USER MOD reduce.3.24.130724 H: found=0, std=0, add=1080, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1082 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 93 TYR OH : rot 50:sc= 0.633 USER MOD Set 1.2: A 131 ASN : amide:sc= 0.745 K(o=1.4,f=0.11) USER MOD Set 2.1: A 72 LYS NZ :NH3+ 160:sc= 1.39 (180deg=-0.0283) USER MOD Set 2.2: A 77 TYR OH : rot -105:sc= 1.9 USER MOD Set 2.3: A 79 TYR OH : rot -158:sc= 1.38 USER MOD Set 2.4: A 106 HIS : no HD1:sc= -1.15! C(o=5.3!,f=-7.2!) USER MOD Set 2.5: A 110 ASN : amide:sc= 1.83 K(o=5.3,f=1.2) USER MOD Set 3.1: A 84 LYS NZ :NH3+ -128:sc= 0.811 (180deg=0) USER MOD Set 3.2: A 92 THR OG1 : rot 150:sc= -1.53! USER MOD Set 3.3: A 95 ASN : amide:sc= -1.35! K(o=-2.1!,f=-5.6) USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 TYR OH : rot 180:sc= 0.988 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 CYS SG : rot -87:sc= 1.15 USER MOD Single : A 26 LYS NZ :NH3+ -156:sc= 1.23 (180deg=1.16) USER MOD Single : A 27 THR OG1 : rot 60:sc= 1.04 USER MOD Single : A 29 SER OG : rot -160:sc= -0.0601 USER MOD Single : A 32 HIS : no HD1:sc= -1.8 K(o=-1.8,f=-3.7!) USER MOD Single : A 33 CYS SG : rot 25:sc= 0.0807 USER MOD Single : A 35 SER OG : rot 180:sc= 0.0327 USER MOD Single : A 38 CYS SG : rot 1:sc= 0.00945 USER MOD Single : A 40 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ -167:sc= -0.0241 (180deg=-0.227) USER MOD Single : A 56 GLN : amide:sc= -0.522 X(o=-0.52,f=-0.52) USER MOD Single : A 60 ASN : amide:sc= -0.0111 K(o=-0.011,f=-0.91) USER MOD Single : A 61 GLN : amide:sc= 0.617 K(o=0.62,f=0.024) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 173:sc= 0.371 (180deg=0.332) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot -93:sc= 1.21 USER MOD Single : A 80 TYR OH : rot 130:sc= -0.0604 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.0307 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 HIS : no HD1:sc= -2.21! X(o=-2.2!,f=-2.5) USER MOD Single : A 90 LYS NZ :NH3+ 169:sc=-0.00545 (180deg=-0.156) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=-0.057) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 82:sc= 1.23 USER MOD Single : A 103 MET CE :methyl -179:sc= -2.41 (180deg=-2.47) USER MOD Single : A 104 LYS NZ :NH3+ 169:sc= 1.27 (180deg=1.22) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 CYS SG : rot 14:sc= -5.37! USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 52:sc= 0.844 USER MOD Single : A 116 SER OG : rot -43:sc= 0.491 USER MOD Single : A 117 MET CE :methyl 180:sc= -2.27 (180deg=-2.27) USER MOD Single : A 128 GLN : amide:sc= 0.344 K(o=0.34,f=-5.6!) USER MOD Single : A 133 SER OG : rot 180:sc= -0.475 USER MOD Single : A 135 MET CE :methyl 161:sc= -0.792 (180deg=-1.32) USER MOD Single : A 143 THR OG1 : rot 8:sc= 0.977 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 1.22 (180deg=1.22) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 151 THR OG1 : rot 180:sc= -0.163 USER MOD ----------------------------------------------------------------- ATOM 155 N ARG A 13 -8.281 1.858 -13.593 1.00 12.22 N ATOM 156 CA ARG A 13 -7.003 1.716 -13.014 1.00 50.24 C ATOM 157 C ARG A 13 -7.109 2.056 -11.557 1.00 61.13 C ATOM 158 O ARG A 13 -6.837 1.239 -10.713 1.00 20.32 O ATOM 159 CB ARG A 13 -6.049 2.670 -13.686 1.00 24.23 C ATOM 160 CG ARG A 13 -4.662 2.664 -13.110 1.00 13.11 C ATOM 161 CD ARG A 13 -3.945 1.341 -13.351 1.00 62.11 C ATOM 162 NE ARG A 13 -3.794 1.077 -14.782 1.00 73.24 N ATOM 163 CZ ARG A 13 -4.004 -0.095 -15.394 1.00 4.32 C ATOM 164 NH1 ARG A 13 -4.393 -1.168 -14.698 1.00 33.04 N ATOM 165 NH2 ARG A 13 -3.809 -0.194 -16.698 1.00 64.22 N ATOM 0 HA ARG A 13 -6.638 0.696 -13.136 1.00 50.24 H new ATOM 0 HB2 ARG A 13 -5.991 2.421 -14.746 1.00 24.23 H new ATOM 0 HB3 ARG A 13 -6.454 3.680 -13.617 1.00 24.23 H new ATOM 0 HG2 ARG A 13 -4.083 3.475 -13.552 1.00 13.11 H new ATOM 0 HG3 ARG A 13 -4.714 2.857 -12.039 1.00 13.11 H new ATOM 0 HD2 ARG A 13 -2.964 1.364 -12.877 1.00 62.11 H new ATOM 0 HD3 ARG A 13 -4.505 0.530 -12.886 1.00 62.11 H new ATOM 0 HE ARG A 13 -3.501 1.859 -15.368 1.00 73.24 H new ATOM 0 HH11 ARG A 13 -4.533 -1.099 -13.690 1.00 33.04 H new ATOM 0 HH12 ARG A 13 -4.550 -2.056 -15.175 1.00 33.04 H new ATOM 0 HH21 ARG A 13 -3.501 0.619 -17.231 1.00 64.22 H new ATOM 0 HH22 ARG A 13 -3.967 -1.084 -17.171 1.00 64.22 H new ATOM 179 N ILE A 14 -7.529 3.265 -11.284 1.00 40.44 N ATOM 180 CA ILE A 14 -7.705 3.729 -9.940 1.00 71.33 C ATOM 181 C ILE A 14 -9.176 3.767 -9.664 1.00 31.23 C ATOM 182 O ILE A 14 -9.935 4.421 -10.375 1.00 22.41 O ATOM 183 CB ILE A 14 -7.124 5.149 -9.766 1.00 51.21 C ATOM 184 CG1 ILE A 14 -5.657 5.176 -10.229 1.00 64.14 C ATOM 185 CG2 ILE A 14 -7.249 5.614 -8.298 1.00 73.40 C ATOM 186 CD1 ILE A 14 -5.025 6.546 -10.232 1.00 22.33 C ATOM 0 H ILE A 14 -7.759 3.957 -11.997 1.00 40.44 H new ATOM 0 HA ILE A 14 -7.186 3.062 -9.252 1.00 71.33 H new ATOM 0 HB ILE A 14 -7.696 5.841 -10.384 1.00 51.21 H new ATOM 0 HG12 ILE A 14 -5.073 4.522 -9.581 1.00 64.14 H new ATOM 0 HG13 ILE A 14 -5.600 4.761 -11.235 1.00 64.14 H new ATOM 0 HG21 ILE A 14 -6.834 6.617 -8.197 1.00 73.40 H new ATOM 0 HG22 ILE A 14 -8.300 5.626 -8.008 1.00 73.40 H new ATOM 0 HG23 ILE A 14 -6.702 4.928 -7.651 1.00 73.40 H new ATOM 0 HD11 ILE A 14 -3.992 6.469 -10.572 1.00 22.33 H new ATOM 0 HD12 ILE A 14 -5.580 7.201 -10.903 1.00 22.33 H new ATOM 0 HD13 ILE A 14 -5.045 6.958 -9.223 1.00 22.33 H new ATOM 198 N THR A 15 -9.572 3.067 -8.675 1.00 71.54 N ATOM 199 CA THR A 15 -10.941 2.995 -8.289 1.00 41.03 C ATOM 200 C THR A 15 -11.043 3.336 -6.811 1.00 33.31 C ATOM 201 O THR A 15 -10.219 2.893 -6.007 1.00 70.23 O ATOM 202 CB THR A 15 -11.494 1.592 -8.584 1.00 51.55 C ATOM 203 OG1 THR A 15 -11.280 1.305 -9.980 1.00 14.14 O ATOM 204 CG2 THR A 15 -12.978 1.511 -8.285 1.00 73.44 C ATOM 0 H THR A 15 -8.946 2.512 -8.091 1.00 71.54 H new ATOM 0 HA THR A 15 -11.538 3.708 -8.858 1.00 41.03 H new ATOM 0 HB THR A 15 -10.979 0.870 -7.950 1.00 51.55 H new ATOM 0 HG1 THR A 15 -11.625 0.412 -10.187 1.00 14.14 H new ATOM 0 HG21 THR A 15 -13.339 0.506 -8.504 1.00 73.44 H new ATOM 0 HG22 THR A 15 -13.150 1.737 -7.233 1.00 73.44 H new ATOM 0 HG23 THR A 15 -13.514 2.232 -8.903 1.00 73.44 H new ATOM 212 N TYR A 16 -12.007 4.145 -6.461 1.00 50.34 N ATOM 213 CA TYR A 16 -12.133 4.628 -5.107 1.00 43.15 C ATOM 214 C TYR A 16 -13.186 3.842 -4.346 1.00 31.22 C ATOM 215 O TYR A 16 -14.290 3.598 -4.856 1.00 15.31 O ATOM 216 CB TYR A 16 -12.484 6.119 -5.119 1.00 13.34 C ATOM 217 CG TYR A 16 -11.511 6.961 -5.922 1.00 13.10 C ATOM 218 CD1 TYR A 16 -10.381 7.517 -5.340 1.00 41.41 C ATOM 219 CD2 TYR A 16 -11.729 7.187 -7.275 1.00 42.22 C ATOM 220 CE1 TYR A 16 -9.498 8.276 -6.090 1.00 31.42 C ATOM 221 CE2 TYR A 16 -10.858 7.938 -8.025 1.00 15.43 C ATOM 222 CZ TYR A 16 -9.747 8.479 -7.435 1.00 62.12 C ATOM 223 OH TYR A 16 -8.875 9.226 -8.193 1.00 53.43 O ATOM 0 H TYR A 16 -12.724 4.488 -7.100 1.00 50.34 H new ATOM 0 HA TYR A 16 -11.179 4.490 -4.599 1.00 43.15 H new ATOM 0 HB2 TYR A 16 -13.486 6.245 -5.529 1.00 13.34 H new ATOM 0 HB3 TYR A 16 -12.510 6.487 -4.093 1.00 13.34 H new ATOM 0 HD1 TYR A 16 -10.188 7.356 -4.290 1.00 41.41 H new ATOM 0 HD2 TYR A 16 -12.603 6.763 -7.747 1.00 42.22 H new ATOM 0 HE1 TYR A 16 -8.622 8.706 -5.628 1.00 31.42 H new ATOM 0 HE2 TYR A 16 -11.048 8.101 -9.075 1.00 15.43 H new ATOM 0 HH TYR A 16 -9.199 9.269 -9.117 1.00 53.43 H new ATOM 233 N VAL A 17 -12.843 3.434 -3.148 1.00 23.22 N ATOM 234 CA VAL A 17 -13.747 2.700 -2.275 1.00 35.14 C ATOM 235 C VAL A 17 -13.748 3.363 -0.908 1.00 71.32 C ATOM 236 O VAL A 17 -12.724 3.859 -0.459 1.00 3.42 O ATOM 237 CB VAL A 17 -13.307 1.203 -2.106 1.00 12.21 C ATOM 238 CG1 VAL A 17 -14.272 0.432 -1.207 1.00 5.33 C ATOM 239 CG2 VAL A 17 -13.195 0.513 -3.445 1.00 74.04 C ATOM 0 H VAL A 17 -11.922 3.600 -2.742 1.00 23.22 H new ATOM 0 HA VAL A 17 -14.740 2.714 -2.724 1.00 35.14 H new ATOM 0 HB VAL A 17 -12.326 1.212 -1.631 1.00 12.21 H new ATOM 0 HG11 VAL A 17 -13.935 -0.600 -1.113 1.00 5.33 H new ATOM 0 HG12 VAL A 17 -14.300 0.896 -0.221 1.00 5.33 H new ATOM 0 HG13 VAL A 17 -15.270 0.450 -1.645 1.00 5.33 H new ATOM 0 HG21 VAL A 17 -12.889 -0.522 -3.296 1.00 74.04 H new ATOM 0 HG22 VAL A 17 -14.161 0.537 -3.948 1.00 74.04 H new ATOM 0 HG23 VAL A 17 -12.454 1.026 -4.058 1.00 74.04 H new ATOM 249 N LYS A 18 -14.879 3.429 -0.282 1.00 21.54 N ATOM 250 CA LYS A 18 -14.971 3.939 1.043 1.00 60.13 C ATOM 251 C LYS A 18 -15.378 2.817 1.981 1.00 34.32 C ATOM 252 O LYS A 18 -16.304 2.055 1.681 1.00 2.22 O ATOM 253 CB LYS A 18 -15.945 5.116 1.110 1.00 45.54 C ATOM 254 CG LYS A 18 -17.371 4.813 0.652 1.00 42.12 C ATOM 255 CD LYS A 18 -18.254 6.049 0.727 1.00 62.21 C ATOM 256 CE LYS A 18 -18.335 6.594 2.142 1.00 33.33 C ATOM 257 NZ LYS A 18 -19.173 7.800 2.229 1.00 3.20 N ATOM 0 H LYS A 18 -15.769 3.128 -0.680 1.00 21.54 H new ATOM 0 HA LYS A 18 -13.998 4.319 1.355 1.00 60.13 H new ATOM 0 HB2 LYS A 18 -15.981 5.478 2.137 1.00 45.54 H new ATOM 0 HB3 LYS A 18 -15.550 5.928 0.499 1.00 45.54 H new ATOM 0 HG2 LYS A 18 -17.354 4.438 -0.371 1.00 42.12 H new ATOM 0 HG3 LYS A 18 -17.794 4.024 1.273 1.00 42.12 H new ATOM 0 HD2 LYS A 18 -17.861 6.818 0.062 1.00 62.21 H new ATOM 0 HD3 LYS A 18 -19.255 5.803 0.373 1.00 62.21 H new ATOM 0 HE2 LYS A 18 -18.738 5.826 2.802 1.00 33.33 H new ATOM 0 HE3 LYS A 18 -17.331 6.825 2.498 1.00 33.33 H new ATOM 0 HZ1 LYS A 18 -19.198 8.135 3.213 1.00 3.20 H new ATOM 0 HZ2 LYS A 18 -18.776 8.544 1.620 1.00 3.20 H new ATOM 0 HZ3 LYS A 18 -20.139 7.575 1.915 1.00 3.20 H new ATOM 271 N GLY A 19 -14.695 2.690 3.084 1.00 2.30 N ATOM 272 CA GLY A 19 -15.015 1.638 4.005 1.00 71.41 C ATOM 273 C GLY A 19 -13.846 1.264 4.867 1.00 20.22 C ATOM 274 O GLY A 19 -13.178 2.140 5.427 1.00 61.11 O ATOM 0 H GLY A 19 -13.922 3.294 3.364 1.00 2.30 H new ATOM 0 HA2 GLY A 19 -15.845 1.952 4.638 1.00 71.41 H new ATOM 0 HA3 GLY A 19 -15.350 0.762 3.450 1.00 71.41 H new ATOM 278 N ASP A 20 -13.579 -0.017 4.962 1.00 73.02 N ATOM 279 CA ASP A 20 -12.512 -0.517 5.816 1.00 4.24 C ATOM 280 C ASP A 20 -11.377 -1.037 4.957 1.00 42.55 C ATOM 281 O ASP A 20 -11.613 -1.589 3.878 1.00 60.14 O ATOM 282 CB ASP A 20 -13.040 -1.638 6.705 1.00 12.51 C ATOM 283 CG ASP A 20 -12.062 -2.056 7.754 1.00 0.43 C ATOM 284 OD1 ASP A 20 -11.246 -2.915 7.499 1.00 5.12 O ATOM 285 OD2 ASP A 20 -12.111 -1.503 8.875 1.00 31.25 O ATOM 0 H ASP A 20 -14.087 -0.742 4.456 1.00 73.02 H new ATOM 0 HA ASP A 20 -12.147 0.294 6.446 1.00 4.24 H new ATOM 0 HB2 ASP A 20 -13.962 -1.311 7.185 1.00 12.51 H new ATOM 0 HB3 ASP A 20 -13.291 -2.499 6.085 1.00 12.51 H new ATOM 290 N LEU A 21 -10.154 -0.873 5.419 1.00 23.24 N ATOM 291 CA LEU A 21 -9.012 -1.284 4.640 1.00 34.13 C ATOM 292 C LEU A 21 -8.318 -2.533 5.230 1.00 12.13 C ATOM 293 O LEU A 21 -7.365 -3.059 4.666 1.00 71.22 O ATOM 294 CB LEU A 21 -8.075 -0.103 4.453 1.00 42.45 C ATOM 295 CG LEU A 21 -6.882 -0.302 3.517 1.00 41.45 C ATOM 296 CD1 LEU A 21 -7.304 -0.987 2.225 1.00 54.00 C ATOM 297 CD2 LEU A 21 -6.333 1.036 3.173 1.00 22.33 C ATOM 0 H LEU A 21 -9.930 -0.460 6.324 1.00 23.24 H new ATOM 0 HA LEU A 21 -9.351 -1.599 3.653 1.00 34.13 H new ATOM 0 HB2 LEU A 21 -8.660 0.738 4.081 1.00 42.45 H new ATOM 0 HB3 LEU A 21 -7.692 0.184 5.433 1.00 42.45 H new ATOM 0 HG LEU A 21 -6.143 -0.925 4.020 1.00 41.45 H new ATOM 0 HD11 LEU A 21 -6.435 -1.115 1.580 1.00 54.00 H new ATOM 0 HD12 LEU A 21 -7.733 -1.963 2.454 1.00 54.00 H new ATOM 0 HD13 LEU A 21 -8.048 -0.375 1.715 1.00 54.00 H new ATOM 0 HD21 LEU A 21 -5.480 0.918 2.505 1.00 22.33 H new ATOM 0 HD22 LEU A 21 -7.102 1.629 2.678 1.00 22.33 H new ATOM 0 HD23 LEU A 21 -6.014 1.543 4.083 1.00 22.33 H new ATOM 309 N PHE A 22 -8.819 -3.009 6.342 1.00 54.04 N ATOM 310 CA PHE A 22 -8.332 -4.255 6.933 1.00 62.12 C ATOM 311 C PHE A 22 -9.212 -5.424 6.489 1.00 44.31 C ATOM 312 O PHE A 22 -8.766 -6.582 6.426 1.00 64.31 O ATOM 313 CB PHE A 22 -8.250 -4.195 8.476 1.00 74.41 C ATOM 314 CG PHE A 22 -7.074 -3.424 9.033 1.00 52.11 C ATOM 315 CD1 PHE A 22 -5.812 -3.997 9.023 1.00 3.51 C ATOM 316 CD2 PHE A 22 -7.222 -2.155 9.592 1.00 52.45 C ATOM 317 CE1 PHE A 22 -4.725 -3.331 9.545 1.00 31.25 C ATOM 318 CE2 PHE A 22 -6.129 -1.487 10.112 1.00 13.44 C ATOM 319 CZ PHE A 22 -4.884 -2.076 10.088 1.00 53.14 C ATOM 0 H PHE A 22 -9.568 -2.558 6.867 1.00 54.04 H new ATOM 0 HA PHE A 22 -7.314 -4.405 6.572 1.00 62.12 H new ATOM 0 HB2 PHE A 22 -9.169 -3.747 8.855 1.00 74.41 H new ATOM 0 HB3 PHE A 22 -8.210 -5.214 8.861 1.00 74.41 H new ATOM 0 HD1 PHE A 22 -5.679 -4.981 8.599 1.00 3.51 H new ATOM 0 HD2 PHE A 22 -8.197 -1.691 9.619 1.00 52.45 H new ATOM 0 HE1 PHE A 22 -3.749 -3.793 9.528 1.00 31.25 H new ATOM 0 HE2 PHE A 22 -6.251 -0.502 10.538 1.00 13.44 H new ATOM 0 HZ PHE A 22 -4.032 -1.553 10.496 1.00 53.14 H new ATOM 329 N ALA A 23 -10.454 -5.110 6.153 1.00 54.03 N ATOM 330 CA ALA A 23 -11.432 -6.097 5.689 1.00 2.11 C ATOM 331 C ALA A 23 -11.356 -6.286 4.165 1.00 51.52 C ATOM 332 O ALA A 23 -12.286 -6.801 3.540 1.00 44.55 O ATOM 333 CB ALA A 23 -12.832 -5.659 6.097 1.00 21.23 C ATOM 0 H ALA A 23 -10.819 -4.159 6.193 1.00 54.03 H new ATOM 0 HA ALA A 23 -11.201 -7.055 6.154 1.00 2.11 H new ATOM 0 HB1 ALA A 23 -13.559 -6.394 5.751 1.00 21.23 H new ATOM 0 HB2 ALA A 23 -12.886 -5.578 7.183 1.00 21.23 H new ATOM 0 HB3 ALA A 23 -13.055 -4.690 5.650 1.00 21.23 H new ATOM 339 N CYS A 24 -10.248 -5.889 3.588 1.00 40.22 N ATOM 340 CA CYS A 24 -10.021 -6.037 2.164 1.00 44.14 C ATOM 341 C CYS A 24 -9.617 -7.498 1.850 1.00 24.45 C ATOM 342 O CYS A 24 -9.130 -8.215 2.746 1.00 13.41 O ATOM 343 CB CYS A 24 -8.926 -5.053 1.724 1.00 20.12 C ATOM 344 SG CYS A 24 -7.376 -5.230 2.633 1.00 71.23 S ATOM 0 H CYS A 24 -9.475 -5.453 4.090 1.00 40.22 H new ATOM 0 HA CYS A 24 -10.934 -5.812 1.613 1.00 44.14 H new ATOM 0 HB2 CYS A 24 -8.731 -5.194 0.661 1.00 20.12 H new ATOM 0 HB3 CYS A 24 -9.295 -4.035 1.848 1.00 20.12 H new ATOM 0 HG CYS A 24 -7.425 -4.515 3.718 1.00 71.23 H new ATOM 350 N PRO A 25 -9.820 -7.975 0.606 1.00 45.11 N ATOM 351 CA PRO A 25 -9.459 -9.353 0.216 1.00 61.52 C ATOM 352 C PRO A 25 -7.940 -9.545 0.189 1.00 33.32 C ATOM 353 O PRO A 25 -7.199 -8.593 -0.032 1.00 65.21 O ATOM 354 CB PRO A 25 -10.028 -9.488 -1.204 1.00 3.44 C ATOM 355 CG PRO A 25 -10.959 -8.330 -1.368 1.00 61.11 C ATOM 356 CD PRO A 25 -10.401 -7.235 -0.524 1.00 32.41 C ATOM 0 HA PRO A 25 -9.847 -10.094 0.914 1.00 61.52 H new ATOM 0 HB2 PRO A 25 -9.234 -9.463 -1.950 1.00 3.44 H new ATOM 0 HB3 PRO A 25 -10.553 -10.435 -1.329 1.00 3.44 H new ATOM 0 HG2 PRO A 25 -11.022 -8.025 -2.412 1.00 61.11 H new ATOM 0 HG3 PRO A 25 -11.968 -8.592 -1.051 1.00 61.11 H new ATOM 0 HD2 PRO A 25 -9.650 -6.653 -1.058 1.00 32.41 H new ATOM 0 HD3 PRO A 25 -11.174 -6.538 -0.199 1.00 32.41 H new ATOM 364 N LYS A 26 -7.473 -10.780 0.419 1.00 75.32 N ATOM 365 CA LYS A 26 -6.027 -11.074 0.426 1.00 3.44 C ATOM 366 C LYS A 26 -5.424 -11.062 -0.959 1.00 21.32 C ATOM 367 O LYS A 26 -4.205 -11.060 -1.115 1.00 21.45 O ATOM 368 CB LYS A 26 -5.670 -12.357 1.159 1.00 20.34 C ATOM 369 CG LYS A 26 -6.011 -12.320 2.631 1.00 62.41 C ATOM 370 CD LYS A 26 -5.393 -13.480 3.384 1.00 50.24 C ATOM 371 CE LYS A 26 -5.872 -14.828 2.875 1.00 61.25 C ATOM 372 NZ LYS A 26 -5.290 -15.947 3.641 1.00 41.03 N ATOM 0 H LYS A 26 -8.068 -11.588 0.602 1.00 75.32 H new ATOM 0 HA LYS A 26 -5.582 -10.255 0.991 1.00 3.44 H new ATOM 0 HB2 LYS A 26 -6.194 -13.191 0.693 1.00 20.34 H new ATOM 0 HB3 LYS A 26 -4.603 -12.547 1.045 1.00 20.34 H new ATOM 0 HG2 LYS A 26 -5.662 -11.381 3.061 1.00 62.41 H new ATOM 0 HG3 LYS A 26 -7.094 -12.344 2.753 1.00 62.41 H new ATOM 0 HD2 LYS A 26 -4.308 -13.428 3.297 1.00 50.24 H new ATOM 0 HD3 LYS A 26 -5.633 -13.390 4.443 1.00 50.24 H new ATOM 0 HE2 LYS A 26 -6.959 -14.873 2.937 1.00 61.25 H new ATOM 0 HE3 LYS A 26 -5.608 -14.933 1.823 1.00 61.25 H new ATOM 0 HZ1 LYS A 26 -5.293 -16.807 3.056 1.00 41.03 H new ATOM 0 HZ2 LYS A 26 -4.312 -15.713 3.908 1.00 41.03 H new ATOM 0 HZ3 LYS A 26 -5.854 -16.110 4.499 1.00 41.03 H new ATOM 386 N THR A 27 -6.280 -11.061 -1.961 1.00 51.42 N ATOM 387 CA THR A 27 -5.853 -11.030 -3.337 1.00 22.55 C ATOM 388 C THR A 27 -5.371 -9.636 -3.706 1.00 64.40 C ATOM 389 O THR A 27 -4.661 -9.436 -4.699 1.00 42.41 O ATOM 390 CB THR A 27 -7.050 -11.394 -4.223 1.00 12.11 C ATOM 391 OG1 THR A 27 -8.222 -10.651 -3.787 1.00 41.03 O ATOM 392 CG2 THR A 27 -7.337 -12.886 -4.176 1.00 72.43 C ATOM 0 H THR A 27 -7.292 -11.082 -1.839 1.00 51.42 H new ATOM 0 HA THR A 27 -5.036 -11.737 -3.481 1.00 22.55 H new ATOM 0 HB THR A 27 -6.808 -11.130 -5.252 1.00 12.11 H new ATOM 0 HG1 THR A 27 -8.042 -9.690 -3.850 1.00 41.03 H new ATOM 0 HG21 THR A 27 -8.191 -13.113 -4.814 1.00 72.43 H new ATOM 0 HG22 THR A 27 -6.464 -13.436 -4.529 1.00 72.43 H new ATOM 0 HG23 THR A 27 -7.562 -13.181 -3.151 1.00 72.43 H new ATOM 400 N ASP A 28 -5.717 -8.718 -2.876 1.00 15.15 N ATOM 401 CA ASP A 28 -5.395 -7.341 -3.035 1.00 72.14 C ATOM 402 C ASP A 28 -4.294 -7.002 -2.080 1.00 41.44 C ATOM 403 O ASP A 28 -4.446 -7.139 -0.857 1.00 54.32 O ATOM 404 CB ASP A 28 -6.633 -6.495 -2.717 1.00 51.34 C ATOM 405 CG ASP A 28 -7.803 -6.804 -3.625 1.00 55.42 C ATOM 406 OD1 ASP A 28 -8.333 -7.948 -3.573 1.00 72.02 O ATOM 407 OD2 ASP A 28 -8.196 -5.940 -4.403 1.00 24.15 O ATOM 0 H ASP A 28 -6.255 -8.912 -2.031 1.00 15.15 H new ATOM 0 HA ASP A 28 -5.077 -7.139 -4.058 1.00 72.14 H new ATOM 0 HB2 ASP A 28 -6.928 -6.665 -1.682 1.00 51.34 H new ATOM 0 HB3 ASP A 28 -6.379 -5.439 -2.806 1.00 51.34 H new ATOM 412 N SER A 29 -3.178 -6.598 -2.604 1.00 62.12 N ATOM 413 CA SER A 29 -2.085 -6.207 -1.765 1.00 64.42 C ATOM 414 C SER A 29 -2.360 -4.812 -1.241 1.00 20.11 C ATOM 415 O SER A 29 -3.208 -4.116 -1.783 1.00 53.14 O ATOM 416 CB SER A 29 -0.786 -6.283 -2.535 1.00 13.24 C ATOM 417 OG SER A 29 -0.580 -7.609 -2.995 1.00 14.34 O ATOM 0 H SER A 29 -2.999 -6.530 -3.606 1.00 62.12 H new ATOM 0 HA SER A 29 -1.988 -6.884 -0.916 1.00 64.42 H new ATOM 0 HB2 SER A 29 -0.812 -5.595 -3.380 1.00 13.24 H new ATOM 0 HB3 SER A 29 0.044 -5.975 -1.899 1.00 13.24 H new ATOM 0 HG SER A 29 0.368 -7.739 -3.204 1.00 14.34 H new ATOM 423 N LEU A 30 -1.683 -4.394 -0.221 1.00 74.11 N ATOM 424 CA LEU A 30 -2.016 -3.131 0.365 1.00 35.51 C ATOM 425 C LEU A 30 -0.758 -2.297 0.416 1.00 3.23 C ATOM 426 O LEU A 30 0.290 -2.806 0.719 1.00 51.14 O ATOM 427 CB LEU A 30 -2.553 -3.387 1.780 1.00 31.20 C ATOM 428 CG LEU A 30 -3.655 -2.459 2.312 1.00 25.21 C ATOM 429 CD1 LEU A 30 -4.058 -2.889 3.692 1.00 14.14 C ATOM 430 CD2 LEU A 30 -3.247 -1.005 2.306 1.00 73.32 C ATOM 0 H LEU A 30 -0.911 -4.895 0.219 1.00 74.11 H new ATOM 0 HA LEU A 30 -2.775 -2.604 -0.214 1.00 35.51 H new ATOM 0 HB2 LEU A 30 -2.932 -4.409 1.814 1.00 31.20 H new ATOM 0 HB3 LEU A 30 -1.711 -3.336 2.471 1.00 31.20 H new ATOM 0 HG LEU A 30 -4.507 -2.544 1.638 1.00 25.21 H new ATOM 0 HD11 LEU A 30 -4.840 -2.228 4.065 1.00 14.14 H new ATOM 0 HD12 LEU A 30 -4.433 -3.912 3.659 1.00 14.14 H new ATOM 0 HD13 LEU A 30 -3.194 -2.840 4.355 1.00 14.14 H new ATOM 0 HD21 LEU A 30 -4.064 -0.396 2.692 1.00 73.32 H new ATOM 0 HD22 LEU A 30 -2.367 -0.872 2.935 1.00 73.32 H new ATOM 0 HD23 LEU A 30 -3.015 -0.696 1.287 1.00 73.32 H new ATOM 442 N ALA A 31 -0.876 -1.039 0.146 1.00 1.21 N ATOM 443 CA ALA A 31 0.252 -0.137 0.138 1.00 64.23 C ATOM 444 C ALA A 31 -0.074 1.102 0.922 1.00 11.11 C ATOM 445 O ALA A 31 -1.235 1.401 1.169 1.00 55.00 O ATOM 446 CB ALA A 31 0.631 0.230 -1.283 1.00 63.23 C ATOM 0 H ALA A 31 -1.765 -0.593 -0.079 1.00 1.21 H new ATOM 0 HA ALA A 31 1.100 -0.639 0.603 1.00 64.23 H new ATOM 0 HB1 ALA A 31 1.483 0.910 -1.268 1.00 63.23 H new ATOM 0 HB2 ALA A 31 0.897 -0.673 -1.833 1.00 63.23 H new ATOM 0 HB3 ALA A 31 -0.214 0.717 -1.771 1.00 63.23 H new ATOM 452 N HIS A 32 0.945 1.793 1.360 1.00 54.12 N ATOM 453 CA HIS A 32 0.803 3.009 2.144 1.00 31.33 C ATOM 454 C HIS A 32 1.995 3.864 1.845 1.00 61.43 C ATOM 455 O HIS A 32 2.927 3.389 1.211 1.00 62.52 O ATOM 456 CB HIS A 32 0.874 2.692 3.640 1.00 35.34 C ATOM 457 CG HIS A 32 -0.023 1.614 4.110 1.00 71.32 C ATOM 458 ND1 HIS A 32 0.425 0.338 4.367 1.00 20.44 N ATOM 459 CD2 HIS A 32 -1.336 1.611 4.376 1.00 54.01 C ATOM 460 CE1 HIS A 32 -0.574 -0.396 4.769 1.00 50.12 C ATOM 461 NE2 HIS A 32 -1.660 0.351 4.785 1.00 3.11 N ATOM 0 H HIS A 32 1.915 1.530 1.184 1.00 54.12 H new ATOM 0 HA HIS A 32 -0.147 3.486 1.903 1.00 31.33 H new ATOM 0 HB2 HIS A 32 1.900 2.419 3.887 1.00 35.34 H new ATOM 0 HB3 HIS A 32 0.643 3.600 4.197 1.00 35.34 H new ATOM 0 HD2 HIS A 32 -2.011 2.449 4.284 1.00 54.01 H new ATOM 0 HE1 HIS A 32 -0.521 -1.439 5.043 1.00 50.12 H new ATOM 0 HE2 HIS A 32 -2.591 0.038 5.059 1.00 3.11 H new ATOM 470 N CYS A 33 1.990 5.083 2.303 1.00 53.50 N ATOM 471 CA CYS A 33 3.155 5.920 2.177 1.00 12.31 C ATOM 472 C CYS A 33 3.676 6.222 3.575 1.00 4.15 C ATOM 473 O CYS A 33 2.886 6.570 4.474 1.00 14.12 O ATOM 474 CB CYS A 33 2.809 7.212 1.428 1.00 43.13 C ATOM 475 SG CYS A 33 1.525 8.214 2.213 1.00 3.12 S ATOM 0 H CYS A 33 1.195 5.522 2.767 1.00 53.50 H new ATOM 0 HA CYS A 33 3.926 5.408 1.601 1.00 12.31 H new ATOM 0 HB2 CYS A 33 3.713 7.814 1.331 1.00 43.13 H new ATOM 0 HB3 CYS A 33 2.486 6.956 0.419 1.00 43.13 H new ATOM 0 HG CYS A 33 1.499 7.965 3.489 1.00 3.12 H new ATOM 481 N ILE A 34 4.974 6.087 3.770 1.00 70.12 N ATOM 482 CA ILE A 34 5.597 6.304 5.067 1.00 15.33 C ATOM 483 C ILE A 34 6.961 6.939 4.883 1.00 74.44 C ATOM 484 O ILE A 34 7.458 7.067 3.756 1.00 64.42 O ATOM 485 CB ILE A 34 5.786 5.010 5.924 1.00 31.14 C ATOM 486 CG1 ILE A 34 6.757 4.060 5.250 1.00 53.34 C ATOM 487 CG2 ILE A 34 4.457 4.325 6.211 1.00 11.22 C ATOM 488 CD1 ILE A 34 7.210 2.926 6.137 1.00 42.31 C ATOM 0 H ILE A 34 5.629 5.823 3.034 1.00 70.12 H new ATOM 0 HA ILE A 34 4.908 6.953 5.607 1.00 15.33 H new ATOM 0 HB ILE A 34 6.208 5.307 6.884 1.00 31.14 H new ATOM 0 HG12 ILE A 34 6.287 3.646 4.358 1.00 53.34 H new ATOM 0 HG13 ILE A 34 7.630 4.622 4.919 1.00 53.34 H new ATOM 0 HG21 ILE A 34 4.631 3.430 6.809 1.00 11.22 H new ATOM 0 HG22 ILE A 34 3.807 5.007 6.759 1.00 11.22 H new ATOM 0 HG23 ILE A 34 3.981 4.047 5.271 1.00 11.22 H new ATOM 0 HD11 ILE A 34 7.902 2.288 5.587 1.00 42.31 H new ATOM 0 HD12 ILE A 34 7.710 3.330 7.017 1.00 42.31 H new ATOM 0 HD13 ILE A 34 6.345 2.339 6.448 1.00 42.31 H new ATOM 500 N SER A 35 7.541 7.349 5.970 1.00 72.41 N ATOM 501 CA SER A 35 8.824 7.967 5.968 1.00 74.00 C ATOM 502 C SER A 35 9.957 6.932 6.189 1.00 41.34 C ATOM 503 O SER A 35 9.769 5.939 6.913 1.00 53.23 O ATOM 504 CB SER A 35 8.828 9.057 7.028 1.00 2.24 C ATOM 505 OG SER A 35 8.329 8.565 8.285 1.00 52.22 O ATOM 0 H SER A 35 7.125 7.260 6.897 1.00 72.41 H new ATOM 0 HA SER A 35 9.018 8.413 4.993 1.00 74.00 H new ATOM 0 HB2 SER A 35 9.842 9.436 7.160 1.00 2.24 H new ATOM 0 HB3 SER A 35 8.216 9.895 6.694 1.00 2.24 H new ATOM 0 HG SER A 35 8.345 9.286 8.948 1.00 52.22 H new ATOM 511 N GLU A 36 11.127 7.180 5.575 1.00 30.42 N ATOM 512 CA GLU A 36 12.300 6.278 5.670 1.00 11.44 C ATOM 513 C GLU A 36 12.851 6.155 7.072 1.00 31.03 C ATOM 514 O GLU A 36 13.568 5.210 7.382 1.00 12.32 O ATOM 515 CB GLU A 36 13.431 6.679 4.701 1.00 2.41 C ATOM 516 CG GLU A 36 13.846 8.119 4.738 1.00 40.31 C ATOM 517 CD GLU A 36 15.036 8.394 3.847 1.00 2.34 C ATOM 518 OE1 GLU A 36 14.854 8.583 2.623 1.00 52.10 O ATOM 519 OE2 GLU A 36 16.170 8.427 4.356 1.00 25.23 O ATOM 0 H GLU A 36 11.291 8.006 5.000 1.00 30.42 H new ATOM 0 HA GLU A 36 11.919 5.300 5.377 1.00 11.44 H new ATOM 0 HB2 GLU A 36 14.304 6.064 4.918 1.00 2.41 H new ATOM 0 HB3 GLU A 36 13.116 6.438 3.686 1.00 2.41 H new ATOM 0 HG2 GLU A 36 13.009 8.744 4.427 1.00 40.31 H new ATOM 0 HG3 GLU A 36 14.089 8.399 5.763 1.00 40.31 H new ATOM 526 N ASP A 37 12.538 7.102 7.899 1.00 42.31 N ATOM 527 CA ASP A 37 13.008 7.096 9.270 1.00 33.01 C ATOM 528 C ASP A 37 11.996 6.380 10.173 1.00 5.04 C ATOM 529 O ASP A 37 12.262 6.116 11.350 1.00 23.14 O ATOM 530 CB ASP A 37 13.251 8.543 9.715 1.00 11.13 C ATOM 531 CG ASP A 37 13.766 8.677 11.119 1.00 14.13 C ATOM 532 OD1 ASP A 37 14.921 8.313 11.381 1.00 64.25 O ATOM 533 OD2 ASP A 37 13.043 9.208 11.974 1.00 70.15 O ATOM 0 H ASP A 37 11.953 7.902 7.656 1.00 42.31 H new ATOM 0 HA ASP A 37 13.948 6.549 9.346 1.00 33.01 H new ATOM 0 HB2 ASP A 37 13.964 9.006 9.033 1.00 11.13 H new ATOM 0 HB3 ASP A 37 12.318 9.100 9.628 1.00 11.13 H new ATOM 538 N CYS A 38 10.848 6.034 9.579 1.00 24.14 N ATOM 539 CA CYS A 38 9.740 5.382 10.259 1.00 33.35 C ATOM 540 C CYS A 38 9.333 6.077 11.549 1.00 21.44 C ATOM 541 O CYS A 38 9.579 5.590 12.663 1.00 73.24 O ATOM 542 CB CYS A 38 9.953 3.872 10.437 1.00 12.44 C ATOM 543 SG CYS A 38 10.086 2.974 8.871 1.00 64.21 S ATOM 0 H CYS A 38 10.667 6.207 8.590 1.00 24.14 H new ATOM 0 HA CYS A 38 8.886 5.487 9.589 1.00 33.35 H new ATOM 0 HB2 CYS A 38 10.859 3.707 11.020 1.00 12.44 H new ATOM 0 HB3 CYS A 38 9.124 3.461 11.013 1.00 12.44 H new ATOM 0 HG CYS A 38 9.980 3.810 7.881 1.00 64.21 H new ATOM 549 N ARG A 39 8.808 7.269 11.384 1.00 63.32 N ATOM 550 CA ARG A 39 8.287 8.042 12.483 1.00 54.01 C ATOM 551 C ARG A 39 6.971 7.481 12.978 1.00 41.01 C ATOM 552 O ARG A 39 6.772 7.318 14.187 1.00 31.24 O ATOM 553 CB ARG A 39 8.173 9.503 12.086 1.00 24.11 C ATOM 554 CG ARG A 39 9.518 10.189 11.946 1.00 75.33 C ATOM 555 CD ARG A 39 10.183 10.315 13.306 1.00 13.23 C ATOM 556 NE ARG A 39 11.490 10.951 13.241 1.00 21.01 N ATOM 557 CZ ARG A 39 11.814 12.078 13.884 1.00 30.45 C ATOM 558 NH1 ARG A 39 10.864 12.807 14.476 1.00 44.13 N ATOM 559 NH2 ARG A 39 13.075 12.486 13.911 1.00 34.53 N ATOM 0 H ARG A 39 8.731 7.731 10.478 1.00 63.32 H new ATOM 0 HA ARG A 39 8.985 7.976 13.318 1.00 54.01 H new ATOM 0 HB2 ARG A 39 7.635 9.575 11.141 1.00 24.11 H new ATOM 0 HB3 ARG A 39 7.579 10.031 12.832 1.00 24.11 H new ATOM 0 HG2 ARG A 39 10.157 9.619 11.271 1.00 75.33 H new ATOM 0 HG3 ARG A 39 9.387 11.176 11.503 1.00 75.33 H new ATOM 0 HD2 ARG A 39 9.537 10.891 13.969 1.00 13.23 H new ATOM 0 HD3 ARG A 39 10.289 9.324 13.746 1.00 13.23 H new ATOM 0 HE ARG A 39 12.207 10.508 12.667 1.00 21.01 H new ATOM 0 HH11 ARG A 39 9.891 12.504 14.438 1.00 44.13 H new ATOM 0 HH12 ARG A 39 11.112 13.666 14.966 1.00 44.13 H new ATOM 0 HH21 ARG A 39 13.798 11.940 13.441 1.00 34.53 H new ATOM 0 HH22 ARG A 39 13.323 13.346 14.401 1.00 34.53 H new ATOM 573 N MET A 40 6.073 7.183 12.024 1.00 72.04 N ATOM 574 CA MET A 40 4.753 6.597 12.306 1.00 63.20 C ATOM 575 C MET A 40 3.934 7.503 13.238 1.00 14.14 C ATOM 576 O MET A 40 4.217 8.697 13.357 1.00 53.00 O ATOM 577 CB MET A 40 4.903 5.186 12.905 1.00 51.31 C ATOM 578 CG MET A 40 5.612 4.230 12.032 1.00 15.31 C ATOM 579 SD MET A 40 4.772 4.008 10.485 1.00 64.30 S ATOM 580 CE MET A 40 5.783 2.728 9.857 1.00 42.21 C ATOM 0 H MET A 40 6.244 7.343 11.031 1.00 72.04 H new ATOM 0 HA MET A 40 4.212 6.513 11.363 1.00 63.20 H new ATOM 0 HB2 MET A 40 5.437 5.261 13.852 1.00 51.31 H new ATOM 0 HB3 MET A 40 3.912 4.791 13.128 1.00 51.31 H new ATOM 0 HG2 MET A 40 6.625 4.587 11.848 1.00 15.31 H new ATOM 0 HG3 MET A 40 5.700 3.269 12.540 1.00 15.31 H new ATOM 0 HE1 MET A 40 5.424 2.431 8.871 1.00 42.21 H new ATOM 0 HE2 MET A 40 6.811 3.082 9.778 1.00 42.21 H new ATOM 0 HE3 MET A 40 5.745 1.871 10.530 1.00 42.21 H new ATOM 590 N GLY A 41 2.897 6.950 13.841 1.00 63.12 N ATOM 591 CA GLY A 41 2.091 7.712 14.781 1.00 42.21 C ATOM 592 C GLY A 41 1.083 8.607 14.100 1.00 64.11 C ATOM 593 O GLY A 41 0.455 9.452 14.744 1.00 10.02 O ATOM 0 H GLY A 41 2.594 5.986 13.700 1.00 63.12 H new ATOM 0 HA2 GLY A 41 1.568 7.024 15.445 1.00 42.21 H new ATOM 0 HA3 GLY A 41 2.747 8.320 15.404 1.00 42.21 H new ATOM 597 N ALA A 42 0.930 8.437 12.808 1.00 33.44 N ATOM 598 CA ALA A 42 0.001 9.225 12.040 1.00 43.31 C ATOM 599 C ALA A 42 -0.544 8.411 10.892 1.00 2.44 C ATOM 600 O ALA A 42 0.090 7.426 10.460 1.00 45.03 O ATOM 601 CB ALA A 42 0.675 10.488 11.516 1.00 15.10 C ATOM 0 H ALA A 42 1.447 7.748 12.262 1.00 33.44 H new ATOM 0 HA ALA A 42 -0.824 9.518 12.689 1.00 43.31 H new ATOM 0 HB1 ALA A 42 -0.043 11.070 10.938 1.00 15.10 H new ATOM 0 HB2 ALA A 42 1.034 11.084 12.355 1.00 15.10 H new ATOM 0 HB3 ALA A 42 1.516 10.214 10.879 1.00 15.10 H new ATOM 607 N GLY A 43 -1.709 8.806 10.415 1.00 42.02 N ATOM 608 CA GLY A 43 -2.333 8.157 9.285 1.00 42.53 C ATOM 609 C GLY A 43 -2.732 6.730 9.564 1.00 74.15 C ATOM 610 O GLY A 43 -2.908 6.335 10.713 1.00 54.03 O ATOM 0 H GLY A 43 -2.245 9.583 10.800 1.00 42.02 H new ATOM 0 HA2 GLY A 43 -3.217 8.724 8.992 1.00 42.53 H new ATOM 0 HA3 GLY A 43 -1.646 8.176 8.439 1.00 42.53 H new ATOM 614 N ILE A 44 -2.875 5.962 8.520 1.00 1.42 N ATOM 615 CA ILE A 44 -3.227 4.559 8.632 1.00 71.20 C ATOM 616 C ILE A 44 -1.980 3.717 8.971 1.00 12.42 C ATOM 617 O ILE A 44 -2.079 2.559 9.367 1.00 3.45 O ATOM 618 CB ILE A 44 -3.900 4.066 7.323 1.00 65.25 C ATOM 619 CG1 ILE A 44 -4.382 2.618 7.434 1.00 4.14 C ATOM 620 CG2 ILE A 44 -2.948 4.210 6.158 1.00 21.30 C ATOM 621 CD1 ILE A 44 -5.229 2.193 6.289 1.00 52.50 C ATOM 0 H ILE A 44 -2.752 6.285 7.560 1.00 1.42 H new ATOM 0 HA ILE A 44 -3.943 4.439 9.445 1.00 71.20 H new ATOM 0 HB ILE A 44 -4.777 4.691 7.153 1.00 65.25 H new ATOM 0 HG12 ILE A 44 -3.517 1.958 7.502 1.00 4.14 H new ATOM 0 HG13 ILE A 44 -4.947 2.500 8.359 1.00 4.14 H new ATOM 0 HG21 ILE A 44 -3.433 3.861 5.247 1.00 21.30 H new ATOM 0 HG22 ILE A 44 -2.670 5.258 6.042 1.00 21.30 H new ATOM 0 HG23 ILE A 44 -2.053 3.616 6.344 1.00 21.30 H new ATOM 0 HD11 ILE A 44 -5.537 1.157 6.429 1.00 52.50 H new ATOM 0 HD12 ILE A 44 -6.112 2.830 6.233 1.00 52.50 H new ATOM 0 HD13 ILE A 44 -4.660 2.280 5.363 1.00 52.50 H new ATOM 633 N ALA A 45 -0.810 4.328 8.838 1.00 4.40 N ATOM 634 CA ALA A 45 0.447 3.643 9.102 1.00 64.25 C ATOM 635 C ALA A 45 0.580 3.297 10.576 1.00 11.21 C ATOM 636 O ALA A 45 1.181 2.284 10.930 1.00 14.22 O ATOM 637 CB ALA A 45 1.625 4.481 8.648 1.00 51.22 C ATOM 0 H ALA A 45 -0.706 5.300 8.548 1.00 4.40 H new ATOM 0 HA ALA A 45 0.445 2.714 8.532 1.00 64.25 H new ATOM 0 HB1 ALA A 45 2.553 3.948 8.856 1.00 51.22 H new ATOM 0 HB2 ALA A 45 1.547 4.669 7.577 1.00 51.22 H new ATOM 0 HB3 ALA A 45 1.624 5.430 9.184 1.00 51.22 H new ATOM 643 N VAL A 46 -0.009 4.127 11.437 1.00 71.24 N ATOM 644 CA VAL A 46 0.039 3.876 12.863 1.00 34.33 C ATOM 645 C VAL A 46 -0.704 2.581 13.196 1.00 53.34 C ATOM 646 O VAL A 46 -0.255 1.787 14.019 1.00 31.40 O ATOM 647 CB VAL A 46 -0.506 5.071 13.698 1.00 24.35 C ATOM 648 CG1 VAL A 46 -1.979 5.342 13.455 1.00 72.21 C ATOM 649 CG2 VAL A 46 -0.211 4.899 15.167 1.00 33.11 C ATOM 0 H VAL A 46 -0.518 4.969 11.168 1.00 71.24 H new ATOM 0 HA VAL A 46 1.087 3.762 13.140 1.00 34.33 H new ATOM 0 HB VAL A 46 0.028 5.955 13.349 1.00 24.35 H new ATOM 0 HG11 VAL A 46 -2.299 6.186 14.066 1.00 72.21 H new ATOM 0 HG12 VAL A 46 -2.137 5.575 12.402 1.00 72.21 H new ATOM 0 HG13 VAL A 46 -2.560 4.460 13.723 1.00 72.21 H new ATOM 0 HG21 VAL A 46 -0.606 5.752 15.720 1.00 33.11 H new ATOM 0 HG22 VAL A 46 -0.681 3.984 15.528 1.00 33.11 H new ATOM 0 HG23 VAL A 46 0.867 4.837 15.317 1.00 33.11 H new ATOM 659 N LEU A 47 -1.812 2.374 12.511 1.00 40.22 N ATOM 660 CA LEU A 47 -2.615 1.158 12.635 1.00 74.05 C ATOM 661 C LEU A 47 -1.788 -0.072 12.296 1.00 13.02 C ATOM 662 O LEU A 47 -1.820 -1.070 13.009 1.00 32.43 O ATOM 663 CB LEU A 47 -3.856 1.241 11.727 1.00 0.05 C ATOM 664 CG LEU A 47 -4.952 2.224 12.163 1.00 22.10 C ATOM 665 CD1 LEU A 47 -5.967 2.412 11.049 1.00 71.24 C ATOM 666 CD2 LEU A 47 -5.666 1.681 13.388 1.00 54.13 C ATOM 0 H LEU A 47 -2.189 3.048 11.845 1.00 40.22 H new ATOM 0 HA LEU A 47 -2.946 1.070 13.670 1.00 74.05 H new ATOM 0 HB2 LEU A 47 -3.529 1.516 10.724 1.00 0.05 H new ATOM 0 HB3 LEU A 47 -4.296 0.246 11.657 1.00 0.05 H new ATOM 0 HG LEU A 47 -4.486 3.182 12.394 1.00 22.10 H new ATOM 0 HD11 LEU A 47 -6.738 3.111 11.373 1.00 71.24 H new ATOM 0 HD12 LEU A 47 -5.467 2.807 10.164 1.00 71.24 H new ATOM 0 HD13 LEU A 47 -6.426 1.453 10.809 1.00 71.24 H new ATOM 0 HD21 LEU A 47 -6.443 2.380 13.696 1.00 54.13 H new ATOM 0 HD22 LEU A 47 -6.118 0.718 13.149 1.00 54.13 H new ATOM 0 HD23 LEU A 47 -4.950 1.554 14.200 1.00 54.13 H new ATOM 678 N PHE A 48 -1.003 0.023 11.244 1.00 45.40 N ATOM 679 CA PHE A 48 -0.200 -1.101 10.808 1.00 12.43 C ATOM 680 C PHE A 48 1.023 -1.320 11.677 1.00 33.14 C ATOM 681 O PHE A 48 1.430 -2.471 11.908 1.00 71.42 O ATOM 682 CB PHE A 48 0.151 -1.004 9.319 1.00 25.22 C ATOM 683 CG PHE A 48 -1.023 -1.280 8.411 1.00 14.21 C ATOM 684 CD1 PHE A 48 -2.093 -0.409 8.340 1.00 22.33 C ATOM 685 CD2 PHE A 48 -1.053 -2.427 7.636 1.00 64.51 C ATOM 686 CE1 PHE A 48 -3.167 -0.677 7.523 1.00 15.53 C ATOM 687 CE2 PHE A 48 -2.127 -2.697 6.810 1.00 11.53 C ATOM 688 CZ PHE A 48 -3.184 -1.817 6.759 1.00 11.54 C ATOM 0 H PHE A 48 -0.903 0.864 10.676 1.00 45.40 H new ATOM 0 HA PHE A 48 -0.817 -1.991 10.933 1.00 12.43 H new ATOM 0 HB2 PHE A 48 0.538 -0.007 9.108 1.00 25.22 H new ATOM 0 HB3 PHE A 48 0.950 -1.711 9.094 1.00 25.22 H new ATOM 0 HD1 PHE A 48 -2.086 0.493 8.933 1.00 22.33 H new ATOM 0 HD2 PHE A 48 -0.226 -3.120 7.678 1.00 64.51 H new ATOM 0 HE1 PHE A 48 -3.998 0.011 7.483 1.00 15.53 H new ATOM 0 HE2 PHE A 48 -2.137 -3.593 6.208 1.00 11.53 H new ATOM 0 HZ PHE A 48 -4.028 -2.024 6.117 1.00 11.54 H new ATOM 698 N LYS A 49 1.598 -0.241 12.201 1.00 34.21 N ATOM 699 CA LYS A 49 2.771 -0.386 13.043 1.00 11.43 C ATOM 700 C LYS A 49 2.373 -1.004 14.374 1.00 12.24 C ATOM 701 O LYS A 49 3.143 -1.740 14.982 1.00 31.44 O ATOM 702 CB LYS A 49 3.566 0.956 13.194 1.00 5.13 C ATOM 703 CG LYS A 49 3.004 2.050 14.125 1.00 15.22 C ATOM 704 CD LYS A 49 3.337 1.777 15.598 1.00 1.13 C ATOM 705 CE LYS A 49 2.855 2.900 16.518 1.00 60.15 C ATOM 706 NZ LYS A 49 3.218 2.653 17.937 1.00 74.33 N ATOM 0 H LYS A 49 1.278 0.717 12.060 1.00 34.21 H new ATOM 0 HA LYS A 49 3.469 -1.068 12.557 1.00 11.43 H new ATOM 0 HB2 LYS A 49 4.569 0.709 13.543 1.00 5.13 H new ATOM 0 HB3 LYS A 49 3.672 1.391 12.200 1.00 5.13 H new ATOM 0 HG2 LYS A 49 3.412 3.018 13.834 1.00 15.22 H new ATOM 0 HG3 LYS A 49 1.923 2.110 14.003 1.00 15.22 H new ATOM 0 HD2 LYS A 49 2.878 0.837 15.904 1.00 1.13 H new ATOM 0 HD3 LYS A 49 4.415 1.657 15.709 1.00 1.13 H new ATOM 0 HE2 LYS A 49 3.288 3.846 16.193 1.00 60.15 H new ATOM 0 HE3 LYS A 49 1.773 2.999 16.433 1.00 60.15 H new ATOM 0 HZ1 LYS A 49 2.872 3.438 18.525 1.00 74.33 H new ATOM 0 HZ2 LYS A 49 2.784 1.764 18.257 1.00 74.33 H new ATOM 0 HZ3 LYS A 49 4.252 2.584 18.024 1.00 74.33 H new ATOM 720 N LYS A 50 1.166 -0.701 14.816 1.00 50.31 N ATOM 721 CA LYS A 50 0.635 -1.288 16.014 1.00 52.34 C ATOM 722 C LYS A 50 0.226 -2.740 15.823 1.00 30.53 C ATOM 723 O LYS A 50 0.643 -3.618 16.587 1.00 41.45 O ATOM 724 CB LYS A 50 -0.512 -0.486 16.553 1.00 41.40 C ATOM 725 CG LYS A 50 -0.096 0.899 16.979 1.00 24.50 C ATOM 726 CD LYS A 50 -1.190 1.585 17.720 1.00 35.25 C ATOM 727 CE LYS A 50 -2.436 1.744 16.872 1.00 11.42 C ATOM 728 NZ LYS A 50 -3.541 2.387 17.622 1.00 44.30 N ATOM 0 H LYS A 50 0.537 -0.045 14.353 1.00 50.31 H new ATOM 0 HA LYS A 50 1.443 -1.274 16.745 1.00 52.34 H new ATOM 0 HB2 LYS A 50 -1.289 -0.411 15.792 1.00 41.40 H new ATOM 0 HB3 LYS A 50 -0.949 -1.009 17.404 1.00 41.40 H new ATOM 0 HG2 LYS A 50 0.791 0.837 17.609 1.00 24.50 H new ATOM 0 HG3 LYS A 50 0.176 1.486 16.102 1.00 24.50 H new ATOM 0 HD2 LYS A 50 -1.432 1.016 18.618 1.00 35.25 H new ATOM 0 HD3 LYS A 50 -0.846 2.566 18.048 1.00 35.25 H new ATOM 0 HE2 LYS A 50 -2.201 2.341 15.991 1.00 11.42 H new ATOM 0 HE3 LYS A 50 -2.760 0.766 16.517 1.00 11.42 H new ATOM 0 HZ1 LYS A 50 -4.373 2.476 17.005 1.00 44.30 H new ATOM 0 HZ2 LYS A 50 -3.784 1.805 18.449 1.00 44.30 H new ATOM 0 HZ3 LYS A 50 -3.242 3.331 17.939 1.00 44.30 H new ATOM 742 N LYS A 51 -0.556 -2.999 14.784 1.00 43.13 N ATOM 743 CA LYS A 51 -1.087 -4.322 14.548 1.00 31.12 C ATOM 744 C LYS A 51 -0.066 -5.341 14.071 1.00 13.21 C ATOM 745 O LYS A 51 -0.052 -6.474 14.553 1.00 51.33 O ATOM 746 CB LYS A 51 -2.266 -4.280 13.608 1.00 50.11 C ATOM 747 CG LYS A 51 -3.457 -3.544 14.170 1.00 65.35 C ATOM 748 CD LYS A 51 -4.610 -3.623 13.218 1.00 72.15 C ATOM 749 CE LYS A 51 -5.837 -2.898 13.745 1.00 74.02 C ATOM 750 NZ LYS A 51 -6.312 -3.472 15.024 1.00 12.44 N ATOM 0 H LYS A 51 -0.834 -2.303 14.092 1.00 43.13 H new ATOM 0 HA LYS A 51 -1.414 -4.668 15.529 1.00 31.12 H new ATOM 0 HB2 LYS A 51 -1.961 -3.804 12.676 1.00 50.11 H new ATOM 0 HB3 LYS A 51 -2.562 -5.300 13.363 1.00 50.11 H new ATOM 0 HG2 LYS A 51 -3.739 -3.974 15.131 1.00 65.35 H new ATOM 0 HG3 LYS A 51 -3.197 -2.501 14.352 1.00 65.35 H new ATOM 0 HD2 LYS A 51 -4.319 -3.192 12.260 1.00 72.15 H new ATOM 0 HD3 LYS A 51 -4.858 -4.669 13.035 1.00 72.15 H new ATOM 0 HE2 LYS A 51 -5.602 -1.843 13.886 1.00 74.02 H new ATOM 0 HE3 LYS A 51 -6.635 -2.951 13.005 1.00 74.02 H new ATOM 0 HZ1 LYS A 51 -7.262 -3.105 15.238 1.00 12.44 H new ATOM 0 HZ2 LYS A 51 -6.350 -4.508 14.946 1.00 12.44 H new ATOM 0 HZ3 LYS A 51 -5.658 -3.206 15.788 1.00 12.44 H new ATOM 764 N PHE A 52 0.783 -4.972 13.138 1.00 24.55 N ATOM 765 CA PHE A 52 1.739 -5.940 12.629 1.00 64.02 C ATOM 766 C PHE A 52 3.096 -5.787 13.277 1.00 12.24 C ATOM 767 O PHE A 52 3.870 -6.737 13.321 1.00 72.33 O ATOM 768 CB PHE A 52 1.852 -5.883 11.101 1.00 24.50 C ATOM 769 CG PHE A 52 0.558 -6.174 10.390 1.00 24.45 C ATOM 770 CD1 PHE A 52 -0.064 -7.402 10.533 1.00 72.24 C ATOM 771 CD2 PHE A 52 -0.026 -5.226 9.573 1.00 4.33 C ATOM 772 CE1 PHE A 52 -1.248 -7.676 9.877 1.00 64.11 C ATOM 773 CE2 PHE A 52 -1.210 -5.496 8.916 1.00 1.42 C ATOM 774 CZ PHE A 52 -1.821 -6.722 9.068 1.00 73.10 C ATOM 0 H PHE A 52 0.836 -4.041 12.725 1.00 24.55 H new ATOM 0 HA PHE A 52 1.356 -6.925 12.895 1.00 64.02 H new ATOM 0 HB2 PHE A 52 2.204 -4.894 10.808 1.00 24.50 H new ATOM 0 HB3 PHE A 52 2.606 -6.599 10.774 1.00 24.50 H new ATOM 0 HD1 PHE A 52 0.382 -8.155 11.165 1.00 72.24 H new ATOM 0 HD2 PHE A 52 0.448 -4.264 9.447 1.00 4.33 H new ATOM 0 HE1 PHE A 52 -1.724 -8.638 9.999 1.00 64.11 H new ATOM 0 HE2 PHE A 52 -1.658 -4.745 8.282 1.00 1.42 H new ATOM 0 HZ PHE A 52 -2.747 -6.933 8.554 1.00 73.10 H new ATOM 784 N GLY A 53 3.367 -4.598 13.800 1.00 50.30 N ATOM 785 CA GLY A 53 4.636 -4.336 14.462 1.00 33.15 C ATOM 786 C GLY A 53 5.819 -4.615 13.568 1.00 62.45 C ATOM 787 O GLY A 53 6.703 -5.393 13.922 1.00 0.15 O ATOM 0 H GLY A 53 2.727 -3.804 13.778 1.00 50.30 H new ATOM 0 HA2 GLY A 53 4.666 -3.296 14.786 1.00 33.15 H new ATOM 0 HA3 GLY A 53 4.709 -4.951 15.359 1.00 33.15 H new ATOM 791 N GLY A 54 5.839 -3.996 12.414 1.00 53.53 N ATOM 792 CA GLY A 54 6.904 -4.245 11.474 1.00 2.30 C ATOM 793 C GLY A 54 7.798 -3.048 11.271 1.00 73.02 C ATOM 794 O GLY A 54 8.310 -2.846 10.184 1.00 43.24 O ATOM 0 H GLY A 54 5.138 -3.323 12.105 1.00 53.53 H new ATOM 0 HA2 GLY A 54 7.504 -5.085 11.826 1.00 2.30 H new ATOM 0 HA3 GLY A 54 6.475 -4.539 10.516 1.00 2.30 H new ATOM 798 N VAL A 55 8.006 -2.262 12.323 1.00 60.31 N ATOM 799 CA VAL A 55 8.827 -1.060 12.230 1.00 15.13 C ATOM 800 C VAL A 55 10.285 -1.432 11.935 1.00 2.03 C ATOM 801 O VAL A 55 10.926 -0.851 11.053 1.00 23.43 O ATOM 802 CB VAL A 55 8.744 -0.203 13.526 1.00 43.14 C ATOM 803 CG1 VAL A 55 9.594 1.050 13.407 1.00 60.02 C ATOM 804 CG2 VAL A 55 7.298 0.168 13.830 1.00 12.45 C ATOM 0 H VAL A 55 7.617 -2.436 13.250 1.00 60.31 H new ATOM 0 HA VAL A 55 8.437 -0.459 11.409 1.00 15.13 H new ATOM 0 HB VAL A 55 9.133 -0.802 14.349 1.00 43.14 H new ATOM 0 HG11 VAL A 55 9.517 1.630 14.327 1.00 60.02 H new ATOM 0 HG12 VAL A 55 10.634 0.770 13.240 1.00 60.02 H new ATOM 0 HG13 VAL A 55 9.241 1.651 12.569 1.00 60.02 H new ATOM 0 HG21 VAL A 55 7.260 0.767 14.740 1.00 12.45 H new ATOM 0 HG22 VAL A 55 6.887 0.742 13.000 1.00 12.45 H new ATOM 0 HG23 VAL A 55 6.711 -0.740 13.968 1.00 12.45 H new ATOM 814 N GLN A 56 10.786 -2.427 12.644 1.00 1.43 N ATOM 815 CA GLN A 56 12.128 -2.898 12.446 1.00 51.13 C ATOM 816 C GLN A 56 12.234 -3.602 11.130 1.00 51.43 C ATOM 817 O GLN A 56 13.224 -3.483 10.452 1.00 71.14 O ATOM 818 CB GLN A 56 12.577 -3.821 13.580 1.00 32.31 C ATOM 819 CG GLN A 56 12.864 -3.170 14.940 1.00 41.43 C ATOM 820 CD GLN A 56 11.707 -2.379 15.512 1.00 41.51 C ATOM 821 OE1 GLN A 56 10.850 -2.922 16.194 1.00 23.15 O ATOM 822 NE2 GLN A 56 11.704 -1.089 15.285 1.00 21.35 N ATOM 0 H GLN A 56 10.269 -2.924 13.369 1.00 1.43 H new ATOM 0 HA GLN A 56 12.790 -2.032 12.446 1.00 51.13 H new ATOM 0 HB2 GLN A 56 11.807 -4.579 13.724 1.00 32.31 H new ATOM 0 HB3 GLN A 56 13.479 -4.340 13.256 1.00 32.31 H new ATOM 0 HG2 GLN A 56 13.142 -3.949 15.650 1.00 41.43 H new ATOM 0 HG3 GLN A 56 13.725 -2.509 14.838 1.00 41.43 H new ATOM 0 HE21 GLN A 56 12.436 -0.671 14.711 1.00 21.35 H new ATOM 0 HE22 GLN A 56 10.970 -0.503 15.683 1.00 21.35 H new ATOM 831 N GLU A 57 11.184 -4.312 10.755 1.00 4.04 N ATOM 832 CA GLU A 57 11.169 -5.029 9.485 1.00 24.04 C ATOM 833 C GLU A 57 11.328 -4.072 8.305 1.00 52.15 C ATOM 834 O GLU A 57 11.966 -4.398 7.309 1.00 64.20 O ATOM 835 CB GLU A 57 9.903 -5.867 9.317 1.00 11.14 C ATOM 836 CG GLU A 57 9.724 -6.948 10.361 1.00 5.52 C ATOM 837 CD GLU A 57 8.559 -7.851 10.052 1.00 30.15 C ATOM 838 OE1 GLU A 57 8.713 -8.742 9.198 1.00 50.51 O ATOM 839 OE2 GLU A 57 7.472 -7.691 10.653 1.00 33.13 O ATOM 0 H GLU A 57 10.332 -4.409 11.307 1.00 4.04 H new ATOM 0 HA GLU A 57 12.021 -5.708 9.499 1.00 24.04 H new ATOM 0 HB2 GLU A 57 9.038 -5.205 9.345 1.00 11.14 H new ATOM 0 HB3 GLU A 57 9.917 -6.331 8.331 1.00 11.14 H new ATOM 0 HG2 GLU A 57 10.635 -7.543 10.425 1.00 5.52 H new ATOM 0 HG3 GLU A 57 9.575 -6.487 11.337 1.00 5.52 H new ATOM 846 N LEU A 58 10.761 -2.898 8.427 1.00 21.25 N ATOM 847 CA LEU A 58 10.862 -1.889 7.393 1.00 53.14 C ATOM 848 C LEU A 58 12.264 -1.293 7.365 1.00 53.44 C ATOM 849 O LEU A 58 12.879 -1.167 6.297 1.00 61.41 O ATOM 850 CB LEU A 58 9.814 -0.805 7.616 1.00 14.42 C ATOM 851 CG LEU A 58 8.365 -1.290 7.616 1.00 0.10 C ATOM 852 CD1 LEU A 58 7.414 -0.152 7.909 1.00 24.22 C ATOM 853 CD2 LEU A 58 8.020 -1.951 6.294 1.00 24.22 C ATOM 0 H LEU A 58 10.217 -2.612 9.241 1.00 21.25 H new ATOM 0 HA LEU A 58 10.675 -2.355 6.426 1.00 53.14 H new ATOM 0 HB2 LEU A 58 10.017 -0.317 8.569 1.00 14.42 H new ATOM 0 HB3 LEU A 58 9.927 -0.048 6.840 1.00 14.42 H new ATOM 0 HG LEU A 58 8.258 -2.032 8.407 1.00 0.10 H new ATOM 0 HD11 LEU A 58 6.389 -0.524 7.903 1.00 24.22 H new ATOM 0 HD12 LEU A 58 7.642 0.270 8.888 1.00 24.22 H new ATOM 0 HD13 LEU A 58 7.524 0.620 7.147 1.00 24.22 H new ATOM 0 HD21 LEU A 58 6.984 -2.289 6.316 1.00 24.22 H new ATOM 0 HD22 LEU A 58 8.151 -1.234 5.484 1.00 24.22 H new ATOM 0 HD23 LEU A 58 8.677 -2.806 6.132 1.00 24.22 H new ATOM 865 N LEU A 59 12.776 -0.962 8.536 1.00 54.31 N ATOM 866 CA LEU A 59 14.103 -0.387 8.652 1.00 62.23 C ATOM 867 C LEU A 59 15.206 -1.381 8.312 1.00 61.13 C ATOM 868 O LEU A 59 16.182 -1.019 7.671 1.00 41.30 O ATOM 869 CB LEU A 59 14.319 0.262 10.018 1.00 53.13 C ATOM 870 CG LEU A 59 13.439 1.486 10.317 1.00 34.13 C ATOM 871 CD1 LEU A 59 13.718 2.025 11.702 1.00 41.03 C ATOM 872 CD2 LEU A 59 13.666 2.575 9.280 1.00 62.31 C ATOM 0 H LEU A 59 12.290 -1.082 9.425 1.00 54.31 H new ATOM 0 HA LEU A 59 14.165 0.403 7.904 1.00 62.23 H new ATOM 0 HB2 LEU A 59 14.142 -0.488 10.789 1.00 53.13 H new ATOM 0 HB3 LEU A 59 15.364 0.560 10.098 1.00 53.13 H new ATOM 0 HG LEU A 59 12.397 1.169 10.272 1.00 34.13 H new ATOM 0 HD11 LEU A 59 13.083 2.891 11.890 1.00 41.03 H new ATOM 0 HD12 LEU A 59 13.508 1.253 12.442 1.00 41.03 H new ATOM 0 HD13 LEU A 59 14.765 2.320 11.773 1.00 41.03 H new ATOM 0 HD21 LEU A 59 13.034 3.433 9.509 1.00 62.31 H new ATOM 0 HD22 LEU A 59 14.712 2.880 9.296 1.00 62.31 H new ATOM 0 HD23 LEU A 59 13.415 2.193 8.290 1.00 62.31 H new ATOM 884 N ASN A 60 15.048 -2.636 8.717 1.00 50.42 N ATOM 885 CA ASN A 60 16.027 -3.686 8.386 1.00 3.25 C ATOM 886 C ASN A 60 16.102 -3.940 6.883 1.00 20.41 C ATOM 887 O ASN A 60 17.140 -4.355 6.367 1.00 51.14 O ATOM 888 CB ASN A 60 15.754 -4.986 9.149 1.00 14.40 C ATOM 889 CG ASN A 60 15.982 -4.852 10.647 1.00 0.54 C ATOM 890 OD1 ASN A 60 16.841 -4.083 11.097 1.00 22.13 O ATOM 891 ND2 ASN A 60 15.207 -5.564 11.427 1.00 12.00 N ATOM 0 H ASN A 60 14.257 -2.959 9.274 1.00 50.42 H new ATOM 0 HA ASN A 60 17.000 -3.315 8.707 1.00 3.25 H new ATOM 0 HB2 ASN A 60 14.725 -5.297 8.970 1.00 14.40 H new ATOM 0 HB3 ASN A 60 16.398 -5.773 8.757 1.00 14.40 H new ATOM 0 HD21 ASN A 60 15.301 -5.495 12.440 1.00 12.00 H new ATOM 0 HD22 ASN A 60 14.509 -6.188 11.021 1.00 12.00 H new ATOM 898 N GLN A 61 15.007 -3.686 6.180 1.00 22.14 N ATOM 899 CA GLN A 61 15.003 -3.781 4.721 1.00 22.12 C ATOM 900 C GLN A 61 15.670 -2.558 4.103 1.00 62.55 C ATOM 901 O GLN A 61 16.017 -2.566 2.924 1.00 55.22 O ATOM 902 CB GLN A 61 13.583 -3.939 4.165 1.00 41.50 C ATOM 903 CG GLN A 61 12.931 -5.272 4.475 1.00 42.51 C ATOM 904 CD GLN A 61 11.520 -5.366 3.925 1.00 42.13 C ATOM 905 OE1 GLN A 61 11.305 -5.783 2.796 1.00 44.55 O ATOM 906 NE2 GLN A 61 10.555 -4.988 4.716 1.00 2.45 N ATOM 0 H GLN A 61 14.114 -3.414 6.590 1.00 22.14 H new ATOM 0 HA GLN A 61 15.570 -4.673 4.453 1.00 22.12 H new ATOM 0 HB2 GLN A 61 12.958 -3.141 4.567 1.00 41.50 H new ATOM 0 HB3 GLN A 61 13.613 -3.806 3.084 1.00 41.50 H new ATOM 0 HG2 GLN A 61 13.536 -6.076 4.056 1.00 42.51 H new ATOM 0 HG3 GLN A 61 12.908 -5.420 5.555 1.00 42.51 H new ATOM 0 HE21 GLN A 61 10.768 -4.645 5.653 1.00 2.45 H new ATOM 0 HE22 GLN A 61 9.587 -5.036 4.398 1.00 2.45 H new ATOM 915 N GLN A 62 15.836 -1.526 4.929 1.00 53.42 N ATOM 916 CA GLN A 62 16.391 -0.254 4.615 1.00 61.30 C ATOM 917 C GLN A 62 15.982 0.290 3.263 1.00 61.31 C ATOM 918 O GLN A 62 16.697 0.153 2.266 1.00 13.20 O ATOM 919 CB GLN A 62 17.880 -0.191 4.824 1.00 21.41 C ATOM 920 CG GLN A 62 18.327 1.224 4.911 1.00 70.52 C ATOM 921 CD GLN A 62 19.813 1.392 5.065 1.00 24.41 C ATOM 922 OE1 GLN A 62 20.542 1.498 4.075 1.00 43.40 O ATOM 923 NE2 GLN A 62 20.280 1.425 6.282 1.00 24.24 N ATOM 0 H GLN A 62 15.556 -1.585 5.908 1.00 53.42 H new ATOM 0 HA GLN A 62 15.941 0.419 5.344 1.00 61.30 H new ATOM 0 HB2 GLN A 62 18.149 -0.722 5.737 1.00 21.41 H new ATOM 0 HB3 GLN A 62 18.391 -0.692 4.002 1.00 21.41 H new ATOM 0 HG2 GLN A 62 18.004 1.751 4.013 1.00 70.52 H new ATOM 0 HG3 GLN A 62 17.829 1.699 5.756 1.00 70.52 H new ATOM 0 HE21 GLN A 62 19.645 1.334 7.075 1.00 24.24 H new ATOM 0 HE22 GLN A 62 21.281 1.542 6.441 1.00 24.24 H new ATOM 932 N LYS A 63 14.816 0.832 3.217 1.00 34.52 N ATOM 933 CA LYS A 63 14.323 1.459 2.042 1.00 33.34 C ATOM 934 C LYS A 63 14.254 2.926 2.271 1.00 62.02 C ATOM 935 O LYS A 63 13.750 3.387 3.301 1.00 35.21 O ATOM 936 CB LYS A 63 12.983 0.876 1.697 1.00 44.43 C ATOM 937 CG LYS A 63 13.098 -0.578 1.330 1.00 62.44 C ATOM 938 CD LYS A 63 13.638 -0.768 -0.081 1.00 14.50 C ATOM 939 CE LYS A 63 13.889 -2.236 -0.409 1.00 75.01 C ATOM 940 NZ LYS A 63 15.007 -2.796 0.377 1.00 43.41 N ATOM 0 H LYS A 63 14.169 0.853 4.005 1.00 34.52 H new ATOM 0 HA LYS A 63 14.988 1.282 1.197 1.00 33.34 H new ATOM 0 HB2 LYS A 63 12.307 0.987 2.545 1.00 44.43 H new ATOM 0 HB3 LYS A 63 12.546 1.430 0.866 1.00 44.43 H new ATOM 0 HG2 LYS A 63 13.754 -1.081 2.040 1.00 62.44 H new ATOM 0 HG3 LYS A 63 12.119 -1.051 1.411 1.00 62.44 H new ATOM 0 HD2 LYS A 63 12.930 -0.353 -0.798 1.00 14.50 H new ATOM 0 HD3 LYS A 63 14.567 -0.209 -0.191 1.00 14.50 H new ATOM 0 HE2 LYS A 63 12.984 -2.811 -0.213 1.00 75.01 H new ATOM 0 HE3 LYS A 63 14.107 -2.338 -1.472 1.00 75.01 H new ATOM 0 HZ1 LYS A 63 15.068 -3.821 0.212 1.00 43.41 H new ATOM 0 HZ2 LYS A 63 15.897 -2.345 0.085 1.00 43.41 H new ATOM 0 HZ3 LYS A 63 14.844 -2.617 1.388 1.00 43.41 H new ATOM 954 N LYS A 64 14.794 3.644 1.361 1.00 25.12 N ATOM 955 CA LYS A 64 14.843 5.078 1.454 1.00 0.23 C ATOM 956 C LYS A 64 13.845 5.704 0.535 1.00 13.35 C ATOM 957 O LYS A 64 13.196 5.010 -0.240 1.00 51.23 O ATOM 958 CB LYS A 64 16.235 5.604 1.158 1.00 53.41 C ATOM 959 CG LYS A 64 17.305 5.125 2.131 1.00 70.43 C ATOM 960 CD LYS A 64 16.941 5.507 3.545 1.00 34.41 C ATOM 961 CE LYS A 64 17.992 5.107 4.543 1.00 11.34 C ATOM 962 NZ LYS A 64 17.568 5.450 5.915 1.00 11.21 N ATOM 0 H LYS A 64 15.222 3.263 0.517 1.00 25.12 H new ATOM 0 HA LYS A 64 14.591 5.349 2.479 1.00 0.23 H new ATOM 0 HB2 LYS A 64 16.517 5.304 0.149 1.00 53.41 H new ATOM 0 HB3 LYS A 64 16.210 6.694 1.171 1.00 53.41 H new ATOM 0 HG2 LYS A 64 17.415 4.043 2.057 1.00 70.43 H new ATOM 0 HG3 LYS A 64 18.268 5.562 1.866 1.00 70.43 H new ATOM 0 HD2 LYS A 64 16.787 6.585 3.598 1.00 34.41 H new ATOM 0 HD3 LYS A 64 15.995 5.037 3.812 1.00 34.41 H new ATOM 0 HE2 LYS A 64 18.178 4.035 4.472 1.00 11.34 H new ATOM 0 HE3 LYS A 64 18.931 5.610 4.311 1.00 11.34 H new ATOM 0 HZ1 LYS A 64 18.308 5.165 6.588 1.00 11.21 H new ATOM 0 HZ2 LYS A 64 17.413 6.476 5.984 1.00 11.21 H new ATOM 0 HZ3 LYS A 64 16.684 4.950 6.140 1.00 11.21 H new ATOM 976 N SER A 65 13.701 7.005 0.647 1.00 62.30 N ATOM 977 CA SER A 65 12.774 7.754 -0.160 1.00 62.54 C ATOM 978 C SER A 65 12.979 7.523 -1.664 1.00 72.14 C ATOM 979 O SER A 65 13.999 7.922 -2.251 1.00 72.01 O ATOM 980 CB SER A 65 12.798 9.228 0.250 1.00 51.42 C ATOM 981 OG SER A 65 14.131 9.721 0.373 1.00 23.52 O ATOM 0 H SER A 65 14.230 7.575 1.307 1.00 62.30 H new ATOM 0 HA SER A 65 11.767 7.383 0.032 1.00 62.54 H new ATOM 0 HB2 SER A 65 12.258 9.820 -0.489 1.00 51.42 H new ATOM 0 HB3 SER A 65 12.276 9.350 1.199 1.00 51.42 H new ATOM 0 HG SER A 65 14.428 9.632 1.303 1.00 23.52 H new ATOM 987 N GLY A 66 12.005 6.856 -2.265 1.00 50.23 N ATOM 988 CA GLY A 66 12.079 6.484 -3.651 1.00 24.00 C ATOM 989 C GLY A 66 12.074 4.972 -3.817 1.00 54.15 C ATOM 990 O GLY A 66 12.031 4.456 -4.933 1.00 44.15 O ATOM 0 H GLY A 66 11.147 6.563 -1.798 1.00 50.23 H new ATOM 0 HA2 GLY A 66 11.236 6.914 -4.191 1.00 24.00 H new ATOM 0 HA3 GLY A 66 12.985 6.898 -4.093 1.00 24.00 H new ATOM 994 N GLU A 67 12.135 4.266 -2.703 1.00 34.33 N ATOM 995 CA GLU A 67 12.117 2.823 -2.667 1.00 75.43 C ATOM 996 C GLU A 67 10.880 2.358 -1.912 1.00 24.31 C ATOM 997 O GLU A 67 10.257 3.141 -1.189 1.00 53.12 O ATOM 998 CB GLU A 67 13.368 2.285 -1.979 1.00 44.15 C ATOM 999 CG GLU A 67 14.672 2.681 -2.637 1.00 73.13 C ATOM 1000 CD GLU A 67 15.862 2.124 -1.913 1.00 12.41 C ATOM 1001 OE1 GLU A 67 16.216 2.651 -0.846 1.00 63.33 O ATOM 1002 OE2 GLU A 67 16.483 1.153 -2.416 1.00 23.43 O ATOM 0 H GLU A 67 12.200 4.694 -1.779 1.00 34.33 H new ATOM 0 HA GLU A 67 12.095 2.445 -3.689 1.00 75.43 H new ATOM 0 HB2 GLU A 67 13.377 2.635 -0.947 1.00 44.15 H new ATOM 0 HB3 GLU A 67 13.309 1.197 -1.947 1.00 44.15 H new ATOM 0 HG2 GLU A 67 14.678 2.329 -3.669 1.00 73.13 H new ATOM 0 HG3 GLU A 67 14.745 3.768 -2.671 1.00 73.13 H new ATOM 1009 N VAL A 68 10.516 1.115 -2.082 1.00 74.20 N ATOM 1010 CA VAL A 68 9.347 0.588 -1.414 1.00 31.03 C ATOM 1011 C VAL A 68 9.727 -0.605 -0.525 1.00 52.22 C ATOM 1012 O VAL A 68 10.507 -1.479 -0.927 1.00 53.45 O ATOM 1013 CB VAL A 68 8.220 0.176 -2.433 1.00 20.25 C ATOM 1014 CG1 VAL A 68 8.604 -1.024 -3.283 1.00 72.22 C ATOM 1015 CG2 VAL A 68 6.916 -0.079 -1.734 1.00 53.23 C ATOM 0 H VAL A 68 11.008 0.447 -2.675 1.00 74.20 H new ATOM 0 HA VAL A 68 8.945 1.384 -0.787 1.00 31.03 H new ATOM 0 HB VAL A 68 8.098 1.025 -3.106 1.00 20.25 H new ATOM 0 HG11 VAL A 68 7.789 -1.262 -3.966 1.00 72.22 H new ATOM 0 HG12 VAL A 68 9.502 -0.792 -3.856 1.00 72.22 H new ATOM 0 HG13 VAL A 68 8.797 -1.880 -2.637 1.00 72.22 H new ATOM 0 HG21 VAL A 68 6.160 -0.361 -2.466 1.00 53.23 H new ATOM 0 HG22 VAL A 68 7.042 -0.886 -1.013 1.00 53.23 H new ATOM 0 HG23 VAL A 68 6.599 0.825 -1.215 1.00 53.23 H new ATOM 1025 N ALA A 69 9.216 -0.610 0.682 1.00 23.43 N ATOM 1026 CA ALA A 69 9.434 -1.704 1.611 1.00 65.14 C ATOM 1027 C ALA A 69 8.223 -2.610 1.567 1.00 35.20 C ATOM 1028 O ALA A 69 7.104 -2.126 1.377 1.00 11.35 O ATOM 1029 CB ALA A 69 9.664 -1.176 3.019 1.00 2.10 C ATOM 0 H ALA A 69 8.636 0.143 1.053 1.00 23.43 H new ATOM 0 HA ALA A 69 10.325 -2.263 1.325 1.00 65.14 H new ATOM 0 HB1 ALA A 69 9.825 -2.012 3.699 1.00 2.10 H new ATOM 0 HB2 ALA A 69 10.541 -0.528 3.026 1.00 2.10 H new ATOM 0 HB3 ALA A 69 8.791 -0.609 3.342 1.00 2.10 H new ATOM 1035 N VAL A 70 8.419 -3.910 1.719 1.00 60.11 N ATOM 1036 CA VAL A 70 7.303 -4.836 1.592 1.00 32.31 C ATOM 1037 C VAL A 70 7.266 -5.811 2.771 1.00 1.21 C ATOM 1038 O VAL A 70 8.311 -6.280 3.232 1.00 34.15 O ATOM 1039 CB VAL A 70 7.378 -5.659 0.263 1.00 52.44 C ATOM 1040 CG1 VAL A 70 6.142 -6.519 0.078 1.00 53.12 C ATOM 1041 CG2 VAL A 70 7.598 -4.768 -0.957 1.00 34.33 C ATOM 0 H VAL A 70 9.319 -4.342 1.926 1.00 60.11 H new ATOM 0 HA VAL A 70 6.396 -4.231 1.582 1.00 32.31 H new ATOM 0 HB VAL A 70 8.245 -6.314 0.350 1.00 52.44 H new ATOM 0 HG11 VAL A 70 6.224 -7.078 -0.854 1.00 53.12 H new ATOM 0 HG12 VAL A 70 6.055 -7.215 0.912 1.00 53.12 H new ATOM 0 HG13 VAL A 70 5.258 -5.882 0.042 1.00 53.12 H new ATOM 0 HG21 VAL A 70 7.643 -5.385 -1.855 1.00 34.33 H new ATOM 0 HG22 VAL A 70 6.774 -4.060 -1.044 1.00 34.33 H new ATOM 0 HG23 VAL A 70 8.535 -4.222 -0.845 1.00 34.33 H new ATOM 1051 N LEU A 71 6.076 -6.088 3.260 1.00 74.31 N ATOM 1052 CA LEU A 71 5.874 -7.061 4.318 1.00 43.25 C ATOM 1053 C LEU A 71 4.959 -8.168 3.823 1.00 30.34 C ATOM 1054 O LEU A 71 3.850 -7.895 3.354 1.00 73.15 O ATOM 1055 CB LEU A 71 5.242 -6.414 5.567 1.00 33.03 C ATOM 1056 CG LEU A 71 6.039 -5.291 6.246 1.00 41.11 C ATOM 1057 CD1 LEU A 71 5.290 -4.771 7.464 1.00 63.32 C ATOM 1058 CD2 LEU A 71 7.424 -5.774 6.650 1.00 5.25 C ATOM 0 H LEU A 71 5.217 -5.644 2.935 1.00 74.31 H new ATOM 0 HA LEU A 71 6.849 -7.464 4.591 1.00 43.25 H new ATOM 0 HB2 LEU A 71 4.267 -6.016 5.286 1.00 33.03 H new ATOM 0 HB3 LEU A 71 5.066 -7.198 6.303 1.00 33.03 H new ATOM 0 HG LEU A 71 6.155 -4.478 5.529 1.00 41.11 H new ATOM 0 HD11 LEU A 71 5.868 -3.975 7.934 1.00 63.32 H new ATOM 0 HD12 LEU A 71 4.320 -4.381 7.156 1.00 63.32 H new ATOM 0 HD13 LEU A 71 5.145 -5.583 8.176 1.00 63.32 H new ATOM 0 HD21 LEU A 71 7.968 -4.960 7.129 1.00 5.25 H new ATOM 0 HD22 LEU A 71 7.330 -6.607 7.347 1.00 5.25 H new ATOM 0 HD23 LEU A 71 7.968 -6.102 5.764 1.00 5.25 H new ATOM 1070 N LYS A 72 5.410 -9.398 3.909 1.00 71.43 N ATOM 1071 CA LYS A 72 4.581 -10.518 3.529 1.00 63.43 C ATOM 1072 C LYS A 72 3.982 -11.114 4.759 1.00 22.11 C ATOM 1073 O LYS A 72 4.690 -11.516 5.681 1.00 24.41 O ATOM 1074 CB LYS A 72 5.364 -11.580 2.776 1.00 45.11 C ATOM 1075 CG LYS A 72 4.525 -12.787 2.324 1.00 30.23 C ATOM 1076 CD LYS A 72 5.390 -13.837 1.633 1.00 11.21 C ATOM 1077 CE LYS A 72 4.580 -15.054 1.175 1.00 11.31 C ATOM 1078 NZ LYS A 72 3.559 -14.723 0.147 1.00 52.05 N ATOM 0 H LYS A 72 6.343 -9.648 4.237 1.00 71.43 H new ATOM 0 HA LYS A 72 3.802 -10.152 2.859 1.00 63.43 H new ATOM 0 HB2 LYS A 72 5.822 -11.123 1.899 1.00 45.11 H new ATOM 0 HB3 LYS A 72 6.176 -11.935 3.411 1.00 45.11 H new ATOM 0 HG2 LYS A 72 4.030 -13.232 3.187 1.00 30.23 H new ATOM 0 HG3 LYS A 72 3.741 -12.453 1.644 1.00 30.23 H new ATOM 0 HD2 LYS A 72 5.883 -13.387 0.771 1.00 11.21 H new ATOM 0 HD3 LYS A 72 6.175 -14.163 2.315 1.00 11.21 H new ATOM 0 HE2 LYS A 72 5.260 -15.805 0.774 1.00 11.31 H new ATOM 0 HE3 LYS A 72 4.086 -15.500 2.038 1.00 11.31 H new ATOM 0 HZ1 LYS A 72 3.286 -15.588 -0.362 1.00 52.05 H new ATOM 0 HZ2 LYS A 72 2.722 -14.314 0.609 1.00 52.05 H new ATOM 0 HZ3 LYS A 72 3.954 -14.035 -0.526 1.00 52.05 H new ATOM 1092 N ARG A 73 2.705 -11.175 4.779 1.00 1.54 N ATOM 1093 CA ARG A 73 2.004 -11.704 5.926 1.00 32.42 C ATOM 1094 C ARG A 73 1.559 -13.122 5.645 1.00 34.52 C ATOM 1095 O ARG A 73 2.036 -14.073 6.268 1.00 11.33 O ATOM 1096 CB ARG A 73 0.818 -10.806 6.302 1.00 63.25 C ATOM 1097 CG ARG A 73 1.217 -9.384 6.713 1.00 31.55 C ATOM 1098 CD ARG A 73 2.145 -9.391 7.927 1.00 71.40 C ATOM 1099 NE ARG A 73 1.525 -10.057 9.070 1.00 74.21 N ATOM 1100 CZ ARG A 73 2.079 -10.222 10.273 1.00 51.05 C ATOM 1101 NH1 ARG A 73 3.297 -9.740 10.537 1.00 35.03 N ATOM 1102 NH2 ARG A 73 1.400 -10.864 11.213 1.00 14.51 N ATOM 0 H ARG A 73 2.103 -10.867 4.016 1.00 1.54 H new ATOM 0 HA ARG A 73 2.681 -11.720 6.780 1.00 32.42 H new ATOM 0 HB2 ARG A 73 0.135 -10.750 5.454 1.00 63.25 H new ATOM 0 HB3 ARG A 73 0.270 -11.270 7.122 1.00 63.25 H new ATOM 0 HG2 ARG A 73 1.712 -8.888 5.878 1.00 31.55 H new ATOM 0 HG3 ARG A 73 0.322 -8.806 6.941 1.00 31.55 H new ATOM 0 HD2 ARG A 73 3.077 -9.896 7.671 1.00 71.40 H new ATOM 0 HD3 ARG A 73 2.401 -8.366 8.196 1.00 71.40 H new ATOM 0 HE ARG A 73 0.585 -10.429 8.937 1.00 74.21 H new ATOM 0 HH11 ARG A 73 3.815 -9.239 9.815 1.00 35.03 H new ATOM 0 HH12 ARG A 73 3.709 -9.873 11.461 1.00 35.03 H new ATOM 0 HH21 ARG A 73 0.467 -11.224 11.012 1.00 14.51 H new ATOM 0 HH22 ARG A 73 1.810 -10.998 12.137 1.00 14.51 H new ATOM 1116 N ASP A 74 0.668 -13.261 4.715 1.00 60.04 N ATOM 1117 CA ASP A 74 0.198 -14.562 4.291 1.00 64.13 C ATOM 1118 C ASP A 74 -0.060 -14.538 2.812 1.00 22.03 C ATOM 1119 O ASP A 74 0.772 -14.982 2.020 1.00 34.54 O ATOM 1120 CB ASP A 74 -1.068 -14.983 5.073 1.00 43.13 C ATOM 1121 CG ASP A 74 -1.702 -16.261 4.559 1.00 13.03 C ATOM 1122 OD1 ASP A 74 -1.241 -17.355 4.918 1.00 44.24 O ATOM 1123 OD2 ASP A 74 -2.675 -16.182 3.786 1.00 43.24 O ATOM 0 H ASP A 74 0.238 -12.479 4.220 1.00 60.04 H new ATOM 0 HA ASP A 74 0.967 -15.304 4.506 1.00 64.13 H new ATOM 0 HB2 ASP A 74 -0.809 -15.113 6.124 1.00 43.13 H new ATOM 0 HB3 ASP A 74 -1.801 -14.178 5.022 1.00 43.13 H new ATOM 1128 N GLY A 75 -1.165 -13.946 2.436 1.00 50.43 N ATOM 1129 CA GLY A 75 -1.519 -13.887 1.059 1.00 23.15 C ATOM 1130 C GLY A 75 -1.250 -12.541 0.460 1.00 1.23 C ATOM 1131 O GLY A 75 -1.001 -12.429 -0.745 1.00 12.35 O ATOM 0 H GLY A 75 -1.828 -13.501 3.071 1.00 50.43 H new ATOM 0 HA2 GLY A 75 -0.960 -14.645 0.510 1.00 23.15 H new ATOM 0 HA3 GLY A 75 -2.576 -14.127 0.947 1.00 23.15 H new ATOM 1135 N ARG A 76 -1.255 -11.511 1.284 1.00 12.34 N ATOM 1136 CA ARG A 76 -1.097 -10.188 0.765 1.00 2.51 C ATOM 1137 C ARG A 76 0.285 -9.661 1.086 1.00 33.14 C ATOM 1138 O ARG A 76 0.967 -10.154 2.017 1.00 1.13 O ATOM 1139 CB ARG A 76 -2.152 -9.242 1.355 1.00 54.34 C ATOM 1140 CG ARG A 76 -1.921 -8.888 2.817 1.00 30.04 C ATOM 1141 CD ARG A 76 -3.002 -7.978 3.350 1.00 54.35 C ATOM 1142 NE ARG A 76 -4.280 -8.664 3.537 1.00 54.10 N ATOM 1143 CZ ARG A 76 -5.408 -8.385 2.891 1.00 3.31 C ATOM 1144 NH1 ARG A 76 -5.396 -7.610 1.813 1.00 42.20 N ATOM 1145 NH2 ARG A 76 -6.544 -8.935 3.294 1.00 12.41 N ATOM 0 H ARG A 76 -1.365 -11.573 2.296 1.00 12.34 H new ATOM 0 HA ARG A 76 -1.227 -10.232 -0.316 1.00 2.51 H new ATOM 0 HB2 ARG A 76 -2.170 -8.324 0.768 1.00 54.34 H new ATOM 0 HB3 ARG A 76 -3.135 -9.703 1.255 1.00 54.34 H new ATOM 0 HG2 ARG A 76 -1.888 -9.801 3.412 1.00 30.04 H new ATOM 0 HG3 ARG A 76 -0.951 -8.403 2.925 1.00 30.04 H new ATOM 0 HD2 ARG A 76 -2.679 -7.556 4.302 1.00 54.35 H new ATOM 0 HD3 ARG A 76 -3.140 -7.144 2.662 1.00 54.35 H new ATOM 0 HE ARG A 76 -4.308 -9.420 4.221 1.00 54.10 H new ATOM 0 HH11 ARG A 76 -4.516 -7.223 1.473 1.00 42.20 H new ATOM 0 HH12 ARG A 76 -6.267 -7.402 1.325 1.00 42.20 H new ATOM 0 HH21 ARG A 76 -6.549 -9.567 4.094 1.00 12.41 H new ATOM 0 HH22 ARG A 76 -7.414 -8.726 2.804 1.00 12.41 H new ATOM 1159 N TYR A 77 0.695 -8.687 0.329 1.00 54.32 N ATOM 1160 CA TYR A 77 1.927 -7.997 0.554 1.00 64.35 C ATOM 1161 C TYR A 77 1.615 -6.586 0.958 1.00 21.21 C ATOM 1162 O TYR A 77 0.731 -5.950 0.367 1.00 51.34 O ATOM 1163 CB TYR A 77 2.806 -8.021 -0.699 1.00 71.00 C ATOM 1164 CG TYR A 77 3.268 -9.406 -1.071 1.00 0.01 C ATOM 1165 CD1 TYR A 77 4.439 -9.915 -0.542 1.00 24.21 C ATOM 1166 CD2 TYR A 77 2.533 -10.207 -1.935 1.00 2.41 C ATOM 1167 CE1 TYR A 77 4.868 -11.182 -0.855 1.00 33.13 C ATOM 1168 CE2 TYR A 77 2.958 -11.478 -2.256 1.00 11.14 C ATOM 1169 CZ TYR A 77 4.129 -11.959 -1.708 1.00 21.23 C ATOM 1170 OH TYR A 77 4.558 -13.232 -2.007 1.00 51.12 O ATOM 0 H TYR A 77 0.172 -8.345 -0.477 1.00 54.32 H new ATOM 0 HA TYR A 77 2.484 -8.494 1.348 1.00 64.35 H new ATOM 0 HB2 TYR A 77 2.250 -7.594 -1.534 1.00 71.00 H new ATOM 0 HB3 TYR A 77 3.677 -7.385 -0.537 1.00 71.00 H new ATOM 0 HD1 TYR A 77 5.027 -9.306 0.129 1.00 24.21 H new ATOM 0 HD2 TYR A 77 1.616 -9.829 -2.361 1.00 2.41 H new ATOM 0 HE1 TYR A 77 5.784 -11.564 -0.430 1.00 33.13 H new ATOM 0 HE2 TYR A 77 2.380 -12.092 -2.930 1.00 11.14 H new ATOM 0 HH TYR A 77 4.926 -13.248 -2.915 1.00 51.12 H new ATOM 1180 N ILE A 78 2.269 -6.113 1.979 1.00 63.23 N ATOM 1181 CA ILE A 78 2.050 -4.779 2.448 1.00 64.34 C ATOM 1182 C ILE A 78 3.188 -3.920 1.921 1.00 22.50 C ATOM 1183 O ILE A 78 4.348 -4.220 2.165 1.00 65.22 O ATOM 1184 CB ILE A 78 2.074 -4.702 4.001 1.00 41.33 C ATOM 1185 CG1 ILE A 78 1.258 -5.836 4.648 1.00 2.11 C ATOM 1186 CG2 ILE A 78 1.507 -3.362 4.446 1.00 21.55 C ATOM 1187 CD1 ILE A 78 -0.213 -5.822 4.326 1.00 54.30 C ATOM 0 H ILE A 78 2.965 -6.639 2.507 1.00 63.23 H new ATOM 0 HA ILE A 78 1.073 -4.441 2.103 1.00 64.34 H new ATOM 0 HB ILE A 78 3.110 -4.809 4.324 1.00 41.33 H new ATOM 0 HG12 ILE A 78 1.676 -6.791 4.330 1.00 2.11 H new ATOM 0 HG13 ILE A 78 1.379 -5.779 5.730 1.00 2.11 H new ATOM 0 HG21 ILE A 78 1.522 -3.304 5.534 1.00 21.55 H new ATOM 0 HG22 ILE A 78 2.111 -2.555 4.031 1.00 21.55 H new ATOM 0 HG23 ILE A 78 0.481 -3.265 4.092 1.00 21.55 H new ATOM 0 HD11 ILE A 78 -0.703 -6.657 4.826 1.00 54.30 H new ATOM 0 HD12 ILE A 78 -0.652 -4.885 4.670 1.00 54.30 H new ATOM 0 HD13 ILE A 78 -0.350 -5.913 3.249 1.00 54.30 H new ATOM 1199 N TYR A 79 2.860 -2.891 1.209 1.00 75.34 N ATOM 1200 CA TYR A 79 3.836 -1.999 0.656 1.00 24.32 C ATOM 1201 C TYR A 79 3.907 -0.730 1.441 1.00 22.04 C ATOM 1202 O TYR A 79 2.891 -0.223 1.957 1.00 71.41 O ATOM 1203 CB TYR A 79 3.525 -1.666 -0.800 1.00 55.21 C ATOM 1204 CG TYR A 79 3.572 -2.838 -1.721 1.00 72.13 C ATOM 1205 CD1 TYR A 79 2.460 -3.636 -1.923 1.00 22.31 C ATOM 1206 CD2 TYR A 79 4.736 -3.155 -2.383 1.00 74.35 C ATOM 1207 CE1 TYR A 79 2.515 -4.719 -2.762 1.00 52.54 C ATOM 1208 CE2 TYR A 79 4.801 -4.232 -3.218 1.00 71.45 C ATOM 1209 CZ TYR A 79 3.693 -5.012 -3.409 1.00 34.13 C ATOM 1210 OH TYR A 79 3.776 -6.111 -4.232 1.00 72.42 O ATOM 0 H TYR A 79 1.896 -2.640 0.990 1.00 75.34 H new ATOM 0 HA TYR A 79 4.797 -2.510 0.705 1.00 24.32 H new ATOM 0 HB2 TYR A 79 2.534 -1.216 -0.854 1.00 55.21 H new ATOM 0 HB3 TYR A 79 4.235 -0.916 -1.149 1.00 55.21 H new ATOM 0 HD1 TYR A 79 1.537 -3.403 -1.413 1.00 22.31 H new ATOM 0 HD2 TYR A 79 5.613 -2.541 -2.239 1.00 74.35 H new ATOM 0 HE1 TYR A 79 1.642 -5.336 -2.913 1.00 52.54 H new ATOM 0 HE2 TYR A 79 5.724 -4.468 -3.727 1.00 71.45 H new ATOM 0 HH TYR A 79 4.715 -6.375 -4.332 1.00 72.42 H new ATOM 1220 N TYR A 80 5.083 -0.240 1.562 1.00 21.12 N ATOM 1221 CA TYR A 80 5.341 1.000 2.194 1.00 74.15 C ATOM 1222 C TYR A 80 6.167 1.850 1.280 1.00 53.14 C ATOM 1223 O TYR A 80 7.369 1.619 1.118 1.00 22.43 O ATOM 1224 CB TYR A 80 6.033 0.799 3.540 1.00 43.53 C ATOM 1225 CG TYR A 80 5.165 0.123 4.569 1.00 4.32 C ATOM 1226 CD1 TYR A 80 5.102 -1.255 4.654 1.00 24.22 C ATOM 1227 CD2 TYR A 80 4.397 0.870 5.451 1.00 71.54 C ATOM 1228 CE1 TYR A 80 4.303 -1.872 5.582 1.00 23.14 C ATOM 1229 CE2 TYR A 80 3.594 0.259 6.388 1.00 34.30 C ATOM 1230 CZ TYR A 80 3.551 -1.114 6.447 1.00 52.13 C ATOM 1231 OH TYR A 80 2.744 -1.733 7.366 1.00 30.43 O ATOM 0 H TYR A 80 5.921 -0.705 1.213 1.00 21.12 H new ATOM 0 HA TYR A 80 4.396 1.505 2.396 1.00 74.15 H new ATOM 0 HB2 TYR A 80 6.935 0.205 3.391 1.00 43.53 H new ATOM 0 HB3 TYR A 80 6.350 1.768 3.925 1.00 43.53 H new ATOM 0 HD1 TYR A 80 5.692 -1.856 3.978 1.00 24.22 H new ATOM 0 HD2 TYR A 80 4.430 1.948 5.402 1.00 71.54 H new ATOM 0 HE1 TYR A 80 4.265 -2.950 5.633 1.00 23.14 H new ATOM 0 HE2 TYR A 80 3.004 0.853 7.070 1.00 34.30 H new ATOM 0 HH TYR A 80 2.910 -1.355 8.255 1.00 30.43 H new ATOM 1241 N LEU A 81 5.504 2.776 0.636 1.00 55.41 N ATOM 1242 CA LEU A 81 6.132 3.702 -0.265 1.00 74.23 C ATOM 1243 C LEU A 81 6.861 4.697 0.567 1.00 3.21 C ATOM 1244 O LEU A 81 6.244 5.395 1.390 1.00 44.10 O ATOM 1245 CB LEU A 81 5.057 4.433 -1.088 1.00 61.33 C ATOM 1246 CG LEU A 81 4.101 3.550 -1.895 1.00 74.03 C ATOM 1247 CD1 LEU A 81 3.063 4.403 -2.598 1.00 35.15 C ATOM 1248 CD2 LEU A 81 4.862 2.723 -2.903 1.00 34.24 C ATOM 0 H LEU A 81 4.497 2.908 0.726 1.00 55.41 H new ATOM 0 HA LEU A 81 6.806 3.181 -0.945 1.00 74.23 H new ATOM 0 HB2 LEU A 81 4.465 5.046 -0.409 1.00 61.33 H new ATOM 0 HB3 LEU A 81 5.558 5.113 -1.777 1.00 61.33 H new ATOM 0 HG LEU A 81 3.594 2.875 -1.205 1.00 74.03 H new ATOM 0 HD11 LEU A 81 2.390 3.762 -3.168 1.00 35.15 H new ATOM 0 HD12 LEU A 81 2.491 4.963 -1.858 1.00 35.15 H new ATOM 0 HD13 LEU A 81 3.561 5.098 -3.274 1.00 35.15 H new ATOM 0 HD21 LEU A 81 4.164 2.103 -3.466 1.00 34.24 H new ATOM 0 HD22 LEU A 81 5.394 3.383 -3.588 1.00 34.24 H new ATOM 0 HD23 LEU A 81 5.578 2.085 -2.384 1.00 34.24 H new ATOM 1260 N ILE A 82 8.132 4.773 0.402 1.00 53.51 N ATOM 1261 CA ILE A 82 8.892 5.681 1.172 1.00 1.10 C ATOM 1262 C ILE A 82 8.939 6.994 0.448 1.00 15.23 C ATOM 1263 O ILE A 82 9.670 7.158 -0.541 1.00 62.53 O ATOM 1264 CB ILE A 82 10.310 5.176 1.435 1.00 23.11 C ATOM 1265 CG1 ILE A 82 10.306 3.757 2.050 1.00 60.34 C ATOM 1266 CG2 ILE A 82 10.998 6.126 2.367 1.00 34.43 C ATOM 1267 CD1 ILE A 82 9.626 3.650 3.402 1.00 63.12 C ATOM 0 H ILE A 82 8.667 4.214 -0.263 1.00 53.51 H new ATOM 0 HA ILE A 82 8.413 5.793 2.145 1.00 1.10 H new ATOM 0 HB ILE A 82 10.839 5.123 0.483 1.00 23.11 H new ATOM 0 HG12 ILE A 82 9.812 3.077 1.356 1.00 60.34 H new ATOM 0 HG13 ILE A 82 11.337 3.417 2.150 1.00 60.34 H new ATOM 0 HG21 ILE A 82 12.011 5.775 2.562 1.00 34.43 H new ATOM 0 HG22 ILE A 82 11.038 7.116 1.913 1.00 34.43 H new ATOM 0 HG23 ILE A 82 10.446 6.179 3.305 1.00 34.43 H new ATOM 0 HD11 ILE A 82 9.673 2.619 3.752 1.00 63.12 H new ATOM 0 HD12 ILE A 82 10.132 4.300 4.116 1.00 63.12 H new ATOM 0 HD13 ILE A 82 8.583 3.954 3.310 1.00 63.12 H new ATOM 1279 N THR A 83 8.148 7.905 0.909 1.00 64.14 N ATOM 1280 CA THR A 83 8.037 9.179 0.299 1.00 11.13 C ATOM 1281 C THR A 83 9.199 10.078 0.657 1.00 14.25 C ATOM 1282 O THR A 83 9.891 10.573 -0.224 1.00 70.14 O ATOM 1283 CB THR A 83 6.702 9.836 0.666 1.00 3.44 C ATOM 1284 OG1 THR A 83 6.499 9.754 2.089 1.00 24.45 O ATOM 1285 CG2 THR A 83 5.550 9.165 -0.066 1.00 51.31 C ATOM 0 H THR A 83 7.555 7.780 1.730 1.00 64.14 H new ATOM 0 HA THR A 83 8.066 9.031 -0.781 1.00 11.13 H new ATOM 0 HB THR A 83 6.733 10.883 0.364 1.00 3.44 H new ATOM 0 HG1 THR A 83 5.646 10.176 2.323 1.00 24.45 H new ATOM 0 HG21 THR A 83 4.613 9.648 0.210 1.00 51.31 H new ATOM 0 HG22 THR A 83 5.701 9.254 -1.142 1.00 51.31 H new ATOM 0 HG23 THR A 83 5.509 8.111 0.208 1.00 51.31 H new ATOM 1293 N LYS A 84 9.428 10.256 1.946 1.00 0.44 N ATOM 1294 CA LYS A 84 10.468 11.152 2.442 1.00 52.33 C ATOM 1295 C LYS A 84 11.020 10.662 3.778 1.00 22.42 C ATOM 1296 O LYS A 84 10.671 9.586 4.242 1.00 44.10 O ATOM 1297 CB LYS A 84 9.946 12.603 2.568 1.00 1.15 C ATOM 1298 CG LYS A 84 9.673 13.330 1.239 1.00 11.54 C ATOM 1299 CD LYS A 84 10.964 13.532 0.445 1.00 12.32 C ATOM 1300 CE LYS A 84 10.723 14.249 -0.875 1.00 0.15 C ATOM 1301 NZ LYS A 84 11.987 14.451 -1.633 1.00 20.21 N ATOM 0 H LYS A 84 8.901 9.786 2.682 1.00 0.44 H new ATOM 0 HA LYS A 84 11.280 11.149 1.714 1.00 52.33 H new ATOM 0 HB2 LYS A 84 9.024 12.589 3.150 1.00 1.15 H new ATOM 0 HB3 LYS A 84 10.673 13.183 3.136 1.00 1.15 H new ATOM 0 HG2 LYS A 84 8.964 12.754 0.645 1.00 11.54 H new ATOM 0 HG3 LYS A 84 9.210 14.297 1.438 1.00 11.54 H new ATOM 0 HD2 LYS A 84 11.671 14.106 1.044 1.00 12.32 H new ATOM 0 HD3 LYS A 84 11.424 12.563 0.251 1.00 12.32 H new ATOM 0 HE2 LYS A 84 10.025 13.671 -1.480 1.00 0.15 H new ATOM 0 HE3 LYS A 84 10.255 15.215 -0.684 1.00 0.15 H new ATOM 0 HZ1 LYS A 84 12.076 15.452 -1.900 1.00 20.21 H new ATOM 0 HZ2 LYS A 84 12.796 14.178 -1.039 1.00 20.21 H new ATOM 0 HZ3 LYS A 84 11.975 13.864 -2.491 1.00 20.21 H new ATOM 1315 N LYS A 85 11.884 11.461 4.382 1.00 3.33 N ATOM 1316 CA LYS A 85 12.562 11.102 5.631 1.00 3.43 C ATOM 1317 C LYS A 85 11.682 11.310 6.860 1.00 22.54 C ATOM 1318 O LYS A 85 11.540 10.413 7.683 1.00 13.11 O ATOM 1319 CB LYS A 85 13.838 11.918 5.763 1.00 14.40 C ATOM 1320 CG LYS A 85 14.748 11.763 4.573 1.00 20.44 C ATOM 1321 CD LYS A 85 16.022 12.545 4.718 1.00 12.02 C ATOM 1322 CE LYS A 85 16.885 12.359 3.494 1.00 72.42 C ATOM 1323 NZ LYS A 85 18.140 13.129 3.574 1.00 13.14 N ATOM 0 H LYS A 85 12.140 12.381 4.024 1.00 3.33 H new ATOM 0 HA LYS A 85 12.794 10.038 5.584 1.00 3.43 H new ATOM 0 HB2 LYS A 85 13.581 12.970 5.885 1.00 14.40 H new ATOM 0 HB3 LYS A 85 14.369 11.613 6.665 1.00 14.40 H new ATOM 0 HG2 LYS A 85 14.986 10.708 4.437 1.00 20.44 H new ATOM 0 HG3 LYS A 85 14.225 12.090 3.674 1.00 20.44 H new ATOM 0 HD2 LYS A 85 15.796 13.602 4.856 1.00 12.02 H new ATOM 0 HD3 LYS A 85 16.561 12.216 5.606 1.00 12.02 H new ATOM 0 HE2 LYS A 85 17.117 11.301 3.373 1.00 72.42 H new ATOM 0 HE3 LYS A 85 16.328 12.666 2.609 1.00 72.42 H new ATOM 0 HZ1 LYS A 85 18.700 12.971 2.712 1.00 13.14 H new ATOM 0 HZ2 LYS A 85 17.921 14.142 3.663 1.00 13.14 H new ATOM 0 HZ3 LYS A 85 18.685 12.819 4.403 1.00 13.14 H new ATOM 1337 N ARG A 86 11.093 12.482 6.988 1.00 45.33 N ATOM 1338 CA ARG A 86 10.269 12.781 8.157 1.00 63.51 C ATOM 1339 C ARG A 86 8.812 12.605 7.803 1.00 13.33 C ATOM 1340 O ARG A 86 8.442 12.738 6.642 1.00 62.35 O ATOM 1341 CB ARG A 86 10.476 14.227 8.627 1.00 4.14 C ATOM 1342 CG ARG A 86 11.918 14.629 8.876 1.00 4.31 C ATOM 1343 CD ARG A 86 12.576 13.766 9.909 1.00 33.52 C ATOM 1344 NE ARG A 86 13.965 14.177 10.147 1.00 62.14 N ATOM 1345 CZ ARG A 86 14.949 13.382 10.596 1.00 24.34 C ATOM 1346 NH1 ARG A 86 14.738 12.078 10.780 1.00 62.12 N ATOM 1347 NH2 ARG A 86 16.146 13.892 10.838 1.00 70.15 N ATOM 0 H ARG A 86 11.164 13.240 6.309 1.00 45.33 H new ATOM 0 HA ARG A 86 10.561 12.100 8.956 1.00 63.51 H new ATOM 0 HB2 ARG A 86 10.053 14.898 7.880 1.00 4.14 H new ATOM 0 HB3 ARG A 86 9.911 14.377 9.547 1.00 4.14 H new ATOM 0 HG2 ARG A 86 12.477 14.566 7.943 1.00 4.31 H new ATOM 0 HG3 ARG A 86 11.953 15.670 9.199 1.00 4.31 H new ATOM 0 HD2 ARG A 86 12.014 13.820 10.842 1.00 33.52 H new ATOM 0 HD3 ARG A 86 12.554 12.726 9.584 1.00 33.52 H new ATOM 0 HE ARG A 86 14.203 15.150 9.955 1.00 62.14 H new ATOM 0 HH11 ARG A 86 13.822 11.676 10.579 1.00 62.12 H new ATOM 0 HH12 ARG A 86 15.492 11.483 11.122 1.00 62.12 H new ATOM 0 HH21 ARG A 86 16.318 14.885 10.683 1.00 70.15 H new ATOM 0 HH22 ARG A 86 16.897 13.292 11.179 1.00 70.15 H new ATOM 1361 N ALA A 87 7.986 12.336 8.797 1.00 64.12 N ATOM 1362 CA ALA A 87 6.545 12.184 8.586 1.00 15.31 C ATOM 1363 C ALA A 87 5.912 13.541 8.317 1.00 42.24 C ATOM 1364 O ALA A 87 4.806 13.639 7.791 1.00 62.10 O ATOM 1365 CB ALA A 87 5.888 11.517 9.786 1.00 13.34 C ATOM 0 H ALA A 87 8.283 12.216 9.765 1.00 64.12 H new ATOM 0 HA ALA A 87 6.388 11.544 7.718 1.00 15.31 H new ATOM 0 HB1 ALA A 87 4.818 11.415 9.605 1.00 13.34 H new ATOM 0 HB2 ALA A 87 6.326 10.530 9.939 1.00 13.34 H new ATOM 0 HB3 ALA A 87 6.049 12.127 10.675 1.00 13.34 H new ATOM 1371 N SER A 88 6.626 14.583 8.693 1.00 3.12 N ATOM 1372 CA SER A 88 6.186 15.937 8.470 1.00 60.23 C ATOM 1373 C SER A 88 6.688 16.458 7.110 1.00 21.22 C ATOM 1374 O SER A 88 6.541 17.642 6.787 1.00 31.00 O ATOM 1375 CB SER A 88 6.684 16.815 9.604 1.00 32.45 C ATOM 1376 OG SER A 88 6.258 16.291 10.857 1.00 34.12 O ATOM 0 H SER A 88 7.529 14.510 9.162 1.00 3.12 H new ATOM 0 HA SER A 88 5.097 15.963 8.449 1.00 60.23 H new ATOM 0 HB2 SER A 88 7.772 16.873 9.577 1.00 32.45 H new ATOM 0 HB3 SER A 88 6.307 17.830 9.480 1.00 32.45 H new ATOM 0 HG SER A 88 6.587 16.865 11.580 1.00 34.12 H new ATOM 1382 N HIS A 89 7.286 15.569 6.321 1.00 61.43 N ATOM 1383 CA HIS A 89 7.723 15.920 4.981 1.00 35.41 C ATOM 1384 C HIS A 89 6.629 15.703 4.009 1.00 60.42 C ATOM 1385 O HIS A 89 5.779 14.831 4.192 1.00 14.35 O ATOM 1386 CB HIS A 89 8.954 15.145 4.509 1.00 22.24 C ATOM 1387 CG HIS A 89 10.275 15.624 5.017 1.00 41.24 C ATOM 1388 ND1 HIS A 89 11.469 15.300 4.411 1.00 34.50 N ATOM 1389 CD2 HIS A 89 10.593 16.368 6.076 1.00 11.11 C ATOM 1390 CE1 HIS A 89 12.462 15.815 5.085 1.00 31.51 C ATOM 1391 NE2 HIS A 89 11.963 16.479 6.104 1.00 21.54 N ATOM 0 H HIS A 89 7.477 14.604 6.589 1.00 61.43 H new ATOM 0 HA HIS A 89 8.000 16.973 5.032 1.00 35.41 H new ATOM 0 HB2 HIS A 89 8.834 14.102 4.801 1.00 22.24 H new ATOM 0 HB3 HIS A 89 8.977 15.171 3.420 1.00 22.24 H new ATOM 0 HD2 HIS A 89 9.902 16.804 6.782 1.00 11.11 H new ATOM 0 HE1 HIS A 89 13.510 15.713 4.847 1.00 31.51 H new ATOM 0 HE2 HIS A 89 12.503 16.992 6.801 1.00 21.54 H new ATOM 1400 N LYS A 90 6.642 16.480 2.998 1.00 55.02 N ATOM 1401 CA LYS A 90 5.657 16.366 1.950 1.00 10.22 C ATOM 1402 C LYS A 90 6.250 15.683 0.722 1.00 3.20 C ATOM 1403 O LYS A 90 7.336 16.055 0.263 1.00 11.11 O ATOM 1404 CB LYS A 90 4.997 17.722 1.593 1.00 72.10 C ATOM 1405 CG LYS A 90 4.024 18.283 2.657 1.00 4.10 C ATOM 1406 CD LYS A 90 4.690 18.652 3.989 1.00 25.33 C ATOM 1407 CE LYS A 90 5.643 19.837 3.862 1.00 30.53 C ATOM 1408 NZ LYS A 90 4.949 21.079 3.443 1.00 31.14 N ATOM 0 H LYS A 90 7.329 17.221 2.855 1.00 55.02 H new ATOM 0 HA LYS A 90 4.854 15.737 2.334 1.00 10.22 H new ATOM 0 HB2 LYS A 90 5.784 18.456 1.421 1.00 72.10 H new ATOM 0 HB3 LYS A 90 4.456 17.608 0.654 1.00 72.10 H new ATOM 0 HG2 LYS A 90 3.533 19.168 2.252 1.00 4.10 H new ATOM 0 HG3 LYS A 90 3.245 17.544 2.846 1.00 4.10 H new ATOM 0 HD2 LYS A 90 3.919 18.888 4.723 1.00 25.33 H new ATOM 0 HD3 LYS A 90 5.238 17.789 4.368 1.00 25.33 H new ATOM 0 HE2 LYS A 90 6.138 20.006 4.818 1.00 30.53 H new ATOM 0 HE3 LYS A 90 6.422 19.597 3.138 1.00 30.53 H new ATOM 0 HZ1 LYS A 90 5.592 21.889 3.550 1.00 31.14 H new ATOM 0 HZ2 LYS A 90 4.659 20.996 2.448 1.00 31.14 H new ATOM 0 HZ3 LYS A 90 4.108 21.224 4.037 1.00 31.14 H new ATOM 1422 N PRO A 91 5.554 14.658 0.193 1.00 1.11 N ATOM 1423 CA PRO A 91 6.021 13.869 -0.957 1.00 32.32 C ATOM 1424 C PRO A 91 6.161 14.686 -2.242 1.00 34.21 C ATOM 1425 O PRO A 91 5.474 15.692 -2.442 1.00 60.14 O ATOM 1426 CB PRO A 91 4.932 12.798 -1.136 1.00 62.31 C ATOM 1427 CG PRO A 91 3.731 13.356 -0.459 1.00 52.14 C ATOM 1428 CD PRO A 91 4.243 14.182 0.680 1.00 33.41 C ATOM 0 HA PRO A 91 7.018 13.470 -0.770 1.00 32.32 H new ATOM 0 HB2 PRO A 91 4.737 12.605 -2.191 1.00 62.31 H new ATOM 0 HB3 PRO A 91 5.233 11.850 -0.689 1.00 62.31 H new ATOM 0 HG2 PRO A 91 3.143 13.963 -1.147 1.00 52.14 H new ATOM 0 HG3 PRO A 91 3.080 12.559 -0.101 1.00 52.14 H new ATOM 0 HD2 PRO A 91 3.573 15.011 0.908 1.00 33.41 H new ATOM 0 HD3 PRO A 91 4.342 13.593 1.591 1.00 33.41 H new ATOM 1436 N THR A 92 7.062 14.253 -3.087 1.00 65.35 N ATOM 1437 CA THR A 92 7.290 14.857 -4.358 1.00 75.21 C ATOM 1438 C THR A 92 6.869 13.897 -5.449 1.00 53.53 C ATOM 1439 O THR A 92 6.703 12.703 -5.176 1.00 54.14 O ATOM 1440 CB THR A 92 8.771 15.186 -4.497 1.00 53.21 C ATOM 1441 OG1 THR A 92 9.527 14.099 -4.016 1.00 53.32 O ATOM 1442 CG2 THR A 92 9.143 16.441 -3.758 1.00 50.30 C ATOM 0 H THR A 92 7.666 13.453 -2.898 1.00 65.35 H new ATOM 0 HA THR A 92 6.708 15.775 -4.444 1.00 75.21 H new ATOM 0 HB THR A 92 8.985 15.360 -5.551 1.00 53.21 H new ATOM 0 HG1 THR A 92 10.378 14.053 -4.500 1.00 53.32 H new ATOM 0 HG21 THR A 92 10.208 16.636 -3.885 1.00 50.30 H new ATOM 0 HG22 THR A 92 8.571 17.280 -4.154 1.00 50.30 H new ATOM 0 HG23 THR A 92 8.921 16.318 -2.698 1.00 50.30 H new ATOM 1450 N TYR A 93 6.709 14.387 -6.666 1.00 73.35 N ATOM 1451 CA TYR A 93 6.313 13.536 -7.773 1.00 31.04 C ATOM 1452 C TYR A 93 7.358 12.485 -8.062 1.00 1.20 C ATOM 1453 O TYR A 93 7.028 11.322 -8.207 1.00 1.43 O ATOM 1454 CB TYR A 93 6.029 14.336 -9.032 1.00 31.12 C ATOM 1455 CG TYR A 93 4.807 15.199 -8.952 1.00 45.51 C ATOM 1456 CD1 TYR A 93 4.851 16.454 -8.384 1.00 54.23 C ATOM 1457 CD2 TYR A 93 3.601 14.753 -9.462 1.00 62.33 C ATOM 1458 CE1 TYR A 93 3.731 17.241 -8.326 1.00 10.20 C ATOM 1459 CE2 TYR A 93 2.477 15.535 -9.413 1.00 75.45 C ATOM 1460 CZ TYR A 93 2.544 16.783 -8.844 1.00 31.20 C ATOM 1461 OH TYR A 93 1.418 17.594 -8.793 1.00 10.32 O ATOM 0 H TYR A 93 6.847 15.367 -6.912 1.00 73.35 H new ATOM 0 HA TYR A 93 5.391 13.041 -7.467 1.00 31.04 H new ATOM 0 HB2 TYR A 93 6.891 14.966 -9.250 1.00 31.12 H new ATOM 0 HB3 TYR A 93 5.918 13.647 -9.869 1.00 31.12 H new ATOM 0 HD1 TYR A 93 5.782 16.822 -7.979 1.00 54.23 H new ATOM 0 HD2 TYR A 93 3.544 13.771 -9.907 1.00 62.33 H new ATOM 0 HE1 TYR A 93 3.781 18.220 -7.874 1.00 10.20 H new ATOM 0 HE2 TYR A 93 1.544 15.172 -9.819 1.00 75.45 H new ATOM 0 HH TYR A 93 1.639 18.483 -9.141 1.00 10.32 H new ATOM 1471 N GLU A 94 8.632 12.903 -8.106 1.00 42.24 N ATOM 1472 CA GLU A 94 9.736 12.005 -8.412 1.00 30.32 C ATOM 1473 C GLU A 94 9.782 10.869 -7.399 1.00 41.42 C ATOM 1474 O GLU A 94 9.821 9.693 -7.753 1.00 13.01 O ATOM 1475 CB GLU A 94 11.054 12.778 -8.370 1.00 33.41 C ATOM 1476 CG GLU A 94 12.254 11.926 -8.687 1.00 41.12 C ATOM 1477 CD GLU A 94 13.560 12.648 -8.513 1.00 53.15 C ATOM 1478 OE1 GLU A 94 14.093 12.648 -7.394 1.00 1.44 O ATOM 1479 OE2 GLU A 94 14.093 13.202 -9.501 1.00 24.04 O ATOM 0 H GLU A 94 8.916 13.867 -7.931 1.00 42.24 H new ATOM 0 HA GLU A 94 9.588 11.589 -9.409 1.00 30.32 H new ATOM 0 HB2 GLU A 94 11.006 13.604 -9.080 1.00 33.41 H new ATOM 0 HB3 GLU A 94 11.179 13.216 -7.380 1.00 33.41 H new ATOM 0 HG2 GLU A 94 12.245 11.046 -8.044 1.00 41.12 H new ATOM 0 HG3 GLU A 94 12.177 11.571 -9.715 1.00 41.12 H new ATOM 1486 N ASN A 95 9.753 11.246 -6.149 1.00 72.12 N ATOM 1487 CA ASN A 95 9.750 10.324 -5.030 1.00 21.34 C ATOM 1488 C ASN A 95 8.564 9.401 -5.071 1.00 22.21 C ATOM 1489 O ASN A 95 8.711 8.180 -4.924 1.00 34.02 O ATOM 1490 CB ASN A 95 9.766 11.129 -3.741 1.00 0.23 C ATOM 1491 CG ASN A 95 11.154 11.547 -3.328 1.00 14.11 C ATOM 1492 OD1 ASN A 95 11.704 12.527 -3.814 1.00 33.43 O ATOM 1493 ND2 ASN A 95 11.683 10.886 -2.380 1.00 71.25 N ATOM 0 H ASN A 95 9.730 12.226 -5.867 1.00 72.12 H new ATOM 0 HA ASN A 95 10.637 9.693 -5.086 1.00 21.34 H new ATOM 0 HB2 ASN A 95 9.146 12.017 -3.865 1.00 0.23 H new ATOM 0 HB3 ASN A 95 9.318 10.537 -2.943 1.00 0.23 H new ATOM 0 HD21 ASN A 95 12.589 11.168 -2.005 1.00 71.25 H new ATOM 0 HD22 ASN A 95 11.202 10.073 -1.994 1.00 71.25 H new ATOM 1500 N LEU A 96 7.400 9.962 -5.276 1.00 74.22 N ATOM 1501 CA LEU A 96 6.196 9.179 -5.333 1.00 63.55 C ATOM 1502 C LEU A 96 6.212 8.203 -6.515 1.00 22.20 C ATOM 1503 O LEU A 96 5.990 7.016 -6.326 1.00 14.20 O ATOM 1504 CB LEU A 96 4.964 10.079 -5.376 1.00 60.34 C ATOM 1505 CG LEU A 96 3.600 9.381 -5.345 1.00 3.12 C ATOM 1506 CD1 LEU A 96 3.441 8.565 -4.065 1.00 5.33 C ATOM 1507 CD2 LEU A 96 2.502 10.417 -5.442 1.00 64.42 C ATOM 0 H LEU A 96 7.262 10.964 -5.407 1.00 74.22 H new ATOM 0 HA LEU A 96 6.147 8.582 -4.422 1.00 63.55 H new ATOM 0 HB2 LEU A 96 5.014 10.765 -4.531 1.00 60.34 H new ATOM 0 HB3 LEU A 96 5.016 10.684 -6.281 1.00 60.34 H new ATOM 0 HG LEU A 96 3.533 8.700 -6.193 1.00 3.12 H new ATOM 0 HD11 LEU A 96 2.466 8.078 -4.063 1.00 5.33 H new ATOM 0 HD12 LEU A 96 4.225 7.809 -4.016 1.00 5.33 H new ATOM 0 HD13 LEU A 96 3.519 9.225 -3.201 1.00 5.33 H new ATOM 0 HD21 LEU A 96 1.531 9.922 -5.420 1.00 64.42 H new ATOM 0 HD22 LEU A 96 2.577 11.106 -4.601 1.00 64.42 H new ATOM 0 HD23 LEU A 96 2.606 10.971 -6.375 1.00 64.42 H new ATOM 1519 N GLN A 97 6.519 8.690 -7.723 1.00 73.33 N ATOM 1520 CA GLN A 97 6.493 7.839 -8.896 1.00 15.44 C ATOM 1521 C GLN A 97 7.526 6.725 -8.785 1.00 44.03 C ATOM 1522 O GLN A 97 7.271 5.610 -9.204 1.00 75.34 O ATOM 1523 CB GLN A 97 6.663 8.644 -10.192 1.00 40.40 C ATOM 1524 CG GLN A 97 8.030 9.238 -10.411 1.00 23.32 C ATOM 1525 CD GLN A 97 8.085 10.172 -11.606 1.00 5.44 C ATOM 1526 OE1 GLN A 97 7.855 11.372 -11.483 1.00 52.22 O ATOM 1527 NE2 GLN A 97 8.385 9.642 -12.759 1.00 44.14 N ATOM 0 H GLN A 97 6.784 9.658 -7.903 1.00 73.33 H new ATOM 0 HA GLN A 97 5.508 7.375 -8.942 1.00 15.44 H new ATOM 0 HB2 GLN A 97 6.428 7.995 -11.036 1.00 40.40 H new ATOM 0 HB3 GLN A 97 5.930 9.451 -10.197 1.00 40.40 H new ATOM 0 HG2 GLN A 97 8.331 9.783 -9.516 1.00 23.32 H new ATOM 0 HG3 GLN A 97 8.752 8.433 -10.552 1.00 23.32 H new ATOM 0 HE21 GLN A 97 8.571 8.641 -12.828 1.00 44.14 H new ATOM 0 HE22 GLN A 97 8.434 10.228 -13.592 1.00 44.14 H new ATOM 1536 N LYS A 98 8.680 7.025 -8.178 1.00 50.00 N ATOM 1537 CA LYS A 98 9.711 6.015 -7.962 1.00 53.33 C ATOM 1538 C LYS A 98 9.242 4.925 -7.019 1.00 1.14 C ATOM 1539 O LYS A 98 9.620 3.755 -7.172 1.00 3.25 O ATOM 1540 CB LYS A 98 11.036 6.623 -7.489 1.00 71.44 C ATOM 1541 CG LYS A 98 11.789 7.369 -8.571 1.00 35.12 C ATOM 1542 CD LYS A 98 13.166 7.788 -8.092 1.00 12.42 C ATOM 1543 CE LYS A 98 13.947 8.463 -9.202 1.00 0.35 C ATOM 1544 NZ LYS A 98 15.335 8.784 -8.793 1.00 24.10 N ATOM 0 H LYS A 98 8.918 7.954 -7.831 1.00 50.00 H new ATOM 0 HA LYS A 98 9.899 5.557 -8.933 1.00 53.33 H new ATOM 0 HB2 LYS A 98 10.837 7.305 -6.662 1.00 71.44 H new ATOM 0 HB3 LYS A 98 11.671 5.827 -7.100 1.00 71.44 H new ATOM 0 HG2 LYS A 98 11.885 6.736 -9.453 1.00 35.12 H new ATOM 0 HG3 LYS A 98 11.222 8.250 -8.871 1.00 35.12 H new ATOM 0 HD2 LYS A 98 13.069 8.468 -7.246 1.00 12.42 H new ATOM 0 HD3 LYS A 98 13.713 6.914 -7.738 1.00 12.42 H new ATOM 0 HE2 LYS A 98 13.969 7.813 -10.076 1.00 0.35 H new ATOM 0 HE3 LYS A 98 13.436 9.379 -9.499 1.00 0.35 H new ATOM 0 HZ1 LYS A 98 15.832 9.244 -9.582 1.00 24.10 H new ATOM 0 HZ2 LYS A 98 15.316 9.426 -7.975 1.00 24.10 H new ATOM 0 HZ3 LYS A 98 15.832 7.908 -8.535 1.00 24.10 H new ATOM 1558 N SER A 99 8.407 5.296 -6.072 1.00 33.43 N ATOM 1559 CA SER A 99 7.832 4.358 -5.140 1.00 33.43 C ATOM 1560 C SER A 99 6.836 3.436 -5.888 1.00 65.41 C ATOM 1561 O SER A 99 6.807 2.219 -5.674 1.00 63.41 O ATOM 1562 CB SER A 99 7.151 5.133 -4.016 1.00 44.15 C ATOM 1563 OG SER A 99 8.072 6.008 -3.375 1.00 31.24 O ATOM 0 H SER A 99 8.109 6.261 -5.929 1.00 33.43 H new ATOM 0 HA SER A 99 8.605 3.727 -4.701 1.00 33.43 H new ATOM 0 HB2 SER A 99 6.316 5.707 -4.418 1.00 44.15 H new ATOM 0 HB3 SER A 99 6.737 4.436 -3.287 1.00 44.15 H new ATOM 0 HG SER A 99 8.160 6.831 -3.899 1.00 31.24 H new ATOM 1569 N LEU A 100 6.046 4.032 -6.787 1.00 63.34 N ATOM 1570 CA LEU A 100 5.116 3.296 -7.654 1.00 20.13 C ATOM 1571 C LEU A 100 5.896 2.337 -8.586 1.00 62.35 C ATOM 1572 O LEU A 100 5.529 1.173 -8.730 1.00 11.12 O ATOM 1573 CB LEU A 100 4.255 4.299 -8.474 1.00 71.04 C ATOM 1574 CG LEU A 100 3.055 5.023 -7.781 1.00 21.33 C ATOM 1575 CD1 LEU A 100 1.863 4.102 -7.682 1.00 34.14 C ATOM 1576 CD2 LEU A 100 3.397 5.513 -6.385 1.00 31.11 C ATOM 0 H LEU A 100 6.032 5.041 -6.935 1.00 63.34 H new ATOM 0 HA LEU A 100 4.449 2.694 -7.037 1.00 20.13 H new ATOM 0 HB2 LEU A 100 4.925 5.069 -8.857 1.00 71.04 H new ATOM 0 HB3 LEU A 100 3.860 3.762 -9.337 1.00 71.04 H new ATOM 0 HG LEU A 100 2.821 5.886 -8.404 1.00 21.33 H new ATOM 0 HD11 LEU A 100 1.039 4.625 -7.197 1.00 34.14 H new ATOM 0 HD12 LEU A 100 1.558 3.793 -8.682 1.00 34.14 H new ATOM 0 HD13 LEU A 100 2.130 3.223 -7.096 1.00 34.14 H new ATOM 0 HD21 LEU A 100 2.529 6.008 -5.950 1.00 31.11 H new ATOM 0 HD22 LEU A 100 3.682 4.665 -5.762 1.00 31.11 H new ATOM 0 HD23 LEU A 100 4.227 6.218 -6.440 1.00 31.11 H new ATOM 1588 N GLU A 101 6.980 2.849 -9.194 1.00 65.33 N ATOM 1589 CA GLU A 101 7.894 2.048 -10.054 1.00 34.20 C ATOM 1590 C GLU A 101 8.399 0.847 -9.284 1.00 55.40 C ATOM 1591 O GLU A 101 8.365 -0.293 -9.769 1.00 45.42 O ATOM 1592 CB GLU A 101 9.112 2.894 -10.439 1.00 64.43 C ATOM 1593 CG GLU A 101 8.840 4.058 -11.359 1.00 11.22 C ATOM 1594 CD GLU A 101 8.709 3.660 -12.811 1.00 43.33 C ATOM 1595 OE1 GLU A 101 7.693 3.098 -13.208 1.00 11.02 O ATOM 1596 OE2 GLU A 101 9.667 3.913 -13.579 1.00 23.24 O ATOM 0 H GLU A 101 7.254 3.828 -9.109 1.00 65.33 H new ATOM 0 HA GLU A 101 7.347 1.733 -10.942 1.00 34.20 H new ATOM 0 HB2 GLU A 101 9.568 3.276 -9.526 1.00 64.43 H new ATOM 0 HB3 GLU A 101 9.846 2.244 -10.914 1.00 64.43 H new ATOM 0 HG2 GLU A 101 7.923 4.555 -11.042 1.00 11.22 H new ATOM 0 HG3 GLU A 101 9.646 4.785 -11.261 1.00 11.22 H new ATOM 1603 N ALA A 102 8.866 1.120 -8.081 1.00 32.25 N ATOM 1604 CA ALA A 102 9.390 0.104 -7.198 1.00 40.13 C ATOM 1605 C ALA A 102 8.348 -0.976 -6.920 1.00 4.14 C ATOM 1606 O ALA A 102 8.659 -2.180 -6.945 1.00 70.50 O ATOM 1607 CB ALA A 102 9.893 0.729 -5.910 1.00 23.51 C ATOM 0 H ALA A 102 8.891 2.061 -7.689 1.00 32.25 H new ATOM 0 HA ALA A 102 10.233 -0.377 -7.694 1.00 40.13 H new ATOM 0 HB1 ALA A 102 10.284 -0.050 -5.256 1.00 23.51 H new ATOM 0 HB2 ALA A 102 10.684 1.443 -6.137 1.00 23.51 H new ATOM 0 HB3 ALA A 102 9.072 1.243 -5.410 1.00 23.51 H new ATOM 1613 N MET A 103 7.102 -0.553 -6.676 1.00 32.04 N ATOM 1614 CA MET A 103 6.021 -1.501 -6.467 1.00 13.31 C ATOM 1615 C MET A 103 5.805 -2.389 -7.662 1.00 43.53 C ATOM 1616 O MET A 103 5.616 -3.596 -7.490 1.00 63.45 O ATOM 1617 CB MET A 103 4.701 -0.856 -6.068 1.00 24.33 C ATOM 1618 CG MET A 103 4.664 -0.270 -4.688 1.00 60.20 C ATOM 1619 SD MET A 103 2.987 0.186 -4.184 1.00 0.34 S ATOM 1620 CE MET A 103 2.528 1.344 -5.469 1.00 5.44 C ATOM 0 H MET A 103 6.827 0.428 -6.620 1.00 32.04 H new ATOM 0 HA MET A 103 6.353 -2.107 -5.624 1.00 13.31 H new ATOM 0 HB2 MET A 103 4.469 -0.069 -6.785 1.00 24.33 H new ATOM 0 HB3 MET A 103 3.912 -1.603 -6.149 1.00 24.33 H new ATOM 0 HG2 MET A 103 5.072 -0.990 -3.978 1.00 60.20 H new ATOM 0 HG3 MET A 103 5.305 0.611 -4.652 1.00 60.20 H new ATOM 0 HE1 MET A 103 1.523 1.721 -5.277 1.00 5.44 H new ATOM 0 HE2 MET A 103 3.232 2.176 -5.478 1.00 5.44 H new ATOM 0 HE3 MET A 103 2.548 0.841 -6.436 1.00 5.44 H new ATOM 1630 N LYS A 104 5.880 -1.808 -8.883 1.00 44.10 N ATOM 1631 CA LYS A 104 5.669 -2.565 -10.099 1.00 20.33 C ATOM 1632 C LYS A 104 6.584 -3.746 -10.170 1.00 11.33 C ATOM 1633 O LYS A 104 6.141 -4.869 -10.395 1.00 44.21 O ATOM 1634 CB LYS A 104 5.922 -1.752 -11.322 1.00 10.33 C ATOM 1635 CG LYS A 104 5.004 -0.605 -11.506 1.00 42.45 C ATOM 1636 CD LYS A 104 5.033 -0.173 -12.936 1.00 12.42 C ATOM 1637 CE LYS A 104 6.425 0.246 -13.383 1.00 40.34 C ATOM 1638 NZ LYS A 104 6.462 0.593 -14.809 1.00 14.21 N ATOM 0 H LYS A 104 6.085 -0.820 -9.032 1.00 44.10 H new ATOM 0 HA LYS A 104 4.626 -2.879 -10.067 1.00 20.33 H new ATOM 0 HB2 LYS A 104 6.945 -1.378 -11.288 1.00 10.33 H new ATOM 0 HB3 LYS A 104 5.849 -2.401 -12.194 1.00 10.33 H new ATOM 0 HG2 LYS A 104 3.991 -0.886 -11.220 1.00 42.45 H new ATOM 0 HG3 LYS A 104 5.301 0.220 -10.859 1.00 42.45 H new ATOM 0 HD2 LYS A 104 4.681 -0.989 -13.567 1.00 12.42 H new ATOM 0 HD3 LYS A 104 4.343 0.659 -13.076 1.00 12.42 H new ATOM 0 HE2 LYS A 104 6.753 1.102 -12.793 1.00 40.34 H new ATOM 0 HE3 LYS A 104 7.128 -0.564 -13.188 1.00 40.34 H new ATOM 0 HZ1 LYS A 104 7.371 1.047 -15.032 1.00 14.21 H new ATOM 0 HZ2 LYS A 104 6.357 -0.270 -15.379 1.00 14.21 H new ATOM 0 HZ3 LYS A 104 5.685 1.249 -15.027 1.00 14.21 H new ATOM 1652 N SER A 105 7.861 -3.495 -9.940 1.00 12.54 N ATOM 1653 CA SER A 105 8.875 -4.519 -10.008 1.00 44.34 C ATOM 1654 C SER A 105 8.535 -5.683 -9.063 1.00 24.45 C ATOM 1655 O SER A 105 8.650 -6.845 -9.436 1.00 23.12 O ATOM 1656 CB SER A 105 10.256 -3.915 -9.684 1.00 11.41 C ATOM 1657 OG SER A 105 11.308 -4.876 -9.804 1.00 13.52 O ATOM 0 H SER A 105 8.219 -2.571 -9.700 1.00 12.54 H new ATOM 0 HA SER A 105 8.908 -4.919 -11.021 1.00 44.34 H new ATOM 0 HB2 SER A 105 10.452 -3.079 -10.356 1.00 11.41 H new ATOM 0 HB3 SER A 105 10.246 -3.514 -8.670 1.00 11.41 H new ATOM 0 HG SER A 105 12.165 -4.451 -9.592 1.00 13.52 H new ATOM 1663 N HIS A 106 8.070 -5.368 -7.867 1.00 54.21 N ATOM 1664 CA HIS A 106 7.738 -6.405 -6.918 1.00 54.33 C ATOM 1665 C HIS A 106 6.429 -7.111 -7.260 1.00 45.02 C ATOM 1666 O HIS A 106 6.348 -8.344 -7.165 1.00 31.23 O ATOM 1667 CB HIS A 106 7.698 -5.893 -5.486 1.00 62.23 C ATOM 1668 CG HIS A 106 7.395 -6.995 -4.533 1.00 33.23 C ATOM 1669 ND1 HIS A 106 6.301 -7.020 -3.722 1.00 30.54 N ATOM 1670 CD2 HIS A 106 8.054 -8.130 -4.304 1.00 1.43 C ATOM 1671 CE1 HIS A 106 6.299 -8.114 -3.021 1.00 34.42 C ATOM 1672 NE2 HIS A 106 7.358 -8.816 -3.346 1.00 71.13 N ATOM 0 H HIS A 106 7.917 -4.415 -7.537 1.00 54.21 H new ATOM 0 HA HIS A 106 8.544 -7.135 -6.992 1.00 54.33 H new ATOM 0 HB2 HIS A 106 8.656 -5.440 -5.231 1.00 62.23 H new ATOM 0 HB3 HIS A 106 6.943 -5.112 -5.396 1.00 62.23 H new ATOM 0 HD2 HIS A 106 8.967 -8.449 -4.785 1.00 1.43 H new ATOM 0 HE1 HIS A 106 5.552 -8.397 -2.294 1.00 34.42 H new ATOM 0 HE2 HIS A 106 7.619 -9.720 -2.952 1.00 71.13 H new ATOM 1681 N CYS A 107 5.414 -6.357 -7.626 1.00 55.51 N ATOM 1682 CA CYS A 107 4.127 -6.951 -7.937 1.00 23.43 C ATOM 1683 C CYS A 107 4.226 -7.929 -9.102 1.00 52.41 C ATOM 1684 O CYS A 107 3.555 -8.957 -9.107 1.00 22.22 O ATOM 1685 CB CYS A 107 3.031 -5.893 -8.126 1.00 34.04 C ATOM 1686 SG CYS A 107 3.398 -4.627 -9.326 1.00 14.31 S ATOM 0 H CYS A 107 5.451 -5.342 -7.716 1.00 55.51 H new ATOM 0 HA CYS A 107 3.821 -7.539 -7.071 1.00 23.43 H new ATOM 0 HB2 CYS A 107 2.110 -6.396 -8.422 1.00 34.04 H new ATOM 0 HB3 CYS A 107 2.839 -5.416 -7.165 1.00 34.04 H new ATOM 0 HG CYS A 107 4.418 -4.992 -10.044 1.00 14.31 H new ATOM 1692 N LEU A 108 5.114 -7.634 -10.048 1.00 63.55 N ATOM 1693 CA LEU A 108 5.356 -8.503 -11.189 1.00 12.32 C ATOM 1694 C LEU A 108 5.916 -9.839 -10.757 1.00 72.34 C ATOM 1695 O LEU A 108 5.530 -10.874 -11.276 1.00 74.34 O ATOM 1696 CB LEU A 108 6.327 -7.856 -12.153 1.00 23.05 C ATOM 1697 CG LEU A 108 5.877 -6.562 -12.790 1.00 34.33 C ATOM 1698 CD1 LEU A 108 6.948 -6.037 -13.716 1.00 24.35 C ATOM 1699 CD2 LEU A 108 4.571 -6.769 -13.519 1.00 32.01 C ATOM 0 H LEU A 108 5.683 -6.787 -10.043 1.00 63.55 H new ATOM 0 HA LEU A 108 4.396 -8.663 -11.681 1.00 12.32 H new ATOM 0 HB2 LEU A 108 7.261 -7.670 -11.624 1.00 23.05 H new ATOM 0 HB3 LEU A 108 6.547 -8.570 -12.947 1.00 23.05 H new ATOM 0 HG LEU A 108 5.713 -5.817 -12.012 1.00 34.33 H new ATOM 0 HD11 LEU A 108 6.612 -5.104 -14.169 1.00 24.35 H new ATOM 0 HD12 LEU A 108 7.862 -5.857 -13.150 1.00 24.35 H new ATOM 0 HD13 LEU A 108 7.144 -6.770 -14.498 1.00 24.35 H new ATOM 0 HD21 LEU A 108 4.256 -5.830 -13.974 1.00 32.01 H new ATOM 0 HD22 LEU A 108 4.703 -7.523 -14.295 1.00 32.01 H new ATOM 0 HD23 LEU A 108 3.810 -7.104 -12.814 1.00 32.01 H new ATOM 1711 N LYS A 109 6.802 -9.814 -9.767 1.00 52.41 N ATOM 1712 CA LYS A 109 7.473 -11.044 -9.293 1.00 54.33 C ATOM 1713 C LYS A 109 6.499 -11.989 -8.606 1.00 43.31 C ATOM 1714 O LYS A 109 6.795 -13.162 -8.370 1.00 13.51 O ATOM 1715 CB LYS A 109 8.605 -10.681 -8.340 1.00 53.44 C ATOM 1716 CG LYS A 109 9.585 -9.734 -8.970 1.00 35.21 C ATOM 1717 CD LYS A 109 10.776 -9.393 -8.066 1.00 3.33 C ATOM 1718 CE LYS A 109 11.630 -10.613 -7.740 1.00 51.41 C ATOM 1719 NZ LYS A 109 12.813 -10.255 -6.922 1.00 40.21 N ATOM 0 H LYS A 109 7.079 -8.966 -9.272 1.00 52.41 H new ATOM 0 HA LYS A 109 7.877 -11.560 -10.164 1.00 54.33 H new ATOM 0 HB2 LYS A 109 8.190 -10.228 -7.439 1.00 53.44 H new ATOM 0 HB3 LYS A 109 9.124 -11.588 -8.031 1.00 53.44 H new ATOM 0 HG2 LYS A 109 9.956 -10.172 -9.897 1.00 35.21 H new ATOM 0 HG3 LYS A 109 9.067 -8.813 -9.238 1.00 35.21 H new ATOM 0 HD2 LYS A 109 11.395 -8.640 -8.555 1.00 3.33 H new ATOM 0 HD3 LYS A 109 10.410 -8.952 -7.139 1.00 3.33 H new ATOM 0 HE2 LYS A 109 11.027 -11.346 -7.205 1.00 51.41 H new ATOM 0 HE3 LYS A 109 11.958 -11.085 -8.666 1.00 51.41 H new ATOM 0 HZ1 LYS A 109 13.368 -11.111 -6.721 1.00 40.21 H new ATOM 0 HZ2 LYS A 109 13.402 -9.574 -7.443 1.00 40.21 H new ATOM 0 HZ3 LYS A 109 12.500 -9.828 -6.027 1.00 40.21 H new ATOM 1733 N ASN A 110 5.363 -11.467 -8.284 1.00 34.01 N ATOM 1734 CA ASN A 110 4.332 -12.233 -7.579 1.00 42.35 C ATOM 1735 C ASN A 110 3.070 -12.427 -8.397 1.00 2.13 C ATOM 1736 O ASN A 110 2.255 -13.294 -8.091 1.00 54.34 O ATOM 1737 CB ASN A 110 4.007 -11.590 -6.238 1.00 42.54 C ATOM 1738 CG ASN A 110 5.195 -11.584 -5.317 1.00 71.34 C ATOM 1739 OD1 ASN A 110 5.401 -12.509 -4.542 1.00 71.11 O ATOM 1740 ND2 ASN A 110 5.997 -10.557 -5.407 1.00 53.44 N ATOM 0 H ASN A 110 5.102 -10.503 -8.491 1.00 34.01 H new ATOM 0 HA ASN A 110 4.748 -13.226 -7.409 1.00 42.35 H new ATOM 0 HB2 ASN A 110 3.667 -10.567 -6.399 1.00 42.54 H new ATOM 0 HB3 ASN A 110 3.185 -12.129 -5.767 1.00 42.54 H new ATOM 0 HD21 ASN A 110 6.829 -10.507 -4.819 1.00 53.44 H new ATOM 0 HD22 ASN A 110 5.791 -9.805 -6.065 1.00 53.44 H new ATOM 1747 N GLY A 111 2.904 -11.625 -9.422 1.00 44.12 N ATOM 1748 CA GLY A 111 1.715 -11.716 -10.233 1.00 21.22 C ATOM 1749 C GLY A 111 0.551 -10.978 -9.597 1.00 61.02 C ATOM 1750 O GLY A 111 -0.620 -11.346 -9.792 1.00 32.51 O ATOM 0 H GLY A 111 3.570 -10.909 -9.712 1.00 44.12 H new ATOM 0 HA2 GLY A 111 1.914 -11.301 -11.221 1.00 21.22 H new ATOM 0 HA3 GLY A 111 1.449 -12.764 -10.375 1.00 21.22 H new ATOM 1754 N VAL A 112 0.871 -9.936 -8.852 1.00 31.52 N ATOM 1755 CA VAL A 112 -0.121 -9.140 -8.156 1.00 71.33 C ATOM 1756 C VAL A 112 -0.712 -8.110 -9.099 1.00 63.33 C ATOM 1757 O VAL A 112 -0.007 -7.246 -9.612 1.00 44.13 O ATOM 1758 CB VAL A 112 0.484 -8.435 -6.911 1.00 13.21 C ATOM 1759 CG1 VAL A 112 -0.542 -7.534 -6.243 1.00 21.22 C ATOM 1760 CG2 VAL A 112 0.990 -9.465 -5.917 1.00 45.03 C ATOM 0 H VAL A 112 1.830 -9.617 -8.713 1.00 31.52 H new ATOM 0 HA VAL A 112 -0.907 -9.811 -7.811 1.00 71.33 H new ATOM 0 HB VAL A 112 1.319 -7.819 -7.245 1.00 13.21 H new ATOM 0 HG11 VAL A 112 -0.093 -7.053 -5.374 1.00 21.22 H new ATOM 0 HG12 VAL A 112 -0.872 -6.773 -6.949 1.00 21.22 H new ATOM 0 HG13 VAL A 112 -1.398 -8.130 -5.925 1.00 21.22 H new ATOM 0 HG21 VAL A 112 1.411 -8.957 -5.049 1.00 45.03 H new ATOM 0 HG22 VAL A 112 0.164 -10.101 -5.599 1.00 45.03 H new ATOM 0 HG23 VAL A 112 1.759 -10.078 -6.388 1.00 45.03 H new ATOM 1770 N THR A 113 -1.986 -8.224 -9.328 1.00 4.51 N ATOM 1771 CA THR A 113 -2.705 -7.358 -10.235 1.00 73.25 C ATOM 1772 C THR A 113 -3.741 -6.542 -9.503 1.00 72.50 C ATOM 1773 O THR A 113 -4.520 -5.830 -10.122 1.00 43.23 O ATOM 1774 CB THR A 113 -3.407 -8.207 -11.301 1.00 65.42 C ATOM 1775 OG1 THR A 113 -4.197 -9.245 -10.649 1.00 45.45 O ATOM 1776 CG2 THR A 113 -2.390 -8.846 -12.231 1.00 14.13 C ATOM 0 H THR A 113 -2.572 -8.932 -8.885 1.00 4.51 H new ATOM 0 HA THR A 113 -1.988 -6.680 -10.697 1.00 73.25 H new ATOM 0 HB THR A 113 -4.059 -7.563 -11.891 1.00 65.42 H new ATOM 0 HG1 THR A 113 -4.775 -8.838 -9.970 1.00 45.45 H new ATOM 0 HG21 THR A 113 -2.908 -9.444 -12.980 1.00 14.13 H new ATOM 0 HG22 THR A 113 -1.810 -8.067 -12.726 1.00 14.13 H new ATOM 0 HG23 THR A 113 -1.721 -9.486 -11.655 1.00 14.13 H new ATOM 1784 N ASP A 114 -3.757 -6.643 -8.198 1.00 54.41 N ATOM 1785 CA ASP A 114 -4.722 -5.916 -7.395 1.00 41.34 C ATOM 1786 C ASP A 114 -3.975 -5.341 -6.226 1.00 61.02 C ATOM 1787 O ASP A 114 -3.347 -6.082 -5.444 1.00 33.21 O ATOM 1788 CB ASP A 114 -5.833 -6.867 -6.902 1.00 31.41 C ATOM 1789 CG ASP A 114 -6.501 -7.642 -8.030 1.00 72.03 C ATOM 1790 OD1 ASP A 114 -5.904 -8.646 -8.509 1.00 5.04 O ATOM 1791 OD2 ASP A 114 -7.607 -7.279 -8.472 1.00 23.14 O ATOM 0 H ASP A 114 -3.112 -7.223 -7.662 1.00 54.41 H new ATOM 0 HA ASP A 114 -5.197 -5.128 -7.979 1.00 41.34 H new ATOM 0 HB2 ASP A 114 -5.409 -7.572 -6.187 1.00 31.41 H new ATOM 0 HB3 ASP A 114 -6.588 -6.289 -6.370 1.00 31.41 H new ATOM 1796 N LEU A 115 -4.010 -4.054 -6.100 1.00 40.22 N ATOM 1797 CA LEU A 115 -3.242 -3.379 -5.102 1.00 54.14 C ATOM 1798 C LEU A 115 -4.102 -2.232 -4.532 1.00 25.40 C ATOM 1799 O LEU A 115 -4.671 -1.446 -5.282 1.00 72.25 O ATOM 1800 CB LEU A 115 -1.953 -2.864 -5.790 1.00 60.23 C ATOM 1801 CG LEU A 115 -0.706 -2.620 -4.926 1.00 41.24 C ATOM 1802 CD1 LEU A 115 0.458 -2.188 -5.805 1.00 45.41 C ATOM 1803 CD2 LEU A 115 -0.954 -1.596 -3.855 1.00 63.43 C ATOM 0 H LEU A 115 -4.573 -3.439 -6.687 1.00 40.22 H new ATOM 0 HA LEU A 115 -2.960 -4.027 -4.272 1.00 54.14 H new ATOM 0 HB2 LEU A 115 -1.683 -3.580 -6.566 1.00 60.23 H new ATOM 0 HB3 LEU A 115 -2.197 -1.927 -6.291 1.00 60.23 H new ATOM 0 HG LEU A 115 -0.460 -3.558 -4.429 1.00 41.24 H new ATOM 0 HD11 LEU A 115 1.338 -2.017 -5.185 1.00 45.41 H new ATOM 0 HD12 LEU A 115 0.674 -2.970 -6.533 1.00 45.41 H new ATOM 0 HD13 LEU A 115 0.198 -1.267 -6.327 1.00 45.41 H new ATOM 0 HD21 LEU A 115 -0.046 -1.455 -3.269 1.00 63.43 H new ATOM 0 HD22 LEU A 115 -1.239 -0.650 -4.315 1.00 63.43 H new ATOM 0 HD23 LEU A 115 -1.757 -1.939 -3.203 1.00 63.43 H new ATOM 1815 N SER A 116 -4.190 -2.146 -3.238 1.00 50.42 N ATOM 1816 CA SER A 116 -5.016 -1.168 -2.600 1.00 74.41 C ATOM 1817 C SER A 116 -4.194 -0.270 -1.682 1.00 65.35 C ATOM 1818 O SER A 116 -3.220 -0.708 -1.088 1.00 42.02 O ATOM 1819 CB SER A 116 -6.131 -1.877 -1.824 1.00 25.14 C ATOM 1820 OG SER A 116 -5.601 -2.822 -0.901 1.00 21.41 O ATOM 0 H SER A 116 -3.688 -2.756 -2.593 1.00 50.42 H new ATOM 0 HA SER A 116 -5.463 -0.528 -3.361 1.00 74.41 H new ATOM 0 HB2 SER A 116 -6.730 -1.140 -1.289 1.00 25.14 H new ATOM 0 HB3 SER A 116 -6.798 -2.383 -2.522 1.00 25.14 H new ATOM 0 HG SER A 116 -4.875 -3.324 -1.327 1.00 21.41 H new ATOM 1826 N MET A 117 -4.566 0.969 -1.597 1.00 42.55 N ATOM 1827 CA MET A 117 -3.902 1.924 -0.741 1.00 71.03 C ATOM 1828 C MET A 117 -4.949 2.844 -0.131 1.00 53.21 C ATOM 1829 O MET A 117 -6.085 2.881 -0.610 1.00 35.21 O ATOM 1830 CB MET A 117 -2.805 2.738 -1.509 1.00 24.22 C ATOM 1831 CG MET A 117 -3.295 3.556 -2.714 1.00 74.44 C ATOM 1832 SD MET A 117 -3.855 2.544 -4.095 1.00 4.14 S ATOM 1833 CE MET A 117 -2.349 1.668 -4.511 1.00 20.35 C ATOM 0 H MET A 117 -5.348 1.359 -2.123 1.00 42.55 H new ATOM 0 HA MET A 117 -3.381 1.386 0.051 1.00 71.03 H new ATOM 0 HB2 MET A 117 -2.325 3.417 -0.805 1.00 24.22 H new ATOM 0 HB3 MET A 117 -2.039 2.043 -1.854 1.00 24.22 H new ATOM 0 HG2 MET A 117 -4.112 4.204 -2.395 1.00 74.44 H new ATOM 0 HG3 MET A 117 -2.488 4.205 -3.054 1.00 74.44 H new ATOM 0 HE1 MET A 117 -2.537 1.000 -5.352 1.00 20.35 H new ATOM 0 HE2 MET A 117 -1.574 2.385 -4.783 1.00 20.35 H new ATOM 0 HE3 MET A 117 -2.018 1.085 -3.651 1.00 20.35 H new ATOM 1843 N PRO A 118 -4.617 3.576 0.948 1.00 24.13 N ATOM 1844 CA PRO A 118 -5.561 4.469 1.590 1.00 62.34 C ATOM 1845 C PRO A 118 -5.620 5.817 0.881 1.00 2.03 C ATOM 1846 O PRO A 118 -5.160 5.965 -0.261 1.00 61.31 O ATOM 1847 CB PRO A 118 -4.947 4.636 2.978 1.00 33.33 C ATOM 1848 CG PRO A 118 -3.493 4.627 2.702 1.00 52.11 C ATOM 1849 CD PRO A 118 -3.304 3.602 1.630 1.00 4.52 C ATOM 0 HA PRO A 118 -6.583 4.089 1.589 1.00 62.34 H new ATOM 0 HB2 PRO A 118 -5.263 5.567 3.450 1.00 33.33 H new ATOM 0 HB3 PRO A 118 -5.236 3.826 3.647 1.00 33.33 H new ATOM 0 HG2 PRO A 118 -3.148 5.608 2.374 1.00 52.11 H new ATOM 0 HG3 PRO A 118 -2.924 4.371 3.596 1.00 52.11 H new ATOM 0 HD2 PRO A 118 -2.501 3.878 0.946 1.00 4.52 H new ATOM 0 HD3 PRO A 118 -3.047 2.628 2.046 1.00 4.52 H new ATOM 1857 N ARG A 119 -6.164 6.788 1.563 1.00 31.13 N ATOM 1858 CA ARG A 119 -6.283 8.113 1.047 1.00 24.40 C ATOM 1859 C ARG A 119 -4.925 8.814 1.159 1.00 45.32 C ATOM 1860 O ARG A 119 -4.641 9.519 2.131 1.00 60.21 O ATOM 1861 CB ARG A 119 -7.382 8.863 1.825 1.00 4.04 C ATOM 1862 CG ARG A 119 -7.729 10.254 1.330 1.00 14.41 C ATOM 1863 CD ARG A 119 -8.827 10.851 2.195 1.00 61.03 C ATOM 1864 NE ARG A 119 -9.275 12.156 1.722 1.00 53.12 N ATOM 1865 CZ ARG A 119 -10.184 12.924 2.337 1.00 10.35 C ATOM 1866 NH1 ARG A 119 -10.751 12.522 3.482 1.00 65.13 N ATOM 1867 NH2 ARG A 119 -10.532 14.087 1.800 1.00 10.32 N ATOM 0 H ARG A 119 -6.540 6.674 2.504 1.00 31.13 H new ATOM 0 HA ARG A 119 -6.570 8.096 -0.004 1.00 24.40 H new ATOM 0 HB2 ARG A 119 -8.288 8.258 1.805 1.00 4.04 H new ATOM 0 HB3 ARG A 119 -7.072 8.939 2.867 1.00 4.04 H new ATOM 0 HG2 ARG A 119 -6.845 10.891 1.358 1.00 14.41 H new ATOM 0 HG3 ARG A 119 -8.056 10.209 0.291 1.00 14.41 H new ATOM 0 HD2 ARG A 119 -9.676 10.168 2.219 1.00 61.03 H new ATOM 0 HD3 ARG A 119 -8.465 10.946 3.219 1.00 61.03 H new ATOM 0 HE ARG A 119 -8.865 12.511 0.858 1.00 53.12 H new ATOM 0 HH11 ARG A 119 -10.491 11.625 3.892 1.00 65.13 H new ATOM 0 HH12 ARG A 119 -11.442 13.113 3.944 1.00 65.13 H new ATOM 0 HH21 ARG A 119 -10.108 14.391 0.924 1.00 10.32 H new ATOM 0 HH22 ARG A 119 -11.224 14.676 2.264 1.00 10.32 H new ATOM 1980 N LEU A 127 1.028 18.608 -3.987 1.00 25.34 N ATOM 1981 CA LEU A 127 0.814 17.981 -5.258 1.00 52.31 C ATOM 1982 C LEU A 127 -0.596 17.493 -5.321 1.00 51.14 C ATOM 1983 O LEU A 127 -1.112 16.910 -4.356 1.00 25.43 O ATOM 1984 CB LEU A 127 1.789 16.833 -5.568 1.00 42.34 C ATOM 1985 CG LEU A 127 1.768 15.589 -4.686 1.00 14.43 C ATOM 1986 CD1 LEU A 127 2.650 14.539 -5.303 1.00 62.32 C ATOM 1987 CD2 LEU A 127 2.261 15.916 -3.309 1.00 64.43 C ATOM 0 HA LEU A 127 1.005 18.736 -6.021 1.00 52.31 H new ATOM 0 HB2 LEU A 127 1.605 16.513 -6.594 1.00 42.34 H new ATOM 0 HB3 LEU A 127 2.799 17.241 -5.538 1.00 42.34 H new ATOM 0 HG LEU A 127 0.745 15.220 -4.609 1.00 14.43 H new ATOM 0 HD11 LEU A 127 2.642 13.645 -4.680 1.00 62.32 H new ATOM 0 HD12 LEU A 127 2.280 14.291 -6.298 1.00 62.32 H new ATOM 0 HD13 LEU A 127 3.669 14.919 -5.380 1.00 62.32 H new ATOM 0 HD21 LEU A 127 2.240 15.018 -2.692 1.00 64.43 H new ATOM 0 HD22 LEU A 127 3.283 16.292 -3.368 1.00 64.43 H new ATOM 0 HD23 LEU A 127 1.620 16.677 -2.864 1.00 64.43 H new ATOM 1999 N GLN A 128 -1.206 17.700 -6.423 1.00 54.03 N ATOM 2000 CA GLN A 128 -2.572 17.424 -6.583 1.00 61.10 C ATOM 2001 C GLN A 128 -2.778 15.982 -7.024 1.00 35.21 C ATOM 2002 O GLN A 128 -2.025 15.459 -7.856 1.00 22.44 O ATOM 2003 CB GLN A 128 -3.159 18.410 -7.580 1.00 33.30 C ATOM 2004 CG GLN A 128 -4.620 18.229 -7.810 1.00 3.21 C ATOM 2005 CD GLN A 128 -5.437 18.381 -6.535 1.00 54.42 C ATOM 2006 OE1 GLN A 128 -5.670 17.404 -5.814 1.00 53.13 O ATOM 2007 NE2 GLN A 128 -5.869 19.571 -6.254 1.00 12.24 N ATOM 0 H GLN A 128 -0.755 18.075 -7.257 1.00 54.03 H new ATOM 0 HA GLN A 128 -3.090 17.541 -5.631 1.00 61.10 H new ATOM 0 HB2 GLN A 128 -2.979 19.424 -7.224 1.00 33.30 H new ATOM 0 HB3 GLN A 128 -2.635 18.308 -8.530 1.00 33.30 H new ATOM 0 HG2 GLN A 128 -4.961 18.958 -8.545 1.00 3.21 H new ATOM 0 HG3 GLN A 128 -4.797 17.241 -8.235 1.00 3.21 H new ATOM 0 HE21 GLN A 128 -5.655 20.351 -6.875 1.00 12.24 H new ATOM 0 HE22 GLN A 128 -6.423 19.727 -5.412 1.00 12.24 H new ATOM 2016 N TRP A 129 -3.813 15.353 -6.480 1.00 1.32 N ATOM 2017 CA TRP A 129 -4.102 13.960 -6.742 1.00 30.15 C ATOM 2018 C TRP A 129 -4.391 13.699 -8.198 1.00 12.33 C ATOM 2019 O TRP A 129 -4.021 12.671 -8.710 1.00 73.33 O ATOM 2020 CB TRP A 129 -5.246 13.456 -5.878 1.00 42.20 C ATOM 2021 CG TRP A 129 -5.613 12.028 -6.168 1.00 1.34 C ATOM 2022 CD1 TRP A 129 -6.682 11.593 -6.887 1.00 32.32 C ATOM 2023 CD2 TRP A 129 -4.892 10.855 -5.776 1.00 55.24 C ATOM 2024 NE1 TRP A 129 -6.672 10.233 -6.964 1.00 11.32 N ATOM 2025 CE2 TRP A 129 -5.589 9.749 -6.289 1.00 11.12 C ATOM 2026 CE3 TRP A 129 -3.729 10.634 -5.041 1.00 32.52 C ATOM 2027 CZ2 TRP A 129 -5.163 8.441 -6.093 1.00 32.21 C ATOM 2028 CZ3 TRP A 129 -3.308 9.337 -4.846 1.00 61.33 C ATOM 2029 CH2 TRP A 129 -4.021 8.256 -5.370 1.00 25.24 C ATOM 0 H TRP A 129 -4.473 15.801 -5.844 1.00 1.32 H new ATOM 0 HA TRP A 129 -3.201 13.406 -6.480 1.00 30.15 H new ATOM 0 HB2 TRP A 129 -4.969 13.549 -4.828 1.00 42.20 H new ATOM 0 HB3 TRP A 129 -6.119 14.089 -6.035 1.00 42.20 H new ATOM 0 HD1 TRP A 129 -7.430 12.232 -7.332 1.00 32.32 H new ATOM 0 HE1 TRP A 129 -7.366 9.665 -7.450 1.00 11.32 H new ATOM 0 HE3 TRP A 129 -3.169 11.462 -4.633 1.00 32.52 H new ATOM 0 HZ2 TRP A 129 -5.714 7.604 -6.497 1.00 32.21 H new ATOM 0 HZ3 TRP A 129 -2.409 9.152 -4.277 1.00 61.33 H new ATOM 0 HH2 TRP A 129 -3.660 7.252 -5.199 1.00 25.24 H new ATOM 2040 N GLU A 130 -5.045 14.625 -8.855 1.00 34.22 N ATOM 2041 CA GLU A 130 -5.347 14.475 -10.267 1.00 53.21 C ATOM 2042 C GLU A 130 -4.057 14.281 -11.095 1.00 14.53 C ATOM 2043 O GLU A 130 -4.038 13.536 -12.082 1.00 40.41 O ATOM 2044 CB GLU A 130 -6.175 15.652 -10.761 1.00 1.24 C ATOM 2045 CG GLU A 130 -6.594 15.552 -12.209 1.00 50.33 C ATOM 2046 CD GLU A 130 -7.514 16.659 -12.604 1.00 72.02 C ATOM 2047 OE1 GLU A 130 -7.038 17.761 -12.903 1.00 65.53 O ATOM 2048 OE2 GLU A 130 -8.748 16.446 -12.600 1.00 73.42 O ATOM 0 H GLU A 130 -5.381 15.493 -8.439 1.00 34.22 H new ATOM 0 HA GLU A 130 -5.945 13.574 -10.401 1.00 53.21 H new ATOM 0 HB2 GLU A 130 -7.068 15.739 -10.142 1.00 1.24 H new ATOM 0 HB3 GLU A 130 -5.601 16.568 -10.623 1.00 1.24 H new ATOM 0 HG2 GLU A 130 -5.709 15.573 -12.845 1.00 50.33 H new ATOM 0 HG3 GLU A 130 -7.086 14.594 -12.378 1.00 50.33 H new ATOM 2055 N ASN A 131 -2.978 14.919 -10.666 1.00 44.13 N ATOM 2056 CA ASN A 131 -1.695 14.751 -11.333 1.00 12.20 C ATOM 2057 C ASN A 131 -1.102 13.413 -10.940 1.00 63.20 C ATOM 2058 O ASN A 131 -0.519 12.718 -11.759 1.00 15.00 O ATOM 2059 CB ASN A 131 -0.709 15.868 -10.983 1.00 22.34 C ATOM 2060 CG ASN A 131 -1.183 17.246 -11.381 1.00 21.02 C ATOM 2061 OD1 ASN A 131 -1.945 17.412 -12.338 1.00 41.41 O ATOM 2062 ND2 ASN A 131 -0.722 18.241 -10.666 1.00 14.24 N ATOM 0 H ASN A 131 -2.964 15.552 -9.866 1.00 44.13 H new ATOM 0 HA ASN A 131 -1.870 14.794 -12.408 1.00 12.20 H new ATOM 0 HB2 ASN A 131 -0.524 15.854 -9.909 1.00 22.34 H new ATOM 0 HB3 ASN A 131 0.243 15.666 -11.473 1.00 22.34 H new ATOM 0 HD21 ASN A 131 -0.991 19.199 -10.892 1.00 14.24 H new ATOM 0 HD22 ASN A 131 -0.094 18.059 -9.883 1.00 14.24 H new ATOM 2069 N VAL A 132 -1.280 13.050 -9.672 1.00 23.43 N ATOM 2070 CA VAL A 132 -0.817 11.764 -9.156 1.00 23.43 C ATOM 2071 C VAL A 132 -1.525 10.620 -9.885 1.00 4.23 C ATOM 2072 O VAL A 132 -0.896 9.668 -10.307 1.00 3.45 O ATOM 2073 CB VAL A 132 -1.069 11.631 -7.629 1.00 41.23 C ATOM 2074 CG1 VAL A 132 -0.602 10.277 -7.118 1.00 75.25 C ATOM 2075 CG2 VAL A 132 -0.376 12.752 -6.869 1.00 65.24 C ATOM 0 H VAL A 132 -1.746 13.634 -8.978 1.00 23.43 H new ATOM 0 HA VAL A 132 0.258 11.710 -9.331 1.00 23.43 H new ATOM 0 HB VAL A 132 -2.143 11.710 -7.458 1.00 41.23 H new ATOM 0 HG11 VAL A 132 -0.789 10.208 -6.046 1.00 75.25 H new ATOM 0 HG12 VAL A 132 -1.147 9.486 -7.633 1.00 75.25 H new ATOM 0 HG13 VAL A 132 0.465 10.165 -7.308 1.00 75.25 H new ATOM 0 HG21 VAL A 132 -0.566 12.639 -5.802 1.00 65.24 H new ATOM 0 HG22 VAL A 132 0.697 12.707 -7.053 1.00 65.24 H new ATOM 0 HG23 VAL A 132 -0.762 13.714 -7.207 1.00 65.24 H new ATOM 2085 N SER A 133 -2.830 10.754 -10.036 1.00 13.55 N ATOM 2086 CA SER A 133 -3.666 9.798 -10.733 1.00 45.22 C ATOM 2087 C SER A 133 -3.158 9.590 -12.160 1.00 71.45 C ATOM 2088 O SER A 133 -3.184 8.473 -12.675 1.00 70.55 O ATOM 2089 CB SER A 133 -5.141 10.291 -10.709 1.00 64.32 C ATOM 2090 OG SER A 133 -6.023 9.436 -11.432 1.00 62.51 O ATOM 0 H SER A 133 -3.349 11.551 -9.668 1.00 13.55 H new ATOM 0 HA SER A 133 -3.621 8.832 -10.231 1.00 45.22 H new ATOM 0 HB2 SER A 133 -5.478 10.362 -9.675 1.00 64.32 H new ATOM 0 HB3 SER A 133 -5.190 11.295 -11.130 1.00 64.32 H new ATOM 0 HG SER A 133 -6.935 9.791 -11.383 1.00 62.51 H new ATOM 2096 N ALA A 134 -2.678 10.664 -12.778 1.00 21.10 N ATOM 2097 CA ALA A 134 -2.104 10.584 -14.104 1.00 54.31 C ATOM 2098 C ALA A 134 -0.750 9.885 -14.040 1.00 11.21 C ATOM 2099 O ALA A 134 -0.472 8.989 -14.809 1.00 74.15 O ATOM 2100 CB ALA A 134 -1.958 11.975 -14.703 1.00 22.02 C ATOM 0 H ALA A 134 -2.678 11.601 -12.375 1.00 21.10 H new ATOM 0 HA ALA A 134 -2.769 10.005 -14.744 1.00 54.31 H new ATOM 0 HB1 ALA A 134 -1.525 11.898 -15.700 1.00 22.02 H new ATOM 0 HB2 ALA A 134 -2.938 12.448 -14.768 1.00 22.02 H new ATOM 0 HB3 ALA A 134 -1.306 12.577 -14.070 1.00 22.02 H new ATOM 2106 N MET A 135 0.068 10.300 -13.090 1.00 14.04 N ATOM 2107 CA MET A 135 1.398 9.741 -12.874 1.00 71.14 C ATOM 2108 C MET A 135 1.355 8.233 -12.562 1.00 34.11 C ATOM 2109 O MET A 135 2.217 7.488 -13.006 1.00 14.24 O ATOM 2110 CB MET A 135 2.137 10.532 -11.789 1.00 52.41 C ATOM 2111 CG MET A 135 3.539 10.038 -11.487 1.00 61.45 C ATOM 2112 SD MET A 135 4.446 11.147 -10.384 1.00 42.33 S ATOM 2113 CE MET A 135 3.420 11.141 -8.925 1.00 53.31 C ATOM 0 H MET A 135 -0.172 11.045 -12.436 1.00 14.04 H new ATOM 0 HA MET A 135 1.957 9.838 -13.805 1.00 71.14 H new ATOM 0 HB2 MET A 135 2.193 11.577 -12.095 1.00 52.41 H new ATOM 0 HB3 MET A 135 1.550 10.499 -10.871 1.00 52.41 H new ATOM 0 HG2 MET A 135 3.482 9.048 -11.034 1.00 61.45 H new ATOM 0 HG3 MET A 135 4.091 9.929 -12.421 1.00 61.45 H new ATOM 0 HE1 MET A 135 4.000 11.489 -8.071 1.00 53.31 H new ATOM 0 HE2 MET A 135 2.567 11.802 -9.078 1.00 53.31 H new ATOM 0 HE3 MET A 135 3.065 10.128 -8.734 1.00 53.31 H new ATOM 2123 N ILE A 136 0.345 7.793 -11.817 1.00 64.23 N ATOM 2124 CA ILE A 136 0.148 6.361 -11.538 1.00 54.34 C ATOM 2125 C ILE A 136 -0.077 5.610 -12.858 1.00 31.52 C ATOM 2126 O ILE A 136 0.450 4.529 -13.066 1.00 41.10 O ATOM 2127 CB ILE A 136 -1.045 6.124 -10.553 1.00 4.24 C ATOM 2128 CG1 ILE A 136 -0.733 6.764 -9.188 1.00 2.14 C ATOM 2129 CG2 ILE A 136 -1.363 4.633 -10.391 1.00 11.31 C ATOM 2130 CD1 ILE A 136 -1.845 6.633 -8.166 1.00 43.22 C ATOM 0 H ILE A 136 -0.354 8.403 -11.392 1.00 64.23 H new ATOM 0 HA ILE A 136 1.045 5.977 -11.052 1.00 54.34 H new ATOM 0 HB ILE A 136 -1.930 6.598 -10.977 1.00 4.24 H new ATOM 0 HG12 ILE A 136 0.171 6.307 -8.784 1.00 2.14 H new ATOM 0 HG13 ILE A 136 -0.516 7.822 -9.337 1.00 2.14 H new ATOM 0 HG21 ILE A 136 -2.197 4.512 -9.699 1.00 11.31 H new ATOM 0 HG22 ILE A 136 -1.631 4.211 -11.360 1.00 11.31 H new ATOM 0 HG23 ILE A 136 -0.488 4.115 -9.999 1.00 11.31 H new ATOM 0 HD11 ILE A 136 -1.541 7.111 -7.235 1.00 43.22 H new ATOM 0 HD12 ILE A 136 -2.746 7.116 -8.545 1.00 43.22 H new ATOM 0 HD13 ILE A 136 -2.048 5.578 -7.983 1.00 43.22 H new ATOM 2142 N GLU A 137 -0.824 6.232 -13.741 1.00 31.32 N ATOM 2143 CA GLU A 137 -1.076 5.725 -15.084 1.00 63.23 C ATOM 2144 C GLU A 137 0.186 5.746 -15.933 1.00 34.25 C ATOM 2145 O GLU A 137 0.356 4.926 -16.823 1.00 52.54 O ATOM 2146 CB GLU A 137 -2.181 6.548 -15.729 1.00 0.23 C ATOM 2147 CG GLU A 137 -3.555 6.165 -15.248 1.00 2.42 C ATOM 2148 CD GLU A 137 -4.039 4.930 -15.953 1.00 41.52 C ATOM 2149 OE1 GLU A 137 -3.545 3.831 -15.682 1.00 21.14 O ATOM 2150 OE2 GLU A 137 -4.901 5.063 -16.841 1.00 64.30 O ATOM 0 H GLU A 137 -1.285 7.121 -13.549 1.00 31.32 H new ATOM 0 HA GLU A 137 -1.394 4.685 -15.014 1.00 63.23 H new ATOM 0 HB2 GLU A 137 -2.010 7.604 -15.520 1.00 0.23 H new ATOM 0 HB3 GLU A 137 -2.133 6.426 -16.811 1.00 0.23 H new ATOM 0 HG2 GLU A 137 -3.534 5.991 -14.172 1.00 2.42 H new ATOM 0 HG3 GLU A 137 -4.250 6.986 -15.424 1.00 2.42 H new ATOM 2157 N GLU A 138 1.059 6.691 -15.662 1.00 12.25 N ATOM 2158 CA GLU A 138 2.322 6.782 -16.365 1.00 32.10 C ATOM 2159 C GLU A 138 3.265 5.703 -15.875 1.00 20.03 C ATOM 2160 O GLU A 138 4.028 5.146 -16.631 1.00 54.24 O ATOM 2161 CB GLU A 138 2.969 8.137 -16.161 1.00 61.25 C ATOM 2162 CG GLU A 138 2.106 9.318 -16.530 1.00 25.11 C ATOM 2163 CD GLU A 138 2.861 10.603 -16.425 1.00 53.24 C ATOM 2164 OE1 GLU A 138 3.280 10.962 -15.319 1.00 21.32 O ATOM 2165 OE2 GLU A 138 3.095 11.267 -17.468 1.00 53.02 O ATOM 0 H GLU A 138 0.917 7.412 -14.955 1.00 12.25 H new ATOM 0 HA GLU A 138 2.122 6.648 -17.428 1.00 32.10 H new ATOM 0 HB2 GLU A 138 3.258 8.231 -15.114 1.00 61.25 H new ATOM 0 HB3 GLU A 138 3.885 8.178 -16.750 1.00 61.25 H new ATOM 0 HG2 GLU A 138 1.735 9.195 -17.548 1.00 25.11 H new ATOM 0 HG3 GLU A 138 1.235 9.352 -15.875 1.00 25.11 H new ATOM 2172 N VAL A 139 3.221 5.435 -14.603 1.00 24.12 N ATOM 2173 CA VAL A 139 4.050 4.405 -14.026 1.00 44.11 C ATOM 2174 C VAL A 139 3.522 3.007 -14.392 1.00 33.32 C ATOM 2175 O VAL A 139 4.258 2.176 -14.912 1.00 54.54 O ATOM 2176 CB VAL A 139 4.190 4.578 -12.483 1.00 43.33 C ATOM 2177 CG1 VAL A 139 4.941 3.414 -11.881 1.00 24.53 C ATOM 2178 CG2 VAL A 139 4.919 5.889 -12.153 1.00 55.35 C ATOM 0 H VAL A 139 2.617 5.916 -13.937 1.00 24.12 H new ATOM 0 HA VAL A 139 5.049 4.506 -14.450 1.00 44.11 H new ATOM 0 HB VAL A 139 3.188 4.610 -12.055 1.00 43.33 H new ATOM 0 HG11 VAL A 139 5.027 3.555 -10.804 1.00 24.53 H new ATOM 0 HG12 VAL A 139 4.401 2.489 -12.084 1.00 24.53 H new ATOM 0 HG13 VAL A 139 5.937 3.357 -12.320 1.00 24.53 H new ATOM 0 HG21 VAL A 139 5.008 5.994 -11.072 1.00 55.35 H new ATOM 0 HG22 VAL A 139 5.913 5.875 -12.599 1.00 55.35 H new ATOM 0 HG23 VAL A 139 4.354 6.730 -12.554 1.00 55.35 H new ATOM 2188 N PHE A 140 2.251 2.784 -14.151 1.00 50.03 N ATOM 2189 CA PHE A 140 1.597 1.505 -14.429 1.00 25.22 C ATOM 2190 C PHE A 140 1.330 1.205 -15.882 1.00 41.32 C ATOM 2191 O PHE A 140 0.938 0.093 -16.179 1.00 63.43 O ATOM 2192 CB PHE A 140 0.362 1.227 -13.582 1.00 20.42 C ATOM 2193 CG PHE A 140 0.650 0.752 -12.185 1.00 43.31 C ATOM 2194 CD1 PHE A 140 1.019 -0.574 -11.955 1.00 43.34 C ATOM 2195 CD2 PHE A 140 0.528 1.594 -11.104 1.00 32.02 C ATOM 2196 CE1 PHE A 140 1.258 -1.031 -10.693 1.00 33.22 C ATOM 2197 CE2 PHE A 140 0.763 1.125 -9.825 1.00 65.12 C ATOM 2198 CZ PHE A 140 1.127 -0.198 -9.631 1.00 71.21 C ATOM 0 H PHE A 140 1.627 3.486 -13.753 1.00 50.03 H new ATOM 0 HA PHE A 140 2.369 0.802 -14.118 1.00 25.22 H new ATOM 0 HB2 PHE A 140 -0.235 2.137 -13.525 1.00 20.42 H new ATOM 0 HB3 PHE A 140 -0.247 0.477 -14.087 1.00 20.42 H new ATOM 0 HD1 PHE A 140 1.117 -1.250 -12.791 1.00 43.34 H new ATOM 0 HD2 PHE A 140 0.247 2.626 -11.255 1.00 32.02 H new ATOM 0 HE1 PHE A 140 1.552 -2.059 -10.539 1.00 33.22 H new ATOM 0 HE2 PHE A 140 0.663 1.788 -8.979 1.00 65.12 H new ATOM 0 HZ PHE A 140 1.307 -0.566 -8.632 1.00 71.21 H new ATOM 2208 N GLU A 141 1.447 2.180 -16.780 1.00 51.22 N ATOM 2209 CA GLU A 141 1.241 1.900 -18.200 1.00 54.52 C ATOM 2210 C GLU A 141 2.046 0.654 -18.615 1.00 14.53 C ATOM 2211 O GLU A 141 3.197 0.479 -18.200 1.00 63.22 O ATOM 2212 CB GLU A 141 1.590 3.100 -19.081 1.00 24.21 C ATOM 2213 CG GLU A 141 3.034 3.519 -19.024 1.00 13.42 C ATOM 2214 CD GLU A 141 3.343 4.692 -19.923 1.00 1.04 C ATOM 2215 OE1 GLU A 141 3.200 5.862 -19.491 1.00 20.13 O ATOM 2216 OE2 GLU A 141 3.741 4.465 -21.081 1.00 71.22 O ATOM 0 H GLU A 141 1.678 3.149 -16.559 1.00 51.22 H new ATOM 0 HA GLU A 141 0.180 1.701 -18.350 1.00 54.52 H new ATOM 0 HB2 GLU A 141 1.335 2.863 -20.114 1.00 24.21 H new ATOM 0 HB3 GLU A 141 0.968 3.945 -18.785 1.00 24.21 H new ATOM 0 HG2 GLU A 141 3.291 3.778 -17.997 1.00 13.42 H new ATOM 0 HG3 GLU A 141 3.663 2.675 -19.308 1.00 13.42 H new ATOM 2223 N ALA A 142 1.391 -0.205 -19.372 1.00 4.24 N ATOM 2224 CA ALA A 142 1.885 -1.522 -19.809 1.00 3.45 C ATOM 2225 C ALA A 142 1.665 -2.625 -18.751 1.00 40.33 C ATOM 2226 O ALA A 142 1.647 -3.809 -19.084 1.00 62.45 O ATOM 2227 CB ALA A 142 3.327 -1.498 -20.340 1.00 2.11 C ATOM 0 H ALA A 142 0.454 -0.006 -19.722 1.00 4.24 H new ATOM 0 HA ALA A 142 1.265 -1.785 -20.666 1.00 3.45 H new ATOM 0 HB1 ALA A 142 3.620 -2.503 -20.642 1.00 2.11 H new ATOM 0 HB2 ALA A 142 3.388 -0.829 -21.198 1.00 2.11 H new ATOM 0 HB3 ALA A 142 3.997 -1.145 -19.556 1.00 2.11 H new ATOM 2233 N THR A 143 1.477 -2.246 -17.498 1.00 2.11 N ATOM 2234 CA THR A 143 1.209 -3.214 -16.443 1.00 71.42 C ATOM 2235 C THR A 143 -0.233 -3.068 -15.962 1.00 11.14 C ATOM 2236 O THR A 143 -0.603 -2.056 -15.363 1.00 2.55 O ATOM 2237 CB THR A 143 2.184 -3.057 -15.232 1.00 71.14 C ATOM 2238 OG1 THR A 143 2.084 -1.752 -14.676 1.00 44.01 O ATOM 2239 CG2 THR A 143 3.606 -3.271 -15.656 1.00 34.10 C ATOM 0 H THR A 143 1.505 -1.276 -17.185 1.00 2.11 H new ATOM 0 HA THR A 143 1.366 -4.207 -16.865 1.00 71.42 H new ATOM 0 HB THR A 143 1.902 -3.806 -14.492 1.00 71.14 H new ATOM 0 HG1 THR A 143 1.337 -1.275 -15.094 1.00 44.01 H new ATOM 0 HG21 THR A 143 4.264 -3.156 -14.794 1.00 34.10 H new ATOM 0 HG22 THR A 143 3.716 -4.275 -16.065 1.00 34.10 H new ATOM 0 HG23 THR A 143 3.873 -2.538 -16.417 1.00 34.10 H new ATOM 2247 N ASP A 144 -1.053 -4.044 -16.223 1.00 50.23 N ATOM 2248 CA ASP A 144 -2.437 -3.927 -15.812 1.00 42.44 C ATOM 2249 C ASP A 144 -2.664 -4.417 -14.405 1.00 25.23 C ATOM 2250 O ASP A 144 -2.897 -5.604 -14.159 1.00 1.30 O ATOM 2251 CB ASP A 144 -3.431 -4.546 -16.788 1.00 21.32 C ATOM 2252 CG ASP A 144 -4.853 -4.409 -16.277 1.00 22.22 C ATOM 2253 OD1 ASP A 144 -5.369 -3.264 -16.206 1.00 1.42 O ATOM 2254 OD2 ASP A 144 -5.480 -5.437 -15.939 1.00 14.51 O ATOM 0 H ASP A 144 -0.806 -4.909 -16.704 1.00 50.23 H new ATOM 0 HA ASP A 144 -2.639 -2.856 -15.825 1.00 42.44 H new ATOM 0 HB2 ASP A 144 -3.342 -4.061 -17.760 1.00 21.32 H new ATOM 0 HB3 ASP A 144 -3.194 -5.600 -16.935 1.00 21.32 H new ATOM 2259 N ILE A 145 -2.544 -3.507 -13.485 1.00 74.10 N ATOM 2260 CA ILE A 145 -2.753 -3.770 -12.092 1.00 34.11 C ATOM 2261 C ILE A 145 -3.790 -2.783 -11.579 1.00 15.11 C ATOM 2262 O ILE A 145 -3.757 -1.600 -11.935 1.00 33.00 O ATOM 2263 CB ILE A 145 -1.396 -3.654 -11.314 1.00 4.53 C ATOM 2264 CG1 ILE A 145 -0.401 -4.656 -11.929 1.00 42.13 C ATOM 2265 CG2 ILE A 145 -1.579 -3.904 -9.819 1.00 40.32 C ATOM 2266 CD1 ILE A 145 0.990 -4.552 -11.418 1.00 23.21 C ATOM 0 H ILE A 145 -2.292 -2.539 -13.686 1.00 74.10 H new ATOM 0 HA ILE A 145 -3.121 -4.784 -11.937 1.00 34.11 H new ATOM 0 HB ILE A 145 -1.009 -2.640 -11.410 1.00 4.53 H new ATOM 0 HG12 ILE A 145 -0.765 -5.667 -11.745 1.00 42.13 H new ATOM 0 HG13 ILE A 145 -0.387 -4.514 -13.010 1.00 42.13 H new ATOM 0 HG21 ILE A 145 -0.617 -3.815 -9.315 1.00 40.32 H new ATOM 0 HG22 ILE A 145 -2.273 -3.170 -9.410 1.00 40.32 H new ATOM 0 HG23 ILE A 145 -1.978 -4.906 -9.664 1.00 40.32 H new ATOM 0 HD11 ILE A 145 1.615 -5.297 -11.910 1.00 23.21 H new ATOM 0 HD12 ILE A 145 1.381 -3.556 -11.627 1.00 23.21 H new ATOM 0 HD13 ILE A 145 0.996 -4.726 -10.342 1.00 23.21 H new ATOM 2278 N LYS A 146 -4.735 -3.268 -10.822 1.00 71.42 N ATOM 2279 CA LYS A 146 -5.787 -2.439 -10.292 1.00 44.45 C ATOM 2280 C LYS A 146 -5.347 -1.732 -9.065 1.00 5.33 C ATOM 2281 O LYS A 146 -4.697 -2.310 -8.192 1.00 14.32 O ATOM 2282 CB LYS A 146 -7.094 -3.210 -10.018 1.00 55.54 C ATOM 2283 CG LYS A 146 -7.930 -3.569 -11.247 1.00 41.33 C ATOM 2284 CD LYS A 146 -7.221 -4.491 -12.206 1.00 22.41 C ATOM 2285 CE LYS A 146 -8.126 -4.820 -13.383 1.00 2.44 C ATOM 2286 NZ LYS A 146 -7.536 -5.806 -14.309 1.00 31.12 N ATOM 0 H LYS A 146 -4.799 -4.250 -10.554 1.00 71.42 H new ATOM 0 HA LYS A 146 -6.006 -1.708 -11.070 1.00 44.45 H new ATOM 0 HB2 LYS A 146 -6.846 -4.131 -9.490 1.00 55.54 H new ATOM 0 HB3 LYS A 146 -7.710 -2.614 -9.345 1.00 55.54 H new ATOM 0 HG2 LYS A 146 -8.858 -4.040 -10.921 1.00 41.33 H new ATOM 0 HG3 LYS A 146 -8.204 -2.653 -11.771 1.00 41.33 H new ATOM 0 HD2 LYS A 146 -6.304 -4.022 -12.563 1.00 22.41 H new ATOM 0 HD3 LYS A 146 -6.931 -5.408 -11.693 1.00 22.41 H new ATOM 0 HE2 LYS A 146 -9.074 -5.205 -13.008 1.00 2.44 H new ATOM 0 HE3 LYS A 146 -8.348 -3.904 -13.930 1.00 2.44 H new ATOM 0 HZ1 LYS A 146 -8.199 -5.989 -15.089 1.00 31.12 H new ATOM 0 HZ2 LYS A 146 -6.644 -5.432 -14.692 1.00 31.12 H new ATOM 0 HZ3 LYS A 146 -7.349 -6.693 -13.799 1.00 31.12 H new ATOM 2300 N ILE A 147 -5.682 -0.496 -9.021 1.00 75.42 N ATOM 2301 CA ILE A 147 -5.379 0.366 -7.926 1.00 12.00 C ATOM 2302 C ILE A 147 -6.684 0.677 -7.214 1.00 55.13 C ATOM 2303 O ILE A 147 -7.599 1.274 -7.800 1.00 22.42 O ATOM 2304 CB ILE A 147 -4.769 1.706 -8.457 1.00 10.13 C ATOM 2305 CG1 ILE A 147 -3.494 1.461 -9.279 1.00 51.31 C ATOM 2306 CG2 ILE A 147 -4.519 2.708 -7.338 1.00 2.53 C ATOM 2307 CD1 ILE A 147 -2.372 0.808 -8.516 1.00 64.40 C ATOM 0 H ILE A 147 -6.194 -0.034 -9.772 1.00 75.42 H new ATOM 0 HA ILE A 147 -4.664 -0.113 -7.257 1.00 12.00 H new ATOM 0 HB ILE A 147 -5.513 2.146 -9.121 1.00 10.13 H new ATOM 0 HG12 ILE A 147 -3.745 0.836 -10.136 1.00 51.31 H new ATOM 0 HG13 ILE A 147 -3.142 2.415 -9.672 1.00 51.31 H new ATOM 0 HG21 ILE A 147 -4.096 3.622 -7.755 1.00 2.53 H new ATOM 0 HG22 ILE A 147 -5.460 2.939 -6.840 1.00 2.53 H new ATOM 0 HG23 ILE A 147 -3.822 2.282 -6.617 1.00 2.53 H new ATOM 0 HD11 ILE A 147 -1.514 0.674 -9.175 1.00 64.40 H new ATOM 0 HD12 ILE A 147 -2.088 1.440 -7.674 1.00 64.40 H new ATOM 0 HD13 ILE A 147 -2.701 -0.163 -8.146 1.00 64.40 H new ATOM 2319 N THR A 148 -6.780 0.296 -5.997 1.00 24.11 N ATOM 2320 CA THR A 148 -7.954 0.569 -5.247 1.00 12.25 C ATOM 2321 C THR A 148 -7.622 1.519 -4.112 1.00 51.24 C ATOM 2322 O THR A 148 -6.885 1.181 -3.189 1.00 14.12 O ATOM 2323 CB THR A 148 -8.602 -0.715 -4.707 1.00 34.34 C ATOM 2324 OG1 THR A 148 -8.854 -1.619 -5.795 1.00 21.24 O ATOM 2325 CG2 THR A 148 -9.919 -0.387 -4.048 1.00 53.10 C ATOM 0 H THR A 148 -6.054 -0.211 -5.491 1.00 24.11 H new ATOM 0 HA THR A 148 -8.680 1.037 -5.912 1.00 12.25 H new ATOM 0 HB THR A 148 -7.927 -1.172 -3.983 1.00 34.34 H new ATOM 0 HG1 THR A 148 -9.266 -2.439 -5.450 1.00 21.24 H new ATOM 0 HG21 THR A 148 -10.373 -1.302 -3.667 1.00 53.10 H new ATOM 0 HG22 THR A 148 -9.751 0.305 -3.223 1.00 53.10 H new ATOM 0 HG23 THR A 148 -10.586 0.073 -4.777 1.00 53.10 H new ATOM 2333 N VAL A 149 -8.158 2.693 -4.196 1.00 33.42 N ATOM 2334 CA VAL A 149 -7.904 3.720 -3.233 1.00 44.21 C ATOM 2335 C VAL A 149 -9.057 3.800 -2.263 1.00 3.14 C ATOM 2336 O VAL A 149 -10.196 4.087 -2.645 1.00 11.51 O ATOM 2337 CB VAL A 149 -7.687 5.094 -3.934 1.00 13.25 C ATOM 2338 CG1 VAL A 149 -7.496 6.216 -2.934 1.00 2.43 C ATOM 2339 CG2 VAL A 149 -6.481 5.029 -4.837 1.00 25.40 C ATOM 0 H VAL A 149 -8.793 2.971 -4.944 1.00 33.42 H new ATOM 0 HA VAL A 149 -6.993 3.473 -2.688 1.00 44.21 H new ATOM 0 HB VAL A 149 -8.584 5.304 -4.517 1.00 13.25 H new ATOM 0 HG11 VAL A 149 -7.348 7.156 -3.466 1.00 2.43 H new ATOM 0 HG12 VAL A 149 -8.379 6.293 -2.300 1.00 2.43 H new ATOM 0 HG13 VAL A 149 -6.623 6.008 -2.316 1.00 2.43 H new ATOM 0 HG21 VAL A 149 -6.338 5.994 -5.323 1.00 25.40 H new ATOM 0 HG22 VAL A 149 -5.598 4.785 -4.247 1.00 25.40 H new ATOM 0 HG23 VAL A 149 -6.635 4.261 -5.595 1.00 25.40 H new ATOM 2349 N TYR A 150 -8.771 3.529 -1.030 1.00 13.12 N ATOM 2350 CA TYR A 150 -9.757 3.590 0.003 1.00 25.30 C ATOM 2351 C TYR A 150 -9.754 4.950 0.621 1.00 2.32 C ATOM 2352 O TYR A 150 -8.727 5.450 1.061 1.00 24.22 O ATOM 2353 CB TYR A 150 -9.547 2.503 1.057 1.00 33.12 C ATOM 2354 CG TYR A 150 -9.866 1.097 0.581 1.00 23.23 C ATOM 2355 CD1 TYR A 150 -9.069 0.447 -0.350 1.00 43.15 C ATOM 2356 CD2 TYR A 150 -10.976 0.421 1.070 1.00 72.14 C ATOM 2357 CE1 TYR A 150 -9.369 -0.830 -0.773 1.00 31.03 C ATOM 2358 CE2 TYR A 150 -11.276 -0.859 0.650 1.00 45.43 C ATOM 2359 CZ TYR A 150 -10.469 -1.478 -0.271 1.00 32.35 C ATOM 2360 OH TYR A 150 -10.767 -2.751 -0.700 1.00 51.22 O ATOM 0 H TYR A 150 -7.842 3.257 -0.709 1.00 13.12 H new ATOM 0 HA TYR A 150 -10.733 3.406 -0.445 1.00 25.30 H new ATOM 0 HB2 TYR A 150 -8.510 2.534 1.391 1.00 33.12 H new ATOM 0 HB3 TYR A 150 -10.168 2.730 1.924 1.00 33.12 H new ATOM 0 HD1 TYR A 150 -8.200 0.949 -0.749 1.00 43.15 H new ATOM 0 HD2 TYR A 150 -11.616 0.906 1.792 1.00 72.14 H new ATOM 0 HE1 TYR A 150 -8.738 -1.320 -1.500 1.00 31.03 H new ATOM 0 HE2 TYR A 150 -12.141 -1.371 1.044 1.00 45.43 H new ATOM 0 HH TYR A 150 -11.576 -3.068 -0.247 1.00 51.22 H new ATOM 2370 N THR A 151 -10.893 5.537 0.657 1.00 4.30 N ATOM 2371 CA THR A 151 -11.035 6.865 1.118 1.00 54.13 C ATOM 2372 C THR A 151 -11.329 6.908 2.605 1.00 24.35 C ATOM 2373 O THR A 151 -12.175 6.164 3.123 1.00 73.01 O ATOM 2374 CB THR A 151 -12.105 7.619 0.297 1.00 52.42 C ATOM 2375 OG1 THR A 151 -13.309 6.831 0.219 1.00 33.15 O ATOM 2376 CG2 THR A 151 -11.597 7.908 -1.113 1.00 31.22 C ATOM 0 H THR A 151 -11.766 5.100 0.362 1.00 4.30 H new ATOM 0 HA THR A 151 -10.084 7.377 0.969 1.00 54.13 H new ATOM 0 HB THR A 151 -12.317 8.564 0.796 1.00 52.42 H new ATOM 0 HG1 THR A 151 -13.984 7.315 -0.301 1.00 33.15 H new ATOM 0 HG21 THR A 151 -12.365 8.439 -1.675 1.00 31.22 H new ATOM 0 HG22 THR A 151 -10.698 8.522 -1.057 1.00 31.22 H new ATOM 0 HG23 THR A 151 -11.364 6.969 -1.615 1.00 31.22 H new