USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 914 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 125 ASN : amide:sc= -0.531 X(o=-1,f=-1.1) USER MOD Set 1.2: A 137 ASN : amide:sc= -0.479 K(o=-1,f=-2.2!) USER MOD Set 2.1: A 101 THR OG1 : rot -67:sc= 1.2 USER MOD Set 2.2: A 103 GLN : amide:sc= 1.88 K(o=3.1,f=-6.1!) USER MOD Set 3.1: A 86 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 110 MET CE :methyl -177:sc= 0 (180deg=-0.0169) USER MOD Set 4.1: A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 88 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 71 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 55:sc= 0.707 USER MOD Single : A 31 GLN : amide:sc= 1.17 K(o=1.2,f=-3.6!) USER MOD Single : A 34 THR OG1 : rot -56:sc= 1.21 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 168:sc= 1.08 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -172:sc= 0 (180deg=-0.112) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -1.11 K(o=-1.1,f=-2.7) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= -0.309 USER MOD Single : A 57 GLN : amide:sc= 0.137 K(o=0.14,f=-0.77) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 1.03! (180deg=1.03!) USER MOD Single : A 66 THR OG1 : rot 93:sc= 1.26 USER MOD Single : A 70 THR OG1 : rot 75:sc= 1.12 USER MOD Single : A 76 THR OG1 : rot 28:sc= 1.67 USER MOD Single : A 77 THR OG1 : rot 160:sc=-0.00562 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0.12 USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.759 USER MOD Single : A 99 THR OG1 : rot -52:sc= 0.533 USER MOD Single : A 108 HIS : no HE2:sc= 0.337 K(o=0.34,f=-3.4!) USER MOD Single : A 112 MET CE :methyl -131:sc= -0.0256 (180deg=-0.2) USER MOD Single : A 115 LYS NZ :NH3+ 165:sc= 2.36 (180deg=1.92) USER MOD Single : A 119 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00126) USER MOD Single : A 123 THR OG1 : rot 10:sc= 0.621 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot -31:sc= 0.124 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 LYS NZ :NH3+ 150:sc= 1.25 (180deg=1.12) USER MOD ----------------------------------------------------------------- ATOM 369 N VAL A 28 -3.890 12.580 -6.656 1.00 10.00 N ATOM 370 CA VAL A 28 -3.055 11.593 -7.334 1.00 10.00 C ATOM 371 C VAL A 28 -2.665 10.438 -6.410 1.00 10.00 C ATOM 372 O VAL A 28 -1.497 10.074 -6.304 1.00 10.00 O ATOM 373 CB VAL A 28 -1.809 12.309 -7.894 1.00 10.00 C ATOM 374 CG1 VAL A 28 -2.196 13.312 -8.982 1.00 10.00 C ATOM 375 CG2 VAL A 28 -0.969 13.050 -6.839 1.00 10.00 C ATOM 0 HA VAL A 28 -3.623 11.147 -8.150 1.00 10.00 H new ATOM 0 HB VAL A 28 -1.194 11.505 -8.297 1.00 10.00 H new ATOM 0 HG11 VAL A 28 -1.299 13.803 -9.360 1.00 10.00 H new ATOM 0 HG12 VAL A 28 -2.695 12.789 -9.798 1.00 10.00 H new ATOM 0 HG13 VAL A 28 -2.870 14.060 -8.564 1.00 10.00 H new ATOM 0 HG21 VAL A 28 -0.114 13.524 -7.322 1.00 10.00 H new ATOM 0 HG22 VAL A 28 -1.581 13.812 -6.356 1.00 10.00 H new ATOM 0 HG23 VAL A 28 -0.616 12.340 -6.091 1.00 10.00 H new ATOM 385 N THR A 29 -3.659 9.813 -5.783 1.00 10.00 N ATOM 386 CA THR A 29 -3.460 8.750 -4.816 1.00 10.00 C ATOM 387 C THR A 29 -4.737 7.914 -4.740 1.00 10.00 C ATOM 388 O THR A 29 -5.368 7.871 -3.686 1.00 10.00 O ATOM 389 CB THR A 29 -3.065 9.326 -3.437 1.00 10.00 C ATOM 390 OG1 THR A 29 -4.066 10.187 -2.924 1.00 10.00 O ATOM 391 CG2 THR A 29 -1.736 10.083 -3.414 1.00 10.00 C ATOM 0 H THR A 29 -4.641 10.039 -5.940 1.00 10.00 H new ATOM 0 HA THR A 29 -2.637 8.109 -5.132 1.00 10.00 H new ATOM 0 HB THR A 29 -2.952 8.440 -2.812 1.00 10.00 H new ATOM 0 HG1 THR A 29 -4.924 9.714 -2.902 1.00 10.00 H new ATOM 0 HG21 THR A 29 -1.544 10.450 -2.406 1.00 10.00 H new ATOM 0 HG22 THR A 29 -0.931 9.414 -3.717 1.00 10.00 H new ATOM 0 HG23 THR A 29 -1.785 10.926 -4.103 1.00 10.00 H new ATOM 399 N VAL A 30 -5.124 7.277 -5.850 1.00 10.00 N ATOM 400 CA VAL A 30 -6.279 6.384 -5.912 1.00 10.00 C ATOM 401 C VAL A 30 -5.793 4.939 -6.058 1.00 10.00 C ATOM 402 O VAL A 30 -6.089 4.256 -7.034 1.00 10.00 O ATOM 403 CB VAL A 30 -7.287 6.871 -6.976 1.00 10.00 C ATOM 404 CG1 VAL A 30 -6.726 6.932 -8.404 1.00 10.00 C ATOM 405 CG2 VAL A 30 -8.588 6.053 -6.944 1.00 10.00 C ATOM 0 H VAL A 30 -4.636 7.370 -6.741 1.00 10.00 H new ATOM 0 HA VAL A 30 -6.849 6.405 -4.983 1.00 10.00 H new ATOM 0 HB VAL A 30 -7.506 7.901 -6.695 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -7.501 7.284 -9.085 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -5.879 7.617 -8.433 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -6.399 5.938 -8.709 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -9.271 6.426 -7.707 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -8.363 5.004 -7.139 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -9.053 6.148 -5.963 1.00 10.00 H new ATOM 415 N GLN A 31 -5.020 4.480 -5.071 1.00 10.00 N ATOM 416 CA GLN A 31 -4.470 3.136 -5.029 1.00 10.00 C ATOM 417 C GLN A 31 -4.667 2.507 -3.648 1.00 10.00 C ATOM 418 O GLN A 31 -4.554 3.188 -2.631 1.00 10.00 O ATOM 419 CB GLN A 31 -2.986 3.223 -5.400 1.00 10.00 C ATOM 420 CG GLN A 31 -2.295 1.858 -5.378 1.00 10.00 C ATOM 421 CD GLN A 31 -3.010 0.840 -6.262 1.00 10.00 C ATOM 422 OE1 GLN A 31 -3.672 -0.064 -5.764 1.00 10.00 O ATOM 423 NE2 GLN A 31 -2.923 1.001 -7.573 1.00 10.00 N ATOM 0 H GLN A 31 -4.758 5.049 -4.266 1.00 10.00 H new ATOM 0 HA GLN A 31 -4.989 2.493 -5.740 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -2.888 3.660 -6.394 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -2.480 3.894 -4.706 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -1.264 1.968 -5.714 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -2.259 1.487 -4.354 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -2.364 1.763 -7.957 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -3.415 0.363 -8.199 1.00 10.00 H new ATOM 432 N GLY A 32 -4.915 1.194 -3.625 1.00 10.00 N ATOM 433 CA GLY A 32 -4.972 0.375 -2.428 1.00 10.00 C ATOM 434 C GLY A 32 -3.602 -0.252 -2.192 1.00 10.00 C ATOM 435 O GLY A 32 -3.335 -1.355 -2.663 1.00 10.00 O ATOM 0 H GLY A 32 -5.087 0.660 -4.477 1.00 10.00 H new ATOM 0 HA2 GLY A 32 -5.262 0.981 -1.570 1.00 10.00 H new ATOM 0 HA3 GLY A 32 -5.728 -0.402 -2.539 1.00 10.00 H new ATOM 439 N ALA A 33 -2.720 0.468 -1.495 1.00 10.00 N ATOM 440 CA ALA A 33 -1.367 0.005 -1.217 1.00 10.00 C ATOM 441 C ALA A 33 -1.359 -1.380 -0.566 1.00 10.00 C ATOM 442 O ALA A 33 -2.181 -1.659 0.309 1.00 10.00 O ATOM 443 CB ALA A 33 -0.643 1.030 -0.341 1.00 10.00 C ATOM 0 H ALA A 33 -2.928 1.389 -1.109 1.00 10.00 H new ATOM 0 HA ALA A 33 -0.838 -0.092 -2.165 1.00 10.00 H new ATOM 0 HB1 ALA A 33 0.369 0.682 -0.134 1.00 10.00 H new ATOM 0 HB2 ALA A 33 -0.598 1.987 -0.862 1.00 10.00 H new ATOM 0 HB3 ALA A 33 -1.183 1.153 0.598 1.00 10.00 H new ATOM 449 N THR A 34 -0.413 -2.234 -0.974 1.00 10.00 N ATOM 450 CA THR A 34 -0.169 -3.514 -0.329 1.00 10.00 C ATOM 451 C THR A 34 1.242 -3.490 0.235 1.00 10.00 C ATOM 452 O THR A 34 2.127 -2.942 -0.423 1.00 10.00 O ATOM 453 CB THR A 34 -0.384 -4.695 -1.290 1.00 10.00 C ATOM 454 OG1 THR A 34 0.689 -4.919 -2.182 1.00 10.00 O ATOM 455 CG2 THR A 34 -1.669 -4.515 -2.100 1.00 10.00 C ATOM 0 H THR A 34 0.204 -2.049 -1.765 1.00 10.00 H new ATOM 0 HA THR A 34 -0.887 -3.662 0.478 1.00 10.00 H new ATOM 0 HB THR A 34 -0.455 -5.571 -0.645 1.00 10.00 H new ATOM 0 HG1 THR A 34 0.872 -4.099 -2.686 1.00 10.00 H new ATOM 0 HG21 THR A 34 -1.798 -5.364 -2.772 1.00 10.00 H new ATOM 0 HG22 THR A 34 -2.521 -4.456 -1.423 1.00 10.00 H new ATOM 0 HG23 THR A 34 -1.606 -3.597 -2.684 1.00 10.00 H new ATOM 463 N VAL A 35 1.447 -4.052 1.430 1.00 10.00 N ATOM 464 CA VAL A 35 2.765 -4.257 2.011 1.00 10.00 C ATOM 465 C VAL A 35 3.036 -5.751 2.060 1.00 10.00 C ATOM 466 O VAL A 35 2.173 -6.523 2.480 1.00 10.00 O ATOM 467 CB VAL A 35 2.895 -3.617 3.403 1.00 10.00 C ATOM 468 CG1 VAL A 35 4.359 -3.683 3.861 1.00 10.00 C ATOM 469 CG2 VAL A 35 2.449 -2.153 3.378 1.00 10.00 C ATOM 0 H VAL A 35 0.686 -4.380 2.025 1.00 10.00 H new ATOM 0 HA VAL A 35 3.510 -3.763 1.387 1.00 10.00 H new ATOM 0 HB VAL A 35 2.256 -4.167 4.093 1.00 10.00 H new ATOM 0 HG11 VAL A 35 4.452 -3.230 4.848 1.00 10.00 H new ATOM 0 HG12 VAL A 35 4.679 -4.724 3.908 1.00 10.00 H new ATOM 0 HG13 VAL A 35 4.987 -3.142 3.152 1.00 10.00 H new ATOM 0 HG21 VAL A 35 2.551 -1.724 4.375 1.00 10.00 H new ATOM 0 HG22 VAL A 35 3.071 -1.595 2.678 1.00 10.00 H new ATOM 0 HG23 VAL A 35 1.407 -2.095 3.063 1.00 10.00 H new ATOM 479 N ALA A 36 4.236 -6.156 1.642 1.00 10.00 N ATOM 480 CA ALA A 36 4.667 -7.525 1.780 1.00 10.00 C ATOM 481 C ALA A 36 4.751 -7.861 3.265 1.00 10.00 C ATOM 482 O ALA A 36 5.460 -7.211 4.022 1.00 10.00 O ATOM 483 CB ALA A 36 5.993 -7.740 1.047 1.00 10.00 C ATOM 0 H ALA A 36 4.922 -5.542 1.204 1.00 10.00 H new ATOM 0 HA ALA A 36 3.949 -8.204 1.320 1.00 10.00 H new ATOM 0 HB1 ALA A 36 6.307 -8.778 1.159 1.00 10.00 H new ATOM 0 HB2 ALA A 36 5.865 -7.512 -0.011 1.00 10.00 H new ATOM 0 HB3 ALA A 36 6.753 -7.083 1.470 1.00 10.00 H new ATOM 489 N ALA A 37 3.992 -8.867 3.686 1.00 10.00 N ATOM 490 CA ALA A 37 3.992 -9.334 5.067 1.00 10.00 C ATOM 491 C ALA A 37 5.420 -9.642 5.524 1.00 10.00 C ATOM 492 O ALA A 37 5.999 -8.935 6.345 1.00 10.00 O ATOM 493 CB ALA A 37 3.056 -10.539 5.197 1.00 10.00 C ATOM 0 H ALA A 37 3.357 -9.383 3.077 1.00 10.00 H new ATOM 0 HA ALA A 37 3.615 -8.552 5.727 1.00 10.00 H new ATOM 0 HB1 ALA A 37 3.055 -10.889 6.229 1.00 10.00 H new ATOM 0 HB2 ALA A 37 2.045 -10.247 4.912 1.00 10.00 H new ATOM 0 HB3 ALA A 37 3.401 -11.340 4.543 1.00 10.00 H new ATOM 499 N VAL A 38 5.983 -10.699 4.944 1.00 10.00 N ATOM 500 CA VAL A 38 7.375 -11.103 5.081 1.00 10.00 C ATOM 501 C VAL A 38 7.840 -11.634 3.715 1.00 10.00 C ATOM 502 O VAL A 38 7.436 -12.736 3.325 1.00 10.00 O ATOM 503 CB VAL A 38 7.515 -12.158 6.196 1.00 10.00 C ATOM 504 CG1 VAL A 38 8.970 -12.623 6.322 1.00 10.00 C ATOM 505 CG2 VAL A 38 7.095 -11.576 7.552 1.00 10.00 C ATOM 0 H VAL A 38 5.454 -11.325 4.337 1.00 10.00 H new ATOM 0 HA VAL A 38 8.004 -10.262 5.371 1.00 10.00 H new ATOM 0 HB VAL A 38 6.871 -12.996 5.929 1.00 10.00 H new ATOM 0 HG11 VAL A 38 9.047 -13.367 7.115 1.00 10.00 H new ATOM 0 HG12 VAL A 38 9.295 -13.062 5.379 1.00 10.00 H new ATOM 0 HG13 VAL A 38 9.605 -11.770 6.562 1.00 10.00 H new ATOM 0 HG21 VAL A 38 7.202 -12.338 8.324 1.00 10.00 H new ATOM 0 HG22 VAL A 38 7.729 -10.723 7.794 1.00 10.00 H new ATOM 0 HG23 VAL A 38 6.055 -11.253 7.503 1.00 10.00 H new ATOM 515 N PRO A 39 8.645 -10.874 2.952 1.00 10.00 N ATOM 516 CA PRO A 39 9.270 -11.372 1.735 1.00 10.00 C ATOM 517 C PRO A 39 10.261 -12.492 2.078 1.00 10.00 C ATOM 518 O PRO A 39 10.664 -12.614 3.237 1.00 10.00 O ATOM 519 CB PRO A 39 10.014 -10.186 1.108 1.00 10.00 C ATOM 520 CG PRO A 39 9.627 -8.964 1.936 1.00 10.00 C ATOM 521 CD PRO A 39 9.077 -9.521 3.246 1.00 10.00 C ATOM 0 HA PRO A 39 8.529 -11.779 1.047 1.00 10.00 H new ATOM 0 HB2 PRO A 39 11.092 -10.346 1.129 1.00 10.00 H new ATOM 0 HB3 PRO A 39 9.731 -10.056 0.063 1.00 10.00 H new ATOM 0 HG2 PRO A 39 10.489 -8.321 2.114 1.00 10.00 H new ATOM 0 HG3 PRO A 39 8.880 -8.361 1.421 1.00 10.00 H new ATOM 0 HD2 PRO A 39 9.840 -9.515 4.024 1.00 10.00 H new ATOM 0 HD3 PRO A 39 8.246 -8.916 3.610 1.00 10.00 H new ATOM 529 N PRO A 40 10.706 -13.283 1.088 1.00 10.00 N ATOM 530 CA PRO A 40 11.749 -14.282 1.258 1.00 10.00 C ATOM 531 C PRO A 40 13.110 -13.591 1.358 1.00 10.00 C ATOM 532 O PRO A 40 13.971 -13.701 0.490 1.00 10.00 O ATOM 533 CB PRO A 40 11.620 -15.181 0.036 1.00 10.00 C ATOM 534 CG PRO A 40 11.176 -14.211 -1.058 1.00 10.00 C ATOM 535 CD PRO A 40 10.297 -13.211 -0.303 1.00 10.00 C ATOM 0 HA PRO A 40 11.655 -14.869 2.172 1.00 10.00 H new ATOM 0 HB2 PRO A 40 12.565 -15.664 -0.212 1.00 10.00 H new ATOM 0 HB3 PRO A 40 10.889 -15.974 0.194 1.00 10.00 H new ATOM 0 HG2 PRO A 40 12.027 -13.722 -1.532 1.00 10.00 H new ATOM 0 HG3 PRO A 40 10.621 -14.720 -1.846 1.00 10.00 H new ATOM 0 HD2 PRO A 40 10.428 -12.203 -0.696 1.00 10.00 H new ATOM 0 HD3 PRO A 40 9.242 -13.460 -0.412 1.00 10.00 H new ATOM 543 N SER A 41 13.266 -12.852 2.449 1.00 10.00 N ATOM 544 CA SER A 41 14.434 -12.080 2.821 1.00 10.00 C ATOM 545 C SER A 41 14.385 -11.917 4.341 1.00 10.00 C ATOM 546 O SER A 41 15.357 -12.227 5.026 1.00 10.00 O ATOM 547 CB SER A 41 14.425 -10.738 2.071 1.00 10.00 C ATOM 548 OG SER A 41 15.610 -10.016 2.331 1.00 10.00 O ATOM 0 H SER A 41 12.523 -12.774 3.144 1.00 10.00 H new ATOM 0 HA SER A 41 15.366 -12.573 2.546 1.00 10.00 H new ATOM 0 HB2 SER A 41 14.328 -10.914 1.000 1.00 10.00 H new ATOM 0 HB3 SER A 41 13.560 -10.150 2.377 1.00 10.00 H new ATOM 0 HG SER A 41 15.588 -9.166 1.845 1.00 10.00 H new ATOM 554 N ILE A 42 13.210 -11.520 4.855 1.00 10.00 N ATOM 555 CA ILE A 42 12.918 -11.300 6.261 1.00 10.00 C ATOM 556 C ILE A 42 13.629 -10.024 6.715 1.00 10.00 C ATOM 557 O ILE A 42 14.673 -9.665 6.178 1.00 10.00 O ATOM 558 CB ILE A 42 13.210 -12.546 7.127 1.00 10.00 C ATOM 559 CG1 ILE A 42 12.630 -13.814 6.463 1.00 10.00 C ATOM 560 CG2 ILE A 42 12.596 -12.349 8.520 1.00 10.00 C ATOM 561 CD1 ILE A 42 12.777 -15.078 7.313 1.00 10.00 C ATOM 0 H ILE A 42 12.402 -11.337 4.260 1.00 10.00 H new ATOM 0 HA ILE A 42 11.848 -11.145 6.399 1.00 10.00 H new ATOM 0 HB ILE A 42 14.289 -12.673 7.220 1.00 10.00 H new ATOM 0 HG12 ILE A 42 11.573 -13.651 6.251 1.00 10.00 H new ATOM 0 HG13 ILE A 42 13.127 -13.971 5.506 1.00 10.00 H new ATOM 0 HG21 ILE A 42 12.800 -13.226 9.135 1.00 10.00 H new ATOM 0 HG22 ILE A 42 13.033 -11.468 8.989 1.00 10.00 H new ATOM 0 HG23 ILE A 42 11.518 -12.213 8.427 1.00 10.00 H new ATOM 0 HD11 ILE A 42 12.347 -15.926 6.781 1.00 10.00 H new ATOM 0 HD12 ILE A 42 13.833 -15.267 7.504 1.00 10.00 H new ATOM 0 HD13 ILE A 42 12.256 -14.942 8.261 1.00 10.00 H new ATOM 573 N ARG A 43 13.032 -9.283 7.654 1.00 10.00 N ATOM 574 CA ARG A 43 13.550 -8.042 8.196 1.00 10.00 C ATOM 575 C ARG A 43 13.373 -6.881 7.221 1.00 10.00 C ATOM 576 O ARG A 43 12.866 -5.833 7.613 1.00 10.00 O ATOM 577 CB ARG A 43 14.996 -8.223 8.652 1.00 10.00 C ATOM 578 CG ARG A 43 15.397 -7.117 9.614 1.00 10.00 C ATOM 579 CD ARG A 43 16.864 -7.353 9.983 1.00 10.00 C ATOM 580 NE ARG A 43 17.401 -6.290 10.849 1.00 10.00 N ATOM 581 CZ ARG A 43 17.187 -6.176 12.170 1.00 10.00 C ATOM 582 NH1 ARG A 43 16.386 -7.047 12.792 1.00 10.00 N ATOM 583 NH2 ARG A 43 17.772 -5.190 12.860 1.00 10.00 N ATOM 0 H ARG A 43 12.139 -9.550 8.068 1.00 10.00 H new ATOM 0 HA ARG A 43 12.965 -7.778 9.077 1.00 10.00 H new ATOM 0 HB2 ARG A 43 15.111 -9.193 9.136 1.00 10.00 H new ATOM 0 HB3 ARG A 43 15.659 -8.218 7.787 1.00 10.00 H new ATOM 0 HG2 ARG A 43 15.269 -6.138 9.151 1.00 10.00 H new ATOM 0 HG3 ARG A 43 14.768 -7.134 10.504 1.00 10.00 H new ATOM 0 HD2 ARG A 43 16.959 -8.314 10.489 1.00 10.00 H new ATOM 0 HD3 ARG A 43 17.460 -7.412 9.072 1.00 10.00 H new ATOM 0 HE ARG A 43 17.985 -5.580 10.408 1.00 10.00 H new ATOM 0 HH11 ARG A 43 15.939 -7.796 12.263 1.00 10.00 H new ATOM 0 HH12 ARG A 43 16.222 -6.962 13.795 1.00 10.00 H new ATOM 0 HH21 ARG A 43 18.380 -4.525 12.383 1.00 10.00 H new ATOM 0 HH22 ARG A 43 17.609 -5.103 13.863 1.00 10.00 H new ATOM 597 N ASP A 44 13.776 -7.056 5.965 1.00 10.00 N ATOM 598 CA ASP A 44 13.435 -6.120 4.909 1.00 10.00 C ATOM 599 C ASP A 44 12.006 -6.399 4.445 1.00 10.00 C ATOM 600 O ASP A 44 11.522 -7.524 4.579 1.00 10.00 O ATOM 601 CB ASP A 44 14.436 -6.213 3.751 1.00 10.00 C ATOM 602 CG ASP A 44 14.141 -5.182 2.667 1.00 10.00 C ATOM 603 OD1 ASP A 44 13.523 -4.151 3.016 1.00 10.00 O ATOM 604 OD2 ASP A 44 14.533 -5.439 1.511 1.00 10.00 O ATOM 0 H ASP A 44 14.343 -7.846 5.657 1.00 10.00 H new ATOM 0 HA ASP A 44 13.490 -5.100 5.290 1.00 10.00 H new ATOM 0 HB2 ASP A 44 15.447 -6.063 4.131 1.00 10.00 H new ATOM 0 HB3 ASP A 44 14.402 -7.214 3.320 1.00 10.00 H new ATOM 609 N THR A 45 11.339 -5.379 3.909 1.00 10.00 N ATOM 610 CA THR A 45 10.041 -5.474 3.271 1.00 10.00 C ATOM 611 C THR A 45 9.707 -4.136 2.610 1.00 10.00 C ATOM 612 O THR A 45 10.437 -3.156 2.754 1.00 10.00 O ATOM 613 CB THR A 45 8.941 -5.962 4.228 1.00 10.00 C ATOM 614 OG1 THR A 45 7.765 -6.098 3.467 1.00 10.00 O ATOM 615 CG2 THR A 45 8.678 -5.030 5.411 1.00 10.00 C ATOM 0 H THR A 45 11.709 -4.428 3.911 1.00 10.00 H new ATOM 0 HA THR A 45 10.088 -6.240 2.496 1.00 10.00 H new ATOM 0 HB THR A 45 9.272 -6.902 4.669 1.00 10.00 H new ATOM 0 HG1 THR A 45 7.095 -6.590 3.986 1.00 10.00 H new ATOM 0 HG21 THR A 45 7.889 -5.449 6.035 1.00 10.00 H new ATOM 0 HG22 THR A 45 9.589 -4.924 6.000 1.00 10.00 H new ATOM 0 HG23 THR A 45 8.369 -4.052 5.042 1.00 10.00 H new ATOM 623 N ALA A 46 8.614 -4.096 1.847 1.00 10.00 N ATOM 624 CA ALA A 46 8.252 -2.962 1.026 1.00 10.00 C ATOM 625 C ALA A 46 6.762 -2.937 0.722 1.00 10.00 C ATOM 626 O ALA A 46 6.081 -3.962 0.833 1.00 10.00 O ATOM 627 CB ALA A 46 9.056 -3.031 -0.269 1.00 10.00 C ATOM 0 H ALA A 46 7.951 -4.868 1.788 1.00 10.00 H new ATOM 0 HA ALA A 46 8.480 -2.045 1.569 1.00 10.00 H new ATOM 0 HB1 ALA A 46 8.797 -2.183 -0.903 1.00 10.00 H new ATOM 0 HB2 ALA A 46 10.121 -3.000 -0.038 1.00 10.00 H new ATOM 0 HB3 ALA A 46 8.825 -3.959 -0.792 1.00 10.00 H new ATOM 633 N ALA A 47 6.288 -1.755 0.309 1.00 10.00 N ATOM 634 CA ALA A 47 4.967 -1.591 -0.280 1.00 10.00 C ATOM 635 C ALA A 47 5.064 -1.743 -1.794 1.00 10.00 C ATOM 636 O ALA A 47 6.034 -1.267 -2.384 1.00 10.00 O ATOM 637 CB ALA A 47 4.333 -0.256 0.112 1.00 10.00 C ATOM 0 H ALA A 47 6.818 -0.886 0.377 1.00 10.00 H new ATOM 0 HA ALA A 47 4.312 -2.369 0.111 1.00 10.00 H new ATOM 0 HB1 ALA A 47 3.348 -0.172 -0.348 1.00 10.00 H new ATOM 0 HB2 ALA A 47 4.233 -0.205 1.196 1.00 10.00 H new ATOM 0 HB3 ALA A 47 4.965 0.562 -0.233 1.00 10.00 H new ATOM 643 N TYR A 48 4.077 -2.408 -2.407 1.00 10.00 N ATOM 644 CA TYR A 48 4.062 -2.751 -3.819 1.00 10.00 C ATOM 645 C TYR A 48 2.660 -2.448 -4.348 1.00 10.00 C ATOM 646 O TYR A 48 1.690 -3.032 -3.866 1.00 10.00 O ATOM 647 CB TYR A 48 4.452 -4.205 -4.037 1.00 10.00 C ATOM 648 CG TYR A 48 5.855 -4.536 -3.569 1.00 10.00 C ATOM 649 CD1 TYR A 48 6.966 -3.712 -3.864 1.00 10.00 C ATOM 650 CD2 TYR A 48 6.040 -5.683 -2.793 1.00 10.00 C ATOM 651 CE1 TYR A 48 8.264 -4.113 -3.515 1.00 10.00 C ATOM 652 CE2 TYR A 48 7.328 -6.037 -2.391 1.00 10.00 C ATOM 653 CZ TYR A 48 8.448 -5.311 -2.815 1.00 10.00 C ATOM 654 OH TYR A 48 9.697 -5.702 -2.435 1.00 10.00 O ATOM 0 H TYR A 48 3.245 -2.728 -1.911 1.00 10.00 H new ATOM 0 HA TYR A 48 4.798 -2.161 -4.365 1.00 10.00 H new ATOM 0 HB2 TYR A 48 3.743 -4.845 -3.512 1.00 10.00 H new ATOM 0 HB3 TYR A 48 4.368 -4.439 -5.098 1.00 10.00 H new ATOM 0 HD1 TYR A 48 6.814 -2.766 -4.362 1.00 10.00 H new ATOM 0 HD2 TYR A 48 5.194 -6.290 -2.507 1.00 10.00 H new ATOM 0 HE1 TYR A 48 9.114 -3.503 -3.784 1.00 10.00 H new ATOM 0 HE2 TYR A 48 7.464 -6.888 -1.740 1.00 10.00 H new ATOM 0 HH TYR A 48 9.641 -6.556 -1.958 1.00 10.00 H new ATOM 664 N MET A 49 2.533 -1.456 -5.227 1.00 10.00 N ATOM 665 CA MET A 49 1.270 -0.949 -5.741 1.00 10.00 C ATOM 666 C MET A 49 1.530 -0.121 -7.002 1.00 10.00 C ATOM 667 O MET A 49 2.644 -0.127 -7.508 1.00 10.00 O ATOM 668 CB MET A 49 0.451 -0.243 -4.651 1.00 10.00 C ATOM 669 CG MET A 49 1.055 1.044 -4.073 1.00 10.00 C ATOM 670 SD MET A 49 2.488 0.825 -2.986 1.00 10.00 S ATOM 671 CE MET A 49 2.594 2.480 -2.269 1.00 10.00 C ATOM 0 H MET A 49 3.340 -0.967 -5.613 1.00 10.00 H new ATOM 0 HA MET A 49 0.629 -1.777 -6.045 1.00 10.00 H new ATOM 0 HB2 MET A 49 -0.531 -0.006 -5.060 1.00 10.00 H new ATOM 0 HB3 MET A 49 0.294 -0.945 -3.832 1.00 10.00 H new ATOM 0 HG2 MET A 49 1.347 1.690 -4.901 1.00 10.00 H new ATOM 0 HG3 MET A 49 0.278 1.570 -3.517 1.00 10.00 H new ATOM 0 HE1 MET A 49 3.509 2.564 -1.682 1.00 10.00 H new ATOM 0 HE2 MET A 49 2.605 3.222 -3.067 1.00 10.00 H new ATOM 0 HE3 MET A 49 1.732 2.653 -1.624 1.00 10.00 H new ATOM 681 N THR A 50 0.519 0.563 -7.539 1.00 10.00 N ATOM 682 CA THR A 50 0.643 1.433 -8.704 1.00 10.00 C ATOM 683 C THR A 50 0.119 2.838 -8.365 1.00 10.00 C ATOM 684 O THR A 50 -1.048 2.960 -8.006 1.00 10.00 O ATOM 685 CB THR A 50 -0.154 0.779 -9.839 1.00 10.00 C ATOM 686 OG1 THR A 50 0.218 -0.580 -9.970 1.00 10.00 O ATOM 687 CG2 THR A 50 0.091 1.487 -11.163 1.00 10.00 C ATOM 0 H THR A 50 -0.430 0.525 -7.166 1.00 10.00 H new ATOM 0 HA THR A 50 1.682 1.553 -9.010 1.00 10.00 H new ATOM 0 HB THR A 50 -1.212 0.856 -9.589 1.00 10.00 H new ATOM 0 HG1 THR A 50 -0.296 -0.991 -10.696 1.00 10.00 H new ATOM 0 HG21 THR A 50 -0.488 1.000 -11.948 1.00 10.00 H new ATOM 0 HG22 THR A 50 -0.215 2.530 -11.080 1.00 10.00 H new ATOM 0 HG23 THR A 50 1.151 1.439 -11.411 1.00 10.00 H new ATOM 695 N LEU A 51 0.922 3.904 -8.486 1.00 10.00 N ATOM 696 CA LEU A 51 0.420 5.264 -8.270 1.00 10.00 C ATOM 697 C LEU A 51 -0.238 5.719 -9.555 1.00 10.00 C ATOM 698 O LEU A 51 0.315 5.508 -10.632 1.00 10.00 O ATOM 699 CB LEU A 51 1.532 6.268 -7.934 1.00 10.00 C ATOM 700 CG LEU A 51 1.584 6.634 -6.441 1.00 10.00 C ATOM 701 CD1 LEU A 51 1.653 5.437 -5.483 1.00 10.00 C ATOM 702 CD2 LEU A 51 2.773 7.557 -6.169 1.00 10.00 C ATOM 0 H LEU A 51 1.911 3.851 -8.730 1.00 10.00 H new ATOM 0 HA LEU A 51 -0.267 5.235 -7.425 1.00 10.00 H new ATOM 0 HB2 LEU A 51 2.493 5.850 -8.233 1.00 10.00 H new ATOM 0 HB3 LEU A 51 1.383 7.175 -8.519 1.00 10.00 H new ATOM 0 HG LEU A 51 0.636 7.132 -6.238 1.00 10.00 H new ATOM 0 HD11 LEU A 51 1.686 5.796 -4.454 1.00 10.00 H new ATOM 0 HD12 LEU A 51 0.772 4.810 -5.620 1.00 10.00 H new ATOM 0 HD13 LEU A 51 2.550 4.854 -5.693 1.00 10.00 H new ATOM 0 HD21 LEU A 51 2.802 7.811 -5.109 1.00 10.00 H new ATOM 0 HD22 LEU A 51 3.698 7.051 -6.446 1.00 10.00 H new ATOM 0 HD23 LEU A 51 2.668 8.468 -6.758 1.00 10.00 H new ATOM 714 N THR A 52 -1.411 6.334 -9.410 1.00 10.00 N ATOM 715 CA THR A 52 -2.317 6.654 -10.491 1.00 10.00 C ATOM 716 C THR A 52 -2.496 8.170 -10.588 1.00 10.00 C ATOM 717 O THR A 52 -3.516 8.714 -10.163 1.00 10.00 O ATOM 718 CB THR A 52 -3.632 5.915 -10.210 1.00 10.00 C ATOM 719 OG1 THR A 52 -3.360 4.571 -9.866 1.00 10.00 O ATOM 720 CG2 THR A 52 -4.527 5.931 -11.447 1.00 10.00 C ATOM 0 H THR A 52 -1.761 6.630 -8.499 1.00 10.00 H new ATOM 0 HA THR A 52 -1.929 6.333 -11.458 1.00 10.00 H new ATOM 0 HB THR A 52 -4.140 6.418 -9.387 1.00 10.00 H new ATOM 0 HG1 THR A 52 -4.202 4.103 -9.686 1.00 10.00 H new ATOM 0 HG21 THR A 52 -5.456 5.403 -11.231 1.00 10.00 H new ATOM 0 HG22 THR A 52 -4.751 6.962 -11.721 1.00 10.00 H new ATOM 0 HG23 THR A 52 -4.014 5.440 -12.274 1.00 10.00 H new ATOM 728 N ASN A 53 -1.520 8.862 -11.181 1.00 10.00 N ATOM 729 CA ASN A 53 -1.581 10.318 -11.277 1.00 10.00 C ATOM 730 C ASN A 53 -2.489 10.725 -12.440 1.00 10.00 C ATOM 731 O ASN A 53 -2.085 10.713 -13.608 1.00 10.00 O ATOM 732 CB ASN A 53 -0.183 10.922 -11.443 1.00 10.00 C ATOM 733 CG ASN A 53 0.615 10.931 -10.139 1.00 10.00 C ATOM 734 OD1 ASN A 53 0.553 9.999 -9.347 1.00 10.00 O ATOM 735 ND2 ASN A 53 1.349 12.008 -9.879 1.00 10.00 N ATOM 0 H ASN A 53 -0.689 8.442 -11.597 1.00 10.00 H new ATOM 0 HA ASN A 53 -1.999 10.708 -10.349 1.00 10.00 H new ATOM 0 HB2 ASN A 53 0.366 10.356 -12.196 1.00 10.00 H new ATOM 0 HB3 ASN A 53 -0.274 11.942 -11.815 1.00 10.00 H new ATOM 0 HD21 ASN A 53 1.874 12.069 -9.007 1.00 10.00 H new ATOM 0 HD22 ASN A 53 1.387 12.774 -10.552 1.00 10.00 H new ATOM 742 N LYS A 54 -3.731 11.098 -12.112 1.00 10.00 N ATOM 743 CA LYS A 54 -4.729 11.558 -13.074 1.00 10.00 C ATOM 744 C LYS A 54 -4.968 13.058 -12.891 1.00 10.00 C ATOM 745 O LYS A 54 -6.110 13.498 -12.784 1.00 10.00 O ATOM 746 CB LYS A 54 -6.030 10.764 -12.877 1.00 10.00 C ATOM 747 CG LYS A 54 -5.890 9.287 -13.263 1.00 10.00 C ATOM 748 CD LYS A 54 -7.021 8.425 -12.673 1.00 10.00 C ATOM 749 CE LYS A 54 -8.446 8.943 -12.932 1.00 10.00 C ATOM 750 NZ LYS A 54 -8.765 9.057 -14.369 1.00 10.00 N ATOM 0 H LYS A 54 -4.073 11.087 -11.151 1.00 10.00 H new ATOM 0 HA LYS A 54 -4.371 11.391 -14.090 1.00 10.00 H new ATOM 0 HB2 LYS A 54 -6.339 10.834 -11.834 1.00 10.00 H new ATOM 0 HB3 LYS A 54 -6.821 11.217 -13.475 1.00 10.00 H new ATOM 0 HG2 LYS A 54 -5.893 9.195 -14.349 1.00 10.00 H new ATOM 0 HG3 LYS A 54 -4.928 8.911 -12.914 1.00 10.00 H new ATOM 0 HD2 LYS A 54 -6.939 7.418 -13.081 1.00 10.00 H new ATOM 0 HD3 LYS A 54 -6.871 8.346 -11.596 1.00 10.00 H new ATOM 0 HE2 LYS A 54 -9.162 8.272 -12.458 1.00 10.00 H new ATOM 0 HE3 LYS A 54 -8.563 9.919 -12.461 1.00 10.00 H new ATOM 0 HZ1 LYS A 54 -9.737 9.410 -14.482 1.00 10.00 H new ATOM 0 HZ2 LYS A 54 -8.101 9.718 -14.821 1.00 10.00 H new ATOM 0 HZ3 LYS A 54 -8.682 8.123 -14.818 1.00 10.00 H new ATOM 764 N SER A 55 -3.891 13.842 -12.950 1.00 10.00 N ATOM 765 CA SER A 55 -3.927 15.294 -12.897 1.00 10.00 C ATOM 766 C SER A 55 -2.493 15.797 -13.048 1.00 10.00 C ATOM 767 O SER A 55 -1.550 15.120 -12.630 1.00 10.00 O ATOM 768 CB SER A 55 -4.559 15.789 -11.590 1.00 10.00 C ATOM 769 OG SER A 55 -3.975 15.135 -10.484 1.00 10.00 O ATOM 0 H SER A 55 -2.946 13.469 -13.038 1.00 10.00 H new ATOM 0 HA SER A 55 -4.548 15.684 -13.703 1.00 10.00 H new ATOM 0 HB2 SER A 55 -4.422 16.866 -11.497 1.00 10.00 H new ATOM 0 HB3 SER A 55 -5.633 15.604 -11.605 1.00 10.00 H new ATOM 0 HG SER A 55 -4.386 15.461 -9.656 1.00 10.00 H new ATOM 775 N ASP A 56 -2.335 16.967 -13.663 1.00 10.00 N ATOM 776 CA ASP A 56 -1.043 17.530 -14.005 1.00 10.00 C ATOM 777 C ASP A 56 -0.526 18.370 -12.839 1.00 10.00 C ATOM 778 O ASP A 56 -0.546 19.601 -12.882 1.00 10.00 O ATOM 779 CB ASP A 56 -1.191 18.358 -15.282 1.00 10.00 C ATOM 780 CG ASP A 56 0.146 18.903 -15.767 1.00 10.00 C ATOM 781 OD1 ASP A 56 1.179 18.359 -15.323 1.00 10.00 O ATOM 782 OD2 ASP A 56 0.103 19.833 -16.599 1.00 10.00 O ATOM 0 H ASP A 56 -3.120 17.557 -13.940 1.00 10.00 H new ATOM 0 HA ASP A 56 -0.314 16.741 -14.189 1.00 10.00 H new ATOM 0 HB2 ASP A 56 -1.637 17.743 -16.064 1.00 10.00 H new ATOM 0 HB3 ASP A 56 -1.876 19.186 -15.100 1.00 10.00 H new ATOM 787 N GLN A 57 -0.167 17.707 -11.739 1.00 10.00 N ATOM 788 CA GLN A 57 0.337 18.365 -10.541 1.00 10.00 C ATOM 789 C GLN A 57 1.653 17.698 -10.109 1.00 10.00 C ATOM 790 O GLN A 57 1.678 16.476 -9.954 1.00 10.00 O ATOM 791 CB GLN A 57 -0.715 18.312 -9.421 1.00 10.00 C ATOM 792 CG GLN A 57 -1.740 19.459 -9.464 1.00 10.00 C ATOM 793 CD GLN A 57 -2.971 19.185 -10.321 1.00 10.00 C ATOM 794 OE1 GLN A 57 -3.952 18.631 -9.836 1.00 10.00 O ATOM 795 NE2 GLN A 57 -2.968 19.601 -11.583 1.00 10.00 N ATOM 0 H GLN A 57 -0.220 16.692 -11.657 1.00 10.00 H new ATOM 0 HA GLN A 57 0.536 19.415 -10.755 1.00 10.00 H new ATOM 0 HB2 GLN A 57 -1.246 17.362 -9.482 1.00 10.00 H new ATOM 0 HB3 GLN A 57 -0.205 18.331 -8.458 1.00 10.00 H new ATOM 0 HG2 GLN A 57 -2.064 19.676 -8.446 1.00 10.00 H new ATOM 0 HG3 GLN A 57 -1.246 20.355 -9.839 1.00 10.00 H new ATOM 0 HE21 GLN A 57 -2.142 20.060 -11.967 1.00 10.00 H new ATOM 0 HE22 GLN A 57 -3.792 19.462 -12.168 1.00 10.00 H new ATOM 804 N PRO A 58 2.742 18.462 -9.908 1.00 10.00 N ATOM 805 CA PRO A 58 4.024 17.929 -9.479 1.00 10.00 C ATOM 806 C PRO A 58 4.037 17.711 -7.966 1.00 10.00 C ATOM 807 O PRO A 58 4.256 18.663 -7.219 1.00 10.00 O ATOM 808 CB PRO A 58 5.054 18.967 -9.930 1.00 10.00 C ATOM 809 CG PRO A 58 4.290 20.287 -9.834 1.00 10.00 C ATOM 810 CD PRO A 58 2.857 19.887 -10.193 1.00 10.00 C ATOM 0 HA PRO A 58 4.241 16.952 -9.912 1.00 10.00 H new ATOM 0 HB2 PRO A 58 5.935 18.965 -9.288 1.00 10.00 H new ATOM 0 HB3 PRO A 58 5.400 18.775 -10.946 1.00 10.00 H new ATOM 0 HG2 PRO A 58 4.350 20.715 -8.834 1.00 10.00 H new ATOM 0 HG3 PRO A 58 4.685 21.032 -10.524 1.00 10.00 H new ATOM 0 HD2 PRO A 58 2.136 20.459 -9.608 1.00 10.00 H new ATOM 0 HD3 PRO A 58 2.649 20.091 -11.243 1.00 10.00 H new ATOM 818 N ILE A 59 3.833 16.473 -7.500 1.00 10.00 N ATOM 819 CA ILE A 59 3.873 16.158 -6.075 1.00 10.00 C ATOM 820 C ILE A 59 5.259 15.591 -5.740 1.00 10.00 C ATOM 821 O ILE A 59 5.855 14.843 -6.517 1.00 10.00 O ATOM 822 CB ILE A 59 2.707 15.234 -5.646 1.00 10.00 C ATOM 823 CG1 ILE A 59 1.349 15.959 -5.580 1.00 10.00 C ATOM 824 CG2 ILE A 59 2.951 14.630 -4.251 1.00 10.00 C ATOM 825 CD1 ILE A 59 0.813 16.412 -6.939 1.00 10.00 C ATOM 0 H ILE A 59 3.637 15.670 -8.098 1.00 10.00 H new ATOM 0 HA ILE A 59 3.724 17.067 -5.493 1.00 10.00 H new ATOM 0 HB ILE A 59 2.672 14.462 -6.415 1.00 10.00 H new ATOM 0 HG12 ILE A 59 0.618 15.296 -5.116 1.00 10.00 H new ATOM 0 HG13 ILE A 59 1.446 16.830 -4.932 1.00 10.00 H new ATOM 0 HG21 ILE A 59 2.113 13.987 -3.981 1.00 10.00 H new ATOM 0 HG22 ILE A 59 3.869 14.043 -4.264 1.00 10.00 H new ATOM 0 HG23 ILE A 59 3.043 15.432 -3.518 1.00 10.00 H new ATOM 0 HD11 ILE A 59 -0.146 16.913 -6.803 1.00 10.00 H new ATOM 0 HD12 ILE A 59 1.521 17.102 -7.398 1.00 10.00 H new ATOM 0 HD13 ILE A 59 0.681 15.544 -7.585 1.00 10.00 H new ATOM 837 N LYS A 60 5.778 15.959 -4.569 1.00 10.00 N ATOM 838 CA LYS A 60 6.983 15.409 -3.985 1.00 10.00 C ATOM 839 C LYS A 60 6.662 14.931 -2.571 1.00 10.00 C ATOM 840 O LYS A 60 6.635 15.705 -1.613 1.00 10.00 O ATOM 841 CB LYS A 60 8.116 16.431 -4.065 1.00 10.00 C ATOM 842 CG LYS A 60 7.850 17.765 -3.361 1.00 10.00 C ATOM 843 CD LYS A 60 8.171 18.963 -4.259 1.00 10.00 C ATOM 844 CE LYS A 60 7.260 19.139 -5.489 1.00 10.00 C ATOM 845 NZ LYS A 60 5.826 19.212 -5.151 1.00 10.00 N ATOM 0 H LYS A 60 5.348 16.676 -3.985 1.00 10.00 H new ATOM 0 HA LYS A 60 7.338 14.541 -4.540 1.00 10.00 H new ATOM 0 HB2 LYS A 60 9.014 15.986 -3.636 1.00 10.00 H new ATOM 0 HB3 LYS A 60 8.329 16.630 -5.115 1.00 10.00 H new ATOM 0 HG2 LYS A 60 6.805 17.811 -3.055 1.00 10.00 H new ATOM 0 HG3 LYS A 60 8.450 17.822 -2.453 1.00 10.00 H new ATOM 0 HD2 LYS A 60 8.117 19.870 -3.657 1.00 10.00 H new ATOM 0 HD3 LYS A 60 9.201 18.870 -4.603 1.00 10.00 H new ATOM 0 HE2 LYS A 60 7.548 20.048 -6.018 1.00 10.00 H new ATOM 0 HE3 LYS A 60 7.422 18.307 -6.174 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 5.270 19.330 -6.022 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 5.537 18.335 -4.672 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 5.659 20.022 -4.521 1.00 10.00 H new ATOM 859 N LEU A 61 6.406 13.630 -2.462 1.00 10.00 N ATOM 860 CA LEU A 61 6.171 12.979 -1.185 1.00 10.00 C ATOM 861 C LEU A 61 7.531 12.697 -0.558 1.00 10.00 C ATOM 862 O LEU A 61 8.432 12.266 -1.268 1.00 10.00 O ATOM 863 CB LEU A 61 5.182 11.804 -1.304 1.00 10.00 C ATOM 864 CG LEU A 61 5.683 10.419 -1.743 1.00 10.00 C ATOM 865 CD1 LEU A 61 6.347 10.423 -3.122 1.00 10.00 C ATOM 866 CD2 LEU A 61 6.569 9.771 -0.674 1.00 10.00 C ATOM 0 H LEU A 61 6.356 12.999 -3.262 1.00 10.00 H new ATOM 0 HA LEU A 61 5.640 13.622 -0.483 1.00 10.00 H new ATOM 0 HB2 LEU A 61 4.704 11.683 -0.332 1.00 10.00 H new ATOM 0 HB3 LEU A 61 4.404 12.105 -2.006 1.00 10.00 H new ATOM 0 HG LEU A 61 4.795 9.796 -1.850 1.00 10.00 H new ATOM 0 HD11 LEU A 61 6.677 9.414 -3.370 1.00 10.00 H new ATOM 0 HD12 LEU A 61 5.631 10.764 -3.870 1.00 10.00 H new ATOM 0 HD13 LEU A 61 7.206 11.093 -3.110 1.00 10.00 H new ATOM 0 HD21 LEU A 61 6.903 8.794 -1.022 1.00 10.00 H new ATOM 0 HD22 LEU A 61 7.436 10.405 -0.486 1.00 10.00 H new ATOM 0 HD23 LEU A 61 6.000 9.653 0.248 1.00 10.00 H new ATOM 878 N VAL A 62 7.728 13.021 0.724 1.00 10.00 N ATOM 879 CA VAL A 62 9.000 12.802 1.402 1.00 10.00 C ATOM 880 C VAL A 62 8.686 12.288 2.806 1.00 10.00 C ATOM 881 O VAL A 62 9.150 12.819 3.813 1.00 10.00 O ATOM 882 CB VAL A 62 9.828 14.109 1.424 1.00 10.00 C ATOM 883 CG1 VAL A 62 11.264 13.846 1.906 1.00 10.00 C ATOM 884 CG2 VAL A 62 9.897 14.787 0.048 1.00 10.00 C ATOM 0 H VAL A 62 7.010 13.441 1.315 1.00 10.00 H new ATOM 0 HA VAL A 62 9.608 12.065 0.878 1.00 10.00 H new ATOM 0 HB VAL A 62 9.313 14.775 2.116 1.00 10.00 H new ATOM 0 HG11 VAL A 62 11.823 14.782 1.911 1.00 10.00 H new ATOM 0 HG12 VAL A 62 11.239 13.432 2.914 1.00 10.00 H new ATOM 0 HG13 VAL A 62 11.749 13.137 1.235 1.00 10.00 H new ATOM 0 HG21 VAL A 62 10.490 15.699 0.121 1.00 10.00 H new ATOM 0 HG22 VAL A 62 10.361 14.109 -0.669 1.00 10.00 H new ATOM 0 HG23 VAL A 62 8.890 15.035 -0.286 1.00 10.00 H new ATOM 894 N GLY A 63 7.891 11.222 2.885 1.00 10.00 N ATOM 895 CA GLY A 63 7.804 10.447 4.101 1.00 10.00 C ATOM 896 C GLY A 63 7.157 9.101 3.832 1.00 10.00 C ATOM 897 O GLY A 63 6.406 8.949 2.871 1.00 10.00 O ATOM 0 H GLY A 63 7.305 10.884 2.121 1.00 10.00 H new ATOM 0 HA2 GLY A 63 8.801 10.301 4.517 1.00 10.00 H new ATOM 0 HA3 GLY A 63 7.224 10.993 4.846 1.00 10.00 H new ATOM 901 N ALA A 64 7.419 8.170 4.740 1.00 10.00 N ATOM 902 CA ALA A 64 6.668 6.964 5.022 1.00 10.00 C ATOM 903 C ALA A 64 7.057 6.628 6.463 1.00 10.00 C ATOM 904 O ALA A 64 8.245 6.634 6.766 1.00 10.00 O ATOM 905 CB ALA A 64 7.048 5.852 4.040 1.00 10.00 C ATOM 0 H ALA A 64 8.234 8.251 5.348 1.00 10.00 H new ATOM 0 HA ALA A 64 5.590 7.083 4.910 1.00 10.00 H new ATOM 0 HB1 ALA A 64 6.474 4.954 4.267 1.00 10.00 H new ATOM 0 HB2 ALA A 64 6.829 6.175 3.022 1.00 10.00 H new ATOM 0 HB3 ALA A 64 8.112 5.635 4.130 1.00 10.00 H new ATOM 911 N ALA A 65 6.105 6.431 7.373 1.00 10.00 N ATOM 912 CA ALA A 65 6.368 6.156 8.780 1.00 10.00 C ATOM 913 C ALA A 65 5.197 5.344 9.321 1.00 10.00 C ATOM 914 O ALA A 65 4.072 5.533 8.862 1.00 10.00 O ATOM 915 CB ALA A 65 6.529 7.471 9.548 1.00 10.00 C ATOM 0 H ALA A 65 5.111 6.459 7.146 1.00 10.00 H new ATOM 0 HA ALA A 65 7.293 5.592 8.899 1.00 10.00 H new ATOM 0 HB1 ALA A 65 6.725 7.257 10.599 1.00 10.00 H new ATOM 0 HB2 ALA A 65 7.362 8.036 9.131 1.00 10.00 H new ATOM 0 HB3 ALA A 65 5.614 8.057 9.462 1.00 10.00 H new ATOM 921 N THR A 66 5.448 4.395 10.229 1.00 10.00 N ATOM 922 CA THR A 66 4.466 3.363 10.528 1.00 10.00 C ATOM 923 C THR A 66 4.906 2.507 11.724 1.00 10.00 C ATOM 924 O THR A 66 6.107 2.375 11.988 1.00 10.00 O ATOM 925 CB THR A 66 4.274 2.497 9.264 1.00 10.00 C ATOM 926 OG1 THR A 66 3.476 1.364 9.525 1.00 10.00 O ATOM 927 CG2 THR A 66 5.596 2.045 8.635 1.00 10.00 C ATOM 0 H THR A 66 6.315 4.325 10.761 1.00 10.00 H new ATOM 0 HA THR A 66 3.519 3.826 10.805 1.00 10.00 H new ATOM 0 HB THR A 66 3.766 3.145 8.549 1.00 10.00 H new ATOM 0 HG1 THR A 66 2.540 1.570 9.322 1.00 10.00 H new ATOM 0 HG21 THR A 66 5.391 1.441 7.751 1.00 10.00 H new ATOM 0 HG22 THR A 66 6.180 2.919 8.349 1.00 10.00 H new ATOM 0 HG23 THR A 66 6.159 1.453 9.357 1.00 10.00 H new ATOM 935 N PRO A 67 3.961 1.864 12.433 1.00 10.00 N ATOM 936 CA PRO A 67 4.268 0.783 13.357 1.00 10.00 C ATOM 937 C PRO A 67 4.789 -0.476 12.642 1.00 10.00 C ATOM 938 O PRO A 67 5.196 -1.415 13.326 1.00 10.00 O ATOM 939 CB PRO A 67 2.959 0.501 14.101 1.00 10.00 C ATOM 940 CG PRO A 67 1.893 0.887 13.078 1.00 10.00 C ATOM 941 CD PRO A 67 2.521 2.095 12.386 1.00 10.00 C ATOM 0 HA PRO A 67 5.071 1.070 14.036 1.00 10.00 H new ATOM 0 HB2 PRO A 67 2.878 -0.546 14.393 1.00 10.00 H new ATOM 0 HB3 PRO A 67 2.877 1.093 15.012 1.00 10.00 H new ATOM 0 HG2 PRO A 67 1.691 0.077 12.377 1.00 10.00 H new ATOM 0 HG3 PRO A 67 0.946 1.139 13.555 1.00 10.00 H new ATOM 0 HD2 PRO A 67 2.171 2.184 11.358 1.00 10.00 H new ATOM 0 HD3 PRO A 67 2.255 3.021 12.895 1.00 10.00 H new ATOM 949 N LEU A 68 4.806 -0.515 11.301 1.00 10.00 N ATOM 950 CA LEU A 68 5.204 -1.693 10.540 1.00 10.00 C ATOM 951 C LEU A 68 6.720 -1.933 10.607 1.00 10.00 C ATOM 952 O LEU A 68 7.167 -3.001 11.027 1.00 10.00 O ATOM 953 CB LEU A 68 4.685 -1.537 9.098 1.00 10.00 C ATOM 954 CG LEU A 68 4.619 -2.852 8.312 1.00 10.00 C ATOM 955 CD1 LEU A 68 3.470 -2.784 7.300 1.00 10.00 C ATOM 956 CD2 LEU A 68 5.930 -3.191 7.595 1.00 10.00 C ATOM 0 H LEU A 68 4.541 0.278 10.717 1.00 10.00 H new ATOM 0 HA LEU A 68 4.758 -2.585 10.979 1.00 10.00 H new ATOM 0 HB2 LEU A 68 3.690 -1.093 9.127 1.00 10.00 H new ATOM 0 HB3 LEU A 68 5.330 -0.839 8.564 1.00 10.00 H new ATOM 0 HG LEU A 68 4.444 -3.650 9.034 1.00 10.00 H new ATOM 0 HD11 LEU A 68 3.422 -3.718 6.741 1.00 10.00 H new ATOM 0 HD12 LEU A 68 2.529 -2.628 7.828 1.00 10.00 H new ATOM 0 HD13 LEU A 68 3.641 -1.957 6.611 1.00 10.00 H new ATOM 0 HD21 LEU A 68 5.818 -4.133 7.057 1.00 10.00 H new ATOM 0 HD22 LEU A 68 6.175 -2.397 6.889 1.00 10.00 H new ATOM 0 HD23 LEU A 68 6.732 -3.285 8.328 1.00 10.00 H new ATOM 968 N ALA A 69 7.515 -0.938 10.192 1.00 10.00 N ATOM 969 CA ALA A 69 8.951 -1.069 9.953 1.00 10.00 C ATOM 970 C ALA A 69 9.730 0.129 10.495 1.00 10.00 C ATOM 971 O ALA A 69 9.141 1.168 10.793 1.00 10.00 O ATOM 972 CB ALA A 69 9.190 -1.185 8.456 1.00 10.00 C ATOM 0 H ALA A 69 7.165 0.002 10.010 1.00 10.00 H new ATOM 0 HA ALA A 69 9.303 -1.959 10.474 1.00 10.00 H new ATOM 0 HB1 ALA A 69 10.259 -1.283 8.265 1.00 10.00 H new ATOM 0 HB2 ALA A 69 8.670 -2.063 8.071 1.00 10.00 H new ATOM 0 HB3 ALA A 69 8.813 -0.292 7.957 1.00 10.00 H new ATOM 978 N THR A 70 11.039 -0.037 10.691 1.00 10.00 N ATOM 979 CA THR A 70 11.897 0.899 11.413 1.00 10.00 C ATOM 980 C THR A 70 12.566 1.899 10.468 1.00 10.00 C ATOM 981 O THR A 70 12.687 3.074 10.803 1.00 10.00 O ATOM 982 CB THR A 70 12.951 0.110 12.210 1.00 10.00 C ATOM 983 OG1 THR A 70 12.328 -0.924 12.944 1.00 10.00 O ATOM 984 CG2 THR A 70 13.699 1.003 13.203 1.00 10.00 C ATOM 0 H THR A 70 11.545 -0.851 10.341 1.00 10.00 H new ATOM 0 HA THR A 70 11.279 1.477 12.100 1.00 10.00 H new ATOM 0 HB THR A 70 13.659 -0.295 11.487 1.00 10.00 H new ATOM 0 HG1 THR A 70 12.078 -1.652 12.337 1.00 10.00 H new ATOM 0 HG21 THR A 70 14.434 0.408 13.745 1.00 10.00 H new ATOM 0 HG22 THR A 70 14.207 1.802 12.663 1.00 10.00 H new ATOM 0 HG23 THR A 70 12.990 1.436 13.909 1.00 10.00 H new ATOM 992 N SER A 71 13.030 1.423 9.310 1.00 10.00 N ATOM 993 CA SER A 71 13.833 2.164 8.348 1.00 10.00 C ATOM 994 C SER A 71 13.049 2.316 7.034 1.00 10.00 C ATOM 995 O SER A 71 13.231 1.528 6.106 1.00 10.00 O ATOM 996 CB SER A 71 15.167 1.425 8.153 1.00 10.00 C ATOM 997 OG SER A 71 16.128 2.274 7.554 1.00 10.00 O ATOM 0 H SER A 71 12.845 0.466 9.008 1.00 10.00 H new ATOM 0 HA SER A 71 14.052 3.169 8.710 1.00 10.00 H new ATOM 0 HB2 SER A 71 15.537 1.072 9.116 1.00 10.00 H new ATOM 0 HB3 SER A 71 15.013 0.545 7.529 1.00 10.00 H new ATOM 0 HG SER A 71 16.970 1.786 7.440 1.00 10.00 H new ATOM 1003 N PRO A 72 12.148 3.304 6.944 1.00 10.00 N ATOM 1004 CA PRO A 72 11.403 3.584 5.729 1.00 10.00 C ATOM 1005 C PRO A 72 12.295 4.316 4.726 1.00 10.00 C ATOM 1006 O PRO A 72 12.610 5.490 4.906 1.00 10.00 O ATOM 1007 CB PRO A 72 10.218 4.437 6.181 1.00 10.00 C ATOM 1008 CG PRO A 72 10.759 5.177 7.406 1.00 10.00 C ATOM 1009 CD PRO A 72 11.716 4.169 8.029 1.00 10.00 C ATOM 0 HA PRO A 72 11.060 2.683 5.221 1.00 10.00 H new ATOM 0 HB2 PRO A 72 9.901 5.129 5.401 1.00 10.00 H new ATOM 0 HB3 PRO A 72 9.354 3.823 6.432 1.00 10.00 H new ATOM 0 HG2 PRO A 72 11.271 6.098 7.126 1.00 10.00 H new ATOM 0 HG3 PRO A 72 9.960 5.453 8.095 1.00 10.00 H new ATOM 0 HD2 PRO A 72 12.566 4.672 8.490 1.00 10.00 H new ATOM 0 HD3 PRO A 72 11.222 3.595 8.813 1.00 10.00 H new ATOM 1017 N MET A 73 12.699 3.610 3.671 1.00 10.00 N ATOM 1018 CA MET A 73 13.622 4.073 2.654 1.00 10.00 C ATOM 1019 C MET A 73 12.952 3.984 1.284 1.00 10.00 C ATOM 1020 O MET A 73 12.522 2.916 0.852 1.00 10.00 O ATOM 1021 CB MET A 73 14.863 3.184 2.702 1.00 10.00 C ATOM 1022 CG MET A 73 15.694 3.421 3.969 1.00 10.00 C ATOM 1023 SD MET A 73 16.448 5.064 4.088 1.00 10.00 S ATOM 1024 CE MET A 73 17.303 4.903 5.669 1.00 10.00 C ATOM 0 H MET A 73 12.373 2.658 3.501 1.00 10.00 H new ATOM 0 HA MET A 73 13.906 5.110 2.831 1.00 10.00 H new ATOM 0 HB2 MET A 73 14.561 2.138 2.658 1.00 10.00 H new ATOM 0 HB3 MET A 73 15.479 3.375 1.824 1.00 10.00 H new ATOM 0 HG2 MET A 73 15.056 3.266 4.839 1.00 10.00 H new ATOM 0 HG3 MET A 73 16.483 2.671 4.014 1.00 10.00 H new ATOM 0 HE1 MET A 73 17.824 5.833 5.897 1.00 10.00 H new ATOM 0 HE2 MET A 73 16.578 4.691 6.455 1.00 10.00 H new ATOM 0 HE3 MET A 73 18.024 4.088 5.611 1.00 10.00 H new ATOM 1034 N LEU A 74 12.869 5.116 0.592 1.00 10.00 N ATOM 1035 CA LEU A 74 12.296 5.207 -0.742 1.00 10.00 C ATOM 1036 C LEU A 74 13.359 4.813 -1.779 1.00 10.00 C ATOM 1037 O LEU A 74 14.521 5.195 -1.648 1.00 10.00 O ATOM 1038 CB LEU A 74 11.796 6.652 -0.939 1.00 10.00 C ATOM 1039 CG LEU A 74 10.516 6.909 -0.113 1.00 10.00 C ATOM 1040 CD1 LEU A 74 10.284 8.394 0.188 1.00 10.00 C ATOM 1041 CD2 LEU A 74 9.285 6.380 -0.853 1.00 10.00 C ATOM 0 H LEU A 74 13.204 6.010 0.951 1.00 10.00 H new ATOM 0 HA LEU A 74 11.456 4.525 -0.868 1.00 10.00 H new ATOM 0 HB2 LEU A 74 12.574 7.354 -0.640 1.00 10.00 H new ATOM 0 HB3 LEU A 74 11.594 6.831 -1.995 1.00 10.00 H new ATOM 0 HG LEU A 74 10.662 6.384 0.831 1.00 10.00 H new ATOM 0 HD11 LEU A 74 9.370 8.509 0.771 1.00 10.00 H new ATOM 0 HD12 LEU A 74 11.128 8.786 0.756 1.00 10.00 H new ATOM 0 HD13 LEU A 74 10.189 8.944 -0.748 1.00 10.00 H new ATOM 0 HD21 LEU A 74 8.393 6.570 -0.257 1.00 10.00 H new ATOM 0 HD22 LEU A 74 9.193 6.886 -1.814 1.00 10.00 H new ATOM 0 HD23 LEU A 74 9.391 5.308 -1.016 1.00 10.00 H new ATOM 1053 N MET A 75 12.963 4.040 -2.797 1.00 10.00 N ATOM 1054 CA MET A 75 13.795 3.674 -3.941 1.00 10.00 C ATOM 1055 C MET A 75 13.133 4.123 -5.235 1.00 10.00 C ATOM 1056 O MET A 75 11.956 4.469 -5.252 1.00 10.00 O ATOM 1057 CB MET A 75 14.035 2.156 -3.996 1.00 10.00 C ATOM 1058 CG MET A 75 15.316 1.762 -3.255 1.00 10.00 C ATOM 1059 SD MET A 75 15.085 0.827 -1.744 1.00 10.00 S ATOM 1060 CE MET A 75 16.813 0.552 -1.293 1.00 10.00 C ATOM 0 H MET A 75 12.025 3.642 -2.845 1.00 10.00 H new ATOM 0 HA MET A 75 14.756 4.174 -3.824 1.00 10.00 H new ATOM 0 HB2 MET A 75 13.184 1.636 -3.555 1.00 10.00 H new ATOM 0 HB3 MET A 75 14.101 1.835 -5.035 1.00 10.00 H new ATOM 0 HG2 MET A 75 15.939 1.176 -3.931 1.00 10.00 H new ATOM 0 HG3 MET A 75 15.870 2.670 -3.017 1.00 10.00 H new ATOM 0 HE1 MET A 75 16.861 -0.021 -0.367 1.00 10.00 H new ATOM 0 HE2 MET A 75 17.313 -0.001 -2.088 1.00 10.00 H new ATOM 0 HE3 MET A 75 17.309 1.512 -1.152 1.00 10.00 H new ATOM 1070 N THR A 76 13.898 4.073 -6.328 1.00 10.00 N ATOM 1071 CA THR A 76 13.421 4.400 -7.652 1.00 10.00 C ATOM 1072 C THR A 76 14.025 3.392 -8.631 1.00 10.00 C ATOM 1073 O THR A 76 15.242 3.258 -8.689 1.00 10.00 O ATOM 1074 CB THR A 76 13.702 5.872 -7.947 1.00 10.00 C ATOM 1075 OG1 THR A 76 13.215 6.236 -9.214 1.00 10.00 O ATOM 1076 CG2 THR A 76 15.181 6.250 -7.864 1.00 10.00 C ATOM 0 H THR A 76 14.880 3.799 -6.306 1.00 10.00 H new ATOM 0 HA THR A 76 12.340 4.307 -7.751 1.00 10.00 H new ATOM 0 HB THR A 76 13.179 6.420 -7.163 1.00 10.00 H new ATOM 0 HG1 THR A 76 12.448 5.671 -9.444 1.00 10.00 H new ATOM 0 HG21 THR A 76 15.298 7.311 -8.086 1.00 10.00 H new ATOM 0 HG22 THR A 76 15.553 6.046 -6.860 1.00 10.00 H new ATOM 0 HG23 THR A 76 15.748 5.663 -8.587 1.00 10.00 H new ATOM 1084 N THR A 77 13.201 2.623 -9.343 1.00 10.00 N ATOM 1085 CA THR A 77 13.680 1.713 -10.377 1.00 10.00 C ATOM 1086 C THR A 77 12.694 1.745 -11.551 1.00 10.00 C ATOM 1087 O THR A 77 12.309 0.714 -12.095 1.00 10.00 O ATOM 1088 CB THR A 77 13.823 0.296 -9.780 1.00 10.00 C ATOM 1089 OG1 THR A 77 14.206 0.340 -8.419 1.00 10.00 O ATOM 1090 CG2 THR A 77 14.847 -0.545 -10.546 1.00 10.00 C ATOM 0 H THR A 77 12.189 2.615 -9.218 1.00 10.00 H new ATOM 0 HA THR A 77 14.660 2.017 -10.745 1.00 10.00 H new ATOM 0 HB THR A 77 12.840 -0.167 -9.867 1.00 10.00 H new ATOM 0 HG1 THR A 77 13.982 -0.512 -7.989 1.00 10.00 H new ATOM 0 HG21 THR A 77 14.917 -1.534 -10.094 1.00 10.00 H new ATOM 0 HG22 THR A 77 14.533 -0.643 -11.585 1.00 10.00 H new ATOM 0 HG23 THR A 77 15.821 -0.058 -10.505 1.00 10.00 H new ATOM 1098 N THR A 78 12.318 2.938 -11.999 1.00 10.00 N ATOM 1099 CA THR A 78 11.376 3.138 -13.086 1.00 10.00 C ATOM 1100 C THR A 78 11.602 4.513 -13.722 1.00 10.00 C ATOM 1101 O THR A 78 10.856 5.458 -13.462 1.00 10.00 O ATOM 1102 CB THR A 78 9.936 2.958 -12.576 1.00 10.00 C ATOM 1103 OG1 THR A 78 9.821 1.801 -11.771 1.00 10.00 O ATOM 1104 CG2 THR A 78 8.980 2.821 -13.756 1.00 10.00 C ATOM 0 H THR A 78 12.670 3.811 -11.605 1.00 10.00 H new ATOM 0 HA THR A 78 11.539 2.389 -13.861 1.00 10.00 H new ATOM 0 HB THR A 78 9.683 3.836 -11.981 1.00 10.00 H new ATOM 0 HG1 THR A 78 8.897 1.711 -11.458 1.00 10.00 H new ATOM 0 HG21 THR A 78 7.962 2.694 -13.387 1.00 10.00 H new ATOM 0 HG22 THR A 78 9.033 3.718 -14.373 1.00 10.00 H new ATOM 0 HG23 THR A 78 9.261 1.953 -14.353 1.00 10.00 H new ATOM 1112 N HIS A 79 12.610 4.601 -14.599 1.00 10.00 N ATOM 1113 CA HIS A 79 12.924 5.798 -15.372 1.00 10.00 C ATOM 1114 C HIS A 79 11.734 6.202 -16.246 1.00 10.00 C ATOM 1115 O HIS A 79 11.640 5.789 -17.397 1.00 10.00 O ATOM 1116 CB HIS A 79 14.195 5.569 -16.200 1.00 10.00 C ATOM 1117 CG HIS A 79 14.630 6.789 -16.969 1.00 10.00 C ATOM 1118 ND1 HIS A 79 14.605 6.923 -18.357 1.00 10.00 N ATOM 1119 CD2 HIS A 79 15.127 7.932 -16.414 1.00 10.00 C ATOM 1120 CE1 HIS A 79 15.073 8.154 -18.607 1.00 10.00 C ATOM 1121 NE2 HIS A 79 15.395 8.782 -17.462 1.00 10.00 N ATOM 0 H HIS A 79 13.240 3.823 -14.791 1.00 10.00 H new ATOM 0 HA HIS A 79 13.117 6.626 -14.690 1.00 10.00 H new ATOM 0 HB2 HIS A 79 15.002 5.259 -15.536 1.00 10.00 H new ATOM 0 HB3 HIS A 79 14.023 4.750 -16.898 1.00 10.00 H new ATOM 0 HD2 HIS A 79 15.279 8.130 -15.363 1.00 10.00 H new ATOM 0 HE1 HIS A 79 15.177 8.583 -19.593 1.00 10.00 H new ATOM 0 HE2 HIS A 79 15.773 9.726 -17.384 1.00 10.00 H new ATOM 1129 N SER A 80 10.817 6.980 -15.666 1.00 10.00 N ATOM 1130 CA SER A 80 9.529 7.400 -16.218 1.00 10.00 C ATOM 1131 C SER A 80 8.681 7.976 -15.085 1.00 10.00 C ATOM 1132 O SER A 80 7.978 8.961 -15.294 1.00 10.00 O ATOM 1133 CB SER A 80 8.754 6.252 -16.894 1.00 10.00 C ATOM 1134 OG SER A 80 7.544 6.728 -17.459 1.00 10.00 O ATOM 0 H SER A 80 10.967 7.360 -14.731 1.00 10.00 H new ATOM 0 HA SER A 80 9.730 8.143 -16.990 1.00 10.00 H new ATOM 0 HB2 SER A 80 9.370 5.799 -17.671 1.00 10.00 H new ATOM 0 HB3 SER A 80 8.538 5.473 -16.163 1.00 10.00 H new ATOM 0 HG SER A 80 7.067 5.985 -17.885 1.00 10.00 H new ATOM 1140 N GLY A 81 8.704 7.335 -13.911 1.00 10.00 N ATOM 1141 CA GLY A 81 8.099 7.887 -12.712 1.00 10.00 C ATOM 1142 C GLY A 81 9.178 8.716 -12.037 1.00 10.00 C ATOM 1143 O GLY A 81 9.287 9.921 -12.263 1.00 10.00 O ATOM 0 H GLY A 81 9.142 6.424 -13.774 1.00 10.00 H new ATOM 0 HA2 GLY A 81 7.234 8.502 -12.960 1.00 10.00 H new ATOM 0 HA3 GLY A 81 7.748 7.094 -12.052 1.00 10.00 H new ATOM 1147 N GLY A 82 10.019 8.031 -11.269 1.00 10.00 N ATOM 1148 CA GLY A 82 11.325 8.516 -10.875 1.00 10.00 C ATOM 1149 C GLY A 82 12.369 8.130 -11.929 1.00 10.00 C ATOM 1150 O GLY A 82 12.121 8.237 -13.132 1.00 10.00 O ATOM 0 H GLY A 82 9.802 7.106 -10.899 1.00 10.00 H new ATOM 0 HA2 GLY A 82 11.299 9.599 -10.757 1.00 10.00 H new ATOM 0 HA3 GLY A 82 11.601 8.096 -9.908 1.00 10.00 H new ATOM 1154 N MET A 83 13.546 7.706 -11.456 1.00 10.00 N ATOM 1155 CA MET A 83 14.720 7.331 -12.229 1.00 10.00 C ATOM 1156 C MET A 83 14.913 5.807 -12.176 1.00 10.00 C ATOM 1157 O MET A 83 13.985 5.072 -11.847 1.00 10.00 O ATOM 1158 CB MET A 83 15.941 8.098 -11.688 1.00 10.00 C ATOM 1159 CG MET A 83 15.728 9.619 -11.684 1.00 10.00 C ATOM 1160 SD MET A 83 15.416 10.361 -13.308 1.00 10.00 S ATOM 1161 CE MET A 83 15.234 12.094 -12.835 1.00 10.00 C ATOM 0 H MET A 83 13.707 7.612 -10.453 1.00 10.00 H new ATOM 0 HA MET A 83 14.593 7.600 -13.277 1.00 10.00 H new ATOM 0 HB2 MET A 83 16.156 7.762 -10.674 1.00 10.00 H new ATOM 0 HB3 MET A 83 16.814 7.859 -12.295 1.00 10.00 H new ATOM 0 HG2 MET A 83 14.887 9.850 -11.030 1.00 10.00 H new ATOM 0 HG3 MET A 83 16.609 10.092 -11.250 1.00 10.00 H new ATOM 0 HE1 MET A 83 15.036 12.695 -13.723 1.00 10.00 H new ATOM 0 HE2 MET A 83 14.404 12.195 -12.136 1.00 10.00 H new ATOM 0 HE3 MET A 83 16.152 12.440 -12.360 1.00 10.00 H new ATOM 1171 N ALA A 84 16.118 5.319 -12.496 1.00 10.00 N ATOM 1172 CA ALA A 84 16.469 3.910 -12.514 1.00 10.00 C ATOM 1173 C ALA A 84 17.675 3.770 -11.599 1.00 10.00 C ATOM 1174 O ALA A 84 18.810 3.708 -12.064 1.00 10.00 O ATOM 1175 CB ALA A 84 16.774 3.454 -13.945 1.00 10.00 C ATOM 0 H ALA A 84 16.897 5.923 -12.757 1.00 10.00 H new ATOM 0 HA ALA A 84 15.652 3.278 -12.166 1.00 10.00 H new ATOM 0 HB1 ALA A 84 17.035 2.396 -13.942 1.00 10.00 H new ATOM 0 HB2 ALA A 84 15.895 3.609 -14.571 1.00 10.00 H new ATOM 0 HB3 ALA A 84 17.608 4.033 -14.341 1.00 10.00 H new ATOM 1181 N GLY A 85 17.430 3.807 -10.291 1.00 10.00 N ATOM 1182 CA GLY A 85 18.479 3.886 -9.297 1.00 10.00 C ATOM 1183 C GLY A 85 17.968 3.342 -7.966 1.00 10.00 C ATOM 1184 O GLY A 85 17.548 4.126 -7.115 1.00 10.00 O ATOM 0 H GLY A 85 16.490 3.782 -9.896 1.00 10.00 H new ATOM 0 HA2 GLY A 85 19.348 3.315 -9.625 1.00 10.00 H new ATOM 0 HA3 GLY A 85 18.803 4.920 -9.178 1.00 10.00 H new ATOM 1188 N MET A 86 17.980 2.015 -7.780 1.00 10.00 N ATOM 1189 CA MET A 86 17.367 1.350 -6.626 1.00 10.00 C ATOM 1190 C MET A 86 18.265 1.491 -5.388 1.00 10.00 C ATOM 1191 O MET A 86 18.730 0.517 -4.804 1.00 10.00 O ATOM 1192 CB MET A 86 17.084 -0.117 -6.975 1.00 10.00 C ATOM 1193 CG MET A 86 15.969 -0.787 -6.149 1.00 10.00 C ATOM 1194 SD MET A 86 16.385 -1.576 -4.558 1.00 10.00 S ATOM 1195 CE MET A 86 15.891 -3.280 -4.906 1.00 10.00 C ATOM 0 H MET A 86 18.420 1.368 -8.434 1.00 10.00 H new ATOM 0 HA MET A 86 16.417 1.827 -6.384 1.00 10.00 H new ATOM 0 HB2 MET A 86 16.818 -0.177 -8.030 1.00 10.00 H new ATOM 0 HB3 MET A 86 18.003 -0.688 -6.845 1.00 10.00 H new ATOM 0 HG2 MET A 86 15.210 -0.031 -5.950 1.00 10.00 H new ATOM 0 HG3 MET A 86 15.506 -1.546 -6.779 1.00 10.00 H new ATOM 0 HE1 MET A 86 16.080 -3.900 -4.030 1.00 10.00 H new ATOM 0 HE2 MET A 86 14.829 -3.309 -5.148 1.00 10.00 H new ATOM 0 HE3 MET A 86 16.466 -3.660 -5.750 1.00 10.00 H new ATOM 1205 N LYS A 87 18.499 2.735 -4.996 1.00 10.00 N ATOM 1206 CA LYS A 87 19.317 3.169 -3.878 1.00 10.00 C ATOM 1207 C LYS A 87 18.453 4.068 -3.000 1.00 10.00 C ATOM 1208 O LYS A 87 17.360 4.455 -3.412 1.00 10.00 O ATOM 1209 CB LYS A 87 20.556 3.902 -4.416 1.00 10.00 C ATOM 1210 CG LYS A 87 20.202 5.243 -5.084 1.00 10.00 C ATOM 1211 CD LYS A 87 21.254 5.689 -6.105 1.00 10.00 C ATOM 1212 CE LYS A 87 22.624 5.927 -5.453 1.00 10.00 C ATOM 1213 NZ LYS A 87 23.624 6.424 -6.422 1.00 10.00 N ATOM 0 H LYS A 87 18.089 3.527 -5.491 1.00 10.00 H new ATOM 0 HA LYS A 87 19.672 2.328 -3.282 1.00 10.00 H new ATOM 0 HB2 LYS A 87 21.253 4.080 -3.597 1.00 10.00 H new ATOM 0 HB3 LYS A 87 21.067 3.264 -5.137 1.00 10.00 H new ATOM 0 HG2 LYS A 87 19.235 5.154 -5.579 1.00 10.00 H new ATOM 0 HG3 LYS A 87 20.097 6.010 -4.317 1.00 10.00 H new ATOM 0 HD2 LYS A 87 21.349 4.931 -6.882 1.00 10.00 H new ATOM 0 HD3 LYS A 87 20.920 6.605 -6.593 1.00 10.00 H new ATOM 0 HE2 LYS A 87 22.518 6.647 -4.641 1.00 10.00 H new ATOM 0 HE3 LYS A 87 22.980 4.997 -5.010 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 24.533 6.571 -5.938 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 23.746 5.727 -7.184 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 23.298 7.325 -6.826 1.00 10.00 H new ATOM 1227 N MET A 88 18.943 4.434 -1.817 1.00 10.00 N ATOM 1228 CA MET A 88 18.145 5.150 -0.833 1.00 10.00 C ATOM 1229 C MET A 88 18.109 6.629 -1.215 1.00 10.00 C ATOM 1230 O MET A 88 18.771 7.471 -0.611 1.00 10.00 O ATOM 1231 CB MET A 88 18.726 4.907 0.567 1.00 10.00 C ATOM 1232 CG MET A 88 18.621 3.421 0.923 1.00 10.00 C ATOM 1233 SD MET A 88 19.202 2.970 2.577 1.00 10.00 S ATOM 1234 CE MET A 88 18.833 1.200 2.560 1.00 10.00 C ATOM 0 H MET A 88 19.899 4.242 -1.518 1.00 10.00 H new ATOM 0 HA MET A 88 17.117 4.788 -0.817 1.00 10.00 H new ATOM 0 HB2 MET A 88 19.768 5.225 0.598 1.00 10.00 H new ATOM 0 HB3 MET A 88 18.188 5.505 1.303 1.00 10.00 H new ATOM 0 HG2 MET A 88 17.579 3.116 0.828 1.00 10.00 H new ATOM 0 HG3 MET A 88 19.189 2.849 0.189 1.00 10.00 H new ATOM 0 HE1 MET A 88 19.130 0.757 3.511 1.00 10.00 H new ATOM 0 HE2 MET A 88 17.764 1.053 2.409 1.00 10.00 H new ATOM 0 HE3 MET A 88 19.383 0.721 1.750 1.00 10.00 H new ATOM 1244 N VAL A 89 17.352 6.921 -2.272 1.00 10.00 N ATOM 1245 CA VAL A 89 17.118 8.272 -2.746 1.00 10.00 C ATOM 1246 C VAL A 89 16.362 9.068 -1.678 1.00 10.00 C ATOM 1247 O VAL A 89 15.667 8.478 -0.851 1.00 10.00 O ATOM 1248 CB VAL A 89 16.372 8.247 -4.097 1.00 10.00 C ATOM 1249 CG1 VAL A 89 17.306 7.750 -5.206 1.00 10.00 C ATOM 1250 CG2 VAL A 89 15.094 7.399 -4.073 1.00 10.00 C ATOM 0 H VAL A 89 16.879 6.209 -2.828 1.00 10.00 H new ATOM 0 HA VAL A 89 18.071 8.772 -2.920 1.00 10.00 H new ATOM 0 HB VAL A 89 16.063 9.273 -4.296 1.00 10.00 H new ATOM 0 HG11 VAL A 89 16.769 7.736 -6.155 1.00 10.00 H new ATOM 0 HG12 VAL A 89 18.165 8.417 -5.284 1.00 10.00 H new ATOM 0 HG13 VAL A 89 17.649 6.743 -4.969 1.00 10.00 H new ATOM 0 HG21 VAL A 89 14.621 7.426 -5.055 1.00 10.00 H new ATOM 0 HG22 VAL A 89 15.345 6.369 -3.820 1.00 10.00 H new ATOM 0 HG23 VAL A 89 14.406 7.798 -3.328 1.00 10.00 H new ATOM 1260 N PRO A 90 16.473 10.407 -1.681 1.00 10.00 N ATOM 1261 CA PRO A 90 15.812 11.241 -0.693 1.00 10.00 C ATOM 1262 C PRO A 90 14.285 11.090 -0.729 1.00 10.00 C ATOM 1263 O PRO A 90 13.633 11.283 0.294 1.00 10.00 O ATOM 1264 CB PRO A 90 16.338 12.653 -0.940 1.00 10.00 C ATOM 1265 CG PRO A 90 16.682 12.647 -2.426 1.00 10.00 C ATOM 1266 CD PRO A 90 17.244 11.236 -2.598 1.00 10.00 C ATOM 0 HA PRO A 90 16.043 10.943 0.330 1.00 10.00 H new ATOM 0 HB2 PRO A 90 15.588 13.408 -0.704 1.00 10.00 H new ATOM 0 HB3 PRO A 90 17.212 12.869 -0.326 1.00 10.00 H new ATOM 0 HG2 PRO A 90 15.806 12.820 -3.051 1.00 10.00 H new ATOM 0 HG3 PRO A 90 17.413 13.414 -2.682 1.00 10.00 H new ATOM 0 HD2 PRO A 90 17.137 10.891 -3.626 1.00 10.00 H new ATOM 0 HD3 PRO A 90 18.307 11.203 -2.360 1.00 10.00 H new ATOM 1274 N TRP A 91 13.722 10.705 -1.880 1.00 10.00 N ATOM 1275 CA TRP A 91 12.333 10.332 -2.077 1.00 10.00 C ATOM 1276 C TRP A 91 12.210 9.870 -3.533 1.00 10.00 C ATOM 1277 O TRP A 91 13.198 9.932 -4.268 1.00 10.00 O ATOM 1278 CB TRP A 91 11.398 11.516 -1.784 1.00 10.00 C ATOM 1279 CG TRP A 91 11.695 12.723 -2.603 1.00 10.00 C ATOM 1280 CD1 TRP A 91 11.248 12.913 -3.854 1.00 10.00 C ATOM 1281 CD2 TRP A 91 12.610 13.818 -2.348 1.00 10.00 C ATOM 1282 NE1 TRP A 91 12.009 13.874 -4.472 1.00 10.00 N ATOM 1283 CE2 TRP A 91 12.888 14.457 -3.583 1.00 10.00 C ATOM 1284 CE3 TRP A 91 13.272 14.307 -1.211 1.00 10.00 C ATOM 1285 CZ2 TRP A 91 13.889 15.426 -3.697 1.00 10.00 C ATOM 1286 CZ3 TRP A 91 14.155 15.400 -1.289 1.00 10.00 C ATOM 1287 CH2 TRP A 91 14.515 15.919 -2.542 1.00 10.00 C ATOM 0 H TRP A 91 14.262 10.645 -2.743 1.00 10.00 H new ATOM 0 HA TRP A 91 12.039 9.536 -1.393 1.00 10.00 H new ATOM 0 HB2 TRP A 91 10.368 11.209 -1.964 1.00 10.00 H new ATOM 0 HB3 TRP A 91 11.473 11.776 -0.728 1.00 10.00 H new ATOM 0 HD1 TRP A 91 10.417 12.390 -4.305 1.00 10.00 H new ATOM 0 HE1 TRP A 91 11.934 14.124 -5.458 1.00 10.00 H new ATOM 0 HE3 TRP A 91 13.100 13.834 -0.255 1.00 10.00 H new ATOM 0 HZ2 TRP A 91 14.179 15.794 -4.670 1.00 10.00 H new ATOM 0 HZ3 TRP A 91 14.555 15.838 -0.387 1.00 10.00 H new ATOM 0 HH2 TRP A 91 15.267 16.691 -2.617 1.00 10.00 H new ATOM 1298 N LEU A 92 11.010 9.461 -3.962 1.00 10.00 N ATOM 1299 CA LEU A 92 10.673 9.277 -5.371 1.00 10.00 C ATOM 1300 C LEU A 92 9.614 10.317 -5.747 1.00 10.00 C ATOM 1301 O LEU A 92 8.475 10.248 -5.297 1.00 10.00 O ATOM 1302 CB LEU A 92 10.273 7.815 -5.662 1.00 10.00 C ATOM 1303 CG LEU A 92 8.995 7.304 -4.965 1.00 10.00 C ATOM 1304 CD1 LEU A 92 7.807 7.263 -5.939 1.00 10.00 C ATOM 1305 CD2 LEU A 92 9.207 5.881 -4.434 1.00 10.00 C ATOM 0 H LEU A 92 10.239 9.247 -3.329 1.00 10.00 H new ATOM 0 HA LEU A 92 11.540 9.448 -6.010 1.00 10.00 H new ATOM 0 HB2 LEU A 92 10.143 7.704 -6.739 1.00 10.00 H new ATOM 0 HB3 LEU A 92 11.102 7.169 -5.372 1.00 10.00 H new ATOM 0 HG LEU A 92 8.781 7.993 -4.148 1.00 10.00 H new ATOM 0 HD11 LEU A 92 6.922 6.899 -5.418 1.00 10.00 H new ATOM 0 HD12 LEU A 92 7.616 8.265 -6.322 1.00 10.00 H new ATOM 0 HD13 LEU A 92 8.040 6.596 -6.769 1.00 10.00 H new ATOM 0 HD21 LEU A 92 8.296 5.536 -3.945 1.00 10.00 H new ATOM 0 HD22 LEU A 92 9.449 5.216 -5.263 1.00 10.00 H new ATOM 0 HD23 LEU A 92 10.027 5.879 -3.716 1.00 10.00 H new ATOM 1317 N THR A 93 9.996 11.344 -6.509 1.00 10.00 N ATOM 1318 CA THR A 93 9.119 12.464 -6.818 1.00 10.00 C ATOM 1319 C THR A 93 8.135 12.022 -7.904 1.00 10.00 C ATOM 1320 O THR A 93 8.490 11.191 -8.737 1.00 10.00 O ATOM 1321 CB THR A 93 9.987 13.614 -7.372 1.00 10.00 C ATOM 1322 OG1 THR A 93 11.366 13.394 -7.116 1.00 10.00 O ATOM 1323 CG2 THR A 93 9.589 14.956 -6.767 1.00 10.00 C ATOM 0 H THR A 93 10.923 11.418 -6.927 1.00 10.00 H new ATOM 0 HA THR A 93 8.577 12.789 -5.930 1.00 10.00 H new ATOM 0 HB THR A 93 9.817 13.637 -8.448 1.00 10.00 H new ATOM 0 HG1 THR A 93 11.889 14.139 -7.480 1.00 10.00 H new ATOM 0 HG21 THR A 93 10.221 15.743 -7.180 1.00 10.00 H new ATOM 0 HG22 THR A 93 8.546 15.167 -7.003 1.00 10.00 H new ATOM 0 HG23 THR A 93 9.715 14.919 -5.685 1.00 10.00 H new ATOM 1331 N ILE A 94 6.926 12.596 -7.936 1.00 10.00 N ATOM 1332 CA ILE A 94 5.987 12.384 -9.030 1.00 10.00 C ATOM 1333 C ILE A 94 5.739 13.731 -9.724 1.00 10.00 C ATOM 1334 O ILE A 94 4.841 14.481 -9.331 1.00 10.00 O ATOM 1335 CB ILE A 94 4.741 11.624 -8.538 1.00 10.00 C ATOM 1336 CG1 ILE A 94 3.944 12.333 -7.435 1.00 10.00 C ATOM 1337 CG2 ILE A 94 5.196 10.236 -8.071 1.00 10.00 C ATOM 1338 CD1 ILE A 94 2.942 11.432 -6.713 1.00 10.00 C ATOM 0 H ILE A 94 6.578 13.217 -7.205 1.00 10.00 H new ATOM 0 HA ILE A 94 6.392 11.726 -9.799 1.00 10.00 H new ATOM 0 HB ILE A 94 4.044 11.564 -9.374 1.00 10.00 H new ATOM 0 HG12 ILE A 94 4.641 12.743 -6.704 1.00 10.00 H new ATOM 0 HG13 ILE A 94 3.409 13.176 -7.872 1.00 10.00 H new ATOM 0 HG21 ILE A 94 4.334 9.671 -7.715 1.00 10.00 H new ATOM 0 HG22 ILE A 94 5.659 9.706 -8.903 1.00 10.00 H new ATOM 0 HG23 ILE A 94 5.919 10.343 -7.262 1.00 10.00 H new ATOM 0 HD11 ILE A 94 2.420 12.008 -5.949 1.00 10.00 H new ATOM 0 HD12 ILE A 94 2.220 11.042 -7.431 1.00 10.00 H new ATOM 0 HD13 ILE A 94 3.471 10.602 -6.244 1.00 10.00 H new ATOM 1350 N PRO A 95 6.564 14.079 -10.732 1.00 10.00 N ATOM 1351 CA PRO A 95 6.591 15.403 -11.340 1.00 10.00 C ATOM 1352 C PRO A 95 5.434 15.569 -12.327 1.00 10.00 C ATOM 1353 O PRO A 95 5.646 15.831 -13.507 1.00 10.00 O ATOM 1354 CB PRO A 95 7.938 15.477 -12.061 1.00 10.00 C ATOM 1355 CG PRO A 95 8.189 14.032 -12.480 1.00 10.00 C ATOM 1356 CD PRO A 95 7.601 13.236 -11.319 1.00 10.00 C ATOM 0 HA PRO A 95 6.479 16.197 -10.601 1.00 10.00 H new ATOM 0 HB2 PRO A 95 7.898 16.145 -12.922 1.00 10.00 H new ATOM 0 HB3 PRO A 95 8.726 15.849 -11.406 1.00 10.00 H new ATOM 0 HG2 PRO A 95 7.698 13.793 -13.424 1.00 10.00 H new ATOM 0 HG3 PRO A 95 9.251 13.828 -12.613 1.00 10.00 H new ATOM 0 HD2 PRO A 95 7.184 12.291 -11.667 1.00 10.00 H new ATOM 0 HD3 PRO A 95 8.369 12.995 -10.584 1.00 10.00 H new ATOM 1364 N ALA A 96 4.208 15.394 -11.839 1.00 10.00 N ATOM 1365 CA ALA A 96 3.035 15.189 -12.650 1.00 10.00 C ATOM 1366 C ALA A 96 3.151 13.877 -13.417 1.00 10.00 C ATOM 1367 O ALA A 96 4.226 13.315 -13.612 1.00 10.00 O ATOM 1368 CB ALA A 96 2.743 16.397 -13.534 1.00 10.00 C ATOM 0 H ALA A 96 4.010 15.393 -10.838 1.00 10.00 H new ATOM 0 HA ALA A 96 2.164 15.097 -12.002 1.00 10.00 H new ATOM 0 HB1 ALA A 96 1.851 16.204 -14.131 1.00 10.00 H new ATOM 0 HB2 ALA A 96 2.578 17.274 -12.908 1.00 10.00 H new ATOM 0 HB3 ALA A 96 3.590 16.577 -14.196 1.00 10.00 H new ATOM 1374 N ARG A 97 1.987 13.339 -13.759 1.00 10.00 N ATOM 1375 CA ARG A 97 1.819 12.054 -14.419 1.00 10.00 C ATOM 1376 C ARG A 97 2.751 10.945 -13.912 1.00 10.00 C ATOM 1377 O ARG A 97 3.162 10.077 -14.679 1.00 10.00 O ATOM 1378 CB ARG A 97 1.870 12.244 -15.943 1.00 10.00 C ATOM 1379 CG ARG A 97 0.655 13.021 -16.471 1.00 10.00 C ATOM 1380 CD ARG A 97 -0.644 12.321 -16.044 1.00 10.00 C ATOM 1381 NE ARG A 97 -1.722 12.499 -17.022 1.00 10.00 N ATOM 1382 CZ ARG A 97 -2.742 11.635 -17.149 1.00 10.00 C ATOM 1383 NH1 ARG A 97 -2.952 10.706 -16.206 1.00 10.00 N ATOM 1384 NH2 ARG A 97 -3.536 11.698 -18.223 1.00 10.00 N ATOM 0 H ARG A 97 1.099 13.807 -13.576 1.00 10.00 H new ATOM 0 HA ARG A 97 0.831 11.682 -14.148 1.00 10.00 H new ATOM 0 HB2 ARG A 97 2.783 12.775 -16.211 1.00 10.00 H new ATOM 0 HB3 ARG A 97 1.914 11.269 -16.428 1.00 10.00 H new ATOM 0 HG2 ARG A 97 0.671 14.041 -16.087 1.00 10.00 H new ATOM 0 HG3 ARG A 97 0.701 13.089 -17.558 1.00 10.00 H new ATOM 0 HD2 ARG A 97 -0.452 11.257 -15.908 1.00 10.00 H new ATOM 0 HD3 ARG A 97 -0.964 12.713 -15.079 1.00 10.00 H new ATOM 0 HE ARG A 97 -1.696 13.315 -17.633 1.00 10.00 H new ATOM 0 HH11 ARG A 97 -2.337 10.656 -15.393 1.00 10.00 H new ATOM 0 HH12 ARG A 97 -3.726 10.049 -16.301 1.00 10.00 H new ATOM 0 HH21 ARG A 97 -3.366 12.401 -18.942 1.00 10.00 H new ATOM 0 HH22 ARG A 97 -4.312 11.043 -18.323 1.00 10.00 H new ATOM 1398 N GLY A 98 2.973 10.886 -12.596 1.00 10.00 N ATOM 1399 CA GLY A 98 3.476 9.693 -11.935 1.00 10.00 C ATOM 1400 C GLY A 98 2.443 8.566 -11.998 1.00 10.00 C ATOM 1401 O GLY A 98 1.864 8.171 -10.991 1.00 10.00 O ATOM 0 H GLY A 98 2.807 11.669 -11.964 1.00 10.00 H new ATOM 0 HA2 GLY A 98 4.403 9.371 -12.410 1.00 10.00 H new ATOM 0 HA3 GLY A 98 3.712 9.919 -10.895 1.00 10.00 H new ATOM 1405 N THR A 99 2.209 8.017 -13.186 1.00 10.00 N ATOM 1406 CA THR A 99 1.468 6.777 -13.340 1.00 10.00 C ATOM 1407 C THR A 99 2.452 5.635 -13.148 1.00 10.00 C ATOM 1408 O THR A 99 2.629 4.801 -14.037 1.00 10.00 O ATOM 1409 CB THR A 99 0.718 6.761 -14.683 1.00 10.00 C ATOM 1410 OG1 THR A 99 0.152 5.491 -14.924 1.00 10.00 O ATOM 1411 CG2 THR A 99 1.621 7.141 -15.858 1.00 10.00 C ATOM 0 H THR A 99 2.529 8.421 -14.066 1.00 10.00 H new ATOM 0 HA THR A 99 0.684 6.670 -12.590 1.00 10.00 H new ATOM 0 HB THR A 99 -0.071 7.509 -14.606 1.00 10.00 H new ATOM 0 HG1 THR A 99 0.842 4.802 -14.829 1.00 10.00 H new ATOM 0 HG21 THR A 99 1.045 7.115 -16.783 1.00 10.00 H new ATOM 0 HG22 THR A 99 2.015 8.146 -15.704 1.00 10.00 H new ATOM 0 HG23 THR A 99 2.448 6.434 -15.925 1.00 10.00 H new ATOM 1419 N LEU A 100 3.112 5.625 -11.989 1.00 10.00 N ATOM 1420 CA LEU A 100 4.261 4.762 -11.800 1.00 10.00 C ATOM 1421 C LEU A 100 3.848 3.464 -11.121 1.00 10.00 C ATOM 1422 O LEU A 100 2.715 3.300 -10.667 1.00 10.00 O ATOM 1423 CB LEU A 100 5.401 5.507 -11.102 1.00 10.00 C ATOM 1424 CG LEU A 100 5.129 5.761 -9.616 1.00 10.00 C ATOM 1425 CD1 LEU A 100 6.243 5.172 -8.761 1.00 10.00 C ATOM 1426 CD2 LEU A 100 5.040 7.256 -9.336 1.00 10.00 C ATOM 0 H LEU A 100 2.869 6.199 -11.182 1.00 10.00 H new ATOM 0 HA LEU A 100 4.663 4.473 -12.771 1.00 10.00 H new ATOM 0 HB2 LEU A 100 6.320 4.931 -11.204 1.00 10.00 H new ATOM 0 HB3 LEU A 100 5.565 6.461 -11.604 1.00 10.00 H new ATOM 0 HG LEU A 100 4.182 5.284 -9.366 1.00 10.00 H new ATOM 0 HD11 LEU A 100 6.033 5.362 -7.708 1.00 10.00 H new ATOM 0 HD12 LEU A 100 6.302 4.097 -8.931 1.00 10.00 H new ATOM 0 HD13 LEU A 100 7.192 5.635 -9.031 1.00 10.00 H new ATOM 0 HD21 LEU A 100 4.846 7.417 -8.275 1.00 10.00 H new ATOM 0 HD22 LEU A 100 5.981 7.734 -9.610 1.00 10.00 H new ATOM 0 HD23 LEU A 100 4.229 7.688 -9.922 1.00 10.00 H new ATOM 1438 N THR A 101 4.800 2.545 -11.066 1.00 10.00 N ATOM 1439 CA THR A 101 4.622 1.171 -10.664 1.00 10.00 C ATOM 1440 C THR A 101 5.678 0.929 -9.599 1.00 10.00 C ATOM 1441 O THR A 101 6.836 1.309 -9.765 1.00 10.00 O ATOM 1442 CB THR A 101 4.694 0.234 -11.883 1.00 10.00 C ATOM 1443 OG1 THR A 101 4.371 -1.087 -11.510 1.00 10.00 O ATOM 1444 CG2 THR A 101 6.031 0.267 -12.631 1.00 10.00 C ATOM 0 H THR A 101 5.766 2.756 -11.315 1.00 10.00 H new ATOM 0 HA THR A 101 3.638 0.961 -10.244 1.00 10.00 H new ATOM 0 HB THR A 101 3.954 0.614 -12.588 1.00 10.00 H new ATOM 0 HG1 THR A 101 5.068 -1.439 -10.917 1.00 10.00 H new ATOM 0 HG21 THR A 101 5.993 -0.422 -13.474 1.00 10.00 H new ATOM 0 HG22 THR A 101 6.219 1.277 -12.996 1.00 10.00 H new ATOM 0 HG23 THR A 101 6.833 -0.030 -11.955 1.00 10.00 H new ATOM 1452 N LEU A 102 5.225 0.398 -8.473 1.00 10.00 N ATOM 1453 CA LEU A 102 5.973 0.237 -7.256 1.00 10.00 C ATOM 1454 C LEU A 102 5.985 -1.265 -7.025 1.00 10.00 C ATOM 1455 O LEU A 102 4.963 -1.838 -6.653 1.00 10.00 O ATOM 1456 CB LEU A 102 5.297 1.027 -6.117 1.00 10.00 C ATOM 1457 CG LEU A 102 5.044 2.512 -6.457 1.00 10.00 C ATOM 1458 CD1 LEU A 102 3.669 2.783 -7.074 1.00 10.00 C ATOM 1459 CD2 LEU A 102 5.201 3.377 -5.202 1.00 10.00 C ATOM 0 H LEU A 102 4.269 0.051 -8.390 1.00 10.00 H new ATOM 0 HA LEU A 102 6.990 0.626 -7.303 1.00 10.00 H new ATOM 0 HB2 LEU A 102 4.347 0.553 -5.872 1.00 10.00 H new ATOM 0 HB3 LEU A 102 5.922 0.969 -5.226 1.00 10.00 H new ATOM 0 HG LEU A 102 5.790 2.772 -7.208 1.00 10.00 H new ATOM 0 HD11 LEU A 102 3.568 3.848 -7.284 1.00 10.00 H new ATOM 0 HD12 LEU A 102 3.569 2.219 -8.001 1.00 10.00 H new ATOM 0 HD13 LEU A 102 2.890 2.475 -6.376 1.00 10.00 H new ATOM 0 HD21 LEU A 102 5.020 4.422 -5.455 1.00 10.00 H new ATOM 0 HD22 LEU A 102 4.483 3.057 -4.447 1.00 10.00 H new ATOM 0 HD23 LEU A 102 6.212 3.269 -4.810 1.00 10.00 H new ATOM 1471 N GLN A 103 7.111 -1.913 -7.310 1.00 10.00 N ATOM 1472 CA GLN A 103 7.277 -3.347 -7.167 1.00 10.00 C ATOM 1473 C GLN A 103 8.734 -3.583 -6.783 1.00 10.00 C ATOM 1474 O GLN A 103 9.518 -2.640 -6.764 1.00 10.00 O ATOM 1475 CB GLN A 103 6.828 -4.112 -8.425 1.00 10.00 C ATOM 1476 CG GLN A 103 7.753 -4.011 -9.633 1.00 10.00 C ATOM 1477 CD GLN A 103 7.404 -2.863 -10.556 1.00 10.00 C ATOM 1478 OE1 GLN A 103 6.633 -1.968 -10.221 1.00 10.00 O ATOM 1479 NE2 GLN A 103 7.949 -2.892 -11.757 1.00 10.00 N ATOM 0 H GLN A 103 7.948 -1.442 -7.654 1.00 10.00 H new ATOM 0 HA GLN A 103 6.630 -3.744 -6.385 1.00 10.00 H new ATOM 0 HB2 GLN A 103 6.715 -5.165 -8.165 1.00 10.00 H new ATOM 0 HB3 GLN A 103 5.842 -3.748 -8.715 1.00 10.00 H new ATOM 0 HG2 GLN A 103 8.780 -3.892 -9.287 1.00 10.00 H new ATOM 0 HG3 GLN A 103 7.712 -4.945 -10.193 1.00 10.00 H new ATOM 0 HE21 GLN A 103 8.586 -3.647 -12.010 1.00 10.00 H new ATOM 0 HE22 GLN A 103 7.733 -2.159 -12.433 1.00 10.00 H new ATOM 1488 N ARG A 104 9.115 -4.826 -6.498 1.00 10.00 N ATOM 1489 CA ARG A 104 10.509 -5.191 -6.222 1.00 10.00 C ATOM 1490 C ARG A 104 11.490 -4.449 -7.147 1.00 10.00 C ATOM 1491 O ARG A 104 12.460 -3.843 -6.693 1.00 10.00 O ATOM 1492 CB ARG A 104 10.700 -6.707 -6.372 1.00 10.00 C ATOM 1493 CG ARG A 104 9.636 -7.505 -5.610 1.00 10.00 C ATOM 1494 CD ARG A 104 10.089 -8.942 -5.359 1.00 10.00 C ATOM 1495 NE ARG A 104 10.416 -9.643 -6.609 1.00 10.00 N ATOM 1496 CZ ARG A 104 10.889 -10.898 -6.675 1.00 10.00 C ATOM 1497 NH1 ARG A 104 11.082 -11.608 -5.562 1.00 10.00 N ATOM 1498 NH2 ARG A 104 11.177 -11.436 -7.866 1.00 10.00 N ATOM 0 H ARG A 104 8.467 -5.612 -6.451 1.00 10.00 H new ATOM 0 HA ARG A 104 10.727 -4.894 -5.196 1.00 10.00 H new ATOM 0 HB2 ARG A 104 10.663 -6.973 -7.428 1.00 10.00 H new ATOM 0 HB3 ARG A 104 11.689 -6.984 -6.008 1.00 10.00 H new ATOM 0 HG2 ARG A 104 9.426 -7.017 -4.658 1.00 10.00 H new ATOM 0 HG3 ARG A 104 8.706 -7.509 -6.179 1.00 10.00 H new ATOM 0 HD2 ARG A 104 10.962 -8.938 -4.707 1.00 10.00 H new ATOM 0 HD3 ARG A 104 9.302 -9.484 -4.835 1.00 10.00 H new ATOM 0 HE ARG A 104 10.274 -9.142 -7.486 1.00 10.00 H new ATOM 0 HH11 ARG A 104 10.870 -11.198 -4.652 1.00 10.00 H new ATOM 0 HH12 ARG A 104 11.442 -12.561 -5.621 1.00 10.00 H new ATOM 0 HH21 ARG A 104 11.037 -10.893 -8.718 1.00 10.00 H new ATOM 0 HH22 ARG A 104 11.537 -12.389 -7.922 1.00 10.00 H new ATOM 1512 N ASP A 105 11.197 -4.510 -8.445 1.00 10.00 N ATOM 1513 CA ASP A 105 11.952 -3.966 -9.566 1.00 10.00 C ATOM 1514 C ASP A 105 11.421 -2.614 -10.079 1.00 10.00 C ATOM 1515 O ASP A 105 11.811 -2.210 -11.171 1.00 10.00 O ATOM 1516 CB ASP A 105 11.883 -5.008 -10.698 1.00 10.00 C ATOM 1517 CG ASP A 105 10.433 -5.369 -10.996 1.00 10.00 C ATOM 1518 OD1 ASP A 105 9.892 -6.133 -10.165 1.00 10.00 O ATOM 1519 OD2 ASP A 105 9.856 -4.800 -11.948 1.00 10.00 O ATOM 0 H ASP A 105 10.351 -4.983 -8.764 1.00 10.00 H new ATOM 0 HA ASP A 105 12.971 -3.773 -9.231 1.00 10.00 H new ATOM 0 HB2 ASP A 105 12.358 -4.612 -11.596 1.00 10.00 H new ATOM 0 HB3 ASP A 105 12.436 -5.903 -10.412 1.00 10.00 H new ATOM 1524 N GLY A 106 10.581 -1.883 -9.331 1.00 10.00 N ATOM 1525 CA GLY A 106 10.040 -0.600 -9.794 1.00 10.00 C ATOM 1526 C GLY A 106 9.848 0.369 -8.639 1.00 10.00 C ATOM 1527 O GLY A 106 9.699 -0.087 -7.515 1.00 10.00 O ATOM 0 H GLY A 106 10.263 -2.160 -8.403 1.00 10.00 H new ATOM 0 HA2 GLY A 106 10.715 -0.163 -10.530 1.00 10.00 H new ATOM 0 HA3 GLY A 106 9.086 -0.765 -10.295 1.00 10.00 H new ATOM 1531 N ASP A 107 9.928 1.681 -8.890 1.00 10.00 N ATOM 1532 CA ASP A 107 9.995 2.749 -7.887 1.00 10.00 C ATOM 1533 C ASP A 107 9.172 2.460 -6.625 1.00 10.00 C ATOM 1534 O ASP A 107 7.977 2.710 -6.626 1.00 10.00 O ATOM 1535 CB ASP A 107 9.458 4.064 -8.483 1.00 10.00 C ATOM 1536 CG ASP A 107 10.204 4.726 -9.626 1.00 10.00 C ATOM 1537 OD1 ASP A 107 11.392 4.403 -9.829 1.00 10.00 O ATOM 1538 OD2 ASP A 107 9.575 5.577 -10.287 1.00 10.00 O ATOM 0 H ASP A 107 9.949 2.043 -9.843 1.00 10.00 H new ATOM 0 HA ASP A 107 11.046 2.820 -7.607 1.00 10.00 H new ATOM 0 HB2 ASP A 107 8.439 3.876 -8.823 1.00 10.00 H new ATOM 0 HB3 ASP A 107 9.395 4.789 -7.671 1.00 10.00 H new ATOM 1543 N HIS A 108 9.774 1.958 -5.541 1.00 10.00 N ATOM 1544 CA HIS A 108 9.024 1.396 -4.418 1.00 10.00 C ATOM 1545 C HIS A 108 9.454 2.003 -3.080 1.00 10.00 C ATOM 1546 O HIS A 108 10.425 2.759 -3.006 1.00 10.00 O ATOM 1547 CB HIS A 108 9.183 -0.130 -4.390 1.00 10.00 C ATOM 1548 CG HIS A 108 10.621 -0.584 -4.394 1.00 10.00 C ATOM 1549 ND1 HIS A 108 11.438 -0.617 -5.494 1.00 10.00 N ATOM 1550 CD2 HIS A 108 11.319 -1.110 -3.343 1.00 10.00 C ATOM 1551 CE1 HIS A 108 12.589 -1.194 -5.122 1.00 10.00 C ATOM 1552 NE2 HIS A 108 12.600 -1.466 -3.801 1.00 10.00 N ATOM 0 H HIS A 108 10.786 1.931 -5.420 1.00 10.00 H new ATOM 0 HA HIS A 108 7.973 1.646 -4.564 1.00 10.00 H new ATOM 0 HB2 HIS A 108 8.689 -0.523 -3.502 1.00 10.00 H new ATOM 0 HB3 HIS A 108 8.673 -0.557 -5.254 1.00 10.00 H new ATOM 0 HD1 HIS A 108 11.212 -0.267 -6.425 1.00 10.00 H new ATOM 0 HD2 HIS A 108 10.950 -1.231 -2.335 1.00 10.00 H new ATOM 0 HE1 HIS A 108 13.405 -1.413 -5.795 1.00 10.00 H new ATOM 1560 N VAL A 109 8.743 1.627 -2.011 1.00 10.00 N ATOM 1561 CA VAL A 109 9.000 2.065 -0.649 1.00 10.00 C ATOM 1562 C VAL A 109 9.514 0.845 0.112 1.00 10.00 C ATOM 1563 O VAL A 109 8.717 -0.054 0.372 1.00 10.00 O ATOM 1564 CB VAL A 109 7.695 2.592 -0.012 1.00 10.00 C ATOM 1565 CG1 VAL A 109 8.014 3.343 1.288 1.00 10.00 C ATOM 1566 CG2 VAL A 109 6.884 3.492 -0.957 1.00 10.00 C ATOM 0 H VAL A 109 7.950 0.990 -2.080 1.00 10.00 H new ATOM 0 HA VAL A 109 9.730 2.874 -0.621 1.00 10.00 H new ATOM 0 HB VAL A 109 7.073 1.723 0.202 1.00 10.00 H new ATOM 0 HG11 VAL A 109 7.089 3.712 1.732 1.00 10.00 H new ATOM 0 HG12 VAL A 109 8.507 2.667 1.987 1.00 10.00 H new ATOM 0 HG13 VAL A 109 8.672 4.184 1.070 1.00 10.00 H new ATOM 0 HG21 VAL A 109 5.980 3.830 -0.451 1.00 10.00 H new ATOM 0 HG22 VAL A 109 7.485 4.356 -1.241 1.00 10.00 H new ATOM 0 HG23 VAL A 109 6.612 2.930 -1.850 1.00 10.00 H new ATOM 1576 N MET A 110 10.809 0.791 0.453 1.00 10.00 N ATOM 1577 CA MET A 110 11.349 -0.255 1.312 1.00 10.00 C ATOM 1578 C MET A 110 11.127 0.138 2.768 1.00 10.00 C ATOM 1579 O MET A 110 11.828 0.969 3.337 1.00 10.00 O ATOM 1580 CB MET A 110 12.818 -0.582 1.003 1.00 10.00 C ATOM 1581 CG MET A 110 12.896 -1.341 -0.323 1.00 10.00 C ATOM 1582 SD MET A 110 14.442 -2.213 -0.703 1.00 10.00 S ATOM 1583 CE MET A 110 13.780 -3.836 -1.146 1.00 10.00 C ATOM 0 H MET A 110 11.503 1.470 0.140 1.00 10.00 H new ATOM 0 HA MET A 110 10.814 -1.183 1.112 1.00 10.00 H new ATOM 0 HB2 MET A 110 13.403 0.336 0.945 1.00 10.00 H new ATOM 0 HB3 MET A 110 13.246 -1.183 1.805 1.00 10.00 H new ATOM 0 HG2 MET A 110 12.086 -2.070 -0.341 1.00 10.00 H new ATOM 0 HG3 MET A 110 12.704 -0.632 -1.128 1.00 10.00 H new ATOM 0 HE1 MET A 110 14.603 -4.519 -1.358 1.00 10.00 H new ATOM 0 HE2 MET A 110 13.189 -4.226 -0.318 1.00 10.00 H new ATOM 0 HE3 MET A 110 13.149 -3.743 -2.030 1.00 10.00 H new ATOM 1593 N LEU A 111 10.124 -0.488 3.368 1.00 10.00 N ATOM 1594 CA LEU A 111 9.785 -0.394 4.769 1.00 10.00 C ATOM 1595 C LEU A 111 10.693 -1.394 5.481 1.00 10.00 C ATOM 1596 O LEU A 111 10.245 -2.439 5.947 1.00 10.00 O ATOM 1597 CB LEU A 111 8.289 -0.719 4.918 1.00 10.00 C ATOM 1598 CG LEU A 111 7.379 0.314 4.230 1.00 10.00 C ATOM 1599 CD1 LEU A 111 5.935 -0.198 4.233 1.00 10.00 C ATOM 1600 CD2 LEU A 111 7.434 1.676 4.932 1.00 10.00 C ATOM 0 H LEU A 111 9.495 -1.107 2.857 1.00 10.00 H new ATOM 0 HA LEU A 111 9.937 0.595 5.201 1.00 10.00 H new ATOM 0 HB2 LEU A 111 8.093 -1.705 4.497 1.00 10.00 H new ATOM 0 HB3 LEU A 111 8.037 -0.769 5.977 1.00 10.00 H new ATOM 0 HG LEU A 111 7.734 0.446 3.208 1.00 10.00 H new ATOM 0 HD11 LEU A 111 5.289 0.532 3.746 1.00 10.00 H new ATOM 0 HD12 LEU A 111 5.883 -1.144 3.694 1.00 10.00 H new ATOM 0 HD13 LEU A 111 5.604 -0.347 5.261 1.00 10.00 H new ATOM 0 HD21 LEU A 111 6.778 2.378 4.417 1.00 10.00 H new ATOM 0 HD22 LEU A 111 7.107 1.566 5.966 1.00 10.00 H new ATOM 0 HD23 LEU A 111 8.456 2.054 4.913 1.00 10.00 H new ATOM 1612 N MET A 112 11.988 -1.081 5.531 1.00 10.00 N ATOM 1613 CA MET A 112 13.009 -2.028 5.941 1.00 10.00 C ATOM 1614 C MET A 112 13.102 -2.048 7.469 1.00 10.00 C ATOM 1615 O MET A 112 12.853 -1.040 8.127 1.00 10.00 O ATOM 1616 CB MET A 112 14.324 -1.624 5.256 1.00 10.00 C ATOM 1617 CG MET A 112 15.474 -2.617 5.463 1.00 10.00 C ATOM 1618 SD MET A 112 17.035 -2.173 4.655 1.00 10.00 S ATOM 1619 CE MET A 112 16.571 -2.243 2.909 1.00 10.00 C ATOM 0 H MET A 112 12.353 -0.160 5.287 1.00 10.00 H new ATOM 0 HA MET A 112 12.768 -3.047 5.636 1.00 10.00 H new ATOM 0 HB2 MET A 112 14.144 -1.512 4.187 1.00 10.00 H new ATOM 0 HB3 MET A 112 14.631 -0.648 5.631 1.00 10.00 H new ATOM 0 HG2 MET A 112 15.654 -2.721 6.533 1.00 10.00 H new ATOM 0 HG3 MET A 112 15.159 -3.594 5.096 1.00 10.00 H new ATOM 0 HE1 MET A 112 17.306 -2.832 2.361 1.00 10.00 H new ATOM 0 HE2 MET A 112 15.589 -2.706 2.812 1.00 10.00 H new ATOM 0 HE3 MET A 112 16.538 -1.233 2.501 1.00 10.00 H new ATOM 1629 N GLY A 113 13.445 -3.190 8.066 1.00 10.00 N ATOM 1630 CA GLY A 113 13.555 -3.298 9.512 1.00 10.00 C ATOM 1631 C GLY A 113 12.170 -3.499 10.117 1.00 10.00 C ATOM 1632 O GLY A 113 11.714 -2.689 10.922 1.00 10.00 O ATOM 0 H GLY A 113 13.651 -4.054 7.564 1.00 10.00 H new ATOM 0 HA2 GLY A 113 14.203 -4.134 9.776 1.00 10.00 H new ATOM 0 HA3 GLY A 113 14.014 -2.398 9.920 1.00 10.00 H new ATOM 1636 N LEU A 114 11.510 -4.580 9.709 1.00 10.00 N ATOM 1637 CA LEU A 114 10.215 -5.033 10.194 1.00 10.00 C ATOM 1638 C LEU A 114 10.212 -5.088 11.729 1.00 10.00 C ATOM 1639 O LEU A 114 11.117 -5.679 12.315 1.00 10.00 O ATOM 1640 CB LEU A 114 9.966 -6.395 9.525 1.00 10.00 C ATOM 1641 CG LEU A 114 8.807 -7.223 10.095 1.00 10.00 C ATOM 1642 CD1 LEU A 114 8.047 -7.907 8.952 1.00 10.00 C ATOM 1643 CD2 LEU A 114 9.342 -8.305 11.048 1.00 10.00 C ATOM 0 H LEU A 114 11.889 -5.196 8.990 1.00 10.00 H new ATOM 0 HA LEU A 114 9.404 -4.352 9.936 1.00 10.00 H new ATOM 0 HB2 LEU A 114 9.779 -6.228 8.464 1.00 10.00 H new ATOM 0 HB3 LEU A 114 10.879 -6.986 9.599 1.00 10.00 H new ATOM 0 HG LEU A 114 8.141 -6.554 10.640 1.00 10.00 H new ATOM 0 HD11 LEU A 114 7.225 -8.494 9.362 1.00 10.00 H new ATOM 0 HD12 LEU A 114 7.651 -7.151 8.275 1.00 10.00 H new ATOM 0 HD13 LEU A 114 8.725 -8.563 8.406 1.00 10.00 H new ATOM 0 HD21 LEU A 114 8.509 -8.885 11.445 1.00 10.00 H new ATOM 0 HD22 LEU A 114 10.018 -8.966 10.505 1.00 10.00 H new ATOM 0 HD23 LEU A 114 9.879 -7.832 11.870 1.00 10.00 H new ATOM 1655 N LYS A 115 9.220 -4.459 12.379 1.00 10.00 N ATOM 1656 CA LYS A 115 9.036 -4.543 13.825 1.00 10.00 C ATOM 1657 C LYS A 115 8.193 -5.776 14.180 1.00 10.00 C ATOM 1658 O LYS A 115 8.698 -6.725 14.774 1.00 10.00 O ATOM 1659 CB LYS A 115 8.398 -3.253 14.384 1.00 10.00 C ATOM 1660 CG LYS A 115 9.407 -2.136 14.721 1.00 10.00 C ATOM 1661 CD LYS A 115 9.413 -0.921 13.782 1.00 10.00 C ATOM 1662 CE LYS A 115 8.061 -0.192 13.705 1.00 10.00 C ATOM 1663 NZ LYS A 115 8.174 1.219 13.269 1.00 10.00 N ATOM 0 H LYS A 115 8.525 -3.878 11.910 1.00 10.00 H new ATOM 0 HA LYS A 115 10.016 -4.648 14.290 1.00 10.00 H new ATOM 0 HB2 LYS A 115 7.682 -2.871 13.656 1.00 10.00 H new ATOM 0 HB3 LYS A 115 7.836 -3.501 15.284 1.00 10.00 H new ATOM 0 HG2 LYS A 115 9.205 -1.786 15.733 1.00 10.00 H new ATOM 0 HG3 LYS A 115 10.407 -2.569 14.728 1.00 10.00 H new ATOM 0 HD2 LYS A 115 10.176 -0.218 14.117 1.00 10.00 H new ATOM 0 HD3 LYS A 115 9.697 -1.248 12.782 1.00 10.00 H new ATOM 0 HE2 LYS A 115 7.408 -0.726 13.015 1.00 10.00 H new ATOM 0 HE3 LYS A 115 7.584 -0.224 14.684 1.00 10.00 H new ATOM 0 HZ1 LYS A 115 7.236 1.574 12.995 1.00 10.00 H new ATOM 0 HZ2 LYS A 115 8.547 1.795 14.050 1.00 10.00 H new ATOM 0 HZ3 LYS A 115 8.819 1.280 12.455 1.00 10.00 H new ATOM 1677 N ARG A 116 6.892 -5.742 13.877 1.00 10.00 N ATOM 1678 CA ARG A 116 5.972 -6.821 14.241 1.00 10.00 C ATOM 1679 C ARG A 116 6.106 -7.985 13.252 1.00 10.00 C ATOM 1680 O ARG A 116 6.523 -7.773 12.118 1.00 10.00 O ATOM 1681 CB ARG A 116 4.524 -6.294 14.257 1.00 10.00 C ATOM 1682 CG ARG A 116 4.054 -5.844 15.646 1.00 10.00 C ATOM 1683 CD ARG A 116 4.811 -4.621 16.171 1.00 10.00 C ATOM 1684 NE ARG A 116 4.307 -4.243 17.502 1.00 10.00 N ATOM 1685 CZ ARG A 116 4.759 -3.213 18.234 1.00 10.00 C ATOM 1686 NH1 ARG A 116 5.699 -2.406 17.729 1.00 10.00 N ATOM 1687 NH2 ARG A 116 4.272 -2.998 19.461 1.00 10.00 N ATOM 0 H ARG A 116 6.450 -4.971 13.376 1.00 10.00 H new ATOM 0 HA ARG A 116 6.225 -7.182 15.238 1.00 10.00 H new ATOM 0 HB2 ARG A 116 4.443 -5.456 13.565 1.00 10.00 H new ATOM 0 HB3 ARG A 116 3.857 -7.075 13.891 1.00 10.00 H new ATOM 0 HG2 ARG A 116 2.989 -5.615 15.606 1.00 10.00 H new ATOM 0 HG3 ARG A 116 4.176 -6.668 16.349 1.00 10.00 H new ATOM 0 HD2 ARG A 116 5.877 -4.841 16.227 1.00 10.00 H new ATOM 0 HD3 ARG A 116 4.693 -3.787 15.479 1.00 10.00 H new ATOM 0 HE ARG A 116 3.556 -4.808 17.898 1.00 10.00 H new ATOM 0 HH11 ARG A 116 6.068 -2.575 16.793 1.00 10.00 H new ATOM 0 HH12 ARG A 116 6.047 -1.621 18.280 1.00 10.00 H new ATOM 0 HH21 ARG A 116 3.556 -3.617 19.841 1.00 10.00 H new ATOM 0 HH22 ARG A 116 4.616 -2.215 20.016 1.00 10.00 H new ATOM 1701 N PRO A 117 5.714 -9.213 13.621 1.00 10.00 N ATOM 1702 CA PRO A 117 5.601 -10.310 12.674 1.00 10.00 C ATOM 1703 C PRO A 117 4.349 -10.102 11.809 1.00 10.00 C ATOM 1704 O PRO A 117 3.339 -10.772 12.013 1.00 10.00 O ATOM 1705 CB PRO A 117 5.524 -11.566 13.550 1.00 10.00 C ATOM 1706 CG PRO A 117 4.813 -11.067 14.810 1.00 10.00 C ATOM 1707 CD PRO A 117 5.330 -9.635 14.959 1.00 10.00 C ATOM 0 HA PRO A 117 6.435 -10.385 11.976 1.00 10.00 H new ATOM 0 HB2 PRO A 117 4.966 -12.365 13.062 1.00 10.00 H new ATOM 0 HB3 PRO A 117 6.514 -11.961 13.776 1.00 10.00 H new ATOM 0 HG2 PRO A 117 3.729 -11.094 14.698 1.00 10.00 H new ATOM 0 HG3 PRO A 117 5.059 -11.677 15.679 1.00 10.00 H new ATOM 0 HD2 PRO A 117 4.560 -8.982 15.370 1.00 10.00 H new ATOM 0 HD3 PRO A 117 6.179 -9.595 15.641 1.00 10.00 H new ATOM 1715 N LEU A 118 4.403 -9.149 10.869 1.00 10.00 N ATOM 1716 CA LEU A 118 3.276 -8.768 10.029 1.00 10.00 C ATOM 1717 C LEU A 118 2.575 -9.974 9.393 1.00 10.00 C ATOM 1718 O LEU A 118 3.219 -10.855 8.821 1.00 10.00 O ATOM 1719 CB LEU A 118 3.762 -7.798 8.947 1.00 10.00 C ATOM 1720 CG LEU A 118 3.841 -6.325 9.376 1.00 10.00 C ATOM 1721 CD1 LEU A 118 2.474 -5.712 9.705 1.00 10.00 C ATOM 1722 CD2 LEU A 118 4.792 -6.064 10.538 1.00 10.00 C ATOM 0 H LEU A 118 5.250 -8.616 10.673 1.00 10.00 H new ATOM 0 HA LEU A 118 2.535 -8.283 10.665 1.00 10.00 H new ATOM 0 HB2 LEU A 118 4.750 -8.116 8.614 1.00 10.00 H new ATOM 0 HB3 LEU A 118 3.096 -7.874 8.088 1.00 10.00 H new ATOM 0 HG LEU A 118 4.245 -5.833 8.491 1.00 10.00 H new ATOM 0 HD11 LEU A 118 2.604 -4.671 10.000 1.00 10.00 H new ATOM 0 HD12 LEU A 118 1.832 -5.763 8.826 1.00 10.00 H new ATOM 0 HD13 LEU A 118 2.014 -6.266 10.523 1.00 10.00 H new ATOM 0 HD21 LEU A 118 4.789 -5.001 10.779 1.00 10.00 H new ATOM 0 HD22 LEU A 118 4.468 -6.634 11.409 1.00 10.00 H new ATOM 0 HD23 LEU A 118 5.800 -6.370 10.259 1.00 10.00 H new ATOM 1734 N LYS A 119 1.245 -9.995 9.486 1.00 10.00 N ATOM 1735 CA LYS A 119 0.396 -11.106 9.107 1.00 10.00 C ATOM 1736 C LYS A 119 -0.132 -10.884 7.692 1.00 10.00 C ATOM 1737 O LYS A 119 -0.728 -9.850 7.403 1.00 10.00 O ATOM 1738 CB LYS A 119 -0.760 -11.182 10.116 1.00 10.00 C ATOM 1739 CG LYS A 119 -1.737 -12.331 9.840 1.00 10.00 C ATOM 1740 CD LYS A 119 -2.877 -12.285 10.867 1.00 10.00 C ATOM 1741 CE LYS A 119 -4.012 -13.261 10.525 1.00 10.00 C ATOM 1742 NZ LYS A 119 -3.563 -14.668 10.502 1.00 10.00 N ATOM 0 H LYS A 119 0.715 -9.200 9.844 1.00 10.00 H new ATOM 0 HA LYS A 119 0.952 -12.043 9.116 1.00 10.00 H new ATOM 0 HB2 LYS A 119 -0.349 -11.298 11.119 1.00 10.00 H new ATOM 0 HB3 LYS A 119 -1.307 -10.239 10.102 1.00 10.00 H new ATOM 0 HG2 LYS A 119 -2.138 -12.248 8.830 1.00 10.00 H new ATOM 0 HG3 LYS A 119 -1.218 -13.287 9.899 1.00 10.00 H new ATOM 0 HD2 LYS A 119 -2.482 -12.523 11.855 1.00 10.00 H new ATOM 0 HD3 LYS A 119 -3.276 -11.272 10.918 1.00 10.00 H new ATOM 0 HE2 LYS A 119 -4.813 -13.151 11.256 1.00 10.00 H new ATOM 0 HE3 LYS A 119 -4.429 -13.001 9.552 1.00 10.00 H new ATOM 0 HZ1 LYS A 119 -4.370 -15.286 10.283 1.00 10.00 H new ATOM 0 HZ2 LYS A 119 -2.829 -14.786 9.775 1.00 10.00 H new ATOM 0 HZ3 LYS A 119 -3.173 -14.923 11.432 1.00 10.00 H new ATOM 1756 N VAL A 120 0.006 -11.890 6.826 1.00 10.00 N ATOM 1757 CA VAL A 120 -0.732 -11.930 5.572 1.00 10.00 C ATOM 1758 C VAL A 120 -2.228 -11.838 5.905 1.00 10.00 C ATOM 1759 O VAL A 120 -2.786 -12.807 6.422 1.00 10.00 O ATOM 1760 CB VAL A 120 -0.393 -13.228 4.810 1.00 10.00 C ATOM 1761 CG1 VAL A 120 -1.198 -13.347 3.509 1.00 10.00 C ATOM 1762 CG2 VAL A 120 1.097 -13.291 4.452 1.00 10.00 C ATOM 0 H VAL A 120 0.625 -12.687 6.975 1.00 10.00 H new ATOM 0 HA VAL A 120 -0.458 -11.096 4.926 1.00 10.00 H new ATOM 0 HB VAL A 120 -0.651 -14.050 5.478 1.00 10.00 H new ATOM 0 HG11 VAL A 120 -0.932 -14.274 3.000 1.00 10.00 H new ATOM 0 HG12 VAL A 120 -2.263 -13.352 3.740 1.00 10.00 H new ATOM 0 HG13 VAL A 120 -0.971 -12.500 2.862 1.00 10.00 H new ATOM 0 HG21 VAL A 120 1.304 -14.217 3.916 1.00 10.00 H new ATOM 0 HG22 VAL A 120 1.356 -12.441 3.821 1.00 10.00 H new ATOM 0 HG23 VAL A 120 1.692 -13.260 5.365 1.00 10.00 H new ATOM 1772 N GLY A 121 -2.866 -10.687 5.663 1.00 10.00 N ATOM 1773 CA GLY A 121 -4.270 -10.466 5.972 1.00 10.00 C ATOM 1774 C GLY A 121 -4.470 -9.348 6.993 1.00 10.00 C ATOM 1775 O GLY A 121 -5.613 -8.982 7.257 1.00 10.00 O ATOM 0 H GLY A 121 -2.410 -9.878 5.242 1.00 10.00 H new ATOM 0 HA2 GLY A 121 -4.807 -10.219 5.056 1.00 10.00 H new ATOM 0 HA3 GLY A 121 -4.705 -11.389 6.357 1.00 10.00 H new ATOM 1779 N GLU A 122 -3.397 -8.780 7.559 1.00 10.00 N ATOM 1780 CA GLU A 122 -3.508 -7.550 8.306 1.00 10.00 C ATOM 1781 C GLU A 122 -3.804 -6.410 7.333 1.00 10.00 C ATOM 1782 O GLU A 122 -3.906 -6.560 6.113 1.00 10.00 O ATOM 1783 CB GLU A 122 -2.195 -7.282 9.060 1.00 10.00 C ATOM 1784 CG GLU A 122 -2.284 -7.402 10.581 1.00 10.00 C ATOM 1785 CD GLU A 122 -0.900 -7.203 11.190 1.00 10.00 C ATOM 1786 OE1 GLU A 122 -0.002 -7.987 10.810 1.00 10.00 O ATOM 1787 OE2 GLU A 122 -0.753 -6.255 11.988 1.00 10.00 O ATOM 0 H GLU A 122 -2.452 -9.161 7.506 1.00 10.00 H new ATOM 0 HA GLU A 122 -4.316 -7.625 9.034 1.00 10.00 H new ATOM 0 HB2 GLU A 122 -1.439 -7.979 8.700 1.00 10.00 H new ATOM 0 HB3 GLU A 122 -1.849 -6.279 8.810 1.00 10.00 H new ATOM 0 HG2 GLU A 122 -2.976 -6.658 10.975 1.00 10.00 H new ATOM 0 HG3 GLU A 122 -2.677 -8.381 10.857 1.00 10.00 H new ATOM 1794 N THR A 123 -3.893 -5.230 7.917 1.00 10.00 N ATOM 1795 CA THR A 123 -4.026 -3.949 7.247 1.00 10.00 C ATOM 1796 C THR A 123 -3.483 -2.915 8.227 1.00 10.00 C ATOM 1797 O THR A 123 -3.902 -2.912 9.383 1.00 10.00 O ATOM 1798 CB THR A 123 -5.490 -3.701 6.847 1.00 10.00 C ATOM 1799 OG1 THR A 123 -5.871 -4.607 5.829 1.00 10.00 O ATOM 1800 CG2 THR A 123 -5.711 -2.287 6.303 1.00 10.00 C ATOM 0 H THR A 123 -3.873 -5.134 8.932 1.00 10.00 H new ATOM 0 HA THR A 123 -3.468 -3.901 6.312 1.00 10.00 H new ATOM 0 HB THR A 123 -6.086 -3.836 7.749 1.00 10.00 H new ATOM 0 HG1 THR A 123 -5.173 -5.286 5.717 1.00 10.00 H new ATOM 0 HG21 THR A 123 -6.760 -2.160 6.034 1.00 10.00 H new ATOM 0 HG22 THR A 123 -5.441 -1.557 7.066 1.00 10.00 H new ATOM 0 HG23 THR A 123 -5.090 -2.135 5.420 1.00 10.00 H new ATOM 1808 N VAL A 124 -2.503 -2.110 7.809 1.00 10.00 N ATOM 1809 CA VAL A 124 -1.732 -1.258 8.707 1.00 10.00 C ATOM 1810 C VAL A 124 -1.538 0.110 8.055 1.00 10.00 C ATOM 1811 O VAL A 124 -1.407 0.215 6.835 1.00 10.00 O ATOM 1812 CB VAL A 124 -0.396 -1.945 9.058 1.00 10.00 C ATOM 1813 CG1 VAL A 124 0.553 -1.016 9.826 1.00 10.00 C ATOM 1814 CG2 VAL A 124 -0.640 -3.189 9.926 1.00 10.00 C ATOM 0 H VAL A 124 -2.223 -2.033 6.831 1.00 10.00 H new ATOM 0 HA VAL A 124 -2.266 -1.104 9.645 1.00 10.00 H new ATOM 0 HB VAL A 124 0.064 -2.218 8.108 1.00 10.00 H new ATOM 0 HG11 VAL A 124 1.479 -1.546 10.050 1.00 10.00 H new ATOM 0 HG12 VAL A 124 0.775 -0.139 9.218 1.00 10.00 H new ATOM 0 HG13 VAL A 124 0.081 -0.702 10.757 1.00 10.00 H new ATOM 0 HG21 VAL A 124 0.314 -3.660 10.163 1.00 10.00 H new ATOM 0 HG22 VAL A 124 -1.140 -2.896 10.849 1.00 10.00 H new ATOM 0 HG23 VAL A 124 -1.268 -3.895 9.382 1.00 10.00 H new ATOM 1824 N ASN A 125 -1.536 1.163 8.875 1.00 10.00 N ATOM 1825 CA ASN A 125 -1.358 2.526 8.400 1.00 10.00 C ATOM 1826 C ASN A 125 0.103 2.769 8.035 1.00 10.00 C ATOM 1827 O ASN A 125 1.007 2.510 8.835 1.00 10.00 O ATOM 1828 CB ASN A 125 -1.828 3.551 9.443 1.00 10.00 C ATOM 1829 CG ASN A 125 -3.349 3.667 9.536 1.00 10.00 C ATOM 1830 OD1 ASN A 125 -4.088 3.013 8.810 1.00 10.00 O ATOM 1831 ND2 ASN A 125 -3.842 4.517 10.433 1.00 10.00 N ATOM 0 H ASN A 125 -1.658 1.089 9.885 1.00 10.00 H new ATOM 0 HA ASN A 125 -1.973 2.655 7.509 1.00 10.00 H new ATOM 0 HB2 ASN A 125 -1.432 3.273 10.420 1.00 10.00 H new ATOM 0 HB3 ASN A 125 -1.411 4.527 9.196 1.00 10.00 H new ATOM 0 HD21 ASN A 125 -4.851 4.633 10.525 1.00 10.00 H new ATOM 0 HD22 ASN A 125 -3.211 5.053 11.029 1.00 10.00 H new ATOM 1838 N ILE A 126 0.315 3.315 6.838 1.00 10.00 N ATOM 1839 CA ILE A 126 1.533 3.991 6.443 1.00 10.00 C ATOM 1840 C ILE A 126 1.234 5.487 6.393 1.00 10.00 C ATOM 1841 O ILE A 126 0.309 5.909 5.703 1.00 10.00 O ATOM 1842 CB ILE A 126 2.088 3.415 5.132 1.00 10.00 C ATOM 1843 CG1 ILE A 126 1.054 3.348 3.997 1.00 10.00 C ATOM 1844 CG2 ILE A 126 2.654 2.014 5.418 1.00 10.00 C ATOM 1845 CD1 ILE A 126 1.726 2.998 2.672 1.00 10.00 C ATOM 0 H ILE A 126 -0.386 3.294 6.097 1.00 10.00 H new ATOM 0 HA ILE A 126 2.331 3.828 7.168 1.00 10.00 H new ATOM 0 HB ILE A 126 2.866 4.092 4.780 1.00 10.00 H new ATOM 0 HG12 ILE A 126 0.295 2.602 4.234 1.00 10.00 H new ATOM 0 HG13 ILE A 126 0.542 4.306 3.908 1.00 10.00 H new ATOM 0 HG21 ILE A 126 3.053 1.588 4.498 1.00 10.00 H new ATOM 0 HG22 ILE A 126 3.450 2.087 6.159 1.00 10.00 H new ATOM 0 HG23 ILE A 126 1.860 1.372 5.800 1.00 10.00 H new ATOM 0 HD11 ILE A 126 0.975 2.956 1.883 1.00 10.00 H new ATOM 0 HD12 ILE A 126 2.467 3.759 2.428 1.00 10.00 H new ATOM 0 HD13 ILE A 126 2.217 2.028 2.758 1.00 10.00 H new ATOM 1857 N THR A 127 1.975 6.283 7.167 1.00 10.00 N ATOM 1858 CA THR A 127 1.833 7.727 7.196 1.00 10.00 C ATOM 1859 C THR A 127 2.942 8.348 6.364 1.00 10.00 C ATOM 1860 O THR A 127 4.114 8.143 6.670 1.00 10.00 O ATOM 1861 CB THR A 127 1.824 8.245 8.639 1.00 10.00 C ATOM 1862 OG1 THR A 127 0.844 7.538 9.376 1.00 10.00 O ATOM 1863 CG2 THR A 127 1.482 9.742 8.673 1.00 10.00 C ATOM 0 H THR A 127 2.697 5.932 7.796 1.00 10.00 H new ATOM 0 HA THR A 127 0.876 8.016 6.761 1.00 10.00 H new ATOM 0 HB THR A 127 2.813 8.096 9.072 1.00 10.00 H new ATOM 0 HG1 THR A 127 0.833 7.862 10.301 1.00 10.00 H new ATOM 0 HG21 THR A 127 1.480 10.091 9.705 1.00 10.00 H new ATOM 0 HG22 THR A 127 2.226 10.298 8.103 1.00 10.00 H new ATOM 0 HG23 THR A 127 0.497 9.900 8.235 1.00 10.00 H new ATOM 1871 N LEU A 128 2.576 9.095 5.322 1.00 10.00 N ATOM 1872 CA LEU A 128 3.513 9.842 4.497 1.00 10.00 C ATOM 1873 C LEU A 128 3.459 11.324 4.856 1.00 10.00 C ATOM 1874 O LEU A 128 2.581 11.753 5.606 1.00 10.00 O ATOM 1875 CB LEU A 128 3.295 9.578 2.996 1.00 10.00 C ATOM 1876 CG LEU A 128 1.851 9.361 2.527 1.00 10.00 C ATOM 1877 CD1 LEU A 128 1.082 10.672 2.626 1.00 10.00 C ATOM 1878 CD2 LEU A 128 1.856 8.895 1.067 1.00 10.00 C ATOM 0 H LEU A 128 1.605 9.197 5.027 1.00 10.00 H new ATOM 0 HA LEU A 128 4.523 9.490 4.709 1.00 10.00 H new ATOM 0 HB2 LEU A 128 3.708 10.420 2.441 1.00 10.00 H new ATOM 0 HB3 LEU A 128 3.876 8.698 2.719 1.00 10.00 H new ATOM 0 HG LEU A 128 1.376 8.607 3.155 1.00 10.00 H new ATOM 0 HD11 LEU A 128 0.056 10.518 2.293 1.00 10.00 H new ATOM 0 HD12 LEU A 128 1.080 11.015 3.661 1.00 10.00 H new ATOM 0 HD13 LEU A 128 1.559 11.422 1.996 1.00 10.00 H new ATOM 0 HD21 LEU A 128 0.831 8.740 0.731 1.00 10.00 H new ATOM 0 HD22 LEU A 128 2.331 9.653 0.445 1.00 10.00 H new ATOM 0 HD23 LEU A 128 2.410 7.960 0.985 1.00 10.00 H new ATOM 1890 N LYS A 129 4.427 12.083 4.333 1.00 10.00 N ATOM 1891 CA LYS A 129 4.564 13.519 4.483 1.00 10.00 C ATOM 1892 C LYS A 129 5.100 14.077 3.171 1.00 10.00 C ATOM 1893 O LYS A 129 6.303 14.066 2.926 1.00 10.00 O ATOM 1894 CB LYS A 129 5.509 13.866 5.641 1.00 10.00 C ATOM 1895 CG LYS A 129 4.846 13.665 7.007 1.00 10.00 C ATOM 1896 CD LYS A 129 5.724 14.273 8.108 1.00 10.00 C ATOM 1897 CE LYS A 129 4.994 14.242 9.458 1.00 10.00 C ATOM 1898 NZ LYS A 129 5.782 14.884 10.531 1.00 10.00 N ATOM 0 H LYS A 129 5.172 11.681 3.764 1.00 10.00 H new ATOM 0 HA LYS A 129 3.595 13.960 4.716 1.00 10.00 H new ATOM 0 HB2 LYS A 129 6.402 13.245 5.577 1.00 10.00 H new ATOM 0 HB3 LYS A 129 5.834 14.902 5.545 1.00 10.00 H new ATOM 0 HG2 LYS A 129 3.861 14.132 7.015 1.00 10.00 H new ATOM 0 HG3 LYS A 129 4.696 12.602 7.195 1.00 10.00 H new ATOM 0 HD2 LYS A 129 6.660 13.720 8.182 1.00 10.00 H new ATOM 0 HD3 LYS A 129 5.981 15.301 7.850 1.00 10.00 H new ATOM 0 HE2 LYS A 129 4.033 14.748 9.362 1.00 10.00 H new ATOM 0 HE3 LYS A 129 4.784 13.208 9.732 1.00 10.00 H new ATOM 0 HZ1 LYS A 129 5.252 14.841 11.425 1.00 10.00 H new ATOM 0 HZ2 LYS A 129 6.688 14.386 10.642 1.00 10.00 H new ATOM 0 HZ3 LYS A 129 5.961 15.878 10.283 1.00 10.00 H new ATOM 1912 N ALA A 130 4.210 14.570 2.314 1.00 10.00 N ATOM 1913 CA ALA A 130 4.618 15.419 1.208 1.00 10.00 C ATOM 1914 C ALA A 130 4.754 16.851 1.695 1.00 10.00 C ATOM 1915 O ALA A 130 3.841 17.381 2.325 1.00 10.00 O ATOM 1916 CB ALA A 130 3.624 15.330 0.048 1.00 10.00 C ATOM 0 H ALA A 130 3.207 14.395 2.367 1.00 10.00 H new ATOM 0 HA ALA A 130 5.583 15.074 0.836 1.00 10.00 H new ATOM 0 HB1 ALA A 130 3.955 15.976 -0.765 1.00 10.00 H new ATOM 0 HB2 ALA A 130 3.569 14.300 -0.306 1.00 10.00 H new ATOM 0 HB3 ALA A 130 2.639 15.650 0.388 1.00 10.00 H new ATOM 1922 N THR A 131 5.872 17.488 1.344 1.00 10.00 N ATOM 1923 CA THR A 131 6.092 18.909 1.585 1.00 10.00 C ATOM 1924 C THR A 131 5.049 19.767 0.860 1.00 10.00 C ATOM 1925 O THR A 131 4.909 20.944 1.181 1.00 10.00 O ATOM 1926 CB THR A 131 7.535 19.294 1.213 1.00 10.00 C ATOM 1927 OG1 THR A 131 7.753 20.675 1.426 1.00 10.00 O ATOM 1928 CG2 THR A 131 7.896 18.933 -0.232 1.00 10.00 C ATOM 0 H THR A 131 6.655 17.026 0.881 1.00 10.00 H new ATOM 0 HA THR A 131 5.964 19.108 2.649 1.00 10.00 H new ATOM 0 HB THR A 131 8.185 18.712 1.866 1.00 10.00 H new ATOM 0 HG1 THR A 131 6.917 21.165 1.279 1.00 10.00 H new ATOM 0 HG21 THR A 131 8.925 19.229 -0.435 1.00 10.00 H new ATOM 0 HG22 THR A 131 7.793 17.857 -0.375 1.00 10.00 H new ATOM 0 HG23 THR A 131 7.227 19.456 -0.916 1.00 10.00 H new ATOM 1936 N ASP A 132 4.324 19.187 -0.102 1.00 10.00 N ATOM 1937 CA ASP A 132 3.179 19.813 -0.744 1.00 10.00 C ATOM 1938 C ASP A 132 2.005 19.992 0.222 1.00 10.00 C ATOM 1939 O ASP A 132 1.121 20.804 -0.038 1.00 10.00 O ATOM 1940 CB ASP A 132 2.762 18.962 -1.949 1.00 10.00 C ATOM 1941 CG ASP A 132 3.834 18.999 -3.019 1.00 10.00 C ATOM 1942 OD1 ASP A 132 4.134 20.104 -3.522 1.00 10.00 O ATOM 1943 OD2 ASP A 132 4.417 17.935 -3.337 1.00 10.00 O ATOM 0 H ASP A 132 4.526 18.253 -0.458 1.00 10.00 H new ATOM 0 HA ASP A 132 3.468 20.811 -1.073 1.00 10.00 H new ATOM 0 HB2 ASP A 132 2.590 17.933 -1.633 1.00 10.00 H new ATOM 0 HB3 ASP A 132 1.821 19.332 -2.355 1.00 10.00 H new ATOM 1948 N GLY A 133 1.970 19.221 1.315 1.00 10.00 N ATOM 1949 CA GLY A 133 0.942 19.308 2.343 1.00 10.00 C ATOM 1950 C GLY A 133 0.363 17.940 2.706 1.00 10.00 C ATOM 1951 O GLY A 133 -0.315 17.816 3.724 1.00 10.00 O ATOM 0 H GLY A 133 2.672 18.507 1.508 1.00 10.00 H new ATOM 0 HA2 GLY A 133 1.363 19.770 3.236 1.00 10.00 H new ATOM 0 HA3 GLY A 133 0.139 19.959 1.996 1.00 10.00 H new ATOM 1955 N ARG A 134 0.627 16.895 1.912 1.00 10.00 N ATOM 1956 CA ARG A 134 0.022 15.584 2.133 1.00 10.00 C ATOM 1957 C ARG A 134 0.795 14.847 3.228 1.00 10.00 C ATOM 1958 O ARG A 134 1.525 13.892 2.972 1.00 10.00 O ATOM 1959 CB ARG A 134 -0.084 14.767 0.832 1.00 10.00 C ATOM 1960 CG ARG A 134 -0.905 15.517 -0.227 1.00 10.00 C ATOM 1961 CD ARG A 134 -1.044 14.741 -1.550 1.00 10.00 C ATOM 1962 NE ARG A 134 -1.960 13.581 -1.485 1.00 10.00 N ATOM 1963 CZ ARG A 134 -3.303 13.651 -1.515 1.00 10.00 C ATOM 1964 NH1 ARG A 134 -3.903 14.839 -1.381 1.00 10.00 N ATOM 1965 NH2 ARG A 134 -4.055 12.556 -1.691 1.00 10.00 N ATOM 0 H ARG A 134 1.257 16.936 1.111 1.00 10.00 H new ATOM 0 HA ARG A 134 -1.005 15.723 2.471 1.00 10.00 H new ATOM 0 HB2 ARG A 134 0.914 14.563 0.445 1.00 10.00 H new ATOM 0 HB3 ARG A 134 -0.548 13.803 1.041 1.00 10.00 H new ATOM 0 HG2 ARG A 134 -1.898 15.723 0.172 1.00 10.00 H new ATOM 0 HG3 ARG A 134 -0.435 16.480 -0.426 1.00 10.00 H new ATOM 0 HD2 ARG A 134 -1.397 15.424 -2.322 1.00 10.00 H new ATOM 0 HD3 ARG A 134 -0.058 14.393 -1.858 1.00 10.00 H new ATOM 0 HE ARG A 134 -1.540 12.655 -1.412 1.00 10.00 H new ATOM 0 HH11 ARG A 134 -3.343 15.682 -1.257 1.00 10.00 H new ATOM 0 HH12 ARG A 134 -4.921 14.902 -1.403 1.00 10.00 H new ATOM 0 HH21 ARG A 134 -3.611 11.645 -1.806 1.00 10.00 H new ATOM 0 HH22 ARG A 134 -5.072 12.633 -1.710 1.00 10.00 H new ATOM 1979 N THR A 135 0.595 15.313 4.458 1.00 10.00 N ATOM 1980 CA THR A 135 0.784 14.565 5.685 1.00 10.00 C ATOM 1981 C THR A 135 -0.501 13.776 5.894 1.00 10.00 C ATOM 1982 O THR A 135 -1.537 14.372 6.180 1.00 10.00 O ATOM 1983 CB THR A 135 1.066 15.530 6.843 1.00 10.00 C ATOM 1984 OG1 THR A 135 2.293 16.186 6.593 1.00 10.00 O ATOM 1985 CG2 THR A 135 1.161 14.801 8.188 1.00 10.00 C ATOM 0 H THR A 135 0.282 16.269 4.628 1.00 10.00 H new ATOM 0 HA THR A 135 1.637 13.888 5.636 1.00 10.00 H new ATOM 0 HB THR A 135 0.240 16.239 6.903 1.00 10.00 H new ATOM 0 HG1 THR A 135 2.486 16.808 7.325 1.00 10.00 H new ATOM 0 HG21 THR A 135 1.362 15.523 8.980 1.00 10.00 H new ATOM 0 HG22 THR A 135 0.220 14.290 8.392 1.00 10.00 H new ATOM 0 HG23 THR A 135 1.969 14.071 8.150 1.00 10.00 H new ATOM 1993 N LEU A 136 -0.460 12.460 5.679 1.00 10.00 N ATOM 1994 CA LEU A 136 -1.665 11.644 5.645 1.00 10.00 C ATOM 1995 C LEU A 136 -1.300 10.203 5.976 1.00 10.00 C ATOM 1996 O LEU A 136 -0.186 9.774 5.675 1.00 10.00 O ATOM 1997 CB LEU A 136 -2.301 11.762 4.253 1.00 10.00 C ATOM 1998 CG LEU A 136 -3.650 11.045 4.080 1.00 10.00 C ATOM 1999 CD1 LEU A 136 -4.738 11.636 4.986 1.00 10.00 C ATOM 2000 CD2 LEU A 136 -4.092 11.166 2.618 1.00 10.00 C ATOM 0 H LEU A 136 0.403 11.938 5.525 1.00 10.00 H new ATOM 0 HA LEU A 136 -2.389 11.986 6.384 1.00 10.00 H new ATOM 0 HB2 LEU A 136 -2.439 12.819 4.024 1.00 10.00 H new ATOM 0 HB3 LEU A 136 -1.601 11.365 3.518 1.00 10.00 H new ATOM 0 HG LEU A 136 -3.515 10.001 4.362 1.00 10.00 H new ATOM 0 HD11 LEU A 136 -5.673 11.098 4.830 1.00 10.00 H new ATOM 0 HD12 LEU A 136 -4.435 11.541 6.029 1.00 10.00 H new ATOM 0 HD13 LEU A 136 -4.880 12.689 4.744 1.00 10.00 H new ATOM 0 HD21 LEU A 136 -5.048 10.661 2.484 1.00 10.00 H new ATOM 0 HD22 LEU A 136 -4.198 12.219 2.356 1.00 10.00 H new ATOM 0 HD23 LEU A 136 -3.344 10.705 1.973 1.00 10.00 H new ATOM 2012 N ASN A 137 -2.239 9.484 6.592 1.00 10.00 N ATOM 2013 CA ASN A 137 -2.160 8.093 6.989 1.00 10.00 C ATOM 2014 C ASN A 137 -3.030 7.311 6.024 1.00 10.00 C ATOM 2015 O ASN A 137 -4.156 7.710 5.738 1.00 10.00 O ATOM 2016 CB ASN A 137 -2.632 7.907 8.434 1.00 10.00 C ATOM 2017 CG ASN A 137 -4.114 8.230 8.612 1.00 10.00 C ATOM 2018 OD1 ASN A 137 -4.531 9.363 8.391 1.00 10.00 O ATOM 2019 ND2 ASN A 137 -4.917 7.247 9.007 1.00 10.00 N ATOM 0 H ASN A 137 -3.138 9.897 6.841 1.00 10.00 H new ATOM 0 HA ASN A 137 -1.130 7.738 6.953 1.00 10.00 H new ATOM 0 HB2 ASN A 137 -2.448 6.878 8.743 1.00 10.00 H new ATOM 0 HB3 ASN A 137 -2.043 8.547 9.090 1.00 10.00 H new ATOM 0 HD21 ASN A 137 -5.913 7.423 9.135 1.00 10.00 H new ATOM 0 HD22 ASN A 137 -4.537 6.317 9.182 1.00 10.00 H new ATOM 2026 N VAL A 138 -2.477 6.234 5.485 1.00 10.00 N ATOM 2027 CA VAL A 138 -3.067 5.473 4.409 1.00 10.00 C ATOM 2028 C VAL A 138 -3.009 4.009 4.837 1.00 10.00 C ATOM 2029 O VAL A 138 -1.938 3.506 5.165 1.00 10.00 O ATOM 2030 CB VAL A 138 -2.266 5.799 3.137 1.00 10.00 C ATOM 2031 CG1 VAL A 138 -2.371 4.707 2.063 1.00 10.00 C ATOM 2032 CG2 VAL A 138 -2.735 7.134 2.542 1.00 10.00 C ATOM 0 H VAL A 138 -1.581 5.861 5.797 1.00 10.00 H new ATOM 0 HA VAL A 138 -4.109 5.710 4.195 1.00 10.00 H new ATOM 0 HB VAL A 138 -1.221 5.862 3.441 1.00 10.00 H new ATOM 0 HG11 VAL A 138 -1.784 4.997 1.191 1.00 10.00 H new ATOM 0 HG12 VAL A 138 -1.989 3.767 2.461 1.00 10.00 H new ATOM 0 HG13 VAL A 138 -3.414 4.581 1.773 1.00 10.00 H new ATOM 0 HG21 VAL A 138 -2.160 7.353 1.642 1.00 10.00 H new ATOM 0 HG22 VAL A 138 -3.793 7.068 2.289 1.00 10.00 H new ATOM 0 HG23 VAL A 138 -2.585 7.930 3.271 1.00 10.00 H new ATOM 2042 N ALA A 139 -4.162 3.340 4.882 1.00 10.00 N ATOM 2043 CA ALA A 139 -4.273 1.973 5.364 1.00 10.00 C ATOM 2044 C ALA A 139 -3.902 1.025 4.232 1.00 10.00 C ATOM 2045 O ALA A 139 -4.649 0.896 3.264 1.00 10.00 O ATOM 2046 CB ALA A 139 -5.699 1.723 5.862 1.00 10.00 C ATOM 0 H ALA A 139 -5.050 3.741 4.581 1.00 10.00 H new ATOM 0 HA ALA A 139 -3.593 1.801 6.198 1.00 10.00 H new ATOM 0 HB1 ALA A 139 -5.784 0.698 6.224 1.00 10.00 H new ATOM 0 HB2 ALA A 139 -5.928 2.414 6.673 1.00 10.00 H new ATOM 0 HB3 ALA A 139 -6.403 1.878 5.044 1.00 10.00 H new ATOM 2052 N ALA A 140 -2.736 0.389 4.342 1.00 10.00 N ATOM 2053 CA ALA A 140 -2.225 -0.530 3.343 1.00 10.00 C ATOM 2054 C ALA A 140 -2.508 -1.964 3.773 1.00 10.00 C ATOM 2055 O ALA A 140 -2.409 -2.280 4.959 1.00 10.00 O ATOM 2056 CB ALA A 140 -0.723 -0.319 3.197 1.00 10.00 C ATOM 0 H ALA A 140 -2.115 0.504 5.143 1.00 10.00 H new ATOM 0 HA ALA A 140 -2.714 -0.345 2.387 1.00 10.00 H new ATOM 0 HB1 ALA A 140 -0.330 -1.006 2.448 1.00 10.00 H new ATOM 0 HB2 ALA A 140 -0.528 0.707 2.886 1.00 10.00 H new ATOM 0 HB3 ALA A 140 -0.235 -0.507 4.153 1.00 10.00 H new ATOM 2062 N THR A 141 -2.826 -2.834 2.816 1.00 10.00 N ATOM 2063 CA THR A 141 -3.193 -4.216 3.088 1.00 10.00 C ATOM 2064 C THR A 141 -1.910 -5.029 3.263 1.00 10.00 C ATOM 2065 O THR A 141 -1.028 -4.987 2.406 1.00 10.00 O ATOM 2066 CB THR A 141 -4.035 -4.748 1.920 1.00 10.00 C ATOM 2067 OG1 THR A 141 -4.965 -3.760 1.521 1.00 10.00 O ATOM 2068 CG2 THR A 141 -4.797 -6.011 2.330 1.00 10.00 C ATOM 0 H THR A 141 -2.835 -2.595 1.825 1.00 10.00 H new ATOM 0 HA THR A 141 -3.786 -4.294 3.999 1.00 10.00 H new ATOM 0 HB THR A 141 -3.365 -4.991 1.095 1.00 10.00 H new ATOM 0 HG1 THR A 141 -5.502 -4.099 0.774 1.00 10.00 H new ATOM 0 HG21 THR A 141 -5.387 -6.370 1.487 1.00 10.00 H new ATOM 0 HG22 THR A 141 -4.088 -6.782 2.631 1.00 10.00 H new ATOM 0 HG23 THR A 141 -5.460 -5.781 3.164 1.00 10.00 H new ATOM 2076 N VAL A 142 -1.770 -5.768 4.362 1.00 10.00 N ATOM 2077 CA VAL A 142 -0.529 -6.457 4.650 1.00 10.00 C ATOM 2078 C VAL A 142 -0.647 -7.828 4.009 1.00 10.00 C ATOM 2079 O VAL A 142 -1.185 -8.751 4.609 1.00 10.00 O ATOM 2080 CB VAL A 142 -0.318 -6.525 6.165 1.00 10.00 C ATOM 2081 CG1 VAL A 142 0.945 -7.308 6.530 1.00 10.00 C ATOM 2082 CG2 VAL A 142 -0.213 -5.107 6.742 1.00 10.00 C ATOM 0 H VAL A 142 -2.501 -5.900 5.061 1.00 10.00 H new ATOM 0 HA VAL A 142 0.342 -5.941 4.247 1.00 10.00 H new ATOM 0 HB VAL A 142 -1.177 -7.044 6.591 1.00 10.00 H new ATOM 0 HG11 VAL A 142 1.058 -7.332 7.614 1.00 10.00 H new ATOM 0 HG12 VAL A 142 0.864 -8.327 6.151 1.00 10.00 H new ATOM 0 HG13 VAL A 142 1.815 -6.824 6.086 1.00 10.00 H new ATOM 0 HG21 VAL A 142 -0.063 -5.163 7.820 1.00 10.00 H new ATOM 0 HG22 VAL A 142 0.630 -4.590 6.285 1.00 10.00 H new ATOM 0 HG23 VAL A 142 -1.132 -4.560 6.532 1.00 10.00 H new ATOM 2092 N LYS A 143 -0.190 -7.960 2.771 1.00 10.00 N ATOM 2093 CA LYS A 143 0.030 -9.250 2.155 1.00 10.00 C ATOM 2094 C LYS A 143 1.017 -9.051 1.012 1.00 10.00 C ATOM 2095 O LYS A 143 0.922 -8.063 0.285 1.00 10.00 O ATOM 2096 CB LYS A 143 -1.280 -9.890 1.674 1.00 10.00 C ATOM 2097 CG LYS A 143 -2.154 -8.961 0.817 1.00 10.00 C ATOM 2098 CD LYS A 143 -2.732 -9.749 -0.365 1.00 10.00 C ATOM 2099 CE LYS A 143 -3.622 -8.863 -1.249 1.00 10.00 C ATOM 2100 NZ LYS A 143 -3.937 -9.524 -2.532 1.00 10.00 N ATOM 0 H LYS A 143 0.038 -7.169 2.168 1.00 10.00 H new ATOM 0 HA LYS A 143 0.440 -9.945 2.887 1.00 10.00 H new ATOM 0 HB2 LYS A 143 -1.045 -10.784 1.097 1.00 10.00 H new ATOM 0 HB3 LYS A 143 -1.854 -10.213 2.542 1.00 10.00 H new ATOM 0 HG2 LYS A 143 -2.961 -8.545 1.420 1.00 10.00 H new ATOM 0 HG3 LYS A 143 -1.562 -8.121 0.453 1.00 10.00 H new ATOM 0 HD2 LYS A 143 -1.918 -10.161 -0.962 1.00 10.00 H new ATOM 0 HD3 LYS A 143 -3.312 -10.593 0.008 1.00 10.00 H new ATOM 0 HE2 LYS A 143 -4.547 -8.632 -0.721 1.00 10.00 H new ATOM 0 HE3 LYS A 143 -3.119 -7.915 -1.440 1.00 10.00 H new ATOM 0 HZ1 LYS A 143 -4.539 -8.900 -3.106 1.00 10.00 H new ATOM 0 HZ2 LYS A 143 -3.055 -9.722 -3.046 1.00 10.00 H new ATOM 0 HZ3 LYS A 143 -4.439 -10.416 -2.349 1.00 10.00 H new ATOM 2114 N LYS A 144 1.948 -9.989 0.845 1.00 10.00 N ATOM 2115 CA LYS A 144 2.783 -10.001 -0.343 1.00 10.00 C ATOM 2116 C LYS A 144 1.966 -10.488 -1.539 1.00 10.00 C ATOM 2117 O LYS A 144 0.964 -11.183 -1.368 1.00 10.00 O ATOM 2118 CB LYS A 144 4.076 -10.782 -0.085 1.00 10.00 C ATOM 2119 CG LYS A 144 3.912 -12.269 0.249 1.00 10.00 C ATOM 2120 CD LYS A 144 5.266 -12.755 0.783 1.00 10.00 C ATOM 2121 CE LYS A 144 5.256 -14.241 1.152 1.00 10.00 C ATOM 2122 NZ LYS A 144 6.580 -14.670 1.647 1.00 10.00 N ATOM 0 H LYS A 144 2.138 -10.739 1.510 1.00 10.00 H new ATOM 0 HA LYS A 144 3.110 -8.992 -0.594 1.00 10.00 H new ATOM 0 HB2 LYS A 144 4.710 -10.697 -0.968 1.00 10.00 H new ATOM 0 HB3 LYS A 144 4.608 -10.303 0.737 1.00 10.00 H new ATOM 0 HG2 LYS A 144 3.128 -12.414 0.993 1.00 10.00 H new ATOM 0 HG3 LYS A 144 3.620 -12.834 -0.636 1.00 10.00 H new ATOM 0 HD2 LYS A 144 6.034 -12.577 0.030 1.00 10.00 H new ATOM 0 HD3 LYS A 144 5.538 -12.169 1.661 1.00 10.00 H new ATOM 0 HE2 LYS A 144 4.501 -14.425 1.916 1.00 10.00 H new ATOM 0 HE3 LYS A 144 4.979 -14.834 0.281 1.00 10.00 H new ATOM 0 HZ1 LYS A 144 6.461 -15.444 2.331 1.00 10.00 H new ATOM 0 HZ2 LYS A 144 7.159 -15.000 0.848 1.00 10.00 H new ATOM 0 HZ3 LYS A 144 7.054 -13.869 2.110 1.00 10.00 H new