920 6.815 1.00 0.00 H new ATOM 0 HB2 SER A 130 9.039 2.156 7.394 1.00 0.00 H new ATOM 0 HB3 SER A 130 8.444 3.750 6.975 1.00 0.00 H new ATOM 0 HG SER A 130 8.151 4.139 9.276 1.00 0.00 H new ATOM 2022 N ALA A 131 6.631 1.940 10.111 1.00 0.00 N ATOM 2023 CA ALA A 131 6.471 1.092 11.286 1.00 0.00 C ATOM 2024 C ALA A 131 5.190 0.270 11.200 1.00 0.00 C ATOM 2025 O ALA A 131 5.188 -0.926 11.487 1.00 0.00 O ATOM 2026 CB ALA A 131 6.475 1.937 12.551 1.00 0.00 C ATOM 0 H ALA A 131 6.623 2.941 10.309 1.00 0.00 H new ATOM 0 HA ALA A 131 7.313 0.400 11.322 1.00 0.00 H new ATOM 0 HB1 ALA A 131 6.355 1.291 13.421 1.00 0.00 H new ATOM 0 HB2 ALA A 131 7.420 2.475 12.626 1.00 0.00 H new ATOM 0 HB3 ALA A 131 5.653 2.652 12.514 1.00 0.00 H new ATOM 2032 N MET A 132 4.101 0.920 10.803 1.00 0.00 N ATOM 2033 CA MET A 132 2.812 0.248 10.679 1.00 0.00 C ATOM 2034 C MET A 132 2.921 -0.972 9.770 1.00 0.00 C ATOM 2035 O MET A 132 2.238 -1.975 9.978 1.00 0.00 O ATOM 2036 CB MET A 132 1.760 1.214 10.132 1.00 0.00 C ATOM 2037 CG MET A 132 1.017 1.980 11.214 1.00 0.00 C ATOM 2038 SD MET A 132 1.946 3.401 11.822 1.00 0.00 S ATOM 2039 CE MET A 132 0.752 4.714 11.582 1.00 0.00 C ATOM 0 H MET A 132 4.085 1.911 10.562 1.00 0.00 H new ATOM 0 HA MET A 132 2.507 -0.086 11.671 1.00 0.00 H new ATOM 0 HB2 MET A 132 2.245 1.925 9.463 1.00 0.00 H new ATOM 0 HB3 MET A 132 1.040 0.654 9.535 1.00 0.00 H new ATOM 0 HG2 MET A 132 0.059 2.319 10.821 1.00 0.00 H new ATOM 0 HG3 MET A 132 0.801 1.309 12.046 1.00 0.00 H new ATOM 0 HE1 MET A 132 0.761 5.377 12.447 1.00 0.00 H new ATOM 0 HE2 MET A 132 1.010 5.281 10.688 1.00 0.00 H new ATOM 0 HE3 MET A 132 -0.243 4.284 11.465 1.00 0.00 H new ATOM 2049 N ILE A 133 3.783 -0.879 8.763 1.00 0.00 N ATOM 2050 CA ILE A 133 3.980 -1.976 7.824 1.00 0.00 C ATOM 2051 C ILE A 133 4.756 -3.120 8.469 1.00 0.00 C ATOM 2052 O ILE A 133 4.465 -4.291 8.231 1.00 0.00 O ATOM 2053 CB ILE A 133 4.731 -1.509 6.563 1.00 0.00 C ATOM 2054 CG1 ILE A 133 3.982 -0.354 5.895 1.00 0.00 C ATOM 2055 CG2 ILE A 133 4.905 -2.667 5.591 1.00 0.00 C ATOM 2056 CD1 ILE A 133 4.809 0.389 4.869 1.00 0.00 C ATOM 0 H ILE A 133 4.356 -0.056 8.577 1.00 0.00 H new ATOM 0 HA ILE A 133 2.989 -2.328 7.538 1.00 0.00 H new ATOM 0 HB ILE A 133 5.719 -1.155 6.857 1.00 0.00 H new ATOM 0 HG12 ILE A 133 3.085 -0.743 5.414 1.00 0.00 H new ATOM 0 HG13 ILE A 133 3.653 0.347 6.662 1.00 0.00 H new ATOM 0 HG21 ILE A 133 5.437 -2.321 4.705 1.00 0.00 H new ATOM 0 HG22 ILE A 133 5.476 -3.462 6.071 1.00 0.00 H new ATOM 0 HG23 ILE A 133 3.926 -3.048 5.300 1.00 0.00 H new ATOM 0 HD11 ILE A 133 4.215 1.194 4.436 1.00 0.00 H new ATOM 0 HD12 ILE A 133 5.693 0.808 5.349 1.00 0.00 H new ATOM 0 HD13 ILE A 133 5.116 -0.299 4.081 1.00 0.00 H new ATOM 2068 N GLU A 134 5.743 -2.770 9.288 1.00 0.00 N ATOM 2069 CA GLU A 134 6.559 -3.768 9.969 1.00 0.00 C ATOM 2070 C GLU A 134 5.726 -4.558 10.974 1.00 0.00 C ATOM 2071 O GLU A 134 5.820 -5.783 11.046 1.00 0.00 O ATOM 2072 CB GLU A 134 7.736 -3.097 10.681 1.00 0.00 C ATOM 2073 CG GLU A 134 8.597 -2.246 9.763 1.00 0.00 C ATOM 2074 CD GLU A 134 10.046 -2.193 10.205 1.00 0.00 C ATOM 2075 OE1 GLU A 134 10.471 -3.099 10.953 1.00 0.00 O ATOM 2076 OE2 GLU A 134 10.756 -1.247 9.805 1.00 0.00 O ATOM 0 H GLU A 134 5.996 -1.804 9.496 1.00 0.00 H new ATOM 0 HA GLU A 134 6.943 -4.459 9.219 1.00 0.00 H new ATOM 0 HB2 GLU A 134 7.353 -2.473 11.488 1.00 0.00 H new ATOM 0 HB3 GLU A 134 8.358 -3.865 11.140 1.00 0.00 H new ATOM 0 HG2 GLU A 134 8.545 -2.644 8.750 1.00 0.00 H new ATOM 0 HG3 GLU A 134 8.194 -1.234 9.729 1.00 0.00 H new ATOM 2083 N GLU A 135 4.913 -3.847 11.749 1.00 0.00 N ATOM 2084 CA GLU A 135 4.065 -4.482 12.751 1.00 0.00 C ATOM 2085 C GLU A 135 2.930 -5.259 12.090 1.00 0.00 C ATOM 2086 O GLU A 135 2.590 -6.364 12.514 1.00 0.00 O ATOM 2087 CB GLU A 135 3.491 -3.432 13.705 1.00 0.00 C ATOM 2088 CG GLU A 135 2.561 -2.439 13.029 1.00 0.00 C ATOM 2089 CD GLU A 135 2.164 -1.297 13.944 1.00 0.00 C ATOM 2090 OE1 GLU A 135 2.902 -0.291 13.993 1.00 0.00 O ATOM 2091 OE2 GLU A 135 1.113 -1.409 14.610 1.00 0.00 O ATOM 0 H GLU A 135 4.824 -2.832 11.702 1.00 0.00 H new ATOM 0 HA GLU A 135 4.679 -5.182 13.319 1.00 0.00 H new ATOM 0 HB2 GLU A 135 2.950 -3.937 14.505 1.00 0.00 H new ATOM 0 HB3 GLU A 135 4.313 -2.888 14.170 1.00 0.00 H new ATOM 0 HG2 GLU A 135 3.049 -2.036 12.141 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.664 -2.958 12.692 1.00 0.00 H new ATOM 2098 N VAL A 136 2.347 -4.672 11.050 1.00 0.00 N ATOM 2099 CA VAL A 136 1.250 -5.308 10.329 1.00 0.00 C ATOM 2100 C VAL A 136 1.716 -6.581 9.632 1.00 0.00 C ATOM 2101 O VAL A 136 1.038 -7.608 9.672 1.00 0.00 O ATOM 2102 CB VAL A 136 0.640 -4.357 9.283 1.00 0.00 C ATOM 2103 CG1 VAL A 136 -0.161 -5.139 8.253 1.00 0.00 C ATOM 2104 CG2 VAL A 136 -0.228 -3.307 9.960 1.00 0.00 C ATOM 0 H VAL A 136 2.616 -3.757 10.688 1.00 0.00 H new ATOM 0 HA VAL A 136 0.489 -5.559 11.068 1.00 0.00 H new ATOM 0 HB VAL A 136 1.452 -3.846 8.765 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -0.584 -4.450 7.522 1.00 0.00 H new ATOM 0 HG12 VAL A 136 0.493 -5.849 7.746 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -0.966 -5.679 8.752 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -0.651 -2.643 9.206 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -1.034 -3.798 10.505 1.00 0.00 H new ATOM 0 HG23 VAL A 136 0.379 -2.726 10.655 1.00 0.00 H new ATOM 2114 N PHE A 137 2.879 -6.508 8.992 1.00 0.00 N ATOM 2115 CA PHE A 137 3.436 -7.654 8.285 1.00 0.00 C ATOM 2116 C PHE A 137 4.297 -8.503 9.217 1.00 0.00 C ATOM 2117 O PHE A 137 4.822 -9.541 8.818 1.00 0.00 O ATOM 2118 CB PHE A 137 4.268 -7.187 7.089 1.00 0.00 C ATOM 2119 CG PHE A 137 3.438 -6.740 5.920 1.00 0.00 C ATOM 2120 CD1 PHE A 137 2.790 -5.516 5.941 1.00 0.00 C ATOM 2121 CD2 PHE A 137 3.307 -7.543 4.798 1.00 0.00 C ATOM 2122 CE1 PHE A 137 2.025 -5.102 4.867 1.00 0.00 C ATOM 2123 CE2 PHE A 137 2.544 -7.135 3.721 1.00 0.00 C ATOM 2124 CZ PHE A 137 1.903 -5.912 3.755 1.00 0.00 C ATOM 0 H PHE A 137 3.454 -5.666 8.949 1.00 0.00 H new ATOM 0 HA PHE A 137 2.608 -8.265 7.927 1.00 0.00 H new ATOM 0 HB2 PHE A 137 4.912 -6.365 7.403 1.00 0.00 H new ATOM 0 HB3 PHE A 137 4.921 -8.000 6.771 1.00 0.00 H new ATOM 0 HD1 PHE A 137 2.884 -4.878 6.807 1.00 0.00 H new ATOM 0 HD2 PHE A 137 3.808 -8.499 4.765 1.00 0.00 H new ATOM 0 HE1 PHE A 137 1.523 -4.146 4.897 1.00 0.00 H new ATOM 0 HE2 PHE A 137 2.449 -7.771 2.854 1.00 0.00 H new ATOM 0 HZ PHE A 137 1.308 -5.590 2.914 1.00 0.00 H new ATOM 2134 N GLU A 138 4.435 -8.051 10.459 1.00 0.00 N ATOM 2135 CA GLU A 138 5.233 -8.768 11.448 1.00 0.00 C ATOM 2136 C GLU A 138 4.942 -10.265 11.400 1.00 0.00 C ATOM 2137 O GLU A 138 5.824 -11.087 11.642 1.00 0.00 O ATOM 2138 CB GLU A 138 4.952 -8.227 12.851 1.00 0.00 C ATOM 2139 CG GLU A 138 3.763 -8.886 13.531 1.00 0.00 C ATOM 2140 CD GLU A 138 3.526 -8.357 14.932 1.00 0.00 C ATOM 2141 OE1 GLU A 138 4.234 -8.798 15.861 1.00 0.00 O ATOM 2142 OE2 GLU A 138 2.631 -7.501 15.099 1.00 0.00 O ATOM 0 H GLU A 138 4.005 -7.193 10.805 1.00 0.00 H new ATOM 0 HA GLU A 138 6.285 -8.613 11.211 1.00 0.00 H new ATOM 0 HB2 GLU A 138 5.838 -8.368 13.470 1.00 0.00 H new ATOM 0 HB3 GLU A 138 4.775 -7.153 12.788 1.00 0.00 H new ATOM 0 HG2 GLU A 138 2.869 -8.723 12.929 1.00 0.00 H new ATOM 0 HG3 GLU A 138 3.926 -9.963 13.576 1.00 0.00 H new ATOM 2149 N ALA A 139 3.697 -10.610 11.085 1.00 0.00 N ATOM 2150 CA ALA A 139 3.289 -12.007 11.004 1.00 0.00 C ATOM 2151 C ALA A 139 2.750 -12.341 9.617 1.00 0.00 C ATOM 2152 O ALA A 139 1.578 -12.685 9.461 1.00 0.00 O ATOM 2153 CB ALA A 139 2.245 -12.314 12.067 1.00 0.00 C ATOM 0 H ALA A 139 2.954 -9.941 10.882 1.00 0.00 H new ATOM 0 HA ALA A 139 4.167 -12.628 11.183 1.00 0.00 H new ATOM 0 HB1 ALA A 139 1.949 -13.361 11.995 1.00 0.00 H new ATOM 0 HB2 ALA A 139 2.664 -12.123 13.055 1.00 0.00 H new ATOM 0 HB3 ALA A 139 1.372 -11.679 11.914 1.00 0.00 H new ATOM 2159 N THR A 140 3.613 -12.238 8.611 1.00 0.00 N ATOM 2160 CA THR A 140 3.223 -12.528 7.237 1.00 0.00 C ATOM 2161 C THR A 140 4.394 -13.092 6.440 1.00 0.00 C ATOM 2162 O THR A 140 5.503 -13.225 6.959 1.00 0.00 O ATOM 2163 CB THR A 140 2.692 -11.268 6.526 1.00 0.00 C ATOM 2164 OG1 THR A 140 3.739 -10.299 6.400 1.00 0.00 O ATOM 2165 CG2 THR A 140 1.526 -10.665 7.294 1.00 0.00 C ATOM 0 H THR A 140 4.587 -11.956 8.722 1.00 0.00 H new ATOM 0 HA THR A 140 2.428 -13.272 7.285 1.00 0.00 H new ATOM 0 HB THR A 140 2.343 -11.556 5.534 1.00 0.00 H new ATOM 0 HG1 THR A 140 4.146 -10.141 7.277 1.00 0.00 H new ATOM 0 HG21 THR A 140 1.168 -9.777 6.773 1.00 0.00 H new ATOM 0 HG22 THR A 140 0.720 -11.395 7.363 1.00 0.00 H new ATOM 0 HG23 THR A 140 1.854 -10.390 8.297 1.00 0.00 H new ATOM 2173 N ASP A 141 4.141 -13.421 5.178 1.00 0.00 N ATOM 2174 CA ASP A 141 5.175 -13.969 4.309 1.00 0.00 C ATOM 2175 C ASP A 141 5.318 -13.133 3.041 1.00 0.00 C ATOM 2176 O ASP A 141 5.623 -13.660 1.970 1.00 0.00 O ATOM 2177 CB ASP A 141 4.850 -15.418 3.946 1.00 0.00 C ATOM 2178 CG ASP A 141 5.928 -16.057 3.092 1.00 0.00 C ATOM 2179 OD1 ASP A 141 7.122 -15.885 3.417 1.00 0.00 O ATOM 2180 OD2 ASP A 141 5.579 -16.729 2.100 1.00 0.00 O ATOM 0 H ASP A 141 3.228 -13.318 4.734 1.00 0.00 H new ATOM 0 HA ASP A 141 6.121 -13.942 4.849 1.00 0.00 H new ATOM 0 HB2 ASP A 141 4.723 -15.999 4.860 1.00 0.00 H new ATOM 0 HB3 ASP A 141 3.900 -15.451 3.412 1.00 0.00 H new ATOM 2185 N ILE A 142 5.095 -11.830 3.169 1.00 0.00 N ATOM 2186 CA ILE A 142 5.199 -10.922 2.033 1.00 0.00 C ATOM 2187 C ILE A 142 6.398 -9.992 2.181 1.00 0.00 C ATOM 2188 O ILE A 142 6.672 -9.481 3.267 1.00 0.00 O ATOM 2189 CB ILE A 142 3.923 -10.075 1.871 1.00 0.00 C ATOM 2190 CG1 ILE A 142 2.692 -10.979 1.780 1.00 0.00 C ATOM 2191 CG2 ILE A 142 4.029 -9.189 0.638 1.00 0.00 C ATOM 2192 CD1 ILE A 142 1.413 -10.304 2.223 1.00 0.00 C ATOM 0 H ILE A 142 4.841 -11.379 4.048 1.00 0.00 H new ATOM 0 HA ILE A 142 5.330 -11.541 1.145 1.00 0.00 H new ATOM 0 HB ILE A 142 3.816 -9.435 2.747 1.00 0.00 H new ATOM 0 HG12 ILE A 142 2.576 -11.319 0.751 1.00 0.00 H new ATOM 0 HG13 ILE A 142 2.856 -11.866 2.392 1.00 0.00 H new ATOM 0 HG21 ILE A 142 3.120 -8.596 0.537 1.00 0.00 H new ATOM 0 HG22 ILE A 142 4.886 -8.524 0.741 1.00 0.00 H new ATOM 0 HG23 ILE A 142 4.157 -9.812 -0.248 1.00 0.00 H new ATOM 0 HD11 ILE A 142 0.582 -11.003 2.132 1.00 0.00 H new ATOM 0 HD12 ILE A 142 1.509 -9.988 3.262 1.00 0.00 H new ATOM 0 HD13 ILE A 142 1.225 -9.433 1.595 1.00 0.00 H new ATOM 2204 N LYS A 143 7.110 -9.774 1.080 1.00 0.00 N ATOM 2205 CA LYS A 143 8.279 -8.902 1.085 1.00 0.00 C ATOM 2206 C LYS A 143 7.991 -7.602 0.341 1.00 0.00 C ATOM 2207 O LYS A 143 7.575 -7.618 -0.818 1.00 0.00 O ATOM 2208 CB LYS A 143 9.474 -9.614 0.446 1.00 0.00 C ATOM 2209 CG LYS A 143 9.830 -10.929 1.118 1.00 0.00 C ATOM 2210 CD LYS A 143 11.244 -11.365 0.776 1.00 0.00 C ATOM 2211 CE LYS A 143 11.477 -12.827 1.127 1.00 0.00 C ATOM 2212 NZ LYS A 143 12.762 -13.333 0.571 1.00 0.00 N ATOM 0 H LYS A 143 6.898 -10.189 0.173 1.00 0.00 H new ATOM 0 HA LYS A 143 8.518 -8.662 2.121 1.00 0.00 H new ATOM 0 HB2 LYS A 143 9.255 -9.801 -0.605 1.00 0.00 H new ATOM 0 HB3 LYS A 143 10.340 -8.953 0.479 1.00 0.00 H new ATOM 0 HG2 LYS A 143 9.732 -10.825 2.199 1.00 0.00 H new ATOM 0 HG3 LYS A 143 9.125 -11.700 0.807 1.00 0.00 H new ATOM 0 HD2 LYS A 143 11.426 -11.212 -0.288 1.00 0.00 H new ATOM 0 HD3 LYS A 143 11.958 -10.742 1.315 1.00 0.00 H new ATOM 0 HE2 LYS A 143 11.479 -12.944 2.211 1.00 0.00 H new ATOM 0 HE3 LYS A 143 10.653 -13.428 0.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 12.884 -14.332 0.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 12.751 -13.245 -0.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 13.551 -12.776 0.957 1.00 0.00 H new ATOM 2226 N ILE A 144 8.217 -6.479 1.014 1.00 0.00 N ATOM 2227 CA ILE A 144 7.984 -5.171 0.415 1.00 0.00 C ATOM 2228 C ILE A 144 9.300 -4.476 0.083 1.00 0.00 C ATOM 2229 O ILE A 144 10.304 -4.661 0.771 1.00 0.00 O ATOM 2230 CB ILE A 144 7.158 -4.264 1.347 1.00 0.00 C ATOM 2231 CG1 ILE A 144 5.798 -4.900 1.640 1.00 0.00 C ATOM 2232 CG2 ILE A 144 6.982 -2.886 0.726 1.00 0.00 C ATOM 2233 CD1 ILE A 144 5.185 -4.441 2.945 1.00 0.00 C ATOM 0 H ILE A 144 8.561 -6.449 1.974 1.00 0.00 H new ATOM 0 HA ILE A 144 7.423 -5.340 -0.504 1.00 0.00 H new ATOM 0 HB ILE A 144 7.695 -4.151 2.289 1.00 0.00 H new ATOM 0 HG12 ILE A 144 5.114 -4.667 0.824 1.00 0.00 H new ATOM 0 HG13 ILE A 144 5.910 -5.984 1.662 1.00 0.00 H new ATOM 0 HG21 ILE A 144 6.396 -2.257 1.396 1.00 0.00 H new ATOM 0 HG22 ILE A 144 7.960 -2.432 0.564 1.00 0.00 H new ATOM 0 HG23 ILE A 144 6.464 -2.980 -0.228 1.00 0.00 H new ATOM 0 HD11 ILE A 144 4.222 -4.932 3.088 1.00 0.00 H new ATOM 0 HD12 ILE A 144 5.850 -4.699 3.770 1.00 0.00 H new ATOM 0 HD13 ILE A 144 5.041 -3.361 2.919 1.00 0.00 H new ATOM 2245 N THR A 145 9.288 -3.672 -0.976 1.00 0.00 N ATOM 2246 CA THR A 145 10.479 -2.948 -1.400 1.00 0.00 C ATOM 2247 C THR A 145 10.141 -1.515 -1.793 1.00 0.00 C ATOM 2248 O THR A 145 9.303 -1.280 -2.664 1.00 0.00 O ATOM 2249 CB THR A 145 11.167 -3.646 -2.589 1.00 0.00 C ATOM 2250 OG1 THR A 145 11.374 -5.031 -2.292 1.00 0.00 O ATOM 2251 CG2 THR A 145 12.500 -2.985 -2.907 1.00 0.00 C ATOM 0 H THR A 145 8.465 -3.506 -1.556 1.00 0.00 H new ATOM 0 HA THR A 145 11.161 -2.937 -0.550 1.00 0.00 H new ATOM 0 HB THR A 145 10.518 -3.555 -3.460 1.00 0.00 H new ATOM 0 HG1 THR A 145 11.810 -5.467 -3.053 1.00 0.00 H new ATOM 0 HG21 THR A 145 12.967 -3.495 -3.750 1.00 0.00 H new ATOM 0 HG22 THR A 145 12.335 -1.938 -3.162 1.00 0.00 H new ATOM 0 HG23 THR A 145 13.154 -3.048 -2.037 1.00 0.00 H new ATOM 2259 N VAL A 146 10.799 -0.558 -1.146 1.00 0.00 N ATOM 2260 CA VAL A 146 10.570 0.854 -1.429 1.00 0.00 C ATOM 2261 C VAL A 146 11.655 1.415 -2.341 1.00 0.00 C ATOM 2262 O VAL A 146 12.846 1.288 -2.057 1.00 0.00 O ATOM 2263 CB VAL A 146 10.522 1.686 -0.134 1.00 0.00 C ATOM 2264 CG1 VAL A 146 10.263 3.151 -0.449 1.00 0.00 C ATOM 2265 CG2 VAL A 146 9.462 1.140 0.811 1.00 0.00 C ATOM 0 H VAL A 146 11.495 -0.735 -0.422 1.00 0.00 H new ATOM 0 HA VAL A 146 9.605 0.923 -1.932 1.00 0.00 H new ATOM 0 HB VAL A 146 11.490 1.612 0.361 1.00 0.00 H new ATOM 0 HG11 VAL A 146 10.233 3.723 0.479 1.00 0.00 H new ATOM 0 HG12 VAL A 146 11.062 3.533 -1.085 1.00 0.00 H new ATOM 0 HG13 VAL A 146 9.309 3.249 -0.967 1.00 0.00 H new ATOM 0 HG21 VAL A 146 9.442 1.740 1.721 1.00 0.00 H new ATOM 0 HG22 VAL A 146 8.486 1.182 0.327 1.00 0.00 H new ATOM 0 HG23 VAL A 146 9.697 0.106 1.063 1.00 0.00 H new ATOM 2275 N TYR A 147 11.236 2.036 -3.438 1.00 0.00 N ATOM 2276 CA TYR A 147 12.172 2.616 -4.393 1.00 0.00 C ATOM 2277 C TYR A 147 12.124 4.140 -4.347 1.00 0.00 C ATOM 2278 O TYR A 147 11.060 4.735 -4.173 1.00 0.00 O ATOM 2279 CB TYR A 147 11.857 2.127 -5.808 1.00 0.00 C ATOM 2280 CG TYR A 147 12.084 0.644 -6.001 1.00 0.00 C ATOM 2281 CD1 TYR A 147 11.224 -0.289 -5.436 1.00 0.00 C ATOM 2282 CD2 TYR A 147 13.157 0.178 -6.750 1.00 0.00 C ATOM 2283 CE1 TYR A 147 11.428 -1.644 -5.609 1.00 0.00 C ATOM 2284 CE2 TYR A 147 13.368 -1.176 -6.929 1.00 0.00 C ATOM 2285 CZ TYR A 147 12.501 -2.083 -6.356 1.00 0.00 C ATOM 2286 OH TYR A 147 12.706 -3.432 -6.532 1.00 0.00 O ATOM 0 H TYR A 147 10.254 2.151 -3.688 1.00 0.00 H new ATOM 0 HA TYR A 147 13.177 2.294 -4.119 1.00 0.00 H new ATOM 0 HB2 TYR A 147 10.818 2.360 -6.041 1.00 0.00 H new ATOM 0 HB3 TYR A 147 12.474 2.676 -6.519 1.00 0.00 H new ATOM 0 HD1 TYR A 147 10.382 0.051 -4.852 1.00 0.00 H new ATOM 0 HD2 TYR A 147 13.838 0.886 -7.200 1.00 0.00 H new ATOM 0 HE1 TYR A 147 10.751 -2.356 -5.162 1.00 0.00 H new ATOM 0 HE2 TYR A 147 14.207 -1.522 -7.514 1.00 0.00 H new ATOM 0 HH TYR A 147 13.504 -3.572 -7.084 1.00 0.00 H new ATOM 2296 N THR A 148 13.285 4.767 -4.506 1.00 0.00 N ATOM 2297 CA THR A 148 13.378 6.222 -4.483 1.00 0.00 C ATOM 2298 C THR A 148 14.329 6.730 -5.559 1.00 0.00 C ATOM 2299 O THR A 148 15.482 6.301 -5.636 1.00 0.00 O ATOM 2300 CB THR A 148 13.854 6.732 -3.110 1.00 0.00 C ATOM 2301 OG1 THR A 148 15.140 6.182 -2.802 1.00 0.00 O ATOM 2302 CG2 THR A 148 12.862 6.358 -2.019 1.00 0.00 C ATOM 0 H THR A 148 14.175 4.290 -4.652 1.00 0.00 H new ATOM 0 HA THR A 148 12.377 6.606 -4.678 1.00 0.00 H new ATOM 0 HB THR A 148 13.926 7.819 -3.156 1.00 0.00 H new ATOM 0 HG1 THR A 148 15.652 6.065 -3.629 1.00 0.00 H new ATOM 0 HG21 THR A 148 13.220 6.729 -1.059 1.00 0.00 H new ATOM 0 HG22 THR A 148 11.892 6.803 -2.241 1.00 0.00 H new ATOM 0 HG23 THR A 148 12.762 5.274 -1.974 1.00 0.00 H new ATOM 2310 N LEU A 149 13.842 7.645 -6.390 1.00 0.00 N ATOM 2311 CA LEU A 149 14.651 8.213 -7.463 1.00 0.00 C ATOM 2312 C LEU A 149 14.669 9.736 -7.384 1.00 0.00 C ATOM 2313 O LEU A 149 13.729 10.353 -6.882 1.00 0.00 O ATOM 2314 CB LEU A 149 14.112 7.768 -8.824 1.00 0.00 C ATOM 2315 CG LEU A 149 12.869 8.502 -9.326 1.00 0.00 C ATOM 2316 CD1 LEU A 149 12.612 8.177 -10.790 1.00 0.00 C ATOM 2317 CD2 LEU A 149 11.658 8.144 -8.478 1.00 0.00 C ATOM 0 H LEU A 149 12.891 8.010 -6.341 1.00 0.00 H new ATOM 0 HA LEU A 149 15.672 7.850 -7.346 1.00 0.00 H new ATOM 0 HB2 LEU A 149 14.904 7.889 -9.563 1.00 0.00 H new ATOM 0 HB3 LEU A 149 13.884 6.703 -8.772 1.00 0.00 H new ATOM 0 HG LEU A 149 13.044 9.574 -9.238 1.00 0.00 H new ATOM 0 HD11 LEU A 149 11.723 8.708 -11.130 1.00 0.00 H new ATOM 0 HD12 LEU A 149 13.470 8.486 -11.387 1.00 0.00 H new ATOM 0 HD13 LEU A 149 12.458 7.104 -10.903 1.00 0.00 H new ATOM 0 HD21 LEU A 149 10.783 8.676 -8.851 1.00 0.00 H new ATOM 0 HD22 LEU A 149 11.480 7.070 -8.533 1.00 0.00 H new ATOM 0 HD23 LEU A 149 11.842 8.429 -7.442 1.00 0.00 H new