USER MOD reduce.3.24.130724 H: found=0, std=0, add=1029, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1029 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 117 LYS NZ :NH3+ 172:sc= 1.39 (180deg=1.27) USER MOD Set 1.2: A 156 TYR OH : rot 41:sc= 0.146 USER MOD Set 2.1: A 131 HIS : no HD1:sc= -0.355 K(o=-5,f=-10!) USER MOD Set 2.2: A 141 GLN : amide:sc= -1.48! C(o=-5!,f=-9.2!) USER MOD Set 2.3: A 142 CYS SG : rot 138:sc= -1.91! USER MOD Set 2.4: A 143 CYS SG : rot -96:sc= 0.179 USER MOD Set 2.5: A 145 GLN : amide:sc= -0.522 X(o=-5,f=-5.2) USER MOD Set 2.6: A 153 CYS SG : rot -160:sc= -0.92! USER MOD Set 3.1: A 121 LYS NZ :NH3+ -172:sc= 0.81 (180deg=0) USER MOD Set 3.2: A 122 ASN : amide:sc= 0.578 K(o=1.4,f=-7.6!) USER MOD Set 4.1: A 94 HIS : no HE2:sc= -0.0198 K(o=-0.06,f=-1.9) USER MOD Set 4.2: A 97 ASN : amide:sc= -0.0399 K(o=-0.06,f=-2.9!) USER MOD Set 5.1: A 91 GLN : amide:sc= 0.111 X(o=1.9,f=1.7) USER MOD Set 5.2: A 100 TYR OH : rot -45:sc= 1.83 USER MOD Set 6.1: A 71 CYS SG : rot 14:sc= -1.05 USER MOD Set 6.2: A 127 MET CE :methyl -168:sc= -0.0844 (180deg=-0.395) USER MOD Set 7.1: A 70 LYS NZ :NH3+ 133:sc= 0.8 (180deg=0.413) USER MOD Set 7.2: A 125 ASN : amide:sc= 0.162 K(o=0.96,f=-3.1) USER MOD Set 8.1: A 44 THR OG1 : rot -34:sc= 1 USER MOD Set 8.2: A 46 SER OG : rot 180:sc= 0 USER MOD Set 8.3: A 47 MET CE :methyl -161:sc= -0.0583 (180deg=-0.446) USER MOD Set 9.1: A 35 ASN : amide:sc= -0.713 K(o=-0.71,f=-6!) USER MOD Set 9.2: A 37 LYS NZ :NH3+ 179:sc= 0 (180deg=0) USER MOD Set10.1: A 23 LYS NZ :NH3+ -148:sc= 0.427 (180deg=-0.171) USER MOD Set10.2: A 25 SER OG : rot 180:sc= 0.428 USER MOD Single : A 15 THR OG1 : rot 34:sc= -0.0968 USER MOD Single : A 36 TYR OH : rot -166:sc= -0.195 USER MOD Single : A 45 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0245) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 170:sc= -0.0353 (180deg=-0.198) USER MOD Single : A 76 LYS NZ :NH3+ 171:sc= 0.76 (180deg=0.667) USER MOD Single : A 84 CYS SG : rot 60:sc= -4.69! USER MOD Single : A 85 GLN : amide:sc= 0.145 X(o=0.14,f=-0.18) USER MOD Single : A 86 ASN : amide:sc= -0.921 X(o=-0.92,f=-1.2) USER MOD Single : A 87 LYS NZ :NH3+ -175:sc=-0.000513 (180deg=-0.0424) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 108 SER OG : rot -108:sc= 0.309 USER MOD Single : A 114 LYS NZ :NH3+ -148:sc= 0.361 (180deg=0.0583) USER MOD Single : A 115 LYS NZ :NH3+ 174:sc= 0.303 (180deg=0.287) USER MOD Single : A 123 ASN : amide:sc= -0.274 X(o=-0.27,f=-0.54) USER MOD Single : A 124 ASN : amide:sc= 0.191 K(o=0.19,f=-3.7!) USER MOD Single : A 129 LYS NZ :NH3+ -162:sc= -0.0312 (180deg=-0.248) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ -170:sc= -0.0244 (180deg=-0.137) USER MOD Single : A 136 THR OG1 : rot 150:sc= 0.746 USER MOD Single : A 139 SER OG : rot -140:sc= -0.157 USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 THR OG1 : rot -152:sc= 0.536 USER MOD Single : A 148 LYS NZ :NH3+ 143:sc= 0 (180deg=-0.0635) USER MOD Single : A 155 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0415) USER MOD Single : A 157 ASN : amide:sc=-0.00295 K(o=-0.0029,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 229 N THR A 15 -9.895 -0.945 14.978 1.00 44.21 N ATOM 230 CA THR A 15 -9.594 -1.008 13.538 1.00 75.45 C ATOM 231 C THR A 15 -10.248 0.157 12.783 1.00 51.32 C ATOM 232 O THR A 15 -11.358 0.591 13.110 1.00 41.11 O ATOM 233 CB THR A 15 -10.046 -2.371 12.903 1.00 21.11 C ATOM 234 OG1 THR A 15 -9.760 -2.394 11.487 1.00 71.01 O ATOM 235 CG2 THR A 15 -11.539 -2.651 13.112 1.00 13.55 C ATOM 0 HA THR A 15 -8.511 -0.930 13.442 1.00 75.45 H new ATOM 0 HB THR A 15 -9.479 -3.149 13.414 1.00 21.11 H new ATOM 0 HG1 THR A 15 -8.941 -1.885 11.310 1.00 71.01 H new ATOM 0 HG21 THR A 15 -11.798 -3.605 12.653 1.00 13.55 H new ATOM 0 HG22 THR A 15 -11.756 -2.691 14.179 1.00 13.55 H new ATOM 0 HG23 THR A 15 -12.126 -1.856 12.652 1.00 13.55 H new ATOM 243 N ILE A 16 -9.519 0.661 11.787 1.00 72.54 N ATOM 244 CA ILE A 16 -10.003 1.667 10.841 1.00 24.34 C ATOM 245 C ILE A 16 -10.739 0.961 9.688 1.00 12.41 C ATOM 246 O ILE A 16 -11.839 1.374 9.291 1.00 51.10 O ATOM 247 CB ILE A 16 -8.806 2.515 10.266 1.00 70.22 C ATOM 248 CG1 ILE A 16 -7.956 3.116 11.428 1.00 64.32 C ATOM 249 CG2 ILE A 16 -9.310 3.624 9.300 1.00 43.13 C ATOM 250 CD1 ILE A 16 -6.698 3.834 10.984 1.00 2.30 C ATOM 0 H ILE A 16 -8.556 0.375 11.612 1.00 72.54 H new ATOM 0 HA ILE A 16 -10.683 2.342 11.360 1.00 24.34 H new ATOM 0 HB ILE A 16 -8.166 1.850 9.686 1.00 70.22 H new ATOM 0 HG12 ILE A 16 -8.576 3.813 11.992 1.00 64.32 H new ATOM 0 HG13 ILE A 16 -7.678 2.313 12.110 1.00 64.32 H new ATOM 0 HG21 ILE A 16 -8.459 4.191 8.921 1.00 43.13 H new ATOM 0 HG22 ILE A 16 -9.841 3.166 8.466 1.00 43.13 H new ATOM 0 HG23 ILE A 16 -9.983 4.294 9.835 1.00 43.13 H new ATOM 0 HD11 ILE A 16 -6.171 4.219 11.857 1.00 2.30 H new ATOM 0 HD12 ILE A 16 -6.052 3.139 10.448 1.00 2.30 H new ATOM 0 HD13 ILE A 16 -6.964 4.662 10.327 1.00 2.30 H new ATOM 262 N LEU A 17 -10.129 -0.134 9.188 1.00 72.03 N ATOM 263 CA LEU A 17 -10.585 -0.826 7.974 1.00 5.25 C ATOM 264 C LEU A 17 -9.893 -2.193 7.845 1.00 54.34 C ATOM 265 O LEU A 17 -8.686 -2.291 8.046 1.00 71.43 O ATOM 266 CB LEU A 17 -10.280 0.063 6.732 1.00 15.20 C ATOM 267 CG LEU A 17 -10.645 -0.517 5.329 1.00 12.12 C ATOM 268 CD1 LEU A 17 -12.138 -0.887 5.225 1.00 0.34 C ATOM 269 CD2 LEU A 17 -10.228 0.471 4.221 1.00 21.21 C ATOM 0 H LEU A 17 -9.307 -0.559 9.617 1.00 72.03 H new ATOM 0 HA LEU A 17 -11.660 -0.997 8.036 1.00 5.25 H new ATOM 0 HB2 LEU A 17 -10.810 1.007 6.855 1.00 15.20 H new ATOM 0 HB3 LEU A 17 -9.215 0.293 6.735 1.00 15.20 H new ATOM 0 HG LEU A 17 -10.088 -1.444 5.194 1.00 12.12 H new ATOM 0 HD11 LEU A 17 -12.346 -1.286 4.232 1.00 0.34 H new ATOM 0 HD12 LEU A 17 -12.380 -1.639 5.976 1.00 0.34 H new ATOM 0 HD13 LEU A 17 -12.746 0.002 5.393 1.00 0.34 H new ATOM 0 HD21 LEU A 17 -10.487 0.056 3.247 1.00 21.21 H new ATOM 0 HD22 LEU A 17 -10.749 1.418 4.363 1.00 21.21 H new ATOM 0 HD23 LEU A 17 -9.152 0.639 4.269 1.00 21.21 H new ATOM 281 N GLU A 18 -10.672 -3.236 7.509 1.00 65.05 N ATOM 282 CA GLU A 18 -10.162 -4.600 7.257 1.00 34.32 C ATOM 283 C GLU A 18 -10.716 -5.142 5.920 1.00 12.03 C ATOM 284 O GLU A 18 -11.856 -4.836 5.546 1.00 71.31 O ATOM 285 CB GLU A 18 -10.507 -5.565 8.429 1.00 72.11 C ATOM 286 CG GLU A 18 -12.008 -5.688 8.817 1.00 60.23 C ATOM 287 CD GLU A 18 -12.480 -4.663 9.870 1.00 42.31 C ATOM 288 OE1 GLU A 18 -12.690 -3.482 9.528 1.00 34.31 O ATOM 289 OE2 GLU A 18 -12.653 -5.043 11.050 1.00 74.52 O ATOM 0 H GLU A 18 -11.683 -3.158 7.403 1.00 65.05 H new ATOM 0 HA GLU A 18 -9.076 -4.544 7.189 1.00 34.32 H new ATOM 0 HB2 GLU A 18 -10.140 -6.558 8.170 1.00 72.11 H new ATOM 0 HB3 GLU A 18 -9.954 -5.241 9.310 1.00 72.11 H new ATOM 0 HG2 GLU A 18 -12.614 -5.573 7.918 1.00 60.23 H new ATOM 0 HG3 GLU A 18 -12.191 -6.693 9.198 1.00 60.23 H new ATOM 296 N GLU A 19 -9.895 -5.947 5.216 1.00 4.11 N ATOM 297 CA GLU A 19 -10.212 -6.462 3.865 1.00 1.41 C ATOM 298 C GLU A 19 -9.285 -7.631 3.505 1.00 73.14 C ATOM 299 O GLU A 19 -8.154 -7.708 3.996 1.00 21.42 O ATOM 300 CB GLU A 19 -10.065 -5.312 2.833 1.00 23.24 C ATOM 301 CG GLU A 19 -10.250 -5.659 1.338 1.00 41.24 C ATOM 302 CD GLU A 19 -11.658 -6.148 0.983 1.00 33.23 C ATOM 303 OE1 GLU A 19 -12.559 -5.298 0.816 1.00 23.40 O ATOM 304 OE2 GLU A 19 -11.869 -7.372 0.843 1.00 70.11 O ATOM 0 H GLU A 19 -8.990 -6.260 5.568 1.00 4.11 H new ATOM 0 HA GLU A 19 -11.238 -6.830 3.850 1.00 1.41 H new ATOM 0 HB2 GLU A 19 -10.788 -4.537 3.089 1.00 23.24 H new ATOM 0 HB3 GLU A 19 -9.074 -4.876 2.956 1.00 23.24 H new ATOM 0 HG2 GLU A 19 -10.021 -4.777 0.740 1.00 41.24 H new ATOM 0 HG3 GLU A 19 -9.529 -6.428 1.062 1.00 41.24 H new ATOM 311 N ILE A 20 -9.781 -8.531 2.646 1.00 71.11 N ATOM 312 CA ILE A 20 -9.003 -9.640 2.091 1.00 42.23 C ATOM 313 C ILE A 20 -8.166 -9.111 0.898 1.00 30.34 C ATOM 314 O ILE A 20 -8.650 -9.029 -0.228 1.00 63.11 O ATOM 315 CB ILE A 20 -9.963 -10.811 1.641 1.00 62.14 C ATOM 316 CG1 ILE A 20 -10.934 -11.212 2.796 1.00 72.30 C ATOM 317 CG2 ILE A 20 -9.172 -12.048 1.151 1.00 12.23 C ATOM 318 CD1 ILE A 20 -10.252 -11.778 4.031 1.00 42.42 C ATOM 0 H ILE A 20 -10.745 -8.507 2.315 1.00 71.11 H new ATOM 0 HA ILE A 20 -8.330 -10.041 2.849 1.00 42.23 H new ATOM 0 HB ILE A 20 -10.551 -10.438 0.803 1.00 62.14 H new ATOM 0 HG12 ILE A 20 -11.513 -10.335 3.087 1.00 72.30 H new ATOM 0 HG13 ILE A 20 -11.642 -11.950 2.418 1.00 72.30 H new ATOM 0 HG21 ILE A 20 -9.869 -12.830 0.851 1.00 12.23 H new ATOM 0 HG22 ILE A 20 -8.551 -11.769 0.300 1.00 12.23 H new ATOM 0 HG23 ILE A 20 -8.538 -12.417 1.957 1.00 12.23 H new ATOM 0 HD11 ILE A 20 -11.004 -12.028 4.779 1.00 42.42 H new ATOM 0 HD12 ILE A 20 -9.697 -12.676 3.761 1.00 42.42 H new ATOM 0 HD13 ILE A 20 -9.566 -11.036 4.440 1.00 42.42 H new ATOM 330 N LEU A 21 -6.915 -8.721 1.177 1.00 44.40 N ATOM 331 CA LEU A 21 -6.013 -8.085 0.189 1.00 52.43 C ATOM 332 C LEU A 21 -4.918 -9.062 -0.260 1.00 20.20 C ATOM 333 O LEU A 21 -4.640 -10.042 0.425 1.00 61.51 O ATOM 334 CB LEU A 21 -5.359 -6.835 0.818 1.00 24.21 C ATOM 335 CG LEU A 21 -6.290 -5.635 1.160 1.00 73.43 C ATOM 336 CD1 LEU A 21 -5.516 -4.549 1.930 1.00 34.33 C ATOM 337 CD2 LEU A 21 -6.932 -5.048 -0.110 1.00 30.35 C ATOM 0 H LEU A 21 -6.492 -8.836 2.098 1.00 44.40 H new ATOM 0 HA LEU A 21 -6.602 -7.799 -0.683 1.00 52.43 H new ATOM 0 HB2 LEU A 21 -4.856 -7.143 1.735 1.00 24.21 H new ATOM 0 HB3 LEU A 21 -4.587 -6.479 0.135 1.00 24.21 H new ATOM 0 HG LEU A 21 -7.092 -6.005 1.799 1.00 73.43 H new ATOM 0 HD11 LEU A 21 -6.185 -3.719 2.159 1.00 34.33 H new ATOM 0 HD12 LEU A 21 -5.127 -4.968 2.858 1.00 34.33 H new ATOM 0 HD13 LEU A 21 -4.688 -4.190 1.319 1.00 34.33 H new ATOM 0 HD21 LEU A 21 -7.576 -4.212 0.161 1.00 30.35 H new ATOM 0 HD22 LEU A 21 -6.150 -4.700 -0.785 1.00 30.35 H new ATOM 0 HD23 LEU A 21 -7.524 -5.816 -0.607 1.00 30.35 H new ATOM 349 N ILE A 22 -4.267 -8.750 -1.395 1.00 22.54 N ATOM 350 CA ILE A 22 -3.199 -9.583 -1.979 1.00 51.43 C ATOM 351 C ILE A 22 -1.838 -8.878 -1.861 1.00 14.45 C ATOM 352 O ILE A 22 -1.622 -7.844 -2.467 1.00 41.13 O ATOM 353 CB ILE A 22 -3.505 -9.930 -3.487 1.00 70.50 C ATOM 354 CG1 ILE A 22 -4.789 -10.813 -3.574 1.00 43.34 C ATOM 355 CG2 ILE A 22 -2.292 -10.596 -4.182 1.00 31.51 C ATOM 356 CD1 ILE A 22 -5.045 -11.497 -4.903 1.00 11.12 C ATOM 0 H ILE A 22 -4.468 -7.909 -1.936 1.00 22.54 H new ATOM 0 HA ILE A 22 -3.161 -10.516 -1.417 1.00 51.43 H new ATOM 0 HB ILE A 22 -3.690 -9.002 -4.027 1.00 70.50 H new ATOM 0 HG12 ILE A 22 -4.731 -11.579 -2.801 1.00 43.34 H new ATOM 0 HG13 ILE A 22 -5.651 -10.188 -3.339 1.00 43.34 H new ATOM 0 HG21 ILE A 22 -2.544 -10.819 -5.219 1.00 31.51 H new ATOM 0 HG22 ILE A 22 -1.439 -9.918 -4.154 1.00 31.51 H new ATOM 0 HG23 ILE A 22 -2.038 -11.520 -3.663 1.00 31.51 H new ATOM 0 HD11 ILE A 22 -5.964 -12.081 -4.841 1.00 11.12 H new ATOM 0 HD12 ILE A 22 -5.145 -10.745 -5.686 1.00 11.12 H new ATOM 0 HD13 ILE A 22 -4.211 -12.158 -5.139 1.00 11.12 H new ATOM 368 N LYS A 23 -0.928 -9.468 -1.086 1.00 11.43 N ATOM 369 CA LYS A 23 0.450 -8.994 -0.938 1.00 44.12 C ATOM 370 C LYS A 23 1.344 -9.614 -2.024 1.00 61.32 C ATOM 371 O LYS A 23 1.524 -10.840 -2.052 1.00 63.12 O ATOM 372 CB LYS A 23 0.973 -9.399 0.460 1.00 13.30 C ATOM 373 CG LYS A 23 2.411 -8.948 0.781 1.00 15.43 C ATOM 374 CD LYS A 23 2.889 -9.456 2.160 1.00 42.53 C ATOM 375 CE LYS A 23 4.325 -9.018 2.481 1.00 21.24 C ATOM 376 NZ LYS A 23 5.297 -9.447 1.431 1.00 62.53 N ATOM 0 H LYS A 23 -1.130 -10.302 -0.534 1.00 11.43 H new ATOM 0 HA LYS A 23 0.473 -7.909 -1.044 1.00 44.12 H new ATOM 0 HB2 LYS A 23 0.303 -8.986 1.214 1.00 13.30 H new ATOM 0 HB3 LYS A 23 0.922 -10.484 0.549 1.00 13.30 H new ATOM 0 HG2 LYS A 23 3.086 -9.314 0.007 1.00 15.43 H new ATOM 0 HG3 LYS A 23 2.462 -7.859 0.759 1.00 15.43 H new ATOM 0 HD2 LYS A 23 2.217 -9.084 2.934 1.00 42.53 H new ATOM 0 HD3 LYS A 23 2.830 -10.544 2.183 1.00 42.53 H new ATOM 0 HE2 LYS A 23 4.358 -7.933 2.582 1.00 21.24 H new ATOM 0 HE3 LYS A 23 4.624 -9.436 3.442 1.00 21.24 H new ATOM 0 HZ1 LYS A 23 6.220 -9.638 1.870 1.00 62.53 H new ATOM 0 HZ2 LYS A 23 4.949 -10.310 0.967 1.00 62.53 H new ATOM 0 HZ3 LYS A 23 5.400 -8.692 0.724 1.00 62.53 H new ATOM 390 N ARG A 24 1.881 -8.779 -2.922 1.00 51.42 N ATOM 391 CA ARG A 24 2.931 -9.200 -3.852 1.00 3.11 C ATOM 392 C ARG A 24 4.285 -9.058 -3.142 1.00 32.31 C ATOM 393 O ARG A 24 4.770 -7.930 -2.937 1.00 64.31 O ATOM 394 CB ARG A 24 2.923 -8.368 -5.155 1.00 43.52 C ATOM 395 CG ARG A 24 3.870 -8.928 -6.242 1.00 31.04 C ATOM 396 CD ARG A 24 4.059 -7.982 -7.436 1.00 31.33 C ATOM 397 NE ARG A 24 4.905 -6.818 -7.096 1.00 1.34 N ATOM 398 CZ ARG A 24 5.823 -6.272 -7.921 1.00 72.24 C ATOM 399 NH1 ARG A 24 6.020 -6.776 -9.139 1.00 40.44 N ATOM 400 NH2 ARG A 24 6.540 -5.226 -7.527 1.00 42.54 N ATOM 0 H ARG A 24 1.602 -7.803 -3.023 1.00 51.42 H new ATOM 0 HA ARG A 24 2.751 -10.236 -4.139 1.00 3.11 H new ATOM 0 HB2 ARG A 24 1.908 -8.333 -5.550 1.00 43.52 H new ATOM 0 HB3 ARG A 24 3.211 -7.342 -4.925 1.00 43.52 H new ATOM 0 HG2 ARG A 24 4.842 -9.134 -5.794 1.00 31.04 H new ATOM 0 HG3 ARG A 24 3.476 -9.879 -6.601 1.00 31.04 H new ATOM 0 HD2 ARG A 24 4.512 -8.529 -8.263 1.00 31.33 H new ATOM 0 HD3 ARG A 24 3.085 -7.634 -7.779 1.00 31.33 H new ATOM 0 HE ARG A 24 4.787 -6.399 -6.174 1.00 1.34 H new ATOM 0 HH11 ARG A 24 5.475 -7.579 -9.453 1.00 40.44 H new ATOM 0 HH12 ARG A 24 6.715 -6.358 -9.757 1.00 40.44 H new ATOM 0 HH21 ARG A 24 6.398 -4.832 -6.597 1.00 42.54 H new ATOM 0 HH22 ARG A 24 7.233 -4.817 -8.154 1.00 42.54 H new ATOM 414 N SER A 25 4.861 -10.194 -2.731 1.00 32.10 N ATOM 415 CA SER A 25 6.150 -10.226 -2.038 1.00 33.12 C ATOM 416 C SER A 25 7.305 -9.979 -3.029 1.00 2.40 C ATOM 417 O SER A 25 7.424 -10.679 -4.050 1.00 24.41 O ATOM 418 CB SER A 25 6.315 -11.580 -1.312 1.00 12.43 C ATOM 419 OG SER A 25 5.254 -11.790 -0.382 1.00 63.04 O ATOM 0 H SER A 25 4.445 -11.115 -2.870 1.00 32.10 H new ATOM 0 HA SER A 25 6.178 -9.429 -1.296 1.00 33.12 H new ATOM 0 HB2 SER A 25 6.330 -12.389 -2.042 1.00 12.43 H new ATOM 0 HB3 SER A 25 7.272 -11.604 -0.790 1.00 12.43 H new ATOM 0 HG SER A 25 5.377 -12.653 0.065 1.00 63.04 H new ATOM 583 N ASN A 35 5.143 -13.592 -5.590 1.00 55.44 N ATOM 584 CA ASN A 35 4.026 -14.365 -5.040 1.00 63.22 C ATOM 585 C ASN A 35 2.866 -13.422 -4.700 1.00 62.32 C ATOM 586 O ASN A 35 3.052 -12.438 -3.985 1.00 5.45 O ATOM 587 CB ASN A 35 4.506 -15.141 -3.777 1.00 13.42 C ATOM 588 CG ASN A 35 3.483 -16.136 -3.198 1.00 34.14 C ATOM 589 OD1 ASN A 35 2.270 -15.952 -3.271 1.00 22.02 O ATOM 590 ND2 ASN A 35 3.981 -17.204 -2.600 1.00 22.43 N ATOM 0 HA ASN A 35 3.674 -15.087 -5.777 1.00 63.22 H new ATOM 0 HB2 ASN A 35 5.417 -15.684 -4.027 1.00 13.42 H new ATOM 0 HB3 ASN A 35 4.767 -14.419 -3.003 1.00 13.42 H new ATOM 0 HD21 ASN A 35 3.355 -17.896 -2.187 1.00 22.43 H new ATOM 0 HD22 ASN A 35 4.991 -17.337 -2.551 1.00 22.43 H new ATOM 597 N TYR A 36 1.675 -13.751 -5.223 1.00 43.53 N ATOM 598 CA TYR A 36 0.438 -13.025 -4.936 1.00 14.33 C ATOM 599 C TYR A 36 -0.274 -13.768 -3.805 1.00 32.33 C ATOM 600 O TYR A 36 -0.850 -14.841 -4.022 1.00 43.12 O ATOM 601 CB TYR A 36 -0.438 -12.947 -6.220 1.00 54.02 C ATOM 602 CG TYR A 36 0.276 -12.254 -7.392 1.00 72.41 C ATOM 603 CD1 TYR A 36 0.514 -10.878 -7.375 1.00 73.21 C ATOM 604 CD2 TYR A 36 0.743 -12.977 -8.499 1.00 35.12 C ATOM 605 CE1 TYR A 36 1.178 -10.253 -8.411 1.00 70.32 C ATOM 606 CE2 TYR A 36 1.417 -12.346 -9.531 1.00 44.13 C ATOM 607 CZ TYR A 36 1.629 -10.990 -9.478 1.00 65.23 C ATOM 608 OH TYR A 36 2.307 -10.363 -10.498 1.00 54.42 O ATOM 0 H TYR A 36 1.547 -14.536 -5.862 1.00 43.53 H new ATOM 0 HA TYR A 36 0.639 -11.999 -4.626 1.00 14.33 H new ATOM 0 HB2 TYR A 36 -0.723 -13.955 -6.520 1.00 54.02 H new ATOM 0 HB3 TYR A 36 -1.359 -12.409 -5.993 1.00 54.02 H new ATOM 0 HD1 TYR A 36 0.172 -10.292 -6.535 1.00 73.21 H new ATOM 0 HD2 TYR A 36 0.574 -14.043 -8.547 1.00 35.12 H new ATOM 0 HE1 TYR A 36 1.343 -9.186 -8.382 1.00 70.32 H new ATOM 0 HE2 TYR A 36 1.775 -12.918 -10.374 1.00 44.13 H new ATOM 0 HH TYR A 36 2.364 -10.963 -11.271 1.00 54.42 H new ATOM 618 N LYS A 37 -0.200 -13.206 -2.592 1.00 70.10 N ATOM 619 CA LYS A 37 -0.637 -13.887 -1.371 1.00 25.34 C ATOM 620 C LYS A 37 -1.850 -13.158 -0.781 1.00 25.24 C ATOM 621 O LYS A 37 -1.719 -12.099 -0.164 1.00 54.22 O ATOM 622 CB LYS A 37 0.556 -13.925 -0.371 1.00 13.41 C ATOM 623 CG LYS A 37 0.332 -14.789 0.891 1.00 43.14 C ATOM 624 CD LYS A 37 0.120 -16.291 0.592 1.00 32.50 C ATOM 625 CE LYS A 37 1.263 -16.921 -0.227 1.00 12.24 C ATOM 626 NZ LYS A 37 2.582 -16.819 0.452 1.00 62.12 N ATOM 0 H LYS A 37 0.165 -12.267 -2.431 1.00 70.10 H new ATOM 0 HA LYS A 37 -0.943 -14.911 -1.587 1.00 25.34 H new ATOM 0 HB2 LYS A 37 1.436 -14.298 -0.895 1.00 13.41 H new ATOM 0 HB3 LYS A 37 0.779 -12.905 -0.058 1.00 13.41 H new ATOM 0 HG2 LYS A 37 1.191 -14.678 1.553 1.00 43.14 H new ATOM 0 HG3 LYS A 37 -0.536 -14.410 1.430 1.00 43.14 H new ATOM 0 HD2 LYS A 37 0.018 -16.830 1.534 1.00 32.50 H new ATOM 0 HD3 LYS A 37 -0.817 -16.417 0.050 1.00 32.50 H new ATOM 0 HE2 LYS A 37 1.035 -17.971 -0.413 1.00 12.24 H new ATOM 0 HE3 LYS A 37 1.321 -16.431 -1.199 1.00 12.24 H new ATOM 0 HZ1 LYS A 37 3.311 -17.273 -0.135 1.00 62.12 H new ATOM 0 HZ2 LYS A 37 2.824 -15.817 0.591 1.00 62.12 H new ATOM 0 HZ3 LYS A 37 2.535 -17.295 1.375 1.00 62.12 H new ATOM 640 N GLU A 38 -3.020 -13.773 -0.953 1.00 74.03 N ATOM 641 CA GLU A 38 -4.299 -13.185 -0.548 1.00 70.12 C ATOM 642 C GLU A 38 -4.581 -13.519 0.919 1.00 12.22 C ATOM 643 O GLU A 38 -4.928 -14.655 1.239 1.00 53.04 O ATOM 644 CB GLU A 38 -5.428 -13.695 -1.476 1.00 52.31 C ATOM 645 CG GLU A 38 -6.785 -13.013 -1.232 1.00 4.33 C ATOM 646 CD GLU A 38 -7.827 -13.344 -2.304 1.00 64.52 C ATOM 647 OE1 GLU A 38 -8.523 -14.374 -2.177 1.00 1.21 O ATOM 648 OE2 GLU A 38 -7.946 -12.584 -3.286 1.00 11.12 O ATOM 0 H GLU A 38 -3.109 -14.696 -1.378 1.00 74.03 H new ATOM 0 HA GLU A 38 -4.253 -12.100 -0.642 1.00 70.12 H new ATOM 0 HB2 GLU A 38 -5.133 -13.536 -2.513 1.00 52.31 H new ATOM 0 HB3 GLU A 38 -5.542 -14.770 -1.338 1.00 52.31 H new ATOM 0 HG2 GLU A 38 -7.167 -13.316 -0.257 1.00 4.33 H new ATOM 0 HG3 GLU A 38 -6.641 -11.933 -1.196 1.00 4.33 H new ATOM 655 N ARG A 39 -4.397 -12.528 1.805 1.00 33.04 N ATOM 656 CA ARG A 39 -4.560 -12.673 3.267 1.00 5.22 C ATOM 657 C ARG A 39 -5.614 -11.681 3.776 1.00 11.15 C ATOM 658 O ARG A 39 -6.112 -10.845 3.020 1.00 11.13 O ATOM 659 CB ARG A 39 -3.201 -12.392 3.988 1.00 71.11 C ATOM 660 CG ARG A 39 -1.980 -13.191 3.473 1.00 50.03 C ATOM 661 CD ARG A 39 -2.012 -14.686 3.836 1.00 4.01 C ATOM 662 NE ARG A 39 -3.014 -15.472 3.097 1.00 11.43 N ATOM 663 CZ ARG A 39 -3.882 -16.341 3.653 1.00 33.01 C ATOM 664 NH1 ARG A 39 -3.897 -16.545 4.966 1.00 5.15 N ATOM 665 NH2 ARG A 39 -4.746 -16.986 2.880 1.00 4.10 N ATOM 0 H ARG A 39 -4.126 -11.585 1.525 1.00 33.04 H new ATOM 0 HA ARG A 39 -4.882 -13.692 3.483 1.00 5.22 H new ATOM 0 HB2 ARG A 39 -2.978 -11.329 3.898 1.00 71.11 H new ATOM 0 HB3 ARG A 39 -3.326 -12.603 5.050 1.00 71.11 H new ATOM 0 HG2 ARG A 39 -1.925 -13.092 2.389 1.00 50.03 H new ATOM 0 HG3 ARG A 39 -1.071 -12.748 3.880 1.00 50.03 H new ATOM 0 HD2 ARG A 39 -1.026 -15.113 3.652 1.00 4.01 H new ATOM 0 HD3 ARG A 39 -2.207 -14.784 4.904 1.00 4.01 H new ATOM 0 HE ARG A 39 -3.055 -15.349 2.085 1.00 11.43 H new ATOM 0 HH11 ARG A 39 -3.246 -16.041 5.568 1.00 5.15 H new ATOM 0 HH12 ARG A 39 -4.560 -17.206 5.372 1.00 5.15 H new ATOM 0 HH21 ARG A 39 -4.750 -16.823 1.873 1.00 4.10 H new ATOM 0 HH22 ARG A 39 -5.406 -17.645 3.293 1.00 4.10 H new ATOM 679 N LEU A 40 -5.920 -11.772 5.077 1.00 21.03 N ATOM 680 CA LEU A 40 -6.779 -10.805 5.774 1.00 71.45 C ATOM 681 C LEU A 40 -5.892 -9.692 6.355 1.00 72.34 C ATOM 682 O LEU A 40 -5.085 -9.948 7.243 1.00 4.25 O ATOM 683 CB LEU A 40 -7.596 -11.503 6.897 1.00 32.11 C ATOM 684 CG LEU A 40 -8.434 -10.564 7.835 1.00 41.15 C ATOM 685 CD1 LEU A 40 -9.448 -9.705 7.046 1.00 54.33 C ATOM 686 CD2 LEU A 40 -9.133 -11.382 8.935 1.00 1.21 C ATOM 0 H LEU A 40 -5.577 -12.521 5.678 1.00 21.03 H new ATOM 0 HA LEU A 40 -7.493 -10.375 5.071 1.00 71.45 H new ATOM 0 HB2 LEU A 40 -8.276 -12.217 6.432 1.00 32.11 H new ATOM 0 HB3 LEU A 40 -6.906 -12.077 7.516 1.00 32.11 H new ATOM 0 HG LEU A 40 -7.739 -9.872 8.309 1.00 41.15 H new ATOM 0 HD11 LEU A 40 -10.004 -9.072 7.737 1.00 54.33 H new ATOM 0 HD12 LEU A 40 -8.915 -9.080 6.330 1.00 54.33 H new ATOM 0 HD13 LEU A 40 -10.141 -10.357 6.514 1.00 54.33 H new ATOM 0 HD21 LEU A 40 -9.709 -10.714 9.575 1.00 1.21 H new ATOM 0 HD22 LEU A 40 -9.801 -12.111 8.477 1.00 1.21 H new ATOM 0 HD23 LEU A 40 -8.384 -11.902 9.533 1.00 1.21 H new ATOM 698 N PHE A 41 -6.014 -8.481 5.800 1.00 72.41 N ATOM 699 CA PHE A 41 -5.298 -7.280 6.271 1.00 41.12 C ATOM 700 C PHE A 41 -6.230 -6.416 7.120 1.00 70.12 C ATOM 701 O PHE A 41 -7.335 -6.090 6.693 1.00 74.11 O ATOM 702 CB PHE A 41 -4.777 -6.444 5.071 1.00 61.15 C ATOM 703 CG PHE A 41 -3.600 -7.059 4.322 1.00 1.44 C ATOM 704 CD1 PHE A 41 -3.724 -8.287 3.668 1.00 73.12 C ATOM 705 CD2 PHE A 41 -2.365 -6.409 4.276 1.00 11.43 C ATOM 706 CE1 PHE A 41 -2.658 -8.838 2.995 1.00 54.21 C ATOM 707 CE2 PHE A 41 -1.301 -6.966 3.604 1.00 2.42 C ATOM 708 CZ PHE A 41 -1.449 -8.178 2.965 1.00 15.41 C ATOM 0 H PHE A 41 -6.620 -8.300 5.000 1.00 72.41 H new ATOM 0 HA PHE A 41 -4.448 -7.604 6.872 1.00 41.12 H new ATOM 0 HB2 PHE A 41 -5.597 -6.294 4.369 1.00 61.15 H new ATOM 0 HB3 PHE A 41 -4.483 -5.459 5.434 1.00 61.15 H new ATOM 0 HD1 PHE A 41 -4.668 -8.810 3.691 1.00 73.12 H new ATOM 0 HD2 PHE A 41 -2.243 -5.458 4.774 1.00 11.43 H new ATOM 0 HE1 PHE A 41 -2.769 -9.787 2.491 1.00 54.21 H new ATOM 0 HE2 PHE A 41 -0.351 -6.454 3.577 1.00 2.42 H new ATOM 0 HZ PHE A 41 -0.613 -8.613 2.438 1.00 15.41 H new ATOM 718 N VAL A 42 -5.775 -6.066 8.325 1.00 41.03 N ATOM 719 CA VAL A 42 -6.453 -5.107 9.206 1.00 13.22 C ATOM 720 C VAL A 42 -5.535 -3.890 9.433 1.00 3.34 C ATOM 721 O VAL A 42 -4.342 -4.049 9.718 1.00 1.54 O ATOM 722 CB VAL A 42 -6.841 -5.757 10.587 1.00 51.03 C ATOM 723 CG1 VAL A 42 -7.523 -4.729 11.511 1.00 3.43 C ATOM 724 CG2 VAL A 42 -7.745 -7.001 10.391 1.00 5.12 C ATOM 0 H VAL A 42 -4.915 -6.444 8.723 1.00 41.03 H new ATOM 0 HA VAL A 42 -7.378 -4.792 8.722 1.00 13.22 H new ATOM 0 HB VAL A 42 -5.918 -6.085 11.065 1.00 51.03 H new ATOM 0 HG11 VAL A 42 -7.780 -5.205 12.457 1.00 3.43 H new ATOM 0 HG12 VAL A 42 -6.842 -3.898 11.696 1.00 3.43 H new ATOM 0 HG13 VAL A 42 -8.430 -4.356 11.034 1.00 3.43 H new ATOM 0 HG21 VAL A 42 -7.995 -7.426 11.363 1.00 5.12 H new ATOM 0 HG22 VAL A 42 -8.660 -6.708 9.877 1.00 5.12 H new ATOM 0 HG23 VAL A 42 -7.216 -7.745 9.795 1.00 5.12 H new ATOM 734 N LEU A 43 -6.110 -2.688 9.302 1.00 52.33 N ATOM 735 CA LEU A 43 -5.420 -1.414 9.528 1.00 71.40 C ATOM 736 C LEU A 43 -5.886 -0.834 10.862 1.00 4.04 C ATOM 737 O LEU A 43 -7.085 -0.711 11.100 1.00 32.54 O ATOM 738 CB LEU A 43 -5.725 -0.412 8.379 1.00 10.30 C ATOM 739 CG LEU A 43 -5.151 1.039 8.545 1.00 74.52 C ATOM 740 CD1 LEU A 43 -3.609 1.039 8.637 1.00 22.30 C ATOM 741 CD2 LEU A 43 -5.654 1.970 7.419 1.00 42.11 C ATOM 0 H LEU A 43 -7.086 -2.573 9.031 1.00 52.33 H new ATOM 0 HA LEU A 43 -4.344 -1.586 9.550 1.00 71.40 H new ATOM 0 HB2 LEU A 43 -5.335 -0.829 7.450 1.00 10.30 H new ATOM 0 HB3 LEU A 43 -6.807 -0.340 8.267 1.00 10.30 H new ATOM 0 HG LEU A 43 -5.525 1.432 9.490 1.00 74.52 H new ATOM 0 HD11 LEU A 43 -3.251 2.062 8.751 1.00 22.30 H new ATOM 0 HD12 LEU A 43 -3.296 0.447 9.497 1.00 22.30 H new ATOM 0 HD13 LEU A 43 -3.190 0.608 7.728 1.00 22.30 H new ATOM 0 HD21 LEU A 43 -5.240 2.968 7.560 1.00 42.11 H new ATOM 0 HD22 LEU A 43 -5.335 1.578 6.453 1.00 42.11 H new ATOM 0 HD23 LEU A 43 -6.742 2.021 7.448 1.00 42.11 H new ATOM 753 N THR A 44 -4.927 -0.511 11.725 1.00 75.44 N ATOM 754 CA THR A 44 -5.144 0.260 12.956 1.00 32.22 C ATOM 755 C THR A 44 -4.211 1.481 12.912 1.00 32.44 C ATOM 756 O THR A 44 -3.275 1.517 12.094 1.00 54.30 O ATOM 757 CB THR A 44 -4.869 -0.605 14.239 1.00 20.43 C ATOM 758 OG1 THR A 44 -3.519 -1.093 14.238 1.00 63.33 O ATOM 759 CG2 THR A 44 -5.828 -1.801 14.346 1.00 32.44 C ATOM 0 H THR A 44 -3.953 -0.782 11.589 1.00 75.44 H new ATOM 0 HA THR A 44 -6.186 0.575 13.013 1.00 32.22 H new ATOM 0 HB THR A 44 -5.031 0.047 15.097 1.00 20.43 H new ATOM 0 HG1 THR A 44 -3.236 -1.271 13.317 1.00 63.33 H new ATOM 0 HG21 THR A 44 -5.601 -2.370 15.248 1.00 32.44 H new ATOM 0 HG22 THR A 44 -6.855 -1.440 14.394 1.00 32.44 H new ATOM 0 HG23 THR A 44 -5.709 -2.442 13.473 1.00 32.44 H new ATOM 767 N LYS A 45 -4.457 2.474 13.788 1.00 11.42 N ATOM 768 CA LYS A 45 -3.649 3.712 13.850 1.00 21.40 C ATOM 769 C LYS A 45 -2.174 3.429 14.204 1.00 21.22 C ATOM 770 O LYS A 45 -1.294 4.247 13.906 1.00 42.41 O ATOM 771 CB LYS A 45 -4.255 4.721 14.867 1.00 42.02 C ATOM 772 CG LYS A 45 -5.652 5.253 14.484 1.00 12.02 C ATOM 773 CD LYS A 45 -6.138 6.395 15.408 1.00 31.21 C ATOM 774 CE LYS A 45 -7.455 7.023 14.918 1.00 55.11 C ATOM 775 NZ LYS A 45 -8.557 6.030 14.851 1.00 30.24 N ATOM 0 H LYS A 45 -5.216 2.444 14.469 1.00 11.42 H new ATOM 0 HA LYS A 45 -3.673 4.152 12.853 1.00 21.40 H new ATOM 0 HB2 LYS A 45 -4.318 4.240 15.843 1.00 42.02 H new ATOM 0 HB3 LYS A 45 -3.574 5.566 14.971 1.00 42.02 H new ATOM 0 HG2 LYS A 45 -5.629 5.611 13.455 1.00 12.02 H new ATOM 0 HG3 LYS A 45 -6.369 4.433 14.520 1.00 12.02 H new ATOM 0 HD2 LYS A 45 -6.276 6.008 16.418 1.00 31.21 H new ATOM 0 HD3 LYS A 45 -5.369 7.166 15.464 1.00 31.21 H new ATOM 0 HE2 LYS A 45 -7.740 7.835 15.587 1.00 55.11 H new ATOM 0 HE3 LYS A 45 -7.302 7.461 13.932 1.00 55.11 H new ATOM 0 HZ1 LYS A 45 -9.436 6.506 14.565 1.00 30.24 H new ATOM 0 HZ2 LYS A 45 -8.320 5.294 14.155 1.00 30.24 H new ATOM 0 HZ3 LYS A 45 -8.688 5.593 15.786 1.00 30.24 H new ATOM 789 N SER A 46 -1.905 2.278 14.840 1.00 71.34 N ATOM 790 CA SER A 46 -0.549 1.897 15.243 1.00 30.22 C ATOM 791 C SER A 46 0.138 1.037 14.165 1.00 14.31 C ATOM 792 O SER A 46 1.308 1.270 13.841 1.00 43.02 O ATOM 793 CB SER A 46 -0.624 1.133 16.587 1.00 41.00 C ATOM 794 OG SER A 46 -1.493 0.008 16.506 1.00 24.01 O ATOM 0 H SER A 46 -2.618 1.592 15.086 1.00 71.34 H new ATOM 0 HA SER A 46 0.052 2.798 15.364 1.00 30.22 H new ATOM 0 HB2 SER A 46 0.374 0.802 16.873 1.00 41.00 H new ATOM 0 HB3 SER A 46 -0.973 1.807 17.370 1.00 41.00 H new ATOM 0 HG SER A 46 -1.515 -0.451 17.371 1.00 24.01 H new ATOM 800 N MET A 47 -0.603 0.083 13.563 1.00 12.44 N ATOM 801 CA MET A 47 0.001 -0.940 12.660 1.00 32.35 C ATOM 802 C MET A 47 -0.990 -1.437 11.589 1.00 74.20 C ATOM 803 O MET A 47 -2.181 -1.590 11.843 1.00 43.24 O ATOM 804 CB MET A 47 0.523 -2.172 13.489 1.00 71.42 C ATOM 805 CG MET A 47 1.809 -1.931 14.308 1.00 31.11 C ATOM 806 SD MET A 47 2.189 -3.272 15.456 1.00 74.52 S ATOM 807 CE MET A 47 0.857 -3.117 16.644 1.00 41.23 C ATOM 0 H MET A 47 -1.612 -0.007 13.679 1.00 12.44 H new ATOM 0 HA MET A 47 0.833 -0.452 12.152 1.00 32.35 H new ATOM 0 HB2 MET A 47 -0.266 -2.488 14.171 1.00 71.42 H new ATOM 0 HB3 MET A 47 0.701 -2.999 12.802 1.00 71.42 H new ATOM 0 HG2 MET A 47 2.647 -1.800 13.624 1.00 31.11 H new ATOM 0 HG3 MET A 47 1.706 -1.002 14.868 1.00 31.11 H new ATOM 0 HE1 MET A 47 1.130 -3.630 17.566 1.00 41.23 H new ATOM 0 HE2 MET A 47 0.678 -2.063 16.855 1.00 41.23 H new ATOM 0 HE3 MET A 47 -0.049 -3.564 16.235 1.00 41.23 H new ATOM 817 N LEU A 48 -0.447 -1.710 10.398 1.00 23.53 N ATOM 818 CA LEU A 48 -1.094 -2.517 9.360 1.00 21.52 C ATOM 819 C LEU A 48 -0.549 -3.948 9.487 1.00 42.43 C ATOM 820 O LEU A 48 0.649 -4.180 9.308 1.00 14.23 O ATOM 821 CB LEU A 48 -0.786 -1.941 7.947 1.00 14.51 C ATOM 822 CG LEU A 48 -1.218 -2.827 6.720 1.00 2.34 C ATOM 823 CD1 LEU A 48 -2.733 -3.129 6.747 1.00 64.33 C ATOM 824 CD2 LEU A 48 -0.799 -2.168 5.384 1.00 71.11 C ATOM 0 H LEU A 48 0.474 -1.369 10.124 1.00 23.53 H new ATOM 0 HA LEU A 48 -2.177 -2.505 9.487 1.00 21.52 H new ATOM 0 HB2 LEU A 48 -1.278 -0.972 7.859 1.00 14.51 H new ATOM 0 HB3 LEU A 48 0.287 -1.762 7.878 1.00 14.51 H new ATOM 0 HG LEU A 48 -0.695 -3.780 6.800 1.00 2.34 H new ATOM 0 HD11 LEU A 48 -2.997 -3.743 5.886 1.00 64.33 H new ATOM 0 HD12 LEU A 48 -2.981 -3.664 7.664 1.00 64.33 H new ATOM 0 HD13 LEU A 48 -3.291 -2.193 6.711 1.00 64.33 H new ATOM 0 HD21 LEU A 48 -1.110 -2.801 4.553 1.00 71.11 H new ATOM 0 HD22 LEU A 48 -1.276 -1.192 5.295 1.00 71.11 H new ATOM 0 HD23 LEU A 48 0.284 -2.046 5.362 1.00 71.11 H new ATOM 836 N THR A 49 -1.428 -4.894 9.822 1.00 61.10 N ATOM 837 CA THR A 49 -1.048 -6.282 10.123 1.00 52.20 C ATOM 838 C THR A 49 -1.962 -7.250 9.356 1.00 11.22 C ATOM 839 O THR A 49 -3.183 -7.087 9.364 1.00 64.44 O ATOM 840 CB THR A 49 -1.158 -6.535 11.666 1.00 22.11 C ATOM 841 OG1 THR A 49 -0.390 -5.541 12.376 1.00 62.20 O ATOM 842 CG2 THR A 49 -0.666 -7.940 12.063 1.00 40.43 C ATOM 0 H THR A 49 -2.431 -4.721 9.894 1.00 61.10 H new ATOM 0 HA THR A 49 -0.018 -6.452 9.810 1.00 52.20 H new ATOM 0 HB THR A 49 -2.212 -6.465 11.934 1.00 22.11 H new ATOM 0 HG1 THR A 49 -0.461 -5.700 13.340 1.00 62.20 H new ATOM 0 HG21 THR A 49 -0.762 -8.068 13.141 1.00 40.43 H new ATOM 0 HG22 THR A 49 -1.267 -8.693 11.553 1.00 40.43 H new ATOM 0 HG23 THR A 49 0.379 -8.054 11.776 1.00 40.43 H new ATOM 850 N TYR A 50 -1.364 -8.264 8.703 1.00 61.04 N ATOM 851 CA TYR A 50 -2.118 -9.302 7.971 1.00 60.52 C ATOM 852 C TYR A 50 -2.177 -10.604 8.777 1.00 42.50 C ATOM 853 O TYR A 50 -1.485 -10.758 9.787 1.00 24.23 O ATOM 854 CB TYR A 50 -1.531 -9.535 6.554 1.00 11.45 C ATOM 855 CG TYR A 50 -0.012 -9.762 6.488 1.00 61.34 C ATOM 856 CD1 TYR A 50 0.548 -11.033 6.665 1.00 43.33 C ATOM 857 CD2 TYR A 50 0.860 -8.696 6.229 1.00 11.34 C ATOM 858 CE1 TYR A 50 1.914 -11.230 6.586 1.00 41.34 C ATOM 859 CE2 TYR A 50 2.223 -8.889 6.151 1.00 72.12 C ATOM 860 CZ TYR A 50 2.749 -10.158 6.330 1.00 32.24 C ATOM 861 OH TYR A 50 4.114 -10.359 6.246 1.00 43.41 O ATOM 0 H TYR A 50 -0.352 -8.388 8.667 1.00 61.04 H new ATOM 0 HA TYR A 50 -3.140 -8.945 7.841 1.00 60.52 H new ATOM 0 HB2 TYR A 50 -2.028 -10.399 6.113 1.00 11.45 H new ATOM 0 HB3 TYR A 50 -1.778 -8.674 5.933 1.00 11.45 H new ATOM 0 HD1 TYR A 50 -0.099 -11.874 6.867 1.00 43.33 H new ATOM 0 HD2 TYR A 50 0.457 -7.704 6.088 1.00 11.34 H new ATOM 0 HE1 TYR A 50 2.328 -12.218 6.724 1.00 41.34 H new ATOM 0 HE2 TYR A 50 2.878 -8.054 5.951 1.00 72.12 H new ATOM 0 HH TYR A 50 4.559 -9.506 6.060 1.00 43.41 H new ATOM 871 N TYR A 51 -3.013 -11.541 8.304 1.00 44.12 N ATOM 872 CA TYR A 51 -3.354 -12.768 9.041 1.00 25.33 C ATOM 873 C TYR A 51 -3.218 -14.002 8.140 1.00 33.10 C ATOM 874 O TYR A 51 -3.802 -14.061 7.045 1.00 70.33 O ATOM 875 CB TYR A 51 -4.783 -12.649 9.634 1.00 24.11 C ATOM 876 CG TYR A 51 -4.879 -11.581 10.740 1.00 23.13 C ATOM 877 CD1 TYR A 51 -4.509 -11.875 12.058 1.00 21.45 C ATOM 878 CD2 TYR A 51 -5.284 -10.271 10.461 1.00 72.12 C ATOM 879 CE1 TYR A 51 -4.555 -10.908 13.046 1.00 12.42 C ATOM 880 CE2 TYR A 51 -5.318 -9.308 11.446 1.00 42.34 C ATOM 881 CZ TYR A 51 -4.958 -9.628 12.732 1.00 10.40 C ATOM 882 OH TYR A 51 -4.998 -8.659 13.707 1.00 10.04 O ATOM 0 H TYR A 51 -3.473 -11.469 7.397 1.00 44.12 H new ATOM 0 HA TYR A 51 -2.652 -12.892 9.866 1.00 25.33 H new ATOM 0 HB2 TYR A 51 -5.484 -12.404 8.836 1.00 24.11 H new ATOM 0 HB3 TYR A 51 -5.086 -13.615 10.039 1.00 24.11 H new ATOM 0 HD1 TYR A 51 -4.182 -12.874 12.307 1.00 21.45 H new ATOM 0 HD2 TYR A 51 -5.576 -10.010 9.454 1.00 72.12 H new ATOM 0 HE1 TYR A 51 -4.276 -11.155 14.060 1.00 12.42 H new ATOM 0 HE2 TYR A 51 -5.628 -8.301 11.207 1.00 42.34 H new ATOM 0 HH TYR A 51 -5.303 -7.814 13.316 1.00 10.04 H new ATOM 1081 N PHE A 63 4.483 -7.379 9.783 1.00 32.23 N ATOM 1082 CA PHE A 63 3.617 -6.229 10.073 1.00 70.12 C ATOM 1083 C PHE A 63 4.379 -4.946 9.745 1.00 43.30 C ATOM 1084 O PHE A 63 5.620 -4.905 9.812 1.00 50.35 O ATOM 1085 CB PHE A 63 3.084 -6.228 11.545 1.00 43.23 C ATOM 1086 CG PHE A 63 4.126 -5.994 12.647 1.00 24.12 C ATOM 1087 CD1 PHE A 63 4.974 -7.023 13.070 1.00 33.04 C ATOM 1088 CD2 PHE A 63 4.244 -4.749 13.273 1.00 0.30 C ATOM 1089 CE1 PHE A 63 5.901 -6.811 14.077 1.00 11.03 C ATOM 1090 CE2 PHE A 63 5.171 -4.541 14.275 1.00 11.45 C ATOM 1091 CZ PHE A 63 5.999 -5.569 14.678 1.00 12.23 C ATOM 0 HA PHE A 63 2.728 -6.297 9.446 1.00 70.12 H new ATOM 0 HB2 PHE A 63 2.317 -5.458 11.630 1.00 43.23 H new ATOM 0 HB3 PHE A 63 2.597 -7.185 11.733 1.00 43.23 H new ATOM 0 HD1 PHE A 63 4.905 -7.995 12.605 1.00 33.04 H new ATOM 0 HD2 PHE A 63 3.600 -3.937 12.968 1.00 0.30 H new ATOM 0 HE1 PHE A 63 6.548 -7.616 14.393 1.00 11.03 H new ATOM 0 HE2 PHE A 63 5.248 -3.571 14.745 1.00 11.45 H new ATOM 0 HZ PHE A 63 6.723 -5.404 15.462 1.00 12.23 H new ATOM 1101 N ILE A 64 3.627 -3.904 9.409 1.00 11.42 N ATOM 1102 CA ILE A 64 4.159 -2.591 9.054 1.00 73.01 C ATOM 1103 C ILE A 64 3.562 -1.587 10.033 1.00 3.22 C ATOM 1104 O ILE A 64 2.362 -1.613 10.286 1.00 5.43 O ATOM 1105 CB ILE A 64 3.806 -2.179 7.566 1.00 2.25 C ATOM 1106 CG1 ILE A 64 4.368 -3.226 6.544 1.00 30.25 C ATOM 1107 CG2 ILE A 64 4.329 -0.752 7.236 1.00 2.31 C ATOM 1108 CD1 ILE A 64 4.063 -2.916 5.086 1.00 22.43 C ATOM 0 H ILE A 64 2.609 -3.948 9.375 1.00 11.42 H new ATOM 0 HA ILE A 64 5.247 -2.613 9.114 1.00 73.01 H new ATOM 0 HB ILE A 64 2.720 -2.166 7.477 1.00 2.25 H new ATOM 0 HG12 ILE A 64 5.449 -3.292 6.669 1.00 30.25 H new ATOM 0 HG13 ILE A 64 3.958 -4.207 6.787 1.00 30.25 H new ATOM 0 HG21 ILE A 64 4.071 -0.499 6.208 1.00 2.31 H new ATOM 0 HG22 ILE A 64 3.871 -0.031 7.913 1.00 2.31 H new ATOM 0 HG23 ILE A 64 5.412 -0.725 7.355 1.00 2.31 H new ATOM 0 HD11 ILE A 64 4.490 -3.693 4.452 1.00 22.43 H new ATOM 0 HD12 ILE A 64 2.983 -2.881 4.940 1.00 22.43 H new ATOM 0 HD13 ILE A 64 4.497 -1.952 4.821 1.00 22.43 H new ATOM 1120 N ASP A 65 4.404 -0.732 10.606 1.00 64.45 N ATOM 1121 CA ASP A 65 3.940 0.394 11.425 1.00 71.45 C ATOM 1122 C ASP A 65 3.593 1.546 10.490 1.00 53.21 C ATOM 1123 O ASP A 65 4.248 1.728 9.452 1.00 11.22 O ATOM 1124 CB ASP A 65 4.997 0.823 12.475 1.00 35.45 C ATOM 1125 CG ASP A 65 4.988 -0.060 13.724 1.00 72.45 C ATOM 1126 OD1 ASP A 65 5.504 -1.195 13.666 1.00 33.33 O ATOM 1127 OD2 ASP A 65 4.470 0.387 14.776 1.00 10.13 O ATOM 0 H ASP A 65 5.418 -0.795 10.520 1.00 64.45 H new ATOM 0 HA ASP A 65 3.059 0.090 11.991 1.00 71.45 H new ATOM 0 HB2 ASP A 65 5.987 0.791 12.020 1.00 35.45 H new ATOM 0 HB3 ASP A 65 4.814 1.857 12.766 1.00 35.45 H new ATOM 1132 N VAL A 66 2.557 2.308 10.851 1.00 0.52 N ATOM 1133 CA VAL A 66 2.114 3.474 10.065 1.00 61.03 C ATOM 1134 C VAL A 66 3.249 4.523 9.952 1.00 33.30 C ATOM 1135 O VAL A 66 3.388 5.192 8.926 1.00 62.44 O ATOM 1136 CB VAL A 66 0.815 4.112 10.685 1.00 51.35 C ATOM 1137 CG1 VAL A 66 0.325 5.322 9.857 1.00 14.20 C ATOM 1138 CG2 VAL A 66 -0.305 3.049 10.836 1.00 14.43 C ATOM 0 H VAL A 66 2.002 2.140 11.690 1.00 0.52 H new ATOM 0 HA VAL A 66 1.869 3.131 9.060 1.00 61.03 H new ATOM 0 HB VAL A 66 1.070 4.479 11.679 1.00 51.35 H new ATOM 0 HG11 VAL A 66 -0.573 5.736 10.315 1.00 14.20 H new ATOM 0 HG12 VAL A 66 1.104 6.084 9.831 1.00 14.20 H new ATOM 0 HG13 VAL A 66 0.098 5.000 8.841 1.00 14.20 H new ATOM 0 HG21 VAL A 66 -1.192 3.514 11.266 1.00 14.43 H new ATOM 0 HG22 VAL A 66 -0.550 2.637 9.857 1.00 14.43 H new ATOM 0 HG23 VAL A 66 0.039 2.248 11.491 1.00 14.43 H new ATOM 1148 N SER A 67 4.093 4.586 10.996 1.00 54.25 N ATOM 1149 CA SER A 67 5.241 5.505 11.080 1.00 52.13 C ATOM 1150 C SER A 67 6.389 5.096 10.134 1.00 32.13 C ATOM 1151 O SER A 67 7.223 5.933 9.775 1.00 23.33 O ATOM 1152 CB SER A 67 5.732 5.539 12.537 1.00 35.54 C ATOM 1153 OG SER A 67 6.061 4.233 13.001 1.00 0.02 O ATOM 0 H SER A 67 3.995 3.990 11.818 1.00 54.25 H new ATOM 0 HA SER A 67 4.916 6.496 10.763 1.00 52.13 H new ATOM 0 HB2 SER A 67 6.606 6.186 12.614 1.00 35.54 H new ATOM 0 HB3 SER A 67 4.959 5.970 13.174 1.00 35.54 H new ATOM 0 HG SER A 67 6.372 4.284 13.929 1.00 0.02 H new ATOM 1159 N LYS A 68 6.427 3.802 9.743 1.00 51.45 N ATOM 1160 CA LYS A 68 7.442 3.268 8.809 1.00 4.23 C ATOM 1161 C LYS A 68 7.149 3.725 7.377 1.00 11.14 C ATOM 1162 O LYS A 68 8.065 3.819 6.555 1.00 73.31 O ATOM 1163 CB LYS A 68 7.458 1.720 8.849 1.00 41.33 C ATOM 1164 CG LYS A 68 7.789 1.123 10.223 1.00 53.03 C ATOM 1165 CD LYS A 68 9.255 1.325 10.652 1.00 25.13 C ATOM 1166 CE LYS A 68 9.525 0.763 12.057 1.00 1.14 C ATOM 1167 NZ LYS A 68 9.108 -0.664 12.187 1.00 15.42 N ATOM 0 H LYS A 68 5.758 3.102 10.065 1.00 51.45 H new ATOM 0 HA LYS A 68 8.414 3.649 9.120 1.00 4.23 H new ATOM 0 HB2 LYS A 68 6.483 1.351 8.532 1.00 41.33 H new ATOM 0 HB3 LYS A 68 8.187 1.358 8.124 1.00 41.33 H new ATOM 0 HG2 LYS A 68 7.136 1.573 10.971 1.00 53.03 H new ATOM 0 HG3 LYS A 68 7.568 0.056 10.208 1.00 53.03 H new ATOM 0 HD2 LYS A 68 9.914 0.837 9.933 1.00 25.13 H new ATOM 0 HD3 LYS A 68 9.495 2.388 10.634 1.00 25.13 H new ATOM 0 HE2 LYS A 68 10.588 0.850 12.283 1.00 1.14 H new ATOM 0 HE3 LYS A 68 8.992 1.363 12.794 1.00 1.14 H new ATOM 0 HZ1 LYS A 68 9.460 -1.048 13.087 1.00 15.42 H new ATOM 0 HZ2 LYS A 68 8.070 -0.726 12.167 1.00 15.42 H new ATOM 0 HZ3 LYS A 68 9.503 -1.214 11.398 1.00 15.42 H new ATOM 1181 N ILE A 69 5.859 3.996 7.107 1.00 24.45 N ATOM 1182 CA ILE A 69 5.370 4.361 5.777 1.00 14.21 C ATOM 1183 C ILE A 69 5.887 5.756 5.367 1.00 12.53 C ATOM 1184 O ILE A 69 5.872 6.702 6.167 1.00 52.24 O ATOM 1185 CB ILE A 69 3.801 4.333 5.715 1.00 52.32 C ATOM 1186 CG1 ILE A 69 3.250 2.946 6.186 1.00 62.12 C ATOM 1187 CG2 ILE A 69 3.299 4.676 4.293 1.00 33.41 C ATOM 1188 CD1 ILE A 69 1.728 2.840 6.249 1.00 25.45 C ATOM 0 H ILE A 69 5.126 3.966 7.815 1.00 24.45 H new ATOM 0 HA ILE A 69 5.754 3.621 5.075 1.00 14.21 H new ATOM 0 HB ILE A 69 3.421 5.094 6.397 1.00 52.32 H new ATOM 0 HG12 ILE A 69 3.625 2.176 5.512 1.00 62.12 H new ATOM 0 HG13 ILE A 69 3.655 2.728 7.174 1.00 62.12 H new ATOM 0 HG21 ILE A 69 2.209 4.650 4.276 1.00 33.41 H new ATOM 0 HG22 ILE A 69 3.643 5.673 4.016 1.00 33.41 H new ATOM 0 HG23 ILE A 69 3.691 3.947 3.583 1.00 33.41 H new ATOM 0 HD11 ILE A 69 1.446 1.842 6.586 1.00 25.45 H new ATOM 0 HD12 ILE A 69 1.340 3.582 6.947 1.00 25.45 H new ATOM 0 HD13 ILE A 69 1.309 3.020 5.259 1.00 25.45 H new ATOM 1200 N LYS A 70 6.346 5.848 4.110 1.00 24.24 N ATOM 1201 CA LYS A 70 6.942 7.058 3.529 1.00 61.45 C ATOM 1202 C LYS A 70 6.054 7.641 2.410 1.00 41.11 C ATOM 1203 O LYS A 70 6.144 8.831 2.105 1.00 40.52 O ATOM 1204 CB LYS A 70 8.356 6.716 2.995 1.00 52.02 C ATOM 1205 CG LYS A 70 9.257 6.009 4.040 1.00 21.13 C ATOM 1206 CD LYS A 70 10.709 5.797 3.564 1.00 54.35 C ATOM 1207 CE LYS A 70 11.452 7.117 3.304 1.00 61.10 C ATOM 1208 NZ LYS A 70 11.490 7.994 4.508 1.00 1.44 N ATOM 0 H LYS A 70 6.312 5.066 3.456 1.00 24.24 H new ATOM 0 HA LYS A 70 7.021 7.822 4.302 1.00 61.45 H new ATOM 0 HB2 LYS A 70 8.260 6.076 2.118 1.00 52.02 H new ATOM 0 HB3 LYS A 70 8.844 7.634 2.668 1.00 52.02 H new ATOM 0 HG2 LYS A 70 9.267 6.599 4.957 1.00 21.13 H new ATOM 0 HG3 LYS A 70 8.820 5.042 4.288 1.00 21.13 H new ATOM 0 HD2 LYS A 70 11.252 5.222 4.314 1.00 54.35 H new ATOM 0 HD3 LYS A 70 10.703 5.203 2.650 1.00 54.35 H new ATOM 0 HE2 LYS A 70 12.471 6.900 2.983 1.00 61.10 H new ATOM 0 HE3 LYS A 70 10.967 7.649 2.486 1.00 61.10 H new ATOM 0 HZ1 LYS A 70 12.457 8.351 4.647 1.00 1.44 H new ATOM 0 HZ2 LYS A 70 10.841 8.796 4.374 1.00 1.44 H new ATOM 0 HZ3 LYS A 70 11.199 7.448 5.344 1.00 1.44 H new ATOM 1222 N CYS A 71 5.180 6.797 1.838 1.00 54.42 N ATOM 1223 CA CYS A 71 4.285 7.167 0.718 1.00 12.32 C ATOM 1224 C CYS A 71 3.211 6.082 0.538 1.00 35.13 C ATOM 1225 O CYS A 71 3.524 4.890 0.583 1.00 40.42 O ATOM 1226 CB CYS A 71 5.060 7.342 -0.626 1.00 24.20 C ATOM 1227 SG CYS A 71 6.240 8.713 -0.687 1.00 12.35 S ATOM 0 H CYS A 71 5.070 5.829 2.139 1.00 54.42 H new ATOM 0 HA CYS A 71 3.829 8.124 0.969 1.00 12.32 H new ATOM 0 HB2 CYS A 71 5.597 6.417 -0.836 1.00 24.20 H new ATOM 0 HB3 CYS A 71 4.333 7.478 -1.427 1.00 24.20 H new ATOM 0 HG CYS A 71 6.451 9.158 0.516 1.00 12.35 H new ATOM 1233 N VAL A 72 1.947 6.504 0.351 1.00 64.32 N ATOM 1234 CA VAL A 72 0.848 5.619 -0.097 1.00 33.44 C ATOM 1235 C VAL A 72 0.094 6.298 -1.243 1.00 35.04 C ATOM 1236 O VAL A 72 -0.355 7.440 -1.108 1.00 61.15 O ATOM 1237 CB VAL A 72 -0.181 5.243 1.041 1.00 14.13 C ATOM 1238 CG1 VAL A 72 -1.396 4.468 0.461 1.00 71.03 C ATOM 1239 CG2 VAL A 72 0.498 4.410 2.146 1.00 43.21 C ATOM 0 H VAL A 72 1.655 7.469 0.506 1.00 64.32 H new ATOM 0 HA VAL A 72 1.314 4.687 -0.415 1.00 33.44 H new ATOM 0 HB VAL A 72 -0.541 6.174 1.479 1.00 14.13 H new ATOM 0 HG11 VAL A 72 -2.088 4.222 1.266 1.00 71.03 H new ATOM 0 HG12 VAL A 72 -1.904 5.088 -0.278 1.00 71.03 H new ATOM 0 HG13 VAL A 72 -1.049 3.550 -0.013 1.00 71.03 H new ATOM 0 HG21 VAL A 72 -0.232 4.164 2.917 1.00 43.21 H new ATOM 0 HG22 VAL A 72 0.895 3.490 1.716 1.00 43.21 H new ATOM 0 HG23 VAL A 72 1.312 4.985 2.587 1.00 43.21 H new ATOM 1249 N GLU A 73 -0.033 5.565 -2.357 1.00 30.54 N ATOM 1250 CA GLU A 73 -0.778 5.975 -3.552 1.00 10.00 C ATOM 1251 C GLU A 73 -1.382 4.743 -4.218 1.00 74.45 C ATOM 1252 O GLU A 73 -1.070 3.606 -3.856 1.00 31.42 O ATOM 1253 CB GLU A 73 0.148 6.724 -4.568 1.00 72.42 C ATOM 1254 CG GLU A 73 0.394 8.204 -4.245 1.00 55.21 C ATOM 1255 CD GLU A 73 -0.890 9.047 -4.319 1.00 14.02 C ATOM 1256 OE1 GLU A 73 -1.316 9.382 -5.445 1.00 61.54 O ATOM 1257 OE2 GLU A 73 -1.470 9.382 -3.262 1.00 50.42 O ATOM 0 H GLU A 73 0.393 4.643 -2.453 1.00 30.54 H new ATOM 0 HA GLU A 73 -1.569 6.660 -3.247 1.00 10.00 H new ATOM 0 HB2 GLU A 73 1.109 6.211 -4.609 1.00 72.42 H new ATOM 0 HB3 GLU A 73 -0.294 6.652 -5.562 1.00 72.42 H new ATOM 0 HG2 GLU A 73 0.822 8.288 -3.246 1.00 55.21 H new ATOM 0 HG3 GLU A 73 1.129 8.607 -4.942 1.00 55.21 H new ATOM 1264 N ILE A 74 -2.267 4.991 -5.188 1.00 32.23 N ATOM 1265 CA ILE A 74 -2.703 3.975 -6.154 1.00 42.45 C ATOM 1266 C ILE A 74 -1.529 3.664 -7.110 1.00 24.33 C ATOM 1267 O ILE A 74 -0.628 4.509 -7.291 1.00 73.21 O ATOM 1268 CB ILE A 74 -3.963 4.473 -6.972 1.00 74.31 C ATOM 1269 CG1 ILE A 74 -3.631 5.749 -7.823 1.00 43.22 C ATOM 1270 CG2 ILE A 74 -5.153 4.750 -6.020 1.00 62.54 C ATOM 1271 CD1 ILE A 74 -4.795 6.297 -8.644 1.00 64.34 C ATOM 0 H ILE A 74 -2.703 5.903 -5.327 1.00 32.23 H new ATOM 0 HA ILE A 74 -2.995 3.072 -5.619 1.00 42.45 H new ATOM 0 HB ILE A 74 -4.244 3.678 -7.663 1.00 74.31 H new ATOM 0 HG12 ILE A 74 -3.278 6.533 -7.153 1.00 43.22 H new ATOM 0 HG13 ILE A 74 -2.809 5.513 -8.499 1.00 43.22 H new ATOM 0 HG21 ILE A 74 -6.011 5.092 -6.600 1.00 62.54 H new ATOM 0 HG22 ILE A 74 -5.415 3.835 -5.489 1.00 62.54 H new ATOM 0 HG23 ILE A 74 -4.872 5.519 -5.300 1.00 62.54 H new ATOM 0 HD11 ILE A 74 -4.468 7.177 -9.197 1.00 64.34 H new ATOM 0 HD12 ILE A 74 -5.137 5.535 -9.344 1.00 64.34 H new ATOM 0 HD13 ILE A 74 -5.613 6.570 -7.978 1.00 64.34 H new ATOM 1283 N VAL A 75 -1.523 2.473 -7.724 1.00 4.13 N ATOM 1284 CA VAL A 75 -0.483 2.119 -8.704 1.00 53.14 C ATOM 1285 C VAL A 75 -1.032 2.407 -10.097 1.00 3.54 C ATOM 1286 O VAL A 75 -1.853 1.642 -10.626 1.00 51.51 O ATOM 1287 CB VAL A 75 -0.012 0.617 -8.620 1.00 23.04 C ATOM 1288 CG1 VAL A 75 1.105 0.312 -9.657 1.00 73.31 C ATOM 1289 CG2 VAL A 75 0.459 0.271 -7.203 1.00 24.44 C ATOM 0 H VAL A 75 -2.218 1.744 -7.563 1.00 4.13 H new ATOM 0 HA VAL A 75 0.398 2.720 -8.481 1.00 53.14 H new ATOM 0 HB VAL A 75 -0.871 -0.010 -8.861 1.00 23.04 H new ATOM 0 HG11 VAL A 75 1.406 -0.732 -9.571 1.00 73.31 H new ATOM 0 HG12 VAL A 75 0.729 0.500 -10.663 1.00 73.31 H new ATOM 0 HG13 VAL A 75 1.965 0.954 -9.465 1.00 73.31 H new ATOM 0 HG21 VAL A 75 0.779 -0.770 -7.170 1.00 24.44 H new ATOM 0 HG22 VAL A 75 1.294 0.916 -6.929 1.00 24.44 H new ATOM 0 HG23 VAL A 75 -0.361 0.421 -6.500 1.00 24.44 H new ATOM 1299 N LYS A 76 -0.612 3.539 -10.657 1.00 63.41 N ATOM 1300 CA LYS A 76 -0.892 3.890 -12.051 1.00 11.34 C ATOM 1301 C LYS A 76 -0.013 2.990 -12.941 1.00 22.05 C ATOM 1302 O LYS A 76 1.186 3.233 -13.134 1.00 54.35 O ATOM 1303 CB LYS A 76 -0.676 5.417 -12.289 1.00 15.15 C ATOM 1304 CG LYS A 76 0.584 5.997 -11.618 1.00 14.21 C ATOM 1305 CD LYS A 76 0.695 7.531 -11.753 1.00 4.21 C ATOM 1306 CE LYS A 76 0.925 7.992 -13.195 1.00 61.31 C ATOM 1307 NZ LYS A 76 1.069 9.465 -13.282 1.00 61.54 N ATOM 0 H LYS A 76 -0.067 4.242 -10.158 1.00 63.41 H new ATOM 0 HA LYS A 76 -1.936 3.710 -12.308 1.00 11.34 H new ATOM 0 HB2 LYS A 76 -0.617 5.600 -13.362 1.00 15.15 H new ATOM 0 HB3 LYS A 76 -1.549 5.956 -11.921 1.00 15.15 H new ATOM 0 HG2 LYS A 76 0.579 5.731 -10.561 1.00 14.21 H new ATOM 0 HG3 LYS A 76 1.467 5.535 -12.059 1.00 14.21 H new ATOM 0 HD2 LYS A 76 -0.217 7.990 -11.372 1.00 4.21 H new ATOM 0 HD3 LYS A 76 1.515 7.886 -11.129 1.00 4.21 H new ATOM 0 HE2 LYS A 76 1.821 7.514 -13.591 1.00 61.31 H new ATOM 0 HE3 LYS A 76 0.090 7.670 -13.818 1.00 61.31 H new ATOM 0 HZ1 LYS A 76 1.373 9.728 -14.241 1.00 61.54 H new ATOM 0 HZ2 LYS A 76 0.156 9.916 -13.073 1.00 61.54 H new ATOM 0 HZ3 LYS A 76 1.779 9.786 -12.593 1.00 61.54 H new ATOM 1382 N ILE A 82 -3.057 -6.432 -15.732 1.00 3.42 N ATOM 1383 CA ILE A 82 -2.739 -6.665 -14.315 1.00 53.31 C ATOM 1384 C ILE A 82 -2.598 -8.196 -14.089 1.00 23.52 C ATOM 1385 O ILE A 82 -3.563 -8.932 -14.335 1.00 14.23 O ATOM 1386 CB ILE A 82 -3.853 -6.054 -13.377 1.00 22.24 C ATOM 1387 CG1 ILE A 82 -3.930 -4.500 -13.545 1.00 62.24 C ATOM 1388 CG2 ILE A 82 -3.635 -6.436 -11.892 1.00 62.12 C ATOM 1389 CD1 ILE A 82 -2.669 -3.738 -13.146 1.00 44.50 C ATOM 0 HA ILE A 82 -1.802 -6.169 -14.062 1.00 53.31 H new ATOM 0 HB ILE A 82 -4.806 -6.484 -13.685 1.00 22.24 H new ATOM 0 HG12 ILE A 82 -4.157 -4.274 -14.587 1.00 62.24 H new ATOM 0 HG13 ILE A 82 -4.764 -4.127 -12.950 1.00 62.24 H new ATOM 0 HG21 ILE A 82 -4.424 -5.995 -11.283 1.00 62.12 H new ATOM 0 HG22 ILE A 82 -3.660 -7.521 -11.788 1.00 62.12 H new ATOM 0 HG23 ILE A 82 -2.667 -6.062 -11.558 1.00 62.12 H new ATOM 0 HD11 ILE A 82 -2.825 -2.670 -13.300 1.00 44.50 H new ATOM 0 HD12 ILE A 82 -2.448 -3.925 -12.095 1.00 44.50 H new ATOM 0 HD13 ILE A 82 -1.832 -4.074 -13.758 1.00 44.50 H new ATOM 1401 N PRO A 83 -1.400 -8.692 -13.619 1.00 34.24 N ATOM 1402 CA PRO A 83 -1.092 -10.151 -13.557 1.00 22.32 C ATOM 1403 C PRO A 83 -2.034 -10.952 -12.631 1.00 4.31 C ATOM 1404 O PRO A 83 -2.493 -12.047 -12.984 1.00 13.50 O ATOM 1405 CB PRO A 83 0.369 -10.207 -13.021 1.00 3.34 C ATOM 1406 CG PRO A 83 0.925 -8.820 -13.184 1.00 44.32 C ATOM 1407 CD PRO A 83 -0.259 -7.878 -13.105 1.00 42.45 C ATOM 0 HA PRO A 83 -1.225 -10.610 -14.537 1.00 22.32 H new ATOM 0 HB2 PRO A 83 0.389 -10.515 -11.976 1.00 3.34 H new ATOM 0 HB3 PRO A 83 0.961 -10.933 -13.578 1.00 3.34 H new ATOM 0 HG2 PRO A 83 1.652 -8.598 -12.403 1.00 44.32 H new ATOM 0 HG3 PRO A 83 1.441 -8.717 -14.138 1.00 44.32 H new ATOM 0 HD2 PRO A 83 -0.436 -7.543 -12.083 1.00 42.45 H new ATOM 0 HD3 PRO A 83 -0.100 -6.985 -13.710 1.00 42.45 H new ATOM 1415 N CYS A 84 -2.307 -10.376 -11.453 1.00 63.24 N ATOM 1416 CA CYS A 84 -3.048 -11.047 -10.374 1.00 52.13 C ATOM 1417 C CYS A 84 -4.551 -11.155 -10.692 1.00 73.42 C ATOM 1418 O CYS A 84 -5.065 -10.433 -11.555 1.00 32.43 O ATOM 1419 CB CYS A 84 -2.825 -10.283 -9.057 1.00 11.15 C ATOM 1420 SG CYS A 84 -3.600 -11.045 -7.629 1.00 72.45 S ATOM 0 H CYS A 84 -2.019 -9.426 -11.219 1.00 63.24 H new ATOM 0 HA CYS A 84 -2.671 -12.065 -10.277 1.00 52.13 H new ATOM 0 HB2 CYS A 84 -1.754 -10.200 -8.874 1.00 11.15 H new ATOM 0 HB3 CYS A 84 -3.209 -9.269 -9.168 1.00 11.15 H new ATOM 0 HG CYS A 84 -3.123 -12.243 -7.464 1.00 72.45 H new ATOM 1426 N GLN A 85 -5.242 -12.075 -9.980 1.00 53.12 N ATOM 1427 CA GLN A 85 -6.702 -12.287 -10.112 1.00 53.21 C ATOM 1428 C GLN A 85 -7.476 -11.025 -9.676 1.00 62.21 C ATOM 1429 O GLN A 85 -8.539 -10.710 -10.225 1.00 71.03 O ATOM 1430 CB GLN A 85 -7.160 -13.514 -9.269 1.00 22.34 C ATOM 1431 CG GLN A 85 -6.979 -13.350 -7.741 1.00 24.33 C ATOM 1432 CD GLN A 85 -7.523 -14.511 -6.908 1.00 0.35 C ATOM 1433 OE1 GLN A 85 -7.526 -15.665 -7.338 1.00 43.35 O ATOM 1434 NE2 GLN A 85 -7.977 -14.216 -5.704 1.00 33.42 N ATOM 0 H GLN A 85 -4.802 -12.692 -9.297 1.00 53.12 H new ATOM 0 HA GLN A 85 -6.921 -12.486 -11.161 1.00 53.21 H new ATOM 0 HB2 GLN A 85 -8.212 -13.710 -9.478 1.00 22.34 H new ATOM 0 HB3 GLN A 85 -6.602 -14.391 -9.596 1.00 22.34 H new ATOM 0 HG2 GLN A 85 -5.917 -13.231 -7.525 1.00 24.33 H new ATOM 0 HG3 GLN A 85 -7.473 -12.431 -7.426 1.00 24.33 H new ATOM 0 HE21 GLN A 85 -7.961 -13.250 -5.376 1.00 33.42 H new ATOM 0 HE22 GLN A 85 -8.343 -14.954 -5.102 1.00 33.42 H new ATOM 1443 N ASN A 86 -6.919 -10.325 -8.668 1.00 34.13 N ATOM 1444 CA ASN A 86 -7.428 -9.042 -8.184 1.00 52.23 C ATOM 1445 C ASN A 86 -6.714 -7.915 -8.931 1.00 30.31 C ATOM 1446 O ASN A 86 -5.571 -8.077 -9.386 1.00 13.43 O ATOM 1447 CB ASN A 86 -7.243 -8.906 -6.648 1.00 22.53 C ATOM 1448 CG ASN A 86 -8.126 -9.869 -5.835 1.00 70.22 C ATOM 1449 OD1 ASN A 86 -9.006 -10.554 -6.368 1.00 72.02 O ATOM 1450 ND2 ASN A 86 -7.943 -9.878 -4.526 1.00 13.13 N ATOM 0 H ASN A 86 -6.092 -10.646 -8.165 1.00 34.13 H new ATOM 0 HA ASN A 86 -8.499 -8.982 -8.378 1.00 52.23 H new ATOM 0 HB2 ASN A 86 -6.197 -9.087 -6.399 1.00 22.53 H new ATOM 0 HB3 ASN A 86 -7.469 -7.881 -6.352 1.00 22.53 H new ATOM 0 HD21 ASN A 86 -8.535 -10.459 -3.932 1.00 13.13 H new ATOM 0 HD22 ASN A 86 -7.210 -9.304 -4.110 1.00 13.13 H new ATOM 1457 N LYS A 87 -7.388 -6.776 -9.038 1.00 21.32 N ATOM 1458 CA LYS A 87 -6.966 -5.660 -9.894 1.00 24.33 C ATOM 1459 C LYS A 87 -7.168 -4.330 -9.180 1.00 50.05 C ATOM 1460 O LYS A 87 -7.853 -4.261 -8.152 1.00 43.21 O ATOM 1461 CB LYS A 87 -7.718 -5.679 -11.260 1.00 74.05 C ATOM 1462 CG LYS A 87 -9.273 -5.593 -11.198 1.00 1.53 C ATOM 1463 CD LYS A 87 -9.972 -6.914 -10.797 1.00 12.30 C ATOM 1464 CE LYS A 87 -9.701 -8.065 -11.787 1.00 22.22 C ATOM 1465 NZ LYS A 87 -10.153 -7.743 -13.167 1.00 3.14 N ATOM 0 H LYS A 87 -8.253 -6.594 -8.530 1.00 21.32 H new ATOM 0 HA LYS A 87 -5.903 -5.779 -10.101 1.00 24.33 H new ATOM 0 HB2 LYS A 87 -7.354 -4.846 -11.862 1.00 74.05 H new ATOM 0 HB3 LYS A 87 -7.447 -6.595 -11.786 1.00 74.05 H new ATOM 0 HG2 LYS A 87 -9.553 -4.817 -10.486 1.00 1.53 H new ATOM 0 HG3 LYS A 87 -9.646 -5.280 -12.173 1.00 1.53 H new ATOM 0 HD2 LYS A 87 -9.635 -7.210 -9.804 1.00 12.30 H new ATOM 0 HD3 LYS A 87 -11.047 -6.744 -10.731 1.00 12.30 H new ATOM 0 HE2 LYS A 87 -8.634 -8.286 -11.799 1.00 22.22 H new ATOM 0 HE3 LYS A 87 -10.209 -8.965 -11.442 1.00 22.22 H new ATOM 0 HZ1 LYS A 87 -10.028 -8.576 -13.777 1.00 3.14 H new ATOM 0 HZ2 LYS A 87 -11.158 -7.475 -13.150 1.00 3.14 H new ATOM 0 HZ3 LYS A 87 -9.590 -6.953 -13.541 1.00 3.14 H new ATOM 1479 N TYR A 88 -6.599 -3.271 -9.791 1.00 45.54 N ATOM 1480 CA TYR A 88 -6.455 -1.943 -9.180 1.00 22.02 C ATOM 1481 C TYR A 88 -5.631 -2.058 -7.876 1.00 24.44 C ATOM 1482 O TYR A 88 -6.193 -2.042 -6.770 1.00 31.33 O ATOM 1483 CB TYR A 88 -7.833 -1.248 -8.954 1.00 22.14 C ATOM 1484 CG TYR A 88 -8.657 -1.042 -10.236 1.00 44.41 C ATOM 1485 CD1 TYR A 88 -9.500 -2.047 -10.721 1.00 22.41 C ATOM 1486 CD2 TYR A 88 -8.601 0.153 -10.957 1.00 1.24 C ATOM 1487 CE1 TYR A 88 -10.252 -1.871 -11.863 1.00 63.21 C ATOM 1488 CE2 TYR A 88 -9.354 0.332 -12.104 1.00 60.44 C ATOM 1489 CZ TYR A 88 -10.178 -0.681 -12.551 1.00 51.33 C ATOM 1490 OH TYR A 88 -10.935 -0.503 -13.693 1.00 33.24 O ATOM 0 H TYR A 88 -6.222 -3.320 -10.738 1.00 45.54 H new ATOM 0 HA TYR A 88 -5.912 -1.299 -9.872 1.00 22.02 H new ATOM 0 HB2 TYR A 88 -8.417 -1.845 -8.253 1.00 22.14 H new ATOM 0 HB3 TYR A 88 -7.665 -0.279 -8.485 1.00 22.14 H new ATOM 0 HD1 TYR A 88 -9.563 -2.984 -10.188 1.00 22.41 H new ATOM 0 HD2 TYR A 88 -7.959 0.951 -10.613 1.00 1.24 H new ATOM 0 HE1 TYR A 88 -10.896 -2.663 -12.216 1.00 63.21 H new ATOM 0 HE2 TYR A 88 -9.297 1.263 -12.649 1.00 60.44 H new ATOM 0 HH TYR A 88 -10.770 0.391 -14.059 1.00 33.24 H new ATOM 1500 N PRO A 89 -4.280 -2.264 -7.999 1.00 0.21 N ATOM 1501 CA PRO A 89 -3.392 -2.348 -6.830 1.00 3.33 C ATOM 1502 C PRO A 89 -3.035 -0.959 -6.279 1.00 32.13 C ATOM 1503 O PRO A 89 -3.104 0.052 -6.995 1.00 51.04 O ATOM 1504 CB PRO A 89 -2.146 -3.070 -7.396 1.00 44.22 C ATOM 1505 CG PRO A 89 -2.088 -2.669 -8.844 1.00 70.53 C ATOM 1506 CD PRO A 89 -3.527 -2.443 -9.283 1.00 12.53 C ATOM 0 HA PRO A 89 -3.848 -2.868 -5.987 1.00 3.33 H new ATOM 0 HB2 PRO A 89 -1.242 -2.770 -6.867 1.00 44.22 H new ATOM 0 HB3 PRO A 89 -2.234 -4.151 -7.289 1.00 44.22 H new ATOM 0 HG2 PRO A 89 -1.495 -1.763 -8.973 1.00 70.53 H new ATOM 0 HG3 PRO A 89 -1.616 -3.447 -9.444 1.00 70.53 H new ATOM 0 HD2 PRO A 89 -3.615 -1.564 -9.922 1.00 12.53 H new ATOM 0 HD3 PRO A 89 -3.907 -3.291 -9.853 1.00 12.53 H new ATOM 1514 N PHE A 90 -2.688 -0.915 -4.995 1.00 71.44 N ATOM 1515 CA PHE A 90 -2.072 0.253 -4.366 1.00 25.04 C ATOM 1516 C PHE A 90 -0.699 -0.121 -3.819 1.00 70.14 C ATOM 1517 O PHE A 90 -0.362 -1.303 -3.707 1.00 63.11 O ATOM 1518 CB PHE A 90 -2.982 0.835 -3.267 1.00 34.20 C ATOM 1519 CG PHE A 90 -3.340 -0.095 -2.102 1.00 65.21 C ATOM 1520 CD1 PHE A 90 -4.409 -0.992 -2.201 1.00 64.22 C ATOM 1521 CD2 PHE A 90 -2.625 -0.050 -0.896 1.00 64.55 C ATOM 1522 CE1 PHE A 90 -4.750 -1.806 -1.139 1.00 72.12 C ATOM 1523 CE2 PHE A 90 -2.967 -0.871 0.158 1.00 62.32 C ATOM 1524 CZ PHE A 90 -4.029 -1.744 0.039 1.00 30.12 C ATOM 0 H PHE A 90 -2.828 -1.697 -4.355 1.00 71.44 H new ATOM 0 HA PHE A 90 -1.942 1.032 -5.117 1.00 25.04 H new ATOM 0 HB2 PHE A 90 -2.496 1.721 -2.858 1.00 34.20 H new ATOM 0 HB3 PHE A 90 -3.909 1.167 -3.734 1.00 34.20 H new ATOM 0 HD1 PHE A 90 -4.975 -1.049 -3.119 1.00 64.22 H new ATOM 0 HD2 PHE A 90 -1.797 0.636 -0.792 1.00 64.55 H new ATOM 0 HE1 PHE A 90 -5.580 -2.491 -1.229 1.00 72.12 H new ATOM 0 HE2 PHE A 90 -2.403 -0.831 1.078 1.00 62.32 H new ATOM 0 HZ PHE A 90 -4.298 -2.381 0.869 1.00 30.12 H new ATOM 1534 N GLN A 91 0.089 0.898 -3.495 1.00 75.10 N ATOM 1535 CA GLN A 91 1.479 0.744 -3.063 1.00 3.33 C ATOM 1536 C GLN A 91 1.710 1.465 -1.739 1.00 55.24 C ATOM 1537 O GLN A 91 1.181 2.562 -1.504 1.00 31.21 O ATOM 1538 CB GLN A 91 2.433 1.269 -4.163 1.00 73.15 C ATOM 1539 CG GLN A 91 2.144 2.704 -4.665 1.00 52.50 C ATOM 1540 CD GLN A 91 3.026 3.119 -5.843 1.00 35.01 C ATOM 1541 OE1 GLN A 91 4.169 2.677 -5.964 1.00 32.13 O ATOM 1542 NE2 GLN A 91 2.506 3.961 -6.726 1.00 64.13 N ATOM 0 H GLN A 91 -0.221 1.869 -3.524 1.00 75.10 H new ATOM 0 HA GLN A 91 1.689 -0.314 -2.904 1.00 3.33 H new ATOM 0 HB2 GLN A 91 3.453 1.235 -3.781 1.00 73.15 H new ATOM 0 HB3 GLN A 91 2.388 0.589 -5.014 1.00 73.15 H new ATOM 0 HG2 GLN A 91 1.097 2.775 -4.961 1.00 52.50 H new ATOM 0 HG3 GLN A 91 2.291 3.406 -3.844 1.00 52.50 H new ATOM 0 HE21 GLN A 91 1.556 4.310 -6.599 1.00 64.13 H new ATOM 0 HE22 GLN A 91 3.056 4.259 -7.532 1.00 64.13 H new ATOM 1551 N VAL A 92 2.510 0.821 -0.880 1.00 1.33 N ATOM 1552 CA VAL A 92 2.885 1.321 0.436 1.00 11.45 C ATOM 1553 C VAL A 92 4.414 1.269 0.530 1.00 40.01 C ATOM 1554 O VAL A 92 4.993 0.192 0.721 1.00 14.52 O ATOM 1555 CB VAL A 92 2.239 0.460 1.598 1.00 32.22 C ATOM 1556 CG1 VAL A 92 2.670 0.984 2.990 1.00 41.40 C ATOM 1557 CG2 VAL A 92 0.695 0.410 1.476 1.00 1.14 C ATOM 0 H VAL A 92 2.922 -0.087 -1.093 1.00 1.33 H new ATOM 0 HA VAL A 92 2.517 2.340 0.556 1.00 11.45 H new ATOM 0 HB VAL A 92 2.611 -0.559 1.494 1.00 32.22 H new ATOM 0 HG11 VAL A 92 2.211 0.373 3.767 1.00 41.40 H new ATOM 0 HG12 VAL A 92 3.755 0.929 3.079 1.00 41.40 H new ATOM 0 HG13 VAL A 92 2.348 2.019 3.105 1.00 41.40 H new ATOM 0 HG21 VAL A 92 0.285 -0.189 2.289 1.00 1.14 H new ATOM 0 HG22 VAL A 92 0.293 1.421 1.532 1.00 1.14 H new ATOM 0 HG23 VAL A 92 0.420 -0.038 0.521 1.00 1.14 H new ATOM 1567 N VAL A 93 5.067 2.425 0.346 1.00 3.51 N ATOM 1568 CA VAL A 93 6.506 2.559 0.569 1.00 74.51 C ATOM 1569 C VAL A 93 6.729 2.607 2.080 1.00 63.43 C ATOM 1570 O VAL A 93 5.986 3.288 2.785 1.00 54.00 O ATOM 1571 CB VAL A 93 7.102 3.863 -0.093 1.00 31.40 C ATOM 1572 CG1 VAL A 93 8.640 3.930 0.076 1.00 63.45 C ATOM 1573 CG2 VAL A 93 6.701 3.978 -1.581 1.00 24.01 C ATOM 0 H VAL A 93 4.613 3.286 0.040 1.00 3.51 H new ATOM 0 HA VAL A 93 7.015 1.713 0.108 1.00 74.51 H new ATOM 0 HB VAL A 93 6.672 4.717 0.431 1.00 31.40 H new ATOM 0 HG11 VAL A 93 9.018 4.840 -0.391 1.00 63.45 H new ATOM 0 HG12 VAL A 93 8.890 3.936 1.137 1.00 63.45 H new ATOM 0 HG13 VAL A 93 9.096 3.062 -0.399 1.00 63.45 H new ATOM 0 HG21 VAL A 93 7.129 4.887 -2.004 1.00 24.01 H new ATOM 0 HG22 VAL A 93 7.076 3.112 -2.127 1.00 24.01 H new ATOM 0 HG23 VAL A 93 5.615 4.016 -1.663 1.00 24.01 H new ATOM 1583 N HIS A 94 7.719 1.870 2.569 1.00 73.00 N ATOM 1584 CA HIS A 94 8.079 1.865 3.996 1.00 25.14 C ATOM 1585 C HIS A 94 9.596 1.728 4.156 1.00 32.53 C ATOM 1586 O HIS A 94 10.322 1.685 3.156 1.00 34.11 O ATOM 1587 CB HIS A 94 7.284 0.771 4.778 1.00 21.31 C ATOM 1588 CG HIS A 94 7.497 -0.649 4.312 1.00 74.13 C ATOM 1589 ND1 HIS A 94 8.254 -1.564 5.012 1.00 33.21 N ATOM 1590 CD2 HIS A 94 7.027 -1.316 3.226 1.00 63.23 C ATOM 1591 CE1 HIS A 94 8.243 -2.717 4.378 1.00 44.14 C ATOM 1592 NE2 HIS A 94 7.511 -2.598 3.290 1.00 74.24 N ATOM 0 H HIS A 94 8.299 1.257 1.995 1.00 73.00 H new ATOM 0 HA HIS A 94 7.792 2.819 4.438 1.00 25.14 H new ATOM 0 HB2 HIS A 94 7.556 0.833 5.832 1.00 21.31 H new ATOM 0 HB3 HIS A 94 6.221 1.001 4.709 1.00 21.31 H new ATOM 0 HD1 HIS A 94 8.746 -1.376 5.886 1.00 33.21 H new ATOM 0 HD2 HIS A 94 6.389 -0.911 2.454 1.00 63.23 H new ATOM 0 HE1 HIS A 94 8.751 -3.615 4.698 1.00 44.14 H new ATOM 1601 N ASP A 95 10.037 1.661 5.426 1.00 44.22 N ATOM 1602 CA ASP A 95 11.455 1.643 5.854 1.00 35.52 C ATOM 1603 C ASP A 95 12.340 0.686 5.025 1.00 65.12 C ATOM 1604 O ASP A 95 13.484 1.009 4.709 1.00 25.30 O ATOM 1605 CB ASP A 95 11.523 1.246 7.359 1.00 4.41 C ATOM 1606 CG ASP A 95 11.016 -0.191 7.623 1.00 32.00 C ATOM 1607 OD1 ASP A 95 9.809 -0.447 7.407 1.00 33.05 O ATOM 1608 OD2 ASP A 95 11.819 -1.085 7.982 1.00 20.00 O ATOM 0 H ASP A 95 9.393 1.616 6.216 1.00 44.22 H new ATOM 0 HA ASP A 95 11.851 2.645 5.691 1.00 35.52 H new ATOM 0 HB2 ASP A 95 12.552 1.333 7.707 1.00 4.41 H new ATOM 0 HB3 ASP A 95 10.929 1.949 7.943 1.00 4.41 H new ATOM 1613 N ALA A 96 11.788 -0.490 4.685 1.00 0.35 N ATOM 1614 CA ALA A 96 12.518 -1.535 3.966 1.00 33.13 C ATOM 1615 C ALA A 96 12.454 -1.308 2.449 1.00 33.03 C ATOM 1616 O ALA A 96 13.471 -1.026 1.810 1.00 62.40 O ATOM 1617 CB ALA A 96 11.956 -2.912 4.351 1.00 21.01 C ATOM 0 H ALA A 96 10.823 -0.739 4.903 1.00 0.35 H new ATOM 0 HA ALA A 96 13.569 -1.495 4.252 1.00 33.13 H new ATOM 0 HB1 ALA A 96 12.500 -3.690 3.815 1.00 21.01 H new ATOM 0 HB2 ALA A 96 12.069 -3.064 5.424 1.00 21.01 H new ATOM 0 HB3 ALA A 96 10.900 -2.961 4.087 1.00 21.01 H new ATOM 1623 N ASN A 97 11.238 -1.392 1.887 1.00 4.00 N ATOM 1624 CA ASN A 97 11.025 -1.389 0.423 1.00 11.23 C ATOM 1625 C ASN A 97 9.646 -0.814 0.069 1.00 63.43 C ATOM 1626 O ASN A 97 8.872 -0.438 0.955 1.00 22.50 O ATOM 1627 CB ASN A 97 11.167 -2.834 -0.145 1.00 3.13 C ATOM 1628 CG ASN A 97 10.071 -3.806 0.334 1.00 75.32 C ATOM 1629 OD1 ASN A 97 9.514 -3.665 1.429 1.00 1.13 O ATOM 1630 ND2 ASN A 97 9.768 -4.815 -0.471 1.00 30.31 N ATOM 0 H ASN A 97 10.376 -1.464 2.428 1.00 4.00 H new ATOM 0 HA ASN A 97 11.786 -0.753 -0.030 1.00 11.23 H new ATOM 0 HB2 ASN A 97 11.148 -2.789 -1.234 1.00 3.13 H new ATOM 0 HB3 ASN A 97 12.141 -3.232 0.140 1.00 3.13 H new ATOM 0 HD21 ASN A 97 9.062 -5.496 -0.192 1.00 30.31 H new ATOM 0 HD22 ASN A 97 10.241 -4.910 -1.370 1.00 30.31 H new ATOM 1637 N THR A 98 9.358 -0.737 -1.237 1.00 11.53 N ATOM 1638 CA THR A 98 8.030 -0.384 -1.743 1.00 63.44 C ATOM 1639 C THR A 98 7.189 -1.669 -1.909 1.00 4.24 C ATOM 1640 O THR A 98 7.450 -2.480 -2.808 1.00 24.00 O ATOM 1641 CB THR A 98 8.133 0.386 -3.099 1.00 73.41 C ATOM 1642 OG1 THR A 98 9.038 1.495 -2.953 1.00 71.14 O ATOM 1643 CG2 THR A 98 6.761 0.907 -3.574 1.00 4.14 C ATOM 0 H THR A 98 10.042 -0.918 -1.971 1.00 11.53 H new ATOM 0 HA THR A 98 7.542 0.277 -1.026 1.00 63.44 H new ATOM 0 HB THR A 98 8.503 -0.313 -3.849 1.00 73.41 H new ATOM 0 HG1 THR A 98 9.104 1.977 -3.804 1.00 71.14 H new ATOM 0 HG21 THR A 98 6.880 1.436 -4.520 1.00 4.14 H new ATOM 0 HG22 THR A 98 6.080 0.067 -3.711 1.00 4.14 H new ATOM 0 HG23 THR A 98 6.352 1.587 -2.827 1.00 4.14 H new ATOM 1651 N LEU A 99 6.221 -1.860 -1.004 1.00 24.10 N ATOM 1652 CA LEU A 99 5.307 -3.017 -1.028 1.00 4.22 C ATOM 1653 C LEU A 99 4.138 -2.741 -1.997 1.00 1.04 C ATOM 1654 O LEU A 99 3.726 -1.592 -2.165 1.00 63.12 O ATOM 1655 CB LEU A 99 4.771 -3.320 0.400 1.00 71.32 C ATOM 1656 CG LEU A 99 3.871 -4.596 0.538 1.00 24.24 C ATOM 1657 CD1 LEU A 99 4.639 -5.876 0.145 1.00 24.12 C ATOM 1658 CD2 LEU A 99 3.278 -4.712 1.955 1.00 31.13 C ATOM 0 H LEU A 99 6.046 -1.217 -0.231 1.00 24.10 H new ATOM 0 HA LEU A 99 5.856 -3.892 -1.377 1.00 4.22 H new ATOM 0 HB2 LEU A 99 5.623 -3.426 1.072 1.00 71.32 H new ATOM 0 HB3 LEU A 99 4.200 -2.457 0.743 1.00 71.32 H new ATOM 0 HG LEU A 99 3.041 -4.487 -0.160 1.00 24.24 H new ATOM 0 HD11 LEU A 99 3.984 -6.741 0.253 1.00 24.12 H new ATOM 0 HD12 LEU A 99 4.970 -5.798 -0.891 1.00 24.12 H new ATOM 0 HD13 LEU A 99 5.506 -5.994 0.795 1.00 24.12 H new ATOM 0 HD21 LEU A 99 2.659 -5.607 2.018 1.00 31.13 H new ATOM 0 HD22 LEU A 99 4.086 -4.778 2.683 1.00 31.13 H new ATOM 0 HD23 LEU A 99 2.669 -3.834 2.167 1.00 31.13 H new ATOM 1670 N TYR A 100 3.623 -3.806 -2.643 1.00 14.43 N ATOM 1671 CA TYR A 100 2.520 -3.716 -3.624 1.00 31.11 C ATOM 1672 C TYR A 100 1.402 -4.668 -3.227 1.00 54.53 C ATOM 1673 O TYR A 100 1.622 -5.874 -3.114 1.00 13.14 O ATOM 1674 CB TYR A 100 3.040 -4.018 -5.055 1.00 2.12 C ATOM 1675 CG TYR A 100 3.890 -2.867 -5.592 1.00 43.14 C ATOM 1676 CD1 TYR A 100 3.281 -1.761 -6.181 1.00 3.11 C ATOM 1677 CD2 TYR A 100 5.275 -2.845 -5.452 1.00 22.42 C ATOM 1678 CE1 TYR A 100 4.017 -0.681 -6.606 1.00 63.42 C ATOM 1679 CE2 TYR A 100 6.014 -1.769 -5.886 1.00 31.42 C ATOM 1680 CZ TYR A 100 5.376 -0.687 -6.458 1.00 61.54 C ATOM 1681 OH TYR A 100 6.106 0.411 -6.845 1.00 41.21 O ATOM 0 H TYR A 100 3.961 -4.758 -2.499 1.00 14.43 H new ATOM 0 HA TYR A 100 2.122 -2.701 -3.627 1.00 31.11 H new ATOM 0 HB2 TYR A 100 3.630 -4.934 -5.044 1.00 2.12 H new ATOM 0 HB3 TYR A 100 2.195 -4.191 -5.722 1.00 2.12 H new ATOM 0 HD1 TYR A 100 2.208 -1.752 -6.306 1.00 3.11 H new ATOM 0 HD2 TYR A 100 5.777 -3.685 -4.996 1.00 22.42 H new ATOM 0 HE1 TYR A 100 3.524 0.169 -7.055 1.00 63.42 H new ATOM 0 HE2 TYR A 100 7.089 -1.771 -5.780 1.00 31.42 H new ATOM 0 HH TYR A 100 5.795 0.718 -7.722 1.00 41.21 H new ATOM 1691 N ILE A 101 0.207 -4.100 -2.999 1.00 23.52 N ATOM 1692 CA ILE A 101 -0.969 -4.821 -2.509 1.00 20.40 C ATOM 1693 C ILE A 101 -2.151 -4.650 -3.495 1.00 74.21 C ATOM 1694 O ILE A 101 -2.630 -3.536 -3.701 1.00 55.33 O ATOM 1695 CB ILE A 101 -1.388 -4.309 -1.074 1.00 5.32 C ATOM 1696 CG1 ILE A 101 -0.196 -4.403 -0.062 1.00 44.13 C ATOM 1697 CG2 ILE A 101 -2.611 -5.091 -0.551 1.00 74.25 C ATOM 1698 CD1 ILE A 101 -0.498 -3.876 1.337 1.00 12.03 C ATOM 0 H ILE A 101 0.032 -3.107 -3.154 1.00 23.52 H new ATOM 0 HA ILE A 101 -0.712 -5.878 -2.437 1.00 20.40 H new ATOM 0 HB ILE A 101 -1.663 -3.258 -1.165 1.00 5.32 H new ATOM 0 HG12 ILE A 101 0.113 -5.445 0.017 1.00 44.13 H new ATOM 0 HG13 ILE A 101 0.651 -3.849 -0.468 1.00 44.13 H new ATOM 0 HG21 ILE A 101 -2.883 -4.723 0.438 1.00 74.25 H new ATOM 0 HG22 ILE A 101 -3.450 -4.953 -1.233 1.00 74.25 H new ATOM 0 HG23 ILE A 101 -2.365 -6.151 -0.488 1.00 74.25 H new ATOM 0 HD11 ILE A 101 0.386 -3.983 1.965 1.00 12.03 H new ATOM 0 HD12 ILE A 101 -0.775 -2.824 1.277 1.00 12.03 H new ATOM 0 HD13 ILE A 101 -1.321 -4.444 1.770 1.00 12.03 H new ATOM 1710 N PHE A 102 -2.599 -5.767 -4.097 1.00 34.45 N ATOM 1711 CA PHE A 102 -3.743 -5.804 -5.024 1.00 22.24 C ATOM 1712 C PHE A 102 -5.054 -5.909 -4.232 1.00 63.24 C ATOM 1713 O PHE A 102 -5.205 -6.789 -3.379 1.00 42.23 O ATOM 1714 CB PHE A 102 -3.605 -7.002 -6.008 1.00 62.41 C ATOM 1715 CG PHE A 102 -2.365 -6.934 -6.910 1.00 20.01 C ATOM 1716 CD1 PHE A 102 -1.081 -7.143 -6.389 1.00 75.21 C ATOM 1717 CD2 PHE A 102 -2.476 -6.642 -8.273 1.00 55.24 C ATOM 1718 CE1 PHE A 102 0.036 -7.063 -7.197 1.00 20.44 C ATOM 1719 CE2 PHE A 102 -1.351 -6.565 -9.077 1.00 3.30 C ATOM 1720 CZ PHE A 102 -0.098 -6.775 -8.541 1.00 72.00 C ATOM 0 H PHE A 102 -2.170 -6.681 -3.951 1.00 34.45 H new ATOM 0 HA PHE A 102 -3.756 -4.882 -5.606 1.00 22.24 H new ATOM 0 HB2 PHE A 102 -3.573 -7.928 -5.434 1.00 62.41 H new ATOM 0 HB3 PHE A 102 -4.495 -7.047 -6.635 1.00 62.41 H new ATOM 0 HD1 PHE A 102 -0.963 -7.370 -5.340 1.00 75.21 H new ATOM 0 HD2 PHE A 102 -3.452 -6.474 -8.704 1.00 55.24 H new ATOM 0 HE1 PHE A 102 1.017 -7.226 -6.777 1.00 20.44 H new ATOM 0 HE2 PHE A 102 -1.455 -6.340 -10.128 1.00 3.30 H new ATOM 0 HZ PHE A 102 0.777 -6.714 -9.171 1.00 72.00 H new ATOM 1730 N ALA A 103 -5.988 -5.001 -4.522 1.00 71.21 N ATOM 1731 CA ALA A 103 -7.312 -4.978 -3.884 1.00 70.30 C ATOM 1732 C ALA A 103 -8.315 -5.808 -4.714 1.00 4.23 C ATOM 1733 O ALA A 103 -8.178 -5.857 -5.940 1.00 12.21 O ATOM 1734 CB ALA A 103 -7.782 -3.526 -3.733 1.00 43.33 C ATOM 0 H ALA A 103 -5.850 -4.258 -5.207 1.00 71.21 H new ATOM 0 HA ALA A 103 -7.249 -5.425 -2.892 1.00 70.30 H new ATOM 0 HB1 ALA A 103 -8.764 -3.509 -3.260 1.00 43.33 H new ATOM 0 HB2 ALA A 103 -7.072 -2.976 -3.115 1.00 43.33 H new ATOM 0 HB3 ALA A 103 -7.845 -3.060 -4.716 1.00 43.33 H new ATOM 1740 N PRO A 104 -9.324 -6.493 -4.067 1.00 35.14 N ATOM 1741 CA PRO A 104 -10.388 -7.236 -4.801 1.00 51.13 C ATOM 1742 C PRO A 104 -11.136 -6.338 -5.790 1.00 3.14 C ATOM 1743 O PRO A 104 -11.360 -6.705 -6.945 1.00 50.12 O ATOM 1744 CB PRO A 104 -11.329 -7.744 -3.678 1.00 75.44 C ATOM 1745 CG PRO A 104 -10.456 -7.789 -2.458 1.00 44.25 C ATOM 1746 CD PRO A 104 -9.493 -6.626 -2.592 1.00 21.10 C ATOM 0 HA PRO A 104 -9.981 -8.044 -5.409 1.00 51.13 H new ATOM 0 HB2 PRO A 104 -12.177 -7.074 -3.536 1.00 75.44 H new ATOM 0 HB3 PRO A 104 -11.735 -8.728 -3.913 1.00 75.44 H new ATOM 0 HG2 PRO A 104 -11.051 -7.701 -1.549 1.00 44.25 H new ATOM 0 HG3 PRO A 104 -9.919 -8.736 -2.397 1.00 44.25 H new ATOM 0 HD2 PRO A 104 -9.897 -5.716 -2.149 1.00 21.10 H new ATOM 0 HD3 PRO A 104 -8.545 -6.829 -2.095 1.00 21.10 H new ATOM 1754 N SER A 105 -11.473 -5.134 -5.313 1.00 62.45 N ATOM 1755 CA SER A 105 -12.231 -4.138 -6.075 1.00 60.25 C ATOM 1756 C SER A 105 -11.503 -2.773 -6.052 1.00 70.14 C ATOM 1757 O SER A 105 -10.740 -2.493 -5.113 1.00 54.12 O ATOM 1758 CB SER A 105 -13.647 -4.012 -5.459 1.00 74.31 C ATOM 1759 OG SER A 105 -14.302 -5.265 -5.415 1.00 62.30 O ATOM 0 H SER A 105 -11.223 -4.821 -4.375 1.00 62.45 H new ATOM 0 HA SER A 105 -12.313 -4.455 -7.115 1.00 60.25 H new ATOM 0 HB2 SER A 105 -13.572 -3.603 -4.452 1.00 74.31 H new ATOM 0 HB3 SER A 105 -14.240 -3.310 -6.045 1.00 74.31 H new ATOM 0 HG SER A 105 -15.192 -5.155 -5.020 1.00 62.30 H new ATOM 1765 N PRO A 106 -11.757 -1.874 -7.069 1.00 23.44 N ATOM 1766 CA PRO A 106 -11.317 -0.444 -7.022 1.00 13.41 C ATOM 1767 C PRO A 106 -11.995 0.357 -5.885 1.00 32.21 C ATOM 1768 O PRO A 106 -11.582 1.481 -5.592 1.00 41.30 O ATOM 1769 CB PRO A 106 -11.721 0.108 -8.419 1.00 70.34 C ATOM 1770 CG PRO A 106 -12.803 -0.817 -8.897 1.00 64.43 C ATOM 1771 CD PRO A 106 -12.438 -2.186 -8.361 1.00 54.05 C ATOM 0 HA PRO A 106 -10.251 -0.355 -6.813 1.00 13.41 H new ATOM 0 HB2 PRO A 106 -12.080 1.135 -8.350 1.00 70.34 H new ATOM 0 HB3 PRO A 106 -10.873 0.112 -9.103 1.00 70.34 H new ATOM 0 HG2 PRO A 106 -13.779 -0.500 -8.530 1.00 64.43 H new ATOM 0 HG3 PRO A 106 -12.859 -0.825 -9.986 1.00 64.43 H new ATOM 0 HD2 PRO A 106 -13.320 -2.809 -8.212 1.00 54.05 H new ATOM 0 HD3 PRO A 106 -11.780 -2.724 -9.044 1.00 54.05 H new ATOM 1779 N GLN A 107 -13.009 -0.264 -5.237 1.00 31.13 N ATOM 1780 CA GLN A 107 -13.723 0.311 -4.084 1.00 3.41 C ATOM 1781 C GLN A 107 -12.822 0.174 -2.854 1.00 33.40 C ATOM 1782 O GLN A 107 -12.615 1.129 -2.094 1.00 5.42 O ATOM 1783 CB GLN A 107 -15.060 -0.437 -3.825 1.00 51.30 C ATOM 1784 CG GLN A 107 -15.954 -0.632 -5.061 1.00 24.42 C ATOM 1785 CD GLN A 107 -17.277 -1.353 -4.745 1.00 52.43 C ATOM 1786 OE1 GLN A 107 -17.846 -1.198 -3.660 1.00 75.33 O ATOM 1787 NE2 GLN A 107 -17.748 -2.181 -5.667 1.00 21.33 N ATOM 0 H GLN A 107 -13.353 -1.186 -5.506 1.00 31.13 H new ATOM 0 HA GLN A 107 -13.954 1.356 -4.288 1.00 3.41 H new ATOM 0 HB2 GLN A 107 -14.834 -1.416 -3.403 1.00 51.30 H new ATOM 0 HB3 GLN A 107 -15.625 0.112 -3.072 1.00 51.30 H new ATOM 0 HG2 GLN A 107 -16.174 0.341 -5.499 1.00 24.42 H new ATOM 0 HG3 GLN A 107 -15.407 -1.203 -5.811 1.00 24.42 H new ATOM 0 HE21 GLN A 107 -17.257 -2.289 -6.554 1.00 21.33 H new ATOM 0 HE22 GLN A 107 -18.602 -2.710 -5.489 1.00 21.33 H new ATOM 1796 N SER A 108 -12.281 -1.061 -2.710 1.00 75.14 N ATOM 1797 CA SER A 108 -11.357 -1.432 -1.648 1.00 65.42 C ATOM 1798 C SER A 108 -10.087 -0.582 -1.744 1.00 24.53 C ATOM 1799 O SER A 108 -9.729 0.082 -0.781 1.00 63.01 O ATOM 1800 CB SER A 108 -11.009 -2.934 -1.755 1.00 2.42 C ATOM 1801 OG SER A 108 -12.176 -3.739 -1.805 1.00 53.55 O ATOM 0 H SER A 108 -12.488 -1.829 -3.348 1.00 75.14 H new ATOM 0 HA SER A 108 -11.828 -1.250 -0.682 1.00 65.42 H new ATOM 0 HB2 SER A 108 -10.409 -3.106 -2.649 1.00 2.42 H new ATOM 0 HB3 SER A 108 -10.400 -3.229 -0.901 1.00 2.42 H new ATOM 0 HG SER A 108 -12.274 -4.226 -0.960 1.00 53.55 H new ATOM 1807 N ARG A 109 -9.454 -0.580 -2.945 1.00 4.41 N ATOM 1808 CA ARG A 109 -8.238 0.215 -3.221 1.00 75.42 C ATOM 1809 C ARG A 109 -8.422 1.687 -2.821 1.00 70.11 C ATOM 1810 O ARG A 109 -7.592 2.236 -2.114 1.00 42.32 O ATOM 1811 CB ARG A 109 -7.869 0.165 -4.723 1.00 2.31 C ATOM 1812 CG ARG A 109 -6.562 0.933 -5.078 1.00 30.12 C ATOM 1813 CD ARG A 109 -6.473 1.310 -6.563 1.00 22.32 C ATOM 1814 NE ARG A 109 -7.563 2.225 -6.959 1.00 24.14 N ATOM 1815 CZ ARG A 109 -7.695 2.798 -8.169 1.00 73.22 C ATOM 1816 NH1 ARG A 109 -6.810 2.569 -9.138 1.00 15.24 N ATOM 1817 NH2 ARG A 109 -8.714 3.609 -8.400 1.00 52.22 N ATOM 0 H ARG A 109 -9.774 -1.128 -3.744 1.00 4.41 H new ATOM 0 HA ARG A 109 -7.438 -0.226 -2.626 1.00 75.42 H new ATOM 0 HB2 ARG A 109 -7.760 -0.876 -5.026 1.00 2.31 H new ATOM 0 HB3 ARG A 109 -8.692 0.581 -5.303 1.00 2.31 H new ATOM 0 HG2 ARG A 109 -6.504 1.839 -4.475 1.00 30.12 H new ATOM 0 HG3 ARG A 109 -5.702 0.318 -4.813 1.00 30.12 H new ATOM 0 HD2 ARG A 109 -5.511 1.782 -6.762 1.00 22.32 H new ATOM 0 HD3 ARG A 109 -6.517 0.407 -7.171 1.00 22.32 H new ATOM 0 HE ARG A 109 -8.273 2.440 -6.259 1.00 24.14 H new ATOM 0 HH11 ARG A 109 -6.017 1.951 -8.968 1.00 15.24 H new ATOM 0 HH12 ARG A 109 -6.926 3.012 -10.049 1.00 15.24 H new ATOM 0 HH21 ARG A 109 -9.394 3.797 -7.663 1.00 52.22 H new ATOM 0 HH22 ARG A 109 -8.820 4.047 -9.315 1.00 52.22 H new ATOM 1831 N ASP A 110 -9.544 2.276 -3.272 1.00 74.52 N ATOM 1832 CA ASP A 110 -9.857 3.698 -3.059 1.00 11.13 C ATOM 1833 C ASP A 110 -9.860 4.050 -1.570 1.00 50.31 C ATOM 1834 O ASP A 110 -9.185 4.992 -1.158 1.00 34.40 O ATOM 1835 CB ASP A 110 -11.222 4.054 -3.697 1.00 53.31 C ATOM 1836 CG ASP A 110 -11.674 5.501 -3.401 1.00 62.42 C ATOM 1837 OD1 ASP A 110 -11.020 6.441 -3.897 1.00 0.03 O ATOM 1838 OD2 ASP A 110 -12.685 5.701 -2.680 1.00 1.30 O ATOM 0 H ASP A 110 -10.261 1.776 -3.797 1.00 74.52 H new ATOM 0 HA ASP A 110 -9.077 4.286 -3.543 1.00 11.13 H new ATOM 0 HB2 ASP A 110 -11.159 3.914 -4.776 1.00 53.31 H new ATOM 0 HB3 ASP A 110 -11.979 3.361 -3.329 1.00 53.31 H new ATOM 1843 N LEU A 111 -10.598 3.247 -0.788 1.00 73.54 N ATOM 1844 CA LEU A 111 -10.787 3.477 0.646 1.00 73.52 C ATOM 1845 C LEU A 111 -9.482 3.198 1.432 1.00 40.03 C ATOM 1846 O LEU A 111 -9.182 3.912 2.382 1.00 72.31 O ATOM 1847 CB LEU A 111 -11.965 2.605 1.161 1.00 1.51 C ATOM 1848 CG LEU A 111 -12.434 2.861 2.632 1.00 54.25 C ATOM 1849 CD1 LEU A 111 -12.841 4.332 2.856 1.00 12.35 C ATOM 1850 CD2 LEU A 111 -13.577 1.898 3.017 1.00 13.12 C ATOM 0 H LEU A 111 -11.080 2.419 -1.137 1.00 73.54 H new ATOM 0 HA LEU A 111 -11.036 4.526 0.809 1.00 73.52 H new ATOM 0 HB2 LEU A 111 -12.818 2.759 0.500 1.00 1.51 H new ATOM 0 HB3 LEU A 111 -11.678 1.557 1.072 1.00 1.51 H new ATOM 0 HG LEU A 111 -11.586 2.661 3.288 1.00 54.25 H new ATOM 0 HD11 LEU A 111 -13.160 4.468 3.889 1.00 12.35 H new ATOM 0 HD12 LEU A 111 -11.989 4.980 2.651 1.00 12.35 H new ATOM 0 HD13 LEU A 111 -13.662 4.589 2.186 1.00 12.35 H new ATOM 0 HD21 LEU A 111 -13.887 2.094 4.043 1.00 13.12 H new ATOM 0 HD22 LEU A 111 -14.423 2.051 2.347 1.00 13.12 H new ATOM 0 HD23 LEU A 111 -13.229 0.868 2.933 1.00 13.12 H new ATOM 1862 N TRP A 112 -8.717 2.168 1.012 1.00 53.13 N ATOM 1863 CA TRP A 112 -7.421 1.810 1.641 1.00 53.41 C ATOM 1864 C TRP A 112 -6.357 2.904 1.452 1.00 13.32 C ATOM 1865 O TRP A 112 -5.789 3.359 2.443 1.00 62.32 O ATOM 1866 CB TRP A 112 -6.904 0.430 1.134 1.00 74.40 C ATOM 1867 CG TRP A 112 -7.488 -0.728 1.909 1.00 11.44 C ATOM 1868 CD1 TRP A 112 -8.618 -1.432 1.627 1.00 70.21 C ATOM 1869 CD2 TRP A 112 -6.968 -1.285 3.127 1.00 42.32 C ATOM 1870 NE1 TRP A 112 -8.849 -2.359 2.598 1.00 21.21 N ATOM 1871 CE2 TRP A 112 -7.843 -2.308 3.521 1.00 42.40 C ATOM 1872 CE3 TRP A 112 -5.848 -1.016 3.918 1.00 52.13 C ATOM 1873 CZ2 TRP A 112 -7.638 -3.069 4.671 1.00 72.23 C ATOM 1874 CZ3 TRP A 112 -5.641 -1.772 5.054 1.00 4.04 C ATOM 1875 CH2 TRP A 112 -6.532 -2.791 5.422 1.00 70.31 C ATOM 0 H TRP A 112 -8.975 1.563 0.233 1.00 53.13 H new ATOM 0 HA TRP A 112 -7.606 1.728 2.712 1.00 53.41 H new ATOM 0 HB2 TRP A 112 -7.152 0.318 0.079 1.00 74.40 H new ATOM 0 HB3 TRP A 112 -5.817 0.403 1.211 1.00 74.40 H new ATOM 0 HD1 TRP A 112 -9.242 -1.278 0.759 1.00 70.21 H new ATOM 0 HE1 TRP A 112 -9.648 -2.992 2.631 1.00 21.21 H new ATOM 0 HE3 TRP A 112 -5.158 -0.231 3.646 1.00 52.13 H new ATOM 0 HZ2 TRP A 112 -8.328 -3.849 4.957 1.00 72.23 H new ATOM 0 HZ3 TRP A 112 -4.777 -1.575 5.671 1.00 4.04 H new ATOM 0 HH2 TRP A 112 -6.340 -3.366 6.316 1.00 70.31 H new ATOM 1886 N VAL A 113 -6.110 3.319 0.185 1.00 20.01 N ATOM 1887 CA VAL A 113 -5.161 4.415 -0.141 1.00 11.45 C ATOM 1888 C VAL A 113 -5.501 5.663 0.675 1.00 33.21 C ATOM 1889 O VAL A 113 -4.637 6.244 1.323 1.00 63.21 O ATOM 1890 CB VAL A 113 -5.185 4.783 -1.676 1.00 34.20 C ATOM 1891 CG1 VAL A 113 -4.261 5.984 -2.006 1.00 54.34 C ATOM 1892 CG2 VAL A 113 -4.804 3.575 -2.536 1.00 53.15 C ATOM 0 H VAL A 113 -6.558 2.908 -0.634 1.00 20.01 H new ATOM 0 HA VAL A 113 -4.161 4.060 0.109 1.00 11.45 H new ATOM 0 HB VAL A 113 -6.208 5.078 -1.911 1.00 34.20 H new ATOM 0 HG11 VAL A 113 -4.311 6.199 -3.073 1.00 54.34 H new ATOM 0 HG12 VAL A 113 -4.587 6.859 -1.444 1.00 54.34 H new ATOM 0 HG13 VAL A 113 -3.234 5.739 -1.733 1.00 54.34 H new ATOM 0 HG21 VAL A 113 -4.828 3.856 -3.589 1.00 53.15 H new ATOM 0 HG22 VAL A 113 -3.800 3.243 -2.272 1.00 53.15 H new ATOM 0 HG23 VAL A 113 -5.512 2.765 -2.360 1.00 53.15 H new ATOM 1902 N LYS A 114 -6.798 5.986 0.664 1.00 3.21 N ATOM 1903 CA LYS A 114 -7.385 7.132 1.354 1.00 32.45 C ATOM 1904 C LYS A 114 -7.046 7.123 2.851 1.00 33.22 C ATOM 1905 O LYS A 114 -6.388 8.035 3.332 1.00 14.21 O ATOM 1906 CB LYS A 114 -8.907 7.080 1.138 1.00 4.34 C ATOM 1907 CG LYS A 114 -9.704 8.301 1.620 1.00 32.11 C ATOM 1908 CD LYS A 114 -11.212 8.159 1.303 1.00 41.44 C ATOM 1909 CE LYS A 114 -11.479 7.832 -0.179 1.00 21.31 C ATOM 1910 NZ LYS A 114 -12.918 7.856 -0.528 1.00 24.34 N ATOM 0 H LYS A 114 -7.490 5.435 0.156 1.00 3.21 H new ATOM 0 HA LYS A 114 -6.974 8.056 0.948 1.00 32.45 H new ATOM 0 HB2 LYS A 114 -9.097 6.946 0.073 1.00 4.34 H new ATOM 0 HB3 LYS A 114 -9.295 6.196 1.645 1.00 4.34 H new ATOM 0 HG2 LYS A 114 -9.568 8.424 2.694 1.00 32.11 H new ATOM 0 HG3 LYS A 114 -9.315 9.201 1.144 1.00 32.11 H new ATOM 0 HD2 LYS A 114 -11.638 7.373 1.927 1.00 41.44 H new ATOM 0 HD3 LYS A 114 -11.723 9.086 1.564 1.00 41.44 H new ATOM 0 HE2 LYS A 114 -10.947 8.549 -0.805 1.00 21.31 H new ATOM 0 HE3 LYS A 114 -11.072 6.847 -0.407 1.00 21.31 H new ATOM 0 HZ1 LYS A 114 -13.105 7.160 -1.277 1.00 24.34 H new ATOM 0 HZ2 LYS A 114 -13.483 7.620 0.313 1.00 24.34 H new ATOM 0 HZ3 LYS A 114 -13.178 8.805 -0.865 1.00 24.34 H new ATOM 1924 N LYS A 115 -7.454 6.040 3.546 1.00 20.22 N ATOM 1925 CA LYS A 115 -7.290 5.909 5.004 1.00 23.13 C ATOM 1926 C LYS A 115 -5.812 5.859 5.425 1.00 25.20 C ATOM 1927 O LYS A 115 -5.453 6.408 6.470 1.00 53.14 O ATOM 1928 CB LYS A 115 -8.063 4.668 5.535 1.00 73.02 C ATOM 1929 CG LYS A 115 -9.603 4.786 5.399 1.00 61.14 C ATOM 1930 CD LYS A 115 -10.163 6.052 6.099 1.00 72.21 C ATOM 1931 CE LYS A 115 -11.626 6.351 5.749 1.00 33.13 C ATOM 1932 NZ LYS A 115 -12.049 7.674 6.285 1.00 70.51 N ATOM 0 H LYS A 115 -7.905 5.235 3.111 1.00 20.22 H new ATOM 0 HA LYS A 115 -7.716 6.804 5.456 1.00 23.13 H new ATOM 0 HB2 LYS A 115 -7.726 3.783 4.995 1.00 73.02 H new ATOM 0 HB3 LYS A 115 -7.811 4.516 6.584 1.00 73.02 H new ATOM 0 HG2 LYS A 115 -9.871 4.810 4.343 1.00 61.14 H new ATOM 0 HG3 LYS A 115 -10.072 3.900 5.827 1.00 61.14 H new ATOM 0 HD2 LYS A 115 -10.074 5.929 7.178 1.00 72.21 H new ATOM 0 HD3 LYS A 115 -9.550 6.910 5.824 1.00 72.21 H new ATOM 0 HE2 LYS A 115 -11.754 6.337 4.667 1.00 33.13 H new ATOM 0 HE3 LYS A 115 -12.267 5.569 6.156 1.00 33.13 H new ATOM 0 HZ1 LYS A 115 -13.008 7.895 5.948 1.00 70.51 H new ATOM 0 HZ2 LYS A 115 -12.046 7.645 7.325 1.00 70.51 H new ATOM 0 HZ3 LYS A 115 -11.389 8.408 5.958 1.00 70.51 H new ATOM 1946 N LEU A 116 -4.967 5.223 4.599 1.00 74.52 N ATOM 1947 CA LEU A 116 -3.515 5.161 4.837 1.00 54.44 C ATOM 1948 C LEU A 116 -2.897 6.575 4.767 1.00 73.20 C ATOM 1949 O LEU A 116 -2.155 6.952 5.665 1.00 73.31 O ATOM 1950 CB LEU A 116 -2.845 4.205 3.820 1.00 1.42 C ATOM 1951 CG LEU A 116 -3.122 2.675 4.020 1.00 64.35 C ATOM 1952 CD1 LEU A 116 -2.685 1.852 2.789 1.00 30.23 C ATOM 1953 CD2 LEU A 116 -2.439 2.150 5.298 1.00 21.14 C ATOM 0 H LEU A 116 -5.267 4.740 3.752 1.00 74.52 H new ATOM 0 HA LEU A 116 -3.338 4.767 5.838 1.00 54.44 H new ATOM 0 HB2 LEU A 116 -3.174 4.485 2.819 1.00 1.42 H new ATOM 0 HB3 LEU A 116 -1.768 4.366 3.858 1.00 1.42 H new ATOM 0 HG LEU A 116 -4.199 2.553 4.134 1.00 64.35 H new ATOM 0 HD11 LEU A 116 -2.893 0.796 2.965 1.00 30.23 H new ATOM 0 HD12 LEU A 116 -3.237 2.189 1.911 1.00 30.23 H new ATOM 0 HD13 LEU A 116 -1.617 1.989 2.621 1.00 30.23 H new ATOM 0 HD21 LEU A 116 -2.648 1.086 5.412 1.00 21.14 H new ATOM 0 HD22 LEU A 116 -1.362 2.302 5.224 1.00 21.14 H new ATOM 0 HD23 LEU A 116 -2.823 2.690 6.164 1.00 21.14 H new ATOM 1965 N LYS A 117 -3.227 7.339 3.698 1.00 15.02 N ATOM 1966 CA LYS A 117 -2.841 8.770 3.555 1.00 45.50 C ATOM 1967 C LYS A 117 -3.311 9.617 4.757 1.00 3.21 C ATOM 1968 O LYS A 117 -2.551 10.449 5.269 1.00 31.01 O ATOM 1969 CB LYS A 117 -3.406 9.371 2.241 1.00 2.10 C ATOM 1970 CG LYS A 117 -2.825 8.746 0.952 1.00 40.31 C ATOM 1971 CD LYS A 117 -3.531 9.260 -0.324 1.00 0.22 C ATOM 1972 CE LYS A 117 -3.324 10.761 -0.558 1.00 44.24 C ATOM 1973 NZ LYS A 117 -1.895 11.083 -0.789 1.00 13.34 N ATOM 0 H LYS A 117 -3.768 6.984 2.909 1.00 15.02 H new ATOM 0 HA LYS A 117 -1.752 8.799 3.522 1.00 45.50 H new ATOM 0 HB2 LYS A 117 -4.489 9.246 2.235 1.00 2.10 H new ATOM 0 HB3 LYS A 117 -3.209 10.443 2.232 1.00 2.10 H new ATOM 0 HG2 LYS A 117 -1.760 8.971 0.890 1.00 40.31 H new ATOM 0 HG3 LYS A 117 -2.919 7.661 1.004 1.00 40.31 H new ATOM 0 HD2 LYS A 117 -3.158 8.708 -1.187 1.00 0.22 H new ATOM 0 HD3 LYS A 117 -4.599 9.053 -0.251 1.00 0.22 H new ATOM 0 HE2 LYS A 117 -3.914 11.081 -1.417 1.00 44.24 H new ATOM 0 HE3 LYS A 117 -3.689 11.319 0.305 1.00 44.24 H new ATOM 0 HZ1 LYS A 117 -1.806 12.078 -1.077 1.00 13.34 H new ATOM 0 HZ2 LYS A 117 -1.358 10.926 0.088 1.00 13.34 H new ATOM 0 HZ3 LYS A 117 -1.518 10.470 -1.540 1.00 13.34 H new ATOM 1987 N GLU A 118 -4.569 9.382 5.190 1.00 1.22 N ATOM 1988 CA GLU A 118 -5.180 10.071 6.349 1.00 61.33 C ATOM 1989 C GLU A 118 -4.437 9.766 7.664 1.00 34.25 C ATOM 1990 O GLU A 118 -4.537 10.529 8.620 1.00 21.10 O ATOM 1991 CB GLU A 118 -6.689 9.703 6.492 1.00 10.41 C ATOM 1992 CG GLU A 118 -7.576 10.195 5.335 1.00 73.32 C ATOM 1993 CD GLU A 118 -9.075 9.995 5.589 1.00 62.41 C ATOM 1994 OE1 GLU A 118 -9.634 10.715 6.440 1.00 22.44 O ATOM 1995 OE2 GLU A 118 -9.710 9.141 4.938 1.00 63.42 O ATOM 0 H GLU A 118 -5.191 8.707 4.745 1.00 1.22 H new ATOM 0 HA GLU A 118 -5.094 11.140 6.156 1.00 61.33 H new ATOM 0 HB2 GLU A 118 -6.780 8.620 6.568 1.00 10.41 H new ATOM 0 HB3 GLU A 118 -7.066 10.121 7.425 1.00 10.41 H new ATOM 0 HG2 GLU A 118 -7.382 11.254 5.163 1.00 73.32 H new ATOM 0 HG3 GLU A 118 -7.296 9.668 4.423 1.00 73.32 H new ATOM 2002 N GLU A 119 -3.721 8.639 7.719 1.00 52.21 N ATOM 2003 CA GLU A 119 -2.901 8.272 8.884 1.00 25.42 C ATOM 2004 C GLU A 119 -1.482 8.837 8.776 1.00 23.32 C ATOM 2005 O GLU A 119 -0.976 9.467 9.716 1.00 12.54 O ATOM 2006 CB GLU A 119 -2.882 6.735 9.061 1.00 54.40 C ATOM 2007 CG GLU A 119 -4.251 6.148 9.438 1.00 1.45 C ATOM 2008 CD GLU A 119 -4.886 6.841 10.661 1.00 63.42 C ATOM 2009 OE1 GLU A 119 -4.390 6.639 11.780 1.00 23.43 O ATOM 2010 OE2 GLU A 119 -5.869 7.599 10.510 1.00 54.20 O ATOM 0 H GLU A 119 -3.691 7.956 6.962 1.00 52.21 H new ATOM 0 HA GLU A 119 -3.353 8.716 9.771 1.00 25.42 H new ATOM 0 HB2 GLU A 119 -2.540 6.274 8.134 1.00 54.40 H new ATOM 0 HB3 GLU A 119 -2.158 6.474 9.833 1.00 54.40 H new ATOM 0 HG2 GLU A 119 -4.925 6.236 8.586 1.00 1.45 H new ATOM 0 HG3 GLU A 119 -4.139 5.084 9.647 1.00 1.45 H new ATOM 2017 N ILE A 120 -0.856 8.650 7.609 1.00 3.34 N ATOM 2018 CA ILE A 120 0.567 8.964 7.414 1.00 61.24 C ATOM 2019 C ILE A 120 0.804 10.468 7.202 1.00 13.40 C ATOM 2020 O ILE A 120 1.952 10.906 7.150 1.00 64.53 O ATOM 2021 CB ILE A 120 1.181 8.143 6.218 1.00 23.31 C ATOM 2022 CG1 ILE A 120 0.612 8.612 4.838 1.00 50.41 C ATOM 2023 CG2 ILE A 120 0.957 6.627 6.430 1.00 5.12 C ATOM 2024 CD1 ILE A 120 1.232 7.937 3.617 1.00 30.43 C ATOM 0 H ILE A 120 -1.316 8.279 6.777 1.00 3.34 H new ATOM 0 HA ILE A 120 1.076 8.671 8.332 1.00 61.24 H new ATOM 0 HB ILE A 120 2.254 8.333 6.201 1.00 23.31 H new ATOM 0 HG12 ILE A 120 -0.463 8.432 4.826 1.00 50.41 H new ATOM 0 HG13 ILE A 120 0.756 9.689 4.750 1.00 50.41 H new ATOM 0 HG21 ILE A 120 1.387 6.075 5.594 1.00 5.12 H new ATOM 0 HG22 ILE A 120 1.437 6.314 7.357 1.00 5.12 H new ATOM 0 HG23 ILE A 120 -0.112 6.422 6.488 1.00 5.12 H new ATOM 0 HD11 ILE A 120 0.771 8.330 2.711 1.00 30.43 H new ATOM 0 HD12 ILE A 120 2.303 8.137 3.595 1.00 30.43 H new ATOM 0 HD13 ILE A 120 1.065 6.861 3.672 1.00 30.43 H new ATOM 2036 N LYS A 121 -0.292 11.253 7.104 1.00 44.03 N ATOM 2037 CA LYS A 121 -0.219 12.711 6.922 1.00 24.13 C ATOM 2038 C LYS A 121 0.487 13.413 8.096 1.00 23.12 C ATOM 2039 O LYS A 121 1.045 14.500 7.923 1.00 51.04 O ATOM 2040 CB LYS A 121 -1.627 13.311 6.685 1.00 12.22 C ATOM 2041 CG LYS A 121 -2.643 13.132 7.841 1.00 73.30 C ATOM 2042 CD LYS A 121 -3.961 13.903 7.575 1.00 22.45 C ATOM 2043 CE LYS A 121 -5.057 13.652 8.634 1.00 4.20 C ATOM 2044 NZ LYS A 121 -4.622 13.968 10.021 1.00 11.32 N ATOM 0 H LYS A 121 -1.245 10.892 7.149 1.00 44.03 H new ATOM 0 HA LYS A 121 0.387 12.890 6.034 1.00 24.13 H new ATOM 0 HB2 LYS A 121 -1.517 14.377 6.485 1.00 12.22 H new ATOM 0 HB3 LYS A 121 -2.046 12.860 5.786 1.00 12.22 H new ATOM 0 HG2 LYS A 121 -2.862 12.072 7.971 1.00 73.30 H new ATOM 0 HG3 LYS A 121 -2.199 13.483 8.773 1.00 73.30 H new ATOM 0 HD2 LYS A 121 -3.745 14.971 7.536 1.00 22.45 H new ATOM 0 HD3 LYS A 121 -4.345 13.620 6.595 1.00 22.45 H new ATOM 0 HE2 LYS A 121 -5.932 14.254 8.390 1.00 4.20 H new ATOM 0 HE3 LYS A 121 -5.365 12.607 8.587 1.00 4.20 H new ATOM 0 HZ1 LYS A 121 -5.350 13.652 10.694 1.00 11.32 H new ATOM 0 HZ2 LYS A 121 -3.727 13.479 10.224 1.00 11.32 H new ATOM 0 HZ3 LYS A 121 -4.485 14.994 10.116 1.00 11.32 H new ATOM 2058 N ASN A 122 0.473 12.773 9.282 1.00 13.55 N ATOM 2059 CA ASN A 122 1.088 13.320 10.509 1.00 11.30 C ATOM 2060 C ASN A 122 2.521 12.801 10.721 1.00 63.11 C ATOM 2061 O ASN A 122 3.197 13.225 11.671 1.00 33.34 O ATOM 2062 CB ASN A 122 0.203 13.002 11.738 1.00 32.53 C ATOM 2063 CG ASN A 122 -1.159 13.697 11.669 1.00 1.34 C ATOM 2064 OD1 ASN A 122 -2.135 13.134 11.176 1.00 73.31 O ATOM 2065 ND2 ASN A 122 -1.222 14.943 12.125 1.00 45.40 N ATOM 0 H ASN A 122 0.035 11.862 9.417 1.00 13.55 H new ATOM 0 HA ASN A 122 1.155 14.401 10.389 1.00 11.30 H new ATOM 0 HB2 ASN A 122 0.055 11.924 11.807 1.00 32.53 H new ATOM 0 HB3 ASN A 122 0.721 13.312 12.646 1.00 32.53 H new ATOM 0 HD21 ASN A 122 -2.099 15.462 12.072 1.00 45.40 H new ATOM 0 HD22 ASN A 122 -0.394 15.381 12.528 1.00 45.40 H new ATOM 2072 N ASN A 123 2.986 11.899 9.835 1.00 21.03 N ATOM 2073 CA ASN A 123 4.368 11.376 9.884 1.00 2.31 C ATOM 2074 C ASN A 123 5.338 12.405 9.296 1.00 11.04 C ATOM 2075 O ASN A 123 5.013 13.088 8.317 1.00 34.14 O ATOM 2076 CB ASN A 123 4.522 10.042 9.097 1.00 60.40 C ATOM 2077 CG ASN A 123 3.697 8.887 9.647 1.00 40.34 C ATOM 2078 OD1 ASN A 123 3.368 8.832 10.830 1.00 60.24 O ATOM 2079 ND2 ASN A 123 3.383 7.933 8.793 1.00 23.13 N ATOM 0 H ASN A 123 2.424 11.516 9.075 1.00 21.03 H new ATOM 0 HA ASN A 123 4.598 11.185 10.932 1.00 2.31 H new ATOM 0 HB2 ASN A 123 4.238 10.213 8.058 1.00 60.40 H new ATOM 0 HB3 ASN A 123 5.573 9.754 9.097 1.00 60.40 H new ATOM 0 HD21 ASN A 123 2.853 7.121 9.108 1.00 23.13 H new ATOM 0 HD22 ASN A 123 3.670 8.007 7.817 1.00 23.13 H new ATOM 2086 N ASN A 124 6.535 12.489 9.890 1.00 23.22 N ATOM 2087 CA ASN A 124 7.669 13.267 9.343 1.00 30.25 C ATOM 2088 C ASN A 124 8.583 12.347 8.502 1.00 61.12 C ATOM 2089 O ASN A 124 9.682 12.740 8.109 1.00 2.11 O ATOM 2090 CB ASN A 124 8.469 13.948 10.491 1.00 70.44 C ATOM 2091 CG ASN A 124 9.156 12.967 11.460 1.00 35.40 C ATOM 2092 OD1 ASN A 124 8.657 11.876 11.737 1.00 30.20 O ATOM 2093 ND2 ASN A 124 10.307 13.354 11.983 1.00 53.43 N ATOM 0 H ASN A 124 6.752 12.019 10.769 1.00 23.22 H new ATOM 0 HA ASN A 124 7.279 14.052 8.696 1.00 30.25 H new ATOM 0 HB2 ASN A 124 9.227 14.597 10.053 1.00 70.44 H new ATOM 0 HB3 ASN A 124 7.792 14.586 11.059 1.00 70.44 H new ATOM 0 HD21 ASN A 124 10.803 12.744 12.632 1.00 53.43 H new ATOM 0 HD22 ASN A 124 10.699 14.263 11.737 1.00 53.43 H new ATOM 2100 N ASN A 125 8.091 11.126 8.198 1.00 15.43 N ATOM 2101 CA ASN A 125 8.839 10.097 7.442 1.00 55.55 C ATOM 2102 C ASN A 125 8.405 10.096 5.960 1.00 25.25 C ATOM 2103 O ASN A 125 8.859 9.269 5.164 1.00 11.05 O ATOM 2104 CB ASN A 125 8.589 8.699 8.087 1.00 41.24 C ATOM 2105 CG ASN A 125 9.492 7.583 7.540 1.00 60.31 C ATOM 2106 OD1 ASN A 125 10.646 7.807 7.178 1.00 40.40 O ATOM 2107 ND2 ASN A 125 8.966 6.379 7.467 1.00 34.30 N ATOM 0 H ASN A 125 7.156 10.824 8.473 1.00 15.43 H new ATOM 0 HA ASN A 125 9.904 10.324 7.482 1.00 55.55 H new ATOM 0 HB2 ASN A 125 8.738 8.776 9.164 1.00 41.24 H new ATOM 0 HB3 ASN A 125 7.548 8.419 7.928 1.00 41.24 H new ATOM 0 HD21 ASN A 125 9.518 5.602 7.103 1.00 34.30 H new ATOM 0 HD22 ASN A 125 8.006 6.222 7.775 1.00 34.30 H new ATOM 2114 N ILE A 126 7.570 11.074 5.579 1.00 12.40 N ATOM 2115 CA ILE A 126 6.909 11.092 4.271 1.00 14.11 C ATOM 2116 C ILE A 126 7.793 11.795 3.238 1.00 71.41 C ATOM 2117 O ILE A 126 8.224 12.934 3.449 1.00 53.31 O ATOM 2118 CB ILE A 126 5.502 11.790 4.346 1.00 4.13 C ATOM 2119 CG1 ILE A 126 4.605 11.083 5.402 1.00 71.51 C ATOM 2120 CG2 ILE A 126 4.805 11.832 2.964 1.00 24.32 C ATOM 2121 CD1 ILE A 126 4.399 9.595 5.171 1.00 10.04 C ATOM 0 H ILE A 126 7.336 11.872 6.170 1.00 12.40 H new ATOM 0 HA ILE A 126 6.754 10.058 3.963 1.00 14.11 H new ATOM 0 HB ILE A 126 5.659 12.823 4.656 1.00 4.13 H new ATOM 0 HG12 ILE A 126 5.048 11.225 6.388 1.00 71.51 H new ATOM 0 HG13 ILE A 126 3.631 11.572 5.417 1.00 71.51 H new ATOM 0 HG21 ILE A 126 3.836 12.322 3.060 1.00 24.32 H new ATOM 0 HG22 ILE A 126 5.425 12.388 2.261 1.00 24.32 H new ATOM 0 HG23 ILE A 126 4.663 10.815 2.597 1.00 24.32 H new ATOM 0 HD11 ILE A 126 3.761 9.190 5.957 1.00 10.04 H new ATOM 0 HD12 ILE A 126 3.925 9.439 4.202 1.00 10.04 H new ATOM 0 HD13 ILE A 126 5.363 9.087 5.188 1.00 10.04 H new ATOM 2133 N MET A 127 8.088 11.077 2.146 1.00 71.43 N ATOM 2134 CA MET A 127 8.763 11.644 0.981 1.00 24.41 C ATOM 2135 C MET A 127 7.774 12.537 0.222 1.00 31.33 C ATOM 2136 O MET A 127 6.626 12.146 -0.007 1.00 21.21 O ATOM 2137 CB MET A 127 9.316 10.524 0.056 1.00 13.33 C ATOM 2138 CG MET A 127 10.323 9.582 0.730 1.00 71.05 C ATOM 2139 SD MET A 127 11.063 8.375 -0.398 1.00 14.45 S ATOM 2140 CE MET A 127 9.627 7.536 -1.071 1.00 14.54 C ATOM 0 H MET A 127 7.863 10.087 2.050 1.00 71.43 H new ATOM 0 HA MET A 127 9.613 12.240 1.312 1.00 24.41 H new ATOM 0 HB2 MET A 127 8.480 9.934 -0.319 1.00 13.33 H new ATOM 0 HB3 MET A 127 9.792 10.986 -0.809 1.00 13.33 H new ATOM 0 HG2 MET A 127 11.117 10.177 1.182 1.00 71.05 H new ATOM 0 HG3 MET A 127 9.823 9.050 1.539 1.00 71.05 H new ATOM 0 HE1 MET A 127 9.946 6.642 -1.606 1.00 14.54 H new ATOM 0 HE2 MET A 127 8.957 7.254 -0.259 1.00 14.54 H new ATOM 0 HE3 MET A 127 9.105 8.202 -1.757 1.00 14.54 H new ATOM 2150 N ILE A 128 8.241 13.733 -0.157 1.00 55.34 N ATOM 2151 CA ILE A 128 7.433 14.745 -0.874 1.00 50.52 C ATOM 2152 C ILE A 128 7.175 14.301 -2.346 1.00 71.42 C ATOM 2153 O ILE A 128 6.352 14.888 -3.058 1.00 51.22 O ATOM 2154 CB ILE A 128 8.150 16.160 -0.797 1.00 4.12 C ATOM 2155 CG1 ILE A 128 8.468 16.516 0.696 1.00 63.45 C ATOM 2156 CG2 ILE A 128 7.310 17.288 -1.457 1.00 65.02 C ATOM 2157 CD1 ILE A 128 9.219 17.824 0.908 1.00 12.45 C ATOM 0 H ILE A 128 9.198 14.035 0.024 1.00 55.34 H new ATOM 0 HA ILE A 128 6.459 14.836 -0.393 1.00 50.52 H new ATOM 0 HB ILE A 128 9.080 16.087 -1.361 1.00 4.12 H new ATOM 0 HG12 ILE A 128 7.530 16.561 1.249 1.00 63.45 H new ATOM 0 HG13 ILE A 128 9.054 15.705 1.129 1.00 63.45 H new ATOM 0 HG21 ILE A 128 7.845 18.234 -1.377 1.00 65.02 H new ATOM 0 HG22 ILE A 128 7.146 17.052 -2.508 1.00 65.02 H new ATOM 0 HG23 ILE A 128 6.349 17.371 -0.949 1.00 65.02 H new ATOM 0 HD11 ILE A 128 9.389 17.977 1.974 1.00 12.45 H new ATOM 0 HD12 ILE A 128 10.177 17.782 0.390 1.00 12.45 H new ATOM 0 HD13 ILE A 128 8.629 18.651 0.512 1.00 12.45 H new ATOM 2169 N LYS A 129 7.880 13.231 -2.778 1.00 24.31 N ATOM 2170 CA LYS A 129 7.717 12.589 -4.099 1.00 63.35 C ATOM 2171 C LYS A 129 7.525 11.061 -3.885 1.00 3.51 C ATOM 2172 O LYS A 129 7.959 10.515 -2.869 1.00 2.15 O ATOM 2173 CB LYS A 129 8.942 12.838 -5.037 1.00 11.13 C ATOM 2174 CG LYS A 129 9.165 14.280 -5.572 1.00 54.12 C ATOM 2175 CD LYS A 129 9.642 15.281 -4.492 1.00 75.45 C ATOM 2176 CE LYS A 129 10.297 16.540 -5.078 1.00 14.11 C ATOM 2177 NZ LYS A 129 11.575 16.223 -5.781 1.00 14.12 N ATOM 0 H LYS A 129 8.593 12.781 -2.204 1.00 24.31 H new ATOM 0 HA LYS A 129 6.847 13.028 -4.586 1.00 63.35 H new ATOM 0 HB2 LYS A 129 9.842 12.538 -4.500 1.00 11.13 H new ATOM 0 HB3 LYS A 129 8.847 12.173 -5.896 1.00 11.13 H new ATOM 0 HG2 LYS A 129 9.901 14.249 -6.376 1.00 54.12 H new ATOM 0 HG3 LYS A 129 8.234 14.644 -6.006 1.00 54.12 H new ATOM 0 HD2 LYS A 129 8.791 15.575 -3.878 1.00 75.45 H new ATOM 0 HD3 LYS A 129 10.353 14.783 -3.833 1.00 75.45 H new ATOM 0 HE2 LYS A 129 9.608 17.018 -5.774 1.00 14.11 H new ATOM 0 HE3 LYS A 129 10.490 17.255 -4.279 1.00 14.11 H new ATOM 0 HZ1 LYS A 129 12.134 17.093 -5.894 1.00 14.12 H new ATOM 0 HZ2 LYS A 129 12.117 15.533 -5.222 1.00 14.12 H new ATOM 0 HZ3 LYS A 129 11.366 15.822 -6.718 1.00 14.12 H new ATOM 2191 N TYR A 130 6.884 10.380 -4.854 1.00 73.43 N ATOM 2192 CA TYR A 130 6.673 8.911 -4.832 1.00 42.42 C ATOM 2193 C TYR A 130 7.030 8.301 -6.204 1.00 52.21 C ATOM 2194 O TYR A 130 7.308 9.027 -7.171 1.00 22.43 O ATOM 2195 CB TYR A 130 5.202 8.560 -4.449 1.00 72.31 C ATOM 2196 CG TYR A 130 4.166 8.757 -5.577 1.00 31.42 C ATOM 2197 CD1 TYR A 130 3.817 10.030 -6.026 1.00 21.23 C ATOM 2198 CD2 TYR A 130 3.547 7.661 -6.196 1.00 62.35 C ATOM 2199 CE1 TYR A 130 2.899 10.203 -7.035 1.00 32.34 C ATOM 2200 CE2 TYR A 130 2.629 7.837 -7.209 1.00 40.22 C ATOM 2201 CZ TYR A 130 2.308 9.108 -7.622 1.00 62.40 C ATOM 2202 OH TYR A 130 1.384 9.287 -8.622 1.00 43.21 O ATOM 0 H TYR A 130 6.494 10.832 -5.681 1.00 73.43 H new ATOM 0 HA TYR A 130 7.329 8.485 -4.073 1.00 42.42 H new ATOM 0 HB2 TYR A 130 5.166 7.521 -4.122 1.00 72.31 H new ATOM 0 HB3 TYR A 130 4.909 9.173 -3.597 1.00 72.31 H new ATOM 0 HD1 TYR A 130 4.276 10.896 -5.573 1.00 21.23 H new ATOM 0 HD2 TYR A 130 3.794 6.661 -5.873 1.00 62.35 H new ATOM 0 HE1 TYR A 130 2.642 11.198 -7.367 1.00 32.34 H new ATOM 0 HE2 TYR A 130 2.165 6.981 -7.676 1.00 40.22 H new ATOM 0 HH TYR A 130 1.063 8.414 -8.931 1.00 43.21 H new ATOM 2212 N HIS A 131 7.013 6.959 -6.275 1.00 44.11 N ATOM 2213 CA HIS A 131 7.232 6.209 -7.526 1.00 1.41 C ATOM 2214 C HIS A 131 5.889 5.681 -8.083 1.00 0.13 C ATOM 2215 O HIS A 131 5.204 4.925 -7.401 1.00 41.14 O ATOM 2216 CB HIS A 131 8.222 5.054 -7.284 1.00 35.43 C ATOM 2217 CG HIS A 131 9.589 5.542 -6.908 1.00 60.13 C ATOM 2218 ND1 HIS A 131 10.420 6.097 -7.844 1.00 3.34 N ATOM 2219 CD2 HIS A 131 10.207 5.559 -5.707 1.00 65.51 C ATOM 2220 CE1 HIS A 131 11.512 6.442 -7.204 1.00 44.55 C ATOM 2221 NE2 HIS A 131 11.433 6.133 -5.902 1.00 23.01 N ATOM 0 H HIS A 131 6.847 6.362 -5.465 1.00 44.11 H new ATOM 0 HA HIS A 131 7.663 6.880 -8.269 1.00 1.41 H new ATOM 0 HB2 HIS A 131 7.839 4.410 -6.492 1.00 35.43 H new ATOM 0 HB3 HIS A 131 8.292 4.444 -8.185 1.00 35.43 H new ATOM 0 HD2 HIS A 131 9.810 5.190 -4.773 1.00 65.51 H new ATOM 0 HE1 HIS A 131 12.366 6.915 -7.667 1.00 44.55 H new ATOM 0 HE2 HIS A 131 12.149 6.295 -5.194 1.00 23.01 H new ATOM 2229 N PRO A 132 5.484 6.113 -9.313 1.00 72.31 N ATOM 2230 CA PRO A 132 4.187 5.717 -9.936 1.00 53.14 C ATOM 2231 C PRO A 132 4.104 4.230 -10.397 1.00 4.13 C ATOM 2232 O PRO A 132 3.037 3.612 -10.302 1.00 13.22 O ATOM 2233 CB PRO A 132 4.093 6.684 -11.144 1.00 4.33 C ATOM 2234 CG PRO A 132 5.509 7.009 -11.489 1.00 55.42 C ATOM 2235 CD PRO A 132 6.237 7.070 -10.177 1.00 43.51 C ATOM 0 HA PRO A 132 3.367 5.787 -9.222 1.00 53.14 H new ATOM 0 HB2 PRO A 132 3.579 6.217 -11.984 1.00 4.33 H new ATOM 0 HB3 PRO A 132 3.533 7.583 -10.887 1.00 4.33 H new ATOM 0 HG2 PRO A 132 5.939 6.249 -12.141 1.00 55.42 H new ATOM 0 HG3 PRO A 132 5.576 7.959 -12.020 1.00 55.42 H new ATOM 0 HD2 PRO A 132 7.281 6.777 -10.284 1.00 43.51 H new ATOM 0 HD3 PRO A 132 6.229 8.077 -9.761 1.00 43.51 H new ATOM 2243 N LYS A 133 5.230 3.681 -10.896 1.00 41.22 N ATOM 2244 CA LYS A 133 5.276 2.336 -11.543 1.00 53.34 C ATOM 2245 C LYS A 133 5.597 1.229 -10.515 1.00 44.11 C ATOM 2246 O LYS A 133 5.793 1.507 -9.333 1.00 1.21 O ATOM 2247 CB LYS A 133 6.324 2.333 -12.704 1.00 5.34 C ATOM 2248 CG LYS A 133 5.841 2.913 -14.062 1.00 31.20 C ATOM 2249 CD LYS A 133 5.367 4.379 -14.003 1.00 41.01 C ATOM 2250 CE LYS A 133 5.005 4.955 -15.384 1.00 65.23 C ATOM 2251 NZ LYS A 133 6.157 4.945 -16.333 1.00 34.11 N ATOM 0 H LYS A 133 6.136 4.149 -10.866 1.00 41.22 H new ATOM 0 HA LYS A 133 4.291 2.124 -11.958 1.00 53.34 H new ATOM 0 HB2 LYS A 133 7.197 2.900 -12.380 1.00 5.34 H new ATOM 0 HB3 LYS A 133 6.653 1.307 -12.867 1.00 5.34 H new ATOM 0 HG2 LYS A 133 6.654 2.837 -14.784 1.00 31.20 H new ATOM 0 HG3 LYS A 133 5.024 2.296 -14.435 1.00 31.20 H new ATOM 0 HD2 LYS A 133 4.498 4.447 -13.349 1.00 41.01 H new ATOM 0 HD3 LYS A 133 6.151 4.990 -13.556 1.00 41.01 H new ATOM 0 HE2 LYS A 133 4.184 4.378 -15.810 1.00 65.23 H new ATOM 0 HE3 LYS A 133 4.647 5.978 -15.264 1.00 65.23 H new ATOM 0 HZ1 LYS A 133 5.912 5.492 -17.183 1.00 34.11 H new ATOM 0 HZ2 LYS A 133 6.988 5.371 -15.875 1.00 34.11 H new ATOM 0 HZ3 LYS A 133 6.375 3.965 -16.604 1.00 34.11 H new ATOM 2265 N PHE A 134 5.681 -0.030 -11.006 1.00 63.23 N ATOM 2266 CA PHE A 134 5.955 -1.218 -10.175 1.00 52.14 C ATOM 2267 C PHE A 134 7.467 -1.348 -9.890 1.00 22.10 C ATOM 2268 O PHE A 134 8.241 -1.794 -10.751 1.00 12.31 O ATOM 2269 CB PHE A 134 5.425 -2.529 -10.854 1.00 15.42 C ATOM 2270 CG PHE A 134 3.964 -2.874 -10.566 1.00 0.40 C ATOM 2271 CD1 PHE A 134 3.595 -3.353 -9.311 1.00 25.14 C ATOM 2272 CD2 PHE A 134 2.967 -2.743 -11.536 1.00 13.11 C ATOM 2273 CE1 PHE A 134 2.285 -3.685 -9.030 1.00 43.13 C ATOM 2274 CE2 PHE A 134 1.655 -3.078 -11.252 1.00 14.13 C ATOM 2275 CZ PHE A 134 1.315 -3.545 -9.999 1.00 24.35 C ATOM 0 H PHE A 134 5.559 -0.247 -11.995 1.00 63.23 H new ATOM 0 HA PHE A 134 5.425 -1.085 -9.232 1.00 52.14 H new ATOM 0 HB2 PHE A 134 5.553 -2.436 -11.933 1.00 15.42 H new ATOM 0 HB3 PHE A 134 6.048 -3.363 -10.530 1.00 15.42 H new ATOM 0 HD1 PHE A 134 4.347 -3.467 -8.544 1.00 25.14 H new ATOM 0 HD2 PHE A 134 3.223 -2.376 -12.519 1.00 13.11 H new ATOM 0 HE1 PHE A 134 2.020 -4.055 -8.050 1.00 43.13 H new ATOM 0 HE2 PHE A 134 0.895 -2.974 -12.013 1.00 14.13 H new ATOM 0 HZ PHE A 134 0.289 -3.801 -9.778 1.00 24.35 H new ATOM 2285 N TRP A 135 7.869 -0.922 -8.687 1.00 5.43 N ATOM 2286 CA TRP A 135 9.198 -1.183 -8.126 1.00 41.42 C ATOM 2287 C TRP A 135 9.383 -2.685 -7.850 1.00 41.24 C ATOM 2288 O TRP A 135 9.006 -3.212 -6.793 1.00 23.20 O ATOM 2289 CB TRP A 135 9.441 -0.325 -6.839 1.00 65.24 C ATOM 2290 CG TRP A 135 10.214 0.942 -7.104 1.00 22.35 C ATOM 2291 CD1 TRP A 135 9.898 1.930 -7.987 1.00 32.30 C ATOM 2292 CD2 TRP A 135 11.446 1.340 -6.485 1.00 41.12 C ATOM 2293 NE1 TRP A 135 10.864 2.903 -7.967 1.00 72.21 N ATOM 2294 CE2 TRP A 135 11.818 2.566 -7.050 1.00 12.34 C ATOM 2295 CE3 TRP A 135 12.264 0.771 -5.506 1.00 1.03 C ATOM 2296 CZ2 TRP A 135 12.974 3.239 -6.677 1.00 21.11 C ATOM 2297 CZ3 TRP A 135 13.412 1.442 -5.130 1.00 61.02 C ATOM 2298 CH2 TRP A 135 13.754 2.667 -5.719 1.00 64.12 C ATOM 0 H TRP A 135 7.270 -0.378 -8.067 1.00 5.43 H new ATOM 0 HA TRP A 135 9.947 -0.886 -8.860 1.00 41.42 H new ATOM 0 HB2 TRP A 135 8.479 -0.069 -6.394 1.00 65.24 H new ATOM 0 HB3 TRP A 135 9.981 -0.926 -6.107 1.00 65.24 H new ATOM 0 HD1 TRP A 135 9.017 1.945 -8.611 1.00 32.30 H new ATOM 0 HE1 TRP A 135 10.869 3.744 -8.545 1.00 72.21 H new ATOM 0 HE3 TRP A 135 12.004 -0.174 -5.052 1.00 1.03 H new ATOM 0 HZ2 TRP A 135 13.244 4.181 -7.130 1.00 21.11 H new ATOM 0 HZ3 TRP A 135 14.054 1.017 -4.373 1.00 61.02 H new ATOM 0 HH2 TRP A 135 14.657 3.169 -5.406 1.00 64.12 H new ATOM 2309 N THR A 136 9.891 -3.365 -8.870 1.00 20.05 N ATOM 2310 CA THR A 136 10.411 -4.724 -8.775 1.00 34.33 C ATOM 2311 C THR A 136 11.949 -4.622 -8.880 1.00 63.24 C ATOM 2312 O THR A 136 12.443 -3.751 -9.608 1.00 63.25 O ATOM 2313 CB THR A 136 9.801 -5.600 -9.911 1.00 60.55 C ATOM 2314 OG1 THR A 136 8.380 -5.389 -9.957 1.00 11.45 O ATOM 2315 CG2 THR A 136 10.079 -7.093 -9.705 1.00 72.50 C ATOM 0 H THR A 136 9.955 -2.977 -9.811 1.00 20.05 H new ATOM 0 HA THR A 136 10.140 -5.201 -7.833 1.00 34.33 H new ATOM 0 HB THR A 136 10.270 -5.301 -10.848 1.00 60.55 H new ATOM 0 HG1 THR A 136 8.061 -5.510 -10.876 1.00 11.45 H new ATOM 0 HG21 THR A 136 9.634 -7.662 -10.522 1.00 72.50 H new ATOM 0 HG22 THR A 136 11.155 -7.264 -9.688 1.00 72.50 H new ATOM 0 HG23 THR A 136 9.645 -7.417 -8.759 1.00 72.50 H new ATOM 2323 N ASP A 137 12.685 -5.477 -8.148 1.00 21.01 N ATOM 2324 CA ASP A 137 14.146 -5.328 -7.962 1.00 64.11 C ATOM 2325 C ASP A 137 14.927 -5.326 -9.309 1.00 5.32 C ATOM 2326 O ASP A 137 14.781 -6.243 -10.126 1.00 43.41 O ATOM 2327 CB ASP A 137 14.688 -6.422 -6.991 1.00 2.34 C ATOM 2328 CG ASP A 137 14.628 -7.870 -7.531 1.00 20.41 C ATOM 2329 OD1 ASP A 137 13.531 -8.327 -7.926 1.00 1.25 O ATOM 2330 OD2 ASP A 137 15.672 -8.560 -7.561 1.00 11.21 O ATOM 0 H ASP A 137 12.290 -6.287 -7.670 1.00 21.01 H new ATOM 0 HA ASP A 137 14.315 -4.350 -7.512 1.00 64.11 H new ATOM 0 HB2 ASP A 137 15.723 -6.186 -6.745 1.00 2.34 H new ATOM 0 HB3 ASP A 137 14.120 -6.374 -6.062 1.00 2.34 H new ATOM 2335 N GLY A 138 15.681 -4.226 -9.558 1.00 2.13 N ATOM 2336 CA GLY A 138 16.550 -4.093 -10.745 1.00 32.13 C ATOM 2337 C GLY A 138 15.803 -4.017 -12.084 1.00 12.20 C ATOM 2338 O GLY A 138 16.417 -4.148 -13.149 1.00 31.53 O ATOM 0 H GLY A 138 15.701 -3.413 -8.943 1.00 2.13 H new ATOM 0 HA2 GLY A 138 17.159 -3.196 -10.633 1.00 32.13 H new ATOM 0 HA3 GLY A 138 17.234 -4.941 -10.774 1.00 32.13 H new ATOM 2342 N SER A 139 14.478 -3.794 -12.030 1.00 53.44 N ATOM 2343 CA SER A 139 13.601 -3.798 -13.218 1.00 52.32 C ATOM 2344 C SER A 139 13.488 -2.401 -13.849 1.00 24.22 C ATOM 2345 O SER A 139 13.881 -1.398 -13.252 1.00 45.03 O ATOM 2346 CB SER A 139 12.208 -4.320 -12.815 1.00 71.21 C ATOM 2347 OG SER A 139 12.308 -5.576 -12.156 1.00 63.53 O ATOM 0 H SER A 139 13.982 -3.605 -11.159 1.00 53.44 H new ATOM 0 HA SER A 139 14.040 -4.454 -13.969 1.00 52.32 H new ATOM 0 HB2 SER A 139 11.721 -3.599 -12.159 1.00 71.21 H new ATOM 0 HB3 SER A 139 11.582 -4.419 -13.702 1.00 71.21 H new ATOM 0 HG SER A 139 11.579 -6.160 -12.453 1.00 63.53 H new ATOM 2353 N TYR A 140 12.935 -2.344 -15.063 1.00 20.44 N ATOM 2354 CA TYR A 140 12.719 -1.083 -15.773 1.00 2.44 C ATOM 2355 C TYR A 140 11.343 -0.504 -15.388 1.00 4.23 C ATOM 2356 O TYR A 140 10.347 -0.681 -16.095 1.00 22.15 O ATOM 2357 CB TYR A 140 12.860 -1.292 -17.304 1.00 72.41 C ATOM 2358 CG TYR A 140 14.262 -1.749 -17.742 1.00 74.44 C ATOM 2359 CD1 TYR A 140 15.262 -0.823 -18.066 1.00 33.24 C ATOM 2360 CD2 TYR A 140 14.590 -3.109 -17.826 1.00 53.10 C ATOM 2361 CE1 TYR A 140 16.523 -1.238 -18.457 1.00 61.32 C ATOM 2362 CE2 TYR A 140 15.848 -3.525 -18.215 1.00 2.34 C ATOM 2363 CZ TYR A 140 16.811 -2.591 -18.529 1.00 33.35 C ATOM 2364 OH TYR A 140 18.065 -3.011 -18.923 1.00 43.21 O ATOM 0 H TYR A 140 12.626 -3.168 -15.579 1.00 20.44 H new ATOM 0 HA TYR A 140 13.480 -0.360 -15.480 1.00 2.44 H new ATOM 0 HB2 TYR A 140 12.129 -2.032 -17.629 1.00 72.41 H new ATOM 0 HB3 TYR A 140 12.617 -0.359 -17.813 1.00 72.41 H new ATOM 0 HD1 TYR A 140 15.045 0.233 -18.010 1.00 33.24 H new ATOM 0 HD2 TYR A 140 13.842 -3.848 -17.581 1.00 53.10 H new ATOM 0 HE1 TYR A 140 17.280 -0.509 -18.705 1.00 61.32 H new ATOM 0 HE2 TYR A 140 16.076 -4.579 -18.273 1.00 2.34 H new ATOM 0 HH TYR A 140 18.098 -3.990 -18.918 1.00 43.21 H new ATOM 2374 N GLN A 141 11.298 0.141 -14.214 1.00 34.30 N ATOM 2375 CA GLN A 141 10.122 0.909 -13.753 1.00 43.21 C ATOM 2376 C GLN A 141 10.263 2.376 -14.206 1.00 12.54 C ATOM 2377 O GLN A 141 10.982 2.638 -15.175 1.00 72.11 O ATOM 2378 CB GLN A 141 9.913 0.719 -12.207 1.00 61.45 C ATOM 2379 CG GLN A 141 11.181 0.697 -11.323 1.00 4.41 C ATOM 2380 CD GLN A 141 11.858 2.049 -11.080 1.00 33.12 C ATOM 2381 OE1 GLN A 141 13.071 2.125 -10.944 1.00 4.53 O ATOM 2382 NE2 GLN A 141 11.094 3.114 -10.961 1.00 62.05 N ATOM 0 H GLN A 141 12.075 0.148 -13.553 1.00 34.30 H new ATOM 0 HA GLN A 141 9.208 0.532 -14.211 1.00 43.21 H new ATOM 0 HB2 GLN A 141 9.267 1.522 -11.852 1.00 61.45 H new ATOM 0 HB3 GLN A 141 9.375 -0.216 -12.051 1.00 61.45 H new ATOM 0 HG2 GLN A 141 10.918 0.267 -10.357 1.00 4.41 H new ATOM 0 HG3 GLN A 141 11.908 0.027 -11.783 1.00 4.41 H new ATOM 0 HE21 GLN A 141 10.084 3.033 -11.078 1.00 62.05 H new ATOM 0 HE22 GLN A 141 11.512 4.021 -10.752 1.00 62.05 H new ATOM 2391 N CYS A 142 9.550 3.301 -13.529 1.00 12.22 N ATOM 2392 CA CYS A 142 9.489 4.730 -13.895 1.00 63.51 C ATOM 2393 C CYS A 142 10.884 5.368 -14.094 1.00 75.22 C ATOM 2394 O CYS A 142 11.244 5.731 -15.217 1.00 42.34 O ATOM 2395 CB CYS A 142 8.665 5.492 -12.824 1.00 20.04 C ATOM 2396 SG CYS A 142 8.931 4.913 -11.114 1.00 12.32 S ATOM 0 H CYS A 142 8.995 3.073 -12.704 1.00 12.22 H new ATOM 0 HA CYS A 142 8.996 4.807 -14.864 1.00 63.51 H new ATOM 0 HB2 CYS A 142 8.914 6.552 -12.878 1.00 20.04 H new ATOM 0 HB3 CYS A 142 7.606 5.400 -13.065 1.00 20.04 H new ATOM 0 HG CYS A 142 9.018 5.937 -10.318 1.00 12.32 H new ATOM 2401 N CYS A 143 11.653 5.480 -13.004 1.00 42.42 N ATOM 2402 CA CYS A 143 12.973 6.147 -13.009 1.00 32.53 C ATOM 2403 C CYS A 143 14.126 5.178 -13.320 1.00 44.12 C ATOM 2404 O CYS A 143 15.247 5.627 -13.598 1.00 74.41 O ATOM 2405 CB CYS A 143 13.176 6.817 -11.644 1.00 10.44 C ATOM 2406 SG CYS A 143 12.912 5.698 -10.233 1.00 42.22 S ATOM 0 H CYS A 143 11.383 5.113 -12.091 1.00 42.42 H new ATOM 0 HA CYS A 143 12.985 6.890 -13.806 1.00 32.53 H new ATOM 0 HB2 CYS A 143 14.188 7.219 -11.593 1.00 10.44 H new ATOM 0 HB3 CYS A 143 12.493 7.662 -11.559 1.00 10.44 H new ATOM 0 HG CYS A 143 11.697 5.836 -9.791 1.00 42.22 H new ATOM 2411 N ARG A 144 13.830 3.853 -13.287 1.00 63.33 N ATOM 2412 CA ARG A 144 14.826 2.759 -13.472 1.00 45.51 C ATOM 2413 C ARG A 144 15.946 2.842 -12.399 1.00 61.23 C ATOM 2414 O ARG A 144 17.093 2.450 -12.634 1.00 52.35 O ATOM 2415 CB ARG A 144 15.417 2.707 -14.926 1.00 50.02 C ATOM 2416 CG ARG A 144 14.381 2.503 -16.067 1.00 61.41 C ATOM 2417 CD ARG A 144 13.729 3.818 -16.548 1.00 2.54 C ATOM 2418 NE ARG A 144 12.596 3.582 -17.453 1.00 1.13 N ATOM 2419 CZ ARG A 144 12.217 4.391 -18.454 1.00 14.42 C ATOM 2420 NH1 ARG A 144 12.874 5.515 -18.717 1.00 60.24 N ATOM 2421 NH2 ARG A 144 11.160 4.077 -19.185 1.00 63.35 N ATOM 0 H ARG A 144 12.883 3.508 -13.130 1.00 63.33 H new ATOM 0 HA ARG A 144 14.291 1.819 -13.334 1.00 45.51 H new ATOM 0 HB2 ARG A 144 15.957 3.635 -15.112 1.00 50.02 H new ATOM 0 HB3 ARG A 144 16.146 1.898 -14.973 1.00 50.02 H new ATOM 0 HG2 ARG A 144 14.873 2.020 -16.912 1.00 61.41 H new ATOM 0 HG3 ARG A 144 13.601 1.825 -15.722 1.00 61.41 H new ATOM 0 HD2 ARG A 144 13.388 4.389 -15.684 1.00 2.54 H new ATOM 0 HD3 ARG A 144 14.477 4.426 -17.057 1.00 2.54 H new ATOM 0 HE ARG A 144 12.052 2.732 -17.308 1.00 1.13 H new ATOM 0 HH11 ARG A 144 13.683 5.777 -18.153 1.00 60.24 H new ATOM 0 HH12 ARG A 144 12.570 6.116 -19.483 1.00 60.24 H new ATOM 0 HH21 ARG A 144 10.638 3.224 -18.986 1.00 63.35 H new ATOM 0 HH22 ARG A 144 10.867 4.688 -19.947 1.00 63.35 H new ATOM 2435 N GLN A 145 15.572 3.336 -11.204 1.00 10.24 N ATOM 2436 CA GLN A 145 16.483 3.518 -10.050 1.00 64.13 C ATOM 2437 C GLN A 145 16.247 2.451 -8.964 1.00 53.03 C ATOM 2438 O GLN A 145 16.808 2.558 -7.861 1.00 34.03 O ATOM 2439 CB GLN A 145 16.270 4.925 -9.434 1.00 41.41 C ATOM 2440 CG GLN A 145 16.661 6.103 -10.346 1.00 52.35 C ATOM 2441 CD GLN A 145 16.395 7.478 -9.722 1.00 2.11 C ATOM 2442 OE1 GLN A 145 17.122 8.439 -9.977 1.00 53.12 O ATOM 2443 NE2 GLN A 145 15.332 7.600 -8.937 1.00 63.01 N ATOM 0 H GLN A 145 14.614 3.626 -11.006 1.00 10.24 H new ATOM 0 HA GLN A 145 17.505 3.414 -10.415 1.00 64.13 H new ATOM 0 HB2 GLN A 145 15.220 5.030 -9.161 1.00 41.41 H new ATOM 0 HB3 GLN A 145 16.847 4.992 -8.512 1.00 41.41 H new ATOM 0 HG2 GLN A 145 17.720 6.024 -10.593 1.00 52.35 H new ATOM 0 HG3 GLN A 145 16.109 6.025 -11.282 1.00 52.35 H new ATOM 0 HE21 GLN A 145 14.746 6.788 -8.742 1.00 63.01 H new ATOM 0 HE22 GLN A 145 15.101 8.506 -8.529 1.00 63.01 H new ATOM 2452 N THR A 146 15.416 1.436 -9.279 1.00 33.35 N ATOM 2453 CA THR A 146 15.028 0.386 -8.326 1.00 74.32 C ATOM 2454 C THR A 146 16.240 -0.478 -7.900 1.00 15.52 C ATOM 2455 O THR A 146 16.665 -1.420 -8.588 1.00 21.20 O ATOM 2456 CB THR A 146 13.847 -0.490 -8.865 1.00 63.20 C ATOM 2457 OG1 THR A 146 13.519 -1.542 -7.937 1.00 51.15 O ATOM 2458 CG2 THR A 146 14.150 -1.079 -10.241 1.00 35.02 C ATOM 0 H THR A 146 14.997 1.325 -10.202 1.00 33.35 H new ATOM 0 HA THR A 146 14.663 0.889 -7.431 1.00 74.32 H new ATOM 0 HB THR A 146 12.986 0.171 -8.969 1.00 63.20 H new ATOM 0 HG1 THR A 146 13.139 -2.302 -8.425 1.00 51.15 H new ATOM 0 HG21 THR A 146 13.303 -1.679 -10.575 1.00 35.02 H new ATOM 0 HG22 THR A 146 14.325 -0.271 -10.952 1.00 35.02 H new ATOM 0 HG23 THR A 146 15.038 -1.708 -10.180 1.00 35.02 H new ATOM 2466 N GLU A 147 16.829 -0.068 -6.780 1.00 21.01 N ATOM 2467 CA GLU A 147 17.908 -0.779 -6.104 1.00 61.43 C ATOM 2468 C GLU A 147 17.701 -0.531 -4.606 1.00 71.23 C ATOM 2469 O GLU A 147 17.498 -1.459 -3.828 1.00 3.12 O ATOM 2470 CB GLU A 147 19.303 -0.267 -6.599 1.00 1.21 C ATOM 2471 CG GLU A 147 20.528 -1.168 -6.256 1.00 12.33 C ATOM 2472 CD GLU A 147 20.792 -1.356 -4.742 1.00 13.33 C ATOM 2473 OE1 GLU A 147 21.249 -0.392 -4.084 1.00 73.44 O ATOM 2474 OE2 GLU A 147 20.516 -2.454 -4.204 1.00 44.42 O ATOM 0 H GLU A 147 16.560 0.793 -6.305 1.00 21.01 H new ATOM 0 HA GLU A 147 17.891 -1.847 -6.321 1.00 61.43 H new ATOM 0 HB2 GLU A 147 19.259 -0.146 -7.681 1.00 1.21 H new ATOM 0 HB3 GLU A 147 19.475 0.722 -6.174 1.00 1.21 H new ATOM 0 HG2 GLU A 147 20.378 -2.148 -6.709 1.00 12.33 H new ATOM 0 HG3 GLU A 147 21.418 -0.737 -6.715 1.00 12.33 H new ATOM 2481 N LYS A 148 17.743 0.752 -4.237 1.00 52.13 N ATOM 2482 CA LYS A 148 17.528 1.224 -2.862 1.00 5.22 C ATOM 2483 C LYS A 148 16.489 2.352 -2.913 1.00 20.51 C ATOM 2484 O LYS A 148 16.274 2.920 -3.991 1.00 51.12 O ATOM 2485 CB LYS A 148 18.888 1.712 -2.271 1.00 63.32 C ATOM 2486 CG LYS A 148 18.948 1.812 -0.730 1.00 41.41 C ATOM 2487 CD LYS A 148 18.745 0.454 -0.018 1.00 74.31 C ATOM 2488 CE LYS A 148 19.626 -0.684 -0.583 1.00 62.52 C ATOM 2489 NZ LYS A 148 21.070 -0.328 -0.658 1.00 42.50 N ATOM 0 H LYS A 148 17.931 1.508 -4.896 1.00 52.13 H new ATOM 0 HA LYS A 148 17.156 0.429 -2.216 1.00 5.22 H new ATOM 0 HB2 LYS A 148 19.673 1.033 -2.604 1.00 63.32 H new ATOM 0 HB3 LYS A 148 19.115 2.692 -2.690 1.00 63.32 H new ATOM 0 HG2 LYS A 148 19.913 2.227 -0.438 1.00 41.41 H new ATOM 0 HG3 LYS A 148 18.184 2.511 -0.389 1.00 41.41 H new ATOM 0 HD2 LYS A 148 18.961 0.575 1.044 1.00 74.31 H new ATOM 0 HD3 LYS A 148 17.697 0.165 -0.099 1.00 74.31 H new ATOM 0 HE2 LYS A 148 19.509 -1.569 0.042 1.00 62.52 H new ATOM 0 HE3 LYS A 148 19.272 -0.948 -1.579 1.00 62.52 H new ATOM 0 HZ1 LYS A 148 21.646 -1.162 -0.424 1.00 42.50 H new ATOM 0 HZ2 LYS A 148 21.299 -0.008 -1.621 1.00 42.50 H new ATOM 0 HZ3 LYS A 148 21.275 0.435 0.018 1.00 42.50 H new ATOM 2503 N LEU A 149 15.868 2.679 -1.762 1.00 12.45 N ATOM 2504 CA LEU A 149 14.745 3.637 -1.682 1.00 15.45 C ATOM 2505 C LEU A 149 15.113 5.024 -2.249 1.00 41.44 C ATOM 2506 O LEU A 149 15.693 5.860 -1.552 1.00 33.10 O ATOM 2507 CB LEU A 149 14.255 3.777 -0.215 1.00 1.41 C ATOM 2508 CG LEU A 149 13.675 2.488 0.441 1.00 31.51 C ATOM 2509 CD1 LEU A 149 13.380 2.712 1.935 1.00 14.22 C ATOM 2510 CD2 LEU A 149 12.418 1.997 -0.311 1.00 33.10 C ATOM 0 H LEU A 149 16.131 2.285 -0.859 1.00 12.45 H new ATOM 0 HA LEU A 149 13.941 3.235 -2.298 1.00 15.45 H new ATOM 0 HB2 LEU A 149 15.089 4.126 0.393 1.00 1.41 H new ATOM 0 HB3 LEU A 149 13.490 4.553 -0.182 1.00 1.41 H new ATOM 0 HG LEU A 149 14.431 1.706 0.366 1.00 31.51 H new ATOM 0 HD11 LEU A 149 12.976 1.797 2.367 1.00 14.22 H new ATOM 0 HD12 LEU A 149 14.301 2.982 2.451 1.00 14.22 H new ATOM 0 HD13 LEU A 149 12.653 3.517 2.046 1.00 14.22 H new ATOM 0 HD21 LEU A 149 12.035 1.096 0.169 1.00 33.10 H new ATOM 0 HD22 LEU A 149 11.653 2.774 -0.288 1.00 33.10 H new ATOM 0 HD23 LEU A 149 12.677 1.774 -1.346 1.00 33.10 H new ATOM 2522 N ALA A 150 14.807 5.226 -3.540 1.00 15.31 N ATOM 2523 CA ALA A 150 14.919 6.536 -4.187 1.00 4.25 C ATOM 2524 C ALA A 150 13.787 7.452 -3.661 1.00 52.53 C ATOM 2525 O ALA A 150 12.676 6.959 -3.418 1.00 45.21 O ATOM 2526 CB ALA A 150 14.878 6.372 -5.722 1.00 11.42 C ATOM 0 H ALA A 150 14.476 4.487 -4.160 1.00 15.31 H new ATOM 0 HA ALA A 150 15.873 7.003 -3.944 1.00 4.25 H new ATOM 0 HB1 ALA A 150 14.962 7.351 -6.195 1.00 11.42 H new ATOM 0 HB2 ALA A 150 15.707 5.742 -6.043 1.00 11.42 H new ATOM 0 HB3 ALA A 150 13.936 5.908 -6.013 1.00 11.42 H new ATOM 2532 N PRO A 151 14.033 8.788 -3.477 1.00 5.44 N ATOM 2533 CA PRO A 151 13.049 9.711 -2.843 1.00 63.10 C ATOM 2534 C PRO A 151 11.865 10.122 -3.758 1.00 14.32 C ATOM 2535 O PRO A 151 11.222 11.145 -3.506 1.00 72.34 O ATOM 2536 CB PRO A 151 13.934 10.920 -2.451 1.00 75.50 C ATOM 2537 CG PRO A 151 15.022 10.950 -3.486 1.00 31.22 C ATOM 2538 CD PRO A 151 15.296 9.497 -3.842 1.00 4.52 C ATOM 0 HA PRO A 151 12.534 9.242 -2.005 1.00 63.10 H new ATOM 0 HB2 PRO A 151 13.361 11.847 -2.453 1.00 75.50 H new ATOM 0 HB3 PRO A 151 14.345 10.801 -1.448 1.00 75.50 H new ATOM 0 HG2 PRO A 151 14.711 11.516 -4.364 1.00 31.22 H new ATOM 0 HG3 PRO A 151 15.918 11.433 -3.097 1.00 31.22 H new ATOM 0 HD2 PRO A 151 15.525 9.383 -4.901 1.00 4.52 H new ATOM 0 HD3 PRO A 151 16.148 9.104 -3.287 1.00 4.52 H new ATOM 2546 N GLY A 152 11.577 9.307 -4.797 1.00 64.24 N ATOM 2547 CA GLY A 152 10.418 9.506 -5.672 1.00 43.13 C ATOM 2548 C GLY A 152 10.747 10.286 -6.938 1.00 31.54 C ATOM 2549 O GLY A 152 11.488 11.275 -6.880 1.00 14.41 O ATOM 0 H GLY A 152 12.145 8.497 -5.046 1.00 64.24 H new ATOM 0 HA2 GLY A 152 10.009 8.534 -5.948 1.00 43.13 H new ATOM 0 HA3 GLY A 152 9.641 10.034 -5.120 1.00 43.13 H new ATOM 2553 N CYS A 153 10.209 9.834 -8.087 1.00 2.52 N ATOM 2554 CA CYS A 153 10.417 10.489 -9.400 1.00 24.24 C ATOM 2555 C CYS A 153 9.244 11.425 -9.760 1.00 73.41 C ATOM 2556 O CYS A 153 9.463 12.495 -10.345 1.00 21.23 O ATOM 2557 CB CYS A 153 10.635 9.417 -10.479 1.00 23.35 C ATOM 2558 SG CYS A 153 9.386 8.105 -10.482 1.00 73.11 S ATOM 0 H CYS A 153 9.617 9.005 -8.135 1.00 2.52 H new ATOM 0 HA CYS A 153 11.308 11.115 -9.342 1.00 24.24 H new ATOM 0 HB2 CYS A 153 10.643 9.898 -11.457 1.00 23.35 H new ATOM 0 HB3 CYS A 153 11.618 8.968 -10.336 1.00 23.35 H new ATOM 0 HG CYS A 153 9.851 7.064 -11.107 1.00 73.11 H new ATOM 2563 N GLU A 154 8.005 11.038 -9.394 1.00 52.13 N ATOM 2564 CA GLU A 154 6.804 11.895 -9.567 1.00 44.01 C ATOM 2565 C GLU A 154 6.445 12.537 -8.229 1.00 71.10 C ATOM 2566 O GLU A 154 6.747 11.982 -7.187 1.00 62.21 O ATOM 2567 CB GLU A 154 5.586 11.103 -10.126 1.00 1.05 C ATOM 2568 CG GLU A 154 5.618 10.876 -11.657 1.00 24.05 C ATOM 2569 CD GLU A 154 4.282 10.381 -12.252 1.00 22.10 C ATOM 2570 OE1 GLU A 154 3.207 10.694 -11.691 1.00 75.42 O ATOM 2571 OE2 GLU A 154 4.293 9.710 -13.306 1.00 60.21 O ATOM 0 H GLU A 154 7.805 10.131 -8.973 1.00 52.13 H new ATOM 0 HA GLU A 154 7.046 12.665 -10.300 1.00 44.01 H new ATOM 0 HB2 GLU A 154 5.539 10.134 -9.628 1.00 1.05 H new ATOM 0 HB3 GLU A 154 4.672 11.638 -9.869 1.00 1.05 H new ATOM 0 HG2 GLU A 154 5.897 11.810 -12.146 1.00 24.05 H new ATOM 0 HG3 GLU A 154 6.397 10.150 -11.889 1.00 24.05 H new ATOM 2578 N LYS A 155 5.790 13.702 -8.279 1.00 14.21 N ATOM 2579 CA LYS A 155 5.447 14.488 -7.078 1.00 74.50 C ATOM 2580 C LYS A 155 4.291 13.836 -6.313 1.00 14.42 C ATOM 2581 O LYS A 155 3.290 13.423 -6.910 1.00 4.11 O ATOM 2582 CB LYS A 155 5.103 15.961 -7.460 1.00 41.24 C ATOM 2583 CG LYS A 155 6.337 16.864 -7.707 1.00 1.14 C ATOM 2584 CD LYS A 155 7.221 16.395 -8.880 1.00 42.11 C ATOM 2585 CE LYS A 155 6.586 16.653 -10.259 1.00 4.12 C ATOM 2586 NZ LYS A 155 6.518 18.103 -10.588 1.00 33.04 N ATOM 0 H LYS A 155 5.481 14.131 -9.151 1.00 14.21 H new ATOM 0 HA LYS A 155 6.318 14.504 -6.422 1.00 74.50 H new ATOM 0 HB2 LYS A 155 4.486 15.956 -8.359 1.00 41.24 H new ATOM 0 HB3 LYS A 155 4.501 16.399 -6.663 1.00 41.24 H new ATOM 0 HG2 LYS A 155 5.999 17.882 -7.902 1.00 1.14 H new ATOM 0 HG3 LYS A 155 6.940 16.897 -6.799 1.00 1.14 H new ATOM 0 HD2 LYS A 155 8.183 16.906 -8.829 1.00 42.11 H new ATOM 0 HD3 LYS A 155 7.420 15.329 -8.773 1.00 42.11 H new ATOM 0 HE2 LYS A 155 7.164 16.136 -11.025 1.00 4.12 H new ATOM 0 HE3 LYS A 155 5.581 16.231 -10.278 1.00 4.12 H new ATOM 0 HZ1 LYS A 155 6.211 18.221 -11.575 1.00 33.04 H new ATOM 0 HZ2 LYS A 155 5.838 18.571 -9.955 1.00 33.04 H new ATOM 0 HZ3 LYS A 155 7.458 18.531 -10.464 1.00 33.04 H new ATOM 2600 N TYR A 156 4.456 13.744 -4.991 1.00 33.45 N ATOM 2601 CA TYR A 156 3.459 13.149 -4.089 1.00 73.21 C ATOM 2602 C TYR A 156 2.648 14.255 -3.401 1.00 30.00 C ATOM 2603 O TYR A 156 3.193 15.062 -2.636 1.00 13.33 O ATOM 2604 CB TYR A 156 4.157 12.243 -3.034 1.00 73.21 C ATOM 2605 CG TYR A 156 3.217 11.549 -2.024 1.00 74.34 C ATOM 2606 CD1 TYR A 156 2.015 10.974 -2.437 1.00 14.04 C ATOM 2607 CD2 TYR A 156 3.525 11.471 -0.665 1.00 1.04 C ATOM 2608 CE1 TYR A 156 1.169 10.360 -1.540 1.00 12.02 C ATOM 2609 CE2 TYR A 156 2.674 10.848 0.231 1.00 43.13 C ATOM 2610 CZ TYR A 156 1.496 10.296 -0.213 1.00 54.23 C ATOM 2611 OH TYR A 156 0.634 9.681 0.675 1.00 54.13 O ATOM 0 H TYR A 156 5.290 14.082 -4.510 1.00 33.45 H new ATOM 0 HA TYR A 156 2.778 12.530 -4.673 1.00 73.21 H new ATOM 0 HB2 TYR A 156 4.726 11.476 -3.560 1.00 73.21 H new ATOM 0 HB3 TYR A 156 4.874 12.848 -2.479 1.00 73.21 H new ATOM 0 HD1 TYR A 156 1.742 11.011 -3.481 1.00 14.04 H new ATOM 0 HD2 TYR A 156 4.446 11.906 -0.305 1.00 1.04 H new ATOM 0 HE1 TYR A 156 0.242 9.927 -1.886 1.00 12.02 H new ATOM 0 HE2 TYR A 156 2.935 10.796 1.278 1.00 43.13 H new ATOM 0 HH TYR A 156 0.275 8.864 0.270 1.00 54.13 H new ATOM 2621 N ASN A 157 1.338 14.285 -3.690 1.00 73.34 N ATOM 2622 CA ASN A 157 0.374 15.120 -2.970 1.00 14.10 C ATOM 2623 C ASN A 157 -0.120 14.317 -1.767 1.00 55.13 C ATOM 2624 O ASN A 157 -1.032 13.490 -1.904 1.00 60.50 O ATOM 2625 CB ASN A 157 -0.825 15.520 -3.884 1.00 42.32 C ATOM 2626 CG ASN A 157 -0.459 16.439 -5.053 1.00 40.31 C ATOM 2627 OD1 ASN A 157 0.670 16.444 -5.550 1.00 31.33 O ATOM 2628 ND2 ASN A 157 -1.435 17.201 -5.529 1.00 74.21 N ATOM 0 H ASN A 157 0.919 13.727 -4.434 1.00 73.34 H new ATOM 0 HA ASN A 157 0.852 16.046 -2.650 1.00 14.10 H new ATOM 0 HB2 ASN A 157 -1.280 14.613 -4.281 1.00 42.32 H new ATOM 0 HB3 ASN A 157 -1.581 16.014 -3.274 1.00 42.32 H new ATOM 0 HD21 ASN A 157 -1.262 17.812 -6.327 1.00 74.21 H new ATOM 0 HD22 ASN A 157 -2.359 17.176 -5.097 1.00 74.21 H new ATOM 2635 N LEU A 158 0.548 14.508 -0.612 1.00 55.10 N ATOM 2636 CA LEU A 158 0.166 13.859 0.656 1.00 43.35 C ATOM 2637 C LEU A 158 -1.285 14.225 1.009 1.00 24.41 C ATOM 2638 O LEU A 158 -2.113 13.351 1.286 1.00 3.44 O ATOM 2639 CB LEU A 158 1.149 14.276 1.783 1.00 51.24 C ATOM 2640 CG LEU A 158 0.874 13.687 3.210 1.00 71.33 C ATOM 2641 CD1 LEU A 158 0.847 12.145 3.201 1.00 21.03 C ATOM 2642 CD2 LEU A 158 1.906 14.218 4.228 1.00 51.14 C ATOM 0 H LEU A 158 1.364 15.114 -0.533 1.00 55.10 H new ATOM 0 HA LEU A 158 0.225 12.776 0.547 1.00 43.35 H new ATOM 0 HB2 LEU A 158 2.155 13.984 1.482 1.00 51.24 H new ATOM 0 HB3 LEU A 158 1.141 15.364 1.856 1.00 51.24 H new ATOM 0 HG LEU A 158 -0.116 14.023 3.517 1.00 71.33 H new ATOM 0 HD11 LEU A 158 0.654 11.779 4.209 1.00 21.03 H new ATOM 0 HD12 LEU A 158 0.059 11.799 2.532 1.00 21.03 H new ATOM 0 HD13 LEU A 158 1.809 11.766 2.856 1.00 21.03 H new ATOM 0 HD21 LEU A 158 1.697 13.797 5.211 1.00 51.14 H new ATOM 0 HD22 LEU A 158 2.909 13.928 3.915 1.00 51.14 H new ATOM 0 HD23 LEU A 158 1.842 15.305 4.278 1.00 51.14 H new ATOM 2654 N PHE A 159 -1.573 15.530 0.941 1.00 3.33 N ATOM 2655 CA PHE A 159 -2.934 16.066 1.031 1.00 44.21 C ATOM 2656 C PHE A 159 -3.420 16.376 -0.398 1.00 33.03 C ATOM 2657 O PHE A 159 -3.161 17.462 -0.927 1.00 33.22 O ATOM 2658 CB PHE A 159 -2.968 17.354 1.904 1.00 14.31 C ATOM 2659 CG PHE A 159 -2.414 17.190 3.322 1.00 55.11 C ATOM 2660 CD1 PHE A 159 -1.045 17.317 3.578 1.00 12.30 C ATOM 2661 CD2 PHE A 159 -3.260 16.923 4.402 1.00 72.24 C ATOM 2662 CE1 PHE A 159 -0.544 17.181 4.858 1.00 53.54 C ATOM 2663 CE2 PHE A 159 -2.753 16.790 5.679 1.00 25.43 C ATOM 2664 CZ PHE A 159 -1.398 16.918 5.908 1.00 40.25 C ATOM 0 H PHE A 159 -0.860 16.250 0.821 1.00 3.33 H new ATOM 0 HA PHE A 159 -3.588 15.333 1.504 1.00 44.21 H new ATOM 0 HB2 PHE A 159 -2.400 18.134 1.396 1.00 14.31 H new ATOM 0 HB3 PHE A 159 -3.999 17.702 1.971 1.00 14.31 H new ATOM 0 HD1 PHE A 159 -0.369 17.525 2.762 1.00 12.30 H new ATOM 0 HD2 PHE A 159 -4.322 16.820 4.236 1.00 72.24 H new ATOM 0 HE1 PHE A 159 0.517 17.281 5.036 1.00 53.54 H new ATOM 0 HE2 PHE A 159 -3.420 16.585 6.503 1.00 25.43 H new ATOM 0 HZ PHE A 159 -1.007 16.812 6.909 1.00 40.25 H new