USER MOD reduce.3.24.130724 H: found=0, std=0, add=1029, rem=0, adj=40 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 155 LYS NZ :NH3+ -112:sc= 1.16 (180deg=0) USER MOD Set 1.2: A 157 ASN : amide:sc= 0.767 K(o=1.9,f=-4) USER MOD Set 2.1: A 131 HIS : no HD1:sc= -0.332 K(o=-6,f=-8.9) USER MOD Set 2.2: A 142 CYS SG : rot 130:sc= -0.528 USER MOD Set 2.3: A 143 CYS SG : rot 147:sc= 0.19 USER MOD Set 2.4: A 145 GLN :FLIP amide:sc= 0.995 F(o=-10,f=-6) USER MOD Set 2.5: A 153 CYS SG : rot 126:sc= -6.36! USER MOD Set 3.1: A 94 HIS : no HD1:sc= -0.543 K(o=-0.63,f=-1.3) USER MOD Set 3.2: A 97 ASN : amide:sc= -0.0896 K(o=-0.63,f=-3.5) USER MOD Single : A 15 THR OG1 : rot 34:sc= 0.975 USER MOD Single : A 23 LYS NZ :NH3+ -174:sc= 0.532 (180deg=0.478) USER MOD Single : A 25 SER OG : rot 74:sc= 0.303 USER MOD Single : A 35 ASN : amide:sc= -0.282 X(o=-0.28,f=0) USER MOD Single : A 36 TYR OH : rot 165:sc= -1.01 USER MOD Single : A 37 LYS NZ :NH3+ -148:sc= -0.799 (180deg=-2.08!) USER MOD Single : A 44 THR OG1 : rot -37:sc= 0.851 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 MET CE :methyl -167:sc= -0.0295 (180deg=-0.284) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ -124:sc= 0.87 (180deg=-0.444) USER MOD Single : A 71 CYS SG : rot 75:sc= 0.458 USER MOD Single : A 76 LYS NZ :NH3+ -110:sc= 1.06 (180deg=-0.0943) USER MOD Single : A 84 CYS SG : rot -157:sc= -3.26 USER MOD Single : A 85 GLN : amide:sc= -0.884 X(o=-0.88,f=-0.41) USER MOD Single : A 86 ASN : amide:sc= -0.361 K(o=-0.36,f=-4.9!) USER MOD Single : A 87 LYS NZ :NH3+ -172:sc=-0.00802 (180deg=-0.0997) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 GLN :FLIP amide:sc= 0.33 F(o=-0.76,f=0.33) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot -40:sc= 0.705 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) USER MOD Single : A 108 SER OG : rot -150:sc= -1.37 USER MOD Single : A 114 LYS NZ :NH3+ -176:sc= 0.124 (180deg=0.112) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ -110:sc= 1.01 (180deg=-0.046) USER MOD Single : A 121 LYS NZ :NH3+ -171:sc= 0.443 (180deg=0.407) USER MOD Single : A 122 ASN : amide:sc= 0.504 K(o=0.5,f=0) USER MOD Single : A 123 ASN : amide:sc= 0.14 K(o=0.14,f=-0.49) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 125 ASN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 127 MET CE :methyl -174:sc= -0.449 (180deg=-0.606) USER MOD Single : A 129 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.053) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 142:sc= -0.063 (180deg=-1.18!) USER MOD Single : A 136 THR OG1 : rot 180:sc= 0.376 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN : amide:sc= -1.93 K(o=-1.9,f=-11!) USER MOD Single : A 146 THR OG1 : rot -30:sc= 0.357 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 TYR OH : rot 48:sc= 0.587 USER MOD ----------------------------------------------------------------- ATOM 229 N THR A 15 -10.342 -1.657 14.797 1.00 52.04 N ATOM 230 CA THR A 15 -9.681 -1.587 13.483 1.00 51.14 C ATOM 231 C THR A 15 -10.352 -0.523 12.584 1.00 53.01 C ATOM 232 O THR A 15 -11.587 -0.441 12.511 1.00 63.42 O ATOM 233 CB THR A 15 -9.659 -2.989 12.761 1.00 71.12 C ATOM 234 OG1 THR A 15 -9.090 -2.875 11.440 1.00 21.12 O ATOM 235 CG2 THR A 15 -11.056 -3.634 12.666 1.00 33.01 C ATOM 0 HA THR A 15 -8.647 -1.291 13.658 1.00 51.14 H new ATOM 0 HB THR A 15 -9.037 -3.639 13.376 1.00 71.12 H new ATOM 0 HG1 THR A 15 -8.386 -2.194 11.445 1.00 21.12 H new ATOM 0 HG21 THR A 15 -10.979 -4.596 12.160 1.00 33.01 H new ATOM 0 HG22 THR A 15 -11.457 -3.782 13.669 1.00 33.01 H new ATOM 0 HG23 THR A 15 -11.721 -2.980 12.102 1.00 33.01 H new ATOM 243 N ILE A 16 -9.512 0.317 11.951 1.00 0.20 N ATOM 244 CA ILE A 16 -9.951 1.362 11.007 1.00 21.42 C ATOM 245 C ILE A 16 -10.576 0.710 9.759 1.00 34.21 C ATOM 246 O ILE A 16 -11.625 1.154 9.269 1.00 13.41 O ATOM 247 CB ILE A 16 -8.749 2.300 10.586 1.00 1.10 C ATOM 248 CG1 ILE A 16 -8.052 2.888 11.857 1.00 21.30 C ATOM 249 CG2 ILE A 16 -9.216 3.429 9.622 1.00 64.44 C ATOM 250 CD1 ILE A 16 -6.860 3.790 11.582 1.00 72.41 C ATOM 0 H ILE A 16 -8.501 0.289 12.081 1.00 0.20 H new ATOM 0 HA ILE A 16 -10.698 1.979 11.507 1.00 21.42 H new ATOM 0 HB ILE A 16 -8.021 1.698 10.042 1.00 1.10 H new ATOM 0 HG12 ILE A 16 -8.790 3.451 12.428 1.00 21.30 H new ATOM 0 HG13 ILE A 16 -7.724 2.061 12.487 1.00 21.30 H new ATOM 0 HG21 ILE A 16 -8.364 4.054 9.354 1.00 64.44 H new ATOM 0 HG22 ILE A 16 -9.639 2.986 8.721 1.00 64.44 H new ATOM 0 HG23 ILE A 16 -9.972 4.039 10.116 1.00 64.44 H new ATOM 0 HD11 ILE A 16 -6.448 4.146 12.526 1.00 72.41 H new ATOM 0 HD12 ILE A 16 -6.097 3.230 11.041 1.00 72.41 H new ATOM 0 HD13 ILE A 16 -7.179 4.642 10.981 1.00 72.41 H new ATOM 262 N LEU A 17 -9.932 -0.370 9.282 1.00 20.21 N ATOM 263 CA LEU A 17 -10.369 -1.092 8.078 1.00 23.31 C ATOM 264 C LEU A 17 -9.628 -2.431 7.969 1.00 3.33 C ATOM 265 O LEU A 17 -8.415 -2.480 8.163 1.00 40.21 O ATOM 266 CB LEU A 17 -10.116 -0.215 6.812 1.00 10.04 C ATOM 267 CG LEU A 17 -10.665 -0.750 5.448 1.00 21.14 C ATOM 268 CD1 LEU A 17 -12.165 -1.121 5.523 1.00 33.53 C ATOM 269 CD2 LEU A 17 -10.400 0.284 4.329 1.00 70.44 C ATOM 0 H LEU A 17 -9.099 -0.764 9.719 1.00 20.21 H new ATOM 0 HA LEU A 17 -11.437 -1.296 8.150 1.00 23.31 H new ATOM 0 HB2 LEU A 17 -10.553 0.768 6.989 1.00 10.04 H new ATOM 0 HB3 LEU A 17 -9.040 -0.072 6.710 1.00 10.04 H new ATOM 0 HG LEU A 17 -10.131 -1.671 5.213 1.00 21.14 H new ATOM 0 HD11 LEU A 17 -12.498 -1.487 4.552 1.00 33.53 H new ATOM 0 HD12 LEU A 17 -12.310 -1.898 6.273 1.00 33.53 H new ATOM 0 HD13 LEU A 17 -12.745 -0.239 5.797 1.00 33.53 H new ATOM 0 HD21 LEU A 17 -10.785 -0.097 3.383 1.00 70.44 H new ATOM 0 HD22 LEU A 17 -10.900 1.221 4.574 1.00 70.44 H new ATOM 0 HD23 LEU A 17 -9.328 0.457 4.240 1.00 70.44 H new ATOM 281 N GLU A 18 -10.370 -3.509 7.676 1.00 22.11 N ATOM 282 CA GLU A 18 -9.794 -4.830 7.354 1.00 25.24 C ATOM 283 C GLU A 18 -10.328 -5.282 5.988 1.00 24.22 C ATOM 284 O GLU A 18 -11.447 -4.911 5.597 1.00 15.35 O ATOM 285 CB GLU A 18 -10.116 -5.900 8.441 1.00 14.25 C ATOM 286 CG GLU A 18 -11.584 -6.395 8.513 1.00 51.33 C ATOM 287 CD GLU A 18 -12.578 -5.351 9.055 1.00 41.31 C ATOM 288 OE1 GLU A 18 -12.789 -5.309 10.284 1.00 72.24 O ATOM 289 OE2 GLU A 18 -13.160 -4.578 8.255 1.00 45.11 O ATOM 0 H GLU A 18 -11.390 -3.493 7.655 1.00 22.11 H new ATOM 0 HA GLU A 18 -8.709 -4.731 7.325 1.00 25.24 H new ATOM 0 HB2 GLU A 18 -9.473 -6.763 8.270 1.00 14.25 H new ATOM 0 HB3 GLU A 18 -9.847 -5.489 9.414 1.00 14.25 H new ATOM 0 HG2 GLU A 18 -11.902 -6.699 7.516 1.00 51.33 H new ATOM 0 HG3 GLU A 18 -11.626 -7.282 9.145 1.00 51.33 H new ATOM 296 N GLU A 19 -9.514 -6.053 5.259 1.00 71.31 N ATOM 297 CA GLU A 19 -9.883 -6.586 3.938 1.00 35.22 C ATOM 298 C GLU A 19 -8.930 -7.709 3.528 1.00 72.30 C ATOM 299 O GLU A 19 -7.762 -7.735 3.954 1.00 43.54 O ATOM 300 CB GLU A 19 -9.860 -5.446 2.880 1.00 33.24 C ATOM 301 CG GLU A 19 -10.244 -5.845 1.439 1.00 20.34 C ATOM 302 CD GLU A 19 -11.674 -6.393 1.308 1.00 62.01 C ATOM 303 OE1 GLU A 19 -12.626 -5.590 1.300 1.00 12.31 O ATOM 304 OE2 GLU A 19 -11.846 -7.627 1.197 1.00 52.41 O ATOM 0 H GLU A 19 -8.580 -6.327 5.566 1.00 71.31 H new ATOM 0 HA GLU A 19 -10.892 -6.995 3.995 1.00 35.22 H new ATOM 0 HB2 GLU A 19 -10.538 -4.659 3.210 1.00 33.24 H new ATOM 0 HB3 GLU A 19 -8.858 -5.016 2.861 1.00 33.24 H new ATOM 0 HG2 GLU A 19 -10.137 -4.976 0.790 1.00 20.34 H new ATOM 0 HG3 GLU A 19 -9.542 -6.598 1.081 1.00 20.34 H new ATOM 311 N ILE A 20 -9.441 -8.637 2.703 1.00 63.12 N ATOM 312 CA ILE A 20 -8.626 -9.624 2.015 1.00 22.41 C ATOM 313 C ILE A 20 -7.991 -8.930 0.780 1.00 74.33 C ATOM 314 O ILE A 20 -8.604 -8.816 -0.297 1.00 22.32 O ATOM 315 CB ILE A 20 -9.497 -10.874 1.603 1.00 23.44 C ATOM 316 CG1 ILE A 20 -10.146 -11.559 2.853 1.00 65.03 C ATOM 317 CG2 ILE A 20 -8.691 -11.897 0.777 1.00 62.14 C ATOM 318 CD1 ILE A 20 -9.167 -12.235 3.811 1.00 23.14 C ATOM 0 H ILE A 20 -10.438 -8.715 2.500 1.00 63.12 H new ATOM 0 HA ILE A 20 -7.838 -9.998 2.668 1.00 22.41 H new ATOM 0 HB ILE A 20 -10.299 -10.499 0.967 1.00 23.44 H new ATOM 0 HG12 ILE A 20 -10.709 -10.808 3.406 1.00 65.03 H new ATOM 0 HG13 ILE A 20 -10.863 -12.304 2.507 1.00 65.03 H new ATOM 0 HG21 ILE A 20 -9.331 -12.740 0.516 1.00 62.14 H new ATOM 0 HG22 ILE A 20 -8.327 -11.423 -0.134 1.00 62.14 H new ATOM 0 HG23 ILE A 20 -7.844 -12.253 1.364 1.00 62.14 H new ATOM 0 HD11 ILE A 20 -9.717 -12.678 4.641 1.00 23.14 H new ATOM 0 HD12 ILE A 20 -8.620 -13.015 3.282 1.00 23.14 H new ATOM 0 HD13 ILE A 20 -8.464 -11.495 4.195 1.00 23.14 H new ATOM 330 N LEU A 21 -6.788 -8.390 0.999 1.00 35.12 N ATOM 331 CA LEU A 21 -5.971 -7.733 -0.028 1.00 51.44 C ATOM 332 C LEU A 21 -4.830 -8.672 -0.415 1.00 73.33 C ATOM 333 O LEU A 21 -4.335 -9.427 0.424 1.00 53.14 O ATOM 334 CB LEU A 21 -5.357 -6.425 0.516 1.00 1.23 C ATOM 335 CG LEU A 21 -6.323 -5.311 1.004 1.00 52.14 C ATOM 336 CD1 LEU A 21 -5.545 -4.209 1.751 1.00 11.31 C ATOM 337 CD2 LEU A 21 -7.118 -4.711 -0.164 1.00 34.33 C ATOM 0 H LEU A 21 -6.344 -8.397 1.917 1.00 35.12 H new ATOM 0 HA LEU A 21 -6.602 -7.502 -0.886 1.00 51.44 H new ATOM 0 HB2 LEU A 21 -4.701 -6.685 1.347 1.00 1.23 H new ATOM 0 HB3 LEU A 21 -4.728 -6.001 -0.267 1.00 1.23 H new ATOM 0 HG LEU A 21 -7.034 -5.765 1.694 1.00 52.14 H new ATOM 0 HD11 LEU A 21 -6.238 -3.437 2.085 1.00 11.31 H new ATOM 0 HD12 LEU A 21 -5.040 -4.642 2.614 1.00 11.31 H new ATOM 0 HD13 LEU A 21 -4.806 -3.768 1.082 1.00 11.31 H new ATOM 0 HD21 LEU A 21 -7.785 -3.934 0.211 1.00 34.33 H new ATOM 0 HD22 LEU A 21 -6.429 -4.279 -0.889 1.00 34.33 H new ATOM 0 HD23 LEU A 21 -7.706 -5.493 -0.644 1.00 34.33 H new ATOM 349 N ILE A 22 -4.381 -8.596 -1.661 1.00 24.44 N ATOM 350 CA ILE A 22 -3.289 -9.438 -2.153 1.00 71.30 C ATOM 351 C ILE A 22 -1.956 -8.669 -2.151 1.00 61.54 C ATOM 352 O ILE A 22 -1.853 -7.585 -2.704 1.00 14.44 O ATOM 353 CB ILE A 22 -3.648 -10.037 -3.564 1.00 12.21 C ATOM 354 CG1 ILE A 22 -4.790 -11.096 -3.377 1.00 64.01 C ATOM 355 CG2 ILE A 22 -2.411 -10.631 -4.283 1.00 44.10 C ATOM 356 CD1 ILE A 22 -5.207 -11.844 -4.622 1.00 23.33 C ATOM 0 H ILE A 22 -4.758 -7.954 -2.358 1.00 24.44 H new ATOM 0 HA ILE A 22 -3.158 -10.281 -1.474 1.00 71.30 H new ATOM 0 HB ILE A 22 -4.000 -9.237 -4.215 1.00 12.21 H new ATOM 0 HG12 ILE A 22 -4.467 -11.822 -2.631 1.00 64.01 H new ATOM 0 HG13 ILE A 22 -5.665 -10.590 -2.970 1.00 64.01 H new ATOM 0 HG21 ILE A 22 -2.711 -11.031 -5.252 1.00 44.10 H new ATOM 0 HG22 ILE A 22 -1.665 -9.850 -4.428 1.00 44.10 H new ATOM 0 HG23 ILE A 22 -1.986 -11.430 -3.676 1.00 44.10 H new ATOM 0 HD11 ILE A 22 -6.001 -12.548 -4.374 1.00 23.33 H new ATOM 0 HD12 ILE A 22 -5.569 -11.136 -5.368 1.00 23.33 H new ATOM 0 HD13 ILE A 22 -4.352 -12.388 -5.023 1.00 23.33 H new ATOM 368 N LYS A 23 -0.967 -9.240 -1.456 1.00 51.50 N ATOM 369 CA LYS A 23 0.416 -8.747 -1.410 1.00 21.33 C ATOM 370 C LYS A 23 1.243 -9.427 -2.522 1.00 1.11 C ATOM 371 O LYS A 23 1.087 -10.627 -2.756 1.00 22.32 O ATOM 372 CB LYS A 23 1.009 -9.095 -0.012 1.00 21.00 C ATOM 373 CG LYS A 23 2.515 -8.799 0.153 1.00 65.53 C ATOM 374 CD LYS A 23 3.103 -9.355 1.469 1.00 41.44 C ATOM 375 CE LYS A 23 4.627 -9.129 1.576 1.00 42.11 C ATOM 376 NZ LYS A 23 5.371 -9.744 0.442 1.00 15.34 N ATOM 0 H LYS A 23 -1.108 -10.080 -0.895 1.00 51.50 H new ATOM 0 HA LYS A 23 0.443 -7.669 -1.567 1.00 21.33 H new ATOM 0 HB2 LYS A 23 0.460 -8.538 0.747 1.00 21.00 H new ATOM 0 HB3 LYS A 23 0.839 -10.154 0.184 1.00 21.00 H new ATOM 0 HG2 LYS A 23 3.058 -9.228 -0.690 1.00 65.53 H new ATOM 0 HG3 LYS A 23 2.673 -7.721 0.119 1.00 65.53 H new ATOM 0 HD2 LYS A 23 2.608 -8.878 2.315 1.00 41.44 H new ATOM 0 HD3 LYS A 23 2.891 -10.422 1.536 1.00 41.44 H new ATOM 0 HE2 LYS A 23 4.832 -8.059 1.604 1.00 42.11 H new ATOM 0 HE3 LYS A 23 4.989 -9.548 2.515 1.00 42.11 H new ATOM 0 HZ1 LYS A 23 6.394 -9.655 0.609 1.00 15.34 H new ATOM 0 HZ2 LYS A 23 5.119 -10.750 0.366 1.00 15.34 H new ATOM 0 HZ3 LYS A 23 5.121 -9.257 -0.442 1.00 15.34 H new ATOM 390 N ARG A 24 2.128 -8.665 -3.191 1.00 63.12 N ATOM 391 CA ARG A 24 3.084 -9.236 -4.160 1.00 41.21 C ATOM 392 C ARG A 24 4.316 -9.758 -3.397 1.00 74.15 C ATOM 393 O ARG A 24 4.704 -9.195 -2.362 1.00 31.31 O ATOM 394 CB ARG A 24 3.527 -8.174 -5.213 1.00 44.02 C ATOM 395 CG ARG A 24 4.334 -8.759 -6.401 1.00 41.34 C ATOM 396 CD ARG A 24 4.955 -7.682 -7.311 1.00 23.40 C ATOM 397 NE ARG A 24 5.996 -6.893 -6.619 1.00 74.45 N ATOM 398 CZ ARG A 24 7.029 -6.264 -7.216 1.00 75.41 C ATOM 399 NH1 ARG A 24 7.192 -6.304 -8.543 1.00 52.11 N ATOM 400 NH2 ARG A 24 7.902 -5.596 -6.469 1.00 72.24 N ATOM 0 H ARG A 24 2.201 -7.654 -3.079 1.00 63.12 H new ATOM 0 HA ARG A 24 2.596 -10.052 -4.693 1.00 41.21 H new ATOM 0 HB2 ARG A 24 2.641 -7.672 -5.602 1.00 44.02 H new ATOM 0 HB3 ARG A 24 4.131 -7.415 -4.716 1.00 44.02 H new ATOM 0 HG2 ARG A 24 5.128 -9.397 -6.012 1.00 41.34 H new ATOM 0 HG3 ARG A 24 3.679 -9.394 -6.998 1.00 41.34 H new ATOM 0 HD2 ARG A 24 5.388 -8.159 -8.190 1.00 23.40 H new ATOM 0 HD3 ARG A 24 4.171 -7.013 -7.665 1.00 23.40 H new ATOM 0 HE ARG A 24 5.927 -6.818 -5.604 1.00 74.45 H new ATOM 0 HH11 ARG A 24 6.528 -6.817 -9.123 1.00 52.11 H new ATOM 0 HH12 ARG A 24 7.980 -5.821 -8.975 1.00 52.11 H new ATOM 0 HH21 ARG A 24 7.787 -5.563 -5.456 1.00 72.24 H new ATOM 0 HH22 ARG A 24 8.687 -5.116 -6.909 1.00 72.24 H new ATOM 414 N SER A 25 4.929 -10.821 -3.924 1.00 31.21 N ATOM 415 CA SER A 25 6.143 -11.413 -3.358 1.00 73.33 C ATOM 416 C SER A 25 7.336 -10.698 -4.001 1.00 4.13 C ATOM 417 O SER A 25 7.412 -10.621 -5.229 1.00 62.13 O ATOM 418 CB SER A 25 6.179 -12.927 -3.656 1.00 4.45 C ATOM 419 OG SER A 25 4.932 -13.528 -3.343 1.00 60.21 O ATOM 0 H SER A 25 4.594 -11.298 -4.761 1.00 31.21 H new ATOM 0 HA SER A 25 6.172 -11.294 -2.275 1.00 73.33 H new ATOM 0 HB2 SER A 25 6.414 -13.091 -4.708 1.00 4.45 H new ATOM 0 HB3 SER A 25 6.972 -13.399 -3.075 1.00 4.45 H new ATOM 0 HG SER A 25 4.271 -13.282 -4.023 1.00 60.21 H new ATOM 583 N ASN A 35 5.124 -13.785 -6.972 1.00 12.12 N ATOM 584 CA ASN A 35 3.780 -14.379 -6.924 1.00 4.35 C ATOM 585 C ASN A 35 2.805 -13.426 -6.219 1.00 70.44 C ATOM 586 O ASN A 35 3.212 -12.430 -5.616 1.00 22.32 O ATOM 587 CB ASN A 35 3.832 -15.747 -6.180 1.00 1.52 C ATOM 588 CG ASN A 35 4.760 -16.800 -6.821 1.00 75.13 C ATOM 589 OD1 ASN A 35 5.323 -17.650 -6.123 1.00 2.42 O ATOM 590 ND2 ASN A 35 4.916 -16.781 -8.147 1.00 24.35 N ATOM 0 HA ASN A 35 3.428 -14.544 -7.942 1.00 4.35 H new ATOM 0 HB2 ASN A 35 4.157 -15.574 -5.154 1.00 1.52 H new ATOM 0 HB3 ASN A 35 2.823 -16.156 -6.130 1.00 1.52 H new ATOM 0 HD21 ASN A 35 5.508 -17.476 -8.601 1.00 24.35 H new ATOM 0 HD22 ASN A 35 4.443 -16.071 -8.706 1.00 24.35 H new ATOM 597 N TYR A 36 1.514 -13.743 -6.303 1.00 54.43 N ATOM 598 CA TYR A 36 0.438 -12.959 -5.680 1.00 64.51 C ATOM 599 C TYR A 36 -0.123 -13.763 -4.510 1.00 31.15 C ATOM 600 O TYR A 36 -0.476 -14.937 -4.671 1.00 51.24 O ATOM 601 CB TYR A 36 -0.648 -12.650 -6.738 1.00 64.02 C ATOM 602 CG TYR A 36 -0.099 -11.851 -7.929 1.00 32.22 C ATOM 603 CD1 TYR A 36 0.008 -10.459 -7.873 1.00 44.22 C ATOM 604 CD2 TYR A 36 0.349 -12.489 -9.090 1.00 33.13 C ATOM 605 CE1 TYR A 36 0.530 -9.742 -8.929 1.00 14.11 C ATOM 606 CE2 TYR A 36 0.878 -11.768 -10.142 1.00 12.24 C ATOM 607 CZ TYR A 36 0.965 -10.399 -10.055 1.00 21.42 C ATOM 608 OH TYR A 36 1.493 -9.686 -11.106 1.00 70.02 O ATOM 0 H TYR A 36 1.177 -14.561 -6.811 1.00 54.43 H new ATOM 0 HA TYR A 36 0.811 -12.007 -5.303 1.00 64.51 H new ATOM 0 HB2 TYR A 36 -1.076 -13.585 -7.099 1.00 64.02 H new ATOM 0 HB3 TYR A 36 -1.457 -12.089 -6.270 1.00 64.02 H new ATOM 0 HD1 TYR A 36 -0.324 -9.936 -6.988 1.00 44.22 H new ATOM 0 HD2 TYR A 36 0.280 -13.564 -9.165 1.00 33.13 H new ATOM 0 HE1 TYR A 36 0.597 -8.666 -8.871 1.00 14.11 H new ATOM 0 HE2 TYR A 36 1.222 -12.278 -11.030 1.00 12.24 H new ATOM 0 HH TYR A 36 1.966 -10.296 -11.710 1.00 70.02 H new ATOM 618 N LYS A 37 -0.193 -13.136 -3.330 1.00 73.41 N ATOM 619 CA LYS A 37 -0.534 -13.821 -2.081 1.00 62.24 C ATOM 620 C LYS A 37 -1.746 -13.173 -1.414 1.00 62.13 C ATOM 621 O LYS A 37 -1.731 -11.989 -1.101 1.00 14.12 O ATOM 622 CB LYS A 37 0.675 -13.825 -1.114 1.00 52.21 C ATOM 623 CG LYS A 37 0.416 -14.573 0.213 1.00 1.15 C ATOM 624 CD LYS A 37 -0.037 -16.054 0.056 1.00 50.44 C ATOM 625 CE LYS A 37 1.021 -17.001 -0.563 1.00 43.51 C ATOM 626 NZ LYS A 37 1.227 -16.802 -2.027 1.00 24.10 N ATOM 0 H LYS A 37 -0.014 -12.138 -3.216 1.00 73.41 H new ATOM 0 HA LYS A 37 -0.790 -14.853 -2.323 1.00 62.24 H new ATOM 0 HB2 LYS A 37 1.527 -14.282 -1.616 1.00 52.21 H new ATOM 0 HB3 LYS A 37 0.952 -12.795 -0.890 1.00 52.21 H new ATOM 0 HG2 LYS A 37 1.328 -14.549 0.810 1.00 1.15 H new ATOM 0 HG3 LYS A 37 -0.347 -14.033 0.774 1.00 1.15 H new ATOM 0 HD2 LYS A 37 -0.317 -16.438 1.037 1.00 50.44 H new ATOM 0 HD3 LYS A 37 -0.933 -16.080 -0.564 1.00 50.44 H new ATOM 0 HE2 LYS A 37 1.971 -16.854 -0.049 1.00 43.51 H new ATOM 0 HE3 LYS A 37 0.719 -18.033 -0.385 1.00 43.51 H new ATOM 0 HZ1 LYS A 37 1.474 -17.710 -2.469 1.00 24.10 H new ATOM 0 HZ2 LYS A 37 0.352 -16.435 -2.454 1.00 24.10 H new ATOM 0 HZ3 LYS A 37 1.999 -16.122 -2.180 1.00 24.10 H new ATOM 640 N GLU A 38 -2.756 -14.004 -1.159 1.00 33.21 N ATOM 641 CA GLU A 38 -4.018 -13.594 -0.553 1.00 22.12 C ATOM 642 C GLU A 38 -3.814 -13.400 0.967 1.00 52.13 C ATOM 643 O GLU A 38 -3.457 -14.346 1.680 1.00 3.45 O ATOM 644 CB GLU A 38 -5.075 -14.678 -0.872 1.00 23.42 C ATOM 645 CG GLU A 38 -6.524 -14.277 -0.580 1.00 50.03 C ATOM 646 CD GLU A 38 -7.528 -15.387 -0.931 1.00 3.21 C ATOM 647 OE1 GLU A 38 -7.857 -15.543 -2.126 1.00 33.40 O ATOM 648 OE2 GLU A 38 -7.977 -16.116 -0.017 1.00 13.25 O ATOM 0 H GLU A 38 -2.717 -15.001 -1.373 1.00 33.21 H new ATOM 0 HA GLU A 38 -4.367 -12.643 -0.955 1.00 22.12 H new ATOM 0 HB2 GLU A 38 -4.993 -14.944 -1.926 1.00 23.42 H new ATOM 0 HB3 GLU A 38 -4.839 -15.574 -0.297 1.00 23.42 H new ATOM 0 HG2 GLU A 38 -6.621 -14.025 0.476 1.00 50.03 H new ATOM 0 HG3 GLU A 38 -6.769 -13.378 -1.146 1.00 50.03 H new ATOM 655 N ARG A 39 -3.990 -12.155 1.439 1.00 32.15 N ATOM 656 CA ARG A 39 -3.691 -11.750 2.834 1.00 3.43 C ATOM 657 C ARG A 39 -4.878 -10.991 3.448 1.00 1.23 C ATOM 658 O ARG A 39 -5.582 -10.270 2.752 1.00 32.31 O ATOM 659 CB ARG A 39 -2.437 -10.826 2.870 1.00 72.41 C ATOM 660 CG ARG A 39 -1.084 -11.487 2.521 1.00 5.21 C ATOM 661 CD ARG A 39 -0.713 -12.616 3.497 1.00 5.32 C ATOM 662 NE ARG A 39 0.741 -12.834 3.583 1.00 52.31 N ATOM 663 CZ ARG A 39 1.403 -13.063 4.728 1.00 25.14 C ATOM 664 NH1 ARG A 39 0.753 -13.112 5.885 1.00 31.02 N ATOM 665 NH2 ARG A 39 2.712 -13.211 4.717 1.00 4.41 N ATOM 0 H ARG A 39 -4.346 -11.391 0.864 1.00 32.15 H new ATOM 0 HA ARG A 39 -3.503 -12.656 3.411 1.00 3.43 H new ATOM 0 HB2 ARG A 39 -2.602 -10.000 2.178 1.00 72.41 H new ATOM 0 HB3 ARG A 39 -2.359 -10.395 3.868 1.00 72.41 H new ATOM 0 HG2 ARG A 39 -1.129 -11.887 1.508 1.00 5.21 H new ATOM 0 HG3 ARG A 39 -0.300 -10.730 2.531 1.00 5.21 H new ATOM 0 HD2 ARG A 39 -1.100 -12.377 4.487 1.00 5.32 H new ATOM 0 HD3 ARG A 39 -1.197 -13.540 3.180 1.00 5.32 H new ATOM 0 HE ARG A 39 1.279 -12.809 2.717 1.00 52.31 H new ATOM 0 HH11 ARG A 39 -0.257 -12.975 5.908 1.00 31.02 H new ATOM 0 HH12 ARG A 39 1.264 -13.287 6.750 1.00 31.02 H new ATOM 0 HH21 ARG A 39 3.225 -13.152 3.837 1.00 4.41 H new ATOM 0 HH22 ARG A 39 3.213 -13.385 5.588 1.00 4.41 H new ATOM 679 N LEU A 40 -5.078 -11.156 4.765 1.00 72.44 N ATOM 680 CA LEU A 40 -6.024 -10.339 5.544 1.00 41.02 C ATOM 681 C LEU A 40 -5.262 -9.162 6.179 1.00 62.31 C ATOM 682 O LEU A 40 -4.638 -9.313 7.239 1.00 4.43 O ATOM 683 CB LEU A 40 -6.747 -11.197 6.630 1.00 5.52 C ATOM 684 CG LEU A 40 -7.769 -10.441 7.554 1.00 11.52 C ATOM 685 CD1 LEU A 40 -8.888 -9.742 6.744 1.00 11.52 C ATOM 686 CD2 LEU A 40 -8.363 -11.393 8.617 1.00 63.13 C ATOM 0 H LEU A 40 -4.589 -11.859 5.320 1.00 72.44 H new ATOM 0 HA LEU A 40 -6.796 -9.950 4.881 1.00 41.02 H new ATOM 0 HB2 LEU A 40 -7.275 -12.008 6.128 1.00 5.52 H new ATOM 0 HB3 LEU A 40 -5.988 -11.655 7.264 1.00 5.52 H new ATOM 0 HG LEU A 40 -7.214 -9.657 8.069 1.00 11.52 H new ATOM 0 HD11 LEU A 40 -9.569 -9.234 7.427 1.00 11.52 H new ATOM 0 HD12 LEU A 40 -8.445 -9.014 6.065 1.00 11.52 H new ATOM 0 HD13 LEU A 40 -9.440 -10.486 6.169 1.00 11.52 H new ATOM 0 HD21 LEU A 40 -9.067 -10.845 9.243 1.00 63.13 H new ATOM 0 HD22 LEU A 40 -8.881 -12.214 8.121 1.00 63.13 H new ATOM 0 HD23 LEU A 40 -7.560 -11.792 9.237 1.00 63.13 H new ATOM 698 N PHE A 41 -5.252 -8.011 5.480 1.00 50.22 N ATOM 699 CA PHE A 41 -4.676 -6.767 6.012 1.00 60.31 C ATOM 700 C PHE A 41 -5.672 -6.129 6.998 1.00 61.22 C ATOM 701 O PHE A 41 -6.773 -5.735 6.608 1.00 1.54 O ATOM 702 CB PHE A 41 -4.345 -5.761 4.871 1.00 70.35 C ATOM 703 CG PHE A 41 -3.094 -6.072 4.033 1.00 13.52 C ATOM 704 CD1 PHE A 41 -3.085 -7.103 3.092 1.00 23.33 C ATOM 705 CD2 PHE A 41 -1.929 -5.309 4.171 1.00 22.42 C ATOM 706 CE1 PHE A 41 -1.958 -7.361 2.322 1.00 32.02 C ATOM 707 CE2 PHE A 41 -0.809 -5.568 3.400 1.00 44.44 C ATOM 708 CZ PHE A 41 -0.823 -6.596 2.477 1.00 41.14 C ATOM 0 H PHE A 41 -5.639 -7.920 4.541 1.00 50.22 H new ATOM 0 HA PHE A 41 -3.745 -7.009 6.524 1.00 60.31 H new ATOM 0 HB2 PHE A 41 -5.203 -5.710 4.200 1.00 70.35 H new ATOM 0 HB3 PHE A 41 -4.225 -4.771 5.311 1.00 70.35 H new ATOM 0 HD1 PHE A 41 -3.969 -7.710 2.960 1.00 23.33 H new ATOM 0 HD2 PHE A 41 -1.903 -4.505 4.891 1.00 22.42 H new ATOM 0 HE1 PHE A 41 -1.972 -8.164 1.600 1.00 32.02 H new ATOM 0 HE2 PHE A 41 0.079 -4.965 3.520 1.00 44.44 H new ATOM 0 HZ PHE A 41 0.053 -6.799 1.879 1.00 41.14 H new ATOM 718 N VAL A 42 -5.277 -6.074 8.274 1.00 33.14 N ATOM 719 CA VAL A 42 -6.017 -5.388 9.337 1.00 65.44 C ATOM 720 C VAL A 42 -5.256 -4.102 9.699 1.00 52.25 C ATOM 721 O VAL A 42 -4.079 -4.155 10.082 1.00 1.41 O ATOM 722 CB VAL A 42 -6.182 -6.305 10.608 1.00 23.00 C ATOM 723 CG1 VAL A 42 -6.957 -5.578 11.733 1.00 22.24 C ATOM 724 CG2 VAL A 42 -6.856 -7.649 10.233 1.00 31.23 C ATOM 0 H VAL A 42 -4.417 -6.514 8.603 1.00 33.14 H new ATOM 0 HA VAL A 42 -7.020 -5.149 8.982 1.00 65.44 H new ATOM 0 HB VAL A 42 -5.187 -6.526 10.993 1.00 23.00 H new ATOM 0 HG11 VAL A 42 -7.053 -6.239 12.595 1.00 22.24 H new ATOM 0 HG12 VAL A 42 -6.416 -4.678 12.025 1.00 22.24 H new ATOM 0 HG13 VAL A 42 -7.949 -5.305 11.373 1.00 22.24 H new ATOM 0 HG21 VAL A 42 -6.960 -8.266 11.126 1.00 31.23 H new ATOM 0 HG22 VAL A 42 -7.841 -7.456 9.809 1.00 31.23 H new ATOM 0 HG23 VAL A 42 -6.242 -8.172 9.500 1.00 31.23 H new ATOM 734 N LEU A 43 -5.933 -2.958 9.559 1.00 5.21 N ATOM 735 CA LEU A 43 -5.353 -1.633 9.805 1.00 22.31 C ATOM 736 C LEU A 43 -5.837 -1.105 11.158 1.00 11.14 C ATOM 737 O LEU A 43 -7.035 -0.923 11.366 1.00 73.33 O ATOM 738 CB LEU A 43 -5.762 -0.646 8.673 1.00 34.43 C ATOM 739 CG LEU A 43 -5.338 0.850 8.864 1.00 61.44 C ATOM 740 CD1 LEU A 43 -3.809 1.001 8.995 1.00 31.34 C ATOM 741 CD2 LEU A 43 -5.907 1.735 7.728 1.00 73.22 C ATOM 0 H LEU A 43 -6.910 -2.925 9.268 1.00 5.21 H new ATOM 0 HA LEU A 43 -4.266 -1.718 9.817 1.00 22.31 H new ATOM 0 HB2 LEU A 43 -5.335 -1.005 7.737 1.00 34.43 H new ATOM 0 HB3 LEU A 43 -6.846 -0.682 8.564 1.00 34.43 H new ATOM 0 HG LEU A 43 -5.769 1.198 9.803 1.00 61.44 H new ATOM 0 HD11 LEU A 43 -3.557 2.053 9.126 1.00 31.34 H new ATOM 0 HD12 LEU A 43 -3.460 0.434 9.858 1.00 31.34 H new ATOM 0 HD13 LEU A 43 -3.327 0.622 8.094 1.00 31.34 H new ATOM 0 HD21 LEU A 43 -5.599 2.769 7.883 1.00 73.22 H new ATOM 0 HD22 LEU A 43 -5.528 1.383 6.768 1.00 73.22 H new ATOM 0 HD23 LEU A 43 -6.995 1.676 7.732 1.00 73.22 H new ATOM 753 N THR A 44 -4.900 -0.923 12.081 1.00 43.11 N ATOM 754 CA THR A 44 -5.100 -0.123 13.296 1.00 12.25 C ATOM 755 C THR A 44 -4.290 1.174 13.140 1.00 11.43 C ATOM 756 O THR A 44 -3.397 1.252 12.282 1.00 10.21 O ATOM 757 CB THR A 44 -4.644 -0.890 14.586 1.00 3.43 C ATOM 758 OG1 THR A 44 -3.238 -1.194 14.517 1.00 73.11 O ATOM 759 CG2 THR A 44 -5.442 -2.193 14.790 1.00 44.43 C ATOM 0 H THR A 44 -3.967 -1.329 12.011 1.00 43.11 H new ATOM 0 HA THR A 44 -6.163 0.089 13.415 1.00 12.25 H new ATOM 0 HB THR A 44 -4.837 -0.236 15.436 1.00 3.43 H new ATOM 0 HG1 THR A 44 -2.998 -1.424 13.595 1.00 73.11 H new ATOM 0 HG21 THR A 44 -5.096 -2.694 15.694 1.00 44.43 H new ATOM 0 HG22 THR A 44 -6.502 -1.959 14.888 1.00 44.43 H new ATOM 0 HG23 THR A 44 -5.293 -2.849 13.932 1.00 44.43 H new ATOM 767 N LYS A 45 -4.571 2.174 13.985 1.00 42.30 N ATOM 768 CA LYS A 45 -3.864 3.474 13.946 1.00 20.51 C ATOM 769 C LYS A 45 -2.380 3.349 14.363 1.00 23.30 C ATOM 770 O LYS A 45 -1.599 4.295 14.188 1.00 21.02 O ATOM 771 CB LYS A 45 -4.605 4.509 14.829 1.00 4.24 C ATOM 772 CG LYS A 45 -4.765 4.114 16.318 1.00 41.21 C ATOM 773 CD LYS A 45 -5.560 5.173 17.120 1.00 23.41 C ATOM 774 CE LYS A 45 -5.783 4.779 18.588 1.00 74.24 C ATOM 775 NZ LYS A 45 -6.512 5.840 19.336 1.00 15.24 N ATOM 0 H LYS A 45 -5.286 2.113 14.710 1.00 42.30 H new ATOM 0 HA LYS A 45 -3.868 3.821 12.913 1.00 20.51 H new ATOM 0 HB2 LYS A 45 -4.069 5.457 14.777 1.00 4.24 H new ATOM 0 HB3 LYS A 45 -5.595 4.680 14.407 1.00 4.24 H new ATOM 0 HG2 LYS A 45 -5.274 3.152 16.385 1.00 41.21 H new ATOM 0 HG3 LYS A 45 -3.780 3.985 16.766 1.00 41.21 H new ATOM 0 HD2 LYS A 45 -5.027 6.123 17.083 1.00 23.41 H new ATOM 0 HD3 LYS A 45 -6.527 5.331 16.642 1.00 23.41 H new ATOM 0 HE2 LYS A 45 -6.348 3.848 18.634 1.00 74.24 H new ATOM 0 HE3 LYS A 45 -4.821 4.592 19.065 1.00 74.24 H new ATOM 0 HZ1 LYS A 45 -6.645 5.540 20.323 1.00 15.24 H new ATOM 0 HZ2 LYS A 45 -5.961 6.722 19.313 1.00 15.24 H new ATOM 0 HZ3 LYS A 45 -7.440 6.000 18.895 1.00 15.24 H new ATOM 789 N SER A 46 -2.007 2.177 14.913 1.00 13.33 N ATOM 790 CA SER A 46 -0.630 1.886 15.328 1.00 11.12 C ATOM 791 C SER A 46 0.121 1.068 14.262 1.00 72.25 C ATOM 792 O SER A 46 1.290 1.354 13.961 1.00 21.14 O ATOM 793 CB SER A 46 -0.671 1.089 16.650 1.00 21.24 C ATOM 794 OG SER A 46 -1.469 1.745 17.620 1.00 20.12 O ATOM 0 H SER A 46 -2.656 1.408 15.080 1.00 13.33 H new ATOM 0 HA SER A 46 -0.100 2.829 15.460 1.00 11.12 H new ATOM 0 HB2 SER A 46 -1.068 0.091 16.464 1.00 21.24 H new ATOM 0 HB3 SER A 46 0.342 0.963 17.033 1.00 21.24 H new ATOM 0 HG SER A 46 -1.479 1.218 18.446 1.00 20.12 H new ATOM 800 N MET A 47 -0.572 0.066 13.661 1.00 72.43 N ATOM 801 CA MET A 47 0.066 -0.911 12.739 1.00 14.34 C ATOM 802 C MET A 47 -0.908 -1.446 11.670 1.00 65.10 C ATOM 803 O MET A 47 -2.067 -1.749 11.958 1.00 31.10 O ATOM 804 CB MET A 47 0.676 -2.134 13.516 1.00 51.30 C ATOM 805 CG MET A 47 1.909 -1.825 14.378 1.00 74.42 C ATOM 806 SD MET A 47 2.556 -3.274 15.242 1.00 41.55 S ATOM 807 CE MET A 47 1.224 -3.691 16.366 1.00 14.45 C ATOM 0 H MET A 47 -1.571 -0.087 13.798 1.00 72.43 H new ATOM 0 HA MET A 47 0.862 -0.357 12.241 1.00 14.34 H new ATOM 0 HB2 MET A 47 -0.097 -2.556 14.158 1.00 51.30 H new ATOM 0 HB3 MET A 47 0.944 -2.904 12.792 1.00 51.30 H new ATOM 0 HG2 MET A 47 2.692 -1.408 13.744 1.00 74.42 H new ATOM 0 HG3 MET A 47 1.650 -1.060 15.110 1.00 74.42 H new ATOM 0 HE1 MET A 47 1.582 -4.409 17.104 1.00 14.45 H new ATOM 0 HE2 MET A 47 0.880 -2.790 16.873 1.00 14.45 H new ATOM 0 HE3 MET A 47 0.398 -4.129 15.805 1.00 14.45 H new ATOM 817 N LEU A 48 -0.391 -1.574 10.437 1.00 20.31 N ATOM 818 CA LEU A 48 -1.021 -2.340 9.353 1.00 60.22 C ATOM 819 C LEU A 48 -0.360 -3.734 9.309 1.00 33.22 C ATOM 820 O LEU A 48 0.802 -3.869 8.918 1.00 31.20 O ATOM 821 CB LEU A 48 -0.832 -1.604 7.992 1.00 42.15 C ATOM 822 CG LEU A 48 -1.370 -2.354 6.722 1.00 10.40 C ATOM 823 CD1 LEU A 48 -2.890 -2.596 6.807 1.00 33.44 C ATOM 824 CD2 LEU A 48 -0.980 -1.607 5.419 1.00 13.52 C ATOM 0 H LEU A 48 0.491 -1.141 10.163 1.00 20.31 H new ATOM 0 HA LEU A 48 -2.092 -2.439 9.532 1.00 60.22 H new ATOM 0 HB2 LEU A 48 -1.327 -0.635 8.054 1.00 42.15 H new ATOM 0 HB3 LEU A 48 0.231 -1.410 7.851 1.00 42.15 H new ATOM 0 HG LEU A 48 -0.892 -3.333 6.692 1.00 10.40 H new ATOM 0 HD11 LEU A 48 -3.226 -3.117 5.911 1.00 33.44 H new ATOM 0 HD12 LEU A 48 -3.113 -3.203 7.685 1.00 33.44 H new ATOM 0 HD13 LEU A 48 -3.407 -1.640 6.886 1.00 33.44 H new ATOM 0 HD21 LEU A 48 -1.367 -2.151 4.558 1.00 13.52 H new ATOM 0 HD22 LEU A 48 -1.404 -0.603 5.434 1.00 13.52 H new ATOM 0 HD23 LEU A 48 0.106 -1.541 5.348 1.00 13.52 H new ATOM 836 N THR A 49 -1.090 -4.751 9.776 1.00 34.44 N ATOM 837 CA THR A 49 -0.610 -6.149 9.814 1.00 24.21 C ATOM 838 C THR A 49 -1.344 -6.960 8.734 1.00 24.22 C ATOM 839 O THR A 49 -2.487 -6.644 8.417 1.00 64.32 O ATOM 840 CB THR A 49 -0.886 -6.777 11.228 1.00 3.02 C ATOM 841 OG1 THR A 49 -0.480 -5.852 12.254 1.00 55.21 O ATOM 842 CG2 THR A 49 -0.138 -8.120 11.431 1.00 13.04 C ATOM 0 H THR A 49 -2.035 -4.635 10.141 1.00 34.44 H new ATOM 0 HA THR A 49 0.463 -6.169 9.626 1.00 24.21 H new ATOM 0 HB THR A 49 -1.956 -6.977 11.292 1.00 3.02 H new ATOM 0 HG1 THR A 49 -0.654 -6.244 13.135 1.00 55.21 H new ATOM 0 HG21 THR A 49 -0.361 -8.514 12.423 1.00 13.04 H new ATOM 0 HG22 THR A 49 -0.462 -8.835 10.675 1.00 13.04 H new ATOM 0 HG23 THR A 49 0.936 -7.956 11.338 1.00 13.04 H new ATOM 850 N TYR A 50 -0.693 -7.995 8.166 1.00 20.04 N ATOM 851 CA TYR A 50 -1.338 -8.900 7.183 1.00 35.25 C ATOM 852 C TYR A 50 -1.121 -10.374 7.575 1.00 73.30 C ATOM 853 O TYR A 50 -0.001 -10.780 7.884 1.00 51.14 O ATOM 854 CB TYR A 50 -0.834 -8.605 5.741 1.00 30.20 C ATOM 855 CG TYR A 50 0.696 -8.497 5.555 1.00 10.42 C ATOM 856 CD1 TYR A 50 1.474 -9.622 5.287 1.00 23.42 C ATOM 857 CD2 TYR A 50 1.353 -7.260 5.621 1.00 44.31 C ATOM 858 CE1 TYR A 50 2.837 -9.523 5.099 1.00 2.52 C ATOM 859 CE2 TYR A 50 2.722 -7.161 5.433 1.00 61.42 C ATOM 860 CZ TYR A 50 3.455 -8.295 5.174 1.00 41.42 C ATOM 861 OH TYR A 50 4.819 -8.205 4.989 1.00 45.34 O ATOM 0 H TYR A 50 0.279 -8.228 8.369 1.00 20.04 H new ATOM 0 HA TYR A 50 -2.412 -8.712 7.195 1.00 35.25 H new ATOM 0 HB2 TYR A 50 -1.203 -9.392 5.083 1.00 30.20 H new ATOM 0 HB3 TYR A 50 -1.285 -7.671 5.406 1.00 30.20 H new ATOM 0 HD1 TYR A 50 1.000 -10.591 5.225 1.00 23.42 H new ATOM 0 HD2 TYR A 50 0.780 -6.367 5.822 1.00 44.31 H new ATOM 0 HE1 TYR A 50 3.419 -10.409 4.893 1.00 2.52 H new ATOM 0 HE2 TYR A 50 3.210 -6.199 5.490 1.00 61.42 H new ATOM 0 HH TYR A 50 5.099 -7.270 5.072 1.00 45.34 H new ATOM 871 N TYR A 51 -2.219 -11.155 7.594 1.00 11.10 N ATOM 872 CA TYR A 51 -2.211 -12.576 8.002 1.00 14.30 C ATOM 873 C TYR A 51 -2.415 -13.517 6.803 1.00 75.40 C ATOM 874 O TYR A 51 -3.110 -13.175 5.846 1.00 55.01 O ATOM 875 CB TYR A 51 -3.326 -12.797 9.050 1.00 42.10 C ATOM 876 CG TYR A 51 -3.203 -11.871 10.272 1.00 51.01 C ATOM 877 CD1 TYR A 51 -2.238 -12.108 11.251 1.00 10.34 C ATOM 878 CD2 TYR A 51 -4.026 -10.746 10.428 1.00 1.11 C ATOM 879 CE1 TYR A 51 -2.103 -11.268 12.341 1.00 0.11 C ATOM 880 CE2 TYR A 51 -3.888 -9.903 11.517 1.00 32.22 C ATOM 881 CZ TYR A 51 -2.927 -10.170 12.469 1.00 34.34 C ATOM 882 OH TYR A 51 -2.783 -9.332 13.558 1.00 12.43 O ATOM 0 H TYR A 51 -3.143 -10.817 7.325 1.00 11.10 H new ATOM 0 HA TYR A 51 -1.236 -12.810 8.431 1.00 14.30 H new ATOM 0 HB2 TYR A 51 -4.296 -12.638 8.578 1.00 42.10 H new ATOM 0 HB3 TYR A 51 -3.301 -13.834 9.384 1.00 42.10 H new ATOM 0 HD1 TYR A 51 -1.585 -12.963 11.156 1.00 10.34 H new ATOM 0 HD2 TYR A 51 -4.781 -10.534 9.685 1.00 1.11 H new ATOM 0 HE1 TYR A 51 -1.353 -11.472 13.091 1.00 0.11 H new ATOM 0 HE2 TYR A 51 -4.530 -9.041 11.621 1.00 32.22 H new ATOM 0 HH TYR A 51 -3.438 -8.605 13.500 1.00 12.43 H new ATOM 1081 N PHE A 63 3.953 -6.947 10.557 1.00 4.43 N ATOM 1082 CA PHE A 63 3.208 -5.748 10.967 1.00 3.14 C ATOM 1083 C PHE A 63 4.056 -4.511 10.655 1.00 13.32 C ATOM 1084 O PHE A 63 5.283 -4.531 10.812 1.00 31.33 O ATOM 1085 CB PHE A 63 2.800 -5.809 12.473 1.00 41.33 C ATOM 1086 CG PHE A 63 3.913 -6.160 13.477 1.00 65.44 C ATOM 1087 CD1 PHE A 63 4.732 -5.170 14.030 1.00 32.14 C ATOM 1088 CD2 PHE A 63 4.115 -7.481 13.896 1.00 31.34 C ATOM 1089 CE1 PHE A 63 5.709 -5.486 14.957 1.00 2.22 C ATOM 1090 CE2 PHE A 63 5.094 -7.793 14.830 1.00 13.02 C ATOM 1091 CZ PHE A 63 5.889 -6.795 15.358 1.00 64.54 C ATOM 0 HA PHE A 63 2.276 -5.693 10.405 1.00 3.14 H new ATOM 0 HB2 PHE A 63 2.383 -4.841 12.752 1.00 41.33 H new ATOM 0 HB3 PHE A 63 2.001 -6.543 12.580 1.00 41.33 H new ATOM 0 HD1 PHE A 63 4.599 -4.142 13.728 1.00 32.14 H new ATOM 0 HD2 PHE A 63 3.500 -8.269 13.487 1.00 31.34 H new ATOM 0 HE1 PHE A 63 6.333 -4.706 15.368 1.00 2.22 H new ATOM 0 HE2 PHE A 63 5.234 -8.817 15.144 1.00 13.02 H new ATOM 0 HZ PHE A 63 6.651 -7.038 16.084 1.00 64.54 H new ATOM 1101 N ILE A 64 3.386 -3.455 10.189 1.00 60.13 N ATOM 1102 CA ILE A 64 4.023 -2.235 9.676 1.00 41.44 C ATOM 1103 C ILE A 64 3.584 -1.063 10.554 1.00 73.44 C ATOM 1104 O ILE A 64 2.387 -0.825 10.693 1.00 23.32 O ATOM 1105 CB ILE A 64 3.620 -1.969 8.166 1.00 31.23 C ATOM 1106 CG1 ILE A 64 4.206 -3.087 7.238 1.00 13.34 C ATOM 1107 CG2 ILE A 64 4.054 -0.554 7.697 1.00 51.54 C ATOM 1108 CD1 ILE A 64 3.901 -2.931 5.760 1.00 42.43 C ATOM 0 H ILE A 64 2.367 -3.421 10.156 1.00 60.13 H new ATOM 0 HA ILE A 64 5.106 -2.350 9.708 1.00 41.44 H new ATOM 0 HB ILE A 64 2.533 -2.005 8.096 1.00 31.23 H new ATOM 0 HG12 ILE A 64 5.288 -3.113 7.368 1.00 13.34 H new ATOM 0 HG13 ILE A 64 3.822 -4.051 7.571 1.00 13.34 H new ATOM 0 HG21 ILE A 64 3.760 -0.409 6.657 1.00 51.54 H new ATOM 0 HG22 ILE A 64 3.571 0.200 8.319 1.00 51.54 H new ATOM 0 HG23 ILE A 64 5.136 -0.457 7.785 1.00 51.54 H new ATOM 0 HD11 ILE A 64 4.351 -3.755 5.207 1.00 42.43 H new ATOM 0 HD12 ILE A 64 2.822 -2.939 5.608 1.00 42.43 H new ATOM 0 HD13 ILE A 64 4.311 -1.987 5.402 1.00 42.43 H new ATOM 1120 N ASP A 65 4.552 -0.339 11.135 1.00 1.15 N ATOM 1121 CA ASP A 65 4.267 0.848 11.952 1.00 33.52 C ATOM 1122 C ASP A 65 3.731 1.965 11.042 1.00 10.11 C ATOM 1123 O ASP A 65 4.369 2.297 10.038 1.00 33.23 O ATOM 1124 CB ASP A 65 5.546 1.322 12.679 1.00 12.54 C ATOM 1125 CG ASP A 65 6.071 0.306 13.706 1.00 54.12 C ATOM 1126 OD1 ASP A 65 5.556 0.290 14.846 1.00 5.32 O ATOM 1127 OD2 ASP A 65 6.989 -0.485 13.373 1.00 10.12 O ATOM 0 H ASP A 65 5.545 -0.557 11.053 1.00 1.15 H new ATOM 0 HA ASP A 65 3.520 0.598 12.705 1.00 33.52 H new ATOM 0 HB2 ASP A 65 6.324 1.518 11.941 1.00 12.54 H new ATOM 0 HB3 ASP A 65 5.340 2.266 13.184 1.00 12.54 H new ATOM 1132 N VAL A 66 2.550 2.509 11.392 1.00 32.00 N ATOM 1133 CA VAL A 66 1.914 3.634 10.670 1.00 1.12 C ATOM 1134 C VAL A 66 2.831 4.886 10.686 1.00 52.12 C ATOM 1135 O VAL A 66 2.880 5.648 9.716 1.00 31.13 O ATOM 1136 CB VAL A 66 0.471 3.930 11.261 1.00 61.11 C ATOM 1137 CG1 VAL A 66 -0.176 5.205 10.666 1.00 2.22 C ATOM 1138 CG2 VAL A 66 -0.458 2.703 11.057 1.00 53.13 C ATOM 0 H VAL A 66 2.005 2.180 12.189 1.00 32.00 H new ATOM 0 HA VAL A 66 1.780 3.354 9.625 1.00 1.12 H new ATOM 0 HB VAL A 66 0.600 4.114 12.328 1.00 61.11 H new ATOM 0 HG11 VAL A 66 -1.161 5.354 11.109 1.00 2.22 H new ATOM 0 HG12 VAL A 66 0.454 6.068 10.883 1.00 2.22 H new ATOM 0 HG13 VAL A 66 -0.277 5.092 9.587 1.00 2.22 H new ATOM 0 HG21 VAL A 66 -1.444 2.921 11.467 1.00 53.13 H new ATOM 0 HG22 VAL A 66 -0.548 2.487 9.992 1.00 53.13 H new ATOM 0 HG23 VAL A 66 -0.036 1.838 11.568 1.00 53.13 H new ATOM 1148 N SER A 67 3.607 5.031 11.778 1.00 54.44 N ATOM 1149 CA SER A 67 4.609 6.105 11.936 1.00 25.41 C ATOM 1150 C SER A 67 5.819 5.926 10.977 1.00 51.40 C ATOM 1151 O SER A 67 6.460 6.910 10.599 1.00 53.20 O ATOM 1152 CB SER A 67 5.086 6.150 13.402 1.00 23.20 C ATOM 1153 OG SER A 67 3.990 6.319 14.287 1.00 71.42 O ATOM 0 H SER A 67 3.556 4.403 12.580 1.00 54.44 H new ATOM 0 HA SER A 67 4.133 7.050 11.673 1.00 25.41 H new ATOM 0 HB2 SER A 67 5.615 5.229 13.645 1.00 23.20 H new ATOM 0 HB3 SER A 67 5.794 6.968 13.533 1.00 23.20 H new ATOM 0 HG SER A 67 4.316 6.343 15.211 1.00 71.42 H new ATOM 1159 N LYS A 68 6.116 4.667 10.591 1.00 51.05 N ATOM 1160 CA LYS A 68 7.266 4.327 9.711 1.00 4.12 C ATOM 1161 C LYS A 68 6.894 4.379 8.215 1.00 42.30 C ATOM 1162 O LYS A 68 7.784 4.286 7.356 1.00 24.24 O ATOM 1163 CB LYS A 68 7.826 2.916 10.062 1.00 73.22 C ATOM 1164 CG LYS A 68 8.609 2.833 11.393 1.00 5.11 C ATOM 1165 CD LYS A 68 9.936 3.617 11.352 1.00 1.12 C ATOM 1166 CE LYS A 68 10.747 3.474 12.646 1.00 71.01 C ATOM 1167 NZ LYS A 68 11.999 4.279 12.610 1.00 54.12 N ATOM 0 H LYS A 68 5.569 3.855 10.878 1.00 51.05 H new ATOM 0 HA LYS A 68 8.033 5.080 9.890 1.00 4.12 H new ATOM 0 HB2 LYS A 68 6.995 2.212 10.103 1.00 73.22 H new ATOM 0 HB3 LYS A 68 8.480 2.590 9.253 1.00 73.22 H new ATOM 0 HG2 LYS A 68 7.988 3.220 12.200 1.00 5.11 H new ATOM 0 HG3 LYS A 68 8.816 1.788 11.624 1.00 5.11 H new ATOM 0 HD2 LYS A 68 10.535 3.266 10.512 1.00 1.12 H new ATOM 0 HD3 LYS A 68 9.725 4.672 11.175 1.00 1.12 H new ATOM 0 HE2 LYS A 68 10.137 3.789 13.493 1.00 71.01 H new ATOM 0 HE3 LYS A 68 10.995 2.424 12.805 1.00 71.01 H new ATOM 0 HZ1 LYS A 68 12.518 4.155 13.503 1.00 54.12 H new ATOM 0 HZ2 LYS A 68 12.593 3.962 11.817 1.00 54.12 H new ATOM 0 HZ3 LYS A 68 11.762 5.284 12.484 1.00 54.12 H new ATOM 1181 N ILE A 69 5.586 4.497 7.903 1.00 12.12 N ATOM 1182 CA ILE A 69 5.122 4.597 6.509 1.00 63.10 C ATOM 1183 C ILE A 69 5.432 6.008 5.963 1.00 10.33 C ATOM 1184 O ILE A 69 4.907 7.014 6.463 1.00 71.40 O ATOM 1185 CB ILE A 69 3.588 4.293 6.343 1.00 63.31 C ATOM 1186 CG1 ILE A 69 3.194 2.941 7.010 1.00 31.34 C ATOM 1187 CG2 ILE A 69 3.210 4.286 4.844 1.00 74.34 C ATOM 1188 CD1 ILE A 69 1.702 2.600 6.961 1.00 51.31 C ATOM 0 H ILE A 69 4.838 4.525 8.596 1.00 12.12 H new ATOM 0 HA ILE A 69 5.658 3.837 5.941 1.00 63.10 H new ATOM 0 HB ILE A 69 3.032 5.082 6.850 1.00 63.31 H new ATOM 0 HG12 ILE A 69 3.750 2.139 6.524 1.00 31.34 H new ATOM 0 HG13 ILE A 69 3.511 2.963 8.053 1.00 31.34 H new ATOM 0 HG21 ILE A 69 2.146 4.075 4.738 1.00 74.34 H new ATOM 0 HG22 ILE A 69 3.432 5.260 4.408 1.00 74.34 H new ATOM 0 HG23 ILE A 69 3.786 3.518 4.327 1.00 74.34 H new ATOM 0 HD11 ILE A 69 1.532 1.641 7.451 1.00 51.31 H new ATOM 0 HD12 ILE A 69 1.134 3.376 7.475 1.00 51.31 H new ATOM 0 HD13 ILE A 69 1.376 2.540 5.922 1.00 51.31 H new ATOM 1200 N LYS A 70 6.303 6.051 4.944 1.00 22.02 N ATOM 1201 CA LYS A 70 6.769 7.295 4.307 1.00 64.51 C ATOM 1202 C LYS A 70 5.838 7.758 3.167 1.00 50.32 C ATOM 1203 O LYS A 70 5.932 8.907 2.740 1.00 15.41 O ATOM 1204 CB LYS A 70 8.207 7.091 3.760 1.00 25.10 C ATOM 1205 CG LYS A 70 9.273 6.797 4.845 1.00 44.03 C ATOM 1206 CD LYS A 70 10.716 6.748 4.275 1.00 71.04 C ATOM 1207 CE LYS A 70 10.971 5.550 3.336 1.00 62.33 C ATOM 1208 NZ LYS A 70 10.918 4.254 4.065 1.00 55.23 N ATOM 0 H LYS A 70 6.710 5.211 4.532 1.00 22.02 H new ATOM 0 HA LYS A 70 6.761 8.075 5.068 1.00 64.51 H new ATOM 0 HB2 LYS A 70 8.197 6.267 3.046 1.00 25.10 H new ATOM 0 HB3 LYS A 70 8.503 7.985 3.211 1.00 25.10 H new ATOM 0 HG2 LYS A 70 9.219 7.564 5.618 1.00 44.03 H new ATOM 0 HG3 LYS A 70 9.044 5.845 5.324 1.00 44.03 H new ATOM 0 HD2 LYS A 70 10.915 7.672 3.733 1.00 71.04 H new ATOM 0 HD3 LYS A 70 11.423 6.706 5.103 1.00 71.04 H new ATOM 0 HE2 LYS A 70 10.228 5.549 2.539 1.00 62.33 H new ATOM 0 HE3 LYS A 70 11.946 5.661 2.862 1.00 62.33 H new ATOM 0 HZ1 LYS A 70 11.808 3.737 3.918 1.00 55.23 H new ATOM 0 HZ2 LYS A 70 10.784 4.432 5.081 1.00 55.23 H new ATOM 0 HZ3 LYS A 70 10.124 3.686 3.706 1.00 55.23 H new ATOM 1222 N CYS A 71 4.955 6.867 2.677 1.00 22.35 N ATOM 1223 CA CYS A 71 4.051 7.179 1.540 1.00 42.42 C ATOM 1224 C CYS A 71 3.056 6.035 1.297 1.00 3.01 C ATOM 1225 O CYS A 71 3.413 4.862 1.428 1.00 14.23 O ATOM 1226 CB CYS A 71 4.854 7.441 0.235 1.00 54.15 C ATOM 1227 SG CYS A 71 3.837 7.807 -1.216 1.00 33.21 S ATOM 0 H CYS A 71 4.844 5.923 3.047 1.00 22.35 H new ATOM 0 HA CYS A 71 3.503 8.083 1.807 1.00 42.42 H new ATOM 0 HB2 CYS A 71 5.535 8.275 0.405 1.00 54.15 H new ATOM 0 HB3 CYS A 71 5.468 6.566 0.020 1.00 54.15 H new ATOM 0 HG CYS A 71 3.376 9.019 -1.128 1.00 33.21 H new ATOM 1233 N VAL A 72 1.798 6.396 0.966 1.00 3.30 N ATOM 1234 CA VAL A 72 0.782 5.460 0.437 1.00 32.21 C ATOM 1235 C VAL A 72 0.053 6.141 -0.723 1.00 61.44 C ATOM 1236 O VAL A 72 -0.554 7.203 -0.538 1.00 1.44 O ATOM 1237 CB VAL A 72 -0.294 4.993 1.501 1.00 41.34 C ATOM 1238 CG1 VAL A 72 -1.403 4.128 0.833 1.00 44.35 C ATOM 1239 CG2 VAL A 72 0.367 4.220 2.660 1.00 51.12 C ATOM 0 H VAL A 72 1.456 7.352 1.059 1.00 3.30 H new ATOM 0 HA VAL A 72 1.319 4.564 0.126 1.00 32.21 H new ATOM 0 HB VAL A 72 -0.759 5.889 1.912 1.00 41.34 H new ATOM 0 HG11 VAL A 72 -2.128 3.821 1.587 1.00 44.35 H new ATOM 0 HG12 VAL A 72 -1.906 4.713 0.062 1.00 44.35 H new ATOM 0 HG13 VAL A 72 -0.952 3.244 0.382 1.00 44.35 H new ATOM 0 HG21 VAL A 72 -0.397 3.912 3.374 1.00 51.12 H new ATOM 0 HG22 VAL A 72 0.873 3.338 2.267 1.00 51.12 H new ATOM 0 HG23 VAL A 72 1.093 4.862 3.159 1.00 51.12 H new ATOM 1249 N GLU A 73 0.113 5.521 -1.904 1.00 44.30 N ATOM 1250 CA GLU A 73 -0.616 5.985 -3.087 1.00 15.14 C ATOM 1251 C GLU A 73 -0.798 4.809 -4.055 1.00 33.14 C ATOM 1252 O GLU A 73 -0.174 3.763 -3.891 1.00 52.32 O ATOM 1253 CB GLU A 73 0.122 7.182 -3.761 1.00 14.11 C ATOM 1254 CG GLU A 73 -0.718 7.969 -4.798 1.00 13.31 C ATOM 1255 CD GLU A 73 -2.098 8.402 -4.257 1.00 25.23 C ATOM 1256 OE1 GLU A 73 -2.160 9.334 -3.426 1.00 21.44 O ATOM 1257 OE2 GLU A 73 -3.128 7.811 -4.659 1.00 50.14 O ATOM 0 H GLU A 73 0.669 4.682 -2.067 1.00 44.30 H new ATOM 0 HA GLU A 73 -1.600 6.350 -2.792 1.00 15.14 H new ATOM 0 HB2 GLU A 73 0.450 7.871 -2.983 1.00 14.11 H new ATOM 0 HB3 GLU A 73 1.019 6.806 -4.253 1.00 14.11 H new ATOM 0 HG2 GLU A 73 -0.163 8.854 -5.110 1.00 13.31 H new ATOM 0 HG3 GLU A 73 -0.860 7.352 -5.685 1.00 13.31 H new ATOM 1264 N ILE A 74 -1.678 4.991 -5.040 1.00 4.23 N ATOM 1265 CA ILE A 74 -1.950 3.996 -6.086 1.00 52.11 C ATOM 1266 C ILE A 74 -0.688 3.665 -6.911 1.00 1.04 C ATOM 1267 O ILE A 74 0.259 4.459 -6.973 1.00 63.13 O ATOM 1268 CB ILE A 74 -3.135 4.504 -7.001 1.00 11.45 C ATOM 1269 CG1 ILE A 74 -2.793 5.832 -7.786 1.00 34.11 C ATOM 1270 CG2 ILE A 74 -4.385 4.720 -6.122 1.00 15.44 C ATOM 1271 CD1 ILE A 74 -2.159 5.639 -9.156 1.00 75.33 C ATOM 0 H ILE A 74 -2.230 5.843 -5.138 1.00 4.23 H new ATOM 0 HA ILE A 74 -2.251 3.063 -5.609 1.00 52.11 H new ATOM 0 HB ILE A 74 -3.316 3.740 -7.757 1.00 11.45 H new ATOM 0 HG12 ILE A 74 -3.710 6.408 -7.907 1.00 34.11 H new ATOM 0 HG13 ILE A 74 -2.119 6.432 -7.174 1.00 34.11 H new ATOM 0 HG21 ILE A 74 -5.210 5.071 -6.742 1.00 15.44 H new ATOM 0 HG22 ILE A 74 -4.663 3.779 -5.647 1.00 15.44 H new ATOM 0 HG23 ILE A 74 -4.166 5.463 -5.355 1.00 15.44 H new ATOM 0 HD11 ILE A 74 -1.965 6.612 -9.608 1.00 75.33 H new ATOM 0 HD12 ILE A 74 -1.220 5.095 -9.049 1.00 75.33 H new ATOM 0 HD13 ILE A 74 -2.837 5.071 -9.794 1.00 75.33 H new ATOM 1283 N VAL A 75 -0.692 2.491 -7.545 1.00 32.53 N ATOM 1284 CA VAL A 75 0.388 2.058 -8.441 1.00 23.24 C ATOM 1285 C VAL A 75 -0.150 2.111 -9.875 1.00 12.15 C ATOM 1286 O VAL A 75 -1.050 1.338 -10.236 1.00 50.22 O ATOM 1287 CB VAL A 75 0.908 0.604 -8.118 1.00 2.11 C ATOM 1288 CG1 VAL A 75 2.103 0.213 -9.019 1.00 60.24 C ATOM 1289 CG2 VAL A 75 1.274 0.458 -6.632 1.00 43.50 C ATOM 0 H VAL A 75 -1.446 1.810 -7.453 1.00 32.53 H new ATOM 0 HA VAL A 75 1.240 2.724 -8.305 1.00 23.24 H new ATOM 0 HB VAL A 75 0.091 -0.085 -8.333 1.00 2.11 H new ATOM 0 HG11 VAL A 75 2.434 -0.795 -8.768 1.00 60.24 H new ATOM 0 HG12 VAL A 75 1.796 0.244 -10.064 1.00 60.24 H new ATOM 0 HG13 VAL A 75 2.923 0.914 -8.861 1.00 60.24 H new ATOM 0 HG21 VAL A 75 1.629 -0.555 -6.442 1.00 43.50 H new ATOM 0 HG22 VAL A 75 2.059 1.171 -6.379 1.00 43.50 H new ATOM 0 HG23 VAL A 75 0.394 0.655 -6.020 1.00 43.50 H new ATOM 1299 N LYS A 76 0.371 3.067 -10.655 1.00 72.52 N ATOM 1300 CA LYS A 76 0.062 3.205 -12.082 1.00 5.14 C ATOM 1301 C LYS A 76 0.602 1.978 -12.838 1.00 42.23 C ATOM 1302 O LYS A 76 1.807 1.864 -13.076 1.00 2.04 O ATOM 1303 CB LYS A 76 0.696 4.520 -12.624 1.00 22.10 C ATOM 1304 CG LYS A 76 0.168 5.800 -11.939 1.00 53.35 C ATOM 1305 CD LYS A 76 1.001 7.063 -12.268 1.00 32.31 C ATOM 1306 CE LYS A 76 1.020 7.432 -13.757 1.00 4.41 C ATOM 1307 NZ LYS A 76 1.802 8.680 -14.002 1.00 52.01 N ATOM 0 H LYS A 76 1.023 3.771 -10.310 1.00 72.52 H new ATOM 0 HA LYS A 76 -1.017 3.257 -12.231 1.00 5.14 H new ATOM 0 HB2 LYS A 76 1.777 4.470 -12.495 1.00 22.10 H new ATOM 0 HB3 LYS A 76 0.506 4.588 -13.695 1.00 22.10 H new ATOM 0 HG2 LYS A 76 -0.865 5.966 -12.244 1.00 53.35 H new ATOM 0 HG3 LYS A 76 0.162 5.649 -10.860 1.00 53.35 H new ATOM 0 HD2 LYS A 76 0.603 7.905 -11.701 1.00 32.31 H new ATOM 0 HD3 LYS A 76 2.026 6.907 -11.930 1.00 32.31 H new ATOM 0 HE2 LYS A 76 1.452 6.612 -14.331 1.00 4.41 H new ATOM 0 HE3 LYS A 76 -0.002 7.566 -14.113 1.00 4.41 H new ATOM 0 HZ1 LYS A 76 1.155 9.448 -14.273 1.00 52.01 H new ATOM 0 HZ2 LYS A 76 2.312 8.946 -13.135 1.00 52.01 H new ATOM 0 HZ3 LYS A 76 2.485 8.517 -14.769 1.00 52.01 H new ATOM 1382 N ILE A 82 -2.175 -7.095 -14.617 1.00 12.04 N ATOM 1383 CA ILE A 82 -2.060 -7.889 -13.391 1.00 52.43 C ATOM 1384 C ILE A 82 -2.753 -9.264 -13.590 1.00 13.54 C ATOM 1385 O ILE A 82 -3.970 -9.307 -13.791 1.00 53.14 O ATOM 1386 CB ILE A 82 -2.701 -7.122 -12.165 1.00 65.23 C ATOM 1387 CG1 ILE A 82 -2.185 -5.641 -12.073 1.00 45.52 C ATOM 1388 CG2 ILE A 82 -2.442 -7.873 -10.843 1.00 43.00 C ATOM 1389 CD1 ILE A 82 -0.676 -5.485 -11.921 1.00 54.12 C ATOM 0 HA ILE A 82 -1.004 -8.049 -13.175 1.00 52.43 H new ATOM 0 HB ILE A 82 -3.777 -7.087 -12.333 1.00 65.23 H new ATOM 0 HG12 ILE A 82 -2.500 -5.107 -12.970 1.00 45.52 H new ATOM 0 HG13 ILE A 82 -2.671 -5.156 -11.226 1.00 45.52 H new ATOM 0 HG21 ILE A 82 -2.894 -7.323 -10.018 1.00 43.00 H new ATOM 0 HG22 ILE A 82 -2.881 -8.869 -10.898 1.00 43.00 H new ATOM 0 HG23 ILE A 82 -1.368 -7.958 -10.677 1.00 43.00 H new ATOM 0 HD11 ILE A 82 -0.423 -4.426 -11.867 1.00 54.12 H new ATOM 0 HD12 ILE A 82 -0.349 -5.983 -11.009 1.00 54.12 H new ATOM 0 HD13 ILE A 82 -0.176 -5.934 -12.779 1.00 54.12 H new ATOM 1401 N PRO A 83 -1.990 -10.411 -13.588 1.00 4.44 N ATOM 1402 CA PRO A 83 -2.579 -11.768 -13.667 1.00 31.50 C ATOM 1403 C PRO A 83 -3.011 -12.286 -12.266 1.00 3.11 C ATOM 1404 O PRO A 83 -2.614 -13.374 -11.817 1.00 52.43 O ATOM 1405 CB PRO A 83 -1.423 -12.584 -14.286 1.00 21.34 C ATOM 1406 CG PRO A 83 -0.178 -11.954 -13.736 1.00 72.12 C ATOM 1407 CD PRO A 83 -0.500 -10.480 -13.531 1.00 32.11 C ATOM 0 HA PRO A 83 -3.497 -11.826 -14.252 1.00 31.50 H new ATOM 0 HB2 PRO A 83 -1.489 -13.637 -14.011 1.00 21.34 H new ATOM 0 HB3 PRO A 83 -1.443 -12.537 -15.375 1.00 21.34 H new ATOM 0 HG2 PRO A 83 0.112 -12.423 -12.796 1.00 72.12 H new ATOM 0 HG3 PRO A 83 0.657 -12.077 -14.425 1.00 72.12 H new ATOM 0 HD2 PRO A 83 -0.122 -10.121 -12.574 1.00 32.11 H new ATOM 0 HD3 PRO A 83 -0.044 -9.863 -14.305 1.00 32.11 H new ATOM 1415 N CYS A 84 -3.844 -11.475 -11.599 1.00 63.54 N ATOM 1416 CA CYS A 84 -4.364 -11.734 -10.248 1.00 53.41 C ATOM 1417 C CYS A 84 -5.859 -11.374 -10.206 1.00 61.10 C ATOM 1418 O CYS A 84 -6.333 -10.585 -11.041 1.00 24.22 O ATOM 1419 CB CYS A 84 -3.577 -10.898 -9.219 1.00 63.12 C ATOM 1420 SG CYS A 84 -4.119 -11.090 -7.516 1.00 20.40 S ATOM 0 H CYS A 84 -4.184 -10.598 -11.994 1.00 63.54 H new ATOM 0 HA CYS A 84 -4.245 -12.789 -10.000 1.00 53.41 H new ATOM 0 HB2 CYS A 84 -2.523 -11.169 -9.282 1.00 63.12 H new ATOM 0 HB3 CYS A 84 -3.653 -9.846 -9.493 1.00 63.12 H new ATOM 0 HG CYS A 84 -3.764 -10.046 -6.827 1.00 20.40 H new ATOM 1426 N GLN A 85 -6.593 -11.958 -9.239 1.00 45.54 N ATOM 1427 CA GLN A 85 -8.047 -11.721 -9.081 1.00 5.22 C ATOM 1428 C GLN A 85 -8.315 -10.299 -8.531 1.00 20.24 C ATOM 1429 O GLN A 85 -9.351 -9.694 -8.824 1.00 64.25 O ATOM 1430 CB GLN A 85 -8.687 -12.796 -8.154 1.00 65.42 C ATOM 1431 CG GLN A 85 -8.198 -12.761 -6.691 1.00 11.23 C ATOM 1432 CD GLN A 85 -8.888 -13.761 -5.761 1.00 72.15 C ATOM 1433 OE1 GLN A 85 -10.045 -14.137 -5.960 1.00 35.23 O ATOM 1434 NE2 GLN A 85 -8.189 -14.174 -4.718 1.00 2.13 N ATOM 0 H GLN A 85 -6.203 -12.601 -8.550 1.00 45.54 H new ATOM 0 HA GLN A 85 -8.510 -11.801 -10.065 1.00 5.22 H new ATOM 0 HB2 GLN A 85 -9.769 -12.667 -8.164 1.00 65.42 H new ATOM 0 HB3 GLN A 85 -8.480 -13.783 -8.568 1.00 65.42 H new ATOM 0 HG2 GLN A 85 -7.125 -12.953 -6.676 1.00 11.23 H new ATOM 0 HG3 GLN A 85 -8.348 -11.756 -6.296 1.00 11.23 H new ATOM 0 HE21 GLN A 85 -7.233 -13.844 -4.581 1.00 2.13 H new ATOM 0 HE22 GLN A 85 -8.605 -14.823 -4.050 1.00 2.13 H new ATOM 1443 N ASN A 86 -7.369 -9.784 -7.722 1.00 10.21 N ATOM 1444 CA ASN A 86 -7.436 -8.422 -7.161 1.00 44.13 C ATOM 1445 C ASN A 86 -6.836 -7.406 -8.154 1.00 22.23 C ATOM 1446 O ASN A 86 -5.754 -7.624 -8.718 1.00 10.21 O ATOM 1447 CB ASN A 86 -6.722 -8.341 -5.779 1.00 2.03 C ATOM 1448 CG ASN A 86 -7.512 -9.010 -4.642 1.00 15.15 C ATOM 1449 OD1 ASN A 86 -8.202 -10.006 -4.849 1.00 11.51 O ATOM 1450 ND2 ASN A 86 -7.431 -8.460 -3.435 1.00 55.41 N ATOM 0 H ASN A 86 -6.537 -10.301 -7.439 1.00 10.21 H new ATOM 0 HA ASN A 86 -8.485 -8.172 -7.000 1.00 44.13 H new ATOM 0 HB2 ASN A 86 -5.742 -8.812 -5.857 1.00 2.03 H new ATOM 0 HB3 ASN A 86 -6.553 -7.294 -5.527 1.00 2.03 H new ATOM 0 HD21 ASN A 86 -7.948 -8.864 -2.655 1.00 55.41 H new ATOM 0 HD22 ASN A 86 -6.851 -7.634 -3.289 1.00 55.41 H new ATOM 1457 N LYS A 87 -7.569 -6.296 -8.340 1.00 12.52 N ATOM 1458 CA LYS A 87 -7.270 -5.229 -9.317 1.00 11.54 C ATOM 1459 C LYS A 87 -7.059 -3.890 -8.580 1.00 13.44 C ATOM 1460 O LYS A 87 -7.352 -3.781 -7.389 1.00 31.02 O ATOM 1461 CB LYS A 87 -8.452 -5.108 -10.322 1.00 13.40 C ATOM 1462 CG LYS A 87 -8.771 -6.416 -11.078 1.00 34.02 C ATOM 1463 CD LYS A 87 -10.041 -6.307 -11.954 1.00 15.05 C ATOM 1464 CE LYS A 87 -10.340 -7.603 -12.719 1.00 41.25 C ATOM 1465 NZ LYS A 87 -9.240 -7.972 -13.654 1.00 55.24 N ATOM 0 H LYS A 87 -8.413 -6.108 -7.799 1.00 12.52 H new ATOM 0 HA LYS A 87 -6.359 -5.476 -9.862 1.00 11.54 H new ATOM 0 HB2 LYS A 87 -9.343 -4.786 -9.782 1.00 13.40 H new ATOM 0 HB3 LYS A 87 -8.220 -4.329 -11.048 1.00 13.40 H new ATOM 0 HG2 LYS A 87 -7.922 -6.682 -11.708 1.00 34.02 H new ATOM 0 HG3 LYS A 87 -8.900 -7.224 -10.358 1.00 34.02 H new ATOM 0 HD2 LYS A 87 -10.894 -6.057 -11.323 1.00 15.05 H new ATOM 0 HD3 LYS A 87 -9.919 -5.489 -12.664 1.00 15.05 H new ATOM 0 HE2 LYS A 87 -10.498 -8.414 -12.008 1.00 41.25 H new ATOM 0 HE3 LYS A 87 -11.267 -7.486 -13.280 1.00 41.25 H new ATOM 0 HZ1 LYS A 87 -9.541 -8.773 -14.245 1.00 55.24 H new ATOM 0 HZ2 LYS A 87 -9.014 -7.159 -14.262 1.00 55.24 H new ATOM 0 HZ3 LYS A 87 -8.397 -8.242 -13.109 1.00 55.24 H new ATOM 1479 N TYR A 88 -6.578 -2.876 -9.318 1.00 22.12 N ATOM 1480 CA TYR A 88 -6.281 -1.535 -8.773 1.00 20.42 C ATOM 1481 C TYR A 88 -5.251 -1.624 -7.624 1.00 74.31 C ATOM 1482 O TYR A 88 -5.622 -1.624 -6.438 1.00 45.30 O ATOM 1483 CB TYR A 88 -7.581 -0.782 -8.358 1.00 15.44 C ATOM 1484 CG TYR A 88 -8.386 -0.257 -9.556 1.00 3.53 C ATOM 1485 CD1 TYR A 88 -9.355 -1.038 -10.189 1.00 14.21 C ATOM 1486 CD2 TYR A 88 -8.144 1.019 -10.078 1.00 73.14 C ATOM 1487 CE1 TYR A 88 -10.048 -0.566 -11.292 1.00 61.20 C ATOM 1488 CE2 TYR A 88 -8.841 1.493 -11.176 1.00 71.51 C ATOM 1489 CZ TYR A 88 -9.788 0.695 -11.779 1.00 12.41 C ATOM 1490 OH TYR A 88 -10.477 1.158 -12.884 1.00 13.41 O ATOM 0 H TYR A 88 -6.382 -2.961 -10.315 1.00 22.12 H new ATOM 0 HA TYR A 88 -5.826 -0.940 -9.564 1.00 20.42 H new ATOM 0 HB2 TYR A 88 -8.210 -1.452 -7.772 1.00 15.44 H new ATOM 0 HB3 TYR A 88 -7.317 0.055 -7.711 1.00 15.44 H new ATOM 0 HD1 TYR A 88 -9.568 -2.027 -9.812 1.00 14.21 H new ATOM 0 HD2 TYR A 88 -7.398 1.647 -9.614 1.00 73.14 H new ATOM 0 HE1 TYR A 88 -10.792 -1.187 -11.769 1.00 61.20 H new ATOM 0 HE2 TYR A 88 -8.643 2.484 -11.558 1.00 71.51 H new ATOM 0 HH TYR A 88 -10.177 2.066 -13.100 1.00 13.41 H new ATOM 1500 N PRO A 89 -3.939 -1.776 -7.973 1.00 63.32 N ATOM 1501 CA PRO A 89 -2.860 -1.858 -6.973 1.00 63.31 C ATOM 1502 C PRO A 89 -2.622 -0.516 -6.261 1.00 2.31 C ATOM 1503 O PRO A 89 -2.792 0.553 -6.856 1.00 61.21 O ATOM 1504 CB PRO A 89 -1.624 -2.279 -7.805 1.00 64.43 C ATOM 1505 CG PRO A 89 -1.909 -1.794 -9.196 1.00 24.03 C ATOM 1506 CD PRO A 89 -3.407 -1.902 -9.369 1.00 74.41 C ATOM 0 HA PRO A 89 -3.095 -2.557 -6.171 1.00 63.31 H new ATOM 0 HB2 PRO A 89 -0.712 -1.832 -7.410 1.00 64.43 H new ATOM 0 HB3 PRO A 89 -1.484 -3.360 -7.785 1.00 64.43 H new ATOM 0 HG2 PRO A 89 -1.573 -0.766 -9.328 1.00 24.03 H new ATOM 0 HG3 PRO A 89 -1.385 -2.398 -9.936 1.00 24.03 H new ATOM 0 HD2 PRO A 89 -3.793 -1.114 -10.016 1.00 74.41 H new ATOM 0 HD3 PRO A 89 -3.690 -2.853 -9.820 1.00 74.41 H new ATOM 1514 N PHE A 90 -2.270 -0.582 -4.976 1.00 14.11 N ATOM 1515 CA PHE A 90 -1.753 0.564 -4.227 1.00 52.21 C ATOM 1516 C PHE A 90 -0.552 0.107 -3.399 1.00 31.12 C ATOM 1517 O PHE A 90 -0.510 -1.026 -2.910 1.00 73.00 O ATOM 1518 CB PHE A 90 -2.851 1.204 -3.338 1.00 50.35 C ATOM 1519 CG PHE A 90 -3.446 0.291 -2.257 1.00 73.14 C ATOM 1520 CD1 PHE A 90 -4.466 -0.616 -2.564 1.00 21.25 C ATOM 1521 CD2 PHE A 90 -2.990 0.348 -0.934 1.00 41.12 C ATOM 1522 CE1 PHE A 90 -5.006 -1.433 -1.589 1.00 54.33 C ATOM 1523 CE2 PHE A 90 -3.532 -0.472 0.036 1.00 4.13 C ATOM 1524 CZ PHE A 90 -4.536 -1.359 -0.293 1.00 63.22 C ATOM 0 H PHE A 90 -2.336 -1.437 -4.423 1.00 14.11 H new ATOM 0 HA PHE A 90 -1.434 1.338 -4.925 1.00 52.21 H new ATOM 0 HB2 PHE A 90 -2.432 2.086 -2.853 1.00 50.35 H new ATOM 0 HB3 PHE A 90 -3.660 1.549 -3.982 1.00 50.35 H new ATOM 0 HD1 PHE A 90 -4.836 -0.679 -3.577 1.00 21.25 H new ATOM 0 HD2 PHE A 90 -2.205 1.041 -0.669 1.00 41.12 H new ATOM 0 HE1 PHE A 90 -5.794 -2.128 -1.840 1.00 54.33 H new ATOM 0 HE2 PHE A 90 -3.170 -0.419 1.052 1.00 4.13 H new ATOM 0 HZ PHE A 90 -4.957 -1.999 0.468 1.00 63.22 H new ATOM 1534 N GLN A 91 0.421 1.001 -3.258 1.00 70.14 N ATOM 1535 CA GLN A 91 1.687 0.723 -2.578 1.00 22.32 C ATOM 1536 C GLN A 91 1.699 1.378 -1.197 1.00 45.11 C ATOM 1537 O GLN A 91 1.035 2.397 -0.967 1.00 63.52 O ATOM 1538 CB GLN A 91 2.870 1.239 -3.445 1.00 42.14 C ATOM 1539 CG GLN A 91 2.891 2.766 -3.675 1.00 11.51 C ATOM 1540 CD GLN A 91 3.859 3.194 -4.769 1.00 74.22 C ATOM 1541 OE1 GLN A 91 3.375 3.237 -6.006 1.00 5.23 O flip ATOM 1542 NE2 GLN A 91 5.027 3.485 -4.507 1.00 61.41 N flip ATOM 0 H GLN A 91 0.354 1.953 -3.617 1.00 70.14 H new ATOM 0 HA GLN A 91 1.796 -0.353 -2.444 1.00 22.32 H new ATOM 0 HB2 GLN A 91 3.805 0.945 -2.969 1.00 42.14 H new ATOM 0 HB3 GLN A 91 2.835 0.741 -4.414 1.00 42.14 H new ATOM 0 HG2 GLN A 91 1.887 3.102 -3.935 1.00 11.51 H new ATOM 0 HG3 GLN A 91 3.162 3.264 -2.744 1.00 11.51 H new ATOM 0 HE21 GLN A 91 5.360 3.439 -3.544 1.00 61.41 H new ATOM 0 HE22 GLN A 91 5.661 3.772 -5.253 1.00 61.41 H new ATOM 1551 N VAL A 92 2.460 0.767 -0.287 1.00 2.33 N ATOM 1552 CA VAL A 92 2.742 1.306 1.038 1.00 53.43 C ATOM 1553 C VAL A 92 4.260 1.307 1.178 1.00 74.40 C ATOM 1554 O VAL A 92 4.861 0.259 1.457 1.00 2.30 O ATOM 1555 CB VAL A 92 2.075 0.434 2.184 1.00 64.44 C ATOM 1556 CG1 VAL A 92 2.487 0.910 3.598 1.00 4.13 C ATOM 1557 CG2 VAL A 92 0.537 0.418 2.038 1.00 23.12 C ATOM 0 H VAL A 92 2.905 -0.135 -0.457 1.00 2.33 H new ATOM 0 HA VAL A 92 2.325 2.308 1.141 1.00 53.43 H new ATOM 0 HB VAL A 92 2.447 -0.584 2.067 1.00 64.44 H new ATOM 0 HG11 VAL A 92 2.005 0.283 4.348 1.00 4.13 H new ATOM 0 HG12 VAL A 92 3.569 0.838 3.705 1.00 4.13 H new ATOM 0 HG13 VAL A 92 2.177 1.946 3.738 1.00 4.13 H new ATOM 0 HG21 VAL A 92 0.102 -0.186 2.834 1.00 23.12 H new ATOM 0 HG22 VAL A 92 0.155 1.437 2.105 1.00 23.12 H new ATOM 0 HG23 VAL A 92 0.268 -0.008 1.072 1.00 23.12 H new ATOM 1567 N VAL A 93 4.894 2.468 0.938 1.00 3.13 N ATOM 1568 CA VAL A 93 6.326 2.615 1.157 1.00 31.02 C ATOM 1569 C VAL A 93 6.532 2.686 2.669 1.00 3.13 C ATOM 1570 O VAL A 93 6.337 3.736 3.285 1.00 10.03 O ATOM 1571 CB VAL A 93 6.930 3.900 0.460 1.00 55.21 C ATOM 1572 CG1 VAL A 93 8.473 3.943 0.613 1.00 33.34 C ATOM 1573 CG2 VAL A 93 6.504 3.991 -1.024 1.00 24.12 C ATOM 0 H VAL A 93 4.431 3.309 0.594 1.00 3.13 H new ATOM 0 HA VAL A 93 6.848 1.768 0.711 1.00 31.02 H new ATOM 0 HB VAL A 93 6.523 4.775 0.967 1.00 55.21 H new ATOM 0 HG11 VAL A 93 8.862 4.836 0.125 1.00 33.34 H new ATOM 0 HG12 VAL A 93 8.733 3.965 1.671 1.00 33.34 H new ATOM 0 HG13 VAL A 93 8.909 3.058 0.151 1.00 33.34 H new ATOM 0 HG21 VAL A 93 6.936 4.885 -1.472 1.00 24.12 H new ATOM 0 HG22 VAL A 93 6.858 3.110 -1.559 1.00 24.12 H new ATOM 0 HG23 VAL A 93 5.417 4.042 -1.088 1.00 24.12 H new ATOM 1583 N HIS A 94 6.862 1.532 3.252 1.00 52.31 N ATOM 1584 CA HIS A 94 7.144 1.409 4.688 1.00 74.44 C ATOM 1585 C HIS A 94 8.649 1.597 4.918 1.00 2.40 C ATOM 1586 O HIS A 94 9.368 2.002 3.990 1.00 13.13 O ATOM 1587 CB HIS A 94 6.611 0.057 5.246 1.00 31.14 C ATOM 1588 CG HIS A 94 7.184 -1.204 4.648 1.00 71.22 C ATOM 1589 ND1 HIS A 94 8.099 -1.998 5.309 1.00 22.13 N ATOM 1590 CD2 HIS A 94 6.911 -1.847 3.484 1.00 74.13 C ATOM 1591 CE1 HIS A 94 8.358 -3.064 4.580 1.00 5.25 C ATOM 1592 NE2 HIS A 94 7.657 -2.999 3.468 1.00 13.34 N ATOM 0 H HIS A 94 6.942 0.652 2.742 1.00 52.31 H new ATOM 0 HA HIS A 94 6.619 2.188 5.240 1.00 74.44 H new ATOM 0 HB2 HIS A 94 6.796 0.037 6.320 1.00 31.14 H new ATOM 0 HB3 HIS A 94 5.530 0.036 5.108 1.00 31.14 H new ATOM 0 HD2 HIS A 94 6.232 -1.514 2.713 1.00 74.13 H new ATOM 0 HE1 HIS A 94 9.035 -3.861 4.850 1.00 5.25 H new ATOM 0 HE2 HIS A 94 7.667 -3.690 2.718 1.00 13.34 H new ATOM 1601 N ASP A 95 9.106 1.311 6.147 1.00 3.20 N ATOM 1602 CA ASP A 95 10.484 1.563 6.588 1.00 32.02 C ATOM 1603 C ASP A 95 11.528 0.920 5.652 1.00 22.03 C ATOM 1604 O ASP A 95 12.363 1.626 5.070 1.00 21.05 O ATOM 1605 CB ASP A 95 10.657 1.066 8.048 1.00 22.11 C ATOM 1606 CG ASP A 95 12.085 1.255 8.585 1.00 62.53 C ATOM 1607 OD1 ASP A 95 12.425 2.378 9.013 1.00 25.02 O ATOM 1608 OD2 ASP A 95 12.868 0.277 8.598 1.00 23.43 O ATOM 0 H ASP A 95 8.521 0.893 6.870 1.00 3.20 H new ATOM 0 HA ASP A 95 10.661 2.638 6.548 1.00 32.02 H new ATOM 0 HB2 ASP A 95 9.959 1.601 8.692 1.00 22.11 H new ATOM 0 HB3 ASP A 95 10.393 0.010 8.099 1.00 22.11 H new ATOM 1613 N ALA A 96 11.427 -0.407 5.482 1.00 23.33 N ATOM 1614 CA ALA A 96 12.398 -1.206 4.709 1.00 54.24 C ATOM 1615 C ALA A 96 12.344 -0.897 3.201 1.00 62.12 C ATOM 1616 O ALA A 96 13.336 -0.443 2.619 1.00 64.44 O ATOM 1617 CB ALA A 96 12.152 -2.697 4.961 1.00 3.24 C ATOM 0 H ALA A 96 10.667 -0.961 5.877 1.00 23.33 H new ATOM 0 HA ALA A 96 13.397 -0.935 5.050 1.00 54.24 H new ATOM 0 HB1 ALA A 96 12.870 -3.286 4.390 1.00 3.24 H new ATOM 0 HB2 ALA A 96 12.271 -2.911 6.023 1.00 3.24 H new ATOM 0 HB3 ALA A 96 11.140 -2.957 4.650 1.00 3.24 H new ATOM 1623 N ASN A 97 11.176 -1.136 2.581 1.00 41.34 N ATOM 1624 CA ASN A 97 11.013 -1.019 1.114 1.00 43.35 C ATOM 1625 C ASN A 97 9.584 -0.595 0.748 1.00 35.04 C ATOM 1626 O ASN A 97 8.760 -0.320 1.627 1.00 60.02 O ATOM 1627 CB ASN A 97 11.394 -2.362 0.399 1.00 3.53 C ATOM 1628 CG ASN A 97 10.452 -3.549 0.703 1.00 65.25 C ATOM 1629 OD1 ASN A 97 9.874 -3.659 1.786 1.00 52.42 O ATOM 1630 ND2 ASN A 97 10.304 -4.460 -0.253 1.00 70.14 N ATOM 0 H ASN A 97 10.325 -1.413 3.071 1.00 41.34 H new ATOM 0 HA ASN A 97 11.694 -0.243 0.765 1.00 43.35 H new ATOM 0 HB2 ASN A 97 11.406 -2.193 -0.678 1.00 3.53 H new ATOM 0 HB3 ASN A 97 12.408 -2.637 0.690 1.00 3.53 H new ATOM 0 HD21 ASN A 97 9.703 -5.269 -0.098 1.00 70.14 H new ATOM 0 HD22 ASN A 97 10.791 -4.350 -1.142 1.00 70.14 H new ATOM 1637 N THR A 98 9.320 -0.511 -0.565 1.00 34.23 N ATOM 1638 CA THR A 98 7.985 -0.252 -1.107 1.00 73.41 C ATOM 1639 C THR A 98 7.193 -1.579 -1.192 1.00 14.02 C ATOM 1640 O THR A 98 7.587 -2.504 -1.917 1.00 42.33 O ATOM 1641 CB THR A 98 8.081 0.422 -2.520 1.00 63.52 C ATOM 1642 OG1 THR A 98 8.912 1.595 -2.440 1.00 22.13 O ATOM 1643 CG2 THR A 98 6.698 0.818 -3.077 1.00 63.12 C ATOM 0 H THR A 98 10.036 -0.622 -1.283 1.00 34.23 H new ATOM 0 HA THR A 98 7.461 0.435 -0.442 1.00 73.41 H new ATOM 0 HB THR A 98 8.516 -0.311 -3.200 1.00 63.52 H new ATOM 0 HG1 THR A 98 8.972 2.014 -3.324 1.00 22.13 H new ATOM 0 HG21 THR A 98 6.819 1.280 -4.057 1.00 63.12 H new ATOM 0 HG22 THR A 98 6.075 -0.072 -3.170 1.00 63.12 H new ATOM 0 HG23 THR A 98 6.221 1.525 -2.398 1.00 63.12 H new ATOM 1651 N LEU A 99 6.113 -1.666 -0.405 1.00 22.55 N ATOM 1652 CA LEU A 99 5.182 -2.811 -0.416 1.00 11.34 C ATOM 1653 C LEU A 99 4.162 -2.606 -1.546 1.00 44.45 C ATOM 1654 O LEU A 99 3.719 -1.488 -1.768 1.00 3.01 O ATOM 1655 CB LEU A 99 4.459 -2.925 0.958 1.00 32.31 C ATOM 1656 CG LEU A 99 3.414 -4.080 1.108 1.00 4.25 C ATOM 1657 CD1 LEU A 99 4.062 -5.459 0.884 1.00 13.22 C ATOM 1658 CD2 LEU A 99 2.700 -4.011 2.477 1.00 15.21 C ATOM 0 H LEU A 99 5.855 -0.940 0.264 1.00 22.55 H new ATOM 0 HA LEU A 99 5.733 -3.736 -0.587 1.00 11.34 H new ATOM 0 HB2 LEU A 99 5.216 -3.049 1.732 1.00 32.31 H new ATOM 0 HB3 LEU A 99 3.953 -1.980 1.156 1.00 32.31 H new ATOM 0 HG LEU A 99 2.660 -3.944 0.333 1.00 4.25 H new ATOM 0 HD11 LEU A 99 3.308 -6.238 0.996 1.00 13.22 H new ATOM 0 HD12 LEU A 99 4.484 -5.504 -0.120 1.00 13.22 H new ATOM 0 HD13 LEU A 99 4.853 -5.613 1.618 1.00 13.22 H new ATOM 0 HD21 LEU A 99 1.980 -4.826 2.553 1.00 15.21 H new ATOM 0 HD22 LEU A 99 3.436 -4.101 3.276 1.00 15.21 H new ATOM 0 HD23 LEU A 99 2.180 -3.057 2.569 1.00 15.21 H new ATOM 1670 N TYR A 100 3.813 -3.682 -2.268 1.00 1.34 N ATOM 1671 CA TYR A 100 2.833 -3.627 -3.374 1.00 1.42 C ATOM 1672 C TYR A 100 1.618 -4.495 -3.031 1.00 2.10 C ATOM 1673 O TYR A 100 1.732 -5.716 -2.908 1.00 23.15 O ATOM 1674 CB TYR A 100 3.492 -4.063 -4.706 1.00 72.52 C ATOM 1675 CG TYR A 100 4.542 -3.054 -5.197 1.00 71.34 C ATOM 1676 CD1 TYR A 100 4.148 -1.814 -5.712 1.00 24.53 C ATOM 1677 CD2 TYR A 100 5.912 -3.323 -5.134 1.00 11.55 C ATOM 1678 CE1 TYR A 100 5.076 -0.888 -6.142 1.00 14.44 C ATOM 1679 CE2 TYR A 100 6.842 -2.395 -5.568 1.00 5.15 C ATOM 1680 CZ TYR A 100 6.419 -1.183 -6.070 1.00 4.25 C ATOM 1681 OH TYR A 100 7.345 -0.257 -6.497 1.00 4.22 O ATOM 0 H TYR A 100 4.198 -4.613 -2.106 1.00 1.34 H new ATOM 0 HA TYR A 100 2.491 -2.600 -3.504 1.00 1.42 H new ATOM 0 HB2 TYR A 100 3.962 -5.037 -4.574 1.00 72.52 H new ATOM 0 HB3 TYR A 100 2.722 -4.181 -5.468 1.00 72.52 H new ATOM 0 HD1 TYR A 100 3.096 -1.577 -5.774 1.00 24.53 H new ATOM 0 HD2 TYR A 100 6.250 -4.270 -4.740 1.00 11.55 H new ATOM 0 HE1 TYR A 100 4.750 0.064 -6.533 1.00 14.44 H new ATOM 0 HE2 TYR A 100 7.897 -2.620 -5.514 1.00 5.15 H new ATOM 0 HH TYR A 100 7.018 0.182 -7.310 1.00 4.22 H new ATOM 1691 N ILE A 101 0.476 -3.822 -2.844 1.00 2.55 N ATOM 1692 CA ILE A 101 -0.808 -4.434 -2.459 1.00 21.43 C ATOM 1693 C ILE A 101 -1.805 -4.295 -3.639 1.00 63.52 C ATOM 1694 O ILE A 101 -1.648 -3.408 -4.478 1.00 4.11 O ATOM 1695 CB ILE A 101 -1.392 -3.724 -1.173 1.00 51.20 C ATOM 1696 CG1 ILE A 101 -0.300 -3.575 -0.062 1.00 22.52 C ATOM 1697 CG2 ILE A 101 -2.619 -4.482 -0.622 1.00 64.13 C ATOM 1698 CD1 ILE A 101 -0.746 -2.786 1.159 1.00 1.10 C ATOM 0 H ILE A 101 0.415 -2.810 -2.959 1.00 2.55 H new ATOM 0 HA ILE A 101 -0.652 -5.488 -2.229 1.00 21.43 H new ATOM 0 HB ILE A 101 -1.714 -2.726 -1.472 1.00 51.20 H new ATOM 0 HG12 ILE A 101 0.013 -4.569 0.258 1.00 22.52 H new ATOM 0 HG13 ILE A 101 0.575 -3.089 -0.493 1.00 22.52 H new ATOM 0 HG21 ILE A 101 -2.997 -3.969 0.262 1.00 64.13 H new ATOM 0 HG22 ILE A 101 -3.398 -4.515 -1.383 1.00 64.13 H new ATOM 0 HG23 ILE A 101 -2.329 -5.498 -0.355 1.00 64.13 H new ATOM 0 HD11 ILE A 101 0.073 -2.733 1.877 1.00 1.10 H new ATOM 0 HD12 ILE A 101 -1.030 -1.778 0.857 1.00 1.10 H new ATOM 0 HD13 ILE A 101 -1.601 -3.281 1.620 1.00 1.10 H new ATOM 1710 N PHE A 102 -2.814 -5.189 -3.698 1.00 30.03 N ATOM 1711 CA PHE A 102 -3.850 -5.218 -4.753 1.00 52.34 C ATOM 1712 C PHE A 102 -5.229 -5.307 -4.069 1.00 72.11 C ATOM 1713 O PHE A 102 -5.422 -6.158 -3.188 1.00 42.52 O ATOM 1714 CB PHE A 102 -3.625 -6.446 -5.696 1.00 33.23 C ATOM 1715 CG PHE A 102 -2.241 -6.484 -6.354 1.00 3.53 C ATOM 1716 CD1 PHE A 102 -1.161 -7.114 -5.727 1.00 60.52 C ATOM 1717 CD2 PHE A 102 -2.006 -5.856 -7.575 1.00 52.43 C ATOM 1718 CE1 PHE A 102 0.097 -7.107 -6.293 1.00 12.42 C ATOM 1719 CE2 PHE A 102 -0.742 -5.860 -8.145 1.00 11.55 C ATOM 1720 CZ PHE A 102 0.306 -6.480 -7.503 1.00 15.12 C ATOM 0 H PHE A 102 -2.934 -5.924 -3.001 1.00 30.03 H new ATOM 0 HA PHE A 102 -3.795 -4.315 -5.361 1.00 52.34 H new ATOM 0 HB2 PHE A 102 -3.768 -7.362 -5.123 1.00 33.23 H new ATOM 0 HB3 PHE A 102 -4.386 -6.436 -6.476 1.00 33.23 H new ATOM 0 HD1 PHE A 102 -1.315 -7.615 -4.783 1.00 60.52 H new ATOM 0 HD2 PHE A 102 -2.819 -5.360 -8.084 1.00 52.43 H new ATOM 0 HE1 PHE A 102 0.919 -7.593 -5.788 1.00 12.42 H new ATOM 0 HE2 PHE A 102 -0.579 -5.375 -9.096 1.00 11.55 H new ATOM 0 HZ PHE A 102 1.291 -6.475 -7.947 1.00 15.12 H new ATOM 1730 N ALA A 103 -6.169 -4.433 -4.462 1.00 12.33 N ATOM 1731 CA ALA A 103 -7.515 -4.354 -3.847 1.00 71.11 C ATOM 1732 C ALA A 103 -8.521 -5.282 -4.564 1.00 52.53 C ATOM 1733 O ALA A 103 -8.370 -5.526 -5.748 1.00 34.44 O ATOM 1734 CB ALA A 103 -7.999 -2.900 -3.881 1.00 1.25 C ATOM 0 H ALA A 103 -6.023 -3.759 -5.214 1.00 12.33 H new ATOM 0 HA ALA A 103 -7.448 -4.692 -2.813 1.00 71.11 H new ATOM 0 HB1 ALA A 103 -8.989 -2.835 -3.430 1.00 1.25 H new ATOM 0 HB2 ALA A 103 -7.304 -2.272 -3.323 1.00 1.25 H new ATOM 0 HB3 ALA A 103 -8.048 -2.557 -4.914 1.00 1.25 H new ATOM 1740 N PRO A 104 -9.563 -5.836 -3.864 1.00 70.13 N ATOM 1741 CA PRO A 104 -10.605 -6.669 -4.528 1.00 14.04 C ATOM 1742 C PRO A 104 -11.529 -5.838 -5.444 1.00 40.31 C ATOM 1743 O PRO A 104 -12.034 -6.349 -6.445 1.00 62.13 O ATOM 1744 CB PRO A 104 -11.386 -7.268 -3.337 1.00 34.50 C ATOM 1745 CG PRO A 104 -11.209 -6.269 -2.236 1.00 62.43 C ATOM 1746 CD PRO A 104 -9.802 -5.737 -2.396 1.00 63.22 C ATOM 0 HA PRO A 104 -10.176 -7.422 -5.189 1.00 14.04 H new ATOM 0 HB2 PRO A 104 -12.439 -7.407 -3.582 1.00 34.50 H new ATOM 0 HB3 PRO A 104 -10.993 -8.245 -3.055 1.00 34.50 H new ATOM 0 HG2 PRO A 104 -11.943 -5.467 -2.312 1.00 62.43 H new ATOM 0 HG3 PRO A 104 -11.344 -6.733 -1.259 1.00 62.43 H new ATOM 0 HD2 PRO A 104 -9.718 -4.709 -2.043 1.00 63.22 H new ATOM 0 HD3 PRO A 104 -9.082 -6.328 -1.830 1.00 63.22 H new ATOM 1754 N SER A 105 -11.724 -4.549 -5.094 1.00 60.15 N ATOM 1755 CA SER A 105 -12.659 -3.645 -5.790 1.00 52.01 C ATOM 1756 C SER A 105 -12.011 -2.250 -6.017 1.00 42.24 C ATOM 1757 O SER A 105 -11.128 -1.847 -5.242 1.00 24.33 O ATOM 1758 CB SER A 105 -13.965 -3.513 -4.961 1.00 72.20 C ATOM 1759 OG SER A 105 -14.541 -4.786 -4.680 1.00 5.35 O ATOM 0 H SER A 105 -11.234 -4.106 -4.317 1.00 60.15 H new ATOM 0 HA SER A 105 -12.897 -4.065 -6.767 1.00 52.01 H new ATOM 0 HB2 SER A 105 -13.752 -2.995 -4.026 1.00 72.20 H new ATOM 0 HB3 SER A 105 -14.683 -2.901 -5.507 1.00 72.20 H new ATOM 0 HG SER A 105 -15.360 -4.666 -4.156 1.00 5.35 H new ATOM 1765 N PRO A 106 -12.446 -1.484 -7.086 1.00 62.42 N ATOM 1766 CA PRO A 106 -11.951 -0.099 -7.357 1.00 44.33 C ATOM 1767 C PRO A 106 -12.265 0.891 -6.213 1.00 34.01 C ATOM 1768 O PRO A 106 -11.512 1.848 -5.986 1.00 41.13 O ATOM 1769 CB PRO A 106 -12.690 0.300 -8.667 1.00 62.34 C ATOM 1770 CG PRO A 106 -13.882 -0.609 -8.733 1.00 20.51 C ATOM 1771 CD PRO A 106 -13.417 -1.917 -8.139 1.00 74.14 C ATOM 0 HA PRO A 106 -10.865 -0.068 -7.443 1.00 44.33 H new ATOM 0 HB2 PRO A 106 -12.993 1.347 -8.646 1.00 62.34 H new ATOM 0 HB3 PRO A 106 -12.047 0.171 -9.538 1.00 62.34 H new ATOM 0 HG2 PRO A 106 -14.722 -0.198 -8.172 1.00 20.51 H new ATOM 0 HG3 PRO A 106 -14.220 -0.741 -9.761 1.00 20.51 H new ATOM 0 HD2 PRO A 106 -14.245 -2.484 -7.715 1.00 74.14 H new ATOM 0 HD3 PRO A 106 -12.944 -2.554 -8.886 1.00 74.14 H new ATOM 1779 N GLN A 107 -13.345 0.607 -5.456 1.00 32.04 N ATOM 1780 CA GLN A 107 -13.815 1.485 -4.366 1.00 12.34 C ATOM 1781 C GLN A 107 -13.033 1.157 -3.080 1.00 45.45 C ATOM 1782 O GLN A 107 -12.790 2.039 -2.245 1.00 43.22 O ATOM 1783 CB GLN A 107 -15.347 1.328 -4.135 1.00 13.23 C ATOM 1784 CG GLN A 107 -15.818 -0.100 -3.772 1.00 72.40 C ATOM 1785 CD GLN A 107 -17.278 -0.169 -3.303 1.00 30.44 C ATOM 1786 OE1 GLN A 107 -17.560 -0.069 -2.105 1.00 23.23 O ATOM 1787 NE2 GLN A 107 -18.213 -0.324 -4.228 1.00 43.25 N ATOM 0 H GLN A 107 -13.912 -0.232 -5.582 1.00 32.04 H new ATOM 0 HA GLN A 107 -13.635 2.523 -4.646 1.00 12.34 H new ATOM 0 HB2 GLN A 107 -15.649 2.006 -3.337 1.00 13.23 H new ATOM 0 HB3 GLN A 107 -15.868 1.646 -5.038 1.00 13.23 H new ATOM 0 HG2 GLN A 107 -15.694 -0.746 -4.642 1.00 72.40 H new ATOM 0 HG3 GLN A 107 -15.174 -0.496 -2.987 1.00 72.40 H new ATOM 0 HE21 GLN A 107 -17.950 -0.404 -5.210 1.00 43.25 H new ATOM 0 HE22 GLN A 107 -19.196 -0.363 -3.958 1.00 43.25 H new ATOM 1796 N SER A 108 -12.632 -0.131 -2.952 1.00 13.33 N ATOM 1797 CA SER A 108 -11.840 -0.632 -1.823 1.00 62.21 C ATOM 1798 C SER A 108 -10.448 -0.006 -1.847 1.00 64.22 C ATOM 1799 O SER A 108 -9.938 0.408 -0.814 1.00 34.30 O ATOM 1800 CB SER A 108 -11.738 -2.168 -1.892 1.00 13.40 C ATOM 1801 OG SER A 108 -13.023 -2.737 -1.998 1.00 24.42 O ATOM 0 H SER A 108 -12.856 -0.850 -3.640 1.00 13.33 H new ATOM 0 HA SER A 108 -12.332 -0.356 -0.890 1.00 62.21 H new ATOM 0 HB2 SER A 108 -11.131 -2.461 -2.748 1.00 13.40 H new ATOM 0 HB3 SER A 108 -11.237 -2.547 -1.001 1.00 13.40 H new ATOM 0 HG SER A 108 -13.024 -3.623 -1.580 1.00 24.42 H new ATOM 1807 N ARG A 109 -9.851 0.047 -3.057 1.00 31.14 N ATOM 1808 CA ARG A 109 -8.578 0.744 -3.319 1.00 41.35 C ATOM 1809 C ARG A 109 -8.624 2.203 -2.842 1.00 14.42 C ATOM 1810 O ARG A 109 -7.747 2.640 -2.104 1.00 33.10 O ATOM 1811 CB ARG A 109 -8.283 0.685 -4.845 1.00 72.35 C ATOM 1812 CG ARG A 109 -6.931 1.326 -5.317 1.00 32.35 C ATOM 1813 CD ARG A 109 -7.122 2.473 -6.342 1.00 14.11 C ATOM 1814 NE ARG A 109 -7.462 3.761 -5.701 1.00 1.44 N ATOM 1815 CZ ARG A 109 -8.244 4.720 -6.227 1.00 15.52 C ATOM 1816 NH1 ARG A 109 -8.823 4.577 -7.419 1.00 41.43 N ATOM 1817 NH2 ARG A 109 -8.395 5.864 -5.574 1.00 10.43 N ATOM 0 H ARG A 109 -10.245 -0.398 -3.886 1.00 31.14 H new ATOM 0 HA ARG A 109 -7.783 0.247 -2.762 1.00 41.35 H new ATOM 0 HB2 ARG A 109 -8.293 -0.360 -5.155 1.00 72.35 H new ATOM 0 HB3 ARG A 109 -9.099 1.181 -5.371 1.00 72.35 H new ATOM 0 HG2 ARG A 109 -6.396 1.710 -4.448 1.00 32.35 H new ATOM 0 HG3 ARG A 109 -6.305 0.552 -5.761 1.00 32.35 H new ATOM 0 HD2 ARG A 109 -6.207 2.591 -6.923 1.00 14.11 H new ATOM 0 HD3 ARG A 109 -7.912 2.201 -7.042 1.00 14.11 H new ATOM 0 HE ARG A 109 -7.068 3.938 -4.777 1.00 1.44 H new ATOM 0 HH11 ARG A 109 -8.678 3.723 -7.957 1.00 41.43 H new ATOM 0 HH12 ARG A 109 -9.411 5.322 -7.793 1.00 41.43 H new ATOM 0 HH21 ARG A 109 -7.920 6.009 -4.683 1.00 10.43 H new ATOM 0 HH22 ARG A 109 -8.986 6.599 -5.963 1.00 10.43 H new ATOM 1831 N ASP A 110 -9.682 2.923 -3.259 1.00 5.40 N ATOM 1832 CA ASP A 110 -9.866 4.358 -2.951 1.00 72.04 C ATOM 1833 C ASP A 110 -9.971 4.591 -1.430 1.00 4.02 C ATOM 1834 O ASP A 110 -9.388 5.546 -0.896 1.00 44.52 O ATOM 1835 CB ASP A 110 -11.127 4.901 -3.681 1.00 64.03 C ATOM 1836 CG ASP A 110 -11.271 6.436 -3.577 1.00 11.21 C ATOM 1837 OD1 ASP A 110 -11.846 6.933 -2.578 1.00 44.50 O ATOM 1838 OD2 ASP A 110 -10.823 7.158 -4.508 1.00 31.45 O ATOM 0 H ASP A 110 -10.436 2.527 -3.820 1.00 5.40 H new ATOM 0 HA ASP A 110 -8.992 4.902 -3.308 1.00 72.04 H new ATOM 0 HB2 ASP A 110 -11.082 4.616 -4.732 1.00 64.03 H new ATOM 0 HB3 ASP A 110 -12.015 4.429 -3.260 1.00 64.03 H new ATOM 1843 N LEU A 111 -10.696 3.679 -0.756 1.00 40.34 N ATOM 1844 CA LEU A 111 -10.922 3.734 0.697 1.00 51.30 C ATOM 1845 C LEU A 111 -9.604 3.475 1.452 1.00 65.24 C ATOM 1846 O LEU A 111 -9.246 4.237 2.351 1.00 21.32 O ATOM 1847 CB LEU A 111 -12.021 2.711 1.120 1.00 53.01 C ATOM 1848 CG LEU A 111 -12.551 2.830 2.591 1.00 44.12 C ATOM 1849 CD1 LEU A 111 -13.166 4.222 2.864 1.00 65.14 C ATOM 1850 CD2 LEU A 111 -13.563 1.702 2.913 1.00 32.44 C ATOM 0 H LEU A 111 -11.143 2.881 -1.207 1.00 40.34 H new ATOM 0 HA LEU A 111 -11.275 4.732 0.959 1.00 51.30 H new ATOM 0 HB2 LEU A 111 -12.867 2.818 0.442 1.00 53.01 H new ATOM 0 HB3 LEU A 111 -11.625 1.705 0.979 1.00 53.01 H new ATOM 0 HG LEU A 111 -11.695 2.714 3.256 1.00 44.12 H new ATOM 0 HD11 LEU A 111 -13.522 4.267 3.893 1.00 65.14 H new ATOM 0 HD12 LEU A 111 -12.409 4.991 2.708 1.00 65.14 H new ATOM 0 HD13 LEU A 111 -14.001 4.391 2.183 1.00 65.14 H new ATOM 0 HD21 LEU A 111 -13.914 1.810 3.939 1.00 32.44 H new ATOM 0 HD22 LEU A 111 -14.411 1.768 2.231 1.00 32.44 H new ATOM 0 HD23 LEU A 111 -13.078 0.733 2.795 1.00 32.44 H new ATOM 1862 N TRP A 112 -8.879 2.412 1.041 1.00 54.10 N ATOM 1863 CA TRP A 112 -7.608 1.998 1.671 1.00 42.43 C ATOM 1864 C TRP A 112 -6.508 3.062 1.545 1.00 40.22 C ATOM 1865 O TRP A 112 -5.847 3.369 2.542 1.00 3.52 O ATOM 1866 CB TRP A 112 -7.117 0.638 1.084 1.00 31.52 C ATOM 1867 CG TRP A 112 -7.648 -0.564 1.821 1.00 15.41 C ATOM 1868 CD1 TRP A 112 -8.697 -1.364 1.475 1.00 52.13 C ATOM 1869 CD2 TRP A 112 -7.138 -1.084 3.058 1.00 13.32 C ATOM 1870 NE1 TRP A 112 -8.881 -2.329 2.422 1.00 71.01 N ATOM 1871 CE2 TRP A 112 -7.933 -2.190 3.402 1.00 51.21 C ATOM 1872 CE3 TRP A 112 -6.087 -0.720 3.907 1.00 35.32 C ATOM 1873 CZ2 TRP A 112 -7.711 -2.935 4.557 1.00 23.11 C ATOM 1874 CZ3 TRP A 112 -5.867 -1.461 5.049 1.00 60.43 C ATOM 1875 CH2 TRP A 112 -6.676 -2.561 5.367 1.00 61.21 C ATOM 0 H TRP A 112 -9.160 1.817 0.262 1.00 54.10 H new ATOM 0 HA TRP A 112 -7.813 1.876 2.734 1.00 42.43 H new ATOM 0 HB2 TRP A 112 -7.417 0.574 0.038 1.00 31.52 H new ATOM 0 HB3 TRP A 112 -6.027 0.615 1.105 1.00 31.52 H new ATOM 0 HD1 TRP A 112 -9.294 -1.250 0.582 1.00 52.13 H new ATOM 0 HE1 TRP A 112 -9.610 -3.042 2.403 1.00 71.01 H new ATOM 0 HE3 TRP A 112 -5.459 0.127 3.672 1.00 35.32 H new ATOM 0 HZ2 TRP A 112 -8.336 -3.780 4.805 1.00 23.11 H new ATOM 0 HZ3 TRP A 112 -5.057 -1.189 5.710 1.00 60.43 H new ATOM 0 HH2 TRP A 112 -6.478 -3.123 6.268 1.00 61.21 H new ATOM 1886 N VAL A 113 -6.313 3.616 0.324 1.00 44.45 N ATOM 1887 CA VAL A 113 -5.281 4.646 0.088 1.00 74.53 C ATOM 1888 C VAL A 113 -5.570 5.871 0.970 1.00 11.31 C ATOM 1889 O VAL A 113 -4.678 6.360 1.654 1.00 53.41 O ATOM 1890 CB VAL A 113 -5.180 5.090 -1.424 1.00 24.02 C ATOM 1891 CG1 VAL A 113 -4.094 6.173 -1.626 1.00 60.51 C ATOM 1892 CG2 VAL A 113 -4.909 3.890 -2.351 1.00 24.41 C ATOM 0 H VAL A 113 -6.854 3.367 -0.504 1.00 44.45 H new ATOM 0 HA VAL A 113 -4.321 4.201 0.349 1.00 74.53 H new ATOM 0 HB VAL A 113 -6.146 5.518 -1.691 1.00 24.02 H new ATOM 0 HG11 VAL A 113 -4.052 6.455 -2.678 1.00 60.51 H new ATOM 0 HG12 VAL A 113 -4.338 7.049 -1.025 1.00 60.51 H new ATOM 0 HG13 VAL A 113 -3.126 5.779 -1.317 1.00 60.51 H new ATOM 0 HG21 VAL A 113 -4.846 4.235 -3.383 1.00 24.41 H new ATOM 0 HG22 VAL A 113 -3.969 3.417 -2.068 1.00 24.41 H new ATOM 0 HG23 VAL A 113 -5.720 3.168 -2.258 1.00 24.41 H new ATOM 1902 N LYS A 114 -6.854 6.294 0.983 1.00 71.43 N ATOM 1903 CA LYS A 114 -7.336 7.433 1.791 1.00 33.40 C ATOM 1904 C LYS A 114 -7.049 7.228 3.289 1.00 40.11 C ATOM 1905 O LYS A 114 -6.458 8.102 3.924 1.00 4.34 O ATOM 1906 CB LYS A 114 -8.864 7.650 1.548 1.00 72.24 C ATOM 1907 CG LYS A 114 -9.590 8.522 2.610 1.00 32.11 C ATOM 1908 CD LYS A 114 -11.082 8.776 2.284 1.00 52.31 C ATOM 1909 CE LYS A 114 -11.286 9.738 1.103 1.00 24.32 C ATOM 1910 NZ LYS A 114 -10.778 11.105 1.402 1.00 55.22 N ATOM 0 H LYS A 114 -7.588 5.851 0.430 1.00 71.43 H new ATOM 0 HA LYS A 114 -6.794 8.324 1.475 1.00 33.40 H new ATOM 0 HB2 LYS A 114 -8.997 8.113 0.570 1.00 72.24 H new ATOM 0 HB3 LYS A 114 -9.350 6.675 1.509 1.00 72.24 H new ATOM 0 HG2 LYS A 114 -9.516 8.034 3.582 1.00 32.11 H new ATOM 0 HG3 LYS A 114 -9.077 9.480 2.695 1.00 32.11 H new ATOM 0 HD2 LYS A 114 -11.565 7.825 2.058 1.00 52.31 H new ATOM 0 HD3 LYS A 114 -11.576 9.183 3.166 1.00 52.31 H new ATOM 0 HE2 LYS A 114 -10.775 9.346 0.224 1.00 24.32 H new ATOM 0 HE3 LYS A 114 -12.347 9.791 0.858 1.00 24.32 H new ATOM 0 HZ1 LYS A 114 -10.996 11.738 0.606 1.00 55.22 H new ATOM 0 HZ2 LYS A 114 -11.234 11.464 2.265 1.00 55.22 H new ATOM 0 HZ3 LYS A 114 -9.748 11.069 1.544 1.00 55.22 H new ATOM 1924 N LYS A 115 -7.459 6.063 3.832 1.00 12.43 N ATOM 1925 CA LYS A 115 -7.305 5.765 5.266 1.00 2.32 C ATOM 1926 C LYS A 115 -5.826 5.793 5.671 1.00 52.31 C ATOM 1927 O LYS A 115 -5.443 6.537 6.573 1.00 73.25 O ATOM 1928 CB LYS A 115 -7.949 4.394 5.630 1.00 72.30 C ATOM 1929 CG LYS A 115 -9.489 4.346 5.492 1.00 73.44 C ATOM 1930 CD LYS A 115 -10.206 5.375 6.400 1.00 53.04 C ATOM 1931 CE LYS A 115 -11.730 5.404 6.191 1.00 44.40 C ATOM 1932 NZ LYS A 115 -12.404 6.316 7.160 1.00 11.13 N ATOM 0 H LYS A 115 -7.899 5.315 3.296 1.00 12.43 H new ATOM 0 HA LYS A 115 -7.829 6.540 5.825 1.00 2.32 H new ATOM 0 HB2 LYS A 115 -7.516 3.624 4.991 1.00 72.30 H new ATOM 0 HB3 LYS A 115 -7.682 4.144 6.657 1.00 72.30 H new ATOM 0 HG2 LYS A 115 -9.762 4.533 4.453 1.00 73.44 H new ATOM 0 HG3 LYS A 115 -9.840 3.344 5.739 1.00 73.44 H new ATOM 0 HD2 LYS A 115 -9.992 5.141 7.443 1.00 53.04 H new ATOM 0 HD3 LYS A 115 -9.799 6.368 6.206 1.00 53.04 H new ATOM 0 HE2 LYS A 115 -11.951 5.727 5.174 1.00 44.40 H new ATOM 0 HE3 LYS A 115 -12.131 4.396 6.300 1.00 44.40 H new ATOM 0 HZ1 LYS A 115 -13.430 6.309 6.988 1.00 11.13 H new ATOM 0 HZ2 LYS A 115 -12.214 5.994 8.130 1.00 11.13 H new ATOM 0 HZ3 LYS A 115 -12.039 7.282 7.038 1.00 11.13 H new ATOM 1946 N LEU A 116 -5.012 5.020 4.937 1.00 30.24 N ATOM 1947 CA LEU A 116 -3.571 4.891 5.182 1.00 31.23 C ATOM 1948 C LEU A 116 -2.858 6.261 5.104 1.00 3.32 C ATOM 1949 O LEU A 116 -2.281 6.709 6.104 1.00 43.03 O ATOM 1950 CB LEU A 116 -2.960 3.883 4.171 1.00 44.14 C ATOM 1951 CG LEU A 116 -3.327 2.376 4.375 1.00 13.34 C ATOM 1952 CD1 LEU A 116 -2.909 1.520 3.159 1.00 25.02 C ATOM 1953 CD2 LEU A 116 -2.689 1.831 5.667 1.00 73.10 C ATOM 0 H LEU A 116 -5.341 4.462 4.149 1.00 30.24 H new ATOM 0 HA LEU A 116 -3.422 4.513 6.193 1.00 31.23 H new ATOM 0 HB2 LEU A 116 -3.270 4.176 3.168 1.00 44.14 H new ATOM 0 HB3 LEU A 116 -1.875 3.977 4.210 1.00 44.14 H new ATOM 0 HG LEU A 116 -4.411 2.311 4.468 1.00 13.34 H new ATOM 0 HD11 LEU A 116 -3.180 0.479 3.336 1.00 25.02 H new ATOM 0 HD12 LEU A 116 -3.421 1.881 2.267 1.00 25.02 H new ATOM 0 HD13 LEU A 116 -1.831 1.595 3.014 1.00 25.02 H new ATOM 0 HD21 LEU A 116 -2.957 0.782 5.790 1.00 73.10 H new ATOM 0 HD22 LEU A 116 -1.605 1.924 5.605 1.00 73.10 H new ATOM 0 HD23 LEU A 116 -3.054 2.401 6.521 1.00 73.10 H new ATOM 1965 N LYS A 117 -2.930 6.932 3.925 1.00 64.45 N ATOM 1966 CA LYS A 117 -2.203 8.199 3.694 1.00 25.12 C ATOM 1967 C LYS A 117 -2.666 9.350 4.609 1.00 12.52 C ATOM 1968 O LYS A 117 -1.856 10.211 4.968 1.00 51.42 O ATOM 1969 CB LYS A 117 -2.209 8.631 2.198 1.00 74.24 C ATOM 1970 CG LYS A 117 -3.514 9.233 1.631 1.00 53.11 C ATOM 1971 CD LYS A 117 -3.373 9.552 0.118 1.00 63.11 C ATOM 1972 CE LYS A 117 -4.707 9.869 -0.566 1.00 54.44 C ATOM 1973 NZ LYS A 117 -4.536 10.009 -2.040 1.00 34.43 N ATOM 0 H LYS A 117 -3.481 6.616 3.127 1.00 64.45 H new ATOM 0 HA LYS A 117 -1.171 7.982 3.968 1.00 25.12 H new ATOM 0 HB2 LYS A 117 -1.413 9.362 2.057 1.00 74.24 H new ATOM 0 HB3 LYS A 117 -1.952 7.759 1.596 1.00 74.24 H new ATOM 0 HG2 LYS A 117 -4.336 8.534 1.783 1.00 53.11 H new ATOM 0 HG3 LYS A 117 -3.765 10.143 2.176 1.00 53.11 H new ATOM 0 HD2 LYS A 117 -2.700 10.400 -0.005 1.00 63.11 H new ATOM 0 HD3 LYS A 117 -2.910 8.702 -0.383 1.00 63.11 H new ATOM 0 HE2 LYS A 117 -5.425 9.077 -0.354 1.00 54.44 H new ATOM 0 HE3 LYS A 117 -5.119 10.791 -0.156 1.00 54.44 H new ATOM 0 HZ1 LYS A 117 -4.663 11.005 -2.311 1.00 34.43 H new ATOM 0 HZ2 LYS A 117 -3.582 9.696 -2.310 1.00 34.43 H new ATOM 0 HZ3 LYS A 117 -5.244 9.424 -2.529 1.00 34.43 H new ATOM 1987 N GLU A 118 -3.962 9.372 4.983 1.00 25.42 N ATOM 1988 CA GLU A 118 -4.505 10.406 5.895 1.00 32.51 C ATOM 1989 C GLU A 118 -4.286 10.083 7.389 1.00 50.41 C ATOM 1990 O GLU A 118 -4.462 10.969 8.238 1.00 71.33 O ATOM 1991 CB GLU A 118 -5.985 10.738 5.585 1.00 23.04 C ATOM 1992 CG GLU A 118 -6.184 11.336 4.173 1.00 43.34 C ATOM 1993 CD GLU A 118 -7.544 12.015 3.963 1.00 44.23 C ATOM 1994 OE1 GLU A 118 -7.863 12.950 4.731 1.00 50.11 O ATOM 1995 OE2 GLU A 118 -8.303 11.629 3.040 1.00 24.33 O ATOM 0 H GLU A 118 -4.652 8.689 4.670 1.00 25.42 H new ATOM 0 HA GLU A 118 -3.923 11.306 5.698 1.00 32.51 H new ATOM 0 HB2 GLU A 118 -6.583 9.831 5.678 1.00 23.04 H new ATOM 0 HB3 GLU A 118 -6.358 11.443 6.328 1.00 23.04 H new ATOM 0 HG2 GLU A 118 -5.394 12.063 3.984 1.00 43.34 H new ATOM 0 HG3 GLU A 118 -6.069 10.542 3.435 1.00 43.34 H new ATOM 2002 N GLU A 119 -3.938 8.833 7.734 1.00 33.42 N ATOM 2003 CA GLU A 119 -3.404 8.540 9.085 1.00 34.22 C ATOM 2004 C GLU A 119 -1.934 8.987 9.152 1.00 1.44 C ATOM 2005 O GLU A 119 -1.538 9.693 10.082 1.00 35.15 O ATOM 2006 CB GLU A 119 -3.556 7.041 9.482 1.00 14.40 C ATOM 2007 CG GLU A 119 -5.019 6.558 9.631 1.00 31.02 C ATOM 2008 CD GLU A 119 -5.887 7.453 10.542 1.00 0.11 C ATOM 2009 OE1 GLU A 119 -5.806 7.316 11.786 1.00 12.45 O ATOM 2010 OE2 GLU A 119 -6.668 8.292 10.016 1.00 32.52 O ATOM 0 H GLU A 119 -4.012 8.023 7.118 1.00 33.42 H new ATOM 0 HA GLU A 119 -3.993 9.101 9.811 1.00 34.22 H new ATOM 0 HB2 GLU A 119 -3.060 6.428 8.730 1.00 14.40 H new ATOM 0 HB3 GLU A 119 -3.034 6.874 10.424 1.00 14.40 H new ATOM 0 HG2 GLU A 119 -5.477 6.510 8.643 1.00 31.02 H new ATOM 0 HG3 GLU A 119 -5.017 5.544 10.031 1.00 31.02 H new ATOM 2017 N ILE A 120 -1.154 8.643 8.108 1.00 63.13 N ATOM 2018 CA ILE A 120 0.303 8.905 8.079 1.00 21.03 C ATOM 2019 C ILE A 120 0.620 10.373 7.701 1.00 63.04 C ATOM 2020 O ILE A 120 1.775 10.776 7.783 1.00 64.11 O ATOM 2021 CB ILE A 120 1.071 7.929 7.094 1.00 41.01 C ATOM 2022 CG1 ILE A 120 0.776 8.291 5.609 1.00 14.10 C ATOM 2023 CG2 ILE A 120 0.710 6.454 7.384 1.00 1.11 C ATOM 2024 CD1 ILE A 120 1.496 7.461 4.557 1.00 73.24 C ATOM 0 H ILE A 120 -1.508 8.181 7.270 1.00 63.13 H new ATOM 0 HA ILE A 120 0.656 8.719 9.093 1.00 21.03 H new ATOM 0 HB ILE A 120 2.140 8.054 7.265 1.00 41.01 H new ATOM 0 HG12 ILE A 120 -0.297 8.200 5.441 1.00 14.10 H new ATOM 0 HG13 ILE A 120 1.035 9.338 5.454 1.00 14.10 H new ATOM 0 HG21 ILE A 120 1.250 5.805 6.695 1.00 1.11 H new ATOM 0 HG22 ILE A 120 0.987 6.206 8.409 1.00 1.11 H new ATOM 0 HG23 ILE A 120 -0.362 6.309 7.254 1.00 1.11 H new ATOM 0 HD11 ILE A 120 1.211 7.806 3.563 1.00 73.24 H new ATOM 0 HD12 ILE A 120 2.573 7.569 4.683 1.00 73.24 H new ATOM 0 HD13 ILE A 120 1.221 6.412 4.670 1.00 73.24 H new ATOM 2036 N LYS A 121 -0.406 11.171 7.302 1.00 24.21 N ATOM 2037 CA LYS A 121 -0.199 12.589 6.895 1.00 34.25 C ATOM 2038 C LYS A 121 0.315 13.437 8.073 1.00 45.55 C ATOM 2039 O LYS A 121 0.965 14.467 7.873 1.00 2.10 O ATOM 2040 CB LYS A 121 -1.496 13.216 6.298 1.00 74.12 C ATOM 2041 CG LYS A 121 -2.665 13.447 7.291 1.00 42.24 C ATOM 2042 CD LYS A 121 -3.934 14.021 6.594 1.00 65.41 C ATOM 2043 CE LYS A 121 -5.157 14.146 7.523 1.00 54.40 C ATOM 2044 NZ LYS A 121 -6.380 14.588 6.781 1.00 50.35 N ATOM 0 H LYS A 121 -1.377 10.861 7.253 1.00 24.21 H new ATOM 0 HA LYS A 121 0.561 12.588 6.113 1.00 34.25 H new ATOM 0 HB2 LYS A 121 -1.237 14.173 5.845 1.00 74.12 H new ATOM 0 HB3 LYS A 121 -1.851 12.570 5.495 1.00 74.12 H new ATOM 0 HG2 LYS A 121 -2.916 12.504 7.777 1.00 42.24 H new ATOM 0 HG3 LYS A 121 -2.342 14.133 8.074 1.00 42.24 H new ATOM 0 HD2 LYS A 121 -3.699 15.004 6.186 1.00 65.41 H new ATOM 0 HD3 LYS A 121 -4.195 13.380 5.752 1.00 65.41 H new ATOM 0 HE2 LYS A 121 -5.350 13.185 8.000 1.00 54.40 H new ATOM 0 HE3 LYS A 121 -4.937 14.859 8.318 1.00 54.40 H new ATOM 0 HZ1 LYS A 121 -7.137 14.807 7.459 1.00 50.35 H new ATOM 0 HZ2 LYS A 121 -6.159 15.437 6.223 1.00 50.35 H new ATOM 0 HZ3 LYS A 121 -6.694 13.827 6.145 1.00 50.35 H new ATOM 2058 N ASN A 122 0.017 12.965 9.300 1.00 41.41 N ATOM 2059 CA ASN A 122 0.439 13.606 10.558 1.00 5.43 C ATOM 2060 C ASN A 122 1.949 13.390 10.822 1.00 73.54 C ATOM 2061 O ASN A 122 2.556 14.132 11.606 1.00 43.15 O ATOM 2062 CB ASN A 122 -0.413 13.051 11.734 1.00 42.31 C ATOM 2063 CG ASN A 122 -1.917 13.304 11.556 1.00 22.34 C ATOM 2064 OD1 ASN A 122 -2.450 14.319 12.011 1.00 70.41 O ATOM 2065 ND2 ASN A 122 -2.615 12.389 10.889 1.00 21.42 N ATOM 0 H ASN A 122 -0.531 12.117 9.445 1.00 41.41 H new ATOM 0 HA ASN A 122 0.276 14.680 10.473 1.00 5.43 H new ATOM 0 HB2 ASN A 122 -0.239 11.979 11.827 1.00 42.31 H new ATOM 0 HB3 ASN A 122 -0.080 13.510 12.665 1.00 42.31 H new ATOM 0 HD21 ASN A 122 -3.616 12.518 10.743 1.00 21.42 H new ATOM 0 HD22 ASN A 122 -2.149 11.559 10.523 1.00 21.42 H new ATOM 2072 N ASN A 123 2.538 12.370 10.153 1.00 73.51 N ATOM 2073 CA ASN A 123 3.991 12.063 10.227 1.00 64.33 C ATOM 2074 C ASN A 123 4.817 13.113 9.468 1.00 2.40 C ATOM 2075 O ASN A 123 4.306 13.809 8.582 1.00 51.22 O ATOM 2076 CB ASN A 123 4.318 10.659 9.631 1.00 43.34 C ATOM 2077 CG ASN A 123 3.631 9.505 10.350 1.00 4.13 C ATOM 2078 OD1 ASN A 123 3.364 9.563 11.548 1.00 64.32 O ATOM 2079 ND2 ASN A 123 3.351 8.441 9.623 1.00 34.12 N ATOM 0 H ASN A 123 2.020 11.735 9.546 1.00 73.51 H new ATOM 0 HA ASN A 123 4.254 12.075 11.285 1.00 64.33 H new ATOM 0 HB2 ASN A 123 4.026 10.645 8.581 1.00 43.34 H new ATOM 0 HB3 ASN A 123 5.396 10.504 9.664 1.00 43.34 H new ATOM 0 HD21 ASN A 123 2.899 7.634 10.053 1.00 34.12 H new ATOM 0 HD22 ASN A 123 3.586 8.425 8.631 1.00 34.12 H new ATOM 2086 N ASN A 124 6.108 13.184 9.821 1.00 43.33 N ATOM 2087 CA ASN A 124 7.104 14.050 9.159 1.00 42.43 C ATOM 2088 C ASN A 124 8.042 13.195 8.277 1.00 54.32 C ATOM 2089 O ASN A 124 9.092 13.670 7.831 1.00 22.42 O ATOM 2090 CB ASN A 124 7.904 14.851 10.232 1.00 20.43 C ATOM 2091 CG ASN A 124 7.017 15.717 11.149 1.00 74.24 C ATOM 2092 OD1 ASN A 124 5.932 16.162 10.765 1.00 23.23 O ATOM 2093 ND2 ASN A 124 7.477 15.977 12.362 1.00 41.33 N ATOM 0 H ASN A 124 6.500 12.634 10.586 1.00 43.33 H new ATOM 0 HA ASN A 124 6.595 14.765 8.513 1.00 42.43 H new ATOM 0 HB2 ASN A 124 8.472 14.152 10.846 1.00 20.43 H new ATOM 0 HB3 ASN A 124 8.627 15.493 9.729 1.00 20.43 H new ATOM 0 HD21 ASN A 124 6.932 16.556 13.001 1.00 41.33 H new ATOM 0 HD22 ASN A 124 8.377 15.599 12.658 1.00 41.33 H new ATOM 2100 N ASN A 125 7.618 11.940 7.987 1.00 42.31 N ATOM 2101 CA ASN A 125 8.406 10.958 7.201 1.00 31.14 C ATOM 2102 C ASN A 125 7.962 10.957 5.734 1.00 74.05 C ATOM 2103 O ASN A 125 8.543 10.240 4.911 1.00 61.35 O ATOM 2104 CB ASN A 125 8.231 9.522 7.779 1.00 63.10 C ATOM 2105 CG ASN A 125 8.701 9.396 9.226 1.00 32.22 C ATOM 2106 OD1 ASN A 125 7.920 9.576 10.162 1.00 43.41 O ATOM 2107 ND2 ASN A 125 9.983 9.112 9.427 1.00 31.02 N ATOM 0 H ASN A 125 6.715 11.579 8.294 1.00 42.31 H new ATOM 0 HA ASN A 125 9.454 11.251 7.265 1.00 31.14 H new ATOM 0 HB2 ASN A 125 7.180 9.238 7.719 1.00 63.10 H new ATOM 0 HB3 ASN A 125 8.787 8.818 7.160 1.00 63.10 H new ATOM 0 HD21 ASN A 125 10.346 9.037 10.377 1.00 31.02 H new ATOM 0 HD22 ASN A 125 10.604 8.968 8.631 1.00 31.02 H new ATOM 2114 N ILE A 126 6.958 11.794 5.412 1.00 75.43 N ATOM 2115 CA ILE A 126 6.239 11.716 4.140 1.00 10.12 C ATOM 2116 C ILE A 126 7.113 12.264 3.017 1.00 14.11 C ATOM 2117 O ILE A 126 7.571 13.409 3.075 1.00 70.00 O ATOM 2118 CB ILE A 126 4.849 12.458 4.195 1.00 42.15 C ATOM 2119 CG1 ILE A 126 3.988 11.892 5.367 1.00 44.55 C ATOM 2120 CG2 ILE A 126 4.083 12.355 2.847 1.00 2.35 C ATOM 2121 CD1 ILE A 126 3.753 10.389 5.302 1.00 52.14 C ATOM 0 H ILE A 126 6.629 12.538 6.027 1.00 75.43 H new ATOM 0 HA ILE A 126 6.022 10.667 3.941 1.00 10.12 H new ATOM 0 HB ILE A 126 5.041 13.516 4.373 1.00 42.15 H new ATOM 0 HG12 ILE A 126 4.478 12.131 6.311 1.00 44.55 H new ATOM 0 HG13 ILE A 126 3.023 12.399 5.372 1.00 44.55 H new ATOM 0 HG21 ILE A 126 3.131 12.879 2.929 1.00 2.35 H new ATOM 0 HG22 ILE A 126 4.679 12.807 2.054 1.00 2.35 H new ATOM 0 HG23 ILE A 126 3.901 11.307 2.611 1.00 2.35 H new ATOM 0 HD11 ILE A 126 3.147 10.078 6.153 1.00 52.14 H new ATOM 0 HD12 ILE A 126 3.233 10.142 4.376 1.00 52.14 H new ATOM 0 HD13 ILE A 126 4.711 9.869 5.330 1.00 52.14 H new ATOM 2133 N MET A 127 7.389 11.402 2.034 1.00 3.23 N ATOM 2134 CA MET A 127 8.159 11.757 0.853 1.00 44.41 C ATOM 2135 C MET A 127 7.276 12.598 -0.075 1.00 73.25 C ATOM 2136 O MET A 127 6.106 12.267 -0.296 1.00 12.05 O ATOM 2137 CB MET A 127 8.664 10.482 0.132 1.00 4.44 C ATOM 2138 CG MET A 127 9.509 9.535 1.004 1.00 61.12 C ATOM 2139 SD MET A 127 10.203 8.133 0.084 1.00 30.21 S ATOM 2140 CE MET A 127 8.762 7.454 -0.747 1.00 5.10 C ATOM 0 H MET A 127 7.078 10.431 2.042 1.00 3.23 H new ATOM 0 HA MET A 127 9.034 12.339 1.143 1.00 44.41 H new ATOM 0 HB2 MET A 127 7.803 9.932 -0.247 1.00 4.44 H new ATOM 0 HB3 MET A 127 9.256 10.782 -0.732 1.00 4.44 H new ATOM 0 HG2 MET A 127 10.323 10.101 1.458 1.00 61.12 H new ATOM 0 HG3 MET A 127 8.892 9.156 1.818 1.00 61.12 H new ATOM 0 HE1 MET A 127 9.037 6.530 -1.256 1.00 5.10 H new ATOM 0 HE2 MET A 127 7.983 7.246 -0.013 1.00 5.10 H new ATOM 0 HE3 MET A 127 8.390 8.173 -1.477 1.00 5.10 H new ATOM 2150 N ILE A 128 7.851 13.682 -0.601 1.00 42.10 N ATOM 2151 CA ILE A 128 7.147 14.636 -1.488 1.00 52.14 C ATOM 2152 C ILE A 128 6.916 13.994 -2.888 1.00 25.23 C ATOM 2153 O ILE A 128 6.122 14.483 -3.695 1.00 63.53 O ATOM 2154 CB ILE A 128 7.974 15.983 -1.610 1.00 63.13 C ATOM 2155 CG1 ILE A 128 8.443 16.458 -0.193 1.00 62.14 C ATOM 2156 CG2 ILE A 128 7.156 17.101 -2.323 1.00 64.53 C ATOM 2157 CD1 ILE A 128 9.397 17.644 -0.182 1.00 72.22 C ATOM 0 H ILE A 128 8.825 13.932 -0.428 1.00 42.10 H new ATOM 0 HA ILE A 128 6.175 14.873 -1.056 1.00 52.14 H new ATOM 0 HB ILE A 128 8.851 15.782 -2.225 1.00 63.13 H new ATOM 0 HG12 ILE A 128 7.562 16.717 0.394 1.00 62.14 H new ATOM 0 HG13 ILE A 128 8.926 15.621 0.310 1.00 62.14 H new ATOM 0 HG21 ILE A 128 7.758 18.008 -2.387 1.00 64.53 H new ATOM 0 HG22 ILE A 128 6.888 16.772 -3.327 1.00 64.53 H new ATOM 0 HG23 ILE A 128 6.249 17.307 -1.755 1.00 64.53 H new ATOM 0 HD11 ILE A 128 9.659 17.891 0.847 1.00 72.22 H new ATOM 0 HD12 ILE A 128 10.301 17.389 -0.735 1.00 72.22 H new ATOM 0 HD13 ILE A 128 8.915 18.503 -0.650 1.00 72.22 H new ATOM 2169 N LYS A 129 7.634 12.882 -3.148 1.00 34.43 N ATOM 2170 CA LYS A 129 7.562 12.085 -4.394 1.00 55.30 C ATOM 2171 C LYS A 129 7.352 10.589 -4.018 1.00 73.24 C ATOM 2172 O LYS A 129 7.532 10.208 -2.858 1.00 2.42 O ATOM 2173 CB LYS A 129 8.864 12.246 -5.250 1.00 63.43 C ATOM 2174 CG LYS A 129 9.057 13.585 -6.024 1.00 43.43 C ATOM 2175 CD LYS A 129 9.411 14.792 -5.129 1.00 2.43 C ATOM 2176 CE LYS A 129 9.724 16.069 -5.931 1.00 42.35 C ATOM 2177 NZ LYS A 129 10.956 15.941 -6.756 1.00 5.20 N ATOM 0 H LYS A 129 8.301 12.501 -2.477 1.00 34.43 H new ATOM 0 HA LYS A 129 6.727 12.444 -4.996 1.00 55.30 H new ATOM 0 HB2 LYS A 129 9.720 12.114 -4.588 1.00 63.43 H new ATOM 0 HB3 LYS A 129 8.893 11.432 -5.974 1.00 63.43 H new ATOM 0 HG2 LYS A 129 9.846 13.453 -6.764 1.00 43.43 H new ATOM 0 HG3 LYS A 129 8.142 13.810 -6.571 1.00 43.43 H new ATOM 0 HD2 LYS A 129 8.580 14.990 -4.452 1.00 2.43 H new ATOM 0 HD3 LYS A 129 10.272 14.538 -4.511 1.00 2.43 H new ATOM 0 HE2 LYS A 129 8.880 16.302 -6.580 1.00 42.35 H new ATOM 0 HE3 LYS A 129 9.838 16.907 -5.243 1.00 42.35 H new ATOM 0 HZ1 LYS A 129 11.186 16.862 -7.181 1.00 5.20 H new ATOM 0 HZ2 LYS A 129 11.746 15.630 -6.155 1.00 5.20 H new ATOM 0 HZ3 LYS A 129 10.798 15.242 -7.510 1.00 5.20 H new ATOM 2191 N TYR A 130 6.930 9.755 -4.994 1.00 22.35 N ATOM 2192 CA TYR A 130 6.844 8.283 -4.825 1.00 73.20 C ATOM 2193 C TYR A 130 7.227 7.563 -6.139 1.00 3.44 C ATOM 2194 O TYR A 130 7.484 8.211 -7.166 1.00 73.32 O ATOM 2195 CB TYR A 130 5.424 7.862 -4.328 1.00 11.35 C ATOM 2196 CG TYR A 130 4.297 7.862 -5.386 1.00 61.13 C ATOM 2197 CD1 TYR A 130 3.942 9.012 -6.097 1.00 62.42 C ATOM 2198 CD2 TYR A 130 3.566 6.699 -5.644 1.00 23.34 C ATOM 2199 CE1 TYR A 130 2.910 8.996 -7.022 1.00 34.34 C ATOM 2200 CE2 TYR A 130 2.543 6.682 -6.567 1.00 15.14 C ATOM 2201 CZ TYR A 130 2.216 7.830 -7.252 1.00 73.34 C ATOM 2202 OH TYR A 130 1.186 7.808 -8.172 1.00 4.31 O ATOM 0 H TYR A 130 6.640 10.078 -5.917 1.00 22.35 H new ATOM 0 HA TYR A 130 7.559 7.979 -4.060 1.00 73.20 H new ATOM 0 HB2 TYR A 130 5.494 6.861 -3.903 1.00 11.35 H new ATOM 0 HB3 TYR A 130 5.133 8.532 -3.519 1.00 11.35 H new ATOM 0 HD1 TYR A 130 4.482 9.931 -5.922 1.00 62.42 H new ATOM 0 HD2 TYR A 130 3.808 5.793 -5.108 1.00 23.34 H new ATOM 0 HE1 TYR A 130 2.651 9.896 -7.561 1.00 34.34 H new ATOM 0 HE2 TYR A 130 1.998 5.768 -6.753 1.00 15.14 H new ATOM 0 HH TYR A 130 0.803 6.907 -8.213 1.00 4.31 H new ATOM 2212 N HIS A 131 7.311 6.218 -6.075 1.00 14.34 N ATOM 2213 CA HIS A 131 7.622 5.348 -7.234 1.00 70.31 C ATOM 2214 C HIS A 131 6.325 4.681 -7.761 1.00 52.54 C ATOM 2215 O HIS A 131 5.924 3.635 -7.256 1.00 22.03 O ATOM 2216 CB HIS A 131 8.663 4.283 -6.812 1.00 24.15 C ATOM 2217 CG HIS A 131 9.959 4.874 -6.322 1.00 54.24 C ATOM 2218 ND1 HIS A 131 10.889 5.362 -7.198 1.00 13.52 N ATOM 2219 CD2 HIS A 131 10.418 5.043 -5.056 1.00 41.53 C ATOM 2220 CE1 HIS A 131 11.880 5.816 -6.466 1.00 34.23 C ATOM 2221 NE2 HIS A 131 11.641 5.648 -5.159 1.00 54.54 N ATOM 0 H HIS A 131 7.164 5.698 -5.210 1.00 14.34 H new ATOM 0 HA HIS A 131 8.044 5.948 -8.041 1.00 70.31 H new ATOM 0 HB2 HIS A 131 8.236 3.660 -6.026 1.00 24.15 H new ATOM 0 HB3 HIS A 131 8.868 3.630 -7.660 1.00 24.15 H new ATOM 0 HD2 HIS A 131 9.915 4.756 -4.144 1.00 41.53 H new ATOM 0 HE1 HIS A 131 12.775 6.268 -6.867 1.00 34.23 H new ATOM 0 HE2 HIS A 131 12.253 5.919 -4.389 1.00 54.54 H new ATOM 2229 N PRO A 132 5.654 5.272 -8.803 1.00 25.13 N ATOM 2230 CA PRO A 132 4.275 4.886 -9.209 1.00 52.52 C ATOM 2231 C PRO A 132 4.169 3.538 -9.947 1.00 24.40 C ATOM 2232 O PRO A 132 3.065 3.065 -10.180 1.00 72.21 O ATOM 2233 CB PRO A 132 3.865 6.050 -10.134 1.00 34.50 C ATOM 2234 CG PRO A 132 5.147 6.455 -10.779 1.00 74.14 C ATOM 2235 CD PRO A 132 6.185 6.351 -9.683 1.00 23.41 C ATOM 0 HA PRO A 132 3.636 4.736 -8.339 1.00 52.52 H new ATOM 0 HB2 PRO A 132 3.127 5.735 -10.872 1.00 34.50 H new ATOM 0 HB3 PRO A 132 3.422 6.872 -9.572 1.00 34.50 H new ATOM 0 HG2 PRO A 132 5.391 5.802 -11.617 1.00 74.14 H new ATOM 0 HG3 PRO A 132 5.088 7.470 -11.172 1.00 74.14 H new ATOM 0 HD2 PRO A 132 7.167 6.096 -10.083 1.00 23.41 H new ATOM 0 HD3 PRO A 132 6.295 7.292 -9.143 1.00 23.41 H new ATOM 2243 N LYS A 133 5.303 2.942 -10.345 1.00 53.43 N ATOM 2244 CA LYS A 133 5.312 1.644 -11.062 1.00 50.32 C ATOM 2245 C LYS A 133 5.734 0.524 -10.086 1.00 43.20 C ATOM 2246 O LYS A 133 5.837 0.760 -8.877 1.00 62.12 O ATOM 2247 CB LYS A 133 6.264 1.723 -12.293 1.00 54.32 C ATOM 2248 CG LYS A 133 6.055 2.957 -13.213 1.00 1.13 C ATOM 2249 CD LYS A 133 4.671 3.061 -13.908 1.00 43.33 C ATOM 2250 CE LYS A 133 4.442 2.020 -15.031 1.00 23.02 C ATOM 2251 NZ LYS A 133 4.102 0.667 -14.509 1.00 42.25 N ATOM 0 H LYS A 133 6.231 3.334 -10.185 1.00 53.43 H new ATOM 0 HA LYS A 133 4.313 1.415 -11.432 1.00 50.32 H new ATOM 0 HB2 LYS A 133 7.294 1.726 -11.936 1.00 54.32 H new ATOM 0 HB3 LYS A 133 6.136 0.820 -12.889 1.00 54.32 H new ATOM 0 HG2 LYS A 133 6.210 3.858 -12.620 1.00 1.13 H new ATOM 0 HG3 LYS A 133 6.826 2.946 -13.983 1.00 1.13 H new ATOM 0 HD2 LYS A 133 3.890 2.945 -13.156 1.00 43.33 H new ATOM 0 HD3 LYS A 133 4.563 4.061 -14.328 1.00 43.33 H new ATOM 0 HE2 LYS A 133 3.638 2.365 -15.681 1.00 23.02 H new ATOM 0 HE3 LYS A 133 5.340 1.952 -15.644 1.00 23.02 H new ATOM 0 HZ1 LYS A 133 3.387 0.227 -15.123 1.00 42.25 H new ATOM 0 HZ2 LYS A 133 4.957 0.075 -14.495 1.00 42.25 H new ATOM 0 HZ3 LYS A 133 3.724 0.752 -13.544 1.00 42.25 H new ATOM 2265 N PHE A 134 5.973 -0.694 -10.610 1.00 32.32 N ATOM 2266 CA PHE A 134 6.397 -1.850 -9.799 1.00 4.45 C ATOM 2267 C PHE A 134 7.923 -1.988 -9.852 1.00 3.35 C ATOM 2268 O PHE A 134 8.492 -2.118 -10.942 1.00 13.52 O ATOM 2269 CB PHE A 134 5.736 -3.161 -10.308 1.00 31.10 C ATOM 2270 CG PHE A 134 4.227 -3.216 -10.115 1.00 14.44 C ATOM 2271 CD1 PHE A 134 3.691 -3.461 -8.855 1.00 20.42 C ATOM 2272 CD2 PHE A 134 3.349 -3.024 -11.185 1.00 24.03 C ATOM 2273 CE1 PHE A 134 2.327 -3.513 -8.664 1.00 74.53 C ATOM 2274 CE2 PHE A 134 1.982 -3.077 -10.994 1.00 54.22 C ATOM 2275 CZ PHE A 134 1.474 -3.321 -9.734 1.00 1.43 C ATOM 0 H PHE A 134 5.878 -0.903 -11.604 1.00 32.32 H new ATOM 0 HA PHE A 134 6.079 -1.681 -8.770 1.00 4.45 H new ATOM 0 HB2 PHE A 134 5.960 -3.279 -11.368 1.00 31.10 H new ATOM 0 HB3 PHE A 134 6.188 -4.007 -9.790 1.00 31.10 H new ATOM 0 HD1 PHE A 134 4.353 -3.613 -8.015 1.00 20.42 H new ATOM 0 HD2 PHE A 134 3.743 -2.832 -12.172 1.00 24.03 H new ATOM 0 HE1 PHE A 134 1.926 -3.703 -7.680 1.00 74.53 H new ATOM 0 HE2 PHE A 134 1.313 -2.928 -11.828 1.00 54.22 H new ATOM 0 HZ PHE A 134 0.405 -3.362 -9.584 1.00 1.43 H new ATOM 2285 N TRP A 135 8.573 -1.925 -8.674 1.00 64.23 N ATOM 2286 CA TRP A 135 10.000 -2.249 -8.521 1.00 62.41 C ATOM 2287 C TRP A 135 10.247 -3.731 -8.859 1.00 53.44 C ATOM 2288 O TRP A 135 10.081 -4.622 -8.020 1.00 60.52 O ATOM 2289 CB TRP A 135 10.512 -1.886 -7.094 1.00 13.31 C ATOM 2290 CG TRP A 135 10.901 -0.430 -6.916 1.00 72.23 C ATOM 2291 CD1 TRP A 135 10.491 0.649 -7.659 1.00 1.12 C ATOM 2292 CD2 TRP A 135 11.799 0.097 -5.927 1.00 63.41 C ATOM 2293 NE1 TRP A 135 11.091 1.793 -7.199 1.00 3.52 N ATOM 2294 CE2 TRP A 135 11.890 1.483 -6.135 1.00 23.34 C ATOM 2295 CE3 TRP A 135 12.535 -0.475 -4.887 1.00 15.14 C ATOM 2296 CZ2 TRP A 135 12.688 2.304 -5.349 1.00 42.43 C ATOM 2297 CZ3 TRP A 135 13.322 0.344 -4.100 1.00 21.31 C ATOM 2298 CH2 TRP A 135 13.392 1.721 -4.337 1.00 13.51 C ATOM 0 H TRP A 135 8.121 -1.648 -7.803 1.00 64.23 H new ATOM 0 HA TRP A 135 10.572 -1.644 -9.224 1.00 62.41 H new ATOM 0 HB2 TRP A 135 9.736 -2.133 -6.370 1.00 13.31 H new ATOM 0 HB3 TRP A 135 11.375 -2.510 -6.862 1.00 13.31 H new ATOM 0 HD1 TRP A 135 9.797 0.604 -8.485 1.00 1.12 H new ATOM 0 HE1 TRP A 135 10.961 2.727 -7.589 1.00 3.52 H new ATOM 0 HE3 TRP A 135 12.490 -1.538 -4.701 1.00 15.14 H new ATOM 0 HZ2 TRP A 135 12.749 3.367 -5.533 1.00 42.43 H new ATOM 0 HZ3 TRP A 135 13.892 -0.086 -3.289 1.00 21.31 H new ATOM 0 HH2 TRP A 135 14.017 2.335 -3.705 1.00 13.51 H new ATOM 2309 N THR A 136 10.589 -3.963 -10.127 1.00 64.32 N ATOM 2310 CA THR A 136 10.812 -5.288 -10.690 1.00 30.14 C ATOM 2311 C THR A 136 12.127 -5.263 -11.478 1.00 62.21 C ATOM 2312 O THR A 136 12.244 -4.526 -12.465 1.00 65.21 O ATOM 2313 CB THR A 136 9.627 -5.683 -11.626 1.00 1.54 C ATOM 2314 OG1 THR A 136 8.379 -5.507 -10.930 1.00 60.01 O ATOM 2315 CG2 THR A 136 9.748 -7.130 -12.127 1.00 60.52 C ATOM 0 H THR A 136 10.721 -3.213 -10.805 1.00 64.32 H new ATOM 0 HA THR A 136 10.872 -6.027 -9.891 1.00 30.14 H new ATOM 0 HB THR A 136 9.660 -5.030 -12.498 1.00 1.54 H new ATOM 0 HG1 THR A 136 7.637 -5.754 -11.521 1.00 60.01 H new ATOM 0 HG21 THR A 136 8.903 -7.363 -12.775 1.00 60.52 H new ATOM 0 HG22 THR A 136 10.676 -7.245 -12.686 1.00 60.52 H new ATOM 0 HG23 THR A 136 9.751 -7.811 -11.276 1.00 60.52 H new ATOM 2323 N ASP A 137 13.109 -6.043 -11.010 1.00 65.25 N ATOM 2324 CA ASP A 137 14.453 -6.116 -11.602 1.00 32.54 C ATOM 2325 C ASP A 137 14.406 -6.519 -13.094 1.00 43.24 C ATOM 2326 O ASP A 137 14.087 -7.664 -13.421 1.00 71.12 O ATOM 2327 CB ASP A 137 15.313 -7.127 -10.797 1.00 32.01 C ATOM 2328 CG ASP A 137 15.617 -6.667 -9.358 1.00 52.52 C ATOM 2329 OD1 ASP A 137 14.703 -6.701 -8.499 1.00 53.51 O ATOM 2330 OD2 ASP A 137 16.762 -6.242 -9.088 1.00 1.35 O ATOM 0 H ASP A 137 12.992 -6.650 -10.199 1.00 65.25 H new ATOM 0 HA ASP A 137 14.902 -5.124 -11.552 1.00 32.54 H new ATOM 0 HB2 ASP A 137 14.795 -8.085 -10.762 1.00 32.01 H new ATOM 0 HB3 ASP A 137 16.253 -7.292 -11.323 1.00 32.01 H new ATOM 2335 N GLY A 138 14.701 -5.554 -13.992 1.00 60.25 N ATOM 2336 CA GLY A 138 14.749 -5.803 -15.444 1.00 70.42 C ATOM 2337 C GLY A 138 13.604 -5.146 -16.211 1.00 55.03 C ATOM 2338 O GLY A 138 13.687 -5.003 -17.433 1.00 44.30 O ATOM 0 H GLY A 138 14.910 -4.590 -13.731 1.00 60.25 H new ATOM 0 HA2 GLY A 138 15.697 -5.436 -15.837 1.00 70.42 H new ATOM 0 HA3 GLY A 138 14.725 -6.878 -15.622 1.00 70.42 H new ATOM 2342 N SER A 139 12.534 -4.753 -15.501 1.00 3.21 N ATOM 2343 CA SER A 139 11.343 -4.127 -16.119 1.00 4.14 C ATOM 2344 C SER A 139 11.531 -2.613 -16.311 1.00 44.41 C ATOM 2345 O SER A 139 12.361 -1.994 -15.625 1.00 55.32 O ATOM 2346 CB SER A 139 10.106 -4.399 -15.232 1.00 61.02 C ATOM 2347 OG SER A 139 9.878 -5.794 -15.090 1.00 20.43 O ATOM 0 H SER A 139 12.465 -4.857 -14.489 1.00 3.21 H new ATOM 0 HA SER A 139 11.199 -4.567 -17.106 1.00 4.14 H new ATOM 0 HB2 SER A 139 10.252 -3.949 -14.250 1.00 61.02 H new ATOM 0 HB3 SER A 139 9.228 -3.926 -15.672 1.00 61.02 H new ATOM 0 HG SER A 139 9.092 -5.941 -14.524 1.00 20.43 H new ATOM 2353 N TYR A 140 10.752 -2.029 -17.255 1.00 32.32 N ATOM 2354 CA TYR A 140 10.689 -0.571 -17.479 1.00 21.22 C ATOM 2355 C TYR A 140 9.945 0.106 -16.308 1.00 2.12 C ATOM 2356 O TYR A 140 8.770 0.468 -16.415 1.00 74.52 O ATOM 2357 CB TYR A 140 10.012 -0.245 -18.845 1.00 72.30 C ATOM 2358 CG TYR A 140 10.804 -0.706 -20.078 1.00 61.31 C ATOM 2359 CD1 TYR A 140 11.947 -0.019 -20.491 1.00 33.22 C ATOM 2360 CD2 TYR A 140 10.400 -1.811 -20.840 1.00 2.43 C ATOM 2361 CE1 TYR A 140 12.659 -0.416 -21.610 1.00 61.32 C ATOM 2362 CE2 TYR A 140 11.114 -2.211 -21.960 1.00 14.22 C ATOM 2363 CZ TYR A 140 12.242 -1.509 -22.339 1.00 61.31 C ATOM 2364 OH TYR A 140 12.959 -1.902 -23.452 1.00 54.12 O ATOM 0 H TYR A 140 10.149 -2.562 -17.882 1.00 32.32 H new ATOM 0 HA TYR A 140 11.704 -0.176 -17.519 1.00 21.22 H new ATOM 0 HB2 TYR A 140 9.027 -0.711 -18.867 1.00 72.30 H new ATOM 0 HB3 TYR A 140 9.857 0.832 -18.911 1.00 72.30 H new ATOM 0 HD1 TYR A 140 12.282 0.839 -19.927 1.00 33.22 H new ATOM 0 HD2 TYR A 140 9.517 -2.361 -20.550 1.00 2.43 H new ATOM 0 HE1 TYR A 140 13.541 0.130 -21.912 1.00 61.32 H new ATOM 0 HE2 TYR A 140 10.790 -3.067 -22.533 1.00 14.22 H new ATOM 0 HH TYR A 140 12.535 -2.689 -23.853 1.00 54.12 H new ATOM 2374 N GLN A 141 10.658 0.248 -15.179 1.00 20.04 N ATOM 2375 CA GLN A 141 10.092 0.733 -13.907 1.00 4.10 C ATOM 2376 C GLN A 141 9.883 2.258 -13.920 1.00 74.51 C ATOM 2377 O GLN A 141 10.002 2.915 -14.961 1.00 41.11 O ATOM 2378 CB GLN A 141 11.034 0.322 -12.741 1.00 43.20 C ATOM 2379 CG GLN A 141 11.272 -1.187 -12.601 1.00 51.15 C ATOM 2380 CD GLN A 141 12.494 -1.518 -11.743 1.00 61.13 C ATOM 2381 OE1 GLN A 141 12.404 -1.635 -10.532 1.00 1.11 O ATOM 2382 NE2 GLN A 141 13.641 -1.700 -12.378 1.00 72.44 N ATOM 0 H GLN A 141 11.652 0.028 -15.122 1.00 20.04 H new ATOM 0 HA GLN A 141 9.112 0.277 -13.768 1.00 4.10 H new ATOM 0 HB2 GLN A 141 11.996 0.815 -12.880 1.00 43.20 H new ATOM 0 HB3 GLN A 141 10.616 0.697 -11.807 1.00 43.20 H new ATOM 0 HG2 GLN A 141 10.389 -1.650 -12.161 1.00 51.15 H new ATOM 0 HG3 GLN A 141 11.401 -1.623 -13.592 1.00 51.15 H new ATOM 0 HE21 GLN A 141 13.685 -1.595 -13.392 1.00 72.44 H new ATOM 0 HE22 GLN A 141 14.481 -1.945 -11.854 1.00 72.44 H new ATOM 2391 N CYS A 142 9.563 2.779 -12.732 1.00 35.45 N ATOM 2392 CA CYS A 142 9.330 4.197 -12.471 1.00 3.21 C ATOM 2393 C CYS A 142 10.556 5.063 -12.866 1.00 71.32 C ATOM 2394 O CYS A 142 10.477 5.863 -13.811 1.00 50.00 O ATOM 2395 CB CYS A 142 8.970 4.296 -10.979 1.00 50.51 C ATOM 2396 SG CYS A 142 10.050 3.292 -9.906 1.00 31.31 S ATOM 0 H CYS A 142 9.456 2.202 -11.898 1.00 35.45 H new ATOM 0 HA CYS A 142 8.518 4.593 -13.081 1.00 3.21 H new ATOM 0 HB2 CYS A 142 9.028 5.339 -10.667 1.00 50.51 H new ATOM 0 HB3 CYS A 142 7.936 3.979 -10.840 1.00 50.51 H new ATOM 0 HG CYS A 142 10.494 4.026 -8.929 1.00 31.31 H new ATOM 2401 N CYS A 143 11.682 4.879 -12.155 1.00 24.32 N ATOM 2402 CA CYS A 143 12.993 5.460 -12.532 1.00 30.35 C ATOM 2403 C CYS A 143 13.992 4.354 -12.910 1.00 23.54 C ATOM 2404 O CYS A 143 15.204 4.612 -12.993 1.00 41.31 O ATOM 2405 CB CYS A 143 13.530 6.313 -11.367 1.00 52.13 C ATOM 2406 SG CYS A 143 13.422 5.497 -9.744 1.00 14.11 S ATOM 0 H CYS A 143 11.714 4.323 -11.300 1.00 24.32 H new ATOM 0 HA CYS A 143 12.863 6.097 -13.406 1.00 30.35 H new ATOM 0 HB2 CYS A 143 14.571 6.568 -11.566 1.00 52.13 H new ATOM 0 HB3 CYS A 143 12.974 7.250 -11.329 1.00 52.13 H new ATOM 0 HG CYS A 143 14.419 5.875 -9.001 1.00 14.11 H new ATOM 2411 N ARG A 144 13.465 3.116 -13.120 1.00 42.12 N ATOM 2412 CA ARG A 144 14.257 1.908 -13.488 1.00 64.15 C ATOM 2413 C ARG A 144 15.107 1.402 -12.300 1.00 33.54 C ATOM 2414 O ARG A 144 15.796 0.385 -12.425 1.00 21.11 O ATOM 2415 CB ARG A 144 15.122 2.151 -14.772 1.00 72.22 C ATOM 2416 CG ARG A 144 14.300 2.291 -16.084 1.00 22.02 C ATOM 2417 CD ARG A 144 14.005 0.940 -16.763 1.00 42.13 C ATOM 2418 NE ARG A 144 15.208 0.386 -17.416 1.00 24.35 N ATOM 2419 CZ ARG A 144 15.472 -0.911 -17.635 1.00 41.22 C ATOM 2420 NH1 ARG A 144 14.633 -1.870 -17.260 1.00 70.14 N ATOM 2421 NH2 ARG A 144 16.591 -1.244 -18.257 1.00 71.31 N ATOM 0 H ARG A 144 12.466 2.927 -13.037 1.00 42.12 H new ATOM 0 HA ARG A 144 13.549 1.116 -13.731 1.00 64.15 H new ATOM 0 HB2 ARG A 144 15.714 3.055 -14.630 1.00 72.22 H new ATOM 0 HB3 ARG A 144 15.824 1.325 -14.884 1.00 72.22 H new ATOM 0 HG2 ARG A 144 13.358 2.792 -15.863 1.00 22.02 H new ATOM 0 HG3 ARG A 144 14.845 2.929 -16.780 1.00 22.02 H new ATOM 0 HD2 ARG A 144 13.634 0.233 -16.021 1.00 42.13 H new ATOM 0 HD3 ARG A 144 13.215 1.069 -17.503 1.00 42.13 H new ATOM 0 HE ARG A 144 15.908 1.057 -17.732 1.00 24.35 H new ATOM 0 HH11 ARG A 144 13.760 -1.629 -16.791 1.00 70.14 H new ATOM 0 HH12 ARG A 144 14.862 -2.847 -17.441 1.00 70.14 H new ATOM 0 HH21 ARG A 144 17.240 -0.519 -18.563 1.00 71.31 H new ATOM 0 HH22 ARG A 144 16.805 -2.226 -18.431 1.00 71.31 H new ATOM 2435 N GLN A 145 14.993 2.083 -11.135 1.00 2.51 N ATOM 2436 CA GLN A 145 15.758 1.767 -9.922 1.00 32.11 C ATOM 2437 C GLN A 145 15.015 0.734 -9.065 1.00 61.14 C ATOM 2438 O GLN A 145 13.786 0.757 -8.972 1.00 4.43 O ATOM 2439 CB GLN A 145 16.007 3.050 -9.086 1.00 31.20 C ATOM 2440 CG GLN A 145 16.820 4.144 -9.807 1.00 14.54 C ATOM 2441 CD GLN A 145 16.991 5.437 -8.993 1.00 52.20 C ATOM 2442 OE1 GLN A 145 15.969 5.819 -8.229 1.00 43.34 O flip ATOM 2443 NE2 GLN A 145 18.017 6.121 -9.095 1.00 11.01 N flip ATOM 0 H GLN A 145 14.359 2.873 -11.018 1.00 2.51 H new ATOM 0 HA GLN A 145 16.716 1.349 -10.230 1.00 32.11 H new ATOM 0 HB2 GLN A 145 15.044 3.467 -8.791 1.00 31.20 H new ATOM 0 HB3 GLN A 145 16.529 2.774 -8.170 1.00 31.20 H new ATOM 0 HG2 GLN A 145 17.806 3.748 -10.051 1.00 14.54 H new ATOM 0 HG3 GLN A 145 16.330 4.383 -10.751 1.00 14.54 H new ATOM 0 HE21 GLN A 145 18.784 5.804 -9.687 1.00 11.01 H new ATOM 0 HE22 GLN A 145 18.095 7.002 -8.587 1.00 11.01 H new ATOM 2452 N THR A 146 15.790 -0.162 -8.458 1.00 53.13 N ATOM 2453 CA THR A 146 15.301 -1.190 -7.521 1.00 22.13 C ATOM 2454 C THR A 146 16.458 -1.634 -6.587 1.00 14.05 C ATOM 2455 O THR A 146 16.268 -2.457 -5.686 1.00 75.23 O ATOM 2456 CB THR A 146 14.689 -2.407 -8.316 1.00 13.00 C ATOM 2457 OG1 THR A 146 14.237 -3.451 -7.432 1.00 35.24 O ATOM 2458 CG2 THR A 146 15.678 -2.986 -9.347 1.00 54.44 C ATOM 0 H THR A 146 16.799 -0.201 -8.602 1.00 53.13 H new ATOM 0 HA THR A 146 14.506 -0.774 -6.901 1.00 22.13 H new ATOM 0 HB THR A 146 13.828 -2.012 -8.856 1.00 13.00 H new ATOM 0 HG1 THR A 146 14.787 -3.454 -6.621 1.00 35.24 H new ATOM 0 HG21 THR A 146 15.212 -3.821 -9.869 1.00 54.44 H new ATOM 0 HG22 THR A 146 15.947 -2.213 -10.067 1.00 54.44 H new ATOM 0 HG23 THR A 146 16.575 -3.334 -8.835 1.00 54.44 H new ATOM 2466 N GLU A 147 17.647 -1.011 -6.775 1.00 65.31 N ATOM 2467 CA GLU A 147 18.899 -1.382 -6.084 1.00 51.14 C ATOM 2468 C GLU A 147 18.837 -0.978 -4.601 1.00 12.31 C ATOM 2469 O GLU A 147 19.314 -1.718 -3.734 1.00 62.44 O ATOM 2470 CB GLU A 147 20.135 -0.718 -6.771 1.00 5.20 C ATOM 2471 CG GLU A 147 20.454 -1.196 -8.216 1.00 4.13 C ATOM 2472 CD GLU A 147 19.334 -0.925 -9.244 1.00 3.30 C ATOM 2473 OE1 GLU A 147 18.838 0.221 -9.309 1.00 20.52 O ATOM 2474 OE2 GLU A 147 18.915 -1.861 -9.963 1.00 44.00 O ATOM 0 H GLU A 147 17.761 -0.228 -7.419 1.00 65.31 H new ATOM 0 HA GLU A 147 19.010 -2.464 -6.149 1.00 51.14 H new ATOM 0 HB2 GLU A 147 19.977 0.360 -6.794 1.00 5.20 H new ATOM 0 HB3 GLU A 147 21.011 -0.899 -6.149 1.00 5.20 H new ATOM 0 HG2 GLU A 147 21.366 -0.705 -8.554 1.00 4.13 H new ATOM 0 HG3 GLU A 147 20.658 -2.267 -8.194 1.00 4.13 H new ATOM 2481 N LYS A 148 18.245 0.200 -4.334 1.00 32.13 N ATOM 2482 CA LYS A 148 18.061 0.731 -2.967 1.00 40.12 C ATOM 2483 C LYS A 148 16.952 1.817 -2.987 1.00 72.44 C ATOM 2484 O LYS A 148 16.459 2.169 -4.062 1.00 53.14 O ATOM 2485 CB LYS A 148 19.424 1.272 -2.402 1.00 24.33 C ATOM 2486 CG LYS A 148 19.517 1.514 -0.863 1.00 22.30 C ATOM 2487 CD LYS A 148 19.357 0.230 0.023 1.00 64.32 C ATOM 2488 CE LYS A 148 17.892 -0.142 0.343 1.00 45.05 C ATOM 2489 NZ LYS A 148 17.781 -1.430 1.093 1.00 34.43 N ATOM 0 H LYS A 148 17.879 0.814 -5.061 1.00 32.13 H new ATOM 0 HA LYS A 148 17.739 -0.064 -2.295 1.00 40.12 H new ATOM 0 HB2 LYS A 148 20.208 0.567 -2.680 1.00 24.33 H new ATOM 0 HB3 LYS A 148 19.648 2.213 -2.905 1.00 24.33 H new ATOM 0 HG2 LYS A 148 20.481 1.972 -0.641 1.00 22.30 H new ATOM 0 HG3 LYS A 148 18.749 2.232 -0.577 1.00 22.30 H new ATOM 0 HD2 LYS A 148 19.830 -0.610 -0.486 1.00 64.32 H new ATOM 0 HD3 LYS A 148 19.895 0.379 0.959 1.00 64.32 H new ATOM 0 HE2 LYS A 148 17.437 0.657 0.929 1.00 45.05 H new ATOM 0 HE3 LYS A 148 17.328 -0.216 -0.587 1.00 45.05 H new ATOM 0 HZ1 LYS A 148 16.779 -1.636 1.284 1.00 34.43 H new ATOM 0 HZ2 LYS A 148 18.190 -2.199 0.525 1.00 34.43 H new ATOM 0 HZ3 LYS A 148 18.296 -1.353 1.993 1.00 34.43 H new ATOM 2503 N LEU A 149 16.560 2.319 -1.791 1.00 4.23 N ATOM 2504 CA LEU A 149 15.489 3.316 -1.625 1.00 31.42 C ATOM 2505 C LEU A 149 15.856 4.668 -2.257 1.00 33.33 C ATOM 2506 O LEU A 149 17.025 5.068 -2.284 1.00 34.32 O ATOM 2507 CB LEU A 149 15.170 3.531 -0.114 1.00 35.32 C ATOM 2508 CG LEU A 149 14.534 2.333 0.655 1.00 32.42 C ATOM 2509 CD1 LEU A 149 14.359 2.672 2.159 1.00 4.44 C ATOM 2510 CD2 LEU A 149 13.190 1.917 0.011 1.00 64.22 C ATOM 0 H LEU A 149 16.987 2.036 -0.909 1.00 4.23 H new ATOM 0 HA LEU A 149 14.611 2.923 -2.138 1.00 31.42 H new ATOM 0 HB2 LEU A 149 16.096 3.804 0.392 1.00 35.32 H new ATOM 0 HB3 LEU A 149 14.497 4.384 -0.028 1.00 35.32 H new ATOM 0 HG LEU A 149 15.213 1.483 0.584 1.00 32.42 H new ATOM 0 HD11 LEU A 149 13.914 1.821 2.674 1.00 4.44 H new ATOM 0 HD12 LEU A 149 15.332 2.893 2.598 1.00 4.44 H new ATOM 0 HD13 LEU A 149 13.708 3.540 2.263 1.00 4.44 H new ATOM 0 HD21 LEU A 149 12.765 1.080 0.564 1.00 64.22 H new ATOM 0 HD22 LEU A 149 12.498 2.758 0.038 1.00 64.22 H new ATOM 0 HD23 LEU A 149 13.359 1.619 -1.024 1.00 64.22 H new ATOM 2522 N ALA A 150 14.825 5.359 -2.740 1.00 50.33 N ATOM 2523 CA ALA A 150 14.919 6.725 -3.258 1.00 63.41 C ATOM 2524 C ALA A 150 13.689 7.518 -2.764 1.00 74.11 C ATOM 2525 O ALA A 150 12.615 6.919 -2.590 1.00 1.12 O ATOM 2526 CB ALA A 150 15.016 6.698 -4.799 1.00 65.41 C ATOM 0 H ALA A 150 13.880 4.978 -2.784 1.00 50.33 H new ATOM 0 HA ALA A 150 15.819 7.218 -2.892 1.00 63.41 H new ATOM 0 HB1 ALA A 150 15.086 7.718 -5.177 1.00 65.41 H new ATOM 0 HB2 ALA A 150 15.903 6.139 -5.098 1.00 65.41 H new ATOM 0 HB3 ALA A 150 14.128 6.218 -5.211 1.00 65.41 H new ATOM 2532 N PRO A 151 13.813 8.868 -2.511 1.00 41.42 N ATOM 2533 CA PRO A 151 12.676 9.720 -2.041 1.00 31.34 C ATOM 2534 C PRO A 151 11.462 9.741 -3.006 1.00 15.40 C ATOM 2535 O PRO A 151 10.395 10.247 -2.656 1.00 32.42 O ATOM 2536 CB PRO A 151 13.314 11.127 -1.900 1.00 71.01 C ATOM 2537 CG PRO A 151 14.787 10.871 -1.757 1.00 63.45 C ATOM 2538 CD PRO A 151 15.068 9.661 -2.620 1.00 20.32 C ATOM 0 HA PRO A 151 12.250 9.335 -1.114 1.00 31.34 H new ATOM 0 HB2 PRO A 151 13.103 11.745 -2.772 1.00 71.01 H new ATOM 0 HB3 PRO A 151 12.919 11.655 -1.032 1.00 71.01 H new ATOM 0 HG2 PRO A 151 15.369 11.732 -2.085 1.00 63.45 H new ATOM 0 HG3 PRO A 151 15.054 10.683 -0.717 1.00 63.45 H new ATOM 0 HD2 PRO A 151 15.278 9.942 -3.652 1.00 20.32 H new ATOM 0 HD3 PRO A 151 15.931 9.101 -2.260 1.00 20.32 H new ATOM 2546 N GLY A 152 11.664 9.224 -4.228 1.00 24.42 N ATOM 2547 CA GLY A 152 10.595 9.051 -5.214 1.00 32.01 C ATOM 2548 C GLY A 152 10.955 9.708 -6.535 1.00 23.54 C ATOM 2549 O GLY A 152 11.578 10.781 -6.546 1.00 41.23 O ATOM 0 H GLY A 152 12.578 8.914 -4.558 1.00 24.42 H new ATOM 0 HA2 GLY A 152 10.411 7.988 -5.372 1.00 32.01 H new ATOM 0 HA3 GLY A 152 9.670 9.482 -4.831 1.00 32.01 H new ATOM 2553 N CYS A 153 10.579 9.077 -7.651 1.00 61.34 N ATOM 2554 CA CYS A 153 10.937 9.550 -9.003 1.00 23.51 C ATOM 2555 C CYS A 153 9.871 10.499 -9.556 1.00 5.23 C ATOM 2556 O CYS A 153 10.186 11.540 -10.140 1.00 50.03 O ATOM 2557 CB CYS A 153 11.084 8.345 -9.922 1.00 24.54 C ATOM 2558 SG CYS A 153 9.603 7.304 -9.989 1.00 22.14 S ATOM 0 H CYS A 153 10.019 8.225 -7.649 1.00 61.34 H new ATOM 0 HA CYS A 153 11.877 10.099 -8.948 1.00 23.51 H new ATOM 0 HB2 CYS A 153 11.321 8.692 -10.928 1.00 24.54 H new ATOM 0 HB3 CYS A 153 11.928 7.742 -9.586 1.00 24.54 H new ATOM 0 HG CYS A 153 9.235 7.152 -11.227 1.00 22.14 H new ATOM 2563 N GLU A 154 8.607 10.116 -9.376 1.00 12.31 N ATOM 2564 CA GLU A 154 7.454 10.895 -9.844 1.00 64.31 C ATOM 2565 C GLU A 154 6.808 11.584 -8.638 1.00 12.11 C ATOM 2566 O GLU A 154 6.882 11.066 -7.527 1.00 25.32 O ATOM 2567 CB GLU A 154 6.453 9.968 -10.584 1.00 73.20 C ATOM 2568 CG GLU A 154 5.282 10.696 -11.281 1.00 33.34 C ATOM 2569 CD GLU A 154 4.419 9.765 -12.150 1.00 55.42 C ATOM 2570 OE1 GLU A 154 4.834 9.433 -13.285 1.00 34.35 O ATOM 2571 OE2 GLU A 154 3.338 9.350 -11.702 1.00 32.44 O ATOM 0 H GLU A 154 8.350 9.252 -8.899 1.00 12.31 H new ATOM 0 HA GLU A 154 7.771 11.659 -10.553 1.00 64.31 H new ATOM 0 HB2 GLU A 154 6.999 9.392 -11.331 1.00 73.20 H new ATOM 0 HB3 GLU A 154 6.043 9.255 -9.868 1.00 73.20 H new ATOM 0 HG2 GLU A 154 4.652 11.163 -10.524 1.00 33.34 H new ATOM 0 HG3 GLU A 154 5.680 11.497 -11.904 1.00 33.34 H new ATOM 2578 N LYS A 155 6.177 12.741 -8.872 1.00 70.43 N ATOM 2579 CA LYS A 155 5.614 13.593 -7.808 1.00 51.23 C ATOM 2580 C LYS A 155 4.494 12.860 -7.019 1.00 75.54 C ATOM 2581 O LYS A 155 3.710 12.095 -7.594 1.00 52.15 O ATOM 2582 CB LYS A 155 5.117 14.944 -8.443 1.00 12.43 C ATOM 2583 CG LYS A 155 4.108 14.816 -9.631 1.00 72.52 C ATOM 2584 CD LYS A 155 2.636 14.594 -9.177 1.00 14.14 C ATOM 2585 CE LYS A 155 1.771 13.922 -10.251 1.00 4.44 C ATOM 2586 NZ LYS A 155 0.420 13.577 -9.736 1.00 33.43 N ATOM 0 H LYS A 155 6.040 13.118 -9.810 1.00 70.43 H new ATOM 0 HA LYS A 155 6.390 13.819 -7.077 1.00 51.23 H new ATOM 0 HB2 LYS A 155 4.650 15.540 -7.659 1.00 12.43 H new ATOM 0 HB3 LYS A 155 5.987 15.500 -8.791 1.00 12.43 H new ATOM 0 HG2 LYS A 155 4.160 15.719 -10.239 1.00 72.52 H new ATOM 0 HG3 LYS A 155 4.412 13.985 -10.267 1.00 72.52 H new ATOM 0 HD2 LYS A 155 2.628 13.980 -8.276 1.00 14.14 H new ATOM 0 HD3 LYS A 155 2.195 15.555 -8.912 1.00 14.14 H new ATOM 0 HE2 LYS A 155 1.674 14.588 -11.108 1.00 4.44 H new ATOM 0 HE3 LYS A 155 2.267 13.018 -10.604 1.00 4.44 H new ATOM 0 HZ1 LYS A 155 0.323 12.543 -9.682 1.00 33.43 H new ATOM 0 HZ2 LYS A 155 0.295 13.987 -8.788 1.00 33.43 H new ATOM 0 HZ3 LYS A 155 -0.304 13.960 -10.377 1.00 33.43 H new ATOM 2600 N TYR A 156 4.482 13.047 -5.691 1.00 74.54 N ATOM 2601 CA TYR A 156 3.395 12.572 -4.812 1.00 14.20 C ATOM 2602 C TYR A 156 2.655 13.778 -4.217 1.00 72.15 C ATOM 2603 O TYR A 156 3.232 14.559 -3.447 1.00 64.41 O ATOM 2604 CB TYR A 156 3.971 11.667 -3.684 1.00 41.54 C ATOM 2605 CG TYR A 156 2.956 11.196 -2.628 1.00 64.24 C ATOM 2606 CD1 TYR A 156 1.753 10.599 -2.995 1.00 31.44 C ATOM 2607 CD2 TYR A 156 3.205 11.357 -1.263 1.00 72.44 C ATOM 2608 CE1 TYR A 156 0.841 10.184 -2.043 1.00 5.14 C ATOM 2609 CE2 TYR A 156 2.295 10.940 -0.310 1.00 61.31 C ATOM 2610 CZ TYR A 156 1.115 10.355 -0.707 1.00 41.42 C ATOM 2611 OH TYR A 156 0.201 9.939 0.235 1.00 15.03 O ATOM 0 H TYR A 156 5.227 13.533 -5.192 1.00 74.54 H new ATOM 0 HA TYR A 156 2.691 11.979 -5.395 1.00 14.20 H new ATOM 0 HB2 TYR A 156 4.425 10.789 -4.143 1.00 41.54 H new ATOM 0 HB3 TYR A 156 4.769 12.211 -3.178 1.00 41.54 H new ATOM 0 HD1 TYR A 156 1.529 10.458 -4.042 1.00 31.44 H new ATOM 0 HD2 TYR A 156 4.129 11.817 -0.945 1.00 72.44 H new ATOM 0 HE1 TYR A 156 -0.088 9.725 -2.349 1.00 5.14 H new ATOM 0 HE2 TYR A 156 2.509 11.073 0.740 1.00 61.31 H new ATOM 0 HH TYR A 156 -0.090 9.027 0.028 1.00 15.03 H new ATOM 2621 N ASN A 157 1.388 13.945 -4.610 1.00 74.24 N ATOM 2622 CA ASN A 157 0.486 14.931 -4.004 1.00 41.33 C ATOM 2623 C ASN A 157 -0.331 14.233 -2.905 1.00 24.13 C ATOM 2624 O ASN A 157 -1.307 13.541 -3.190 1.00 14.43 O ATOM 2625 CB ASN A 157 -0.412 15.621 -5.086 1.00 72.33 C ATOM 2626 CG ASN A 157 -0.992 14.683 -6.139 1.00 51.10 C ATOM 2627 OD1 ASN A 157 -0.389 14.463 -7.190 1.00 30.33 O ATOM 2628 ND2 ASN A 157 -2.157 14.126 -5.872 1.00 51.23 N ATOM 0 H ASN A 157 0.958 13.400 -5.358 1.00 74.24 H new ATOM 0 HA ASN A 157 1.062 15.736 -3.547 1.00 41.33 H new ATOM 0 HB2 ASN A 157 -1.234 16.130 -4.583 1.00 72.33 H new ATOM 0 HB3 ASN A 157 0.177 16.388 -5.590 1.00 72.33 H new ATOM 0 HD21 ASN A 157 -2.585 13.491 -6.546 1.00 51.23 H new ATOM 0 HD22 ASN A 157 -2.630 14.330 -4.992 1.00 51.23 H new ATOM 2635 N LEU A 158 0.150 14.370 -1.650 1.00 24.22 N ATOM 2636 CA LEU A 158 -0.482 13.780 -0.442 1.00 5.42 C ATOM 2637 C LEU A 158 -1.972 14.189 -0.332 1.00 61.12 C ATOM 2638 O LEU A 158 -2.843 13.353 -0.048 1.00 30.34 O ATOM 2639 CB LEU A 158 0.329 14.222 0.820 1.00 55.21 C ATOM 2640 CG LEU A 158 -0.207 13.780 2.227 1.00 34.20 C ATOM 2641 CD1 LEU A 158 -0.345 12.247 2.352 1.00 61.32 C ATOM 2642 CD2 LEU A 158 0.696 14.344 3.350 1.00 74.22 C ATOM 0 H LEU A 158 0.997 14.899 -1.441 1.00 24.22 H new ATOM 0 HA LEU A 158 -0.461 12.693 -0.517 1.00 5.42 H new ATOM 0 HB2 LEU A 158 1.345 13.842 0.715 1.00 55.21 H new ATOM 0 HB3 LEU A 158 0.393 15.310 0.813 1.00 55.21 H new ATOM 0 HG LEU A 158 -1.209 14.195 2.335 1.00 34.20 H new ATOM 0 HD11 LEU A 158 -0.719 11.995 3.344 1.00 61.32 H new ATOM 0 HD12 LEU A 158 -1.042 11.882 1.598 1.00 61.32 H new ATOM 0 HD13 LEU A 158 0.629 11.781 2.202 1.00 61.32 H new ATOM 0 HD21 LEU A 158 0.311 14.028 4.320 1.00 74.22 H new ATOM 0 HD22 LEU A 158 1.711 13.969 3.223 1.00 74.22 H new ATOM 0 HD23 LEU A 158 0.703 15.433 3.299 1.00 74.22 H new ATOM 2654 N PHE A 159 -2.238 15.477 -0.596 1.00 4.42 N ATOM 2655 CA PHE A 159 -3.589 16.065 -0.574 1.00 3.35 C ATOM 2656 C PHE A 159 -4.065 16.333 -2.021 1.00 31.34 C ATOM 2657 O PHE A 159 -4.927 15.625 -2.546 1.00 3.21 O ATOM 2658 CB PHE A 159 -3.575 17.380 0.262 1.00 63.41 C ATOM 2659 CG PHE A 159 -2.972 17.213 1.660 1.00 3.44 C ATOM 2660 CD1 PHE A 159 -3.592 16.396 2.598 1.00 70.44 C ATOM 2661 CD2 PHE A 159 -1.779 17.853 2.028 1.00 13.42 C ATOM 2662 CE1 PHE A 159 -3.052 16.222 3.854 1.00 21.34 C ATOM 2663 CE2 PHE A 159 -1.240 17.673 3.293 1.00 51.20 C ATOM 2664 CZ PHE A 159 -1.880 16.857 4.204 1.00 4.51 C ATOM 0 H PHE A 159 -1.511 16.151 -0.835 1.00 4.42 H new ATOM 0 HA PHE A 159 -4.286 15.368 -0.107 1.00 3.35 H new ATOM 0 HB2 PHE A 159 -3.010 18.139 -0.280 1.00 63.41 H new ATOM 0 HB3 PHE A 159 -4.596 17.750 0.358 1.00 63.41 H new ATOM 0 HD1 PHE A 159 -4.510 15.890 2.339 1.00 70.44 H new ATOM 0 HD2 PHE A 159 -1.275 18.493 1.319 1.00 13.42 H new ATOM 0 HE1 PHE A 159 -3.551 15.584 4.569 1.00 21.34 H new ATOM 0 HE2 PHE A 159 -0.321 18.171 3.565 1.00 51.20 H new ATOM 0 HZ PHE A 159 -1.463 16.716 5.190 1.00 4.51 H new