USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 769 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 120 MET CE :methyl -112:sc= -3.58 (180deg=-0.489) USER MOD Set 1.2: A 125 GLN : amide:sc= -5.85! C(o=-9.4!,f=-25!) USER MOD Set 2.1: A 121 THR OG1 : rot -150:sc= 0.00801 USER MOD Set 2.2: A 123 GLN : amide:sc= -2.73 K(o=-2.7,f=-1.9) USER MOD Set 2.3: A 124 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 70 THR OG1 : rot -74:sc= 0.98 USER MOD Set 3.2: A 109 THR OG1 : rot 42:sc= 1.47! USER MOD Set 4.1: A 86 HIS : no HD1:sc= -1.22 K(o=-4.9,f=-4.3) USER MOD Set 4.2: A 88 ASN : amide:sc= -3.39! C(o=-4.9!,f=-7.5!) USER MOD Set 4.3: A 108 SER OG : rot -130:sc= -0.279 USER MOD Set 5.1: A 74 LYS NZ :NH3+ 145:sc= -1.66 (180deg=-2.88!) USER MOD Set 5.2: A 111 SER OG : rot 166:sc= -0.421 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 116:sc= -2.32! USER MOD Single : A 26 SER OG : rot 40:sc= 0.0261 USER MOD Single : A 34 THR OG1 : rot 123:sc= -3.23! USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.152 USER MOD Single : A 36 ASN : amide:sc= -2.63 K(o=-2.6,f=-1.2) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 40:sc= -3.01! USER MOD Single : A 62 MET CE :methyl 147:sc= -4.18! (180deg=-5.16!) USER MOD Single : A 65 THR OG1 : rot -150:sc= -0.15 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 25:sc= 0.937 USER MOD Single : A 77 TYR OH : rot 180:sc= -0.0509 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 114:sc= 1.18 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 MET CE :methyl -119:sc= -3.76 (180deg=-5.69!) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.00864 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 96:sc= -0.0536 USER MOD ----------------------------------------------------------------- ATOM 318 N ASP A 21 -4.652 -13.788 -8.318 1.00 0.00 N ATOM 319 CA ASP A 21 -4.414 -14.849 -7.344 1.00 0.00 C ATOM 320 C ASP A 21 -3.557 -14.344 -6.186 1.00 0.00 C ATOM 321 O ASP A 21 -2.412 -13.939 -6.378 1.00 0.00 O ATOM 322 CB ASP A 21 -3.735 -16.044 -8.015 1.00 0.00 C ATOM 323 CG ASP A 21 -4.719 -16.924 -8.760 1.00 0.00 C ATOM 324 OD1 ASP A 21 -5.249 -16.474 -9.798 1.00 0.00 O ATOM 325 OD2 ASP A 21 -4.959 -18.063 -8.308 1.00 0.00 O ATOM 0 HA ASP A 21 -5.378 -15.165 -6.946 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -2.976 -15.684 -8.709 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.221 -16.638 -7.259 1.00 0.00 H new ATOM 330 N ARG A 22 -4.127 -14.371 -4.984 1.00 0.00 N ATOM 331 CA ARG A 22 -3.432 -13.911 -3.779 1.00 0.00 C ATOM 332 C ARG A 22 -1.981 -14.391 -3.733 1.00 0.00 C ATOM 333 O ARG A 22 -1.104 -13.689 -3.229 1.00 0.00 O ATOM 334 CB ARG A 22 -4.173 -14.399 -2.533 1.00 0.00 C ATOM 335 CG ARG A 22 -5.485 -13.674 -2.281 1.00 0.00 C ATOM 336 CD ARG A 22 -5.285 -12.432 -1.426 1.00 0.00 C ATOM 337 NE ARG A 22 -6.051 -12.494 -0.183 1.00 0.00 N ATOM 338 CZ ARG A 22 -7.358 -12.253 -0.106 1.00 0.00 C ATOM 339 NH1 ARG A 22 -8.047 -11.937 -1.196 1.00 0.00 N ATOM 340 NH2 ARG A 22 -7.978 -12.328 1.064 1.00 0.00 N ATOM 0 H ARG A 22 -5.075 -14.709 -4.815 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.421 -12.821 -3.805 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -4.371 -15.466 -2.633 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -3.526 -14.275 -1.664 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -5.934 -13.392 -3.233 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -6.184 -14.348 -1.786 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -4.226 -12.318 -1.194 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -5.584 -11.550 -1.992 1.00 0.00 H new ATOM 0 HE ARG A 22 -5.556 -12.736 0.675 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -7.575 -11.878 -2.098 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -9.048 -11.753 -1.131 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -7.453 -12.570 1.905 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -8.979 -12.143 1.123 1.00 0.00 H new ATOM 354 N GLU A 23 -1.733 -15.592 -4.247 1.00 0.00 N ATOM 355 CA GLU A 23 -0.385 -16.159 -4.244 1.00 0.00 C ATOM 356 C GLU A 23 0.279 -16.045 -5.615 1.00 0.00 C ATOM 357 O GLU A 23 1.470 -15.748 -5.712 1.00 0.00 O ATOM 358 CB GLU A 23 -0.430 -17.625 -3.804 1.00 0.00 C ATOM 359 CG GLU A 23 0.144 -17.860 -2.416 1.00 0.00 C ATOM 360 CD GLU A 23 -0.878 -17.641 -1.316 1.00 0.00 C ATOM 361 OE1 GLU A 23 -1.721 -18.538 -1.104 1.00 0.00 O ATOM 362 OE2 GLU A 23 -0.835 -16.574 -0.669 1.00 0.00 O ATOM 0 H GLU A 23 -2.443 -16.190 -4.669 1.00 0.00 H new ATOM 0 HA GLU A 23 0.213 -15.586 -3.535 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -1.464 -17.970 -3.824 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.122 -18.229 -4.524 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.527 -18.879 -2.353 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.990 -17.191 -2.259 1.00 0.00 H new ATOM 369 N LYS A 24 -0.491 -16.289 -6.671 1.00 0.00 N ATOM 370 CA LYS A 24 0.035 -16.218 -8.032 1.00 0.00 C ATOM 371 C LYS A 24 -0.168 -14.829 -8.635 1.00 0.00 C ATOM 372 O LYS A 24 -0.309 -14.684 -9.848 1.00 0.00 O ATOM 373 CB LYS A 24 -0.638 -17.275 -8.912 1.00 0.00 C ATOM 374 CG LYS A 24 0.198 -18.530 -9.098 1.00 0.00 C ATOM 375 CD LYS A 24 -0.001 -19.134 -10.479 1.00 0.00 C ATOM 376 CE LYS A 24 0.090 -20.651 -10.442 1.00 0.00 C ATOM 377 NZ LYS A 24 1.495 -21.127 -10.563 1.00 0.00 N ATOM 0 H LYS A 24 -1.479 -16.537 -6.612 1.00 0.00 H new ATOM 0 HA LYS A 24 1.106 -16.414 -7.989 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -1.596 -17.548 -8.470 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -0.850 -16.841 -9.889 1.00 0.00 H new ATOM 0 HG2 LYS A 24 1.252 -18.291 -8.953 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -0.070 -19.263 -8.337 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -0.974 -18.836 -10.871 1.00 0.00 H new ATOM 0 HD3 LYS A 24 0.752 -18.740 -11.162 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -0.338 -21.017 -9.509 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -0.506 -21.070 -11.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 1.513 -22.166 -10.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 1.896 -20.799 -11.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 2.059 -20.748 -9.775 1.00 0.00 H new ATOM 391 N THR A 25 -0.184 -13.813 -7.779 1.00 0.00 N ATOM 392 CA THR A 25 -0.372 -12.437 -8.224 1.00 0.00 C ATOM 393 C THR A 25 0.929 -11.836 -8.746 1.00 0.00 C ATOM 394 O THR A 25 2.016 -12.358 -8.494 1.00 0.00 O ATOM 395 CB THR A 25 -0.890 -11.585 -7.069 1.00 0.00 C ATOM 396 OG1 THR A 25 -0.972 -10.223 -7.452 1.00 0.00 O ATOM 397 CG2 THR A 25 -0.014 -11.668 -5.836 1.00 0.00 C ATOM 0 H THR A 25 -0.069 -13.917 -6.771 1.00 0.00 H new ATOM 0 HA THR A 25 -1.098 -12.447 -9.037 1.00 0.00 H new ATOM 0 HB THR A 25 -1.875 -11.983 -6.825 1.00 0.00 H new ATOM 0 HG1 THR A 25 -1.908 -9.934 -7.434 1.00 0.00 H new ATOM 0 HG21 THR A 25 -0.433 -11.041 -5.049 1.00 0.00 H new ATOM 0 HG22 THR A 25 0.032 -12.701 -5.491 1.00 0.00 H new ATOM 0 HG23 THR A 25 0.990 -11.321 -6.079 1.00 0.00 H new ATOM 405 N SER A 26 0.807 -10.720 -9.460 1.00 0.00 N ATOM 406 CA SER A 26 1.967 -10.023 -10.004 1.00 0.00 C ATOM 407 C SER A 26 2.233 -8.745 -9.209 1.00 0.00 C ATOM 408 O SER A 26 1.317 -7.960 -8.962 1.00 0.00 O ATOM 409 CB SER A 26 1.743 -9.685 -11.479 1.00 0.00 C ATOM 410 OG SER A 26 0.530 -8.976 -11.661 1.00 0.00 O ATOM 0 H SER A 26 -0.087 -10.279 -9.675 1.00 0.00 H new ATOM 0 HA SER A 26 2.835 -10.678 -9.924 1.00 0.00 H new ATOM 0 HB2 SER A 26 2.576 -9.087 -11.849 1.00 0.00 H new ATOM 0 HB3 SER A 26 1.723 -10.603 -12.067 1.00 0.00 H new ATOM 0 HG SER A 26 0.414 -8.333 -10.931 1.00 0.00 H new ATOM 416 N PRO A 27 3.489 -8.517 -8.783 1.00 0.00 N ATOM 417 CA PRO A 27 3.851 -7.328 -8.005 1.00 0.00 C ATOM 418 C PRO A 27 3.889 -6.056 -8.849 1.00 0.00 C ATOM 419 O PRO A 27 4.384 -6.059 -9.976 1.00 0.00 O ATOM 420 CB PRO A 27 5.246 -7.665 -7.481 1.00 0.00 C ATOM 421 CG PRO A 27 5.812 -8.599 -8.493 1.00 0.00 C ATOM 422 CD PRO A 27 4.649 -9.398 -9.017 1.00 0.00 C ATOM 0 HA PRO A 27 3.121 -7.118 -7.223 1.00 0.00 H new ATOM 0 HB2 PRO A 27 5.859 -6.769 -7.382 1.00 0.00 H new ATOM 0 HB3 PRO A 27 5.198 -8.129 -6.496 1.00 0.00 H new ATOM 0 HG2 PRO A 27 6.303 -8.052 -9.297 1.00 0.00 H new ATOM 0 HG3 PRO A 27 6.563 -9.250 -8.046 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.768 -9.632 -10.075 1.00 0.00 H new ATOM 0 HD3 PRO A 27 4.545 -10.347 -8.490 1.00 0.00 H new ATOM 430 N LEU A 28 3.366 -4.969 -8.288 1.00 0.00 N ATOM 431 CA LEU A 28 3.340 -3.683 -8.976 1.00 0.00 C ATOM 432 C LEU A 28 4.038 -2.612 -8.142 1.00 0.00 C ATOM 433 O LEU A 28 3.981 -2.636 -6.913 1.00 0.00 O ATOM 434 CB LEU A 28 1.898 -3.263 -9.274 1.00 0.00 C ATOM 435 CG LEU A 28 1.088 -2.806 -8.054 1.00 0.00 C ATOM 436 CD1 LEU A 28 0.833 -1.308 -8.110 1.00 0.00 C ATOM 437 CD2 LEU A 28 -0.226 -3.570 -7.969 1.00 0.00 C ATOM 0 H LEU A 28 2.953 -4.954 -7.355 1.00 0.00 H new ATOM 0 HA LEU A 28 3.875 -3.791 -9.920 1.00 0.00 H new ATOM 0 HB2 LEU A 28 1.915 -2.453 -10.003 1.00 0.00 H new ATOM 0 HB3 LEU A 28 1.381 -4.101 -9.741 1.00 0.00 H new ATOM 0 HG LEU A 28 1.669 -3.020 -7.157 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.257 -1.004 -7.236 1.00 0.00 H new ATOM 0 HD12 LEU A 28 1.785 -0.777 -8.120 1.00 0.00 H new ATOM 0 HD13 LEU A 28 0.274 -1.068 -9.014 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.787 -3.233 -7.098 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.811 -3.388 -8.870 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.021 -4.637 -7.878 1.00 0.00 H new ATOM 449 N LEU A 29 4.700 -1.679 -8.819 1.00 0.00 N ATOM 450 CA LEU A 29 5.420 -0.606 -8.141 1.00 0.00 C ATOM 451 C LEU A 29 4.518 0.596 -7.874 1.00 0.00 C ATOM 452 O LEU A 29 3.968 1.192 -8.801 1.00 0.00 O ATOM 453 CB LEU A 29 6.625 -0.171 -8.977 1.00 0.00 C ATOM 454 CG LEU A 29 7.413 1.011 -8.413 1.00 0.00 C ATOM 455 CD1 LEU A 29 7.942 0.685 -7.025 1.00 0.00 C ATOM 456 CD2 LEU A 29 8.553 1.385 -9.348 1.00 0.00 C ATOM 0 H LEU A 29 4.753 -1.644 -9.837 1.00 0.00 H new ATOM 0 HA LEU A 29 5.761 -0.993 -7.181 1.00 0.00 H new ATOM 0 HB2 LEU A 29 7.300 -1.020 -9.083 1.00 0.00 H new ATOM 0 HB3 LEU A 29 6.279 0.087 -9.978 1.00 0.00 H new ATOM 0 HG LEU A 29 6.742 1.866 -8.331 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.500 1.538 -6.639 1.00 0.00 H new ATOM 0 HD12 LEU A 29 7.107 0.467 -6.359 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.598 -0.183 -7.080 1.00 0.00 H new ATOM 0 HD21 LEU A 29 9.104 2.228 -8.931 1.00 0.00 H new ATOM 0 HD22 LEU A 29 9.224 0.534 -9.462 1.00 0.00 H new ATOM 0 HD23 LEU A 29 8.149 1.661 -10.322 1.00 0.00 H new ATOM 468 N LEU A 30 4.380 0.956 -6.601 1.00 0.00 N ATOM 469 CA LEU A 30 3.553 2.096 -6.214 1.00 0.00 C ATOM 470 C LEU A 30 4.299 3.021 -5.249 1.00 0.00 C ATOM 471 O LEU A 30 5.310 2.635 -4.660 1.00 0.00 O ATOM 472 CB LEU A 30 2.242 1.617 -5.586 1.00 0.00 C ATOM 473 CG LEU A 30 2.355 1.062 -4.162 1.00 0.00 C ATOM 474 CD1 LEU A 30 2.455 2.196 -3.155 1.00 0.00 C ATOM 475 CD2 LEU A 30 1.164 0.172 -3.846 1.00 0.00 C ATOM 0 H LEU A 30 4.829 0.476 -5.821 1.00 0.00 H new ATOM 0 HA LEU A 30 3.324 2.664 -7.115 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.538 2.449 -5.578 1.00 0.00 H new ATOM 0 HB3 LEU A 30 1.814 0.844 -6.225 1.00 0.00 H new ATOM 0 HG LEU A 30 3.263 0.462 -4.095 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.535 1.783 -2.149 1.00 0.00 H new ATOM 0 HD12 LEU A 30 3.338 2.798 -3.371 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.565 2.821 -3.221 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.258 -0.215 -2.831 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.245 0.751 -3.930 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.134 -0.660 -4.550 1.00 0.00 H new ATOM 487 N ARG A 31 3.792 4.243 -5.098 1.00 0.00 N ATOM 488 CA ARG A 31 4.408 5.229 -4.214 1.00 0.00 C ATOM 489 C ARG A 31 3.778 5.200 -2.822 1.00 0.00 C ATOM 490 O ARG A 31 2.557 5.105 -2.680 1.00 0.00 O ATOM 491 CB ARG A 31 4.278 6.631 -4.812 1.00 0.00 C ATOM 492 CG ARG A 31 5.211 6.880 -5.987 1.00 0.00 C ATOM 493 CD ARG A 31 4.441 7.113 -7.276 1.00 0.00 C ATOM 494 NE ARG A 31 5.329 7.292 -8.422 1.00 0.00 N ATOM 495 CZ ARG A 31 4.922 7.712 -9.618 1.00 0.00 C ATOM 496 NH1 ARG A 31 3.644 7.997 -9.829 1.00 0.00 N ATOM 497 NH2 ARG A 31 5.798 7.847 -10.604 1.00 0.00 N ATOM 0 H ARG A 31 2.955 4.574 -5.578 1.00 0.00 H new ATOM 0 HA ARG A 31 5.463 4.974 -4.116 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.249 6.784 -5.137 1.00 0.00 H new ATOM 0 HB3 ARG A 31 4.480 7.369 -4.035 1.00 0.00 H new ATOM 0 HG2 ARG A 31 5.839 7.746 -5.776 1.00 0.00 H new ATOM 0 HG3 ARG A 31 5.877 6.026 -6.110 1.00 0.00 H new ATOM 0 HD2 ARG A 31 3.779 6.267 -7.460 1.00 0.00 H new ATOM 0 HD3 ARG A 31 3.809 7.995 -7.166 1.00 0.00 H new ATOM 0 HE ARG A 31 6.320 7.083 -8.299 1.00 0.00 H new ATOM 0 HH11 ARG A 31 2.967 7.895 -9.073 1.00 0.00 H new ATOM 0 HH12 ARG A 31 3.338 8.318 -10.747 1.00 0.00 H new ATOM 0 HH21 ARG A 31 6.782 7.629 -10.446 1.00 0.00 H new ATOM 0 HH22 ARG A 31 5.488 8.169 -11.521 1.00 0.00 H new ATOM 511 N VAL A 32 4.624 5.287 -1.797 1.00 0.00 N ATOM 512 CA VAL A 32 4.158 5.274 -0.414 1.00 0.00 C ATOM 513 C VAL A 32 4.831 6.366 0.408 1.00 0.00 C ATOM 514 O VAL A 32 5.971 6.738 0.144 1.00 0.00 O ATOM 515 CB VAL A 32 4.423 3.916 0.268 1.00 0.00 C ATOM 516 CG1 VAL A 32 3.218 3.004 0.124 1.00 0.00 C ATOM 517 CG2 VAL A 32 5.674 3.259 -0.298 1.00 0.00 C ATOM 0 H VAL A 32 5.636 5.367 -1.899 1.00 0.00 H new ATOM 0 HA VAL A 32 3.083 5.452 -0.453 1.00 0.00 H new ATOM 0 HB VAL A 32 4.591 4.094 1.330 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.423 2.051 0.611 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.351 3.471 0.591 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.014 2.835 -0.933 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.839 2.303 0.199 1.00 0.00 H new ATOM 0 HG22 VAL A 32 5.546 3.095 -1.368 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.533 3.908 -0.131 1.00 0.00 H new ATOM 527 N PHE A 33 4.119 6.864 1.413 1.00 0.00 N ATOM 528 CA PHE A 33 4.646 7.903 2.290 1.00 0.00 C ATOM 529 C PHE A 33 4.634 7.422 3.732 1.00 0.00 C ATOM 530 O PHE A 33 3.580 7.345 4.362 1.00 0.00 O ATOM 531 CB PHE A 33 3.824 9.182 2.146 1.00 0.00 C ATOM 532 CG PHE A 33 3.683 9.629 0.721 1.00 0.00 C ATOM 533 CD1 PHE A 33 2.940 8.884 -0.178 1.00 0.00 C ATOM 534 CD2 PHE A 33 4.299 10.788 0.278 1.00 0.00 C ATOM 535 CE1 PHE A 33 2.813 9.284 -1.493 1.00 0.00 C ATOM 536 CE2 PHE A 33 4.176 11.194 -1.035 1.00 0.00 C ATOM 537 CZ PHE A 33 3.433 10.442 -1.922 1.00 0.00 C ATOM 0 H PHE A 33 3.171 6.563 1.641 1.00 0.00 H new ATOM 0 HA PHE A 33 5.675 8.120 2.003 1.00 0.00 H new ATOM 0 HB2 PHE A 33 2.833 9.021 2.570 1.00 0.00 H new ATOM 0 HB3 PHE A 33 4.293 9.977 2.726 1.00 0.00 H new ATOM 0 HD1 PHE A 33 2.454 7.978 0.153 1.00 0.00 H new ATOM 0 HD2 PHE A 33 4.882 11.380 0.968 1.00 0.00 H new ATOM 0 HE1 PHE A 33 2.231 8.693 -2.185 1.00 0.00 H new ATOM 0 HE2 PHE A 33 4.661 12.100 -1.368 1.00 0.00 H new ATOM 0 HZ PHE A 33 3.336 10.758 -2.950 1.00 0.00 H new ATOM 547 N THR A 34 5.809 7.078 4.246 1.00 0.00 N ATOM 548 CA THR A 34 5.923 6.578 5.608 1.00 0.00 C ATOM 549 C THR A 34 6.545 7.606 6.544 1.00 0.00 C ATOM 550 O THR A 34 7.671 8.056 6.337 1.00 0.00 O ATOM 551 CB THR A 34 6.750 5.292 5.633 1.00 0.00 C ATOM 552 OG1 THR A 34 7.988 5.481 4.973 1.00 0.00 O ATOM 553 CG2 THR A 34 6.055 4.118 4.978 1.00 0.00 C ATOM 0 H THR A 34 6.693 7.136 3.741 1.00 0.00 H new ATOM 0 HA THR A 34 4.913 6.372 5.962 1.00 0.00 H new ATOM 0 HB THR A 34 6.895 5.063 6.689 1.00 0.00 H new ATOM 0 HG1 THR A 34 8.722 5.268 5.587 1.00 0.00 H new ATOM 0 HG21 THR A 34 6.697 3.239 5.031 1.00 0.00 H new ATOM 0 HG22 THR A 34 5.118 3.914 5.496 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.848 4.354 3.934 1.00 0.00 H new ATOM 561 N THR A 35 5.805 7.949 7.593 1.00 0.00 N ATOM 562 CA THR A 35 6.283 8.898 8.593 1.00 0.00 C ATOM 563 C THR A 35 6.622 8.143 9.879 1.00 0.00 C ATOM 564 O THR A 35 6.186 7.009 10.051 1.00 0.00 O ATOM 565 CB THR A 35 5.227 9.976 8.863 1.00 0.00 C ATOM 566 OG1 THR A 35 5.460 10.600 10.120 1.00 0.00 O ATOM 567 CG2 THR A 35 3.806 9.448 8.856 1.00 0.00 C ATOM 0 H THR A 35 4.870 7.583 7.773 1.00 0.00 H new ATOM 0 HA THR A 35 7.178 9.395 8.219 1.00 0.00 H new ATOM 0 HB THR A 35 5.326 10.689 8.045 1.00 0.00 H new ATOM 0 HG1 THR A 35 4.778 11.286 10.276 1.00 0.00 H new ATOM 0 HG21 THR A 35 3.113 10.266 9.054 1.00 0.00 H new ATOM 0 HG22 THR A 35 3.585 9.012 7.882 1.00 0.00 H new ATOM 0 HG23 THR A 35 3.697 8.686 9.627 1.00 0.00 H new ATOM 575 N ASN A 36 7.403 8.757 10.770 1.00 0.00 N ATOM 576 CA ASN A 36 7.782 8.095 12.010 1.00 0.00 C ATOM 577 C ASN A 36 7.017 8.665 13.198 1.00 0.00 C ATOM 578 O ASN A 36 7.499 8.626 14.329 1.00 0.00 O ATOM 579 CB ASN A 36 9.286 8.231 12.238 1.00 0.00 C ATOM 580 CG ASN A 36 9.762 7.429 13.432 1.00 0.00 C ATOM 581 OD1 ASN A 36 10.488 7.938 14.288 1.00 0.00 O ATOM 582 ND2 ASN A 36 9.357 6.166 13.498 1.00 0.00 N ATOM 0 H ASN A 36 7.779 9.698 10.655 1.00 0.00 H new ATOM 0 HA ASN A 36 7.526 7.039 11.921 1.00 0.00 H new ATOM 0 HB2 ASN A 36 9.818 7.900 11.346 1.00 0.00 H new ATOM 0 HB3 ASN A 36 9.535 9.282 12.386 1.00 0.00 H new ATOM 0 HD21 ASN A 36 9.647 5.578 14.279 1.00 0.00 H new ATOM 0 HD22 ASN A 36 8.756 5.784 12.768 1.00 0.00 H new ATOM 589 N ASN A 37 5.826 9.192 12.940 1.00 0.00 N ATOM 590 CA ASN A 37 5.006 9.765 14.001 1.00 0.00 C ATOM 591 C ASN A 37 3.580 9.207 13.975 1.00 0.00 C ATOM 592 O ASN A 37 2.771 9.516 14.849 1.00 0.00 O ATOM 593 CB ASN A 37 4.970 11.289 13.882 1.00 0.00 C ATOM 594 CG ASN A 37 4.968 11.975 15.233 1.00 0.00 C ATOM 595 OD1 ASN A 37 5.976 11.988 15.938 1.00 0.00 O ATOM 596 ND2 ASN A 37 3.829 12.552 15.602 1.00 0.00 N ATOM 0 H ASN A 37 5.408 9.235 12.011 1.00 0.00 H new ATOM 0 HA ASN A 37 5.460 9.488 14.952 1.00 0.00 H new ATOM 0 HB2 ASN A 37 5.833 11.626 13.308 1.00 0.00 H new ATOM 0 HB3 ASN A 37 4.081 11.586 13.326 1.00 0.00 H new ATOM 0 HD21 ASN A 37 3.767 13.030 16.501 1.00 0.00 H new ATOM 0 HD22 ASN A 37 3.017 12.517 14.986 1.00 0.00 H new ATOM 603 N GLY A 38 3.278 8.383 12.972 1.00 0.00 N ATOM 604 CA GLY A 38 1.952 7.801 12.864 1.00 0.00 C ATOM 605 C GLY A 38 0.852 8.841 12.894 1.00 0.00 C ATOM 606 O GLY A 38 -0.060 8.765 13.719 1.00 0.00 O ATOM 0 H GLY A 38 3.928 8.110 12.235 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.884 7.233 11.936 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.802 7.096 13.681 1.00 0.00 H new ATOM 610 N ARG A 39 0.932 9.817 11.996 1.00 0.00 N ATOM 611 CA ARG A 39 -0.071 10.871 11.934 1.00 0.00 C ATOM 612 C ARG A 39 -0.015 11.621 10.605 1.00 0.00 C ATOM 613 O ARG A 39 0.763 12.560 10.447 1.00 0.00 O ATOM 614 CB ARG A 39 0.123 11.844 13.098 1.00 0.00 C ATOM 615 CG ARG A 39 -1.142 12.085 13.906 1.00 0.00 C ATOM 616 CD ARG A 39 -0.847 12.131 15.396 1.00 0.00 C ATOM 617 NE ARG A 39 -0.454 13.469 15.834 1.00 0.00 N ATOM 618 CZ ARG A 39 0.410 13.708 16.820 1.00 0.00 C ATOM 619 NH1 ARG A 39 0.967 12.705 17.487 1.00 0.00 N ATOM 620 NH2 ARG A 39 0.715 14.958 17.142 1.00 0.00 N ATOM 0 H ARG A 39 1.677 9.899 11.305 1.00 0.00 H new ATOM 0 HA ARG A 39 -1.054 10.406 12.011 1.00 0.00 H new ATOM 0 HB2 ARG A 39 0.898 11.457 13.759 1.00 0.00 H new ATOM 0 HB3 ARG A 39 0.483 12.796 12.709 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -1.601 13.024 13.595 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -1.863 11.294 13.700 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -1.730 11.812 15.951 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -0.051 11.424 15.630 1.00 0.00 H new ATOM 0 HE ARG A 39 -0.867 14.269 15.355 1.00 0.00 H new ATOM 0 HH11 ARG A 39 0.735 11.741 17.246 1.00 0.00 H new ATOM 0 HH12 ARG A 39 1.627 12.898 18.240 1.00 0.00 H new ATOM 0 HH21 ARG A 39 0.288 15.734 16.635 1.00 0.00 H new ATOM 0 HH22 ARG A 39 1.376 15.144 17.896 1.00 0.00 H new ATOM 864 N GLU A 55 8.878 9.555 0.927 1.00 0.00 N ATOM 865 CA GLU A 55 8.182 8.540 0.148 1.00 0.00 C ATOM 866 C GLU A 55 9.117 7.411 -0.274 1.00 0.00 C ATOM 867 O GLU A 55 10.298 7.631 -0.543 1.00 0.00 O ATOM 868 CB GLU A 55 7.539 9.171 -1.089 1.00 0.00 C ATOM 869 CG GLU A 55 8.524 9.914 -1.976 1.00 0.00 C ATOM 870 CD GLU A 55 8.627 9.315 -3.366 1.00 0.00 C ATOM 871 OE1 GLU A 55 7.637 9.397 -4.122 1.00 0.00 O ATOM 872 OE2 GLU A 55 9.699 8.765 -3.698 1.00 0.00 O ATOM 0 HA GLU A 55 7.407 8.113 0.784 1.00 0.00 H new ATOM 0 HB2 GLU A 55 7.054 8.390 -1.674 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.758 9.861 -0.770 1.00 0.00 H new ATOM 0 HG2 GLU A 55 8.219 10.957 -2.056 1.00 0.00 H new ATOM 0 HG3 GLU A 55 9.508 9.905 -1.507 1.00 0.00 H new ATOM 879 N LEU A 56 8.569 6.200 -0.341 1.00 0.00 N ATOM 880 CA LEU A 56 9.337 5.023 -0.743 1.00 0.00 C ATOM 881 C LEU A 56 8.574 4.230 -1.800 1.00 0.00 C ATOM 882 O LEU A 56 7.509 4.653 -2.251 1.00 0.00 O ATOM 883 CB LEU A 56 9.650 4.122 0.461 1.00 0.00 C ATOM 884 CG LEU A 56 8.818 4.372 1.726 1.00 0.00 C ATOM 885 CD1 LEU A 56 7.883 3.200 1.992 1.00 0.00 C ATOM 886 CD2 LEU A 56 9.729 4.609 2.924 1.00 0.00 C ATOM 0 H LEU A 56 7.592 6.007 -0.121 1.00 0.00 H new ATOM 0 HA LEU A 56 10.281 5.369 -1.164 1.00 0.00 H new ATOM 0 HB2 LEU A 56 9.511 3.084 0.158 1.00 0.00 H new ATOM 0 HB3 LEU A 56 10.703 4.241 0.714 1.00 0.00 H new ATOM 0 HG LEU A 56 8.213 5.265 1.569 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.301 3.396 2.893 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.209 3.073 1.145 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.469 2.291 2.129 1.00 0.00 H new ATOM 0 HD21 LEU A 56 9.123 4.785 3.813 1.00 0.00 H new ATOM 0 HD22 LEU A 56 10.358 3.733 3.081 1.00 0.00 H new ATOM 0 HD23 LEU A 56 10.358 5.479 2.736 1.00 0.00 H new ATOM 898 N GLN A 57 9.117 3.082 -2.195 1.00 0.00 N ATOM 899 CA GLN A 57 8.478 2.245 -3.203 1.00 0.00 C ATOM 900 C GLN A 57 8.225 0.837 -2.670 1.00 0.00 C ATOM 901 O GLN A 57 9.059 0.268 -1.970 1.00 0.00 O ATOM 902 CB GLN A 57 9.352 2.177 -4.454 1.00 0.00 C ATOM 903 CG GLN A 57 9.126 3.329 -5.419 1.00 0.00 C ATOM 904 CD GLN A 57 10.232 4.366 -5.360 1.00 0.00 C ATOM 905 OE1 GLN A 57 11.336 4.143 -5.857 1.00 0.00 O ATOM 906 NE2 GLN A 57 9.939 5.508 -4.749 1.00 0.00 N ATOM 0 H GLN A 57 9.996 2.712 -1.833 1.00 0.00 H new ATOM 0 HA GLN A 57 7.516 2.692 -3.455 1.00 0.00 H new ATOM 0 HB2 GLN A 57 10.400 2.166 -4.154 1.00 0.00 H new ATOM 0 HB3 GLN A 57 9.158 1.237 -4.972 1.00 0.00 H new ATOM 0 HG2 GLN A 57 9.053 2.939 -6.434 1.00 0.00 H new ATOM 0 HG3 GLN A 57 8.173 3.807 -5.192 1.00 0.00 H new ATOM 0 HE21 GLN A 57 9.011 5.650 -4.351 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.642 6.243 -4.678 1.00 0.00 H new ATOM 915 N ILE A 58 7.068 0.280 -3.019 1.00 0.00 N ATOM 916 CA ILE A 58 6.703 -1.069 -2.586 1.00 0.00 C ATOM 917 C ILE A 58 6.120 -1.871 -3.739 1.00 0.00 C ATOM 918 O ILE A 58 5.193 -1.422 -4.413 1.00 0.00 O ATOM 919 CB ILE A 58 5.665 -1.061 -1.442 1.00 0.00 C ATOM 920 CG1 ILE A 58 4.799 0.199 -1.486 1.00 0.00 C ATOM 921 CG2 ILE A 58 6.355 -1.190 -0.096 1.00 0.00 C ATOM 922 CD1 ILE A 58 3.353 -0.055 -1.118 1.00 0.00 C ATOM 0 H ILE A 58 6.367 0.740 -3.600 1.00 0.00 H new ATOM 0 HA ILE A 58 7.625 -1.526 -2.227 1.00 0.00 H new ATOM 0 HB ILE A 58 5.009 -1.920 -1.579 1.00 0.00 H new ATOM 0 HG12 ILE A 58 5.215 0.941 -0.805 1.00 0.00 H new ATOM 0 HG13 ILE A 58 4.842 0.626 -2.488 1.00 0.00 H new ATOM 0 HG21 ILE A 58 5.608 -1.183 0.698 1.00 0.00 H new ATOM 0 HG22 ILE A 58 6.912 -2.126 -0.061 1.00 0.00 H new ATOM 0 HG23 ILE A 58 7.041 -0.354 0.043 1.00 0.00 H new ATOM 0 HD11 ILE A 58 2.795 0.880 -1.169 1.00 0.00 H new ATOM 0 HD12 ILE A 58 2.921 -0.774 -1.814 1.00 0.00 H new ATOM 0 HD13 ILE A 58 3.300 -0.454 -0.105 1.00 0.00 H new ATOM 934 N TYR A 59 6.649 -3.069 -3.948 1.00 0.00 N ATOM 935 CA TYR A 59 6.150 -3.936 -5.002 1.00 0.00 C ATOM 936 C TYR A 59 5.050 -4.828 -4.441 1.00 0.00 C ATOM 937 O TYR A 59 5.288 -5.985 -4.097 1.00 0.00 O ATOM 938 CB TYR A 59 7.281 -4.785 -5.587 1.00 0.00 C ATOM 939 CG TYR A 59 7.910 -4.183 -6.824 1.00 0.00 C ATOM 940 CD1 TYR A 59 8.546 -2.949 -6.773 1.00 0.00 C ATOM 941 CD2 TYR A 59 7.865 -4.848 -8.043 1.00 0.00 C ATOM 942 CE1 TYR A 59 9.120 -2.395 -7.901 1.00 0.00 C ATOM 943 CE2 TYR A 59 8.437 -4.302 -9.175 1.00 0.00 C ATOM 944 CZ TYR A 59 9.062 -3.076 -9.099 1.00 0.00 C ATOM 945 OH TYR A 59 9.632 -2.527 -10.227 1.00 0.00 O ATOM 0 H TYR A 59 7.419 -3.459 -3.404 1.00 0.00 H new ATOM 0 HA TYR A 59 5.743 -3.322 -5.805 1.00 0.00 H new ATOM 0 HB2 TYR A 59 8.051 -4.923 -4.828 1.00 0.00 H new ATOM 0 HB3 TYR A 59 6.893 -5.774 -5.831 1.00 0.00 H new ATOM 0 HD1 TYR A 59 8.593 -2.414 -5.836 1.00 0.00 H new ATOM 0 HD2 TYR A 59 7.374 -5.808 -8.106 1.00 0.00 H new ATOM 0 HE1 TYR A 59 9.611 -1.435 -7.845 1.00 0.00 H new ATOM 0 HE2 TYR A 59 8.395 -4.833 -10.115 1.00 0.00 H new ATOM 0 HH TYR A 59 9.505 -3.134 -10.986 1.00 0.00 H new ATOM 955 N THR A 60 3.847 -4.270 -4.334 1.00 0.00 N ATOM 956 CA THR A 60 2.709 -5.003 -3.796 1.00 0.00 C ATOM 957 C THR A 60 1.719 -5.361 -4.897 1.00 0.00 C ATOM 958 O THR A 60 1.850 -4.903 -6.029 1.00 0.00 O ATOM 959 CB THR A 60 2.010 -4.173 -2.717 1.00 0.00 C ATOM 960 OG1 THR A 60 1.038 -4.954 -2.043 1.00 0.00 O ATOM 961 CG2 THR A 60 1.319 -2.939 -3.258 1.00 0.00 C ATOM 0 H THR A 60 3.637 -3.312 -4.613 1.00 0.00 H new ATOM 0 HA THR A 60 3.080 -5.928 -3.354 1.00 0.00 H new ATOM 0 HB THR A 60 2.801 -3.852 -2.040 1.00 0.00 H new ATOM 0 HG1 THR A 60 1.387 -5.859 -1.901 1.00 0.00 H new ATOM 0 HG21 THR A 60 0.845 -2.399 -2.439 1.00 0.00 H new ATOM 0 HG22 THR A 60 2.052 -2.294 -3.742 1.00 0.00 H new ATOM 0 HG23 THR A 60 0.561 -3.235 -3.984 1.00 0.00 H new ATOM 969 N TRP A 61 0.725 -6.181 -4.564 1.00 0.00 N ATOM 970 CA TRP A 61 -0.275 -6.584 -5.545 1.00 0.00 C ATOM 971 C TRP A 61 -1.677 -6.146 -5.141 1.00 0.00 C ATOM 972 O TRP A 61 -2.145 -6.436 -4.044 1.00 0.00 O ATOM 973 CB TRP A 61 -0.242 -8.094 -5.770 1.00 0.00 C ATOM 974 CG TRP A 61 -0.286 -8.907 -4.513 1.00 0.00 C ATOM 975 CD1 TRP A 61 -1.340 -9.642 -4.051 1.00 0.00 C ATOM 976 CD2 TRP A 61 0.773 -9.084 -3.566 1.00 0.00 C ATOM 977 NE1 TRP A 61 -0.999 -10.271 -2.880 1.00 0.00 N ATOM 978 CE2 TRP A 61 0.292 -9.940 -2.559 1.00 0.00 C ATOM 979 CE3 TRP A 61 2.081 -8.602 -3.471 1.00 0.00 C ATOM 980 CZ2 TRP A 61 1.074 -10.327 -1.473 1.00 0.00 C ATOM 981 CZ3 TRP A 61 2.856 -8.984 -2.392 1.00 0.00 C ATOM 982 CH2 TRP A 61 2.349 -9.841 -1.405 1.00 0.00 C ATOM 0 H TRP A 61 0.592 -6.575 -3.633 1.00 0.00 H new ATOM 0 HA TRP A 61 -0.024 -6.082 -6.479 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -1.087 -8.374 -6.399 1.00 0.00 H new ATOM 0 HB3 TRP A 61 0.664 -8.347 -6.321 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -2.302 -9.717 -4.536 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -1.607 -10.885 -2.337 1.00 0.00 H new ATOM 0 HE3 TRP A 61 2.480 -7.942 -4.228 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 0.686 -10.988 -0.712 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 3.868 -8.616 -2.308 1.00 0.00 H new ATOM 0 HH2 TRP A 61 2.979 -10.123 -0.574 1.00 0.00 H new ATOM 993 N MET A 62 -2.319 -5.429 -6.049 1.00 0.00 N ATOM 994 CA MET A 62 -3.681 -4.905 -5.847 1.00 0.00 C ATOM 995 C MET A 62 -4.537 -5.814 -4.956 1.00 0.00 C ATOM 996 O MET A 62 -5.344 -5.333 -4.162 1.00 0.00 O ATOM 997 CB MET A 62 -4.379 -4.717 -7.198 1.00 0.00 C ATOM 998 CG MET A 62 -3.689 -3.711 -8.105 1.00 0.00 C ATOM 999 SD MET A 62 -4.717 -2.271 -8.457 1.00 0.00 S ATOM 1000 CE MET A 62 -4.039 -1.085 -7.300 1.00 0.00 C ATOM 0 H MET A 62 -1.917 -5.187 -6.955 1.00 0.00 H new ATOM 0 HA MET A 62 -3.578 -3.946 -5.338 1.00 0.00 H new ATOM 0 HB2 MET A 62 -4.429 -5.679 -7.708 1.00 0.00 H new ATOM 0 HB3 MET A 62 -5.405 -4.394 -7.025 1.00 0.00 H new ATOM 0 HG2 MET A 62 -2.760 -3.384 -7.638 1.00 0.00 H new ATOM 0 HG3 MET A 62 -3.420 -4.198 -9.042 1.00 0.00 H new ATOM 0 HE1 MET A 62 -4.096 -0.085 -7.729 1.00 0.00 H new ATOM 0 HE2 MET A 62 -4.610 -1.115 -6.372 1.00 0.00 H new ATOM 0 HE3 MET A 62 -2.998 -1.333 -7.093 1.00 0.00 H new ATOM 1010 N ASP A 63 -4.363 -7.128 -5.097 1.00 0.00 N ATOM 1011 CA ASP A 63 -5.129 -8.092 -4.305 1.00 0.00 C ATOM 1012 C ASP A 63 -4.343 -8.578 -3.086 1.00 0.00 C ATOM 1013 O ASP A 63 -4.516 -9.712 -2.638 1.00 0.00 O ATOM 1014 CB ASP A 63 -5.526 -9.288 -5.174 1.00 0.00 C ATOM 1015 CG ASP A 63 -6.811 -9.943 -4.706 1.00 0.00 C ATOM 1016 OD1 ASP A 63 -6.793 -10.585 -3.635 1.00 0.00 O ATOM 1017 OD2 ASP A 63 -7.834 -9.813 -5.410 1.00 0.00 O ATOM 0 H ASP A 63 -3.701 -7.549 -5.749 1.00 0.00 H new ATOM 0 HA ASP A 63 -6.024 -7.585 -3.946 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -5.644 -8.960 -6.207 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -4.722 -10.024 -5.164 1.00 0.00 H new ATOM 1022 N ALA A 64 -3.475 -7.721 -2.558 1.00 0.00 N ATOM 1023 CA ALA A 64 -2.659 -8.069 -1.399 1.00 0.00 C ATOM 1024 C ALA A 64 -3.349 -7.703 -0.091 1.00 0.00 C ATOM 1025 O ALA A 64 -3.952 -6.637 0.026 1.00 0.00 O ATOM 1026 CB ALA A 64 -1.307 -7.371 -1.474 1.00 0.00 C ATOM 0 H ALA A 64 -3.318 -6.778 -2.915 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.515 -9.149 -1.417 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -0.710 -7.640 -0.603 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.787 -7.681 -2.380 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.455 -6.291 -1.492 1.00 0.00 H new ATOM 1032 N THR A 65 -3.237 -8.584 0.900 1.00 0.00 N ATOM 1033 CA THR A 65 -3.830 -8.332 2.206 1.00 0.00 C ATOM 1034 C THR A 65 -2.996 -7.302 2.957 1.00 0.00 C ATOM 1035 O THR A 65 -1.780 -7.224 2.769 1.00 0.00 O ATOM 1036 CB THR A 65 -3.937 -9.625 3.017 1.00 0.00 C ATOM 1037 OG1 THR A 65 -3.124 -10.639 2.460 1.00 0.00 O ATOM 1038 CG2 THR A 65 -5.350 -10.162 3.102 1.00 0.00 C ATOM 0 H THR A 65 -2.744 -9.473 0.822 1.00 0.00 H new ATOM 0 HA THR A 65 -4.838 -7.942 2.062 1.00 0.00 H new ATOM 0 HB THR A 65 -3.603 -9.363 4.021 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.523 -11.515 2.642 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.356 -11.080 3.690 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.993 -9.421 3.578 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.720 -10.372 2.099 1.00 0.00 H new ATOM 1046 N LEU A 66 -3.648 -6.508 3.803 1.00 0.00 N ATOM 1047 CA LEU A 66 -2.957 -5.475 4.567 1.00 0.00 C ATOM 1048 C LEU A 66 -1.669 -6.005 5.187 1.00 0.00 C ATOM 1049 O LEU A 66 -0.683 -5.278 5.304 1.00 0.00 O ATOM 1050 CB LEU A 66 -3.871 -4.912 5.655 1.00 0.00 C ATOM 1051 CG LEU A 66 -4.531 -3.575 5.309 1.00 0.00 C ATOM 1052 CD1 LEU A 66 -5.472 -3.143 6.420 1.00 0.00 C ATOM 1053 CD2 LEU A 66 -3.474 -2.508 5.059 1.00 0.00 C ATOM 0 H LEU A 66 -4.652 -6.561 3.976 1.00 0.00 H new ATOM 0 HA LEU A 66 -2.693 -4.675 3.875 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.652 -5.642 5.868 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.291 -4.789 6.570 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.113 -3.704 4.396 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -5.932 -2.191 6.157 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -6.248 -3.897 6.553 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.912 -3.031 7.348 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.961 -1.564 4.814 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.866 -2.381 5.955 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.838 -2.814 4.229 1.00 0.00 H new ATOM 1065 N LYS A 67 -1.677 -7.274 5.583 1.00 0.00 N ATOM 1066 CA LYS A 67 -0.497 -7.879 6.187 1.00 0.00 C ATOM 1067 C LYS A 67 0.693 -7.835 5.229 1.00 0.00 C ATOM 1068 O LYS A 67 1.799 -7.463 5.629 1.00 0.00 O ATOM 1069 CB LYS A 67 -0.781 -9.323 6.620 1.00 0.00 C ATOM 1070 CG LYS A 67 -1.495 -10.159 5.571 1.00 0.00 C ATOM 1071 CD LYS A 67 -1.319 -11.648 5.831 1.00 0.00 C ATOM 1072 CE LYS A 67 -1.033 -12.410 4.548 1.00 0.00 C ATOM 1073 NZ LYS A 67 -1.152 -13.882 4.737 1.00 0.00 N ATOM 0 H LYS A 67 -2.480 -7.898 5.497 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.244 -7.298 7.074 1.00 0.00 H new ATOM 0 HB2 LYS A 67 0.162 -9.807 6.873 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -1.384 -9.306 7.528 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -2.557 -9.912 5.568 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -1.108 -9.913 4.582 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -0.501 -11.801 6.535 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -2.220 -12.045 6.298 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -1.726 -12.087 3.772 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -0.029 -12.169 4.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -0.949 -14.365 3.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -0.473 -14.195 5.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -2.117 -14.115 5.045 1.00 0.00 H new ATOM 1087 N GLU A 68 0.470 -8.205 3.966 1.00 0.00 N ATOM 1088 CA GLU A 68 1.534 -8.189 2.979 1.00 0.00 C ATOM 1089 C GLU A 68 2.121 -6.790 2.853 1.00 0.00 C ATOM 1090 O GLU A 68 3.320 -6.627 2.630 1.00 0.00 O ATOM 1091 CB GLU A 68 0.997 -8.664 1.630 1.00 0.00 C ATOM 1092 CG GLU A 68 0.468 -10.088 1.663 1.00 0.00 C ATOM 1093 CD GLU A 68 1.576 -11.122 1.593 1.00 0.00 C ATOM 1094 OE1 GLU A 68 2.700 -10.821 2.045 1.00 0.00 O ATOM 1095 OE2 GLU A 68 1.318 -12.234 1.087 1.00 0.00 O ATOM 0 H GLU A 68 -0.434 -8.516 3.611 1.00 0.00 H new ATOM 0 HA GLU A 68 2.325 -8.865 3.303 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.199 -7.995 1.308 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.791 -8.595 0.886 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.107 -10.237 2.577 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -0.217 -10.237 0.828 1.00 0.00 H new ATOM 1102 N LEU A 69 1.267 -5.784 3.006 1.00 0.00 N ATOM 1103 CA LEU A 69 1.705 -4.395 2.919 1.00 0.00 C ATOM 1104 C LEU A 69 2.536 -4.025 4.142 1.00 0.00 C ATOM 1105 O LEU A 69 3.395 -3.146 4.080 1.00 0.00 O ATOM 1106 CB LEU A 69 0.500 -3.457 2.788 1.00 0.00 C ATOM 1107 CG LEU A 69 -0.340 -3.654 1.523 1.00 0.00 C ATOM 1108 CD1 LEU A 69 0.552 -3.744 0.296 1.00 0.00 C ATOM 1109 CD2 LEU A 69 -1.201 -4.898 1.652 1.00 0.00 C ATOM 0 H LEU A 69 0.271 -5.903 3.190 1.00 0.00 H new ATOM 0 HA LEU A 69 2.325 -4.284 2.029 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.143 -3.593 3.658 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.856 -2.427 2.813 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.995 -2.791 1.404 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.064 -3.884 -0.592 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.128 -2.824 0.197 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.233 -4.589 0.402 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.793 -5.026 0.746 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.562 -5.770 1.794 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.867 -4.792 2.509 1.00 0.00 H new ATOM 1121 N THR A 70 2.284 -4.717 5.250 1.00 0.00 N ATOM 1122 CA THR A 70 3.016 -4.478 6.489 1.00 0.00 C ATOM 1123 C THR A 70 4.474 -4.909 6.332 1.00 0.00 C ATOM 1124 O THR A 70 5.382 -4.307 6.911 1.00 0.00 O ATOM 1125 CB THR A 70 2.364 -5.243 7.642 1.00 0.00 C ATOM 1126 OG1 THR A 70 1.042 -4.785 7.862 1.00 0.00 O ATOM 1127 CG2 THR A 70 3.117 -5.118 8.948 1.00 0.00 C ATOM 0 H THR A 70 1.577 -5.449 5.314 1.00 0.00 H new ATOM 0 HA THR A 70 2.987 -3.412 6.713 1.00 0.00 H new ATOM 0 HB THR A 70 2.375 -6.289 7.336 1.00 0.00 H new ATOM 0 HG1 THR A 70 1.068 -3.908 8.299 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.599 -5.685 9.722 1.00 0.00 H new ATOM 0 HG22 THR A 70 4.127 -5.510 8.825 1.00 0.00 H new ATOM 0 HG23 THR A 70 3.168 -4.069 9.239 1.00 0.00 H new ATOM 1135 N SER A 71 4.694 -5.949 5.528 1.00 0.00 N ATOM 1136 CA SER A 71 6.039 -6.453 5.287 1.00 0.00 C ATOM 1137 C SER A 71 6.742 -5.612 4.228 1.00 0.00 C ATOM 1138 O SER A 71 7.903 -5.234 4.389 1.00 0.00 O ATOM 1139 CB SER A 71 5.989 -7.917 4.846 1.00 0.00 C ATOM 1140 OG SER A 71 4.906 -8.146 3.959 1.00 0.00 O ATOM 0 H SER A 71 3.958 -6.455 5.035 1.00 0.00 H new ATOM 0 HA SER A 71 6.602 -6.386 6.218 1.00 0.00 H new ATOM 0 HB2 SER A 71 6.926 -8.185 4.358 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.889 -8.560 5.720 1.00 0.00 H new ATOM 0 HG SER A 71 4.672 -7.309 3.506 1.00 0.00 H new ATOM 1146 N LEU A 72 6.026 -5.310 3.149 1.00 0.00 N ATOM 1147 CA LEU A 72 6.576 -4.498 2.069 1.00 0.00 C ATOM 1148 C LEU A 72 7.172 -3.210 2.629 1.00 0.00 C ATOM 1149 O LEU A 72 8.278 -2.809 2.259 1.00 0.00 O ATOM 1150 CB LEU A 72 5.493 -4.185 1.038 1.00 0.00 C ATOM 1151 CG LEU A 72 4.905 -5.407 0.331 1.00 0.00 C ATOM 1152 CD1 LEU A 72 3.448 -5.166 -0.031 1.00 0.00 C ATOM 1153 CD2 LEU A 72 5.718 -5.744 -0.910 1.00 0.00 C ATOM 0 H LEU A 72 5.064 -5.615 2.999 1.00 0.00 H new ATOM 0 HA LEU A 72 7.369 -5.060 1.576 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.685 -3.646 1.533 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.910 -3.514 0.287 1.00 0.00 H new ATOM 0 HG LEU A 72 4.950 -6.256 1.013 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.047 -6.047 -0.533 1.00 0.00 H new ATOM 0 HD12 LEU A 72 2.875 -4.973 0.876 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.376 -4.305 -0.696 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.287 -6.616 -1.402 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.704 -4.897 -1.595 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.747 -5.961 -0.623 1.00 0.00 H new ATOM 1165 N VAL A 73 6.448 -2.581 3.552 1.00 0.00 N ATOM 1166 CA VAL A 73 6.927 -1.363 4.180 1.00 0.00 C ATOM 1167 C VAL A 73 8.179 -1.660 4.987 1.00 0.00 C ATOM 1168 O VAL A 73 9.143 -0.900 4.957 1.00 0.00 O ATOM 1169 CB VAL A 73 5.860 -0.741 5.101 1.00 0.00 C ATOM 1170 CG1 VAL A 73 6.380 0.538 5.741 1.00 0.00 C ATOM 1171 CG2 VAL A 73 4.581 -0.471 4.326 1.00 0.00 C ATOM 0 H VAL A 73 5.534 -2.896 3.877 1.00 0.00 H new ATOM 0 HA VAL A 73 7.152 -0.647 3.390 1.00 0.00 H new ATOM 0 HB VAL A 73 5.637 -1.452 5.896 1.00 0.00 H new ATOM 0 HG11 VAL A 73 5.611 0.960 6.387 1.00 0.00 H new ATOM 0 HG12 VAL A 73 7.268 0.314 6.332 1.00 0.00 H new ATOM 0 HG13 VAL A 73 6.635 1.257 4.962 1.00 0.00 H new ATOM 0 HG21 VAL A 73 3.838 -0.032 4.992 1.00 0.00 H new ATOM 0 HG22 VAL A 73 4.790 0.220 3.509 1.00 0.00 H new ATOM 0 HG23 VAL A 73 4.197 -1.407 3.921 1.00 0.00 H new ATOM 1181 N LYS A 74 8.160 -2.780 5.710 1.00 0.00 N ATOM 1182 CA LYS A 74 9.301 -3.184 6.524 1.00 0.00 C ATOM 1183 C LYS A 74 10.570 -3.237 5.685 1.00 0.00 C ATOM 1184 O LYS A 74 11.617 -2.729 6.087 1.00 0.00 O ATOM 1185 CB LYS A 74 9.040 -4.552 7.162 1.00 0.00 C ATOM 1186 CG LYS A 74 8.418 -4.470 8.546 1.00 0.00 C ATOM 1187 CD LYS A 74 7.469 -3.289 8.663 1.00 0.00 C ATOM 1188 CE LYS A 74 6.302 -3.599 9.584 1.00 0.00 C ATOM 1189 NZ LYS A 74 6.744 -3.844 10.984 1.00 0.00 N ATOM 0 H LYS A 74 7.367 -3.421 5.747 1.00 0.00 H new ATOM 0 HA LYS A 74 9.436 -2.443 7.312 1.00 0.00 H new ATOM 0 HB2 LYS A 74 8.382 -5.127 6.511 1.00 0.00 H new ATOM 0 HB3 LYS A 74 9.981 -5.098 7.228 1.00 0.00 H new ATOM 0 HG2 LYS A 74 7.879 -5.393 8.759 1.00 0.00 H new ATOM 0 HG3 LYS A 74 9.205 -4.381 9.295 1.00 0.00 H new ATOM 0 HD2 LYS A 74 8.011 -2.422 9.041 1.00 0.00 H new ATOM 0 HD3 LYS A 74 7.093 -3.024 7.675 1.00 0.00 H new ATOM 0 HE2 LYS A 74 5.597 -2.768 9.567 1.00 0.00 H new ATOM 0 HE3 LYS A 74 5.771 -4.476 9.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 6.028 -3.477 11.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 6.863 -4.866 11.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 7.650 -3.361 11.152 1.00 0.00 H new ATOM 1203 N GLU A 75 10.467 -3.851 4.513 1.00 0.00 N ATOM 1204 CA GLU A 75 11.606 -3.964 3.614 1.00 0.00 C ATOM 1205 C GLU A 75 12.107 -2.584 3.205 1.00 0.00 C ATOM 1206 O GLU A 75 13.286 -2.407 2.899 1.00 0.00 O ATOM 1207 CB GLU A 75 11.227 -4.774 2.372 1.00 0.00 C ATOM 1208 CG GLU A 75 12.324 -5.718 1.905 1.00 0.00 C ATOM 1209 CD GLU A 75 12.378 -6.996 2.718 1.00 0.00 C ATOM 1210 OE1 GLU A 75 11.464 -7.834 2.569 1.00 0.00 O ATOM 1211 OE2 GLU A 75 13.335 -7.160 3.504 1.00 0.00 O ATOM 0 H GLU A 75 9.608 -4.277 4.164 1.00 0.00 H new ATOM 0 HA GLU A 75 12.407 -4.482 4.142 1.00 0.00 H new ATOM 0 HB2 GLU A 75 10.328 -5.352 2.585 1.00 0.00 H new ATOM 0 HB3 GLU A 75 10.980 -4.088 1.562 1.00 0.00 H new ATOM 0 HG2 GLU A 75 12.163 -5.966 0.856 1.00 0.00 H new ATOM 0 HG3 GLU A 75 13.286 -5.210 1.968 1.00 0.00 H new ATOM 1218 N VAL A 76 11.203 -1.604 3.199 1.00 0.00 N ATOM 1219 CA VAL A 76 11.572 -0.240 2.822 1.00 0.00 C ATOM 1220 C VAL A 76 11.676 0.676 4.041 1.00 0.00 C ATOM 1221 O VAL A 76 11.866 1.886 3.900 1.00 0.00 O ATOM 1222 CB VAL A 76 10.565 0.381 1.829 1.00 0.00 C ATOM 1223 CG1 VAL A 76 11.276 1.320 0.868 1.00 0.00 C ATOM 1224 CG2 VAL A 76 9.805 -0.696 1.067 1.00 0.00 C ATOM 0 H VAL A 76 10.221 -1.727 3.448 1.00 0.00 H new ATOM 0 HA VAL A 76 12.547 -0.320 2.341 1.00 0.00 H new ATOM 0 HB VAL A 76 9.838 0.957 2.402 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.552 1.749 0.175 1.00 0.00 H new ATOM 0 HG12 VAL A 76 11.758 2.120 1.430 1.00 0.00 H new ATOM 0 HG13 VAL A 76 12.029 0.766 0.308 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.104 -0.227 0.376 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.509 -1.311 0.507 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.257 -1.322 1.771 1.00 0.00 H new ATOM 1234 N TYR A 77 11.539 0.106 5.233 1.00 0.00 N ATOM 1235 CA TYR A 77 11.606 0.887 6.461 1.00 0.00 C ATOM 1236 C TYR A 77 12.156 0.053 7.615 1.00 0.00 C ATOM 1237 O TYR A 77 11.506 -0.884 8.079 1.00 0.00 O ATOM 1238 CB TYR A 77 10.218 1.423 6.811 1.00 0.00 C ATOM 1239 CG TYR A 77 10.239 2.776 7.486 1.00 0.00 C ATOM 1240 CD1 TYR A 77 11.146 3.054 8.501 1.00 0.00 C ATOM 1241 CD2 TYR A 77 9.353 3.776 7.105 1.00 0.00 C ATOM 1242 CE1 TYR A 77 11.168 4.290 9.118 1.00 0.00 C ATOM 1243 CE2 TYR A 77 9.369 5.015 7.717 1.00 0.00 C ATOM 1244 CZ TYR A 77 10.279 5.267 8.722 1.00 0.00 C ATOM 1245 OH TYR A 77 10.298 6.501 9.333 1.00 0.00 O ATOM 0 H TYR A 77 11.381 -0.892 5.374 1.00 0.00 H new ATOM 0 HA TYR A 77 12.285 1.724 6.298 1.00 0.00 H new ATOM 0 HB2 TYR A 77 9.625 1.491 5.899 1.00 0.00 H new ATOM 0 HB3 TYR A 77 9.717 0.709 7.465 1.00 0.00 H new ATOM 0 HD1 TYR A 77 11.845 2.292 8.813 1.00 0.00 H new ATOM 0 HD2 TYR A 77 8.640 3.582 6.317 1.00 0.00 H new ATOM 0 HE1 TYR A 77 11.878 4.490 9.907 1.00 0.00 H new ATOM 0 HE2 TYR A 77 8.673 5.781 7.410 1.00 0.00 H new ATOM 0 HH TYR A 77 9.609 7.073 8.936 1.00 0.00 H new ATOM 1255 N PRO A 78 13.368 0.383 8.094 1.00 0.00 N ATOM 1256 CA PRO A 78 14.002 -0.343 9.198 1.00 0.00 C ATOM 1257 C PRO A 78 13.289 -0.124 10.529 1.00 0.00 C ATOM 1258 O PRO A 78 13.010 -1.077 11.258 1.00 0.00 O ATOM 1259 CB PRO A 78 15.412 0.247 9.248 1.00 0.00 C ATOM 1260 CG PRO A 78 15.289 1.599 8.640 1.00 0.00 C ATOM 1261 CD PRO A 78 14.213 1.487 7.598 1.00 0.00 C ATOM 0 HA PRO A 78 13.979 -1.421 9.038 1.00 0.00 H new ATOM 0 HB2 PRO A 78 15.778 0.308 10.273 1.00 0.00 H new ATOM 0 HB3 PRO A 78 16.118 -0.372 8.694 1.00 0.00 H new ATOM 0 HG2 PRO A 78 15.028 2.343 9.392 1.00 0.00 H new ATOM 0 HG3 PRO A 78 16.233 1.914 8.194 1.00 0.00 H new ATOM 0 HD2 PRO A 78 13.648 2.414 7.503 1.00 0.00 H new ATOM 0 HD3 PRO A 78 14.628 1.265 6.615 1.00 0.00 H new ATOM 1269 N GLU A 79 13.002 1.135 10.843 1.00 0.00 N ATOM 1270 CA GLU A 79 12.326 1.480 12.089 1.00 0.00 C ATOM 1271 C GLU A 79 10.956 0.811 12.183 1.00 0.00 C ATOM 1272 O GLU A 79 10.443 0.583 13.279 1.00 0.00 O ATOM 1273 CB GLU A 79 12.172 2.998 12.206 1.00 0.00 C ATOM 1274 CG GLU A 79 13.466 3.760 11.973 1.00 0.00 C ATOM 1275 CD GLU A 79 14.096 4.247 13.262 1.00 0.00 C ATOM 1276 OE1 GLU A 79 13.572 5.216 13.851 1.00 0.00 O ATOM 1277 OE2 GLU A 79 15.114 3.659 13.685 1.00 0.00 O ATOM 0 H GLU A 79 13.227 1.935 10.251 1.00 0.00 H new ATOM 0 HA GLU A 79 12.940 1.115 12.912 1.00 0.00 H new ATOM 0 HB2 GLU A 79 11.426 3.336 11.486 1.00 0.00 H new ATOM 0 HB3 GLU A 79 11.791 3.241 13.198 1.00 0.00 H new ATOM 0 HG2 GLU A 79 14.172 3.117 11.448 1.00 0.00 H new ATOM 0 HG3 GLU A 79 13.269 4.613 11.324 1.00 0.00 H new ATOM 1284 N ALA A 80 10.369 0.503 11.033 1.00 0.00 N ATOM 1285 CA ALA A 80 9.058 -0.133 10.993 1.00 0.00 C ATOM 1286 C ALA A 80 9.120 -1.573 11.498 1.00 0.00 C ATOM 1287 O ALA A 80 8.207 -2.043 12.177 1.00 0.00 O ATOM 1288 CB ALA A 80 8.494 -0.090 9.581 1.00 0.00 C ATOM 0 H ALA A 80 10.779 0.683 10.117 1.00 0.00 H new ATOM 0 HA ALA A 80 8.396 0.423 11.656 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.515 -0.568 9.566 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.396 0.947 9.260 1.00 0.00 H new ATOM 0 HB3 ALA A 80 9.166 -0.618 8.904 1.00 0.00 H new ATOM 1294 N ARG A 81 10.203 -2.268 11.163 1.00 0.00 N ATOM 1295 CA ARG A 81 10.388 -3.659 11.577 1.00 0.00 C ATOM 1296 C ARG A 81 10.280 -3.822 13.094 1.00 0.00 C ATOM 1297 O ARG A 81 10.100 -4.933 13.591 1.00 0.00 O ATOM 1298 CB ARG A 81 11.746 -4.176 11.092 1.00 0.00 C ATOM 1299 CG ARG A 81 11.645 -5.130 9.911 1.00 0.00 C ATOM 1300 CD ARG A 81 12.999 -5.723 9.557 1.00 0.00 C ATOM 1301 NE ARG A 81 12.918 -7.158 9.295 1.00 0.00 N ATOM 1302 CZ ARG A 81 12.522 -7.679 8.135 1.00 0.00 C ATOM 1303 NH1 ARG A 81 12.170 -6.889 7.129 1.00 0.00 N ATOM 1304 NH2 ARG A 81 12.480 -8.995 7.981 1.00 0.00 N ATOM 0 H ARG A 81 10.969 -1.891 10.605 1.00 0.00 H new ATOM 0 HA ARG A 81 9.590 -4.246 11.123 1.00 0.00 H new ATOM 0 HB2 ARG A 81 12.370 -3.327 10.811 1.00 0.00 H new ATOM 0 HB3 ARG A 81 12.249 -4.682 11.916 1.00 0.00 H new ATOM 0 HG2 ARG A 81 10.946 -5.932 10.149 1.00 0.00 H new ATOM 0 HG3 ARG A 81 11.241 -4.601 9.048 1.00 0.00 H new ATOM 0 HD2 ARG A 81 13.398 -5.216 8.678 1.00 0.00 H new ATOM 0 HD3 ARG A 81 13.698 -5.543 10.374 1.00 0.00 H new ATOM 0 HE ARG A 81 13.180 -7.798 10.044 1.00 0.00 H new ATOM 0 HH11 ARG A 81 12.202 -5.876 7.241 1.00 0.00 H new ATOM 0 HH12 ARG A 81 11.868 -7.295 6.243 1.00 0.00 H new ATOM 0 HH21 ARG A 81 12.751 -9.607 8.750 1.00 0.00 H new ATOM 0 HH22 ARG A 81 12.177 -9.395 7.093 1.00 0.00 H new ATOM 1318 N LYS A 82 10.394 -2.719 13.828 1.00 0.00 N ATOM 1319 CA LYS A 82 10.309 -2.764 15.284 1.00 0.00 C ATOM 1320 C LYS A 82 8.960 -3.316 15.734 1.00 0.00 C ATOM 1321 O LYS A 82 7.916 -2.943 15.200 1.00 0.00 O ATOM 1322 CB LYS A 82 10.527 -1.368 15.871 1.00 0.00 C ATOM 1323 CG LYS A 82 11.991 -0.969 15.955 1.00 0.00 C ATOM 1324 CD LYS A 82 12.152 0.520 16.218 1.00 0.00 C ATOM 1325 CE LYS A 82 13.085 0.785 17.390 1.00 0.00 C ATOM 1326 NZ LYS A 82 12.862 2.129 17.990 1.00 0.00 N ATOM 0 H LYS A 82 10.545 -1.787 13.441 1.00 0.00 H new ATOM 0 HA LYS A 82 11.091 -3.429 15.649 1.00 0.00 H new ATOM 0 HB2 LYS A 82 9.994 -0.639 15.261 1.00 0.00 H new ATOM 0 HB3 LYS A 82 10.090 -1.329 16.869 1.00 0.00 H new ATOM 0 HG2 LYS A 82 12.477 -1.534 16.750 1.00 0.00 H new ATOM 0 HG3 LYS A 82 12.494 -1.231 15.024 1.00 0.00 H new ATOM 0 HD2 LYS A 82 12.542 1.008 15.325 1.00 0.00 H new ATOM 0 HD3 LYS A 82 11.176 0.961 16.422 1.00 0.00 H new ATOM 0 HE2 LYS A 82 12.936 0.019 18.151 1.00 0.00 H new ATOM 0 HE3 LYS A 82 14.119 0.705 17.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 13.518 2.268 18.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 13.029 2.862 17.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 11.883 2.198 18.334 1.00 0.00 H new ATOM 1340 N LYS A 83 8.990 -4.206 16.719 1.00 0.00 N ATOM 1341 CA LYS A 83 7.770 -4.812 17.241 1.00 0.00 C ATOM 1342 C LYS A 83 6.931 -3.788 17.997 1.00 0.00 C ATOM 1343 O LYS A 83 7.465 -2.946 18.719 1.00 0.00 O ATOM 1344 CB LYS A 83 8.110 -5.987 18.158 1.00 0.00 C ATOM 1345 CG LYS A 83 9.062 -5.623 19.288 1.00 0.00 C ATOM 1346 CD LYS A 83 8.516 -6.047 20.642 1.00 0.00 C ATOM 1347 CE LYS A 83 9.584 -6.720 21.489 1.00 0.00 C ATOM 1348 NZ LYS A 83 10.411 -5.729 22.231 1.00 0.00 N ATOM 0 H LYS A 83 9.846 -4.524 17.173 1.00 0.00 H new ATOM 0 HA LYS A 83 7.187 -5.177 16.395 1.00 0.00 H new ATOM 0 HB2 LYS A 83 7.188 -6.383 18.584 1.00 0.00 H new ATOM 0 HB3 LYS A 83 8.554 -6.785 17.563 1.00 0.00 H new ATOM 0 HG2 LYS A 83 10.027 -6.101 19.119 1.00 0.00 H new ATOM 0 HG3 LYS A 83 9.235 -4.547 19.286 1.00 0.00 H new ATOM 0 HD2 LYS A 83 8.129 -5.175 21.169 1.00 0.00 H new ATOM 0 HD3 LYS A 83 7.679 -6.731 20.500 1.00 0.00 H new ATOM 0 HE2 LYS A 83 9.110 -7.400 22.197 1.00 0.00 H new ATOM 0 HE3 LYS A 83 10.228 -7.323 20.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 11.127 -6.228 22.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 10.883 -5.096 21.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 9.801 -5.170 22.861 1.00 0.00 H new ATOM 1362 N GLY A 84 5.616 -3.865 17.826 1.00 0.00 N ATOM 1363 CA GLY A 84 4.724 -2.940 18.498 1.00 0.00 C ATOM 1364 C GLY A 84 4.513 -1.654 17.720 1.00 0.00 C ATOM 1365 O GLY A 84 3.924 -0.703 18.234 1.00 0.00 O ATOM 0 H GLY A 84 5.152 -4.553 17.233 1.00 0.00 H new ATOM 0 HA2 GLY A 84 3.761 -3.424 18.659 1.00 0.00 H new ATOM 0 HA3 GLY A 84 5.129 -2.702 19.481 1.00 0.00 H new ATOM 1369 N THR A 85 4.995 -1.620 16.479 1.00 0.00 N ATOM 1370 CA THR A 85 4.852 -0.436 15.642 1.00 0.00 C ATOM 1371 C THR A 85 3.473 -0.388 14.987 1.00 0.00 C ATOM 1372 O THR A 85 3.119 -1.261 14.196 1.00 0.00 O ATOM 1373 CB THR A 85 5.940 -0.418 14.566 1.00 0.00 C ATOM 1374 OG1 THR A 85 7.222 -0.568 15.148 1.00 0.00 O ATOM 1375 CG2 THR A 85 5.952 0.856 13.752 1.00 0.00 C ATOM 0 H THR A 85 5.485 -2.396 16.035 1.00 0.00 H new ATOM 0 HA THR A 85 4.959 0.442 16.278 1.00 0.00 H new ATOM 0 HB THR A 85 5.707 -1.252 13.904 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.611 -1.422 14.866 1.00 0.00 H new ATOM 0 HG21 THR A 85 6.746 0.804 13.007 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.992 0.976 13.251 1.00 0.00 H new ATOM 0 HG23 THR A 85 6.127 1.707 14.410 1.00 0.00 H new ATOM 1383 N HIS A 86 2.703 0.640 15.326 1.00 0.00 N ATOM 1384 CA HIS A 86 1.362 0.811 14.776 1.00 0.00 C ATOM 1385 C HIS A 86 1.382 1.761 13.584 1.00 0.00 C ATOM 1386 O HIS A 86 1.614 2.960 13.740 1.00 0.00 O ATOM 1387 CB HIS A 86 0.415 1.348 15.850 1.00 0.00 C ATOM 1388 CG HIS A 86 -1.032 1.191 15.503 1.00 0.00 C ATOM 1389 ND1 HIS A 86 -1.844 2.250 15.153 1.00 0.00 N ATOM 1390 CD2 HIS A 86 -1.815 0.087 15.452 1.00 0.00 C ATOM 1391 CE1 HIS A 86 -3.063 1.803 14.904 1.00 0.00 C ATOM 1392 NE2 HIS A 86 -3.070 0.496 15.078 1.00 0.00 N ATOM 0 H HIS A 86 2.985 1.370 15.981 1.00 0.00 H new ATOM 0 HA HIS A 86 1.007 -0.163 14.438 1.00 0.00 H new ATOM 0 HB2 HIS A 86 0.613 0.831 16.789 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.628 2.404 16.016 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -1.509 -0.926 15.666 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -3.909 2.406 14.608 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -3.879 -0.113 14.954 1.00 0.00 H new ATOM 1400 N PHE A 87 1.139 1.224 12.392 1.00 0.00 N ATOM 1401 CA PHE A 87 1.135 2.037 11.178 1.00 0.00 C ATOM 1402 C PHE A 87 -0.242 2.037 10.519 1.00 0.00 C ATOM 1403 O PHE A 87 -0.881 0.992 10.390 1.00 0.00 O ATOM 1404 CB PHE A 87 2.193 1.540 10.185 1.00 0.00 C ATOM 1405 CG PHE A 87 2.730 0.173 10.498 1.00 0.00 C ATOM 1406 CD1 PHE A 87 1.917 -0.941 10.388 1.00 0.00 C ATOM 1407 CD2 PHE A 87 4.044 0.003 10.899 1.00 0.00 C ATOM 1408 CE1 PHE A 87 2.403 -2.201 10.675 1.00 0.00 C ATOM 1409 CE2 PHE A 87 4.536 -1.254 11.189 1.00 0.00 C ATOM 1410 CZ PHE A 87 3.714 -2.359 11.075 1.00 0.00 C ATOM 0 H PHE A 87 0.943 0.235 12.240 1.00 0.00 H new ATOM 0 HA PHE A 87 1.378 3.060 11.466 1.00 0.00 H new ATOM 0 HB2 PHE A 87 1.761 1.529 9.184 1.00 0.00 H new ATOM 0 HB3 PHE A 87 3.021 2.249 10.167 1.00 0.00 H new ATOM 0 HD1 PHE A 87 0.890 -0.824 10.074 1.00 0.00 H new ATOM 0 HD2 PHE A 87 4.691 0.863 10.986 1.00 0.00 H new ATOM 0 HE1 PHE A 87 1.757 -3.062 10.586 1.00 0.00 H new ATOM 0 HE2 PHE A 87 5.562 -1.374 11.505 1.00 0.00 H new ATOM 0 HZ PHE A 87 4.097 -3.344 11.298 1.00 0.00 H new ATOM 1420 N ASN A 88 -0.693 3.219 10.106 1.00 0.00 N ATOM 1421 CA ASN A 88 -1.996 3.365 9.463 1.00 0.00 C ATOM 1422 C ASN A 88 -1.852 3.698 7.981 1.00 0.00 C ATOM 1423 O ASN A 88 -1.060 4.560 7.603 1.00 0.00 O ATOM 1424 CB ASN A 88 -2.809 4.460 10.157 1.00 0.00 C ATOM 1425 CG ASN A 88 -3.061 4.160 11.621 1.00 0.00 C ATOM 1426 OD1 ASN A 88 -2.143 3.822 12.367 1.00 0.00 O ATOM 1427 ND2 ASN A 88 -4.316 4.283 12.041 1.00 0.00 N ATOM 0 H ASN A 88 -0.174 4.091 10.206 1.00 0.00 H new ATOM 0 HA ASN A 88 -2.517 2.412 9.552 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -2.281 5.410 10.070 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -3.764 4.578 9.645 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.548 4.094 13.016 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -5.047 4.566 11.388 1.00 0.00 H new ATOM 1434 N PHE A 89 -2.636 3.017 7.149 1.00 0.00 N ATOM 1435 CA PHE A 89 -2.607 3.249 5.710 1.00 0.00 C ATOM 1436 C PHE A 89 -3.738 4.177 5.288 1.00 0.00 C ATOM 1437 O PHE A 89 -4.891 3.998 5.694 1.00 0.00 O ATOM 1438 CB PHE A 89 -2.717 1.929 4.943 1.00 0.00 C ATOM 1439 CG PHE A 89 -1.799 0.857 5.451 1.00 0.00 C ATOM 1440 CD1 PHE A 89 -2.122 0.141 6.589 1.00 0.00 C ATOM 1441 CD2 PHE A 89 -0.619 0.563 4.790 1.00 0.00 C ATOM 1442 CE1 PHE A 89 -1.290 -0.847 7.063 1.00 0.00 C ATOM 1443 CE2 PHE A 89 0.223 -0.428 5.259 1.00 0.00 C ATOM 1444 CZ PHE A 89 -0.113 -1.135 6.398 1.00 0.00 C ATOM 0 H PHE A 89 -3.298 2.301 7.448 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.653 3.720 5.471 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -3.745 1.571 4.999 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.500 2.112 3.890 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.040 0.360 7.113 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.354 1.113 3.899 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.556 -1.397 7.954 1.00 0.00 H new ATOM 0 HE2 PHE A 89 1.142 -0.649 4.736 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.542 -1.910 6.767 1.00 0.00 H new ATOM 1454 N ALA A 90 -3.401 5.160 4.459 1.00 0.00 N ATOM 1455 CA ALA A 90 -4.374 6.119 3.962 1.00 0.00 C ATOM 1456 C ALA A 90 -3.997 6.594 2.566 1.00 0.00 C ATOM 1457 O ALA A 90 -2.978 6.185 2.016 1.00 0.00 O ATOM 1458 CB ALA A 90 -4.481 7.301 4.915 1.00 0.00 C ATOM 0 H ALA A 90 -2.452 5.311 4.116 1.00 0.00 H new ATOM 0 HA ALA A 90 -5.345 5.627 3.904 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.213 8.012 4.532 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -4.797 6.949 5.897 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -3.510 7.789 4.999 1.00 0.00 H new ATOM 1464 N ILE A 91 -4.821 7.464 1.997 1.00 0.00 N ATOM 1465 CA ILE A 91 -4.566 7.997 0.665 1.00 0.00 C ATOM 1466 C ILE A 91 -4.474 9.516 0.704 1.00 0.00 C ATOM 1467 O ILE A 91 -5.478 10.202 0.896 1.00 0.00 O ATOM 1468 CB ILE A 91 -5.666 7.583 -0.329 1.00 0.00 C ATOM 1469 CG1 ILE A 91 -5.886 6.069 -0.283 1.00 0.00 C ATOM 1470 CG2 ILE A 91 -5.307 8.030 -1.740 1.00 0.00 C ATOM 1471 CD1 ILE A 91 -7.346 5.670 -0.304 1.00 0.00 C ATOM 0 H ILE A 91 -5.672 7.816 2.437 1.00 0.00 H new ATOM 0 HA ILE A 91 -3.616 7.581 0.328 1.00 0.00 H new ATOM 0 HB ILE A 91 -6.595 8.075 -0.040 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -5.380 5.610 -1.133 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -5.421 5.670 0.618 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.096 7.729 -2.429 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -5.201 9.115 -1.762 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -4.367 7.567 -2.040 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -7.427 4.584 -0.269 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -7.853 6.099 0.560 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -7.811 6.039 -1.218 1.00 0.00 H new ATOM 1483 N VAL A 92 -3.260 10.036 0.534 1.00 0.00 N ATOM 1484 CA VAL A 92 -3.036 11.478 0.562 1.00 0.00 C ATOM 1485 C VAL A 92 -2.134 11.930 -0.584 1.00 0.00 C ATOM 1486 O VAL A 92 -1.412 11.130 -1.175 1.00 0.00 O ATOM 1487 CB VAL A 92 -2.406 11.916 1.899 1.00 0.00 C ATOM 1488 CG1 VAL A 92 -0.973 11.419 2.005 1.00 0.00 C ATOM 1489 CG2 VAL A 92 -2.464 13.429 2.051 1.00 0.00 C ATOM 0 H VAL A 92 -2.419 9.481 0.376 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.013 11.949 0.449 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.982 11.471 2.710 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.546 11.739 2.956 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -0.960 10.330 1.949 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.383 11.831 1.186 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.014 13.717 3.001 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.916 13.898 1.234 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -3.503 13.757 2.027 1.00 0.00 H new ATOM 1673 N VAL A 103 -8.066 13.430 1.748 1.00 0.00 N ATOM 1674 CA VAL A 103 -7.283 12.292 2.214 1.00 0.00 C ATOM 1675 C VAL A 103 -8.094 11.453 3.198 1.00 0.00 C ATOM 1676 O VAL A 103 -8.861 11.990 3.998 1.00 0.00 O ATOM 1677 CB VAL A 103 -5.965 12.760 2.879 1.00 0.00 C ATOM 1678 CG1 VAL A 103 -6.223 13.930 3.815 1.00 0.00 C ATOM 1679 CG2 VAL A 103 -5.274 11.618 3.618 1.00 0.00 C ATOM 0 HA VAL A 103 -7.033 11.680 1.348 1.00 0.00 H new ATOM 0 HB VAL A 103 -5.294 13.092 2.087 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.285 14.244 4.272 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.648 14.760 3.251 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -6.922 13.626 4.594 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.353 11.983 4.072 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.935 11.235 4.396 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -5.040 10.819 2.915 1.00 0.00 H new ATOM 1689 N LYS A 104 -7.934 10.135 3.126 1.00 0.00 N ATOM 1690 CA LYS A 104 -8.669 9.234 4.010 1.00 0.00 C ATOM 1691 C LYS A 104 -7.889 7.949 4.274 1.00 0.00 C ATOM 1692 O LYS A 104 -7.141 7.477 3.417 1.00 0.00 O ATOM 1693 CB LYS A 104 -10.030 8.897 3.399 1.00 0.00 C ATOM 1694 CG LYS A 104 -11.137 8.726 4.426 1.00 0.00 C ATOM 1695 CD LYS A 104 -11.359 7.260 4.765 1.00 0.00 C ATOM 1696 CE LYS A 104 -12.262 6.580 3.745 1.00 0.00 C ATOM 1697 NZ LYS A 104 -11.686 5.293 3.266 1.00 0.00 N ATOM 0 H LYS A 104 -7.307 9.669 2.470 1.00 0.00 H new ATOM 0 HA LYS A 104 -8.811 9.744 4.963 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.311 9.687 2.703 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -9.940 7.979 2.819 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -10.883 9.276 5.332 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -12.062 9.156 4.041 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -10.399 6.745 4.802 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -11.803 7.178 5.757 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -13.240 6.397 4.190 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -12.418 7.246 2.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -12.330 4.861 2.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -10.764 5.471 2.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -11.561 4.647 4.072 1.00 0.00 H new ATOM 1711 N GLU A 105 -8.073 7.385 5.467 1.00 0.00 N ATOM 1712 CA GLU A 105 -7.391 6.151 5.845 1.00 0.00 C ATOM 1713 C GLU A 105 -8.301 4.944 5.625 1.00 0.00 C ATOM 1714 O GLU A 105 -9.515 5.023 5.810 1.00 0.00 O ATOM 1715 CB GLU A 105 -6.920 6.229 7.305 1.00 0.00 C ATOM 1716 CG GLU A 105 -6.515 4.891 7.914 1.00 0.00 C ATOM 1717 CD GLU A 105 -6.737 4.845 9.413 1.00 0.00 C ATOM 1718 OE1 GLU A 105 -6.130 5.668 10.128 1.00 0.00 O ATOM 1719 OE2 GLU A 105 -7.520 3.985 9.870 1.00 0.00 O ATOM 0 H GLU A 105 -8.688 7.764 6.187 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.514 6.028 5.210 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.072 6.911 7.363 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.719 6.661 7.908 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.086 4.092 7.441 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -5.463 4.701 7.700 1.00 0.00 H new ATOM 1726 N ILE A 106 -7.698 3.833 5.218 1.00 0.00 N ATOM 1727 CA ILE A 106 -8.443 2.606 4.954 1.00 0.00 C ATOM 1728 C ILE A 106 -8.302 1.605 6.098 1.00 0.00 C ATOM 1729 O ILE A 106 -9.188 0.782 6.327 1.00 0.00 O ATOM 1730 CB ILE A 106 -7.977 1.941 3.644 1.00 0.00 C ATOM 1731 CG1 ILE A 106 -6.449 1.993 3.527 1.00 0.00 C ATOM 1732 CG2 ILE A 106 -8.628 2.621 2.448 1.00 0.00 C ATOM 1733 CD1 ILE A 106 -5.876 0.981 2.560 1.00 0.00 C ATOM 0 H ILE A 106 -6.693 3.756 5.063 1.00 0.00 H new ATOM 0 HA ILE A 106 -9.491 2.891 4.861 1.00 0.00 H new ATOM 0 HB ILE A 106 -8.283 0.895 3.658 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -6.152 2.993 3.210 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.013 1.828 4.512 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -8.291 2.142 1.529 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -9.712 2.534 2.526 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -8.349 3.674 2.432 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -4.791 1.079 2.531 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -6.141 -0.025 2.886 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -6.283 1.158 1.564 1.00 0.00 H new ATOM 1745 N GLY A 107 -7.182 1.677 6.812 1.00 0.00 N ATOM 1746 CA GLY A 107 -6.949 0.764 7.920 1.00 0.00 C ATOM 1747 C GLY A 107 -5.503 0.779 8.368 1.00 0.00 C ATOM 1748 O GLY A 107 -4.639 1.252 7.637 1.00 0.00 O ATOM 0 H GLY A 107 -6.433 2.349 6.645 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.591 1.037 8.757 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.226 -0.247 7.622 1.00 0.00 H new ATOM 1752 N SER A 108 -5.234 0.279 9.574 1.00 0.00 N ATOM 1753 CA SER A 108 -3.877 0.267 10.106 1.00 0.00 C ATOM 1754 C SER A 108 -3.459 -1.125 10.575 1.00 0.00 C ATOM 1755 O SER A 108 -4.248 -1.852 11.179 1.00 0.00 O ATOM 1756 CB SER A 108 -3.775 1.255 11.269 1.00 0.00 C ATOM 1757 OG SER A 108 -4.295 0.693 12.462 1.00 0.00 O ATOM 0 H SER A 108 -5.936 -0.121 10.196 1.00 0.00 H new ATOM 0 HA SER A 108 -3.202 0.561 9.303 1.00 0.00 H new ATOM 0 HB2 SER A 108 -2.733 1.537 11.420 1.00 0.00 H new ATOM 0 HB3 SER A 108 -4.320 2.167 11.025 1.00 0.00 H new ATOM 0 HG SER A 108 -4.928 1.320 12.870 1.00 0.00 H new ATOM 1763 N THR A 109 -2.203 -1.479 10.309 1.00 0.00 N ATOM 1764 CA THR A 109 -1.661 -2.772 10.715 1.00 0.00 C ATOM 1765 C THR A 109 -0.619 -2.586 11.813 1.00 0.00 C ATOM 1766 O THR A 109 -0.498 -1.503 12.384 1.00 0.00 O ATOM 1767 CB THR A 109 -1.047 -3.512 9.523 1.00 0.00 C ATOM 1768 OG1 THR A 109 0.072 -2.812 9.011 1.00 0.00 O ATOM 1769 CG2 THR A 109 -2.020 -3.725 8.386 1.00 0.00 C ATOM 0 H THR A 109 -1.540 -0.885 9.812 1.00 0.00 H new ATOM 0 HA THR A 109 -2.482 -3.376 11.102 1.00 0.00 H new ATOM 0 HB THR A 109 -0.751 -4.486 9.913 1.00 0.00 H new ATOM 0 HG1 THR A 109 0.611 -2.469 9.754 1.00 0.00 H new ATOM 0 HG21 THR A 109 -1.521 -4.254 7.574 1.00 0.00 H new ATOM 0 HG22 THR A 109 -2.867 -4.315 8.737 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.375 -2.760 8.025 1.00 0.00 H new ATOM 1777 N MET A 110 0.126 -3.645 12.112 1.00 0.00 N ATOM 1778 CA MET A 110 1.146 -3.580 13.153 1.00 0.00 C ATOM 1779 C MET A 110 2.366 -4.416 12.783 1.00 0.00 C ATOM 1780 O MET A 110 2.329 -5.207 11.840 1.00 0.00 O ATOM 1781 CB MET A 110 0.571 -4.060 14.484 1.00 0.00 C ATOM 1782 CG MET A 110 -0.440 -3.099 15.091 1.00 0.00 C ATOM 1783 SD MET A 110 -0.158 -2.801 16.847 1.00 0.00 S ATOM 1784 CE MET A 110 1.590 -2.418 16.841 1.00 0.00 C ATOM 0 H MET A 110 0.044 -4.552 11.653 1.00 0.00 H new ATOM 0 HA MET A 110 1.461 -2.541 13.250 1.00 0.00 H new ATOM 0 HB2 MET A 110 0.095 -5.030 14.337 1.00 0.00 H new ATOM 0 HB3 MET A 110 1.387 -4.210 15.190 1.00 0.00 H new ATOM 0 HG2 MET A 110 -0.399 -2.150 14.555 1.00 0.00 H new ATOM 0 HG3 MET A 110 -1.444 -3.500 14.952 1.00 0.00 H new ATOM 0 HE1 MET A 110 2.124 -3.147 17.451 1.00 0.00 H new ATOM 0 HE2 MET A 110 1.967 -2.454 15.819 1.00 0.00 H new ATOM 0 HE3 MET A 110 1.745 -1.420 17.250 1.00 0.00 H new ATOM 1794 N SER A 111 3.448 -4.234 13.533 1.00 0.00 N ATOM 1795 CA SER A 111 4.684 -4.967 13.287 1.00 0.00 C ATOM 1796 C SER A 111 4.607 -6.382 13.852 1.00 0.00 C ATOM 1797 O SER A 111 5.280 -6.709 14.829 1.00 0.00 O ATOM 1798 CB SER A 111 5.871 -4.224 13.905 1.00 0.00 C ATOM 1799 OG SER A 111 7.101 -4.795 13.491 1.00 0.00 O ATOM 0 H SER A 111 3.493 -3.584 14.318 1.00 0.00 H new ATOM 0 HA SER A 111 4.824 -5.036 12.208 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.838 -3.174 13.615 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.799 -4.257 14.992 1.00 0.00 H new ATOM 0 HG SER A 111 7.835 -4.183 13.707 1.00 0.00 H new ATOM 1805 N GLY A 112 3.787 -7.219 13.227 1.00 0.00 N ATOM 1806 CA GLY A 112 3.646 -8.590 13.679 1.00 0.00 C ATOM 1807 C GLY A 112 2.366 -8.833 14.457 1.00 0.00 C ATOM 1808 O GLY A 112 2.246 -9.837 15.158 1.00 0.00 O ATOM 0 H GLY A 112 3.218 -6.973 12.417 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.671 -9.255 12.816 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.499 -8.849 14.306 1.00 0.00 H new ATOM 1812 N ARG A 113 1.403 -7.923 14.330 1.00 0.00 N ATOM 1813 CA ARG A 113 0.131 -8.067 15.028 1.00 0.00 C ATOM 1814 C ARG A 113 -1.018 -8.204 14.035 1.00 0.00 C ATOM 1815 O ARG A 113 -1.164 -7.391 13.123 1.00 0.00 O ATOM 1816 CB ARG A 113 -0.115 -6.883 15.964 1.00 0.00 C ATOM 1817 CG ARG A 113 -0.590 -7.301 17.347 1.00 0.00 C ATOM 1818 CD ARG A 113 -0.743 -6.108 18.277 1.00 0.00 C ATOM 1819 NE ARG A 113 -2.100 -5.996 18.805 1.00 0.00 N ATOM 1820 CZ ARG A 113 -3.112 -5.436 18.146 1.00 0.00 C ATOM 1821 NH1 ARG A 113 -2.926 -4.933 16.932 1.00 0.00 N ATOM 1822 NH2 ARG A 113 -4.314 -5.377 18.702 1.00 0.00 N ATOM 0 H ARG A 113 1.479 -7.084 13.754 1.00 0.00 H new ATOM 0 HA ARG A 113 0.180 -8.975 15.629 1.00 0.00 H new ATOM 0 HB2 ARG A 113 0.806 -6.308 16.062 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -0.857 -6.222 15.516 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -1.545 -7.820 17.262 1.00 0.00 H new ATOM 0 HG3 ARG A 113 0.120 -8.008 17.777 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -0.039 -6.200 19.104 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -0.486 -5.195 17.740 1.00 0.00 H new ATOM 0 HE ARG A 113 -2.284 -6.370 19.736 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -2.004 -4.974 16.499 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -3.706 -4.505 16.432 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -4.464 -5.761 19.635 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -5.089 -4.948 18.197 1.00 0.00 H new ATOM 1836 N LYS A 114 -1.827 -9.242 14.216 1.00 0.00 N ATOM 1837 CA LYS A 114 -2.958 -9.495 13.332 1.00 0.00 C ATOM 1838 C LYS A 114 -4.181 -8.683 13.749 1.00 0.00 C ATOM 1839 O LYS A 114 -4.908 -9.064 14.666 1.00 0.00 O ATOM 1840 CB LYS A 114 -3.302 -10.986 13.329 1.00 0.00 C ATOM 1841 CG LYS A 114 -4.086 -11.427 12.103 1.00 0.00 C ATOM 1842 CD LYS A 114 -5.568 -11.568 12.410 1.00 0.00 C ATOM 1843 CE LYS A 114 -6.352 -12.000 11.182 1.00 0.00 C ATOM 1844 NZ LYS A 114 -7.781 -11.590 11.263 1.00 0.00 N ATOM 0 H LYS A 114 -1.720 -9.923 14.968 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.671 -9.187 12.326 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.379 -11.563 13.387 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.880 -11.219 14.223 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.947 -10.702 11.301 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.696 -12.379 11.743 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.708 -12.298 13.208 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -5.957 -10.618 12.776 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -5.899 -11.565 10.291 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -6.291 -13.083 11.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -8.281 -11.903 10.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -8.220 -12.025 12.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -7.841 -10.555 11.340 1.00 0.00 H new ATOM 1858 N GLY A 115 -4.409 -7.569 13.059 1.00 0.00 N ATOM 1859 CA GLY A 115 -5.552 -6.730 13.363 1.00 0.00 C ATOM 1860 C GLY A 115 -6.777 -7.130 12.564 1.00 0.00 C ATOM 1861 O GLY A 115 -6.821 -8.221 11.995 1.00 0.00 O ATOM 0 H GLY A 115 -3.822 -7.233 12.295 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -5.776 -6.794 14.428 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -5.305 -5.690 13.152 1.00 0.00 H new ATOM 1865 N THR A 116 -7.770 -6.251 12.513 1.00 0.00 N ATOM 1866 CA THR A 116 -8.993 -6.530 11.768 1.00 0.00 C ATOM 1867 C THR A 116 -8.836 -6.137 10.303 1.00 0.00 C ATOM 1868 O THR A 116 -9.428 -6.754 9.417 1.00 0.00 O ATOM 1869 CB THR A 116 -10.180 -5.787 12.384 1.00 0.00 C ATOM 1870 OG1 THR A 116 -9.873 -4.415 12.569 1.00 0.00 O ATOM 1871 CG2 THR A 116 -10.610 -6.351 13.721 1.00 0.00 C ATOM 0 H THR A 116 -7.754 -5.342 12.976 1.00 0.00 H new ATOM 0 HA THR A 116 -9.183 -7.602 11.822 1.00 0.00 H new ATOM 0 HB THR A 116 -11.000 -5.913 11.677 1.00 0.00 H new ATOM 0 HG1 THR A 116 -10.645 -3.957 12.962 1.00 0.00 H new ATOM 0 HG21 THR A 116 -11.456 -5.779 14.102 1.00 0.00 H new ATOM 0 HG22 THR A 116 -10.903 -7.394 13.599 1.00 0.00 H new ATOM 0 HG23 THR A 116 -9.781 -6.287 14.426 1.00 0.00 H new ATOM 1879 N ASP A 117 -8.033 -5.109 10.055 1.00 0.00 N ATOM 1880 CA ASP A 117 -7.794 -4.631 8.697 1.00 0.00 C ATOM 1881 C ASP A 117 -6.707 -5.458 8.015 1.00 0.00 C ATOM 1882 O ASP A 117 -6.695 -5.598 6.792 1.00 0.00 O ATOM 1883 CB ASP A 117 -7.398 -3.153 8.713 1.00 0.00 C ATOM 1884 CG ASP A 117 -8.234 -2.338 9.681 1.00 0.00 C ATOM 1885 OD1 ASP A 117 -9.311 -1.854 9.272 1.00 0.00 O ATOM 1886 OD2 ASP A 117 -7.813 -2.182 10.846 1.00 0.00 O ATOM 0 H ASP A 117 -7.535 -4.589 10.778 1.00 0.00 H new ATOM 0 HA ASP A 117 -8.719 -4.742 8.131 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.346 -3.065 8.984 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -7.505 -2.741 7.710 1.00 0.00 H new ATOM 1891 N ASP A 118 -5.796 -6.006 8.815 1.00 0.00 N ATOM 1892 CA ASP A 118 -4.700 -6.822 8.298 1.00 0.00 C ATOM 1893 C ASP A 118 -5.209 -7.883 7.324 1.00 0.00 C ATOM 1894 O ASP A 118 -4.614 -8.111 6.271 1.00 0.00 O ATOM 1895 CB ASP A 118 -3.956 -7.495 9.452 1.00 0.00 C ATOM 1896 CG ASP A 118 -2.483 -7.695 9.155 1.00 0.00 C ATOM 1897 OD1 ASP A 118 -1.893 -6.831 8.474 1.00 0.00 O ATOM 1898 OD2 ASP A 118 -1.920 -8.716 9.604 1.00 0.00 O ATOM 0 H ASP A 118 -5.795 -5.899 9.829 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.018 -6.164 7.760 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.063 -6.889 10.352 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -4.415 -8.461 9.662 1.00 0.00 H new ATOM 1903 N SER A 119 -6.314 -8.532 7.683 1.00 0.00 N ATOM 1904 CA SER A 119 -6.901 -9.572 6.843 1.00 0.00 C ATOM 1905 C SER A 119 -7.589 -8.974 5.613 1.00 0.00 C ATOM 1906 O SER A 119 -8.019 -9.704 4.720 1.00 0.00 O ATOM 1907 CB SER A 119 -7.902 -10.401 7.649 1.00 0.00 C ATOM 1908 OG SER A 119 -7.740 -11.785 7.393 1.00 0.00 O ATOM 0 H SER A 119 -6.821 -8.356 8.550 1.00 0.00 H new ATOM 0 HA SER A 119 -6.093 -10.218 6.499 1.00 0.00 H new ATOM 0 HB2 SER A 119 -7.767 -10.206 8.713 1.00 0.00 H new ATOM 0 HB3 SER A 119 -8.918 -10.097 7.396 1.00 0.00 H new ATOM 0 HG SER A 119 -8.390 -12.294 7.921 1.00 0.00 H new ATOM 1914 N MET A 120 -7.688 -7.649 5.570 1.00 0.00 N ATOM 1915 CA MET A 120 -8.317 -6.966 4.448 1.00 0.00 C ATOM 1916 C MET A 120 -7.365 -6.897 3.261 1.00 0.00 C ATOM 1917 O MET A 120 -6.151 -6.983 3.427 1.00 0.00 O ATOM 1918 CB MET A 120 -8.737 -5.552 4.859 1.00 0.00 C ATOM 1919 CG MET A 120 -10.041 -5.095 4.227 1.00 0.00 C ATOM 1920 SD MET A 120 -10.803 -3.728 5.123 1.00 0.00 S ATOM 1921 CE MET A 120 -9.415 -2.605 5.275 1.00 0.00 C ATOM 0 H MET A 120 -7.340 -7.028 6.300 1.00 0.00 H new ATOM 0 HA MET A 120 -9.202 -7.531 4.155 1.00 0.00 H new ATOM 0 HB2 MET A 120 -8.836 -5.513 5.944 1.00 0.00 H new ATOM 0 HB3 MET A 120 -7.946 -4.853 4.585 1.00 0.00 H new ATOM 0 HG2 MET A 120 -9.854 -4.791 3.197 1.00 0.00 H new ATOM 0 HG3 MET A 120 -10.736 -5.933 4.191 1.00 0.00 H new ATOM 0 HE1 MET A 120 -9.117 -2.535 6.321 1.00 0.00 H new ATOM 0 HE2 MET A 120 -8.579 -2.978 4.683 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.704 -1.618 4.913 1.00 0.00 H new ATOM 1931 N THR A 121 -7.922 -6.739 2.065 1.00 0.00 N ATOM 1932 CA THR A 121 -7.113 -6.656 0.853 1.00 0.00 C ATOM 1933 C THR A 121 -7.042 -5.221 0.349 1.00 0.00 C ATOM 1934 O THR A 121 -7.953 -4.427 0.586 1.00 0.00 O ATOM 1935 CB THR A 121 -7.688 -7.567 -0.233 1.00 0.00 C ATOM 1936 OG1 THR A 121 -9.103 -7.490 -0.255 1.00 0.00 O ATOM 1937 CG2 THR A 121 -7.310 -9.022 -0.054 1.00 0.00 C ATOM 0 H THR A 121 -8.927 -6.666 1.908 1.00 0.00 H new ATOM 0 HA THR A 121 -6.103 -6.988 1.094 1.00 0.00 H new ATOM 0 HB THR A 121 -7.259 -7.209 -1.169 1.00 0.00 H new ATOM 0 HG1 THR A 121 -9.472 -8.345 -0.561 1.00 0.00 H new ATOM 0 HG21 THR A 121 -7.750 -9.614 -0.857 1.00 0.00 H new ATOM 0 HG22 THR A 121 -6.225 -9.122 -0.082 1.00 0.00 H new ATOM 0 HG23 THR A 121 -7.683 -9.379 0.906 1.00 0.00 H new ATOM 1945 N LEU A 122 -5.959 -4.888 -0.346 1.00 0.00 N ATOM 1946 CA LEU A 122 -5.786 -3.542 -0.876 1.00 0.00 C ATOM 1947 C LEU A 122 -6.899 -3.201 -1.861 1.00 0.00 C ATOM 1948 O LEU A 122 -7.476 -2.119 -1.805 1.00 0.00 O ATOM 1949 CB LEU A 122 -4.424 -3.400 -1.553 1.00 0.00 C ATOM 1950 CG LEU A 122 -3.914 -1.961 -1.658 1.00 0.00 C ATOM 1951 CD1 LEU A 122 -2.781 -1.715 -0.676 1.00 0.00 C ATOM 1952 CD2 LEU A 122 -3.465 -1.655 -3.076 1.00 0.00 C ATOM 0 H LEU A 122 -5.193 -5.528 -0.554 1.00 0.00 H new ATOM 0 HA LEU A 122 -5.835 -2.843 -0.041 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -3.694 -3.991 -1.000 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.485 -3.825 -2.555 1.00 0.00 H new ATOM 0 HG LEU A 122 -4.736 -1.291 -1.404 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -2.435 -0.685 -0.770 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -3.136 -1.888 0.340 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -1.957 -2.395 -0.893 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.106 -0.627 -3.130 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -2.662 -2.335 -3.358 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.305 -1.782 -3.759 1.00 0.00 H new ATOM 1964 N GLN A 123 -7.182 -4.124 -2.775 1.00 0.00 N ATOM 1965 CA GLN A 123 -8.225 -3.922 -3.781 1.00 0.00 C ATOM 1966 C GLN A 123 -9.493 -3.315 -3.172 1.00 0.00 C ATOM 1967 O GLN A 123 -10.113 -2.433 -3.765 1.00 0.00 O ATOM 1968 CB GLN A 123 -8.566 -5.250 -4.459 1.00 0.00 C ATOM 1969 CG GLN A 123 -9.122 -6.294 -3.503 1.00 0.00 C ATOM 1970 CD GLN A 123 -9.273 -7.657 -4.151 1.00 0.00 C ATOM 1971 OE1 GLN A 123 -9.615 -7.764 -5.328 1.00 0.00 O ATOM 1972 NE2 GLN A 123 -9.015 -8.709 -3.381 1.00 0.00 N ATOM 0 H GLN A 123 -6.703 -5.022 -2.842 1.00 0.00 H new ATOM 0 HA GLN A 123 -7.837 -3.220 -4.519 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -9.294 -5.069 -5.250 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -7.669 -5.646 -4.936 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -8.463 -6.378 -2.639 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -10.092 -5.962 -3.133 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -8.734 -8.574 -2.410 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -9.098 -9.652 -3.761 1.00 0.00 H new ATOM 1981 N SER A 124 -9.872 -3.795 -1.990 1.00 0.00 N ATOM 1982 CA SER A 124 -11.066 -3.299 -1.308 1.00 0.00 C ATOM 1983 C SER A 124 -10.859 -1.880 -0.770 1.00 0.00 C ATOM 1984 O SER A 124 -11.810 -1.228 -0.337 1.00 0.00 O ATOM 1985 CB SER A 124 -11.448 -4.238 -0.163 1.00 0.00 C ATOM 1986 OG SER A 124 -11.969 -5.461 -0.655 1.00 0.00 O ATOM 0 H SER A 124 -9.371 -4.526 -1.485 1.00 0.00 H new ATOM 0 HA SER A 124 -11.875 -3.268 -2.038 1.00 0.00 H new ATOM 0 HB2 SER A 124 -10.573 -4.435 0.456 1.00 0.00 H new ATOM 0 HB3 SER A 124 -12.188 -3.755 0.475 1.00 0.00 H new ATOM 0 HG SER A 124 -12.203 -6.043 0.098 1.00 0.00 H new ATOM 1992 N GLN A 125 -9.613 -1.408 -0.800 1.00 0.00 N ATOM 1993 CA GLN A 125 -9.278 -0.066 -0.318 1.00 0.00 C ATOM 1994 C GLN A 125 -9.331 0.956 -1.455 1.00 0.00 C ATOM 1995 O GLN A 125 -8.744 2.038 -1.375 1.00 0.00 O ATOM 1996 CB GLN A 125 -7.890 -0.068 0.329 1.00 0.00 C ATOM 1997 CG GLN A 125 -7.531 -1.378 1.021 1.00 0.00 C ATOM 1998 CD GLN A 125 -8.384 -1.658 2.244 1.00 0.00 C ATOM 1999 OE1 GLN A 125 -8.082 -1.201 3.345 1.00 0.00 O ATOM 2000 NE2 GLN A 125 -9.454 -2.420 2.056 1.00 0.00 N ATOM 0 H GLN A 125 -8.816 -1.936 -1.154 1.00 0.00 H new ATOM 0 HA GLN A 125 -10.018 0.221 0.429 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -7.143 0.143 -0.436 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -7.838 0.742 1.057 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -7.642 -2.199 0.312 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -6.482 -1.351 1.316 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -9.668 -2.778 1.125 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -10.063 -2.647 2.842 1.00 0.00 H new ATOM 2009 N LYS A 126 -10.057 0.597 -2.505 1.00 0.00 N ATOM 2010 CA LYS A 126 -10.237 1.453 -3.683 1.00 0.00 C ATOM 2011 C LYS A 126 -8.919 2.045 -4.198 1.00 0.00 C ATOM 2012 O LYS A 126 -8.929 3.059 -4.896 1.00 0.00 O ATOM 2013 CB LYS A 126 -11.222 2.586 -3.366 1.00 0.00 C ATOM 2014 CG LYS A 126 -10.687 3.608 -2.373 1.00 0.00 C ATOM 2015 CD LYS A 126 -11.544 4.864 -2.344 1.00 0.00 C ATOM 2016 CE LYS A 126 -11.839 5.308 -0.919 1.00 0.00 C ATOM 2017 NZ LYS A 126 -13.121 6.058 -0.824 1.00 0.00 N ATOM 0 H LYS A 126 -10.542 -0.298 -2.570 1.00 0.00 H new ATOM 0 HA LYS A 126 -10.636 0.818 -4.474 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -11.484 3.097 -4.293 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -12.141 2.155 -2.969 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -10.655 3.166 -1.377 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -9.663 3.872 -2.638 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -11.033 5.666 -2.877 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -12.481 4.678 -2.869 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -11.881 4.435 -0.268 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -11.024 5.936 -0.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -13.285 6.342 0.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -13.073 6.905 -1.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -13.903 5.451 -1.144 1.00 0.00 H new ATOM 2031 N PHE A 127 -7.791 1.416 -3.870 1.00 0.00 N ATOM 2032 CA PHE A 127 -6.496 1.909 -4.332 1.00 0.00 C ATOM 2033 C PHE A 127 -6.260 1.507 -5.784 1.00 0.00 C ATOM 2034 O PHE A 127 -6.567 0.384 -6.183 1.00 0.00 O ATOM 2035 CB PHE A 127 -5.359 1.378 -3.456 1.00 0.00 C ATOM 2036 CG PHE A 127 -4.000 1.847 -3.898 1.00 0.00 C ATOM 2037 CD1 PHE A 127 -3.278 1.134 -4.841 1.00 0.00 C ATOM 2038 CD2 PHE A 127 -3.447 3.004 -3.373 1.00 0.00 C ATOM 2039 CE1 PHE A 127 -2.030 1.562 -5.251 1.00 0.00 C ATOM 2040 CE2 PHE A 127 -2.198 3.437 -3.780 1.00 0.00 C ATOM 2041 CZ PHE A 127 -1.490 2.716 -4.719 1.00 0.00 C ATOM 0 H PHE A 127 -7.748 0.575 -3.294 1.00 0.00 H new ATOM 0 HA PHE A 127 -6.509 2.996 -4.259 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -5.527 1.691 -2.426 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -5.381 0.288 -3.465 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -3.696 0.231 -5.261 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -3.997 3.574 -2.638 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -1.478 0.995 -5.986 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -1.777 4.340 -3.363 1.00 0.00 H new ATOM 0 HZ PHE A 127 -0.515 3.054 -5.038 1.00 0.00 H new ATOM 2051 N GLN A 128 -5.711 2.428 -6.570 1.00 0.00 N ATOM 2052 CA GLN A 128 -5.435 2.162 -7.978 1.00 0.00 C ATOM 2053 C GLN A 128 -3.937 2.219 -8.260 1.00 0.00 C ATOM 2054 O GLN A 128 -3.162 2.725 -7.448 1.00 0.00 O ATOM 2055 CB GLN A 128 -6.174 3.169 -8.863 1.00 0.00 C ATOM 2056 CG GLN A 128 -7.454 2.618 -9.473 1.00 0.00 C ATOM 2057 CD GLN A 128 -8.665 2.846 -8.591 1.00 0.00 C ATOM 2058 OE1 GLN A 128 -9.136 1.933 -7.913 1.00 0.00 O ATOM 2059 NE2 GLN A 128 -9.178 4.071 -8.596 1.00 0.00 N ATOM 0 H GLN A 128 -5.449 3.363 -6.257 1.00 0.00 H new ATOM 0 HA GLN A 128 -5.790 1.158 -8.209 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -6.414 4.053 -8.272 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -5.509 3.493 -9.664 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -7.622 3.087 -10.442 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -7.336 1.549 -9.653 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -8.756 4.798 -9.173 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -9.994 4.284 -8.023 1.00 0.00 H new ATOM 2068 N ILE A 129 -3.535 1.699 -9.416 1.00 0.00 N ATOM 2069 CA ILE A 129 -2.129 1.693 -9.801 1.00 0.00 C ATOM 2070 C ILE A 129 -1.588 3.113 -9.919 1.00 0.00 C ATOM 2071 O ILE A 129 -1.950 3.851 -10.835 1.00 0.00 O ATOM 2072 CB ILE A 129 -1.911 0.957 -11.140 1.00 0.00 C ATOM 2073 CG1 ILE A 129 -2.550 -0.432 -11.098 1.00 0.00 C ATOM 2074 CG2 ILE A 129 -0.425 0.853 -11.453 1.00 0.00 C ATOM 2075 CD1 ILE A 129 -1.915 -1.358 -10.084 1.00 0.00 C ATOM 0 H ILE A 129 -4.162 1.277 -10.101 1.00 0.00 H new ATOM 0 HA ILE A 129 -1.589 1.164 -9.016 1.00 0.00 H new ATOM 0 HB ILE A 129 -2.391 1.531 -11.933 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -3.611 -0.328 -10.869 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -2.480 -0.886 -12.087 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -0.288 0.331 -12.400 1.00 0.00 H new ATOM 0 HG22 ILE A 129 0.003 1.853 -11.524 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.076 0.300 -10.659 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -2.418 -2.325 -10.109 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -0.860 -1.492 -10.324 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -2.009 -0.926 -9.088 1.00 0.00 H new ATOM 2087 N GLY A 130 -0.718 3.488 -8.987 1.00 0.00 N ATOM 2088 CA GLY A 130 -0.141 4.820 -9.007 1.00 0.00 C ATOM 2089 C GLY A 130 -0.704 5.726 -7.926 1.00 0.00 C ATOM 2090 O GLY A 130 -0.249 6.857 -7.763 1.00 0.00 O ATOM 0 H GLY A 130 -0.403 2.895 -8.220 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.939 4.744 -8.884 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -0.319 5.273 -9.982 1.00 0.00 H new ATOM 2094 N ASP A 131 -1.697 5.234 -7.188 1.00 0.00 N ATOM 2095 CA ASP A 131 -2.312 6.021 -6.125 1.00 0.00 C ATOM 2096 C ASP A 131 -1.316 6.283 -4.998 1.00 0.00 C ATOM 2097 O ASP A 131 -0.354 5.536 -4.819 1.00 0.00 O ATOM 2098 CB ASP A 131 -3.555 5.311 -5.584 1.00 0.00 C ATOM 2099 CG ASP A 131 -4.838 5.912 -6.123 1.00 0.00 C ATOM 2100 OD1 ASP A 131 -4.932 6.109 -7.353 1.00 0.00 O ATOM 2101 OD2 ASP A 131 -5.750 6.187 -5.315 1.00 0.00 O ATOM 0 H ASP A 131 -2.090 4.300 -7.306 1.00 0.00 H new ATOM 0 HA ASP A 131 -2.614 6.981 -6.544 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -3.512 4.254 -5.848 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -3.559 5.367 -4.495 1.00 0.00 H new ATOM 2106 N TYR A 132 -1.549 7.358 -4.252 1.00 0.00 N ATOM 2107 CA TYR A 132 -0.667 7.738 -3.154 1.00 0.00 C ATOM 2108 C TYR A 132 -1.134 7.157 -1.820 1.00 0.00 C ATOM 2109 O TYR A 132 -2.110 7.628 -1.234 1.00 0.00 O ATOM 2110 CB TYR A 132 -0.594 9.261 -3.055 1.00 0.00 C ATOM 2111 CG TYR A 132 -0.312 9.944 -4.375 1.00 0.00 C ATOM 2112 CD1 TYR A 132 0.693 9.486 -5.216 1.00 0.00 C ATOM 2113 CD2 TYR A 132 -1.053 11.048 -4.779 1.00 0.00 C ATOM 2114 CE1 TYR A 132 0.954 10.108 -6.423 1.00 0.00 C ATOM 2115 CE2 TYR A 132 -0.800 11.676 -5.984 1.00 0.00 C ATOM 2116 CZ TYR A 132 0.204 11.202 -6.803 1.00 0.00 C ATOM 2117 OH TYR A 132 0.460 11.824 -8.002 1.00 0.00 O ATOM 0 H TYR A 132 -2.343 7.983 -4.388 1.00 0.00 H new ATOM 0 HA TYR A 132 0.321 7.330 -3.366 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -1.537 9.636 -2.656 1.00 0.00 H new ATOM 0 HB3 TYR A 132 0.184 9.533 -2.342 1.00 0.00 H new ATOM 0 HD1 TYR A 132 1.281 8.629 -4.922 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -1.840 11.422 -4.141 1.00 0.00 H new ATOM 0 HE1 TYR A 132 1.741 9.740 -7.065 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -1.385 12.533 -6.283 1.00 0.00 H new ATOM 0 HH TYR A 132 -0.157 12.576 -8.119 1.00 0.00 H new ATOM 2127 N LEU A 133 -0.411 6.150 -1.334 1.00 0.00 N ATOM 2128 CA LEU A 133 -0.730 5.513 -0.057 1.00 0.00 C ATOM 2129 C LEU A 133 0.212 6.024 1.033 1.00 0.00 C ATOM 2130 O LEU A 133 1.424 5.836 0.942 1.00 0.00 O ATOM 2131 CB LEU A 133 -0.586 3.986 -0.168 1.00 0.00 C ATOM 2132 CG LEU A 133 -1.873 3.164 -0.368 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -1.734 1.810 0.308 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -3.108 3.885 0.160 1.00 0.00 C ATOM 0 H LEU A 133 0.402 5.756 -1.807 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.760 5.761 0.201 1.00 0.00 H new ATOM 0 HB2 LEU A 133 0.084 3.771 -1.001 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -0.095 3.628 0.737 1.00 0.00 H new ATOM 0 HG LEU A 133 -2.009 3.029 -1.441 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -2.648 1.235 0.162 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.893 1.271 -0.127 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -1.561 1.952 1.375 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -3.989 3.265 -0.004 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -2.991 4.074 1.227 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.228 4.833 -0.365 1.00 0.00 H new ATOM 2146 N ASP A 134 -0.338 6.667 2.062 1.00 0.00 N ATOM 2147 CA ASP A 134 0.480 7.188 3.148 1.00 0.00 C ATOM 2148 C ASP A 134 0.395 6.293 4.380 1.00 0.00 C ATOM 2149 O ASP A 134 -0.660 6.178 5.004 1.00 0.00 O ATOM 2150 CB ASP A 134 0.038 8.606 3.513 1.00 0.00 C ATOM 2151 CG ASP A 134 1.106 9.367 4.275 1.00 0.00 C ATOM 2152 OD1 ASP A 134 1.587 8.846 5.303 1.00 0.00 O ATOM 2153 OD2 ASP A 134 1.462 10.483 3.842 1.00 0.00 O ATOM 0 H ASP A 134 -1.339 6.837 2.164 1.00 0.00 H new ATOM 0 HA ASP A 134 1.514 7.208 2.805 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -0.213 9.151 2.603 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -0.869 8.557 4.116 1.00 0.00 H new ATOM 2158 N ILE A 135 1.514 5.668 4.730 1.00 0.00 N ATOM 2159 CA ILE A 135 1.566 4.791 5.893 1.00 0.00 C ATOM 2160 C ILE A 135 2.141 5.520 7.108 1.00 0.00 C ATOM 2161 O ILE A 135 3.352 5.699 7.227 1.00 0.00 O ATOM 2162 CB ILE A 135 2.401 3.524 5.609 1.00 0.00 C ATOM 2163 CG1 ILE A 135 1.727 2.676 4.527 1.00 0.00 C ATOM 2164 CG2 ILE A 135 2.592 2.704 6.881 1.00 0.00 C ATOM 2165 CD1 ILE A 135 2.524 2.582 3.245 1.00 0.00 C ATOM 0 H ILE A 135 2.396 5.753 4.225 1.00 0.00 H new ATOM 0 HA ILE A 135 0.541 4.491 6.111 1.00 0.00 H new ATOM 0 HB ILE A 135 3.383 3.835 5.252 1.00 0.00 H new ATOM 0 HG12 ILE A 135 1.561 1.671 4.916 1.00 0.00 H new ATOM 0 HG13 ILE A 135 0.747 3.098 4.305 1.00 0.00 H new ATOM 0 HG21 ILE A 135 3.183 1.816 6.656 1.00 0.00 H new ATOM 0 HG22 ILE A 135 3.110 3.306 7.627 1.00 0.00 H new ATOM 0 HG23 ILE A 135 1.619 2.403 7.269 1.00 0.00 H new ATOM 0 HD11 ILE A 135 1.985 1.966 2.526 1.00 0.00 H new ATOM 0 HD12 ILE A 135 2.668 3.580 2.832 1.00 0.00 H new ATOM 0 HD13 ILE A 135 3.495 2.132 3.452 1.00 0.00 H new ATOM 2177 N ALA A 136 1.258 5.930 8.013 1.00 0.00 N ATOM 2178 CA ALA A 136 1.673 6.627 9.223 1.00 0.00 C ATOM 2179 C ALA A 136 2.189 5.637 10.259 1.00 0.00 C ATOM 2180 O ALA A 136 1.404 4.984 10.943 1.00 0.00 O ATOM 2181 CB ALA A 136 0.514 7.432 9.788 1.00 0.00 C ATOM 0 H ALA A 136 0.251 5.791 7.930 1.00 0.00 H new ATOM 0 HA ALA A 136 2.483 7.311 8.970 1.00 0.00 H new ATOM 0 HB1 ALA A 136 0.836 7.948 10.692 1.00 0.00 H new ATOM 0 HB2 ALA A 136 0.185 8.164 9.050 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -0.312 6.762 10.028 1.00 0.00 H new ATOM 2187 N ILE A 137 3.511 5.528 10.369 1.00 0.00 N ATOM 2188 CA ILE A 137 4.125 4.609 11.322 1.00 0.00 C ATOM 2189 C ILE A 137 4.266 5.251 12.699 1.00 0.00 C ATOM 2190 O ILE A 137 4.823 6.340 12.836 1.00 0.00 O ATOM 2191 CB ILE A 137 5.512 4.140 10.834 1.00 0.00 C ATOM 2192 CG1 ILE A 137 5.407 3.549 9.428 1.00 0.00 C ATOM 2193 CG2 ILE A 137 6.104 3.123 11.800 1.00 0.00 C ATOM 2194 CD1 ILE A 137 6.718 3.549 8.672 1.00 0.00 C ATOM 0 H ILE A 137 4.176 6.064 9.811 1.00 0.00 H new ATOM 0 HA ILE A 137 3.465 3.745 11.399 1.00 0.00 H new ATOM 0 HB ILE A 137 6.177 5.003 10.798 1.00 0.00 H new ATOM 0 HG12 ILE A 137 5.038 2.526 9.500 1.00 0.00 H new ATOM 0 HG13 ILE A 137 4.669 4.115 8.859 1.00 0.00 H new ATOM 0 HG21 ILE A 137 7.082 2.804 11.439 1.00 0.00 H new ATOM 0 HG22 ILE A 137 6.211 3.577 12.785 1.00 0.00 H new ATOM 0 HG23 ILE A 137 5.443 2.259 11.869 1.00 0.00 H new ATOM 0 HD11 ILE A 137 6.568 3.116 7.683 1.00 0.00 H new ATOM 0 HD12 ILE A 137 7.078 4.572 8.569 1.00 0.00 H new ATOM 0 HD13 ILE A 137 7.453 2.959 9.219 1.00 0.00 H new ATOM 2206 N THR A 138 3.754 4.564 13.717 1.00 0.00 N ATOM 2207 CA THR A 138 3.814 5.057 15.089 1.00 0.00 C ATOM 2208 C THR A 138 4.784 4.224 15.928 1.00 0.00 C ATOM 2209 O THR A 138 4.520 3.054 16.209 1.00 0.00 O ATOM 2210 CB THR A 138 2.423 5.021 15.727 1.00 0.00 C ATOM 2211 OG1 THR A 138 1.418 5.223 14.750 1.00 0.00 O ATOM 2212 CG2 THR A 138 2.232 6.064 16.805 1.00 0.00 C ATOM 0 H THR A 138 3.291 3.661 13.616 1.00 0.00 H new ATOM 0 HA THR A 138 4.172 6.086 15.060 1.00 0.00 H new ATOM 0 HB THR A 138 2.339 4.034 16.181 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.074 4.356 14.450 1.00 0.00 H new ATOM 0 HG21 THR A 138 1.225 5.983 17.215 1.00 0.00 H new ATOM 0 HG22 THR A 138 2.961 5.904 17.599 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.372 7.057 16.379 1.00 0.00 H new ATOM 2220 N PRO A 139 5.920 4.812 16.343 1.00 0.00 N ATOM 2221 CA PRO A 139 6.918 4.104 17.153 1.00 0.00 C ATOM 2222 C PRO A 139 6.303 3.476 18.402 1.00 0.00 C ATOM 2223 O PRO A 139 5.214 3.862 18.828 1.00 0.00 O ATOM 2224 CB PRO A 139 7.914 5.199 17.539 1.00 0.00 C ATOM 2225 CG PRO A 139 7.761 6.247 16.491 1.00 0.00 C ATOM 2226 CD PRO A 139 6.322 6.202 16.062 1.00 0.00 C ATOM 0 HA PRO A 139 7.372 3.276 16.608 1.00 0.00 H new ATOM 0 HB2 PRO A 139 7.698 5.598 18.530 1.00 0.00 H new ATOM 0 HB3 PRO A 139 8.933 4.814 17.566 1.00 0.00 H new ATOM 0 HG2 PRO A 139 8.020 7.231 16.883 1.00 0.00 H new ATOM 0 HG3 PRO A 139 8.425 6.055 15.648 1.00 0.00 H new ATOM 0 HD2 PRO A 139 5.715 6.915 16.619 1.00 0.00 H new ATOM 0 HD3 PRO A 139 6.211 6.446 15.005 1.00 0.00 H new ATOM 2234 N PRO A 140 6.989 2.485 19.004 1.00 0.00 N ATOM 2235 CA PRO A 140 6.500 1.795 20.202 1.00 0.00 C ATOM 2236 C PRO A 140 6.564 2.658 21.462 1.00 0.00 C ATOM 2237 O PRO A 140 5.974 2.316 22.486 1.00 0.00 O ATOM 2238 CB PRO A 140 7.441 0.586 20.344 1.00 0.00 C ATOM 2239 CG PRO A 140 8.241 0.542 19.081 1.00 0.00 C ATOM 2240 CD PRO A 140 8.281 1.949 18.564 1.00 0.00 C ATOM 0 HA PRO A 140 5.448 1.529 20.096 1.00 0.00 H new ATOM 0 HB2 PRO A 140 8.089 0.695 21.214 1.00 0.00 H new ATOM 0 HB3 PRO A 140 6.876 -0.336 20.481 1.00 0.00 H new ATOM 0 HG2 PRO A 140 9.247 0.168 19.270 1.00 0.00 H new ATOM 0 HG3 PRO A 140 7.783 -0.128 18.353 1.00 0.00 H new ATOM 0 HD2 PRO A 140 9.117 2.511 18.981 1.00 0.00 H new ATOM 0 HD3 PRO A 140 8.385 1.980 17.479 1.00 0.00 H new