USER MOD reduce.3.24.130724 H: found=0, std=0, add=884, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 888 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 128 ASN : amide:sc= -0.122 X(o=-0.11,f=0) USER MOD Set 1.2: A 137 SER OG : rot -140:sc= 0.0164 USER MOD Set 2.1: A 73 ASN : amide:sc= 1.11 K(o=1.3,f=-1.2) USER MOD Set 2.2: A 108 THR OG1 : rot 180:sc= 0.222 USER MOD Set 3.1: A 42 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 82 SER OG : rot 143:sc= 0.0793 USER MOD Set 4.1: A 41 THR OG1 : rot 66:sc= 0.834 USER MOD Set 4.2: A 61 GLN : amide:sc= 2.76 K(o=3.6,f=-8.2!) USER MOD Set 5.1: A 46 GLN : amide:sc= -0.0132 X(o=-0.013,f=-0.023) USER MOD Set 5.2: A 85 SER OG : rot -90:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= -0.134 K(o=-0.13,f=-1.5) USER MOD Single : A 24 TYR OH : rot 19:sc= 0.57 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= 0.669 K(o=0.67,f=-3.1!) USER MOD Single : A 48 THR OG1 : rot 77:sc= 0.665 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= -0.0544 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 SER OG : rot -40:sc= 0.2 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -88:sc= 1.07 USER MOD Single : A 84 ASN : amide:sc= -0.121 X(o=-0.12,f=-0.27) USER MOD Single : A 86 GLN : amide:sc= -0.23 K(o=-0.23,f=-2.1) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 101 ASN : amide:sc= -0.0701 X(o=-0.07,f=-0.21) USER MOD Single : A 102 ASN : amide:sc= -0.0127 K(o=-0.013,f=-0.59) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 108:sc= 0.0145 USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= 0.95 K(o=0.95,f=-3!) USER MOD Single : A 117 GLN : amide:sc= 0.714! C(o=0.71!,f=-5.5!) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 THR OG1 : rot -64:sc= 1.1 USER MOD Single : A 124 SER OG : rot 17:sc= 0.00264 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 129 ASN : amide:sc= -0.0301 X(o=-0.03,f=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 145 SER OG : rot -33:sc= 0.118 USER MOD Single : A 152 LYS NZ :NH3+ -164:sc= 1.22 (180deg=1.07) USER MOD ----------------------------------------------------------------- ATOM 277 N SER A 20 42.932 2.100 12.704 1.00 0.00 N ATOM 278 CA SER A 20 43.890 3.088 12.206 1.00 0.00 C ATOM 279 C SER A 20 44.691 3.688 13.367 1.00 0.00 C ATOM 280 O SER A 20 44.260 3.635 14.523 1.00 0.00 O ATOM 281 CB SER A 20 43.123 4.186 11.460 1.00 0.00 C ATOM 282 OG SER A 20 44.025 5.004 10.731 1.00 0.00 O ATOM 0 HA SER A 20 44.593 2.607 11.526 1.00 0.00 H new ATOM 0 HB2 SER A 20 42.398 3.737 10.781 1.00 0.00 H new ATOM 0 HB3 SER A 20 42.561 4.794 12.169 1.00 0.00 H new ATOM 0 HG SER A 20 43.525 5.701 10.257 1.00 0.00 H new ATOM 288 N ALA A 21 45.860 4.257 13.066 1.00 0.00 N ATOM 289 CA ALA A 21 46.764 4.851 14.046 1.00 0.00 C ATOM 290 C ALA A 21 46.081 5.981 14.843 1.00 0.00 C ATOM 291 O ALA A 21 45.596 6.961 14.267 1.00 0.00 O ATOM 292 CB ALA A 21 48.024 5.332 13.315 1.00 0.00 C ATOM 0 H ALA A 21 46.210 4.318 12.110 1.00 0.00 H new ATOM 0 HA ALA A 21 47.046 4.102 14.786 1.00 0.00 H new ATOM 0 HB1 ALA A 21 48.712 5.779 14.032 1.00 0.00 H new ATOM 0 HB2 ALA A 21 48.507 4.485 12.828 1.00 0.00 H new ATOM 0 HB3 ALA A 21 47.749 6.074 12.565 1.00 0.00 H new ATOM 298 N GLY A 22 46.033 5.840 16.170 1.00 0.00 N ATOM 299 CA GLY A 22 45.302 6.762 17.050 1.00 0.00 C ATOM 300 C GLY A 22 45.304 6.369 18.528 1.00 0.00 C ATOM 301 O GLY A 22 45.949 5.394 18.925 1.00 0.00 O ATOM 0 H GLY A 22 46.500 5.082 16.668 1.00 0.00 H new ATOM 0 HA2 GLY A 22 45.736 7.757 16.952 1.00 0.00 H new ATOM 0 HA3 GLY A 22 44.270 6.829 16.707 1.00 0.00 H new ATOM 305 N ASN A 23 44.570 7.130 19.344 1.00 0.00 N ATOM 306 CA ASN A 23 44.374 6.881 20.770 1.00 0.00 C ATOM 307 C ASN A 23 43.102 6.041 20.989 1.00 0.00 C ATOM 308 O ASN A 23 42.067 6.298 20.368 1.00 0.00 O ATOM 309 CB ASN A 23 44.277 8.219 21.532 1.00 0.00 C ATOM 310 CG ASN A 23 45.513 9.113 21.472 1.00 0.00 C ATOM 311 OD1 ASN A 23 46.173 9.279 20.455 1.00 0.00 O ATOM 312 ND2 ASN A 23 45.863 9.749 22.567 1.00 0.00 N ATOM 0 H ASN A 23 44.081 7.963 19.017 1.00 0.00 H new ATOM 0 HA ASN A 23 45.228 6.324 21.155 1.00 0.00 H new ATOM 0 HB2 ASN A 23 43.429 8.778 21.138 1.00 0.00 H new ATOM 0 HB3 ASN A 23 44.059 8.004 22.578 1.00 0.00 H new ATOM 0 HD21 ASN A 23 46.673 10.369 22.560 1.00 0.00 H new ATOM 0 HD22 ASN A 23 45.325 9.623 23.424 1.00 0.00 H new ATOM 319 N TYR A 24 43.169 5.058 21.890 1.00 0.00 N ATOM 320 CA TYR A 24 42.090 4.117 22.195 1.00 0.00 C ATOM 321 C TYR A 24 41.991 3.826 23.703 1.00 0.00 C ATOM 322 O TYR A 24 42.885 4.145 24.488 1.00 0.00 O ATOM 323 CB TYR A 24 42.308 2.808 21.410 1.00 0.00 C ATOM 324 CG TYR A 24 42.120 2.943 19.912 1.00 0.00 C ATOM 325 CD1 TYR A 24 43.174 3.431 19.115 1.00 0.00 C ATOM 326 CD2 TYR A 24 40.885 2.611 19.319 1.00 0.00 C ATOM 327 CE1 TYR A 24 42.994 3.620 17.734 1.00 0.00 C ATOM 328 CE2 TYR A 24 40.705 2.785 17.933 1.00 0.00 C ATOM 329 CZ TYR A 24 41.760 3.286 17.135 1.00 0.00 C ATOM 330 OH TYR A 24 41.591 3.447 15.795 1.00 0.00 O ATOM 0 H TYR A 24 44.007 4.890 22.447 1.00 0.00 H new ATOM 0 HA TYR A 24 41.148 4.574 21.892 1.00 0.00 H new ATOM 0 HB2 TYR A 24 43.316 2.443 21.607 1.00 0.00 H new ATOM 0 HB3 TYR A 24 41.617 2.053 21.785 1.00 0.00 H new ATOM 0 HD1 TYR A 24 44.127 3.661 19.568 1.00 0.00 H new ATOM 0 HD2 TYR A 24 40.079 2.224 19.926 1.00 0.00 H new ATOM 0 HE1 TYR A 24 43.797 4.020 17.133 1.00 0.00 H new ATOM 0 HE2 TYR A 24 39.758 2.535 17.478 1.00 0.00 H new ATOM 0 HH TYR A 24 42.467 3.512 15.360 1.00 0.00 H new ATOM 340 N ILE A 25 40.909 3.158 24.091 1.00 0.00 N ATOM 341 CA ILE A 25 40.668 2.577 25.417 1.00 0.00 C ATOM 342 C ILE A 25 40.290 1.099 25.261 1.00 0.00 C ATOM 343 O ILE A 25 39.727 0.706 24.239 1.00 0.00 O ATOM 344 CB ILE A 25 39.574 3.356 26.182 1.00 0.00 C ATOM 345 CG1 ILE A 25 38.291 3.555 25.343 1.00 0.00 C ATOM 346 CG2 ILE A 25 40.143 4.704 26.658 1.00 0.00 C ATOM 347 CD1 ILE A 25 37.073 3.985 26.169 1.00 0.00 C ATOM 0 H ILE A 25 40.129 2.996 23.455 1.00 0.00 H new ATOM 0 HA ILE A 25 41.582 2.651 26.007 1.00 0.00 H new ATOM 0 HB ILE A 25 39.280 2.761 27.047 1.00 0.00 H new ATOM 0 HG12 ILE A 25 38.482 4.306 24.576 1.00 0.00 H new ATOM 0 HG13 ILE A 25 38.058 2.624 24.826 1.00 0.00 H new ATOM 0 HG21 ILE A 25 39.372 5.254 27.198 1.00 0.00 H new ATOM 0 HG22 ILE A 25 40.992 4.528 27.318 1.00 0.00 H new ATOM 0 HG23 ILE A 25 40.468 5.286 25.796 1.00 0.00 H new ATOM 0 HD11 ILE A 25 36.212 4.105 25.512 1.00 0.00 H new ATOM 0 HD12 ILE A 25 36.855 3.224 26.919 1.00 0.00 H new ATOM 0 HD13 ILE A 25 37.286 4.932 26.665 1.00 0.00 H new ATOM 359 N ILE A 26 40.596 0.285 26.276 1.00 0.00 N ATOM 360 CA ILE A 26 40.406 -1.174 26.268 1.00 0.00 C ATOM 361 C ILE A 26 39.724 -1.587 27.574 1.00 0.00 C ATOM 362 O ILE A 26 40.197 -1.252 28.663 1.00 0.00 O ATOM 363 CB ILE A 26 41.750 -1.926 26.083 1.00 0.00 C ATOM 364 CG1 ILE A 26 42.511 -1.555 24.786 1.00 0.00 C ATOM 365 CG2 ILE A 26 41.481 -3.443 26.067 1.00 0.00 C ATOM 366 CD1 ILE A 26 43.528 -0.419 24.959 1.00 0.00 C ATOM 0 H ILE A 26 40.993 0.629 27.150 1.00 0.00 H new ATOM 0 HA ILE A 26 39.776 -1.445 25.421 1.00 0.00 H new ATOM 0 HB ILE A 26 42.381 -1.627 26.920 1.00 0.00 H new ATOM 0 HG12 ILE A 26 43.030 -2.439 24.416 1.00 0.00 H new ATOM 0 HG13 ILE A 26 41.788 -1.268 24.023 1.00 0.00 H new ATOM 0 HG21 ILE A 26 42.422 -3.978 25.937 1.00 0.00 H new ATOM 0 HG22 ILE A 26 41.021 -3.741 27.009 1.00 0.00 H new ATOM 0 HG23 ILE A 26 40.809 -3.685 25.243 1.00 0.00 H new ATOM 0 HD11 ILE A 26 44.017 -0.220 24.006 1.00 0.00 H new ATOM 0 HD12 ILE A 26 43.014 0.481 25.297 1.00 0.00 H new ATOM 0 HD13 ILE A 26 44.276 -0.709 25.697 1.00 0.00 H new ATOM 378 N TYR A 27 38.625 -2.331 27.461 1.00 0.00 N ATOM 379 CA TYR A 27 37.845 -2.819 28.602 1.00 0.00 C ATOM 380 C TYR A 27 37.297 -4.233 28.372 1.00 0.00 C ATOM 381 O TYR A 27 37.174 -4.700 27.238 1.00 0.00 O ATOM 382 CB TYR A 27 36.751 -1.798 28.972 1.00 0.00 C ATOM 383 CG TYR A 27 35.822 -1.345 27.859 1.00 0.00 C ATOM 384 CD1 TYR A 27 36.209 -0.295 27.002 1.00 0.00 C ATOM 385 CD2 TYR A 27 34.543 -1.921 27.732 1.00 0.00 C ATOM 386 CE1 TYR A 27 35.325 0.176 26.012 1.00 0.00 C ATOM 387 CE2 TYR A 27 33.649 -1.441 26.755 1.00 0.00 C ATOM 388 CZ TYR A 27 34.037 -0.393 25.891 1.00 0.00 C ATOM 389 OH TYR A 27 33.161 0.065 24.956 1.00 0.00 O ATOM 0 H TYR A 27 38.243 -2.618 26.560 1.00 0.00 H new ATOM 0 HA TYR A 27 38.511 -2.910 29.460 1.00 0.00 H new ATOM 0 HB2 TYR A 27 36.142 -2.228 29.767 1.00 0.00 H new ATOM 0 HB3 TYR A 27 37.238 -0.915 29.386 1.00 0.00 H new ATOM 0 HD1 TYR A 27 37.188 0.150 27.105 1.00 0.00 H new ATOM 0 HD2 TYR A 27 34.248 -2.730 28.383 1.00 0.00 H new ATOM 0 HE1 TYR A 27 35.631 0.970 25.347 1.00 0.00 H new ATOM 0 HE2 TYR A 27 32.664 -1.875 26.666 1.00 0.00 H new ATOM 0 HH TYR A 27 32.325 -0.442 25.015 1.00 0.00 H new ATOM 399 N ASN A 28 37.038 -4.962 29.460 1.00 0.00 N ATOM 400 CA ASN A 28 36.621 -6.364 29.388 1.00 0.00 C ATOM 401 C ASN A 28 35.169 -6.497 28.880 1.00 0.00 C ATOM 402 O ASN A 28 34.305 -5.698 29.242 1.00 0.00 O ATOM 403 CB ASN A 28 36.813 -7.005 30.771 1.00 0.00 C ATOM 404 CG ASN A 28 36.558 -8.498 30.703 1.00 0.00 C ATOM 405 OD1 ASN A 28 35.438 -8.960 30.851 1.00 0.00 O ATOM 406 ND2 ASN A 28 37.561 -9.282 30.388 1.00 0.00 N ATOM 0 H ASN A 28 37.111 -4.600 30.411 1.00 0.00 H new ATOM 0 HA ASN A 28 37.240 -6.894 28.664 1.00 0.00 H new ATOM 0 HB2 ASN A 28 37.826 -6.819 31.127 1.00 0.00 H new ATOM 0 HB3 ASN A 28 36.133 -6.546 31.489 1.00 0.00 H new ATOM 0 HD21 ASN A 28 37.407 -10.283 30.266 1.00 0.00 H new ATOM 0 HD22 ASN A 28 38.495 -8.891 30.265 1.00 0.00 H new ATOM 413 N ARG A 29 34.879 -7.526 28.070 1.00 0.00 N ATOM 414 CA ARG A 29 33.549 -7.738 27.457 1.00 0.00 C ATOM 415 C ARG A 29 32.453 -8.199 28.435 1.00 0.00 C ATOM 416 O ARG A 29 31.272 -8.161 28.085 1.00 0.00 O ATOM 417 CB ARG A 29 33.737 -8.693 26.263 1.00 0.00 C ATOM 418 CG ARG A 29 32.522 -8.813 25.330 1.00 0.00 C ATOM 419 CD ARG A 29 31.684 -10.064 25.623 1.00 0.00 C ATOM 420 NE ARG A 29 30.428 -10.041 24.860 1.00 0.00 N ATOM 421 CZ ARG A 29 29.256 -9.571 25.250 1.00 0.00 C ATOM 422 NH1 ARG A 29 29.085 -8.988 26.403 1.00 0.00 N ATOM 423 NH2 ARG A 29 28.221 -9.676 24.468 1.00 0.00 N ATOM 0 H ARG A 29 35.561 -8.241 27.817 1.00 0.00 H new ATOM 0 HA ARG A 29 33.166 -6.776 27.117 1.00 0.00 H new ATOM 0 HB2 ARG A 29 34.593 -8.356 25.679 1.00 0.00 H new ATOM 0 HB3 ARG A 29 33.982 -9.684 26.645 1.00 0.00 H new ATOM 0 HG2 ARG A 29 31.897 -7.927 25.436 1.00 0.00 H new ATOM 0 HG3 ARG A 29 32.863 -8.841 24.295 1.00 0.00 H new ATOM 0 HD2 ARG A 29 32.254 -10.957 25.367 1.00 0.00 H new ATOM 0 HD3 ARG A 29 31.466 -10.120 26.690 1.00 0.00 H new ATOM 0 HE ARG A 29 30.465 -10.434 23.919 1.00 0.00 H new ATOM 0 HH11 ARG A 29 29.873 -8.881 27.042 1.00 0.00 H new ATOM 0 HH12 ARG A 29 28.163 -8.639 26.666 1.00 0.00 H new ATOM 0 HH21 ARG A 29 28.315 -10.121 23.555 1.00 0.00 H new ATOM 0 HH22 ARG A 29 27.316 -9.314 24.768 1.00 0.00 H new ATOM 437 N VAL A 30 32.817 -8.621 29.648 1.00 0.00 N ATOM 438 CA VAL A 30 31.925 -9.250 30.649 1.00 0.00 C ATOM 439 C VAL A 30 31.942 -8.491 31.994 1.00 0.00 C ATOM 440 O VAL A 30 31.216 -8.845 32.925 1.00 0.00 O ATOM 441 CB VAL A 30 32.272 -10.758 30.769 1.00 0.00 C ATOM 442 CG1 VAL A 30 31.327 -11.576 31.665 1.00 0.00 C ATOM 443 CG2 VAL A 30 32.206 -11.415 29.377 1.00 0.00 C ATOM 0 H VAL A 30 33.777 -8.535 29.982 1.00 0.00 H new ATOM 0 HA VAL A 30 30.891 -9.181 30.312 1.00 0.00 H new ATOM 0 HB VAL A 30 33.265 -10.773 31.218 1.00 0.00 H new ATOM 0 HG11 VAL A 30 31.653 -12.616 31.684 1.00 0.00 H new ATOM 0 HG12 VAL A 30 31.344 -11.172 32.677 1.00 0.00 H new ATOM 0 HG13 VAL A 30 30.313 -11.521 31.270 1.00 0.00 H new ATOM 0 HG21 VAL A 30 32.450 -12.474 29.463 1.00 0.00 H new ATOM 0 HG22 VAL A 30 31.201 -11.306 28.970 1.00 0.00 H new ATOM 0 HG23 VAL A 30 32.921 -10.931 28.712 1.00 0.00 H new ATOM 565 N LEU A 38 35.357 -2.918 34.074 1.00 0.00 N ATOM 566 CA LEU A 38 36.810 -3.108 34.240 1.00 0.00 C ATOM 567 C LEU A 38 37.560 -2.710 32.962 1.00 0.00 C ATOM 568 O LEU A 38 37.180 -3.128 31.867 1.00 0.00 O ATOM 569 CB LEU A 38 37.135 -4.579 34.561 1.00 0.00 C ATOM 570 CG LEU A 38 36.633 -5.104 35.914 1.00 0.00 C ATOM 571 CD1 LEU A 38 36.994 -6.586 36.024 1.00 0.00 C ATOM 572 CD2 LEU A 38 37.266 -4.386 37.107 1.00 0.00 C ATOM 0 HA LEU A 38 37.130 -2.473 35.066 1.00 0.00 H new ATOM 0 HB2 LEU A 38 36.713 -5.203 33.773 1.00 0.00 H new ATOM 0 HB3 LEU A 38 38.217 -4.707 34.524 1.00 0.00 H new ATOM 0 HG LEU A 38 35.557 -4.930 35.946 1.00 0.00 H new ATOM 0 HD11 LEU A 38 36.644 -6.976 36.980 1.00 0.00 H new ATOM 0 HD12 LEU A 38 36.520 -7.137 35.212 1.00 0.00 H new ATOM 0 HD13 LEU A 38 38.076 -6.703 35.958 1.00 0.00 H new ATOM 0 HD21 LEU A 38 36.871 -4.802 38.034 1.00 0.00 H new ATOM 0 HD22 LEU A 38 38.347 -4.521 37.081 1.00 0.00 H new ATOM 0 HD23 LEU A 38 37.032 -3.323 37.058 1.00 0.00 H new ATOM 584 N ALA A 39 38.652 -1.961 33.110 1.00 0.00 N ATOM 585 CA ALA A 39 39.455 -1.412 32.020 1.00 0.00 C ATOM 586 C ALA A 39 40.960 -1.626 32.238 1.00 0.00 C ATOM 587 O ALA A 39 41.448 -1.670 33.373 1.00 0.00 O ATOM 588 CB ALA A 39 39.123 0.076 31.886 1.00 0.00 C ATOM 0 H ALA A 39 39.015 -1.711 34.030 1.00 0.00 H new ATOM 0 HA ALA A 39 39.209 -1.939 31.098 1.00 0.00 H new ATOM 0 HB1 ALA A 39 39.711 0.509 31.077 1.00 0.00 H new ATOM 0 HB2 ALA A 39 38.062 0.194 31.666 1.00 0.00 H new ATOM 0 HB3 ALA A 39 39.359 0.587 32.820 1.00 0.00 H new ATOM 594 N LEU A 40 41.695 -1.743 31.130 1.00 0.00 N ATOM 595 CA LEU A 40 43.148 -1.897 31.114 1.00 0.00 C ATOM 596 C LEU A 40 43.822 -0.643 31.689 1.00 0.00 C ATOM 597 O LEU A 40 43.641 0.458 31.162 1.00 0.00 O ATOM 598 CB LEU A 40 43.597 -2.170 29.669 1.00 0.00 C ATOM 599 CG LEU A 40 45.037 -2.704 29.572 1.00 0.00 C ATOM 600 CD1 LEU A 40 45.112 -4.162 30.043 1.00 0.00 C ATOM 601 CD2 LEU A 40 45.514 -2.606 28.124 1.00 0.00 C ATOM 0 H LEU A 40 41.284 -1.733 30.196 1.00 0.00 H new ATOM 0 HA LEU A 40 43.446 -2.738 31.740 1.00 0.00 H new ATOM 0 HB2 LEU A 40 42.918 -2.891 29.214 1.00 0.00 H new ATOM 0 HB3 LEU A 40 43.518 -1.249 29.091 1.00 0.00 H new ATOM 0 HG LEU A 40 45.678 -2.102 30.216 1.00 0.00 H new ATOM 0 HD11 LEU A 40 46.140 -4.517 29.965 1.00 0.00 H new ATOM 0 HD12 LEU A 40 44.783 -4.227 31.080 1.00 0.00 H new ATOM 0 HD13 LEU A 40 44.466 -4.780 29.419 1.00 0.00 H new ATOM 0 HD21 LEU A 40 46.534 -2.983 28.051 1.00 0.00 H new ATOM 0 HD22 LEU A 40 44.861 -3.200 27.485 1.00 0.00 H new ATOM 0 HD23 LEU A 40 45.488 -1.565 27.802 1.00 0.00 H new ATOM 613 N THR A 41 44.601 -0.813 32.758 1.00 0.00 N ATOM 614 CA THR A 41 45.151 0.293 33.553 1.00 0.00 C ATOM 615 C THR A 41 46.662 0.127 33.735 1.00 0.00 C ATOM 616 O THR A 41 47.158 -0.928 34.135 1.00 0.00 O ATOM 617 CB THR A 41 44.442 0.394 34.917 1.00 0.00 C ATOM 618 OG1 THR A 41 43.037 0.461 34.752 1.00 0.00 O ATOM 619 CG2 THR A 41 44.839 1.662 35.677 1.00 0.00 C ATOM 0 H THR A 41 44.873 -1.734 33.103 1.00 0.00 H new ATOM 0 HA THR A 41 44.973 1.222 33.012 1.00 0.00 H new ATOM 0 HB THR A 41 44.741 -0.495 35.472 1.00 0.00 H new ATOM 0 HG1 THR A 41 42.711 -0.383 34.376 1.00 0.00 H new ATOM 0 HG21 THR A 41 44.316 1.692 36.633 1.00 0.00 H new ATOM 0 HG22 THR A 41 45.915 1.659 35.852 1.00 0.00 H new ATOM 0 HG23 THR A 41 44.570 2.539 35.088 1.00 0.00 H new ATOM 627 N TYR A 42 47.407 1.186 33.421 1.00 0.00 N ATOM 628 CA TYR A 42 48.863 1.231 33.504 1.00 0.00 C ATOM 629 C TYR A 42 49.334 1.043 34.964 1.00 0.00 C ATOM 630 O TYR A 42 48.808 1.714 35.857 1.00 0.00 O ATOM 631 CB TYR A 42 49.325 2.580 32.928 1.00 0.00 C ATOM 632 CG TYR A 42 50.828 2.748 32.819 1.00 0.00 C ATOM 633 CD1 TYR A 42 51.552 1.956 31.908 1.00 0.00 C ATOM 634 CD2 TYR A 42 51.500 3.715 33.593 1.00 0.00 C ATOM 635 CE1 TYR A 42 52.944 2.114 31.788 1.00 0.00 C ATOM 636 CE2 TYR A 42 52.894 3.881 33.464 1.00 0.00 C ATOM 637 CZ TYR A 42 53.624 3.074 32.565 1.00 0.00 C ATOM 638 OH TYR A 42 54.969 3.232 32.426 1.00 0.00 O ATOM 0 H TYR A 42 47.000 2.062 33.092 1.00 0.00 H new ATOM 0 HA TYR A 42 49.304 0.417 32.928 1.00 0.00 H new ATOM 0 HB2 TYR A 42 48.888 2.704 31.937 1.00 0.00 H new ATOM 0 HB3 TYR A 42 48.929 3.380 33.554 1.00 0.00 H new ATOM 0 HD1 TYR A 42 51.038 1.226 31.300 1.00 0.00 H new ATOM 0 HD2 TYR A 42 50.946 4.330 34.286 1.00 0.00 H new ATOM 0 HE1 TYR A 42 53.496 1.496 31.096 1.00 0.00 H new ATOM 0 HE2 TYR A 42 53.405 4.627 34.054 1.00 0.00 H new ATOM 0 HH TYR A 42 55.280 3.935 33.034 1.00 0.00 H new ATOM 648 N PRO A 43 50.320 0.164 35.240 1.00 0.00 N ATOM 649 CA PRO A 43 50.784 -0.122 36.603 1.00 0.00 C ATOM 650 C PRO A 43 51.617 1.013 37.237 1.00 0.00 C ATOM 651 O PRO A 43 51.994 0.921 38.406 1.00 0.00 O ATOM 652 CB PRO A 43 51.588 -1.420 36.480 1.00 0.00 C ATOM 653 CG PRO A 43 52.148 -1.354 35.062 1.00 0.00 C ATOM 654 CD PRO A 43 51.009 -0.696 34.288 1.00 0.00 C ATOM 0 HA PRO A 43 49.936 -0.216 37.281 1.00 0.00 H new ATOM 0 HB2 PRO A 43 52.383 -1.473 37.224 1.00 0.00 H new ATOM 0 HB3 PRO A 43 50.958 -2.298 36.623 1.00 0.00 H new ATOM 0 HG2 PRO A 43 53.064 -0.765 35.014 1.00 0.00 H new ATOM 0 HG3 PRO A 43 52.385 -2.344 34.673 1.00 0.00 H new ATOM 0 HD2 PRO A 43 51.392 -0.118 33.447 1.00 0.00 H new ATOM 0 HD3 PRO A 43 50.332 -1.445 33.878 1.00 0.00 H new ATOM 662 N GLY A 44 51.919 2.076 36.481 1.00 0.00 N ATOM 663 CA GLY A 44 52.621 3.279 36.948 1.00 0.00 C ATOM 664 C GLY A 44 54.119 3.307 36.617 1.00 0.00 C ATOM 665 O GLY A 44 54.760 4.345 36.793 1.00 0.00 O ATOM 0 H GLY A 44 51.673 2.124 35.492 1.00 0.00 H new ATOM 0 HA2 GLY A 44 52.147 4.156 36.506 1.00 0.00 H new ATOM 0 HA3 GLY A 44 52.498 3.360 38.028 1.00 0.00 H new ATOM 669 N ARG A 45 54.678 2.189 36.130 1.00 0.00 N ATOM 670 CA ARG A 45 56.105 2.017 35.801 1.00 0.00 C ATOM 671 C ARG A 45 56.365 0.858 34.825 1.00 0.00 C ATOM 672 O ARG A 45 55.442 0.170 34.395 1.00 0.00 O ATOM 673 CB ARG A 45 56.911 1.837 37.101 1.00 0.00 C ATOM 674 CG ARG A 45 56.512 0.580 37.895 1.00 0.00 C ATOM 675 CD ARG A 45 57.642 0.186 38.845 1.00 0.00 C ATOM 676 NE ARG A 45 58.766 -0.432 38.120 1.00 0.00 N ATOM 677 CZ ARG A 45 60.014 -0.550 38.521 1.00 0.00 C ATOM 678 NH1 ARG A 45 60.423 -0.114 39.680 1.00 0.00 N ATOM 679 NH2 ARG A 45 60.876 -1.120 37.734 1.00 0.00 N ATOM 0 H ARG A 45 54.131 1.348 35.947 1.00 0.00 H new ATOM 0 HA ARG A 45 56.434 2.918 35.284 1.00 0.00 H new ATOM 0 HB2 ARG A 45 57.972 1.783 36.858 1.00 0.00 H new ATOM 0 HB3 ARG A 45 56.772 2.716 37.731 1.00 0.00 H new ATOM 0 HG2 ARG A 45 55.600 0.770 38.460 1.00 0.00 H new ATOM 0 HG3 ARG A 45 56.298 -0.241 37.210 1.00 0.00 H new ATOM 0 HD2 ARG A 45 57.994 1.068 39.380 1.00 0.00 H new ATOM 0 HD3 ARG A 45 57.264 -0.510 39.593 1.00 0.00 H new ATOM 0 HE ARG A 45 58.552 -0.813 37.199 1.00 0.00 H new ATOM 0 HH11 ARG A 45 59.766 0.339 40.315 1.00 0.00 H new ATOM 0 HH12 ARG A 45 61.400 -0.226 39.951 1.00 0.00 H new ATOM 0 HH21 ARG A 45 60.581 -1.468 36.821 1.00 0.00 H new ATOM 0 HH22 ARG A 45 61.847 -1.220 38.029 1.00 0.00 H new ATOM 693 N GLN A 46 57.643 0.635 34.518 1.00 0.00 N ATOM 694 CA GLN A 46 58.129 -0.359 33.548 1.00 0.00 C ATOM 695 C GLN A 46 58.736 -1.595 34.238 1.00 0.00 C ATOM 696 O GLN A 46 58.957 -1.594 35.454 1.00 0.00 O ATOM 697 CB GLN A 46 59.153 0.318 32.619 1.00 0.00 C ATOM 698 CG GLN A 46 58.576 1.557 31.912 1.00 0.00 C ATOM 699 CD GLN A 46 59.611 2.282 31.065 1.00 0.00 C ATOM 700 OE1 GLN A 46 60.392 1.699 30.325 1.00 0.00 O ATOM 701 NE2 GLN A 46 59.654 3.593 31.145 1.00 0.00 N ATOM 0 H GLN A 46 58.402 1.160 34.953 1.00 0.00 H new ATOM 0 HA GLN A 46 57.283 -0.722 32.964 1.00 0.00 H new ATOM 0 HB2 GLN A 46 60.029 0.609 33.199 1.00 0.00 H new ATOM 0 HB3 GLN A 46 59.490 -0.399 31.871 1.00 0.00 H new ATOM 0 HG2 GLN A 46 57.742 1.254 31.279 1.00 0.00 H new ATOM 0 HG3 GLN A 46 58.177 2.244 32.658 1.00 0.00 H new ATOM 0 HE21 GLN A 46 59.007 4.088 31.759 1.00 0.00 H new ATOM 0 HE22 GLN A 46 60.334 4.116 30.593 1.00 0.00 H new ATOM 710 N ARG A 47 59.014 -2.656 33.463 1.00 0.00 N ATOM 711 CA ARG A 47 59.479 -3.984 33.934 1.00 0.00 C ATOM 712 C ARG A 47 58.539 -4.591 34.994 1.00 0.00 C ATOM 713 O ARG A 47 58.975 -5.194 35.975 1.00 0.00 O ATOM 714 CB ARG A 47 60.959 -3.910 34.370 1.00 0.00 C ATOM 715 CG ARG A 47 61.894 -3.456 33.231 1.00 0.00 C ATOM 716 CD ARG A 47 63.348 -3.304 33.694 1.00 0.00 C ATOM 717 NE ARG A 47 63.945 -4.590 34.109 1.00 0.00 N ATOM 718 CZ ARG A 47 65.141 -4.767 34.645 1.00 0.00 C ATOM 719 NH1 ARG A 47 65.963 -3.777 34.850 1.00 0.00 N ATOM 720 NH2 ARG A 47 65.538 -5.959 34.989 1.00 0.00 N ATOM 0 H ARG A 47 58.919 -2.617 32.448 1.00 0.00 H new ATOM 0 HA ARG A 47 59.434 -4.685 33.101 1.00 0.00 H new ATOM 0 HB2 ARG A 47 61.052 -3.219 35.208 1.00 0.00 H new ATOM 0 HB3 ARG A 47 61.277 -4.889 34.727 1.00 0.00 H new ATOM 0 HG2 ARG A 47 61.848 -4.180 32.417 1.00 0.00 H new ATOM 0 HG3 ARG A 47 61.541 -2.505 32.832 1.00 0.00 H new ATOM 0 HD2 ARG A 47 63.941 -2.876 32.886 1.00 0.00 H new ATOM 0 HD3 ARG A 47 63.390 -2.602 34.527 1.00 0.00 H new ATOM 0 HE ARG A 47 63.378 -5.426 33.968 1.00 0.00 H new ATOM 0 HH11 ARG A 47 65.692 -2.828 34.595 1.00 0.00 H new ATOM 0 HH12 ARG A 47 66.878 -3.952 35.266 1.00 0.00 H new ATOM 0 HH21 ARG A 47 64.925 -6.762 34.845 1.00 0.00 H new ATOM 0 HH22 ARG A 47 66.461 -6.090 35.402 1.00 0.00 H new ATOM 734 N THR A 48 57.235 -4.377 34.795 1.00 0.00 N ATOM 735 CA THR A 48 56.140 -4.636 35.752 1.00 0.00 C ATOM 736 C THR A 48 54.902 -5.159 35.000 1.00 0.00 C ATOM 737 O THR A 48 54.636 -4.678 33.892 1.00 0.00 O ATOM 738 CB THR A 48 55.800 -3.310 36.467 1.00 0.00 C ATOM 739 OG1 THR A 48 56.935 -2.839 37.156 1.00 0.00 O ATOM 740 CG2 THR A 48 54.702 -3.378 37.525 1.00 0.00 C ATOM 0 H THR A 48 56.889 -3.997 33.914 1.00 0.00 H new ATOM 0 HA THR A 48 56.446 -5.387 36.480 1.00 0.00 H new ATOM 0 HB THR A 48 55.455 -2.669 35.656 1.00 0.00 H new ATOM 0 HG1 THR A 48 57.562 -2.439 36.518 1.00 0.00 H new ATOM 0 HG21 THR A 48 54.551 -2.389 37.957 1.00 0.00 H new ATOM 0 HG22 THR A 48 53.774 -3.718 37.065 1.00 0.00 H new ATOM 0 HG23 THR A 48 54.995 -4.076 38.309 1.00 0.00 H new ATOM 748 N PRO A 49 54.131 -6.125 35.547 1.00 0.00 N ATOM 749 CA PRO A 49 52.899 -6.613 34.921 1.00 0.00 C ATOM 750 C PRO A 49 51.796 -5.544 34.885 1.00 0.00 C ATOM 751 O PRO A 49 51.705 -4.694 35.772 1.00 0.00 O ATOM 752 CB PRO A 49 52.477 -7.844 35.727 1.00 0.00 C ATOM 753 CG PRO A 49 53.074 -7.585 37.108 1.00 0.00 C ATOM 754 CD PRO A 49 54.372 -6.845 36.793 1.00 0.00 C ATOM 0 HA PRO A 49 53.071 -6.866 33.875 1.00 0.00 H new ATOM 0 HB2 PRO A 49 51.392 -7.943 35.770 1.00 0.00 H new ATOM 0 HB3 PRO A 49 52.864 -8.764 35.288 1.00 0.00 H new ATOM 0 HG2 PRO A 49 52.408 -6.985 37.728 1.00 0.00 H new ATOM 0 HG3 PRO A 49 53.261 -8.514 37.647 1.00 0.00 H new ATOM 0 HD2 PRO A 49 54.634 -6.157 37.597 1.00 0.00 H new ATOM 0 HD3 PRO A 49 55.203 -7.542 36.686 1.00 0.00 H new ATOM 762 N VAL A 50 50.952 -5.591 33.851 1.00 0.00 N ATOM 763 CA VAL A 50 49.793 -4.687 33.675 1.00 0.00 C ATOM 764 C VAL A 50 48.711 -4.971 34.739 1.00 0.00 C ATOM 765 O VAL A 50 48.715 -6.037 35.352 1.00 0.00 O ATOM 766 CB VAL A 50 49.222 -4.813 32.243 1.00 0.00 C ATOM 767 CG1 VAL A 50 48.209 -3.708 31.902 1.00 0.00 C ATOM 768 CG2 VAL A 50 50.319 -4.710 31.173 1.00 0.00 C ATOM 0 H VAL A 50 51.050 -6.268 33.094 1.00 0.00 H new ATOM 0 HA VAL A 50 50.130 -3.660 33.813 1.00 0.00 H new ATOM 0 HB VAL A 50 48.743 -5.792 32.235 1.00 0.00 H new ATOM 0 HG11 VAL A 50 47.844 -3.850 30.885 1.00 0.00 H new ATOM 0 HG12 VAL A 50 47.371 -3.755 32.598 1.00 0.00 H new ATOM 0 HG13 VAL A 50 48.692 -2.734 31.981 1.00 0.00 H new ATOM 0 HG21 VAL A 50 49.872 -4.804 30.183 1.00 0.00 H new ATOM 0 HG22 VAL A 50 50.818 -3.745 31.256 1.00 0.00 H new ATOM 0 HG23 VAL A 50 51.046 -5.508 31.320 1.00 0.00 H new ATOM 778 N THR A 51 47.757 -4.056 34.942 1.00 0.00 N ATOM 779 CA THR A 51 46.675 -4.195 35.940 1.00 0.00 C ATOM 780 C THR A 51 45.314 -3.829 35.322 1.00 0.00 C ATOM 781 O THR A 51 45.250 -3.210 34.257 1.00 0.00 O ATOM 782 CB THR A 51 46.978 -3.325 37.185 1.00 0.00 C ATOM 783 OG1 THR A 51 48.318 -3.495 37.605 1.00 0.00 O ATOM 784 CG2 THR A 51 46.123 -3.662 38.413 1.00 0.00 C ATOM 0 H THR A 51 47.708 -3.185 34.414 1.00 0.00 H new ATOM 0 HA THR A 51 46.625 -5.236 36.258 1.00 0.00 H new ATOM 0 HB THR A 51 46.759 -2.310 36.854 1.00 0.00 H new ATOM 0 HG1 THR A 51 48.488 -2.935 38.391 1.00 0.00 H new ATOM 0 HG21 THR A 51 46.399 -3.007 39.239 1.00 0.00 H new ATOM 0 HG22 THR A 51 45.069 -3.519 38.173 1.00 0.00 H new ATOM 0 HG23 THR A 51 46.292 -4.700 38.700 1.00 0.00 H new ATOM 792 N VAL A 52 44.208 -4.179 35.986 1.00 0.00 N ATOM 793 CA VAL A 52 42.853 -3.707 35.634 1.00 0.00 C ATOM 794 C VAL A 52 42.145 -3.058 36.823 1.00 0.00 C ATOM 795 O VAL A 52 42.268 -3.514 37.961 1.00 0.00 O ATOM 796 CB VAL A 52 41.966 -4.816 35.027 1.00 0.00 C ATOM 797 CG1 VAL A 52 42.450 -5.191 33.624 1.00 0.00 C ATOM 798 CG2 VAL A 52 41.886 -6.086 35.883 1.00 0.00 C ATOM 0 H VAL A 52 44.222 -4.804 36.792 1.00 0.00 H new ATOM 0 HA VAL A 52 43.002 -2.950 34.864 1.00 0.00 H new ATOM 0 HB VAL A 52 40.963 -4.391 34.986 1.00 0.00 H new ATOM 0 HG11 VAL A 52 41.811 -5.974 33.216 1.00 0.00 H new ATOM 0 HG12 VAL A 52 42.408 -4.314 32.978 1.00 0.00 H new ATOM 0 HG13 VAL A 52 43.477 -5.553 33.678 1.00 0.00 H new ATOM 0 HG21 VAL A 52 41.245 -6.817 35.390 1.00 0.00 H new ATOM 0 HG22 VAL A 52 42.885 -6.504 36.008 1.00 0.00 H new ATOM 0 HG23 VAL A 52 41.471 -5.840 36.861 1.00 0.00 H new ATOM 808 N SER A 53 41.372 -2.011 36.539 1.00 0.00 N ATOM 809 CA SER A 53 40.622 -1.194 37.508 1.00 0.00 C ATOM 810 C SER A 53 39.296 -0.727 36.882 1.00 0.00 C ATOM 811 O SER A 53 39.153 -0.819 35.659 1.00 0.00 O ATOM 812 CB SER A 53 41.455 0.035 37.916 1.00 0.00 C ATOM 813 OG SER A 53 42.614 -0.350 38.641 1.00 0.00 O ATOM 0 H SER A 53 41.241 -1.688 35.580 1.00 0.00 H new ATOM 0 HA SER A 53 40.414 -1.798 38.391 1.00 0.00 H new ATOM 0 HB2 SER A 53 41.748 0.592 37.026 1.00 0.00 H new ATOM 0 HB3 SER A 53 40.847 0.704 38.525 1.00 0.00 H new ATOM 0 HG SER A 53 43.126 0.448 38.887 1.00 0.00 H new ATOM 819 N PRO A 54 38.310 -0.231 37.656 1.00 0.00 N ATOM 820 CA PRO A 54 37.070 0.316 37.101 1.00 0.00 C ATOM 821 C PRO A 54 37.303 1.374 36.013 1.00 0.00 C ATOM 822 O PRO A 54 38.212 2.200 36.131 1.00 0.00 O ATOM 823 CB PRO A 54 36.283 0.870 38.293 1.00 0.00 C ATOM 824 CG PRO A 54 36.795 0.032 39.462 1.00 0.00 C ATOM 825 CD PRO A 54 38.268 -0.174 39.110 1.00 0.00 C ATOM 0 HA PRO A 54 36.511 -0.464 36.584 1.00 0.00 H new ATOM 0 HB2 PRO A 54 36.474 1.932 38.444 1.00 0.00 H new ATOM 0 HB3 PRO A 54 35.208 0.756 38.155 1.00 0.00 H new ATOM 0 HG2 PRO A 54 36.675 0.549 40.414 1.00 0.00 H new ATOM 0 HG3 PRO A 54 36.262 -0.915 39.545 1.00 0.00 H new ATOM 0 HD2 PRO A 54 38.881 0.643 39.490 1.00 0.00 H new ATOM 0 HD3 PRO A 54 38.653 -1.093 39.551 1.00 0.00 H new ATOM 833 N LEU A 55 36.497 1.349 34.945 1.00 0.00 N ATOM 834 CA LEU A 55 36.610 2.314 33.846 1.00 0.00 C ATOM 835 C LEU A 55 36.286 3.741 34.328 1.00 0.00 C ATOM 836 O LEU A 55 35.189 4.016 34.818 1.00 0.00 O ATOM 837 CB LEU A 55 35.703 1.897 32.669 1.00 0.00 C ATOM 838 CG LEU A 55 35.773 2.837 31.446 1.00 0.00 C ATOM 839 CD1 LEU A 55 37.154 2.912 30.788 1.00 0.00 C ATOM 840 CD2 LEU A 55 34.782 2.375 30.378 1.00 0.00 C ATOM 0 H LEU A 55 35.752 0.663 34.819 1.00 0.00 H new ATOM 0 HA LEU A 55 37.641 2.316 33.493 1.00 0.00 H new ATOM 0 HB2 LEU A 55 35.977 0.890 32.354 1.00 0.00 H new ATOM 0 HB3 LEU A 55 34.672 1.852 33.019 1.00 0.00 H new ATOM 0 HG LEU A 55 35.534 3.828 31.833 1.00 0.00 H new ATOM 0 HD11 LEU A 55 37.116 3.593 29.938 1.00 0.00 H new ATOM 0 HD12 LEU A 55 37.883 3.276 31.512 1.00 0.00 H new ATOM 0 HD13 LEU A 55 37.448 1.920 30.445 1.00 0.00 H new ATOM 0 HD21 LEU A 55 34.836 3.042 29.518 1.00 0.00 H new ATOM 0 HD22 LEU A 55 35.030 1.360 30.066 1.00 0.00 H new ATOM 0 HD23 LEU A 55 33.772 2.392 30.787 1.00 0.00 H new ATOM 852 N ASP A 56 37.236 4.650 34.125 1.00 0.00 N ATOM 853 CA ASP A 56 37.135 6.086 34.410 1.00 0.00 C ATOM 854 C ASP A 56 37.688 6.949 33.255 1.00 0.00 C ATOM 855 O ASP A 56 37.266 8.094 33.084 1.00 0.00 O ATOM 856 CB ASP A 56 37.883 6.371 35.721 1.00 0.00 C ATOM 857 CG ASP A 56 37.752 7.838 36.162 1.00 0.00 C ATOM 858 OD1 ASP A 56 36.651 8.241 36.609 1.00 0.00 O ATOM 859 OD2 ASP A 56 38.759 8.582 36.091 1.00 0.00 O ATOM 0 H ASP A 56 38.145 4.396 33.738 1.00 0.00 H new ATOM 0 HA ASP A 56 36.084 6.355 34.512 1.00 0.00 H new ATOM 0 HB2 ASP A 56 37.495 5.722 36.506 1.00 0.00 H new ATOM 0 HB3 ASP A 56 38.937 6.125 35.596 1.00 0.00 H new ATOM 864 N GLY A 57 38.586 6.399 32.424 1.00 0.00 N ATOM 865 CA GLY A 57 39.107 7.076 31.227 1.00 0.00 C ATOM 866 C GLY A 57 40.234 8.083 31.506 1.00 0.00 C ATOM 867 O GLY A 57 40.507 8.950 30.673 1.00 0.00 O ATOM 0 H GLY A 57 38.974 5.466 32.565 1.00 0.00 H new ATOM 0 HA2 GLY A 57 39.474 6.323 30.530 1.00 0.00 H new ATOM 0 HA3 GLY A 57 38.286 7.596 30.732 1.00 0.00 H new ATOM 871 N SER A 58 40.880 7.982 32.674 1.00 0.00 N ATOM 872 CA SER A 58 42.087 8.731 33.044 1.00 0.00 C ATOM 873 C SER A 58 43.257 8.454 32.085 1.00 0.00 C ATOM 874 O SER A 58 43.248 7.493 31.313 1.00 0.00 O ATOM 875 CB SER A 58 42.458 8.367 34.489 1.00 0.00 C ATOM 876 OG SER A 58 43.574 9.111 34.949 1.00 0.00 O ATOM 0 H SER A 58 40.565 7.354 33.414 1.00 0.00 H new ATOM 0 HA SER A 58 41.880 9.798 32.969 1.00 0.00 H new ATOM 0 HB2 SER A 58 41.604 8.552 35.141 1.00 0.00 H new ATOM 0 HB3 SER A 58 42.681 7.302 34.550 1.00 0.00 H new ATOM 0 HG SER A 58 43.780 8.854 35.872 1.00 0.00 H new ATOM 882 N SER A 59 44.313 9.259 32.173 1.00 0.00 N ATOM 883 CA SER A 59 45.580 9.062 31.444 1.00 0.00 C ATOM 884 C SER A 59 46.270 7.723 31.759 1.00 0.00 C ATOM 885 O SER A 59 47.027 7.210 30.934 1.00 0.00 O ATOM 886 CB SER A 59 46.536 10.229 31.717 1.00 0.00 C ATOM 887 OG SER A 59 46.800 10.353 33.107 1.00 0.00 O ATOM 0 H SER A 59 44.320 10.089 32.766 1.00 0.00 H new ATOM 0 HA SER A 59 45.323 9.032 30.385 1.00 0.00 H new ATOM 0 HB2 SER A 59 47.470 10.073 31.178 1.00 0.00 H new ATOM 0 HB3 SER A 59 46.102 11.156 31.341 1.00 0.00 H new ATOM 0 HG SER A 59 47.413 11.102 33.258 1.00 0.00 H new ATOM 893 N GLU A 60 45.964 7.112 32.910 1.00 0.00 N ATOM 894 CA GLU A 60 46.386 5.754 33.288 1.00 0.00 C ATOM 895 C GLU A 60 45.585 4.642 32.577 1.00 0.00 C ATOM 896 O GLU A 60 45.959 3.476 32.662 1.00 0.00 O ATOM 897 CB GLU A 60 46.267 5.583 34.814 1.00 0.00 C ATOM 898 CG GLU A 60 47.148 6.572 35.592 1.00 0.00 C ATOM 899 CD GLU A 60 47.061 6.331 37.112 1.00 0.00 C ATOM 900 OE1 GLU A 60 46.022 6.674 37.729 1.00 0.00 O ATOM 901 OE2 GLU A 60 48.040 5.819 37.707 1.00 0.00 O ATOM 0 H GLU A 60 45.397 7.562 33.629 1.00 0.00 H new ATOM 0 HA GLU A 60 47.422 5.646 32.967 1.00 0.00 H new ATOM 0 HB2 GLU A 60 45.227 5.718 35.111 1.00 0.00 H new ATOM 0 HB3 GLU A 60 46.546 4.564 35.084 1.00 0.00 H new ATOM 0 HG2 GLU A 60 48.183 6.473 35.266 1.00 0.00 H new ATOM 0 HG3 GLU A 60 46.838 7.592 35.366 1.00 0.00 H new ATOM 908 N GLN A 61 44.500 4.980 31.870 1.00 0.00 N ATOM 909 CA GLN A 61 43.607 4.045 31.162 1.00 0.00 C ATOM 910 C GLN A 61 43.432 4.377 29.672 1.00 0.00 C ATOM 911 O GLN A 61 42.794 3.615 28.944 1.00 0.00 O ATOM 912 CB GLN A 61 42.227 4.030 31.835 1.00 0.00 C ATOM 913 CG GLN A 61 42.281 3.520 33.277 1.00 0.00 C ATOM 914 CD GLN A 61 40.890 3.328 33.866 1.00 0.00 C ATOM 915 OE1 GLN A 61 39.945 4.047 33.566 1.00 0.00 O ATOM 916 NE2 GLN A 61 40.714 2.348 34.719 1.00 0.00 N ATOM 0 H GLN A 61 44.205 5.951 31.769 1.00 0.00 H new ATOM 0 HA GLN A 61 44.081 3.065 31.222 1.00 0.00 H new ATOM 0 HB2 GLN A 61 41.811 5.037 31.825 1.00 0.00 H new ATOM 0 HB3 GLN A 61 41.551 3.401 31.256 1.00 0.00 H new ATOM 0 HG2 GLN A 61 42.821 2.574 33.307 1.00 0.00 H new ATOM 0 HG3 GLN A 61 42.840 4.226 33.891 1.00 0.00 H new ATOM 0 HE21 GLN A 61 41.497 1.746 34.973 1.00 0.00 H new ATOM 0 HE22 GLN A 61 39.794 2.188 35.129 1.00 0.00 H new ATOM 925 N ALA A 62 43.989 5.497 29.210 1.00 0.00 N ATOM 926 CA ALA A 62 44.078 5.849 27.800 1.00 0.00 C ATOM 927 C ALA A 62 45.372 5.282 27.189 1.00 0.00 C ATOM 928 O ALA A 62 46.455 5.368 27.777 1.00 0.00 O ATOM 929 CB ALA A 62 44.012 7.375 27.684 1.00 0.00 C ATOM 0 H ALA A 62 44.400 6.200 29.825 1.00 0.00 H new ATOM 0 HA ALA A 62 43.249 5.414 27.242 1.00 0.00 H new ATOM 0 HB1 ALA A 62 44.077 7.663 26.635 1.00 0.00 H new ATOM 0 HB2 ALA A 62 43.070 7.731 28.101 1.00 0.00 H new ATOM 0 HB3 ALA A 62 44.842 7.818 28.234 1.00 0.00 H new ATOM 935 N TRP A 63 45.259 4.744 25.978 1.00 0.00 N ATOM 936 CA TRP A 63 46.320 4.045 25.253 1.00 0.00 C ATOM 937 C TRP A 63 46.411 4.561 23.809 1.00 0.00 C ATOM 938 O TRP A 63 45.571 5.343 23.361 1.00 0.00 O ATOM 939 CB TRP A 63 46.027 2.531 25.302 1.00 0.00 C ATOM 940 CG TRP A 63 45.892 1.943 26.680 1.00 0.00 C ATOM 941 CD1 TRP A 63 44.751 1.866 27.400 1.00 0.00 C ATOM 942 CD2 TRP A 63 46.931 1.390 27.542 1.00 0.00 C ATOM 943 NE1 TRP A 63 45.013 1.334 28.649 1.00 0.00 N ATOM 944 CE2 TRP A 63 46.351 1.046 28.800 1.00 0.00 C ATOM 945 CE3 TRP A 63 48.312 1.155 27.391 1.00 0.00 C ATOM 946 CZ2 TRP A 63 47.107 0.524 29.859 1.00 0.00 C ATOM 947 CZ3 TRP A 63 49.088 0.654 28.452 1.00 0.00 C ATOM 948 CH2 TRP A 63 48.487 0.333 29.684 1.00 0.00 C ATOM 0 H TRP A 63 44.387 4.784 25.450 1.00 0.00 H new ATOM 0 HA TRP A 63 47.287 4.234 25.719 1.00 0.00 H new ATOM 0 HB2 TRP A 63 45.106 2.339 24.752 1.00 0.00 H new ATOM 0 HB3 TRP A 63 46.826 2.007 24.779 1.00 0.00 H new ATOM 0 HD1 TRP A 63 43.777 2.175 27.051 1.00 0.00 H new ATOM 0 HE1 TRP A 63 44.306 1.175 29.367 1.00 0.00 H new ATOM 0 HE3 TRP A 63 48.784 1.364 26.442 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 46.634 0.272 30.797 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 50.151 0.515 28.321 1.00 0.00 H new ATOM 0 HH2 TRP A 63 49.086 -0.059 30.493 1.00 0.00 H new ATOM 959 N ILE A 64 47.410 4.105 23.058 1.00 0.00 N ATOM 960 CA ILE A 64 47.547 4.328 21.615 1.00 0.00 C ATOM 961 C ILE A 64 47.778 2.997 20.897 1.00 0.00 C ATOM 962 O ILE A 64 48.339 2.062 21.473 1.00 0.00 O ATOM 963 CB ILE A 64 48.661 5.352 21.275 1.00 0.00 C ATOM 964 CG1 ILE A 64 50.070 4.901 21.719 1.00 0.00 C ATOM 965 CG2 ILE A 64 48.320 6.725 21.874 1.00 0.00 C ATOM 966 CD1 ILE A 64 51.206 5.779 21.175 1.00 0.00 C ATOM 0 H ILE A 64 48.173 3.551 23.447 1.00 0.00 H new ATOM 0 HA ILE A 64 46.613 4.763 21.259 1.00 0.00 H new ATOM 0 HB ILE A 64 48.695 5.423 20.188 1.00 0.00 H new ATOM 0 HG12 ILE A 64 50.114 4.901 22.808 1.00 0.00 H new ATOM 0 HG13 ILE A 64 50.231 3.873 21.393 1.00 0.00 H new ATOM 0 HG21 ILE A 64 49.110 7.435 21.629 1.00 0.00 H new ATOM 0 HG22 ILE A 64 47.374 7.077 21.462 1.00 0.00 H new ATOM 0 HG23 ILE A 64 48.234 6.638 22.957 1.00 0.00 H new ATOM 0 HD11 ILE A 64 52.163 5.398 21.531 1.00 0.00 H new ATOM 0 HD12 ILE A 64 51.191 5.760 20.085 1.00 0.00 H new ATOM 0 HD13 ILE A 64 51.072 6.804 21.522 1.00 0.00 H new ATOM 978 N LEU A 65 47.379 2.947 19.627 1.00 0.00 N ATOM 979 CA LEU A 65 47.596 1.833 18.706 1.00 0.00 C ATOM 980 C LEU A 65 48.325 2.373 17.473 1.00 0.00 C ATOM 981 O LEU A 65 47.907 3.383 16.900 1.00 0.00 O ATOM 982 CB LEU A 65 46.250 1.195 18.298 1.00 0.00 C ATOM 983 CG LEU A 65 45.400 0.607 19.439 1.00 0.00 C ATOM 984 CD1 LEU A 65 44.107 0.012 18.877 1.00 0.00 C ATOM 985 CD2 LEU A 65 46.120 -0.501 20.204 1.00 0.00 C ATOM 0 H LEU A 65 46.872 3.718 19.192 1.00 0.00 H new ATOM 0 HA LEU A 65 48.194 1.061 19.190 1.00 0.00 H new ATOM 0 HB2 LEU A 65 45.656 1.950 17.783 1.00 0.00 H new ATOM 0 HB3 LEU A 65 46.452 0.402 17.578 1.00 0.00 H new ATOM 0 HG LEU A 65 45.199 1.432 20.123 1.00 0.00 H new ATOM 0 HD11 LEU A 65 43.513 -0.401 19.692 1.00 0.00 H new ATOM 0 HD12 LEU A 65 43.537 0.792 18.372 1.00 0.00 H new ATOM 0 HD13 LEU A 65 44.349 -0.779 18.167 1.00 0.00 H new ATOM 0 HD21 LEU A 65 45.472 -0.877 20.996 1.00 0.00 H new ATOM 0 HD22 LEU A 65 46.367 -1.314 19.521 1.00 0.00 H new ATOM 0 HD23 LEU A 65 47.036 -0.105 20.642 1.00 0.00 H new ATOM 997 N ARG A 66 49.411 1.706 17.069 1.00 0.00 N ATOM 998 CA ARG A 66 50.252 2.076 15.913 1.00 0.00 C ATOM 999 C ARG A 66 50.601 0.822 15.111 1.00 0.00 C ATOM 1000 O ARG A 66 50.999 -0.193 15.683 1.00 0.00 O ATOM 1001 CB ARG A 66 51.532 2.796 16.392 1.00 0.00 C ATOM 1002 CG ARG A 66 51.306 4.083 17.210 1.00 0.00 C ATOM 1003 CD ARG A 66 50.655 5.210 16.397 1.00 0.00 C ATOM 1004 NE ARG A 66 50.309 6.369 17.247 1.00 0.00 N ATOM 1005 CZ ARG A 66 51.092 7.375 17.598 1.00 0.00 C ATOM 1006 NH1 ARG A 66 52.339 7.452 17.227 1.00 0.00 N ATOM 1007 NH2 ARG A 66 50.631 8.335 18.347 1.00 0.00 N ATOM 0 H ARG A 66 49.744 0.869 17.547 1.00 0.00 H new ATOM 0 HA ARG A 66 49.700 2.761 15.269 1.00 0.00 H new ATOM 0 HB2 ARG A 66 52.114 2.100 16.996 1.00 0.00 H new ATOM 0 HB3 ARG A 66 52.137 3.043 15.519 1.00 0.00 H new ATOM 0 HG2 ARG A 66 50.676 3.853 18.070 1.00 0.00 H new ATOM 0 HG3 ARG A 66 52.263 4.431 17.600 1.00 0.00 H new ATOM 0 HD2 ARG A 66 51.335 5.528 15.607 1.00 0.00 H new ATOM 0 HD3 ARG A 66 49.755 4.834 15.910 1.00 0.00 H new ATOM 0 HE ARG A 66 49.354 6.396 17.605 1.00 0.00 H new ATOM 0 HH11 ARG A 66 52.744 6.719 16.644 1.00 0.00 H new ATOM 0 HH12 ARG A 66 52.910 8.245 17.519 1.00 0.00 H new ATOM 0 HH21 ARG A 66 49.662 8.313 18.665 1.00 0.00 H new ATOM 0 HH22 ARG A 66 51.239 9.109 18.615 1.00 0.00 H new ATOM 1021 N SER A 67 50.380 0.862 13.797 1.00 0.00 N ATOM 1022 CA SER A 67 50.504 -0.318 12.928 1.00 0.00 C ATOM 1023 C SER A 67 51.943 -0.847 12.867 1.00 0.00 C ATOM 1024 O SER A 67 52.903 -0.069 12.871 1.00 0.00 O ATOM 1025 CB SER A 67 50.014 0.025 11.516 1.00 0.00 C ATOM 1026 OG SER A 67 49.991 -1.136 10.703 1.00 0.00 O ATOM 0 H SER A 67 50.110 1.711 13.301 1.00 0.00 H new ATOM 0 HA SER A 67 49.886 -1.107 13.356 1.00 0.00 H new ATOM 0 HB2 SER A 67 49.016 0.460 11.567 1.00 0.00 H new ATOM 0 HB3 SER A 67 50.667 0.775 11.070 1.00 0.00 H new ATOM 0 HG SER A 67 49.675 -0.901 9.806 1.00 0.00 H new ATOM 1032 N TYR A 68 52.086 -2.171 12.752 1.00 0.00 N ATOM 1033 CA TYR A 68 53.357 -2.843 12.463 1.00 0.00 C ATOM 1034 C TYR A 68 53.234 -3.758 11.231 1.00 0.00 C ATOM 1035 O TYR A 68 54.098 -3.711 10.352 1.00 0.00 O ATOM 1036 CB TYR A 68 53.836 -3.614 13.702 1.00 0.00 C ATOM 1037 CG TYR A 68 55.117 -4.392 13.451 1.00 0.00 C ATOM 1038 CD1 TYR A 68 56.373 -3.783 13.652 1.00 0.00 C ATOM 1039 CD2 TYR A 68 55.048 -5.708 12.950 1.00 0.00 C ATOM 1040 CE1 TYR A 68 57.557 -4.478 13.327 1.00 0.00 C ATOM 1041 CE2 TYR A 68 56.226 -6.395 12.605 1.00 0.00 C ATOM 1042 CZ TYR A 68 57.484 -5.779 12.781 1.00 0.00 C ATOM 1043 OH TYR A 68 58.619 -6.448 12.439 1.00 0.00 O ATOM 0 H TYR A 68 51.306 -2.819 12.859 1.00 0.00 H new ATOM 0 HA TYR A 68 54.107 -2.089 12.223 1.00 0.00 H new ATOM 0 HB2 TYR A 68 53.996 -2.913 14.521 1.00 0.00 H new ATOM 0 HB3 TYR A 68 53.054 -4.303 14.021 1.00 0.00 H new ATOM 0 HD1 TYR A 68 56.429 -2.783 14.055 1.00 0.00 H new ATOM 0 HD2 TYR A 68 54.089 -6.190 12.831 1.00 0.00 H new ATOM 0 HE1 TYR A 68 58.518 -4.016 13.495 1.00 0.00 H new ATOM 0 HE2 TYR A 68 56.168 -7.396 12.204 1.00 0.00 H new ATOM 0 HH TYR A 68 58.384 -7.329 12.080 1.00 0.00 H new ATOM 1053 N ASP A 69 52.146 -4.531 11.117 1.00 0.00 N ATOM 1054 CA ASP A 69 51.839 -5.306 9.907 1.00 0.00 C ATOM 1055 C ASP A 69 50.326 -5.512 9.715 1.00 0.00 C ATOM 1056 O ASP A 69 49.696 -6.366 10.345 1.00 0.00 O ATOM 1057 CB ASP A 69 52.597 -6.647 9.902 1.00 0.00 C ATOM 1058 CG ASP A 69 52.420 -7.406 8.576 1.00 0.00 C ATOM 1059 OD1 ASP A 69 52.049 -6.779 7.555 1.00 0.00 O ATOM 1060 OD2 ASP A 69 52.663 -8.635 8.552 1.00 0.00 O ATOM 0 H ASP A 69 51.455 -4.637 11.860 1.00 0.00 H new ATOM 0 HA ASP A 69 52.185 -4.721 9.055 1.00 0.00 H new ATOM 0 HB2 ASP A 69 53.657 -6.464 10.076 1.00 0.00 H new ATOM 0 HB3 ASP A 69 52.241 -7.267 10.725 1.00 0.00 H new ATOM 1065 N SER A 70 49.743 -4.732 8.805 1.00 0.00 N ATOM 1066 CA SER A 70 48.335 -4.798 8.387 1.00 0.00 C ATOM 1067 C SER A 70 47.961 -6.090 7.654 1.00 0.00 C ATOM 1068 O SER A 70 46.793 -6.476 7.618 1.00 0.00 O ATOM 1069 CB SER A 70 48.036 -3.605 7.477 1.00 0.00 C ATOM 1070 OG SER A 70 48.938 -3.565 6.382 1.00 0.00 O ATOM 0 H SER A 70 50.260 -4.002 8.314 1.00 0.00 H new ATOM 0 HA SER A 70 47.737 -4.776 9.298 1.00 0.00 H new ATOM 0 HB2 SER A 70 47.013 -3.671 7.108 1.00 0.00 H new ATOM 0 HB3 SER A 70 48.110 -2.679 8.048 1.00 0.00 H new ATOM 0 HG SER A 70 48.727 -2.796 5.813 1.00 0.00 H new ATOM 1076 N ASN A 71 48.945 -6.807 7.110 1.00 0.00 N ATOM 1077 CA ASN A 71 48.781 -8.154 6.566 1.00 0.00 C ATOM 1078 C ASN A 71 48.669 -9.238 7.657 1.00 0.00 C ATOM 1079 O ASN A 71 48.342 -10.383 7.344 1.00 0.00 O ATOM 1080 CB ASN A 71 49.947 -8.440 5.613 1.00 0.00 C ATOM 1081 CG ASN A 71 50.082 -7.396 4.527 1.00 0.00 C ATOM 1082 OD1 ASN A 71 49.144 -7.100 3.796 1.00 0.00 O ATOM 1083 ND2 ASN A 71 51.242 -6.808 4.393 1.00 0.00 N ATOM 0 H ASN A 71 49.901 -6.458 7.034 1.00 0.00 H new ATOM 0 HA ASN A 71 47.835 -8.192 6.025 1.00 0.00 H new ATOM 0 HB2 ASN A 71 50.874 -8.487 6.184 1.00 0.00 H new ATOM 0 HB3 ASN A 71 49.805 -9.419 5.155 1.00 0.00 H new ATOM 0 HD21 ASN A 71 51.373 -6.096 3.675 1.00 0.00 H new ATOM 0 HD22 ASN A 71 52.016 -7.062 5.007 1.00 0.00 H new ATOM 1090 N SER A 72 48.897 -8.881 8.928 1.00 0.00 N ATOM 1091 CA SER A 72 48.754 -9.769 10.095 1.00 0.00 C ATOM 1092 C SER A 72 47.875 -9.171 11.211 1.00 0.00 C ATOM 1093 O SER A 72 47.750 -9.765 12.284 1.00 0.00 O ATOM 1094 CB SER A 72 50.151 -10.144 10.612 1.00 0.00 C ATOM 1095 OG SER A 72 50.101 -11.287 11.451 1.00 0.00 O ATOM 0 H SER A 72 49.195 -7.939 9.183 1.00 0.00 H new ATOM 0 HA SER A 72 48.229 -10.668 9.772 1.00 0.00 H new ATOM 0 HB2 SER A 72 50.813 -10.338 9.768 1.00 0.00 H new ATOM 0 HB3 SER A 72 50.575 -9.304 11.163 1.00 0.00 H new ATOM 0 HG SER A 72 49.312 -11.234 12.029 1.00 0.00 H new ATOM 1101 N ASN A 73 47.250 -8.010 10.968 1.00 0.00 N ATOM 1102 CA ASN A 73 46.462 -7.231 11.936 1.00 0.00 C ATOM 1103 C ASN A 73 47.193 -6.948 13.268 1.00 0.00 C ATOM 1104 O ASN A 73 46.574 -6.887 14.335 1.00 0.00 O ATOM 1105 CB ASN A 73 45.086 -7.893 12.109 1.00 0.00 C ATOM 1106 CG ASN A 73 44.090 -7.021 12.857 1.00 0.00 C ATOM 1107 OD1 ASN A 73 44.131 -5.795 12.832 1.00 0.00 O ATOM 1108 ND2 ASN A 73 43.176 -7.621 13.580 1.00 0.00 N ATOM 0 H ASN A 73 47.281 -7.568 10.049 1.00 0.00 H new ATOM 0 HA ASN A 73 46.316 -6.231 11.529 1.00 0.00 H new ATOM 0 HB2 ASN A 73 44.681 -8.135 11.127 1.00 0.00 H new ATOM 0 HB3 ASN A 73 45.208 -8.835 12.644 1.00 0.00 H new ATOM 0 HD21 ASN A 73 42.506 -7.069 14.116 1.00 0.00 H new ATOM 0 HD22 ASN A 73 43.135 -8.640 13.607 1.00 0.00 H new ATOM 1115 N THR A 74 48.517 -6.792 13.207 1.00 0.00 N ATOM 1116 CA THR A 74 49.379 -6.580 14.382 1.00 0.00 C ATOM 1117 C THR A 74 49.850 -5.136 14.526 1.00 0.00 C ATOM 1118 O THR A 74 50.271 -4.485 13.562 1.00 0.00 O ATOM 1119 CB THR A 74 50.594 -7.520 14.417 1.00 0.00 C ATOM 1120 OG1 THR A 74 51.169 -7.696 13.142 1.00 0.00 O ATOM 1121 CG2 THR A 74 50.197 -8.892 14.954 1.00 0.00 C ATOM 0 H THR A 74 49.033 -6.809 12.327 1.00 0.00 H new ATOM 0 HA THR A 74 48.738 -6.818 15.231 1.00 0.00 H new ATOM 0 HB THR A 74 51.327 -7.050 15.073 1.00 0.00 H new ATOM 0 HG1 THR A 74 51.939 -8.299 13.211 1.00 0.00 H new ATOM 0 HG21 THR A 74 51.071 -9.543 14.971 1.00 0.00 H new ATOM 0 HG22 THR A 74 49.803 -8.787 15.965 1.00 0.00 H new ATOM 0 HG23 THR A 74 49.433 -9.327 14.310 1.00 0.00 H new ATOM 1129 N TRP A 75 49.811 -4.666 15.772 1.00 0.00 N ATOM 1130 CA TRP A 75 50.031 -3.281 16.187 1.00 0.00 C ATOM 1131 C TRP A 75 50.865 -3.251 17.475 1.00 0.00 C ATOM 1132 O TRP A 75 50.840 -4.205 18.257 1.00 0.00 O ATOM 1133 CB TRP A 75 48.668 -2.612 16.474 1.00 0.00 C ATOM 1134 CG TRP A 75 47.586 -2.729 15.436 1.00 0.00 C ATOM 1135 CD1 TRP A 75 46.873 -3.848 15.174 1.00 0.00 C ATOM 1136 CD2 TRP A 75 47.037 -1.707 14.546 1.00 0.00 C ATOM 1137 NE1 TRP A 75 45.932 -3.600 14.199 1.00 0.00 N ATOM 1138 CE2 TRP A 75 46.043 -2.312 13.716 1.00 0.00 C ATOM 1139 CE3 TRP A 75 47.275 -0.329 14.356 1.00 0.00 C ATOM 1140 CZ2 TRP A 75 45.396 -1.610 12.688 1.00 0.00 C ATOM 1141 CZ3 TRP A 75 46.631 0.389 13.330 1.00 0.00 C ATOM 1142 CH2 TRP A 75 45.713 -0.256 12.482 1.00 0.00 C ATOM 0 H TRP A 75 49.614 -5.277 16.565 1.00 0.00 H new ATOM 0 HA TRP A 75 50.555 -2.751 15.392 1.00 0.00 H new ATOM 0 HB2 TRP A 75 48.283 -3.028 17.405 1.00 0.00 H new ATOM 0 HB3 TRP A 75 48.848 -1.551 16.649 1.00 0.00 H new ATOM 0 HD1 TRP A 75 47.020 -4.801 15.660 1.00 0.00 H new ATOM 0 HE1 TRP A 75 45.243 -4.280 13.876 1.00 0.00 H new ATOM 0 HE3 TRP A 75 47.964 0.185 15.010 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 44.665 -2.103 12.064 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 46.843 1.439 13.194 1.00 0.00 H new ATOM 0 HH2 TRP A 75 45.251 0.289 11.672 1.00 0.00 H new ATOM 1153 N THR A 76 51.566 -2.150 17.730 1.00 0.00 N ATOM 1154 CA THR A 76 52.200 -1.889 19.035 1.00 0.00 C ATOM 1155 C THR A 76 51.218 -1.100 19.918 1.00 0.00 C ATOM 1156 O THR A 76 50.321 -0.417 19.408 1.00 0.00 O ATOM 1157 CB THR A 76 53.533 -1.131 18.886 1.00 0.00 C ATOM 1158 OG1 THR A 76 53.338 0.122 18.273 1.00 0.00 O ATOM 1159 CG2 THR A 76 54.557 -1.898 18.039 1.00 0.00 C ATOM 0 H THR A 76 51.715 -1.410 17.044 1.00 0.00 H new ATOM 0 HA THR A 76 52.434 -2.844 19.506 1.00 0.00 H new ATOM 0 HB THR A 76 53.916 -1.015 19.900 1.00 0.00 H new ATOM 0 HG1 THR A 76 54.199 0.584 18.192 1.00 0.00 H new ATOM 0 HG21 THR A 76 55.477 -1.318 17.967 1.00 0.00 H new ATOM 0 HG22 THR A 76 54.770 -2.859 18.507 1.00 0.00 H new ATOM 0 HG23 THR A 76 54.153 -2.063 17.040 1.00 0.00 H new ATOM 1167 N ILE A 77 51.357 -1.211 21.247 1.00 0.00 N ATOM 1168 CA ILE A 77 50.428 -0.614 22.226 1.00 0.00 C ATOM 1169 C ILE A 77 51.223 0.092 23.325 1.00 0.00 C ATOM 1170 O ILE A 77 52.083 -0.526 23.954 1.00 0.00 O ATOM 1171 CB ILE A 77 49.481 -1.667 22.862 1.00 0.00 C ATOM 1172 CG1 ILE A 77 48.830 -2.603 21.816 1.00 0.00 C ATOM 1173 CG2 ILE A 77 48.407 -0.942 23.707 1.00 0.00 C ATOM 1174 CD1 ILE A 77 47.880 -3.647 22.417 1.00 0.00 C ATOM 0 H ILE A 77 52.125 -1.723 21.680 1.00 0.00 H new ATOM 0 HA ILE A 77 49.806 0.102 21.690 1.00 0.00 H new ATOM 0 HB ILE A 77 50.082 -2.312 23.504 1.00 0.00 H new ATOM 0 HG12 ILE A 77 48.279 -1.998 21.095 1.00 0.00 H new ATOM 0 HG13 ILE A 77 49.617 -3.118 21.265 1.00 0.00 H new ATOM 0 HG21 ILE A 77 47.739 -1.678 24.156 1.00 0.00 H new ATOM 0 HG22 ILE A 77 48.892 -0.364 24.494 1.00 0.00 H new ATOM 0 HG23 ILE A 77 47.832 -0.272 23.068 1.00 0.00 H new ATOM 0 HD11 ILE A 77 47.465 -4.263 21.619 1.00 0.00 H new ATOM 0 HD12 ILE A 77 48.429 -4.279 23.116 1.00 0.00 H new ATOM 0 HD13 ILE A 77 47.070 -3.142 22.944 1.00 0.00 H new ATOM 1186 N SER A 78 50.893 1.355 23.594 1.00 0.00 N ATOM 1187 CA SER A 78 51.550 2.193 24.613 1.00 0.00 C ATOM 1188 C SER A 78 50.527 3.050 25.372 1.00 0.00 C ATOM 1189 O SER A 78 49.487 3.384 24.802 1.00 0.00 O ATOM 1190 CB SER A 78 52.561 3.133 23.945 1.00 0.00 C ATOM 1191 OG SER A 78 53.657 2.424 23.407 1.00 0.00 O ATOM 0 H SER A 78 50.144 1.841 23.101 1.00 0.00 H new ATOM 0 HA SER A 78 52.052 1.526 25.314 1.00 0.00 H new ATOM 0 HB2 SER A 78 52.067 3.695 23.153 1.00 0.00 H new ATOM 0 HB3 SER A 78 52.920 3.859 24.674 1.00 0.00 H new ATOM 0 HG SER A 78 54.350 2.324 24.093 1.00 0.00 H new ATOM 1197 N PRO A 79 50.777 3.426 26.639 1.00 0.00 N ATOM 1198 CA PRO A 79 49.901 4.323 27.395 1.00 0.00 C ATOM 1199 C PRO A 79 50.089 5.782 26.948 1.00 0.00 C ATOM 1200 O PRO A 79 51.197 6.194 26.595 1.00 0.00 O ATOM 1201 CB PRO A 79 50.315 4.135 28.856 1.00 0.00 C ATOM 1202 CG PRO A 79 51.806 3.834 28.738 1.00 0.00 C ATOM 1203 CD PRO A 79 51.921 3.028 27.448 1.00 0.00 C ATOM 0 HA PRO A 79 48.847 4.096 27.238 1.00 0.00 H new ATOM 0 HB2 PRO A 79 50.127 5.029 29.450 1.00 0.00 H new ATOM 0 HB3 PRO A 79 49.772 3.318 29.330 1.00 0.00 H new ATOM 0 HG2 PRO A 79 52.395 4.750 28.690 1.00 0.00 H new ATOM 0 HG3 PRO A 79 52.168 3.267 29.596 1.00 0.00 H new ATOM 0 HD2 PRO A 79 52.858 3.241 26.934 1.00 0.00 H new ATOM 0 HD3 PRO A 79 51.905 1.957 27.651 1.00 0.00 H new ATOM 1211 N VAL A 80 49.034 6.597 27.026 1.00 0.00 N ATOM 1212 CA VAL A 80 49.104 8.044 26.716 1.00 0.00 C ATOM 1213 C VAL A 80 49.986 8.810 27.720 1.00 0.00 C ATOM 1214 O VAL A 80 50.629 9.794 27.350 1.00 0.00 O ATOM 1215 CB VAL A 80 47.685 8.645 26.627 1.00 0.00 C ATOM 1216 CG1 VAL A 80 47.661 10.167 26.432 1.00 0.00 C ATOM 1217 CG2 VAL A 80 46.940 8.043 25.428 1.00 0.00 C ATOM 0 H VAL A 80 48.105 6.282 27.304 1.00 0.00 H new ATOM 0 HA VAL A 80 49.581 8.153 25.742 1.00 0.00 H new ATOM 0 HB VAL A 80 47.216 8.409 27.582 1.00 0.00 H new ATOM 0 HG11 VAL A 80 46.628 10.511 26.379 1.00 0.00 H new ATOM 0 HG12 VAL A 80 48.161 10.649 27.272 1.00 0.00 H new ATOM 0 HG13 VAL A 80 48.176 10.423 25.506 1.00 0.00 H new ATOM 0 HG21 VAL A 80 45.939 8.470 25.370 1.00 0.00 H new ATOM 0 HG22 VAL A 80 47.485 8.268 24.511 1.00 0.00 H new ATOM 0 HG23 VAL A 80 46.866 6.962 25.551 1.00 0.00 H new ATOM 1227 N GLY A 81 50.078 8.340 28.971 1.00 0.00 N ATOM 1228 CA GLY A 81 50.907 8.956 30.018 1.00 0.00 C ATOM 1229 C GLY A 81 52.404 8.603 29.968 1.00 0.00 C ATOM 1230 O GLY A 81 53.218 9.349 30.516 1.00 0.00 O ATOM 0 H GLY A 81 49.574 7.512 29.289 1.00 0.00 H new ATOM 0 HA2 GLY A 81 50.804 10.039 29.949 1.00 0.00 H new ATOM 0 HA3 GLY A 81 50.514 8.660 30.990 1.00 0.00 H new ATOM 1234 N SER A 82 52.782 7.506 29.295 1.00 0.00 N ATOM 1235 CA SER A 82 54.174 7.014 29.201 1.00 0.00 C ATOM 1236 C SER A 82 54.488 6.361 27.835 1.00 0.00 C ATOM 1237 O SER A 82 54.898 5.197 27.785 1.00 0.00 O ATOM 1238 CB SER A 82 54.489 6.043 30.360 1.00 0.00 C ATOM 1239 OG SER A 82 54.264 6.629 31.635 1.00 0.00 O ATOM 0 H SER A 82 52.118 6.920 28.788 1.00 0.00 H new ATOM 0 HA SER A 82 54.822 7.886 29.285 1.00 0.00 H new ATOM 0 HB2 SER A 82 53.872 5.150 30.260 1.00 0.00 H new ATOM 0 HB3 SER A 82 55.528 5.722 30.289 1.00 0.00 H new ATOM 0 HG SER A 82 53.894 5.956 32.244 1.00 0.00 H new ATOM 1245 N PRO A 83 54.330 7.077 26.699 1.00 0.00 N ATOM 1246 CA PRO A 83 54.539 6.524 25.353 1.00 0.00 C ATOM 1247 C PRO A 83 56.006 6.169 25.034 1.00 0.00 C ATOM 1248 O PRO A 83 56.288 5.553 24.006 1.00 0.00 O ATOM 1249 CB PRO A 83 53.965 7.568 24.390 1.00 0.00 C ATOM 1250 CG PRO A 83 54.147 8.881 25.148 1.00 0.00 C ATOM 1251 CD PRO A 83 53.915 8.471 26.601 1.00 0.00 C ATOM 0 HA PRO A 83 54.035 5.562 25.260 1.00 0.00 H new ATOM 0 HB2 PRO A 83 54.498 7.575 23.439 1.00 0.00 H new ATOM 0 HB3 PRO A 83 52.916 7.375 24.166 1.00 0.00 H new ATOM 0 HG2 PRO A 83 55.143 9.298 25.000 1.00 0.00 H new ATOM 0 HG3 PRO A 83 53.433 9.638 24.823 1.00 0.00 H new ATOM 0 HD2 PRO A 83 54.493 9.098 27.280 1.00 0.00 H new ATOM 0 HD3 PRO A 83 52.866 8.586 26.876 1.00 0.00 H new ATOM 1259 N ASN A 84 56.946 6.519 25.922 1.00 0.00 N ATOM 1260 CA ASN A 84 58.344 6.067 25.902 1.00 0.00 C ATOM 1261 C ASN A 84 58.523 4.554 26.201 1.00 0.00 C ATOM 1262 O ASN A 84 59.649 4.057 26.162 1.00 0.00 O ATOM 1263 CB ASN A 84 59.168 6.945 26.856 1.00 0.00 C ATOM 1264 CG ASN A 84 58.682 6.850 28.287 1.00 0.00 C ATOM 1265 OD1 ASN A 84 58.901 5.879 28.992 1.00 0.00 O ATOM 1266 ND2 ASN A 84 57.960 7.844 28.749 1.00 0.00 N ATOM 0 H ASN A 84 56.747 7.146 26.701 1.00 0.00 H new ATOM 0 HA ASN A 84 58.713 6.184 24.883 1.00 0.00 H new ATOM 0 HB2 ASN A 84 60.215 6.645 26.809 1.00 0.00 H new ATOM 0 HB3 ASN A 84 59.118 7.983 26.526 1.00 0.00 H new ATOM 0 HD21 ASN A 84 57.583 7.804 29.696 1.00 0.00 H new ATOM 0 HD22 ASN A 84 57.776 8.657 28.161 1.00 0.00 H new ATOM 1273 N SER A 85 57.438 3.824 26.489 1.00 0.00 N ATOM 1274 CA SER A 85 57.403 2.379 26.763 1.00 0.00 C ATOM 1275 C SER A 85 56.161 1.722 26.133 1.00 0.00 C ATOM 1276 O SER A 85 55.252 2.423 25.677 1.00 0.00 O ATOM 1277 CB SER A 85 57.410 2.176 28.280 1.00 0.00 C ATOM 1278 OG SER A 85 57.796 0.854 28.596 1.00 0.00 O ATOM 0 H SER A 85 56.511 4.247 26.540 1.00 0.00 H new ATOM 0 HA SER A 85 58.277 1.904 26.318 1.00 0.00 H new ATOM 0 HB2 SER A 85 58.096 2.884 28.745 1.00 0.00 H new ATOM 0 HB3 SER A 85 56.419 2.380 28.686 1.00 0.00 H new ATOM 0 HG SER A 85 57.001 0.283 28.639 1.00 0.00 H new ATOM 1284 N GLN A 86 56.100 0.386 26.078 1.00 0.00 N ATOM 1285 CA GLN A 86 55.021 -0.358 25.402 1.00 0.00 C ATOM 1286 C GLN A 86 54.684 -1.700 26.078 1.00 0.00 C ATOM 1287 O GLN A 86 55.443 -2.201 26.909 1.00 0.00 O ATOM 1288 CB GLN A 86 55.377 -0.544 23.911 1.00 0.00 C ATOM 1289 CG GLN A 86 56.608 -1.418 23.631 1.00 0.00 C ATOM 1290 CD GLN A 86 56.904 -1.472 22.132 1.00 0.00 C ATOM 1291 OE1 GLN A 86 57.669 -0.695 21.585 1.00 0.00 O ATOM 1292 NE2 GLN A 86 56.327 -2.386 21.386 1.00 0.00 N ATOM 0 H GLN A 86 56.803 -0.218 26.504 1.00 0.00 H new ATOM 0 HA GLN A 86 54.112 0.238 25.485 1.00 0.00 H new ATOM 0 HB2 GLN A 86 54.518 -0.982 23.402 1.00 0.00 H new ATOM 0 HB3 GLN A 86 55.542 0.439 23.469 1.00 0.00 H new ATOM 0 HG2 GLN A 86 57.472 -1.019 24.163 1.00 0.00 H new ATOM 0 HG3 GLN A 86 56.438 -2.426 24.010 1.00 0.00 H new ATOM 0 HE21 GLN A 86 55.681 -3.054 21.806 1.00 0.00 H new ATOM 0 HE22 GLN A 86 56.525 -2.428 20.386 1.00 0.00 H new ATOM 1301 N ILE A 87 53.540 -2.292 25.722 1.00 0.00 N ATOM 1302 CA ILE A 87 53.117 -3.604 26.233 1.00 0.00 C ATOM 1303 C ILE A 87 53.864 -4.738 25.515 1.00 0.00 C ATOM 1304 O ILE A 87 53.871 -4.812 24.284 1.00 0.00 O ATOM 1305 CB ILE A 87 51.590 -3.803 26.096 1.00 0.00 C ATOM 1306 CG1 ILE A 87 50.748 -2.656 26.704 1.00 0.00 C ATOM 1307 CG2 ILE A 87 51.185 -5.140 26.750 1.00 0.00 C ATOM 1308 CD1 ILE A 87 50.879 -2.518 28.224 1.00 0.00 C ATOM 0 H ILE A 87 52.877 -1.875 25.069 1.00 0.00 H new ATOM 0 HA ILE A 87 53.368 -3.634 27.293 1.00 0.00 H new ATOM 0 HB ILE A 87 51.376 -3.807 25.027 1.00 0.00 H new ATOM 0 HG12 ILE A 87 51.045 -1.716 26.238 1.00 0.00 H new ATOM 0 HG13 ILE A 87 49.699 -2.818 26.454 1.00 0.00 H new ATOM 0 HG21 ILE A 87 50.108 -5.281 26.654 1.00 0.00 H new ATOM 0 HG22 ILE A 87 51.704 -5.960 26.253 1.00 0.00 H new ATOM 0 HG23 ILE A 87 51.456 -5.125 27.806 1.00 0.00 H new ATOM 0 HD11 ILE A 87 50.258 -1.692 28.569 1.00 0.00 H new ATOM 0 HD12 ILE A 87 50.553 -3.442 28.703 1.00 0.00 H new ATOM 0 HD13 ILE A 87 51.919 -2.322 28.483 1.00 0.00 H new ATOM 1320 N GLY A 88 54.412 -5.673 26.291 1.00 0.00 N ATOM 1321 CA GLY A 88 55.033 -6.923 25.844 1.00 0.00 C ATOM 1322 C GLY A 88 54.596 -8.116 26.702 1.00 0.00 C ATOM 1323 O GLY A 88 53.747 -7.985 27.586 1.00 0.00 O ATOM 0 H GLY A 88 54.437 -5.574 27.306 1.00 0.00 H new ATOM 0 HA2 GLY A 88 54.768 -7.108 24.803 1.00 0.00 H new ATOM 0 HA3 GLY A 88 56.118 -6.824 25.884 1.00 0.00 H new ATOM 1327 N TRP A 89 55.140 -9.299 26.424 1.00 0.00 N ATOM 1328 CA TRP A 89 54.689 -10.576 26.992 1.00 0.00 C ATOM 1329 C TRP A 89 55.753 -11.138 27.940 1.00 0.00 C ATOM 1330 O TRP A 89 56.828 -11.567 27.514 1.00 0.00 O ATOM 1331 CB TRP A 89 54.384 -11.518 25.822 1.00 0.00 C ATOM 1332 CG TRP A 89 53.812 -12.880 26.075 1.00 0.00 C ATOM 1333 CD1 TRP A 89 53.404 -13.427 27.245 1.00 0.00 C ATOM 1334 CD2 TRP A 89 53.586 -13.905 25.063 1.00 0.00 C ATOM 1335 NE1 TRP A 89 52.949 -14.716 27.018 1.00 0.00 N ATOM 1336 CE2 TRP A 89 53.038 -15.063 25.685 1.00 0.00 C ATOM 1337 CE3 TRP A 89 53.800 -13.959 23.671 1.00 0.00 C ATOM 1338 CZ2 TRP A 89 52.721 -16.221 24.957 1.00 0.00 C ATOM 1339 CZ3 TRP A 89 53.477 -15.108 22.925 1.00 0.00 C ATOM 1340 CH2 TRP A 89 52.939 -16.238 23.567 1.00 0.00 C ATOM 0 H TRP A 89 55.926 -9.403 25.782 1.00 0.00 H new ATOM 0 HA TRP A 89 53.786 -10.450 27.590 1.00 0.00 H new ATOM 0 HB2 TRP A 89 53.693 -10.996 25.160 1.00 0.00 H new ATOM 0 HB3 TRP A 89 55.313 -11.656 25.269 1.00 0.00 H new ATOM 0 HD1 TRP A 89 53.429 -12.935 28.206 1.00 0.00 H new ATOM 0 HE1 TRP A 89 52.592 -15.333 27.747 1.00 0.00 H new ATOM 0 HE3 TRP A 89 54.220 -13.101 23.167 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 52.315 -17.088 25.458 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 53.643 -15.122 21.858 1.00 0.00 H new ATOM 0 HH2 TRP A 89 52.693 -17.119 22.993 1.00 0.00 H new ATOM 1351 N GLY A 90 55.466 -11.102 29.243 1.00 0.00 N ATOM 1352 CA GLY A 90 56.367 -11.610 30.269 1.00 0.00 C ATOM 1353 C GLY A 90 56.444 -13.136 30.250 1.00 0.00 C ATOM 1354 O GLY A 90 55.458 -13.829 29.985 1.00 0.00 O ATOM 0 H GLY A 90 54.597 -10.717 29.613 1.00 0.00 H new ATOM 0 HA2 GLY A 90 57.363 -11.194 30.117 1.00 0.00 H new ATOM 0 HA3 GLY A 90 56.028 -11.275 31.249 1.00 0.00 H new ATOM 1358 N ALA A 91 57.621 -13.657 30.594 1.00 0.00 N ATOM 1359 CA ALA A 91 57.946 -15.089 30.596 1.00 0.00 C ATOM 1360 C ALA A 91 57.170 -15.937 31.639 1.00 0.00 C ATOM 1361 O ALA A 91 57.307 -17.161 31.678 1.00 0.00 O ATOM 1362 CB ALA A 91 59.469 -15.205 30.740 1.00 0.00 C ATOM 0 H ALA A 91 58.405 -13.075 30.890 1.00 0.00 H new ATOM 0 HA ALA A 91 57.612 -15.524 29.654 1.00 0.00 H new ATOM 0 HB1 ALA A 91 59.755 -16.257 30.746 1.00 0.00 H new ATOM 0 HB2 ALA A 91 59.953 -14.702 29.903 1.00 0.00 H new ATOM 0 HB3 ALA A 91 59.783 -14.738 31.674 1.00 0.00 H new ATOM 1368 N GLY A 92 56.322 -15.292 32.448 1.00 0.00 N ATOM 1369 CA GLY A 92 55.364 -15.894 33.386 1.00 0.00 C ATOM 1370 C GLY A 92 53.919 -15.956 32.858 1.00 0.00 C ATOM 1371 O GLY A 92 52.986 -16.061 33.653 1.00 0.00 O ATOM 0 H GLY A 92 56.283 -14.273 32.467 1.00 0.00 H new ATOM 0 HA2 GLY A 92 55.695 -16.904 33.627 1.00 0.00 H new ATOM 0 HA3 GLY A 92 55.375 -15.324 34.315 1.00 0.00 H new ATOM 1375 N ASN A 93 53.725 -15.880 31.534 1.00 0.00 N ATOM 1376 CA ASN A 93 52.427 -15.906 30.834 1.00 0.00 C ATOM 1377 C ASN A 93 51.451 -14.787 31.267 1.00 0.00 C ATOM 1378 O ASN A 93 50.260 -15.019 31.488 1.00 0.00 O ATOM 1379 CB ASN A 93 51.825 -17.328 30.867 1.00 0.00 C ATOM 1380 CG ASN A 93 52.732 -18.386 30.259 1.00 0.00 C ATOM 1381 OD1 ASN A 93 53.357 -18.188 29.225 1.00 0.00 O ATOM 1382 ND2 ASN A 93 52.835 -19.544 30.871 1.00 0.00 N ATOM 0 H ASN A 93 54.508 -15.794 30.886 1.00 0.00 H new ATOM 0 HA ASN A 93 52.617 -15.664 29.788 1.00 0.00 H new ATOM 0 HB2 ASN A 93 51.608 -17.598 31.900 1.00 0.00 H new ATOM 0 HB3 ASN A 93 50.875 -17.324 30.332 1.00 0.00 H new ATOM 0 HD21 ASN A 93 53.434 -20.274 30.484 1.00 0.00 H new ATOM 0 HD22 ASN A 93 52.316 -19.713 31.733 1.00 0.00 H new ATOM 1389 N VAL A 94 51.965 -13.555 31.365 1.00 0.00 N ATOM 1390 CA VAL A 94 51.205 -12.331 31.693 1.00 0.00 C ATOM 1391 C VAL A 94 51.680 -11.150 30.829 1.00 0.00 C ATOM 1392 O VAL A 94 52.843 -11.140 30.411 1.00 0.00 O ATOM 1393 CB VAL A 94 51.333 -11.966 33.193 1.00 0.00 C ATOM 1394 CG1 VAL A 94 50.669 -13.014 34.092 1.00 0.00 C ATOM 1395 CG2 VAL A 94 52.784 -11.785 33.663 1.00 0.00 C ATOM 0 H VAL A 94 52.957 -13.371 31.214 1.00 0.00 H new ATOM 0 HA VAL A 94 50.156 -12.534 31.479 1.00 0.00 H new ATOM 0 HB VAL A 94 50.821 -11.008 33.283 1.00 0.00 H new ATOM 0 HG11 VAL A 94 50.781 -12.721 35.136 1.00 0.00 H new ATOM 0 HG12 VAL A 94 49.609 -13.085 33.847 1.00 0.00 H new ATOM 0 HG13 VAL A 94 51.144 -13.982 33.934 1.00 0.00 H new ATOM 0 HG21 VAL A 94 52.794 -11.531 34.723 1.00 0.00 H new ATOM 0 HG22 VAL A 94 53.335 -12.712 33.507 1.00 0.00 H new ATOM 0 HG23 VAL A 94 53.254 -10.983 33.093 1.00 0.00 H new ATOM 1405 N PRO A 95 50.834 -10.141 30.543 1.00 0.00 N ATOM 1406 CA PRO A 95 51.280 -8.929 29.861 1.00 0.00 C ATOM 1407 C PRO A 95 52.087 -8.038 30.821 1.00 0.00 C ATOM 1408 O PRO A 95 51.779 -7.936 32.011 1.00 0.00 O ATOM 1409 CB PRO A 95 49.997 -8.251 29.375 1.00 0.00 C ATOM 1410 CG PRO A 95 48.973 -8.647 30.435 1.00 0.00 C ATOM 1411 CD PRO A 95 49.416 -10.045 30.874 1.00 0.00 C ATOM 0 HA PRO A 95 51.949 -9.137 29.026 1.00 0.00 H new ATOM 0 HB2 PRO A 95 50.112 -7.169 29.310 1.00 0.00 H new ATOM 0 HB3 PRO A 95 49.707 -8.600 28.384 1.00 0.00 H new ATOM 0 HG2 PRO A 95 48.973 -7.947 31.271 1.00 0.00 H new ATOM 0 HG3 PRO A 95 47.962 -8.658 30.029 1.00 0.00 H new ATOM 0 HD2 PRO A 95 49.254 -10.188 31.942 1.00 0.00 H new ATOM 0 HD3 PRO A 95 48.842 -10.816 30.359 1.00 0.00 H new ATOM 1419 N VAL A 96 53.106 -7.357 30.295 1.00 0.00 N ATOM 1420 CA VAL A 96 54.035 -6.493 31.047 1.00 0.00 C ATOM 1421 C VAL A 96 54.320 -5.195 30.292 1.00 0.00 C ATOM 1422 O VAL A 96 54.199 -5.137 29.070 1.00 0.00 O ATOM 1423 CB VAL A 96 55.369 -7.212 31.366 1.00 0.00 C ATOM 1424 CG1 VAL A 96 55.173 -8.484 32.200 1.00 0.00 C ATOM 1425 CG2 VAL A 96 56.174 -7.596 30.115 1.00 0.00 C ATOM 0 H VAL A 96 53.320 -7.389 29.298 1.00 0.00 H new ATOM 0 HA VAL A 96 53.541 -6.256 31.989 1.00 0.00 H new ATOM 0 HB VAL A 96 55.928 -6.472 31.939 1.00 0.00 H new ATOM 0 HG11 VAL A 96 56.141 -8.945 32.393 1.00 0.00 H new ATOM 0 HG12 VAL A 96 54.698 -8.228 33.147 1.00 0.00 H new ATOM 0 HG13 VAL A 96 54.540 -9.183 31.654 1.00 0.00 H new ATOM 0 HG21 VAL A 96 57.095 -8.095 30.414 1.00 0.00 H new ATOM 0 HG22 VAL A 96 55.582 -8.268 29.494 1.00 0.00 H new ATOM 0 HG23 VAL A 96 56.416 -6.697 29.548 1.00 0.00 H new ATOM 1435 N VAL A 97 54.743 -4.157 31.010 1.00 0.00 N ATOM 1436 CA VAL A 97 55.266 -2.912 30.423 1.00 0.00 C ATOM 1437 C VAL A 97 56.783 -3.048 30.248 1.00 0.00 C ATOM 1438 O VAL A 97 57.474 -3.409 31.203 1.00 0.00 O ATOM 1439 CB VAL A 97 54.942 -1.721 31.339 1.00 0.00 C ATOM 1440 CG1 VAL A 97 55.472 -0.411 30.753 1.00 0.00 C ATOM 1441 CG2 VAL A 97 53.431 -1.563 31.553 1.00 0.00 C ATOM 0 H VAL A 97 54.735 -4.151 32.030 1.00 0.00 H new ATOM 0 HA VAL A 97 54.800 -2.737 29.454 1.00 0.00 H new ATOM 0 HB VAL A 97 55.428 -1.930 32.292 1.00 0.00 H new ATOM 0 HG11 VAL A 97 55.227 0.413 31.423 1.00 0.00 H new ATOM 0 HG12 VAL A 97 56.554 -0.476 30.637 1.00 0.00 H new ATOM 0 HG13 VAL A 97 55.013 -0.236 29.780 1.00 0.00 H new ATOM 0 HG21 VAL A 97 53.243 -0.711 32.206 1.00 0.00 H new ATOM 0 HG22 VAL A 97 52.943 -1.399 30.592 1.00 0.00 H new ATOM 0 HG23 VAL A 97 53.032 -2.467 32.013 1.00 0.00 H new ATOM 1451 N LEU A 98 57.314 -2.754 29.058 1.00 0.00 N ATOM 1452 CA LEU A 98 58.726 -2.975 28.716 1.00 0.00 C ATOM 1453 C LEU A 98 59.244 -1.925 27.696 1.00 0.00 C ATOM 1454 O LEU A 98 58.478 -1.528 26.808 1.00 0.00 O ATOM 1455 CB LEU A 98 58.821 -4.418 28.168 1.00 0.00 C ATOM 1456 CG LEU A 98 60.225 -5.048 28.135 1.00 0.00 C ATOM 1457 CD1 LEU A 98 60.815 -5.239 29.538 1.00 0.00 C ATOM 1458 CD2 LEU A 98 60.139 -6.437 27.502 1.00 0.00 C ATOM 0 H LEU A 98 56.771 -2.351 28.294 1.00 0.00 H new ATOM 0 HA LEU A 98 59.363 -2.855 29.592 1.00 0.00 H new ATOM 0 HB2 LEU A 98 58.175 -5.056 28.771 1.00 0.00 H new ATOM 0 HB3 LEU A 98 58.420 -4.425 27.155 1.00 0.00 H new ATOM 0 HG LEU A 98 60.861 -4.369 27.567 1.00 0.00 H new ATOM 0 HD11 LEU A 98 61.806 -5.687 29.458 1.00 0.00 H new ATOM 0 HD12 LEU A 98 60.893 -4.272 30.035 1.00 0.00 H new ATOM 0 HD13 LEU A 98 60.167 -5.895 30.119 1.00 0.00 H new ATOM 0 HD21 LEU A 98 61.131 -6.887 27.476 1.00 0.00 H new ATOM 0 HD22 LEU A 98 59.471 -7.065 28.091 1.00 0.00 H new ATOM 0 HD23 LEU A 98 59.753 -6.351 26.486 1.00 0.00 H new ATOM 1470 N PRO A 99 60.514 -1.459 27.789 1.00 0.00 N ATOM 1471 CA PRO A 99 61.125 -0.528 26.828 1.00 0.00 C ATOM 1472 C PRO A 99 60.943 -0.926 25.350 1.00 0.00 C ATOM 1473 O PRO A 99 60.853 -2.119 25.040 1.00 0.00 O ATOM 1474 CB PRO A 99 62.610 -0.463 27.195 1.00 0.00 C ATOM 1475 CG PRO A 99 62.607 -0.736 28.694 1.00 0.00 C ATOM 1476 CD PRO A 99 61.471 -1.742 28.854 1.00 0.00 C ATOM 0 HA PRO A 99 60.628 0.439 26.903 1.00 0.00 H new ATOM 0 HB2 PRO A 99 63.193 -1.206 26.651 1.00 0.00 H new ATOM 0 HB3 PRO A 99 63.040 0.511 26.963 1.00 0.00 H new ATOM 0 HG2 PRO A 99 63.559 -1.145 29.032 1.00 0.00 H new ATOM 0 HG3 PRO A 99 62.427 0.172 29.270 1.00 0.00 H new ATOM 0 HD2 PRO A 99 61.844 -2.763 28.779 1.00 0.00 H new ATOM 0 HD3 PRO A 99 61.002 -1.645 29.833 1.00 0.00 H new ATOM 1484 N PRO A 100 60.912 0.043 24.417 1.00 0.00 N ATOM 1485 CA PRO A 100 60.519 -0.208 23.035 1.00 0.00 C ATOM 1486 C PRO A 100 61.531 -1.047 22.242 1.00 0.00 C ATOM 1487 O PRO A 100 62.747 -0.862 22.334 1.00 0.00 O ATOM 1488 CB PRO A 100 60.286 1.173 22.412 1.00 0.00 C ATOM 1489 CG PRO A 100 61.175 2.098 23.242 1.00 0.00 C ATOM 1490 CD PRO A 100 61.121 1.466 24.632 1.00 0.00 C ATOM 0 HA PRO A 100 59.617 -0.819 23.007 1.00 0.00 H new ATOM 0 HB2 PRO A 100 60.564 1.189 21.358 1.00 0.00 H new ATOM 0 HB3 PRO A 100 59.238 1.467 22.469 1.00 0.00 H new ATOM 0 HG2 PRO A 100 62.193 2.135 22.854 1.00 0.00 H new ATOM 0 HG3 PRO A 100 60.799 3.121 23.248 1.00 0.00 H new ATOM 0 HD2 PRO A 100 62.047 1.646 25.179 1.00 0.00 H new ATOM 0 HD3 PRO A 100 60.312 1.894 25.224 1.00 0.00 H new ATOM 1498 N ASN A 101 60.992 -1.953 21.421 1.00 0.00 N ATOM 1499 CA ASN A 101 61.715 -2.791 20.464 1.00 0.00 C ATOM 1500 C ASN A 101 60.777 -3.101 19.280 1.00 0.00 C ATOM 1501 O ASN A 101 60.740 -2.334 18.320 1.00 0.00 O ATOM 1502 CB ASN A 101 62.247 -4.040 21.205 1.00 0.00 C ATOM 1503 CG ASN A 101 62.822 -5.106 20.284 1.00 0.00 C ATOM 1504 OD1 ASN A 101 63.387 -4.829 19.236 1.00 0.00 O ATOM 1505 ND2 ASN A 101 62.641 -6.363 20.615 1.00 0.00 N ATOM 0 H ASN A 101 59.988 -2.130 21.406 1.00 0.00 H new ATOM 0 HA ASN A 101 62.587 -2.290 20.044 1.00 0.00 H new ATOM 0 HB2 ASN A 101 63.017 -3.730 21.911 1.00 0.00 H new ATOM 0 HB3 ASN A 101 61.436 -4.477 21.788 1.00 0.00 H new ATOM 0 HD21 ASN A 101 62.971 -7.105 19.998 1.00 0.00 H new ATOM 0 HD22 ASN A 101 62.170 -6.598 21.489 1.00 0.00 H new ATOM 1512 N ASN A 102 59.977 -4.173 19.380 1.00 0.00 N ATOM 1513 CA ASN A 102 59.027 -4.644 18.361 1.00 0.00 C ATOM 1514 C ASN A 102 57.893 -5.513 18.964 1.00 0.00 C ATOM 1515 O ASN A 102 57.311 -6.348 18.273 1.00 0.00 O ATOM 1516 CB ASN A 102 59.829 -5.407 17.281 1.00 0.00 C ATOM 1517 CG ASN A 102 60.377 -4.525 16.174 1.00 0.00 C ATOM 1518 OD1 ASN A 102 59.769 -3.563 15.726 1.00 0.00 O ATOM 1519 ND2 ASN A 102 61.533 -4.858 15.657 1.00 0.00 N ATOM 0 H ASN A 102 59.975 -4.763 20.212 1.00 0.00 H new ATOM 0 HA ASN A 102 58.521 -3.788 17.914 1.00 0.00 H new ATOM 0 HB2 ASN A 102 60.659 -5.927 17.760 1.00 0.00 H new ATOM 0 HB3 ASN A 102 59.188 -6.169 16.839 1.00 0.00 H new ATOM 0 HD21 ASN A 102 61.922 -4.316 14.885 1.00 0.00 H new ATOM 0 HD22 ASN A 102 62.045 -5.659 16.026 1.00 0.00 H new ATOM 1526 N TYR A 103 57.598 -5.392 20.261 1.00 0.00 N ATOM 1527 CA TYR A 103 56.529 -6.168 20.911 1.00 0.00 C ATOM 1528 C TYR A 103 55.149 -5.751 20.373 1.00 0.00 C ATOM 1529 O TYR A 103 54.773 -4.581 20.469 1.00 0.00 O ATOM 1530 CB TYR A 103 56.612 -5.994 22.434 1.00 0.00 C ATOM 1531 CG TYR A 103 58.002 -6.214 23.002 1.00 0.00 C ATOM 1532 CD1 TYR A 103 58.563 -7.505 23.006 1.00 0.00 C ATOM 1533 CD2 TYR A 103 58.755 -5.120 23.474 1.00 0.00 C ATOM 1534 CE1 TYR A 103 59.879 -7.700 23.470 1.00 0.00 C ATOM 1535 CE2 TYR A 103 60.072 -5.317 23.928 1.00 0.00 C ATOM 1536 CZ TYR A 103 60.644 -6.604 23.914 1.00 0.00 C ATOM 1537 OH TYR A 103 61.933 -6.778 24.315 1.00 0.00 O ATOM 0 H TYR A 103 58.089 -4.757 20.891 1.00 0.00 H new ATOM 0 HA TYR A 103 56.664 -7.224 20.678 1.00 0.00 H new ATOM 0 HB2 TYR A 103 56.278 -4.989 22.694 1.00 0.00 H new ATOM 0 HB3 TYR A 103 55.922 -6.692 22.908 1.00 0.00 H new ATOM 0 HD1 TYR A 103 57.985 -8.346 22.653 1.00 0.00 H new ATOM 0 HD2 TYR A 103 58.321 -4.131 23.487 1.00 0.00 H new ATOM 0 HE1 TYR A 103 60.303 -8.693 23.485 1.00 0.00 H new ATOM 0 HE2 TYR A 103 60.647 -4.477 24.289 1.00 0.00 H new ATOM 0 HH TYR A 103 62.310 -5.916 24.588 1.00 0.00 H new ATOM 1547 N VAL A 104 54.393 -6.694 19.806 1.00 0.00 N ATOM 1548 CA VAL A 104 53.120 -6.419 19.110 1.00 0.00 C ATOM 1549 C VAL A 104 51.989 -7.309 19.616 1.00 0.00 C ATOM 1550 O VAL A 104 52.226 -8.334 20.251 1.00 0.00 O ATOM 1551 CB VAL A 104 53.239 -6.577 17.577 1.00 0.00 C ATOM 1552 CG1 VAL A 104 54.071 -5.460 16.949 1.00 0.00 C ATOM 1553 CG2 VAL A 104 53.814 -7.934 17.151 1.00 0.00 C ATOM 0 H VAL A 104 54.644 -7.683 19.814 1.00 0.00 H new ATOM 0 HA VAL A 104 52.884 -5.379 19.335 1.00 0.00 H new ATOM 0 HB VAL A 104 52.215 -6.515 17.209 1.00 0.00 H new ATOM 0 HG11 VAL A 104 54.128 -5.611 15.871 1.00 0.00 H new ATOM 0 HG12 VAL A 104 53.603 -4.497 17.156 1.00 0.00 H new ATOM 0 HG13 VAL A 104 55.076 -5.473 17.371 1.00 0.00 H new ATOM 0 HG21 VAL A 104 53.871 -7.980 16.063 1.00 0.00 H new ATOM 0 HG22 VAL A 104 54.812 -8.055 17.572 1.00 0.00 H new ATOM 0 HG23 VAL A 104 53.168 -8.733 17.514 1.00 0.00 H new ATOM 1563 N TRP A 105 50.757 -6.929 19.282 1.00 0.00 N ATOM 1564 CA TRP A 105 49.539 -7.684 19.571 1.00 0.00 C ATOM 1565 C TRP A 105 48.562 -7.577 18.397 1.00 0.00 C ATOM 1566 O TRP A 105 48.565 -6.591 17.655 1.00 0.00 O ATOM 1567 CB TRP A 105 48.907 -7.147 20.863 1.00 0.00 C ATOM 1568 CG TRP A 105 49.805 -7.206 22.062 1.00 0.00 C ATOM 1569 CD1 TRP A 105 50.603 -6.206 22.500 1.00 0.00 C ATOM 1570 CD2 TRP A 105 50.087 -8.349 22.928 1.00 0.00 C ATOM 1571 NE1 TRP A 105 51.367 -6.648 23.561 1.00 0.00 N ATOM 1572 CE2 TRP A 105 51.065 -7.954 23.889 1.00 0.00 C ATOM 1573 CE3 TRP A 105 49.631 -9.684 22.988 1.00 0.00 C ATOM 1574 CZ2 TRP A 105 51.522 -8.828 24.885 1.00 0.00 C ATOM 1575 CZ3 TRP A 105 50.124 -10.586 23.952 1.00 0.00 C ATOM 1576 CH2 TRP A 105 51.052 -10.152 24.913 1.00 0.00 C ATOM 0 H TRP A 105 50.573 -6.057 18.786 1.00 0.00 H new ATOM 0 HA TRP A 105 49.783 -8.737 19.709 1.00 0.00 H new ATOM 0 HB2 TRP A 105 48.603 -6.113 20.702 1.00 0.00 H new ATOM 0 HB3 TRP A 105 48.001 -7.716 21.074 1.00 0.00 H new ATOM 0 HD1 TRP A 105 50.637 -5.211 22.082 1.00 0.00 H new ATOM 0 HE1 TRP A 105 52.066 -6.081 24.042 1.00 0.00 H new ATOM 0 HE3 TRP A 105 48.888 -10.021 22.280 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 52.230 -8.486 25.625 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 49.788 -11.612 23.952 1.00 0.00 H new ATOM 0 HH2 TRP A 105 51.404 -10.835 25.672 1.00 0.00 H new ATOM 1587 N THR A 106 47.725 -8.597 18.231 1.00 0.00 N ATOM 1588 CA THR A 106 46.667 -8.660 17.214 1.00 0.00 C ATOM 1589 C THR A 106 45.349 -8.163 17.808 1.00 0.00 C ATOM 1590 O THR A 106 44.983 -8.598 18.902 1.00 0.00 O ATOM 1591 CB THR A 106 46.463 -10.098 16.704 1.00 0.00 C ATOM 1592 OG1 THR A 106 47.685 -10.717 16.363 1.00 0.00 O ATOM 1593 CG2 THR A 106 45.611 -10.100 15.437 1.00 0.00 C ATOM 0 H THR A 106 47.761 -9.431 18.817 1.00 0.00 H new ATOM 0 HA THR A 106 46.973 -8.029 16.379 1.00 0.00 H new ATOM 0 HB THR A 106 45.980 -10.641 17.516 1.00 0.00 H new ATOM 0 HG1 THR A 106 47.907 -11.395 17.035 1.00 0.00 H new ATOM 0 HG21 THR A 106 45.477 -11.125 15.090 1.00 0.00 H new ATOM 0 HG22 THR A 106 44.638 -9.659 15.652 1.00 0.00 H new ATOM 0 HG23 THR A 106 46.109 -9.517 14.662 1.00 0.00 H new ATOM 1601 N LEU A 107 44.625 -7.297 17.087 1.00 0.00 N ATOM 1602 CA LEU A 107 43.362 -6.679 17.539 1.00 0.00 C ATOM 1603 C LEU A 107 42.183 -7.061 16.622 1.00 0.00 C ATOM 1604 O LEU A 107 41.848 -6.335 15.684 1.00 0.00 O ATOM 1605 CB LEU A 107 43.488 -5.142 17.659 1.00 0.00 C ATOM 1606 CG LEU A 107 44.363 -4.540 18.777 1.00 0.00 C ATOM 1607 CD1 LEU A 107 44.128 -5.191 20.139 1.00 0.00 C ATOM 1608 CD2 LEU A 107 45.858 -4.563 18.495 1.00 0.00 C ATOM 0 H LEU A 107 44.903 -6.997 16.153 1.00 0.00 H new ATOM 0 HA LEU A 107 43.154 -7.074 18.533 1.00 0.00 H new ATOM 0 HB2 LEU A 107 43.870 -4.770 16.708 1.00 0.00 H new ATOM 0 HB3 LEU A 107 42.482 -4.739 17.778 1.00 0.00 H new ATOM 0 HG LEU A 107 44.036 -3.500 18.801 1.00 0.00 H new ATOM 0 HD11 LEU A 107 44.773 -4.723 20.882 1.00 0.00 H new ATOM 0 HD12 LEU A 107 43.086 -5.060 20.430 1.00 0.00 H new ATOM 0 HD13 LEU A 107 44.357 -6.255 20.078 1.00 0.00 H new ATOM 0 HD21 LEU A 107 46.394 -4.120 19.335 1.00 0.00 H new ATOM 0 HD22 LEU A 107 46.187 -5.593 18.358 1.00 0.00 H new ATOM 0 HD23 LEU A 107 46.066 -3.992 17.590 1.00 0.00 H new ATOM 1620 N THR A 108 41.544 -8.205 16.883 1.00 0.00 N ATOM 1621 CA THR A 108 40.559 -8.822 15.965 1.00 0.00 C ATOM 1622 C THR A 108 39.152 -8.891 16.563 1.00 0.00 C ATOM 1623 O THR A 108 38.957 -9.451 17.641 1.00 0.00 O ATOM 1624 CB THR A 108 41.032 -10.231 15.565 1.00 0.00 C ATOM 1625 OG1 THR A 108 42.243 -10.128 14.846 1.00 0.00 O ATOM 1626 CG2 THR A 108 40.055 -10.952 14.639 1.00 0.00 C ATOM 0 H THR A 108 41.690 -8.739 17.740 1.00 0.00 H new ATOM 0 HA THR A 108 40.497 -8.183 15.084 1.00 0.00 H new ATOM 0 HB THR A 108 41.129 -10.792 16.495 1.00 0.00 H new ATOM 0 HG1 THR A 108 42.549 -11.023 14.590 1.00 0.00 H new ATOM 0 HG21 THR A 108 40.447 -11.939 14.394 1.00 0.00 H new ATOM 0 HG22 THR A 108 39.091 -11.057 15.138 1.00 0.00 H new ATOM 0 HG23 THR A 108 39.928 -10.375 13.723 1.00 0.00 H new ATOM 1634 N LEU A 109 38.151 -8.371 15.848 1.00 0.00 N ATOM 1635 CA LEU A 109 36.731 -8.519 16.195 1.00 0.00 C ATOM 1636 C LEU A 109 36.182 -9.888 15.747 1.00 0.00 C ATOM 1637 O LEU A 109 36.439 -10.334 14.626 1.00 0.00 O ATOM 1638 CB LEU A 109 35.950 -7.354 15.548 1.00 0.00 C ATOM 1639 CG LEU A 109 34.438 -7.323 15.859 1.00 0.00 C ATOM 1640 CD1 LEU A 109 34.149 -7.185 17.352 1.00 0.00 C ATOM 1641 CD2 LEU A 109 33.772 -6.141 15.161 1.00 0.00 C ATOM 0 H LEU A 109 38.304 -7.827 14.999 1.00 0.00 H new ATOM 0 HA LEU A 109 36.611 -8.481 17.278 1.00 0.00 H new ATOM 0 HB2 LEU A 109 36.392 -6.414 15.878 1.00 0.00 H new ATOM 0 HB3 LEU A 109 36.081 -7.406 14.467 1.00 0.00 H new ATOM 0 HG LEU A 109 34.041 -8.273 15.501 1.00 0.00 H new ATOM 0 HD11 LEU A 109 33.071 -7.168 17.514 1.00 0.00 H new ATOM 0 HD12 LEU A 109 34.583 -8.030 17.886 1.00 0.00 H new ATOM 0 HD13 LEU A 109 34.586 -6.258 17.723 1.00 0.00 H new ATOM 0 HD21 LEU A 109 32.707 -6.135 15.392 1.00 0.00 H new ATOM 0 HD22 LEU A 109 34.223 -5.212 15.509 1.00 0.00 H new ATOM 0 HD23 LEU A 109 33.909 -6.230 14.083 1.00 0.00 H new ATOM 1692 N TYR A 114 35.847 -7.977 20.681 1.00 0.00 N ATOM 1693 CA TYR A 114 37.261 -7.879 20.303 1.00 0.00 C ATOM 1694 C TYR A 114 38.117 -8.930 21.024 1.00 0.00 C ATOM 1695 O TYR A 114 37.765 -9.463 22.081 1.00 0.00 O ATOM 1696 CB TYR A 114 37.808 -6.462 20.563 1.00 0.00 C ATOM 1697 CG TYR A 114 37.687 -5.530 19.372 1.00 0.00 C ATOM 1698 CD1 TYR A 114 38.697 -5.516 18.386 1.00 0.00 C ATOM 1699 CD2 TYR A 114 36.573 -4.679 19.251 1.00 0.00 C ATOM 1700 CE1 TYR A 114 38.589 -4.654 17.277 1.00 0.00 C ATOM 1701 CE2 TYR A 114 36.469 -3.807 18.148 1.00 0.00 C ATOM 1702 CZ TYR A 114 37.477 -3.791 17.160 1.00 0.00 C ATOM 1703 OH TYR A 114 37.373 -2.940 16.103 1.00 0.00 O ATOM 0 HA TYR A 114 37.322 -8.080 19.233 1.00 0.00 H new ATOM 0 HB2 TYR A 114 37.275 -6.027 21.409 1.00 0.00 H new ATOM 0 HB3 TYR A 114 38.857 -6.535 20.850 1.00 0.00 H new ATOM 0 HD1 TYR A 114 39.554 -6.167 18.482 1.00 0.00 H new ATOM 0 HD2 TYR A 114 35.798 -4.694 20.003 1.00 0.00 H new ATOM 0 HE1 TYR A 114 39.356 -4.653 16.517 1.00 0.00 H new ATOM 0 HE2 TYR A 114 35.616 -3.150 18.059 1.00 0.00 H new ATOM 0 HH TYR A 114 36.545 -2.421 16.181 1.00 0.00 H new ATOM 1713 N ASN A 115 39.290 -9.184 20.452 1.00 0.00 N ATOM 1714 CA ASN A 115 40.285 -10.137 20.925 1.00 0.00 C ATOM 1715 C ASN A 115 41.662 -9.475 20.915 1.00 0.00 C ATOM 1716 O ASN A 115 41.936 -8.594 20.097 1.00 0.00 O ATOM 1717 CB ASN A 115 40.270 -11.380 20.021 1.00 0.00 C ATOM 1718 CG ASN A 115 38.931 -12.081 20.082 1.00 0.00 C ATOM 1719 OD1 ASN A 115 38.684 -12.919 20.934 1.00 0.00 O ATOM 1720 ND2 ASN A 115 38.020 -11.716 19.215 1.00 0.00 N ATOM 0 H ASN A 115 39.586 -8.705 19.602 1.00 0.00 H new ATOM 0 HA ASN A 115 40.054 -10.446 21.944 1.00 0.00 H new ATOM 0 HB2 ASN A 115 40.485 -11.089 18.993 1.00 0.00 H new ATOM 0 HB3 ASN A 115 41.058 -12.067 20.329 1.00 0.00 H new ATOM 0 HD21 ASN A 115 37.090 -12.133 19.246 1.00 0.00 H new ATOM 0 HD22 ASN A 115 38.241 -11.014 18.508 1.00 0.00 H new ATOM 1727 N ILE A 116 42.517 -9.937 21.823 1.00 0.00 N ATOM 1728 CA ILE A 116 43.863 -9.401 22.060 1.00 0.00 C ATOM 1729 C ILE A 116 44.809 -10.595 22.181 1.00 0.00 C ATOM 1730 O ILE A 116 44.784 -11.318 23.178 1.00 0.00 O ATOM 1731 CB ILE A 116 43.917 -8.468 23.293 1.00 0.00 C ATOM 1732 CG1 ILE A 116 42.833 -7.365 23.228 1.00 0.00 C ATOM 1733 CG2 ILE A 116 45.326 -7.853 23.375 1.00 0.00 C ATOM 1734 CD1 ILE A 116 42.814 -6.414 24.428 1.00 0.00 C ATOM 0 H ILE A 116 42.289 -10.720 22.436 1.00 0.00 H new ATOM 0 HA ILE A 116 44.169 -8.768 21.227 1.00 0.00 H new ATOM 0 HB ILE A 116 43.711 -9.050 24.191 1.00 0.00 H new ATOM 0 HG12 ILE A 116 42.983 -6.780 22.321 1.00 0.00 H new ATOM 0 HG13 ILE A 116 41.856 -7.840 23.143 1.00 0.00 H new ATOM 0 HG21 ILE A 116 45.384 -7.191 24.239 1.00 0.00 H new ATOM 0 HG22 ILE A 116 46.065 -8.648 23.476 1.00 0.00 H new ATOM 0 HG23 ILE A 116 45.528 -7.284 22.468 1.00 0.00 H new ATOM 0 HD11 ILE A 116 42.023 -5.676 24.295 1.00 0.00 H new ATOM 0 HD12 ILE A 116 42.630 -6.982 25.340 1.00 0.00 H new ATOM 0 HD13 ILE A 116 43.775 -5.906 24.505 1.00 0.00 H new ATOM 1746 N GLN A 117 45.594 -10.836 21.130 1.00 0.00 N ATOM 1747 CA GLN A 117 46.377 -12.066 20.960 1.00 0.00 C ATOM 1748 C GLN A 117 47.820 -11.796 20.528 1.00 0.00 C ATOM 1749 O GLN A 117 48.134 -10.735 19.990 1.00 0.00 O ATOM 1750 CB GLN A 117 45.692 -12.958 19.913 1.00 0.00 C ATOM 1751 CG GLN A 117 44.273 -13.390 20.320 1.00 0.00 C ATOM 1752 CD GLN A 117 43.750 -14.508 19.431 1.00 0.00 C ATOM 1753 OE1 GLN A 117 42.869 -14.317 18.605 1.00 0.00 O ATOM 1754 NE2 GLN A 117 44.326 -15.687 19.491 1.00 0.00 N ATOM 0 H GLN A 117 45.707 -10.175 20.361 1.00 0.00 H new ATOM 0 HA GLN A 117 46.418 -12.562 21.930 1.00 0.00 H new ATOM 0 HB2 GLN A 117 45.644 -12.423 18.965 1.00 0.00 H new ATOM 0 HB3 GLN A 117 46.302 -13.846 19.747 1.00 0.00 H new ATOM 0 HG2 GLN A 117 44.277 -13.722 21.358 1.00 0.00 H new ATOM 0 HG3 GLN A 117 43.601 -12.534 20.262 1.00 0.00 H new ATOM 0 HE21 GLN A 117 45.062 -15.861 20.175 1.00 0.00 H new ATOM 0 HE22 GLN A 117 44.037 -16.429 18.853 1.00 0.00 H new ATOM 1763 N ASP A 118 48.696 -12.775 20.735 1.00 0.00 N ATOM 1764 CA ASP A 118 50.059 -12.784 20.201 1.00 0.00 C ATOM 1765 C ASP A 118 50.085 -12.756 18.659 1.00 0.00 C ATOM 1766 O ASP A 118 49.124 -13.147 17.987 1.00 0.00 O ATOM 1767 CB ASP A 118 50.782 -14.034 20.728 1.00 0.00 C ATOM 1768 CG ASP A 118 50.160 -15.328 20.190 1.00 0.00 C ATOM 1769 OD1 ASP A 118 48.973 -15.586 20.488 1.00 0.00 O ATOM 1770 OD2 ASP A 118 50.836 -16.084 19.453 1.00 0.00 O ATOM 0 H ASP A 118 48.476 -13.602 21.290 1.00 0.00 H new ATOM 0 HA ASP A 118 50.568 -11.880 20.536 1.00 0.00 H new ATOM 0 HB2 ASP A 118 51.833 -13.992 20.443 1.00 0.00 H new ATOM 0 HB3 ASP A 118 50.747 -14.041 21.817 1.00 0.00 H new ATOM 1775 N GLY A 119 51.217 -12.353 18.085 1.00 0.00 N ATOM 1776 CA GLY A 119 51.465 -12.306 16.639 1.00 0.00 C ATOM 1777 C GLY A 119 51.420 -13.657 15.902 1.00 0.00 C ATOM 1778 O GLY A 119 51.429 -13.663 14.669 1.00 0.00 O ATOM 0 H GLY A 119 52.019 -12.038 18.631 1.00 0.00 H new ATOM 0 HA2 GLY A 119 50.728 -11.643 16.186 1.00 0.00 H new ATOM 0 HA3 GLY A 119 52.444 -11.856 16.473 1.00 0.00 H new ATOM 1782 N LYS A 120 51.341 -14.794 16.616 1.00 0.00 N ATOM 1783 CA LYS A 120 51.129 -16.143 16.046 1.00 0.00 C ATOM 1784 C LYS A 120 49.747 -16.733 16.405 1.00 0.00 C ATOM 1785 O LYS A 120 49.460 -17.875 16.038 1.00 0.00 O ATOM 1786 CB LYS A 120 52.264 -17.112 16.450 1.00 0.00 C ATOM 1787 CG LYS A 120 53.688 -16.753 15.976 1.00 0.00 C ATOM 1788 CD LYS A 120 54.476 -15.739 16.810 1.00 0.00 C ATOM 1789 CE LYS A 120 54.570 -16.136 18.291 1.00 0.00 C ATOM 1790 NZ LYS A 120 55.372 -17.373 18.489 1.00 0.00 N ATOM 0 H LYS A 120 51.425 -14.804 17.633 1.00 0.00 H new ATOM 0 HA LYS A 120 51.150 -16.023 14.963 1.00 0.00 H new ATOM 0 HB2 LYS A 120 52.277 -17.186 17.537 1.00 0.00 H new ATOM 0 HB3 LYS A 120 52.018 -18.102 16.066 1.00 0.00 H new ATOM 0 HG2 LYS A 120 54.269 -17.674 15.929 1.00 0.00 H new ATOM 0 HG3 LYS A 120 53.617 -16.369 14.958 1.00 0.00 H new ATOM 0 HD2 LYS A 120 55.481 -15.640 16.400 1.00 0.00 H new ATOM 0 HD3 LYS A 120 54.001 -14.761 16.729 1.00 0.00 H new ATOM 0 HE2 LYS A 120 55.018 -15.319 18.857 1.00 0.00 H new ATOM 0 HE3 LYS A 120 53.567 -16.287 18.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 55.409 -17.604 19.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 54.931 -18.159 17.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 56.337 -17.222 18.133 1.00 0.00 H new ATOM 1804 N ARG A 121 48.881 -15.967 17.088 1.00 0.00 N ATOM 1805 CA ARG A 121 47.536 -16.347 17.585 1.00 0.00 C ATOM 1806 C ARG A 121 47.502 -17.630 18.440 1.00 0.00 C ATOM 1807 O ARG A 121 46.455 -18.271 18.556 1.00 0.00 O ATOM 1808 CB ARG A 121 46.530 -16.412 16.414 1.00 0.00 C ATOM 1809 CG ARG A 121 46.544 -15.222 15.441 1.00 0.00 C ATOM 1810 CD ARG A 121 46.106 -13.885 16.053 1.00 0.00 C ATOM 1811 NE ARG A 121 44.652 -13.857 16.317 1.00 0.00 N ATOM 1812 CZ ARG A 121 43.668 -13.692 15.454 1.00 0.00 C ATOM 1813 NH1 ARG A 121 43.868 -13.436 14.192 1.00 0.00 N ATOM 1814 NH2 ARG A 121 42.441 -13.796 15.868 1.00 0.00 N ATOM 0 H ARG A 121 49.110 -15.002 17.326 1.00 0.00 H new ATOM 0 HA ARG A 121 47.237 -15.557 18.274 1.00 0.00 H new ATOM 0 HB2 ARG A 121 46.724 -17.322 15.846 1.00 0.00 H new ATOM 0 HB3 ARG A 121 45.526 -16.503 16.829 1.00 0.00 H new ATOM 0 HG2 ARG A 121 47.552 -15.110 15.041 1.00 0.00 H new ATOM 0 HG3 ARG A 121 45.891 -15.451 14.599 1.00 0.00 H new ATOM 0 HD2 ARG A 121 46.648 -13.715 16.983 1.00 0.00 H new ATOM 0 HD3 ARG A 121 46.369 -13.071 15.377 1.00 0.00 H new ATOM 0 HE ARG A 121 44.374 -13.981 17.291 1.00 0.00 H new ATOM 0 HH11 ARG A 121 44.819 -13.355 13.833 1.00 0.00 H new ATOM 0 HH12 ARG A 121 43.073 -13.317 13.564 1.00 0.00 H new ATOM 0 HH21 ARG A 121 42.249 -14.003 16.848 1.00 0.00 H new ATOM 0 HH22 ARG A 121 41.669 -13.671 15.213 1.00 0.00 H new ATOM 1828 N THR A 122 48.631 -18.029 19.026 1.00 0.00 N ATOM 1829 CA THR A 122 48.757 -19.214 19.896 1.00 0.00 C ATOM 1830 C THR A 122 47.997 -19.091 21.224 1.00 0.00 C ATOM 1831 O THR A 122 47.624 -20.110 21.811 1.00 0.00 O ATOM 1832 CB THR A 122 50.228 -19.547 20.192 1.00 0.00 C ATOM 1833 OG1 THR A 122 50.914 -18.488 20.826 1.00 0.00 O ATOM 1834 CG2 THR A 122 51.000 -19.926 18.927 1.00 0.00 C ATOM 0 H THR A 122 49.512 -17.527 18.910 1.00 0.00 H new ATOM 0 HA THR A 122 48.300 -20.024 19.327 1.00 0.00 H new ATOM 0 HB THR A 122 50.188 -20.400 20.869 1.00 0.00 H new ATOM 0 HG1 THR A 122 50.951 -17.715 20.224 1.00 0.00 H new ATOM 0 HG21 THR A 122 52.034 -20.153 19.186 1.00 0.00 H new ATOM 0 HG22 THR A 122 50.540 -20.802 18.469 1.00 0.00 H new ATOM 0 HG23 THR A 122 50.976 -19.094 18.223 1.00 0.00 H new ATOM 1842 N VAL A 123 47.732 -17.864 21.686 1.00 0.00 N ATOM 1843 CA VAL A 123 47.094 -17.522 22.970 1.00 0.00 C ATOM 1844 C VAL A 123 46.211 -16.266 22.843 1.00 0.00 C ATOM 1845 O VAL A 123 46.109 -15.660 21.775 1.00 0.00 O ATOM 1846 CB VAL A 123 48.160 -17.329 24.079 1.00 0.00 C ATOM 1847 CG1 VAL A 123 48.880 -18.633 24.443 1.00 0.00 C ATOM 1848 CG2 VAL A 123 49.219 -16.280 23.717 1.00 0.00 C ATOM 0 H VAL A 123 47.969 -17.032 21.145 1.00 0.00 H new ATOM 0 HA VAL A 123 46.450 -18.355 23.250 1.00 0.00 H new ATOM 0 HB VAL A 123 47.591 -16.978 24.940 1.00 0.00 H new ATOM 0 HG11 VAL A 123 49.615 -18.437 25.224 1.00 0.00 H new ATOM 0 HG12 VAL A 123 48.153 -19.362 24.803 1.00 0.00 H new ATOM 0 HG13 VAL A 123 49.384 -19.028 23.561 1.00 0.00 H new ATOM 0 HG21 VAL A 123 49.936 -16.191 24.533 1.00 0.00 H new ATOM 0 HG22 VAL A 123 49.738 -16.586 22.809 1.00 0.00 H new ATOM 0 HG23 VAL A 123 48.736 -15.317 23.552 1.00 0.00 H new ATOM 1858 N SER A 124 45.549 -15.871 23.932 1.00 0.00 N ATOM 1859 CA SER A 124 44.740 -14.653 24.071 1.00 0.00 C ATOM 1860 C SER A 124 44.812 -14.105 25.503 1.00 0.00 C ATOM 1861 O SER A 124 45.050 -14.861 26.450 1.00 0.00 O ATOM 1862 CB SER A 124 43.282 -14.971 23.711 1.00 0.00 C ATOM 1863 OG SER A 124 42.537 -13.777 23.548 1.00 0.00 O ATOM 0 H SER A 124 45.562 -16.422 24.790 1.00 0.00 H new ATOM 0 HA SER A 124 45.134 -13.893 23.396 1.00 0.00 H new ATOM 0 HB2 SER A 124 43.248 -15.556 22.792 1.00 0.00 H new ATOM 0 HB3 SER A 124 42.833 -15.582 24.494 1.00 0.00 H new ATOM 0 HG SER A 124 43.151 -13.021 23.437 1.00 0.00 H new ATOM 1869 N TRP A 125 44.613 -12.795 25.677 1.00 0.00 N ATOM 1870 CA TRP A 125 44.523 -12.153 26.995 1.00 0.00 C ATOM 1871 C TRP A 125 43.234 -12.558 27.721 1.00 0.00 C ATOM 1872 O TRP A 125 42.140 -12.504 27.152 1.00 0.00 O ATOM 1873 CB TRP A 125 44.537 -10.626 26.863 1.00 0.00 C ATOM 1874 CG TRP A 125 45.830 -9.954 26.524 1.00 0.00 C ATOM 1875 CD1 TRP A 125 46.937 -10.530 26.001 1.00 0.00 C ATOM 1876 CD2 TRP A 125 46.153 -8.538 26.667 1.00 0.00 C ATOM 1877 NE1 TRP A 125 47.907 -9.570 25.795 1.00 0.00 N ATOM 1878 CE2 TRP A 125 47.472 -8.320 26.171 1.00 0.00 C ATOM 1879 CE3 TRP A 125 45.449 -7.411 27.141 1.00 0.00 C ATOM 1880 CZ2 TRP A 125 48.057 -7.047 26.118 1.00 0.00 C ATOM 1881 CZ3 TRP A 125 46.031 -6.130 27.099 1.00 0.00 C ATOM 1882 CH2 TRP A 125 47.326 -5.943 26.585 1.00 0.00 C ATOM 0 H TRP A 125 44.509 -12.143 24.900 1.00 0.00 H new ATOM 0 HA TRP A 125 45.389 -12.485 27.568 1.00 0.00 H new ATOM 0 HB2 TRP A 125 43.810 -10.352 26.099 1.00 0.00 H new ATOM 0 HB3 TRP A 125 44.182 -10.208 27.805 1.00 0.00 H new ATOM 0 HD1 TRP A 125 47.045 -11.581 25.779 1.00 0.00 H new ATOM 0 HE1 TRP A 125 48.832 -9.763 25.411 1.00 0.00 H new ATOM 0 HE3 TRP A 125 44.453 -7.532 27.540 1.00 0.00 H new ATOM 0 HZ2 TRP A 125 49.054 -6.918 25.724 1.00 0.00 H new ATOM 0 HZ3 TRP A 125 45.475 -5.280 27.466 1.00 0.00 H new ATOM 0 HH2 TRP A 125 47.757 -4.953 26.549 1.00 0.00 H new ATOM 1893 N SER A 126 43.363 -12.889 29.002 1.00 0.00 N ATOM 1894 CA SER A 126 42.293 -13.419 29.853 1.00 0.00 C ATOM 1895 C SER A 126 42.382 -12.929 31.308 1.00 0.00 C ATOM 1896 O SER A 126 43.330 -12.238 31.696 1.00 0.00 O ATOM 1897 CB SER A 126 42.313 -14.956 29.793 1.00 0.00 C ATOM 1898 OG SER A 126 43.547 -15.474 30.271 1.00 0.00 O ATOM 0 H SER A 126 44.249 -12.793 29.499 1.00 0.00 H new ATOM 0 HA SER A 126 41.346 -13.042 29.467 1.00 0.00 H new ATOM 0 HB2 SER A 126 41.493 -15.356 30.389 1.00 0.00 H new ATOM 0 HB3 SER A 126 42.151 -15.284 28.766 1.00 0.00 H new ATOM 0 HG SER A 126 43.531 -16.453 30.223 1.00 0.00 H new ATOM 1904 N LEU A 127 41.381 -13.289 32.117 1.00 0.00 N ATOM 1905 CA LEU A 127 41.276 -12.995 33.551 1.00 0.00 C ATOM 1906 C LEU A 127 40.947 -14.271 34.352 1.00 0.00 C ATOM 1907 O LEU A 127 40.409 -15.239 33.809 1.00 0.00 O ATOM 1908 CB LEU A 127 40.190 -11.921 33.787 1.00 0.00 C ATOM 1909 CG LEU A 127 40.449 -10.539 33.155 1.00 0.00 C ATOM 1910 CD1 LEU A 127 39.251 -9.626 33.425 1.00 0.00 C ATOM 1911 CD2 LEU A 127 41.690 -9.846 33.721 1.00 0.00 C ATOM 0 H LEU A 127 40.581 -13.820 31.773 1.00 0.00 H new ATOM 0 HA LEU A 127 42.237 -12.616 33.898 1.00 0.00 H new ATOM 0 HB2 LEU A 127 39.243 -12.301 33.403 1.00 0.00 H new ATOM 0 HB3 LEU A 127 40.068 -11.788 34.862 1.00 0.00 H new ATOM 0 HG LEU A 127 40.605 -10.710 32.090 1.00 0.00 H new ATOM 0 HD11 LEU A 127 39.431 -8.648 32.979 1.00 0.00 H new ATOM 0 HD12 LEU A 127 38.354 -10.064 32.988 1.00 0.00 H new ATOM 0 HD13 LEU A 127 39.113 -9.515 34.501 1.00 0.00 H new ATOM 0 HD21 LEU A 127 41.819 -8.878 33.237 1.00 0.00 H new ATOM 0 HD22 LEU A 127 41.568 -9.701 34.794 1.00 0.00 H new ATOM 0 HD23 LEU A 127 42.568 -10.464 33.536 1.00 0.00 H new ATOM 1923 N ASN A 128 41.232 -14.256 35.657 1.00 0.00 N ATOM 1924 CA ASN A 128 41.102 -15.401 36.571 1.00 0.00 C ATOM 1925 C ASN A 128 40.218 -15.121 37.801 1.00 0.00 C ATOM 1926 O ASN A 128 39.648 -16.056 38.370 1.00 0.00 O ATOM 1927 CB ASN A 128 42.506 -15.823 37.029 1.00 0.00 C ATOM 1928 CG ASN A 128 43.333 -16.437 35.913 1.00 0.00 C ATOM 1929 OD1 ASN A 128 43.044 -17.512 35.406 1.00 0.00 O ATOM 1930 ND2 ASN A 128 44.393 -15.779 35.508 1.00 0.00 N ATOM 0 H ASN A 128 41.572 -13.417 36.126 1.00 0.00 H new ATOM 0 HA ASN A 128 40.604 -16.198 36.019 1.00 0.00 H new ATOM 0 HB2 ASN A 128 43.030 -14.953 37.426 1.00 0.00 H new ATOM 0 HB3 ASN A 128 42.416 -16.541 37.845 1.00 0.00 H new ATOM 0 HD21 ASN A 128 44.980 -16.163 34.768 1.00 0.00 H new ATOM 0 HD22 ASN A 128 44.630 -14.883 35.933 1.00 0.00 H new ATOM 1937 N ASN A 129 40.067 -13.853 38.192 1.00 0.00 N ATOM 1938 CA ASN A 129 39.215 -13.402 39.299 1.00 0.00 C ATOM 1939 C ASN A 129 38.030 -12.547 38.807 1.00 0.00 C ATOM 1940 O ASN A 129 37.063 -12.360 39.545 1.00 0.00 O ATOM 1941 CB ASN A 129 40.078 -12.615 40.301 1.00 0.00 C ATOM 1942 CG ASN A 129 41.220 -13.436 40.873 1.00 0.00 C ATOM 1943 OD1 ASN A 129 41.027 -14.370 41.640 1.00 0.00 O ATOM 1944 ND2 ASN A 129 42.447 -13.120 40.520 1.00 0.00 N ATOM 0 H ASN A 129 40.552 -13.083 37.731 1.00 0.00 H new ATOM 0 HA ASN A 129 38.785 -14.277 39.786 1.00 0.00 H new ATOM 0 HB2 ASN A 129 40.484 -11.732 39.807 1.00 0.00 H new ATOM 0 HB3 ASN A 129 39.447 -12.262 41.117 1.00 0.00 H new ATOM 0 HD21 ASN A 129 43.236 -13.653 40.885 1.00 0.00 H new ATOM 0 HD22 ASN A 129 42.609 -12.342 39.881 1.00 0.00 H new ATOM 1951 N ALA A 130 38.087 -12.069 37.555 1.00 0.00 N ATOM 1952 CA ALA A 130 37.103 -11.180 36.920 1.00 0.00 C ATOM 1953 C ALA A 130 36.773 -9.906 37.742 1.00 0.00 C ATOM 1954 O ALA A 130 35.639 -9.420 37.729 1.00 0.00 O ATOM 1955 CB ALA A 130 35.871 -12.007 36.513 1.00 0.00 C ATOM 0 H ALA A 130 38.857 -12.303 36.928 1.00 0.00 H new ATOM 0 HA ALA A 130 37.549 -10.764 36.017 1.00 0.00 H new ATOM 0 HB1 ALA A 130 35.135 -11.356 36.041 1.00 0.00 H new ATOM 0 HB2 ALA A 130 36.171 -12.785 35.811 1.00 0.00 H new ATOM 0 HB3 ALA A 130 35.433 -12.467 37.399 1.00 0.00 H new ATOM 1961 N THR A 131 37.758 -9.369 38.471 1.00 0.00 N ATOM 1962 CA THR A 131 37.614 -8.216 39.384 1.00 0.00 C ATOM 1963 C THR A 131 38.822 -7.271 39.317 1.00 0.00 C ATOM 1964 O THR A 131 39.884 -7.617 38.793 1.00 0.00 O ATOM 1965 CB THR A 131 37.407 -8.672 40.843 1.00 0.00 C ATOM 1966 OG1 THR A 131 38.379 -9.624 41.225 1.00 0.00 O ATOM 1967 CG2 THR A 131 36.019 -9.274 41.071 1.00 0.00 C ATOM 0 H THR A 131 38.711 -9.733 38.445 1.00 0.00 H new ATOM 0 HA THR A 131 36.730 -7.674 39.049 1.00 0.00 H new ATOM 0 HB THR A 131 37.506 -7.775 41.455 1.00 0.00 H new ATOM 0 HG1 THR A 131 38.225 -9.894 42.154 1.00 0.00 H new ATOM 0 HG21 THR A 131 35.922 -9.580 42.113 1.00 0.00 H new ATOM 0 HG22 THR A 131 35.257 -8.530 40.839 1.00 0.00 H new ATOM 0 HG23 THR A 131 35.888 -10.142 40.424 1.00 0.00 H new ATOM 1975 N ALA A 132 38.655 -6.049 39.836 1.00 0.00 N ATOM 1976 CA ALA A 132 39.713 -5.040 39.885 1.00 0.00 C ATOM 1977 C ALA A 132 40.918 -5.482 40.741 1.00 0.00 C ATOM 1978 O ALA A 132 40.775 -6.225 41.717 1.00 0.00 O ATOM 1979 CB ALA A 132 39.114 -3.731 40.409 1.00 0.00 C ATOM 0 H ALA A 132 37.772 -5.732 40.237 1.00 0.00 H new ATOM 0 HA ALA A 132 40.102 -4.898 38.877 1.00 0.00 H new ATOM 0 HB1 ALA A 132 39.890 -2.967 40.452 1.00 0.00 H new ATOM 0 HB2 ALA A 132 38.318 -3.402 39.741 1.00 0.00 H new ATOM 0 HB3 ALA A 132 38.707 -3.891 41.407 1.00 0.00 H new ATOM 1985 N GLY A 133 42.107 -4.995 40.380 1.00 0.00 N ATOM 1986 CA GLY A 133 43.381 -5.314 41.029 1.00 0.00 C ATOM 1987 C GLY A 133 44.096 -6.544 40.453 1.00 0.00 C ATOM 1988 O GLY A 133 45.232 -6.815 40.846 1.00 0.00 O ATOM 0 H GLY A 133 42.213 -4.345 39.601 1.00 0.00 H new ATOM 0 HA2 GLY A 133 44.043 -4.452 40.946 1.00 0.00 H new ATOM 0 HA3 GLY A 133 43.202 -5.477 42.092 1.00 0.00 H new ATOM 1992 N GLU A 134 43.474 -7.294 39.532 1.00 0.00 N ATOM 1993 CA GLU A 134 44.126 -8.433 38.872 1.00 0.00 C ATOM 1994 C GLU A 134 45.286 -7.975 37.963 1.00 0.00 C ATOM 1995 O GLU A 134 45.180 -6.980 37.244 1.00 0.00 O ATOM 1996 CB GLU A 134 43.104 -9.279 38.087 1.00 0.00 C ATOM 1997 CG GLU A 134 43.689 -10.671 37.796 1.00 0.00 C ATOM 1998 CD GLU A 134 42.768 -11.602 36.994 1.00 0.00 C ATOM 1999 OE1 GLU A 134 41.544 -11.660 37.252 1.00 0.00 O ATOM 2000 OE2 GLU A 134 43.291 -12.365 36.153 1.00 0.00 O ATOM 0 H GLU A 134 42.515 -7.130 39.226 1.00 0.00 H new ATOM 0 HA GLU A 134 44.553 -9.062 39.653 1.00 0.00 H new ATOM 0 HB2 GLU A 134 42.182 -9.375 38.660 1.00 0.00 H new ATOM 0 HB3 GLU A 134 42.848 -8.780 37.152 1.00 0.00 H new ATOM 0 HG2 GLU A 134 44.624 -10.550 37.250 1.00 0.00 H new ATOM 0 HG3 GLU A 134 43.933 -11.152 38.743 1.00 0.00 H new ATOM 2007 N GLU A 135 46.383 -8.739 37.954 1.00 0.00 N ATOM 2008 CA GLU A 135 47.590 -8.498 37.141 1.00 0.00 C ATOM 2009 C GLU A 135 47.447 -8.932 35.657 1.00 0.00 C ATOM 2010 O GLU A 135 48.436 -9.001 34.921 1.00 0.00 O ATOM 2011 CB GLU A 135 48.789 -9.206 37.806 1.00 0.00 C ATOM 2012 CG GLU A 135 49.072 -8.687 39.225 1.00 0.00 C ATOM 2013 CD GLU A 135 50.279 -9.407 39.858 1.00 0.00 C ATOM 2014 OE1 GLU A 135 50.157 -10.605 40.217 1.00 0.00 O ATOM 2015 OE2 GLU A 135 51.350 -8.777 40.028 1.00 0.00 O ATOM 0 H GLU A 135 46.462 -9.575 38.533 1.00 0.00 H new ATOM 0 HA GLU A 135 47.749 -7.420 37.109 1.00 0.00 H new ATOM 0 HB2 GLU A 135 48.595 -10.278 37.848 1.00 0.00 H new ATOM 0 HB3 GLU A 135 49.676 -9.066 37.189 1.00 0.00 H new ATOM 0 HG2 GLU A 135 49.264 -7.615 39.190 1.00 0.00 H new ATOM 0 HG3 GLU A 135 48.191 -8.833 39.850 1.00 0.00 H new ATOM 2022 N VAL A 136 46.216 -9.246 35.218 1.00 0.00 N ATOM 2023 CA VAL A 136 45.854 -9.840 33.909 1.00 0.00 C ATOM 2024 C VAL A 136 46.529 -11.216 33.685 1.00 0.00 C ATOM 2025 O VAL A 136 47.378 -11.658 34.463 1.00 0.00 O ATOM 2026 CB VAL A 136 46.070 -8.819 32.755 1.00 0.00 C ATOM 2027 CG1 VAL A 136 45.438 -9.243 31.417 1.00 0.00 C ATOM 2028 CG2 VAL A 136 45.440 -7.457 33.091 1.00 0.00 C ATOM 0 H VAL A 136 45.394 -9.084 35.799 1.00 0.00 H new ATOM 0 HA VAL A 136 44.786 -10.060 33.913 1.00 0.00 H new ATOM 0 HB VAL A 136 47.154 -8.767 32.652 1.00 0.00 H new ATOM 0 HG11 VAL A 136 45.633 -8.479 30.664 1.00 0.00 H new ATOM 0 HG12 VAL A 136 45.871 -10.190 31.094 1.00 0.00 H new ATOM 0 HG13 VAL A 136 44.362 -9.361 31.544 1.00 0.00 H new ATOM 0 HG21 VAL A 136 45.608 -6.765 32.266 1.00 0.00 H new ATOM 0 HG22 VAL A 136 44.369 -7.581 33.249 1.00 0.00 H new ATOM 0 HG23 VAL A 136 45.897 -7.058 33.997 1.00 0.00 H new ATOM 2038 N SER A 137 46.126 -11.950 32.647 1.00 0.00 N ATOM 2039 CA SER A 137 46.663 -13.274 32.305 1.00 0.00 C ATOM 2040 C SER A 137 46.640 -13.524 30.795 1.00 0.00 C ATOM 2041 O SER A 137 46.016 -12.775 30.039 1.00 0.00 O ATOM 2042 CB SER A 137 45.836 -14.335 33.035 1.00 0.00 C ATOM 2043 OG SER A 137 46.520 -15.576 33.120 1.00 0.00 O ATOM 0 H SER A 137 45.400 -11.636 32.003 1.00 0.00 H new ATOM 0 HA SER A 137 47.706 -13.325 32.618 1.00 0.00 H new ATOM 0 HB2 SER A 137 45.598 -13.982 34.039 1.00 0.00 H new ATOM 0 HB3 SER A 137 44.889 -14.478 32.515 1.00 0.00 H new ATOM 0 HG SER A 137 45.887 -16.309 32.972 1.00 0.00 H new ATOM 2049 N ILE A 138 47.340 -14.567 30.349 1.00 0.00 N ATOM 2050 CA ILE A 138 47.417 -15.014 28.951 1.00 0.00 C ATOM 2051 C ILE A 138 47.334 -16.547 28.911 1.00 0.00 C ATOM 2052 O ILE A 138 48.003 -17.240 29.682 1.00 0.00 O ATOM 2053 CB ILE A 138 48.715 -14.491 28.282 1.00 0.00 C ATOM 2054 CG1 ILE A 138 48.692 -12.953 28.146 1.00 0.00 C ATOM 2055 CG2 ILE A 138 48.910 -15.109 26.888 1.00 0.00 C ATOM 2056 CD1 ILE A 138 50.036 -12.328 27.758 1.00 0.00 C ATOM 0 H ILE A 138 47.894 -15.151 30.976 1.00 0.00 H new ATOM 0 HA ILE A 138 46.580 -14.605 28.385 1.00 0.00 H new ATOM 0 HB ILE A 138 49.544 -14.785 28.926 1.00 0.00 H new ATOM 0 HG12 ILE A 138 47.949 -12.678 27.398 1.00 0.00 H new ATOM 0 HG13 ILE A 138 48.365 -12.522 29.093 1.00 0.00 H new ATOM 0 HG21 ILE A 138 49.828 -14.723 26.444 1.00 0.00 H new ATOM 0 HG22 ILE A 138 48.978 -16.193 26.977 1.00 0.00 H new ATOM 0 HG23 ILE A 138 48.063 -14.849 26.253 1.00 0.00 H new ATOM 0 HD11 ILE A 138 49.927 -11.246 27.685 1.00 0.00 H new ATOM 0 HD12 ILE A 138 50.781 -12.567 28.517 1.00 0.00 H new ATOM 0 HD13 ILE A 138 50.358 -12.726 26.796 1.00 0.00 H new ATOM 2068 N GLY A 139 46.529 -17.080 27.991 1.00 0.00 N ATOM 2069 CA GLY A 139 46.316 -18.520 27.815 1.00 0.00 C ATOM 2070 C GLY A 139 45.455 -18.844 26.593 1.00 0.00 C ATOM 2071 O GLY A 139 45.283 -18.007 25.708 1.00 0.00 O ATOM 0 H GLY A 139 45.995 -16.512 27.333 1.00 0.00 H new ATOM 0 HA2 GLY A 139 47.281 -19.017 27.716 1.00 0.00 H new ATOM 0 HA3 GLY A 139 45.839 -18.924 28.708 1.00 0.00 H new ATOM 2141 N SER A 145 35.719 -14.985 29.911 1.00 0.00 N ATOM 2142 CA SER A 145 36.899 -14.507 30.657 1.00 0.00 C ATOM 2143 C SER A 145 38.118 -14.194 29.773 1.00 0.00 C ATOM 2144 O SER A 145 39.199 -13.929 30.298 1.00 0.00 O ATOM 2145 CB SER A 145 37.246 -15.526 31.752 1.00 0.00 C ATOM 2146 OG SER A 145 37.495 -16.802 31.183 1.00 0.00 O ATOM 0 HA SER A 145 36.632 -13.550 31.105 1.00 0.00 H new ATOM 0 HB2 SER A 145 38.124 -15.190 32.304 1.00 0.00 H new ATOM 0 HB3 SER A 145 36.426 -15.594 32.467 1.00 0.00 H new ATOM 0 HG SER A 145 36.930 -16.923 30.392 1.00 0.00 H new ATOM 2152 N GLY A 146 37.958 -14.192 28.442 1.00 0.00 N ATOM 2153 CA GLY A 146 39.035 -13.992 27.456 1.00 0.00 C ATOM 2154 C GLY A 146 38.610 -13.186 26.221 1.00 0.00 C ATOM 2155 O GLY A 146 39.118 -13.419 25.123 1.00 0.00 O ATOM 0 H GLY A 146 37.047 -14.334 28.006 1.00 0.00 H new ATOM 0 HA2 GLY A 146 39.867 -13.482 27.941 1.00 0.00 H new ATOM 0 HA3 GLY A 146 39.403 -14.966 27.133 1.00 0.00 H new ATOM 2159 N ARG A 147 37.664 -12.253 26.398 1.00 0.00 N ATOM 2160 CA ARG A 147 37.083 -11.397 25.347 1.00 0.00 C ATOM 2161 C ARG A 147 37.046 -9.940 25.823 1.00 0.00 C ATOM 2162 O ARG A 147 36.824 -9.665 27.005 1.00 0.00 O ATOM 2163 CB ARG A 147 35.679 -11.933 24.990 1.00 0.00 C ATOM 2164 CG ARG A 147 35.128 -11.450 23.633 1.00 0.00 C ATOM 2165 CD ARG A 147 35.753 -12.166 22.423 1.00 0.00 C ATOM 2166 NE ARG A 147 35.340 -13.587 22.363 1.00 0.00 N ATOM 2167 CZ ARG A 147 36.084 -14.650 22.621 1.00 0.00 C ATOM 2168 NH1 ARG A 147 37.370 -14.597 22.759 1.00 0.00 N ATOM 2169 NH2 ARG A 147 35.547 -15.825 22.752 1.00 0.00 N ATOM 0 H ARG A 147 37.263 -12.064 27.317 1.00 0.00 H new ATOM 0 HA ARG A 147 37.696 -11.423 24.446 1.00 0.00 H new ATOM 0 HB2 ARG A 147 35.712 -13.023 24.986 1.00 0.00 H new ATOM 0 HB3 ARG A 147 34.982 -11.638 25.775 1.00 0.00 H new ATOM 0 HG2 ARG A 147 34.048 -11.599 23.615 1.00 0.00 H new ATOM 0 HG3 ARG A 147 35.303 -10.378 23.540 1.00 0.00 H new ATOM 0 HD2 ARG A 147 35.455 -11.660 21.505 1.00 0.00 H new ATOM 0 HD3 ARG A 147 36.840 -12.104 22.483 1.00 0.00 H new ATOM 0 HE ARG A 147 34.373 -13.766 22.092 1.00 0.00 H new ATOM 0 HH11 ARG A 147 37.856 -13.705 22.669 1.00 0.00 H new ATOM 0 HH12 ARG A 147 37.897 -15.447 22.958 1.00 0.00 H new ATOM 0 HH21 ARG A 147 34.538 -15.938 22.656 1.00 0.00 H new ATOM 0 HH22 ARG A 147 36.134 -16.635 22.951 1.00 0.00 H new ATOM 2183 N TRP A 148 37.234 -9.005 24.896 1.00 0.00 N ATOM 2184 CA TRP A 148 37.458 -7.584 25.176 1.00 0.00 C ATOM 2185 C TRP A 148 36.589 -6.683 24.286 1.00 0.00 C ATOM 2186 O TRP A 148 35.898 -7.149 23.380 1.00 0.00 O ATOM 2187 CB TRP A 148 38.960 -7.290 24.997 1.00 0.00 C ATOM 2188 CG TRP A 148 39.868 -8.064 25.909 1.00 0.00 C ATOM 2189 CD1 TRP A 148 40.373 -9.297 25.664 1.00 0.00 C ATOM 2190 CD2 TRP A 148 40.364 -7.690 27.233 1.00 0.00 C ATOM 2191 NE1 TRP A 148 41.114 -9.722 26.748 1.00 0.00 N ATOM 2192 CE2 TRP A 148 41.137 -8.775 27.751 1.00 0.00 C ATOM 2193 CE3 TRP A 148 40.234 -6.544 28.050 1.00 0.00 C ATOM 2194 CZ2 TRP A 148 41.730 -8.734 29.022 1.00 0.00 C ATOM 2195 CZ3 TRP A 148 40.830 -6.491 29.327 1.00 0.00 C ATOM 2196 CH2 TRP A 148 41.573 -7.583 29.814 1.00 0.00 C ATOM 0 H TRP A 148 37.235 -9.218 23.899 1.00 0.00 H new ATOM 0 HA TRP A 148 37.162 -7.362 26.201 1.00 0.00 H new ATOM 0 HB2 TRP A 148 39.237 -7.504 23.965 1.00 0.00 H new ATOM 0 HB3 TRP A 148 39.129 -6.225 25.158 1.00 0.00 H new ATOM 0 HD1 TRP A 148 40.219 -9.862 24.757 1.00 0.00 H new ATOM 0 HE1 TRP A 148 41.586 -10.625 26.801 1.00 0.00 H new ATOM 0 HE3 TRP A 148 39.670 -5.696 27.691 1.00 0.00 H new ATOM 0 HZ2 TRP A 148 42.300 -9.576 29.387 1.00 0.00 H new ATOM 0 HZ3 TRP A 148 40.716 -5.606 29.936 1.00 0.00 H new ATOM 0 HH2 TRP A 148 42.022 -7.537 30.795 1.00 0.00 H new ATOM 2207 N VAL A 149 36.631 -5.379 24.544 1.00 0.00 N ATOM 2208 CA VAL A 149 36.012 -4.317 23.742 1.00 0.00 C ATOM 2209 C VAL A 149 36.981 -3.131 23.706 1.00 0.00 C ATOM 2210 O VAL A 149 37.688 -2.863 24.682 1.00 0.00 O ATOM 2211 CB VAL A 149 34.643 -3.893 24.318 1.00 0.00 C ATOM 2212 CG1 VAL A 149 33.922 -2.918 23.376 1.00 0.00 C ATOM 2213 CG2 VAL A 149 33.692 -5.078 24.535 1.00 0.00 C ATOM 0 H VAL A 149 37.122 -5.011 25.359 1.00 0.00 H new ATOM 0 HA VAL A 149 35.823 -4.683 22.733 1.00 0.00 H new ATOM 0 HB VAL A 149 34.873 -3.426 25.276 1.00 0.00 H new ATOM 0 HG11 VAL A 149 32.962 -2.638 23.808 1.00 0.00 H new ATOM 0 HG12 VAL A 149 34.533 -2.026 23.239 1.00 0.00 H new ATOM 0 HG13 VAL A 149 33.759 -3.398 22.411 1.00 0.00 H new ATOM 0 HG21 VAL A 149 32.747 -4.717 24.941 1.00 0.00 H new ATOM 0 HG22 VAL A 149 33.511 -5.578 23.584 1.00 0.00 H new ATOM 0 HG23 VAL A 149 34.142 -5.782 25.235 1.00 0.00 H new ATOM 2223 N ILE A 150 37.049 -2.446 22.563 1.00 0.00 N ATOM 2224 CA ILE A 150 38.025 -1.390 22.274 1.00 0.00 C ATOM 2225 C ILE A 150 37.303 -0.243 21.573 1.00 0.00 C ATOM 2226 O ILE A 150 36.401 -0.465 20.761 1.00 0.00 O ATOM 2227 CB ILE A 150 39.199 -1.928 21.417 1.00 0.00 C ATOM 2228 CG1 ILE A 150 39.841 -3.158 22.100 1.00 0.00 C ATOM 2229 CG2 ILE A 150 40.251 -0.821 21.171 1.00 0.00 C ATOM 2230 CD1 ILE A 150 41.029 -3.746 21.346 1.00 0.00 C ATOM 0 H ILE A 150 36.407 -2.615 21.788 1.00 0.00 H new ATOM 0 HA ILE A 150 38.461 -1.030 23.206 1.00 0.00 H new ATOM 0 HB ILE A 150 38.807 -2.238 20.448 1.00 0.00 H new ATOM 0 HG12 ILE A 150 40.165 -2.875 23.101 1.00 0.00 H new ATOM 0 HG13 ILE A 150 39.082 -3.931 22.218 1.00 0.00 H new ATOM 0 HG21 ILE A 150 41.066 -1.221 20.568 1.00 0.00 H new ATOM 0 HG22 ILE A 150 39.786 0.013 20.645 1.00 0.00 H new ATOM 0 HG23 ILE A 150 40.644 -0.474 22.127 1.00 0.00 H new ATOM 0 HD11 ILE A 150 41.419 -4.604 21.894 1.00 0.00 H new ATOM 0 HD12 ILE A 150 40.709 -4.064 20.354 1.00 0.00 H new ATOM 0 HD13 ILE A 150 41.809 -2.991 21.251 1.00 0.00 H new ATOM 2242 N GLU A 151 37.694 0.987 21.892 1.00 0.00 N ATOM 2243 CA GLU A 151 37.045 2.195 21.365 1.00 0.00 C ATOM 2244 C GLU A 151 38.019 3.370 21.241 1.00 0.00 C ATOM 2245 O GLU A 151 38.958 3.493 22.028 1.00 0.00 O ATOM 2246 CB GLU A 151 35.862 2.565 22.272 1.00 0.00 C ATOM 2247 CG GLU A 151 34.776 3.325 21.505 1.00 0.00 C ATOM 2248 CD GLU A 151 33.582 3.675 22.414 1.00 0.00 C ATOM 2249 OE1 GLU A 151 33.637 4.704 23.131 1.00 0.00 O ATOM 2250 OE2 GLU A 151 32.569 2.934 22.403 1.00 0.00 O ATOM 0 H GLU A 151 38.471 1.180 22.524 1.00 0.00 H new ATOM 0 HA GLU A 151 36.688 1.979 20.358 1.00 0.00 H new ATOM 0 HB2 GLU A 151 35.437 1.659 22.703 1.00 0.00 H new ATOM 0 HB3 GLU A 151 36.217 3.176 23.102 1.00 0.00 H new ATOM 0 HG2 GLU A 151 35.197 4.240 21.087 1.00 0.00 H new ATOM 0 HG3 GLU A 151 34.431 2.721 20.666 1.00 0.00 H new ATOM 2257 N LYS A 152 37.808 4.215 20.228 1.00 0.00 N ATOM 2258 CA LYS A 152 38.688 5.334 19.871 1.00 0.00 C ATOM 2259 C LYS A 152 38.372 6.571 20.723 1.00 0.00 C ATOM 2260 O LYS A 152 37.199 6.847 20.996 1.00 0.00 O ATOM 2261 CB LYS A 152 38.534 5.588 18.353 1.00 0.00 C ATOM 2262 CG LYS A 152 39.722 6.308 17.694 1.00 0.00 C ATOM 2263 CD LYS A 152 39.620 7.840 17.730 1.00 0.00 C ATOM 2264 CE LYS A 152 40.983 8.453 17.396 1.00 0.00 C ATOM 2265 NZ LYS A 152 41.033 9.884 17.786 1.00 0.00 N ATOM 0 H LYS A 152 36.996 4.138 19.615 1.00 0.00 H new ATOM 0 HA LYS A 152 39.730 5.095 20.082 1.00 0.00 H new ATOM 0 HB2 LYS A 152 38.385 4.631 17.853 1.00 0.00 H new ATOM 0 HB3 LYS A 152 37.633 6.178 18.188 1.00 0.00 H new ATOM 0 HG2 LYS A 152 40.641 6.003 18.194 1.00 0.00 H new ATOM 0 HG3 LYS A 152 39.801 5.983 16.656 1.00 0.00 H new ATOM 0 HD2 LYS A 152 38.871 8.182 17.015 1.00 0.00 H new ATOM 0 HD3 LYS A 152 39.293 8.170 18.716 1.00 0.00 H new ATOM 0 HE2 LYS A 152 41.769 7.904 17.914 1.00 0.00 H new ATOM 0 HE3 LYS A 152 41.177 8.357 16.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 41.840 10.344 17.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 40.151 10.354 17.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 41.143 9.959 18.817 1.00 0.00 H new ATOM 2279 N VAL A 153 39.405 7.326 21.109 1.00 0.00 N ATOM 2280 CA VAL A 153 39.319 8.536 21.973 1.00 0.00 C ATOM 2281 C VAL A 153 40.093 9.752 21.454 1.00 0.00 C ATOM 2282 O VAL A 153 39.814 10.872 21.938 1.00 0.00 O ATOM 2283 CB VAL A 153 39.708 8.229 23.432 1.00 0.00 C ATOM 2284 CG1 VAL A 153 38.732 7.228 24.056 1.00 0.00 C ATOM 2285 CG2 VAL A 153 41.135 7.688 23.564 1.00 0.00 C ATOM 2286 OXT VAL A 153 40.922 9.610 20.528 1.00 0.00 O ATOM 0 H VAL A 153 40.362 7.115 20.826 1.00 0.00 H new ATOM 0 HA VAL A 153 38.267 8.817 21.937 1.00 0.00 H new ATOM 0 HB VAL A 153 39.659 9.179 23.965 1.00 0.00 H new ATOM 0 HG11 VAL A 153 39.026 7.026 25.086 1.00 0.00 H new ATOM 0 HG12 VAL A 153 37.725 7.644 24.041 1.00 0.00 H new ATOM 0 HG13 VAL A 153 38.749 6.299 23.485 1.00 0.00 H new ATOM 0 HG21 VAL A 153 41.353 7.490 24.613 1.00 0.00 H new ATOM 0 HG22 VAL A 153 41.228 6.764 22.993 1.00 0.00 H new ATOM 0 HG23 VAL A 153 41.840 8.425 23.179 1.00 0.00 H new