USER MOD reduce.3.24.130724 H: found=0, std=0, add=855, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 858 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 SER OG : rot -108:sc= 1.29 USER MOD Set 1.2: A 122 GLN : amide:sc= 0.99 K(o=2.3,f=0.26!) USER MOD Set 2.1: A 88 HIS : no HE2:sc= -12! C(o=-12!,f=-22!) USER MOD Set 2.2: A 105 SER OG : rot -122:sc= 0.958! USER MOD Set 2.3: A 109 THR OG1 : rot -98:sc= -0.793 USER MOD Set 3.1: A 67 THR OG1 : rot 117:sc= -0.219 USER MOD Set 3.2: A 71 ASN : amide:sc= -0.32 X(o=-0.3,f=-0.39) USER MOD Set 3.3: A 74 CYS SG : rot 180:sc= -0.582 USER MOD Set 3.4: A 90 GLN : amide:sc= 0.819 X(o=-0.3,f=-0.44) USER MOD Set 4.1: A 38 CYS SG : rot -86:sc= -3.24 USER MOD Set 4.2: A 42 GLN : amide:sc= -2.41! C(o=-5.7!,f=-12!) USER MOD Single : A 31 ASN : amide:sc=-0.00191 X(o=-0.0019,f=0) USER MOD Single : A 34 CYS SG : rot 26:sc= -5.95! USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot -95:sc= 1.21 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 147:sc= -0.317 (180deg=-1.07!) USER MOD Single : A 64 LYS NZ :NH3+ -140:sc= -0.619 (180deg=-1.61!) USER MOD Single : A 76 TYR OH : rot 180:sc= -0.0972 USER MOD Single : A 77 HIS :FLIP no HE2:sc= -1.1 F(o=-3!,f=-1.1) USER MOD Single : A 80 ASN :FLIP amide:sc= 0.861 F(o=-1.2,f=0.86) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 72:sc= 0.194 USER MOD Single : A 86 ASN : amide:sc= -10.6! C(o=-11!,f=-22!) USER MOD Single : A 87 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000845) USER MOD Single : A 102 ASN : amide:sc= -3.87 K(o=-3.9,f=-15!) USER MOD Single : A 106 THR OG1 : rot 155:sc= 0.814 USER MOD Single : A 107 ASN : amide:sc= -0.0763 X(o=-0.076,f=-0.17) USER MOD Single : A 112 ASN : amide:sc= -0.0736 K(o=-0.074,f=-1.1) USER MOD Single : A 114 GLN : amide:sc= -0.117 X(o=-0.12,f=-0.075) USER MOD Single : A 115 LYS NZ :NH3+ 153:sc= 0 (180deg=-0.141) USER MOD Single : A 118 LYS NZ :NH3+ 178:sc= 0.956 (180deg=0.954) USER MOD Single : A 119 ASN : amide:sc= -1.29 X(o=-1.3,f=-1.6!) USER MOD Single : A 121 ASN : amide:sc= -7.23! C(o=-7.2!,f=-8.3!) USER MOD Single : A 125 SER OG : rot 180:sc= -0.51 USER MOD Single : A 126 GLN :FLIP amide:sc= -0.638 F(o=-1.5,f=-0.64) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot -21:sc= 1.13 USER MOD Single : A 142 SER OG : rot 180:sc= -1.37! USER MOD Single : A 148 ASN : amide:sc= -0.497! C(o=-0.5!,f=-10!) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 457 N GLU A 30 -1.252 9.199 -19.895 1.00 0.00 N ATOM 458 CA GLU A 30 -0.237 10.243 -19.796 1.00 0.00 C ATOM 459 C GLU A 30 0.181 10.475 -18.346 1.00 0.00 C ATOM 460 O GLU A 30 1.289 10.939 -18.078 1.00 0.00 O ATOM 461 CB GLU A 30 -0.757 11.547 -20.400 1.00 0.00 C ATOM 462 CG GLU A 30 -1.248 11.404 -21.831 1.00 0.00 C ATOM 463 CD GLU A 30 -0.972 12.637 -22.669 1.00 0.00 C ATOM 464 OE1 GLU A 30 -0.032 13.386 -22.331 1.00 0.00 O ATOM 465 OE2 GLU A 30 -1.695 12.853 -23.664 1.00 0.00 O ATOM 0 HA GLU A 30 0.638 9.910 -20.355 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -1.572 11.924 -19.782 1.00 0.00 H new ATOM 0 HB3 GLU A 30 0.037 12.293 -20.371 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -0.767 10.541 -22.292 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -2.320 11.206 -21.825 1.00 0.00 H new ATOM 472 N ASN A 31 -0.698 10.122 -17.412 1.00 0.00 N ATOM 473 CA ASN A 31 -0.404 10.265 -15.993 1.00 0.00 C ATOM 474 C ASN A 31 -0.206 8.888 -15.396 1.00 0.00 C ATOM 475 O ASN A 31 0.300 8.726 -14.285 1.00 0.00 O ATOM 476 CB ASN A 31 -1.545 10.994 -15.283 1.00 0.00 C ATOM 477 CG ASN A 31 -1.970 12.253 -16.013 1.00 0.00 C ATOM 478 OD1 ASN A 31 -3.148 12.443 -16.313 1.00 0.00 O ATOM 479 ND2 ASN A 31 -1.010 13.122 -16.305 1.00 0.00 N ATOM 0 H ASN A 31 -1.620 9.735 -17.615 1.00 0.00 H new ATOM 0 HA ASN A 31 0.504 10.855 -15.865 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -2.400 10.324 -15.192 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -1.233 11.252 -14.271 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -1.237 13.986 -16.797 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -0.045 12.925 -16.038 1.00 0.00 H new ATOM 486 N ILE A 32 -0.626 7.901 -16.169 1.00 0.00 N ATOM 487 CA ILE A 32 -0.541 6.523 -15.802 1.00 0.00 C ATOM 488 C ILE A 32 0.906 6.026 -15.907 1.00 0.00 C ATOM 489 O ILE A 32 1.417 5.766 -16.994 1.00 0.00 O ATOM 490 CB ILE A 32 -1.517 5.736 -16.710 1.00 0.00 C ATOM 491 CG1 ILE A 32 -2.662 5.155 -15.877 1.00 0.00 C ATOM 492 CG2 ILE A 32 -0.822 4.680 -17.543 1.00 0.00 C ATOM 493 CD1 ILE A 32 -2.538 3.677 -15.569 1.00 0.00 C ATOM 0 H ILE A 32 -1.043 8.053 -17.087 1.00 0.00 H new ATOM 0 HA ILE A 32 -0.830 6.372 -14.762 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.939 6.439 -17.428 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.723 5.704 -14.937 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -3.600 5.324 -16.406 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.556 4.161 -18.159 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.079 5.154 -18.185 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -0.329 3.964 -16.885 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -3.394 3.356 -14.975 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -2.510 3.112 -16.501 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -1.620 3.498 -15.009 1.00 0.00 H new ATOM 505 N VAL A 33 1.559 5.934 -14.753 1.00 0.00 N ATOM 506 CA VAL A 33 2.952 5.499 -14.653 1.00 0.00 C ATOM 507 C VAL A 33 3.301 4.429 -15.687 1.00 0.00 C ATOM 508 O VAL A 33 4.172 4.633 -16.532 1.00 0.00 O ATOM 509 CB VAL A 33 3.236 4.994 -13.209 1.00 0.00 C ATOM 510 CG1 VAL A 33 3.564 3.518 -13.134 1.00 0.00 C ATOM 511 CG2 VAL A 33 4.344 5.801 -12.555 1.00 0.00 C ATOM 0 H VAL A 33 1.135 6.160 -13.853 1.00 0.00 H new ATOM 0 HA VAL A 33 3.590 6.356 -14.869 1.00 0.00 H new ATOM 0 HB VAL A 33 2.304 5.139 -12.662 1.00 0.00 H new ATOM 0 HG11 VAL A 33 3.750 3.239 -12.097 1.00 0.00 H new ATOM 0 HG12 VAL A 33 2.726 2.939 -13.521 1.00 0.00 H new ATOM 0 HG13 VAL A 33 4.453 3.312 -13.730 1.00 0.00 H new ATOM 0 HG21 VAL A 33 4.521 5.426 -11.547 1.00 0.00 H new ATOM 0 HG22 VAL A 33 5.257 5.708 -13.142 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.050 6.849 -12.506 1.00 0.00 H new ATOM 521 N CYS A 34 2.626 3.292 -15.603 1.00 0.00 N ATOM 522 CA CYS A 34 2.879 2.179 -16.525 1.00 0.00 C ATOM 523 C CYS A 34 1.697 1.214 -16.582 1.00 0.00 C ATOM 524 O CYS A 34 0.814 1.244 -15.730 1.00 0.00 O ATOM 525 CB CYS A 34 4.134 1.414 -16.098 1.00 0.00 C ATOM 526 SG CYS A 34 5.690 2.230 -16.522 1.00 0.00 S ATOM 0 H CYS A 34 1.900 3.110 -14.910 1.00 0.00 H new ATOM 0 HA CYS A 34 3.023 2.605 -17.518 1.00 0.00 H new ATOM 0 HB2 CYS A 34 4.101 1.260 -15.019 1.00 0.00 H new ATOM 0 HB3 CYS A 34 4.118 0.427 -16.561 1.00 0.00 H new ATOM 0 HG CYS A 34 5.497 3.513 -16.611 1.00 0.00 H new ATOM 532 N ARG A 35 1.693 0.349 -17.592 1.00 0.00 N ATOM 533 CA ARG A 35 0.626 -0.634 -17.750 1.00 0.00 C ATOM 534 C ARG A 35 1.202 -2.038 -17.920 1.00 0.00 C ATOM 535 O ARG A 35 1.873 -2.327 -18.907 1.00 0.00 O ATOM 536 CB ARG A 35 -0.252 -0.282 -18.952 1.00 0.00 C ATOM 537 CG ARG A 35 -1.694 -0.740 -18.803 1.00 0.00 C ATOM 538 CD ARG A 35 -2.111 -1.668 -19.933 1.00 0.00 C ATOM 539 NE ARG A 35 -3.459 -1.373 -20.413 1.00 0.00 N ATOM 540 CZ ARG A 35 -3.914 -1.721 -21.615 1.00 0.00 C ATOM 541 NH1 ARG A 35 -3.133 -2.374 -22.466 1.00 0.00 N ATOM 542 NH2 ARG A 35 -5.156 -1.415 -21.967 1.00 0.00 N ATOM 0 H ARG A 35 2.415 0.309 -18.312 1.00 0.00 H new ATOM 0 HA ARG A 35 0.015 -0.616 -16.848 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -0.235 0.798 -19.101 1.00 0.00 H new ATOM 0 HB3 ARG A 35 0.174 -0.734 -19.848 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -1.816 -1.252 -17.848 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -2.351 0.129 -18.785 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -1.404 -1.576 -20.758 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -2.067 -2.701 -19.589 1.00 0.00 H new ATOM 0 HE ARG A 35 -4.090 -0.870 -19.789 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -2.177 -2.613 -22.201 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -3.488 -2.637 -23.385 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -5.761 -0.914 -21.317 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -5.505 -1.681 -22.888 1.00 0.00 H new ATOM 556 N VAL A 36 0.926 -2.906 -16.952 1.00 0.00 N ATOM 557 CA VAL A 36 1.411 -4.283 -16.992 1.00 0.00 C ATOM 558 C VAL A 36 0.421 -5.184 -17.715 1.00 0.00 C ATOM 559 O VAL A 36 -0.785 -5.112 -17.479 1.00 0.00 O ATOM 560 CB VAL A 36 1.648 -4.834 -15.574 1.00 0.00 C ATOM 561 CG1 VAL A 36 0.351 -4.833 -14.775 1.00 0.00 C ATOM 562 CG2 VAL A 36 2.250 -6.232 -15.638 1.00 0.00 C ATOM 0 H VAL A 36 0.368 -2.681 -16.128 1.00 0.00 H new ATOM 0 HA VAL A 36 2.358 -4.275 -17.532 1.00 0.00 H new ATOM 0 HB VAL A 36 2.358 -4.183 -15.064 1.00 0.00 H new ATOM 0 HG11 VAL A 36 0.539 -5.226 -13.776 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -0.029 -3.814 -14.699 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -0.387 -5.458 -15.278 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.411 -6.606 -14.627 1.00 0.00 H new ATOM 0 HG22 VAL A 36 1.568 -6.898 -16.167 1.00 0.00 H new ATOM 0 HG23 VAL A 36 3.203 -6.194 -16.166 1.00 0.00 H new ATOM 572 N ILE A 37 0.932 -6.024 -18.605 1.00 0.00 N ATOM 573 CA ILE A 37 0.080 -6.919 -19.362 1.00 0.00 C ATOM 574 C ILE A 37 0.608 -8.350 -19.375 1.00 0.00 C ATOM 575 O ILE A 37 1.582 -8.655 -20.064 1.00 0.00 O ATOM 576 CB ILE A 37 -0.026 -6.437 -20.818 1.00 0.00 C ATOM 577 CG1 ILE A 37 -0.336 -4.940 -20.858 1.00 0.00 C ATOM 578 CG2 ILE A 37 -1.082 -7.233 -21.574 1.00 0.00 C ATOM 579 CD1 ILE A 37 -0.462 -4.385 -22.259 1.00 0.00 C ATOM 0 H ILE A 37 1.927 -6.101 -18.817 1.00 0.00 H new ATOM 0 HA ILE A 37 -0.895 -6.911 -18.874 1.00 0.00 H new ATOM 0 HB ILE A 37 0.932 -6.602 -21.310 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.265 -4.755 -20.318 1.00 0.00 H new ATOM 0 HG13 ILE A 37 0.451 -4.400 -20.332 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.140 -6.875 -22.602 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.812 -8.289 -21.572 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.050 -7.105 -21.090 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.682 -3.319 -22.209 1.00 0.00 H new ATOM 0 HD12 ILE A 37 0.474 -4.538 -22.796 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -1.269 -4.898 -22.782 1.00 0.00 H new ATOM 591 N CYS A 38 -0.067 -9.232 -18.647 1.00 0.00 N ATOM 592 CA CYS A 38 0.310 -10.640 -18.621 1.00 0.00 C ATOM 593 C CYS A 38 -0.425 -11.367 -19.747 1.00 0.00 C ATOM 594 O CYS A 38 -1.637 -11.566 -19.676 1.00 0.00 O ATOM 595 CB CYS A 38 -0.033 -11.264 -17.267 1.00 0.00 C ATOM 596 SG CYS A 38 1.411 -11.698 -16.270 1.00 0.00 S ATOM 0 H CYS A 38 -0.875 -8.999 -18.069 1.00 0.00 H new ATOM 0 HA CYS A 38 1.386 -10.732 -18.767 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -0.654 -10.567 -16.704 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -0.630 -12.161 -17.433 1.00 0.00 H new ATOM 0 HG CYS A 38 1.823 -12.887 -16.597 1.00 0.00 H new ATOM 602 N THR A 39 0.303 -11.723 -20.803 1.00 0.00 N ATOM 603 CA THR A 39 -0.308 -12.382 -21.957 1.00 0.00 C ATOM 604 C THR A 39 -0.119 -13.895 -21.943 1.00 0.00 C ATOM 605 O THR A 39 -0.877 -14.626 -22.581 1.00 0.00 O ATOM 606 CB THR A 39 0.257 -11.828 -23.278 1.00 0.00 C ATOM 607 OG1 THR A 39 -0.384 -12.463 -24.391 1.00 0.00 O ATOM 608 CG2 THR A 39 1.760 -12.047 -23.360 1.00 0.00 C ATOM 0 H THR A 39 1.308 -11.568 -20.885 1.00 0.00 H new ATOM 0 HA THR A 39 -1.375 -12.168 -21.887 1.00 0.00 H new ATOM 0 HB THR A 39 0.060 -10.756 -23.309 1.00 0.00 H new ATOM 0 HG1 THR A 39 -0.020 -12.104 -25.227 1.00 0.00 H new ATOM 0 HG21 THR A 39 2.135 -11.647 -24.302 1.00 0.00 H new ATOM 0 HG22 THR A 39 2.248 -11.537 -22.529 1.00 0.00 H new ATOM 0 HG23 THR A 39 1.976 -13.114 -23.307 1.00 0.00 H new ATOM 616 N THR A 40 0.893 -14.366 -21.227 1.00 0.00 N ATOM 617 CA THR A 40 1.164 -15.797 -21.157 1.00 0.00 C ATOM 618 C THR A 40 -0.040 -16.571 -20.629 1.00 0.00 C ATOM 619 O THR A 40 -0.158 -17.776 -20.851 1.00 0.00 O ATOM 620 CB THR A 40 2.387 -16.090 -20.274 1.00 0.00 C ATOM 621 OG1 THR A 40 2.195 -15.534 -18.967 1.00 0.00 O ATOM 622 CG2 THR A 40 3.644 -15.510 -20.901 1.00 0.00 C ATOM 0 H THR A 40 1.536 -13.784 -20.690 1.00 0.00 H new ATOM 0 HA THR A 40 1.373 -16.127 -22.174 1.00 0.00 H new ATOM 0 HB THR A 40 2.503 -17.171 -20.189 1.00 0.00 H new ATOM 0 HG1 THR A 40 2.612 -14.648 -18.924 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.501 -15.726 -20.264 1.00 0.00 H new ATOM 0 HG22 THR A 40 3.800 -15.957 -21.883 1.00 0.00 H new ATOM 0 HG23 THR A 40 3.533 -14.431 -21.007 1.00 0.00 H new ATOM 630 N GLY A 41 -0.935 -15.874 -19.936 1.00 0.00 N ATOM 631 CA GLY A 41 -2.118 -16.520 -19.399 1.00 0.00 C ATOM 632 C GLY A 41 -2.032 -16.743 -17.903 1.00 0.00 C ATOM 633 O GLY A 41 -1.879 -17.876 -17.446 1.00 0.00 O ATOM 0 H GLY A 41 -0.862 -14.876 -19.737 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.993 -15.910 -19.622 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -2.262 -17.478 -19.898 1.00 0.00 H new ATOM 637 N GLN A 42 -2.132 -15.662 -17.139 1.00 0.00 N ATOM 638 CA GLN A 42 -2.066 -15.746 -15.684 1.00 0.00 C ATOM 639 C GLN A 42 -2.694 -14.517 -15.039 1.00 0.00 C ATOM 640 O GLN A 42 -3.729 -14.609 -14.378 1.00 0.00 O ATOM 641 CB GLN A 42 -0.615 -15.896 -15.209 1.00 0.00 C ATOM 642 CG GLN A 42 0.426 -15.584 -16.276 1.00 0.00 C ATOM 643 CD GLN A 42 1.786 -15.255 -15.689 1.00 0.00 C ATOM 644 OE1 GLN A 42 2.505 -14.399 -16.203 1.00 0.00 O ATOM 645 NE2 GLN A 42 2.148 -15.937 -14.606 1.00 0.00 N ATOM 0 H GLN A 42 -2.259 -14.717 -17.502 1.00 0.00 H new ATOM 0 HA GLN A 42 -2.628 -16.629 -15.380 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -0.454 -15.237 -14.356 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -0.463 -16.916 -14.857 1.00 0.00 H new ATOM 0 HG2 GLN A 42 0.521 -16.439 -16.946 1.00 0.00 H new ATOM 0 HG3 GLN A 42 0.082 -14.743 -16.879 1.00 0.00 H new ATOM 0 HE21 GLN A 42 1.521 -16.638 -14.212 1.00 0.00 H new ATOM 0 HE22 GLN A 42 3.052 -15.758 -14.170 1.00 0.00 H new ATOM 654 N ILE A 43 -2.057 -13.369 -15.230 1.00 0.00 N ATOM 655 CA ILE A 43 -2.546 -12.121 -14.664 1.00 0.00 C ATOM 656 C ILE A 43 -3.224 -11.259 -15.727 1.00 0.00 C ATOM 657 O ILE A 43 -2.741 -11.154 -16.854 1.00 0.00 O ATOM 658 CB ILE A 43 -1.399 -11.319 -14.019 1.00 0.00 C ATOM 659 CG1 ILE A 43 -0.663 -12.178 -12.990 1.00 0.00 C ATOM 660 CG2 ILE A 43 -1.931 -10.048 -13.372 1.00 0.00 C ATOM 661 CD1 ILE A 43 0.727 -11.675 -12.665 1.00 0.00 C ATOM 0 H ILE A 43 -1.199 -13.277 -15.774 1.00 0.00 H new ATOM 0 HA ILE A 43 -3.277 -12.382 -13.899 1.00 0.00 H new ATOM 0 HB ILE A 43 -0.694 -11.035 -14.801 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.251 -12.215 -12.073 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -0.593 -13.199 -13.365 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.106 -9.496 -12.922 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -2.412 -9.429 -14.129 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -2.656 -10.308 -12.601 1.00 0.00 H new ATOM 0 HD11 ILE A 43 1.189 -12.333 -11.929 1.00 0.00 H new ATOM 0 HD12 ILE A 43 1.331 -11.664 -13.572 1.00 0.00 H new ATOM 0 HD13 ILE A 43 0.663 -10.665 -12.260 1.00 0.00 H new ATOM 673 N PRO A 44 -4.353 -10.622 -15.376 1.00 0.00 N ATOM 674 CA PRO A 44 -5.091 -9.760 -16.295 1.00 0.00 C ATOM 675 C PRO A 44 -4.485 -8.365 -16.368 1.00 0.00 C ATOM 676 O PRO A 44 -3.951 -7.862 -15.378 1.00 0.00 O ATOM 677 CB PRO A 44 -6.484 -9.714 -15.675 1.00 0.00 C ATOM 678 CG PRO A 44 -6.244 -9.849 -14.209 1.00 0.00 C ATOM 679 CD PRO A 44 -4.997 -10.685 -14.050 1.00 0.00 C ATOM 0 HA PRO A 44 -5.081 -10.130 -17.320 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -6.992 -8.779 -15.910 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -7.113 -10.521 -16.050 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -6.116 -8.871 -13.746 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -7.094 -10.325 -13.720 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -4.346 -10.287 -13.271 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -5.237 -11.711 -13.771 1.00 0.00 H new ATOM 687 N ILE A 45 -4.564 -7.746 -17.541 1.00 0.00 N ATOM 688 CA ILE A 45 -4.014 -6.407 -17.742 1.00 0.00 C ATOM 689 C ILE A 45 -4.353 -5.479 -16.578 1.00 0.00 C ATOM 690 O ILE A 45 -5.518 -5.171 -16.330 1.00 0.00 O ATOM 691 CB ILE A 45 -4.524 -5.784 -19.059 1.00 0.00 C ATOM 692 CG1 ILE A 45 -4.031 -6.605 -20.249 1.00 0.00 C ATOM 693 CG2 ILE A 45 -4.066 -4.337 -19.187 1.00 0.00 C ATOM 694 CD1 ILE A 45 -4.859 -6.419 -21.500 1.00 0.00 C ATOM 0 H ILE A 45 -5.004 -8.149 -18.369 1.00 0.00 H new ATOM 0 HA ILE A 45 -2.931 -6.518 -17.796 1.00 0.00 H new ATOM 0 HB ILE A 45 -5.614 -5.794 -19.048 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -2.998 -6.333 -20.464 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -4.032 -7.660 -19.977 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -4.437 -3.919 -20.123 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -4.456 -3.757 -18.351 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -2.977 -4.298 -19.179 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -4.449 -7.033 -22.302 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -5.888 -6.719 -21.303 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -4.837 -5.371 -21.798 1.00 0.00 H new ATOM 706 N ARG A 46 -3.318 -5.033 -15.875 1.00 0.00 N ATOM 707 CA ARG A 46 -3.489 -4.132 -14.744 1.00 0.00 C ATOM 708 C ARG A 46 -2.856 -2.783 -15.055 1.00 0.00 C ATOM 709 O ARG A 46 -1.720 -2.714 -15.521 1.00 0.00 O ATOM 710 CB ARG A 46 -2.860 -4.729 -13.483 1.00 0.00 C ATOM 711 CG ARG A 46 -3.695 -5.826 -12.834 1.00 0.00 C ATOM 712 CD ARG A 46 -5.144 -5.404 -12.632 1.00 0.00 C ATOM 713 NE ARG A 46 -5.278 -3.971 -12.373 1.00 0.00 N ATOM 714 CZ ARG A 46 -6.403 -3.285 -12.557 1.00 0.00 C ATOM 715 NH1 ARG A 46 -7.499 -3.896 -12.989 1.00 0.00 N ATOM 716 NH2 ARG A 46 -6.434 -1.983 -12.307 1.00 0.00 N ATOM 0 H ARG A 46 -2.349 -5.283 -16.070 1.00 0.00 H new ATOM 0 HA ARG A 46 -4.556 -3.993 -14.567 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -1.880 -5.134 -13.735 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -2.699 -3.932 -12.757 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -3.662 -6.721 -13.456 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -3.258 -6.091 -11.871 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -5.722 -5.666 -13.518 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -5.569 -5.962 -11.798 1.00 0.00 H new ATOM 0 HE ARG A 46 -4.460 -3.467 -12.031 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -7.482 -4.897 -13.182 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -8.358 -3.364 -13.128 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -5.595 -1.508 -11.974 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -7.296 -1.457 -12.448 1.00 0.00 H new ATOM 730 N ASP A 47 -3.597 -1.712 -14.810 1.00 0.00 N ATOM 731 CA ASP A 47 -3.095 -0.373 -15.085 1.00 0.00 C ATOM 732 C ASP A 47 -2.328 0.194 -13.896 1.00 0.00 C ATOM 733 O ASP A 47 -2.880 0.371 -12.810 1.00 0.00 O ATOM 734 CB ASP A 47 -4.249 0.562 -15.449 1.00 0.00 C ATOM 735 CG ASP A 47 -4.904 0.188 -16.763 1.00 0.00 C ATOM 736 OD1 ASP A 47 -4.826 -0.997 -17.151 1.00 0.00 O ATOM 737 OD2 ASP A 47 -5.498 1.079 -17.407 1.00 0.00 O ATOM 0 H ASP A 47 -4.541 -1.743 -14.424 1.00 0.00 H new ATOM 0 HA ASP A 47 -2.408 -0.447 -15.928 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -4.995 0.539 -14.655 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -3.879 1.585 -15.509 1.00 0.00 H new ATOM 742 N LEU A 48 -1.055 0.499 -14.122 1.00 0.00 N ATOM 743 CA LEU A 48 -0.205 1.075 -13.087 1.00 0.00 C ATOM 744 C LEU A 48 -0.142 2.581 -13.279 1.00 0.00 C ATOM 745 O LEU A 48 0.247 3.059 -14.344 1.00 0.00 O ATOM 746 CB LEU A 48 1.203 0.476 -13.143 1.00 0.00 C ATOM 747 CG LEU A 48 1.279 -0.961 -13.662 1.00 0.00 C ATOM 748 CD1 LEU A 48 2.702 -1.482 -13.562 1.00 0.00 C ATOM 749 CD2 LEU A 48 0.320 -1.861 -12.893 1.00 0.00 C ATOM 0 H LEU A 48 -0.587 0.356 -15.017 1.00 0.00 H new ATOM 0 HA LEU A 48 -0.628 0.846 -12.109 1.00 0.00 H new ATOM 0 HB2 LEU A 48 1.824 1.108 -13.778 1.00 0.00 H new ATOM 0 HB3 LEU A 48 1.634 0.507 -12.142 1.00 0.00 H new ATOM 0 HG LEU A 48 0.982 -0.967 -14.711 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.742 -2.506 -13.935 1.00 0.00 H new ATOM 0 HD12 LEU A 48 3.363 -0.853 -14.158 1.00 0.00 H new ATOM 0 HD13 LEU A 48 3.024 -1.462 -12.521 1.00 0.00 H new ATOM 0 HD21 LEU A 48 0.389 -2.879 -13.277 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.583 -1.854 -11.835 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -0.699 -1.495 -13.016 1.00 0.00 H new ATOM 761 N SER A 49 -0.546 3.336 -12.268 1.00 0.00 N ATOM 762 CA SER A 49 -0.546 4.791 -12.397 1.00 0.00 C ATOM 763 C SER A 49 0.322 5.489 -11.366 1.00 0.00 C ATOM 764 O SER A 49 0.680 4.935 -10.332 1.00 0.00 O ATOM 765 CB SER A 49 -1.962 5.348 -12.314 1.00 0.00 C ATOM 766 OG SER A 49 -2.926 4.312 -12.242 1.00 0.00 O ATOM 0 H SER A 49 -0.871 2.980 -11.369 1.00 0.00 H new ATOM 0 HA SER A 49 -0.119 4.995 -13.379 1.00 0.00 H new ATOM 0 HB2 SER A 49 -2.050 5.990 -11.437 1.00 0.00 H new ATOM 0 HB3 SER A 49 -2.161 5.971 -13.186 1.00 0.00 H new ATOM 0 HG SER A 49 -3.823 4.703 -12.188 1.00 0.00 H new ATOM 772 N ALA A 50 0.639 6.733 -11.674 1.00 0.00 N ATOM 773 CA ALA A 50 1.459 7.562 -10.803 1.00 0.00 C ATOM 774 C ALA A 50 0.675 8.774 -10.306 1.00 0.00 C ATOM 775 O ALA A 50 -0.391 9.091 -10.831 1.00 0.00 O ATOM 776 CB ALA A 50 2.716 8.001 -11.536 1.00 0.00 C ATOM 0 H ALA A 50 0.338 7.198 -12.531 1.00 0.00 H new ATOM 0 HA ALA A 50 1.747 6.971 -9.933 1.00 0.00 H new ATOM 0 HB1 ALA A 50 3.324 8.621 -10.877 1.00 0.00 H new ATOM 0 HB2 ALA A 50 3.287 7.123 -11.837 1.00 0.00 H new ATOM 0 HB3 ALA A 50 2.440 8.575 -12.421 1.00 0.00 H new ATOM 782 N ASP A 51 1.211 9.447 -9.293 1.00 0.00 N ATOM 783 CA ASP A 51 0.557 10.624 -8.728 1.00 0.00 C ATOM 784 C ASP A 51 1.273 11.902 -9.158 1.00 0.00 C ATOM 785 O ASP A 51 1.816 12.635 -8.330 1.00 0.00 O ATOM 786 CB ASP A 51 0.501 10.538 -7.195 1.00 0.00 C ATOM 787 CG ASP A 51 1.005 9.212 -6.653 1.00 0.00 C ATOM 788 OD1 ASP A 51 2.190 8.891 -6.879 1.00 0.00 O ATOM 789 OD2 ASP A 51 0.213 8.499 -6.002 1.00 0.00 O ATOM 0 H ASP A 51 2.094 9.199 -8.847 1.00 0.00 H new ATOM 0 HA ASP A 51 -0.464 10.653 -9.110 1.00 0.00 H new ATOM 0 HB2 ASP A 51 1.095 11.347 -6.770 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -0.527 10.691 -6.866 1.00 0.00 H new ATOM 794 N ILE A 52 1.269 12.164 -10.458 1.00 0.00 N ATOM 795 CA ILE A 52 1.917 13.351 -11.003 1.00 0.00 C ATOM 796 C ILE A 52 1.256 14.626 -10.480 1.00 0.00 C ATOM 797 O ILE A 52 1.937 15.582 -10.108 1.00 0.00 O ATOM 798 CB ILE A 52 1.871 13.347 -12.547 1.00 0.00 C ATOM 799 CG1 ILE A 52 2.782 12.249 -13.100 1.00 0.00 C ATOM 800 CG2 ILE A 52 2.273 14.705 -13.104 1.00 0.00 C ATOM 801 CD1 ILE A 52 2.793 12.178 -14.612 1.00 0.00 C ATOM 0 H ILE A 52 0.823 11.569 -11.157 1.00 0.00 H new ATOM 0 HA ILE A 52 2.957 13.331 -10.678 1.00 0.00 H new ATOM 0 HB ILE A 52 0.847 13.143 -12.860 1.00 0.00 H new ATOM 0 HG12 ILE A 52 3.799 12.418 -12.745 1.00 0.00 H new ATOM 0 HG13 ILE A 52 2.461 11.287 -12.701 1.00 0.00 H new ATOM 0 HG21 ILE A 52 2.233 14.678 -14.193 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.587 15.467 -12.735 1.00 0.00 H new ATOM 0 HG23 ILE A 52 3.287 14.944 -12.784 1.00 0.00 H new ATOM 0 HD11 ILE A 52 3.460 11.378 -14.934 1.00 0.00 H new ATOM 0 HD12 ILE A 52 1.785 11.978 -14.974 1.00 0.00 H new ATOM 0 HD13 ILE A 52 3.143 13.127 -15.018 1.00 0.00 H new ATOM 989 N LYS A 63 6.495 7.799 -4.229 1.00 0.00 N ATOM 990 CA LYS A 63 6.627 6.601 -3.404 1.00 0.00 C ATOM 991 C LYS A 63 5.451 5.655 -3.628 1.00 0.00 C ATOM 992 O LYS A 63 4.594 5.497 -2.760 1.00 0.00 O ATOM 993 CB LYS A 63 6.722 6.979 -1.924 1.00 0.00 C ATOM 994 CG LYS A 63 5.674 7.989 -1.486 1.00 0.00 C ATOM 995 CD LYS A 63 5.474 7.966 0.021 1.00 0.00 C ATOM 996 CE LYS A 63 4.012 8.144 0.392 1.00 0.00 C ATOM 997 NZ LYS A 63 3.148 7.114 -0.247 1.00 0.00 N ATOM 0 HA LYS A 63 7.543 6.088 -3.697 1.00 0.00 H new ATOM 0 HB2 LYS A 63 6.620 6.077 -1.320 1.00 0.00 H new ATOM 0 HB3 LYS A 63 7.713 7.386 -1.724 1.00 0.00 H new ATOM 0 HG2 LYS A 63 5.977 8.988 -1.799 1.00 0.00 H new ATOM 0 HG3 LYS A 63 4.728 7.773 -1.983 1.00 0.00 H new ATOM 0 HD2 LYS A 63 5.840 7.021 0.423 1.00 0.00 H new ATOM 0 HD3 LYS A 63 6.066 8.758 0.480 1.00 0.00 H new ATOM 0 HE2 LYS A 63 3.903 8.088 1.475 1.00 0.00 H new ATOM 0 HE3 LYS A 63 3.679 9.136 0.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 2.354 6.887 0.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 2.780 7.480 -1.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 3.706 6.254 -0.424 1.00 0.00 H new ATOM 1011 N LYS A 64 5.418 5.027 -4.800 1.00 0.00 N ATOM 1012 CA LYS A 64 4.348 4.096 -5.139 1.00 0.00 C ATOM 1013 C LYS A 64 4.923 2.786 -5.667 1.00 0.00 C ATOM 1014 O LYS A 64 5.867 2.786 -6.456 1.00 0.00 O ATOM 1015 CB LYS A 64 3.417 4.716 -6.181 1.00 0.00 C ATOM 1016 CG LYS A 64 2.167 3.892 -6.449 1.00 0.00 C ATOM 1017 CD LYS A 64 0.932 4.769 -6.595 1.00 0.00 C ATOM 1018 CE LYS A 64 1.161 5.898 -7.585 1.00 0.00 C ATOM 1019 NZ LYS A 64 -0.117 6.539 -8.003 1.00 0.00 N ATOM 0 H LYS A 64 6.120 5.146 -5.530 1.00 0.00 H new ATOM 0 HA LYS A 64 3.777 3.886 -4.234 1.00 0.00 H new ATOM 0 HB2 LYS A 64 3.121 5.710 -5.846 1.00 0.00 H new ATOM 0 HB3 LYS A 64 3.965 4.844 -7.115 1.00 0.00 H new ATOM 0 HG2 LYS A 64 2.306 3.306 -7.357 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.016 3.185 -5.633 1.00 0.00 H new ATOM 0 HD2 LYS A 64 0.090 4.160 -6.925 1.00 0.00 H new ATOM 0 HD3 LYS A 64 0.664 5.185 -5.624 1.00 0.00 H new ATOM 0 HE2 LYS A 64 1.813 6.647 -7.136 1.00 0.00 H new ATOM 0 HE3 LYS A 64 1.677 5.511 -8.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -0.082 6.751 -9.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -0.909 5.892 -7.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -0.254 7.421 -7.470 1.00 0.00 H new ATOM 1033 N VAL A 65 4.365 1.667 -5.216 1.00 0.00 N ATOM 1034 CA VAL A 65 4.846 0.361 -5.638 1.00 0.00 C ATOM 1035 C VAL A 65 3.701 -0.599 -5.941 1.00 0.00 C ATOM 1036 O VAL A 65 2.727 -0.680 -5.192 1.00 0.00 O ATOM 1037 CB VAL A 65 5.716 -0.271 -4.548 1.00 0.00 C ATOM 1038 CG1 VAL A 65 6.414 -1.521 -5.058 1.00 0.00 C ATOM 1039 CG2 VAL A 65 6.723 0.732 -4.005 1.00 0.00 C ATOM 0 H VAL A 65 3.583 1.640 -4.561 1.00 0.00 H new ATOM 0 HA VAL A 65 5.426 0.524 -6.546 1.00 0.00 H new ATOM 0 HB VAL A 65 5.060 -0.567 -3.729 1.00 0.00 H new ATOM 0 HG11 VAL A 65 7.024 -1.947 -4.262 1.00 0.00 H new ATOM 0 HG12 VAL A 65 5.669 -2.251 -5.374 1.00 0.00 H new ATOM 0 HG13 VAL A 65 7.051 -1.263 -5.904 1.00 0.00 H new ATOM 0 HG21 VAL A 65 7.328 0.258 -3.232 1.00 0.00 H new ATOM 0 HG22 VAL A 65 7.369 1.073 -4.814 1.00 0.00 H new ATOM 0 HG23 VAL A 65 6.194 1.585 -3.579 1.00 0.00 H new ATOM 1049 N TRP A 66 3.843 -1.340 -7.029 1.00 0.00 N ATOM 1050 CA TRP A 66 2.832 -2.327 -7.424 1.00 0.00 C ATOM 1051 C TRP A 66 3.253 -3.732 -7.023 1.00 0.00 C ATOM 1052 O TRP A 66 4.413 -4.097 -7.158 1.00 0.00 O ATOM 1053 CB TRP A 66 2.568 -2.293 -8.922 1.00 0.00 C ATOM 1054 CG TRP A 66 1.764 -1.113 -9.332 1.00 0.00 C ATOM 1055 CD1 TRP A 66 0.442 -1.029 -9.668 1.00 0.00 C ATOM 1056 CD2 TRP A 66 2.284 0.181 -9.423 1.00 0.00 C ATOM 1057 NE1 TRP A 66 0.125 0.277 -9.961 1.00 0.00 N ATOM 1058 CE2 TRP A 66 1.256 1.039 -9.816 1.00 0.00 C ATOM 1059 CE3 TRP A 66 3.544 0.677 -9.201 1.00 0.00 C ATOM 1060 CZ2 TRP A 66 1.464 2.399 -9.992 1.00 0.00 C ATOM 1061 CZ3 TRP A 66 3.768 2.018 -9.369 1.00 0.00 C ATOM 1062 CH2 TRP A 66 2.730 2.877 -9.763 1.00 0.00 C ATOM 0 H TRP A 66 4.644 -1.282 -7.658 1.00 0.00 H new ATOM 0 HA TRP A 66 1.913 -2.062 -6.901 1.00 0.00 H new ATOM 0 HB2 TRP A 66 3.519 -2.284 -9.455 1.00 0.00 H new ATOM 0 HB3 TRP A 66 2.047 -3.204 -9.216 1.00 0.00 H new ATOM 0 HD1 TRP A 66 -0.247 -1.860 -9.699 1.00 0.00 H new ATOM 0 HE1 TRP A 66 -0.794 0.620 -10.239 1.00 0.00 H new ATOM 0 HE3 TRP A 66 4.346 0.021 -8.899 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 0.662 3.055 -10.297 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 4.756 2.419 -9.196 1.00 0.00 H new ATOM 0 HH2 TRP A 66 2.931 3.931 -9.888 1.00 0.00 H new ATOM 1073 N THR A 67 2.309 -4.528 -6.533 1.00 0.00 N ATOM 1074 CA THR A 67 2.623 -5.891 -6.129 1.00 0.00 C ATOM 1075 C THR A 67 1.646 -6.907 -6.696 1.00 0.00 C ATOM 1076 O THR A 67 0.434 -6.773 -6.563 1.00 0.00 O ATOM 1077 CB THR A 67 2.628 -6.056 -4.611 1.00 0.00 C ATOM 1078 OG1 THR A 67 3.280 -4.946 -3.982 1.00 0.00 O ATOM 1079 CG2 THR A 67 3.312 -7.350 -4.229 1.00 0.00 C ATOM 0 H THR A 67 1.334 -4.257 -6.408 1.00 0.00 H new ATOM 0 HA THR A 67 3.620 -6.077 -6.529 1.00 0.00 H new ATOM 0 HB THR A 67 1.595 -6.087 -4.265 1.00 0.00 H new ATOM 0 HG1 THR A 67 2.639 -4.469 -3.414 1.00 0.00 H new ATOM 0 HG21 THR A 67 3.309 -7.456 -3.144 1.00 0.00 H new ATOM 0 HG22 THR A 67 2.780 -8.189 -4.677 1.00 0.00 H new ATOM 0 HG23 THR A 67 4.340 -7.338 -4.590 1.00 0.00 H new ATOM 1087 N PHE A 68 2.197 -7.949 -7.286 1.00 0.00 N ATOM 1088 CA PHE A 68 1.402 -9.031 -7.842 1.00 0.00 C ATOM 1089 C PHE A 68 1.422 -10.209 -6.888 1.00 0.00 C ATOM 1090 O PHE A 68 2.486 -10.770 -6.624 1.00 0.00 O ATOM 1091 CB PHE A 68 1.986 -9.507 -9.173 1.00 0.00 C ATOM 1092 CG PHE A 68 1.887 -8.527 -10.304 1.00 0.00 C ATOM 1093 CD1 PHE A 68 0.771 -8.502 -11.125 1.00 0.00 C ATOM 1094 CD2 PHE A 68 2.926 -7.654 -10.568 1.00 0.00 C ATOM 1095 CE1 PHE A 68 0.697 -7.624 -12.190 1.00 0.00 C ATOM 1096 CE2 PHE A 68 2.856 -6.771 -11.625 1.00 0.00 C ATOM 1097 CZ PHE A 68 1.743 -6.757 -12.439 1.00 0.00 C ATOM 0 H PHE A 68 3.204 -8.072 -7.394 1.00 0.00 H new ATOM 0 HA PHE A 68 0.388 -8.661 -7.994 1.00 0.00 H new ATOM 0 HB2 PHE A 68 3.036 -9.757 -9.021 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.479 -10.426 -9.465 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -0.050 -9.176 -10.931 1.00 0.00 H new ATOM 0 HD2 PHE A 68 3.804 -7.664 -9.939 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.176 -7.616 -12.826 1.00 0.00 H new ATOM 0 HE2 PHE A 68 3.673 -6.091 -11.815 1.00 0.00 H new ATOM 0 HZ PHE A 68 1.689 -6.069 -13.270 1.00 0.00 H new ATOM 1107 N GLY A 69 0.267 -10.602 -6.381 1.00 0.00 N ATOM 1108 CA GLY A 69 0.248 -11.732 -5.480 1.00 0.00 C ATOM 1109 C GLY A 69 -0.957 -11.741 -4.582 1.00 0.00 C ATOM 1110 O GLY A 69 -1.980 -11.141 -4.911 1.00 0.00 O ATOM 0 H GLY A 69 -0.638 -10.171 -6.570 1.00 0.00 H new ATOM 0 HA2 GLY A 69 0.270 -12.654 -6.061 1.00 0.00 H new ATOM 0 HA3 GLY A 69 1.151 -11.719 -4.869 1.00 0.00 H new ATOM 1114 N ARG A 70 -0.859 -12.422 -3.446 1.00 0.00 N ATOM 1115 CA ARG A 70 -1.987 -12.468 -2.550 1.00 0.00 C ATOM 1116 C ARG A 70 -2.092 -11.143 -1.834 1.00 0.00 C ATOM 1117 O ARG A 70 -1.504 -10.909 -0.778 1.00 0.00 O ATOM 1118 CB ARG A 70 -1.847 -13.616 -1.545 1.00 0.00 C ATOM 1119 CG ARG A 70 -0.578 -13.557 -0.710 1.00 0.00 C ATOM 1120 CD ARG A 70 -0.274 -14.903 -0.067 1.00 0.00 C ATOM 1121 NE ARG A 70 -0.365 -14.847 1.390 1.00 0.00 N ATOM 1122 CZ ARG A 70 -0.457 -15.924 2.168 1.00 0.00 C ATOM 1123 NH1 ARG A 70 -0.473 -17.138 1.632 1.00 0.00 N ATOM 1124 NH2 ARG A 70 -0.534 -15.787 3.485 1.00 0.00 N ATOM 0 H ARG A 70 -0.032 -12.933 -3.137 1.00 0.00 H new ATOM 0 HA ARG A 70 -2.896 -12.649 -3.124 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -2.709 -13.608 -0.878 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -1.870 -14.563 -2.085 1.00 0.00 H new ATOM 0 HG2 ARG A 70 0.260 -13.255 -1.339 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -0.685 -12.798 0.065 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -0.971 -15.651 -0.445 1.00 0.00 H new ATOM 0 HD3 ARG A 70 0.727 -15.225 -0.356 1.00 0.00 H new ATOM 0 HE ARG A 70 -0.358 -13.930 1.837 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -0.415 -17.249 0.620 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -0.544 -17.960 2.232 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -0.523 -14.856 3.902 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -0.604 -16.612 4.080 1.00 0.00 H new ATOM 1138 N ASN A 71 -2.882 -10.301 -2.451 1.00 0.00 N ATOM 1139 CA ASN A 71 -3.176 -8.965 -1.977 1.00 0.00 C ATOM 1140 C ASN A 71 -4.580 -8.610 -2.424 1.00 0.00 C ATOM 1141 O ASN A 71 -5.074 -9.194 -3.382 1.00 0.00 O ATOM 1142 CB ASN A 71 -2.167 -7.957 -2.532 1.00 0.00 C ATOM 1143 CG ASN A 71 -0.770 -8.179 -1.986 1.00 0.00 C ATOM 1144 OD1 ASN A 71 0.027 -8.914 -2.568 1.00 0.00 O ATOM 1145 ND2 ASN A 71 -0.465 -7.540 -0.863 1.00 0.00 N ATOM 0 H ASN A 71 -3.355 -10.530 -3.325 1.00 0.00 H new ATOM 0 HA ASN A 71 -3.105 -8.932 -0.890 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -2.145 -8.030 -3.619 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -2.494 -6.947 -2.287 1.00 0.00 H new ATOM 0 HD21 ASN A 71 0.461 -7.649 -0.450 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -1.157 -6.940 -0.414 1.00 0.00 H new ATOM 1152 N PRO A 72 -5.243 -7.640 -1.793 1.00 0.00 N ATOM 1153 CA PRO A 72 -6.579 -7.248 -2.221 1.00 0.00 C ATOM 1154 C PRO A 72 -6.557 -6.677 -3.622 1.00 0.00 C ATOM 1155 O PRO A 72 -7.601 -6.430 -4.222 1.00 0.00 O ATOM 1156 CB PRO A 72 -7.010 -6.200 -1.199 1.00 0.00 C ATOM 1157 CG PRO A 72 -5.740 -5.700 -0.593 1.00 0.00 C ATOM 1158 CD PRO A 72 -4.748 -6.831 -0.675 1.00 0.00 C ATOM 0 HA PRO A 72 -7.268 -8.092 -2.261 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -7.565 -5.391 -1.674 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -7.664 -6.633 -0.442 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -5.374 -4.824 -1.129 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -5.898 -5.398 0.442 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -3.738 -6.466 -0.860 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -4.715 -7.404 0.252 1.00 0.00 H new ATOM 1166 N ALA A 73 -5.341 -6.497 -4.125 1.00 0.00 N ATOM 1167 CA ALA A 73 -5.078 -5.985 -5.458 1.00 0.00 C ATOM 1168 C ALA A 73 -3.984 -4.976 -5.395 1.00 0.00 C ATOM 1169 O ALA A 73 -4.116 -3.860 -5.901 1.00 0.00 O ATOM 1170 CB ALA A 73 -6.278 -5.372 -6.125 1.00 0.00 C ATOM 0 H ALA A 73 -4.492 -6.709 -3.601 1.00 0.00 H new ATOM 0 HA ALA A 73 -4.791 -6.844 -6.064 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -6.000 -5.013 -7.116 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -7.065 -6.121 -6.218 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -6.640 -4.537 -5.526 1.00 0.00 H new ATOM 1176 N CYS A 74 -2.890 -5.366 -4.776 1.00 0.00 N ATOM 1177 CA CYS A 74 -1.770 -4.455 -4.676 1.00 0.00 C ATOM 1178 C CYS A 74 -1.490 -3.999 -6.086 1.00 0.00 C ATOM 1179 O CYS A 74 -1.893 -2.908 -6.492 1.00 0.00 O ATOM 1180 CB CYS A 74 -0.590 -5.236 -4.147 1.00 0.00 C ATOM 1181 SG CYS A 74 0.181 -4.539 -2.668 1.00 0.00 S ATOM 0 H CYS A 74 -2.753 -6.281 -4.346 1.00 0.00 H new ATOM 0 HA CYS A 74 -1.964 -3.607 -4.019 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -0.915 -6.252 -3.925 1.00 0.00 H new ATOM 0 HB3 CYS A 74 0.162 -5.307 -4.933 1.00 0.00 H new ATOM 0 HG CYS A 74 1.178 -5.290 -2.303 1.00 0.00 H new ATOM 1187 N ASP A 75 -0.985 -4.923 -6.880 1.00 0.00 N ATOM 1188 CA ASP A 75 -0.879 -4.694 -8.293 1.00 0.00 C ATOM 1189 C ASP A 75 -2.123 -5.311 -8.912 1.00 0.00 C ATOM 1190 O ASP A 75 -2.815 -4.720 -9.741 1.00 0.00 O ATOM 1191 CB ASP A 75 0.377 -5.327 -8.891 1.00 0.00 C ATOM 1192 CG ASP A 75 0.485 -5.072 -10.381 1.00 0.00 C ATOM 1193 OD1 ASP A 75 -0.478 -5.396 -11.109 1.00 0.00 O ATOM 1194 OD2 ASP A 75 1.528 -4.548 -10.821 1.00 0.00 O ATOM 0 H ASP A 75 -0.646 -5.832 -6.566 1.00 0.00 H new ATOM 0 HA ASP A 75 -0.802 -3.626 -8.496 1.00 0.00 H new ATOM 0 HB2 ASP A 75 1.259 -4.927 -8.390 1.00 0.00 H new ATOM 0 HB3 ASP A 75 0.365 -6.401 -8.707 1.00 0.00 H new ATOM 1199 N TYR A 76 -2.370 -6.552 -8.451 1.00 0.00 N ATOM 1200 CA TYR A 76 -3.502 -7.371 -8.877 1.00 0.00 C ATOM 1201 C TYR A 76 -4.050 -8.216 -7.721 1.00 0.00 C ATOM 1202 O TYR A 76 -3.271 -8.749 -6.929 1.00 0.00 O ATOM 1203 CB TYR A 76 -3.082 -8.287 -10.027 1.00 0.00 C ATOM 1204 CG TYR A 76 -4.180 -9.216 -10.485 1.00 0.00 C ATOM 1205 CD1 TYR A 76 -5.432 -8.720 -10.827 1.00 0.00 C ATOM 1206 CD2 TYR A 76 -3.971 -10.586 -10.573 1.00 0.00 C ATOM 1207 CE1 TYR A 76 -6.444 -9.562 -11.244 1.00 0.00 C ATOM 1208 CE2 TYR A 76 -4.978 -11.435 -10.991 1.00 0.00 C ATOM 1209 CZ TYR A 76 -6.212 -10.918 -11.324 1.00 0.00 C ATOM 1210 OH TYR A 76 -7.217 -11.761 -11.739 1.00 0.00 O ATOM 0 H TYR A 76 -1.775 -7.013 -7.762 1.00 0.00 H new ATOM 0 HA TYR A 76 -4.292 -6.698 -9.212 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -2.759 -7.675 -10.869 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -2.222 -8.879 -9.714 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -5.617 -7.658 -10.766 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -3.006 -10.994 -10.311 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -7.412 -9.160 -11.506 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -4.799 -12.498 -11.057 1.00 0.00 H new ATOM 0 HH TYR A 76 -6.889 -12.685 -11.741 1.00 0.00 H new ATOM 1220 N HIS A 77 -5.366 -8.394 -7.643 1.00 0.00 N ATOM 1221 CA HIS A 77 -5.945 -9.238 -6.606 1.00 0.00 C ATOM 1222 C HIS A 77 -6.199 -10.645 -7.147 1.00 0.00 C ATOM 1223 O HIS A 77 -7.117 -10.852 -7.940 1.00 0.00 O ATOM 1224 CB HIS A 77 -7.258 -8.663 -6.089 1.00 0.00 C ATOM 1225 CG HIS A 77 -7.820 -9.453 -4.952 1.00 0.00 C ATOM 1226 ND1 HIS A 77 -7.246 -10.404 -4.181 1.00 0.00 N flip ATOM 1227 CD2 HIS A 77 -9.115 -9.320 -4.499 1.00 0.00 C flip ATOM 1228 CE1 HIS A 77 -8.194 -10.825 -3.283 1.00 0.00 C flip ATOM 1229 NE2 HIS A 77 -9.313 -10.155 -3.495 1.00 0.00 N flip ATOM 0 H HIS A 77 -6.043 -7.970 -8.277 1.00 0.00 H new ATOM 0 HA HIS A 77 -5.231 -9.279 -5.783 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -7.099 -7.633 -5.768 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -7.984 -8.635 -6.902 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -6.287 -10.745 -4.253 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -9.851 -8.640 -4.901 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -8.049 -11.581 -2.526 1.00 0.00 H new ATOM 1238 N LEU A 78 -5.387 -11.610 -6.720 1.00 0.00 N ATOM 1239 CA LEU A 78 -5.545 -12.990 -7.176 1.00 0.00 C ATOM 1240 C LEU A 78 -5.709 -13.950 -5.999 1.00 0.00 C ATOM 1241 O LEU A 78 -5.615 -13.550 -4.839 1.00 0.00 O ATOM 1242 CB LEU A 78 -4.347 -13.409 -8.030 1.00 0.00 C ATOM 1243 CG LEU A 78 -2.996 -13.383 -7.309 1.00 0.00 C ATOM 1244 CD1 LEU A 78 -2.298 -14.728 -7.432 1.00 0.00 C ATOM 1245 CD2 LEU A 78 -2.117 -12.269 -7.859 1.00 0.00 C ATOM 0 H LEU A 78 -4.619 -11.464 -6.065 1.00 0.00 H new ATOM 0 HA LEU A 78 -6.450 -13.038 -7.781 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -4.522 -14.417 -8.405 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -4.291 -12.752 -8.898 1.00 0.00 H new ATOM 0 HG LEU A 78 -3.175 -13.187 -6.252 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.340 -14.690 -6.913 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.921 -15.503 -6.986 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.132 -14.957 -8.485 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.162 -12.267 -7.334 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.946 -12.432 -8.923 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -2.613 -11.309 -7.714 1.00 0.00 H new ATOM 1257 N GLY A 79 -5.959 -15.221 -6.310 1.00 0.00 N ATOM 1258 CA GLY A 79 -6.137 -16.224 -5.273 1.00 0.00 C ATOM 1259 C GLY A 79 -4.927 -16.352 -4.369 1.00 0.00 C ATOM 1260 O GLY A 79 -3.978 -15.574 -4.482 1.00 0.00 O ATOM 0 H GLY A 79 -6.041 -15.574 -7.263 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -7.009 -15.968 -4.672 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.342 -17.189 -5.738 1.00 0.00 H new ATOM 1264 N ASN A 80 -4.955 -17.330 -3.465 1.00 0.00 N ATOM 1265 CA ASN A 80 -3.844 -17.539 -2.542 1.00 0.00 C ATOM 1266 C ASN A 80 -3.100 -18.841 -2.841 1.00 0.00 C ATOM 1267 O ASN A 80 -3.513 -19.919 -2.412 1.00 0.00 O ATOM 1268 CB ASN A 80 -4.353 -17.551 -1.097 1.00 0.00 C ATOM 1269 CG ASN A 80 -5.633 -18.353 -0.936 1.00 0.00 C ATOM 1270 OD1 ASN A 80 -6.668 -17.713 -0.404 1.00 0.00 O flip ATOM 1271 ND2 ASN A 80 -5.689 -19.531 -1.286 1.00 0.00 N flip ATOM 0 H ASN A 80 -5.729 -17.985 -3.353 1.00 0.00 H new ATOM 0 HA ASN A 80 -3.145 -16.714 -2.675 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -3.583 -17.968 -0.448 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -4.527 -16.526 -0.768 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -4.869 -19.982 -1.690 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -6.556 -20.056 -1.172 1.00 0.00 H new ATOM 1278 N ILE A 81 -1.989 -18.723 -3.561 1.00 0.00 N ATOM 1279 CA ILE A 81 -1.160 -19.873 -3.905 1.00 0.00 C ATOM 1280 C ILE A 81 0.212 -19.759 -3.237 1.00 0.00 C ATOM 1281 O ILE A 81 0.988 -18.856 -3.545 1.00 0.00 O ATOM 1282 CB ILE A 81 -0.990 -20.004 -5.432 1.00 0.00 C ATOM 1283 CG1 ILE A 81 -2.347 -20.251 -6.096 1.00 0.00 C ATOM 1284 CG2 ILE A 81 -0.020 -21.126 -5.775 1.00 0.00 C ATOM 1285 CD1 ILE A 81 -3.187 -19.002 -6.250 1.00 0.00 C ATOM 0 H ILE A 81 -1.640 -17.835 -3.920 1.00 0.00 H new ATOM 0 HA ILE A 81 -1.664 -20.767 -3.539 1.00 0.00 H new ATOM 0 HB ILE A 81 -0.577 -19.070 -5.812 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.185 -20.692 -7.079 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -2.902 -20.981 -5.507 1.00 0.00 H new ATOM 0 HG21 ILE A 81 0.084 -21.199 -6.858 1.00 0.00 H new ATOM 0 HG22 ILE A 81 0.953 -20.915 -5.331 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -0.401 -22.069 -5.383 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.133 -19.256 -6.728 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.381 -18.571 -5.268 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.653 -18.278 -6.865 1.00 0.00 H new ATOM 1297 N SER A 82 0.493 -20.669 -2.312 1.00 0.00 N ATOM 1298 CA SER A 82 1.759 -20.662 -1.581 1.00 0.00 C ATOM 1299 C SER A 82 2.977 -20.698 -2.509 1.00 0.00 C ATOM 1300 O SER A 82 4.065 -20.272 -2.123 1.00 0.00 O ATOM 1301 CB SER A 82 1.813 -21.850 -0.619 1.00 0.00 C ATOM 1302 OG SER A 82 2.039 -23.062 -1.315 1.00 0.00 O ATOM 0 H SER A 82 -0.140 -21.424 -2.048 1.00 0.00 H new ATOM 0 HA SER A 82 1.800 -19.725 -1.026 1.00 0.00 H new ATOM 0 HB2 SER A 82 2.606 -21.694 0.112 1.00 0.00 H new ATOM 0 HB3 SER A 82 0.877 -21.915 -0.064 1.00 0.00 H new ATOM 0 HG SER A 82 2.071 -23.805 -0.677 1.00 0.00 H new ATOM 1308 N ARG A 83 2.803 -21.221 -3.719 1.00 0.00 N ATOM 1309 CA ARG A 83 3.916 -21.318 -4.664 1.00 0.00 C ATOM 1310 C ARG A 83 4.104 -20.020 -5.468 1.00 0.00 C ATOM 1311 O ARG A 83 4.516 -19.001 -4.917 1.00 0.00 O ATOM 1312 CB ARG A 83 3.714 -22.517 -5.597 1.00 0.00 C ATOM 1313 CG ARG A 83 3.932 -23.860 -4.917 1.00 0.00 C ATOM 1314 CD ARG A 83 2.650 -24.677 -4.865 1.00 0.00 C ATOM 1315 NE ARG A 83 2.900 -26.101 -5.074 1.00 0.00 N ATOM 1316 CZ ARG A 83 2.044 -27.062 -4.730 1.00 0.00 C ATOM 1317 NH1 ARG A 83 0.884 -26.757 -4.162 1.00 0.00 N ATOM 1318 NH2 ARG A 83 2.349 -28.332 -4.957 1.00 0.00 N ATOM 0 H ARG A 83 1.914 -21.581 -4.068 1.00 0.00 H new ATOM 0 HA ARG A 83 4.829 -21.469 -4.088 1.00 0.00 H new ATOM 0 HB2 ARG A 83 2.703 -22.485 -6.003 1.00 0.00 H new ATOM 0 HB3 ARG A 83 4.399 -22.430 -6.440 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.699 -24.419 -5.453 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.303 -23.700 -3.905 1.00 0.00 H new ATOM 0 HD2 ARG A 83 2.166 -24.532 -3.899 1.00 0.00 H new ATOM 0 HD3 ARG A 83 1.958 -24.315 -5.625 1.00 0.00 H new ATOM 0 HE ARG A 83 3.781 -26.375 -5.509 1.00 0.00 H new ATOM 0 HH11 ARG A 83 0.643 -25.782 -3.986 1.00 0.00 H new ATOM 0 HH12 ARG A 83 0.233 -27.498 -3.901 1.00 0.00 H new ATOM 0 HH21 ARG A 83 3.238 -28.573 -5.395 1.00 0.00 H new ATOM 0 HH22 ARG A 83 1.694 -29.069 -4.694 1.00 0.00 H new ATOM 1332 N LEU A 84 3.796 -20.058 -6.768 1.00 0.00 N ATOM 1333 CA LEU A 84 3.925 -18.899 -7.624 1.00 0.00 C ATOM 1334 C LEU A 84 2.551 -18.387 -7.994 1.00 0.00 C ATOM 1335 O LEU A 84 1.796 -19.038 -8.715 1.00 0.00 O ATOM 1336 CB LEU A 84 4.728 -19.197 -8.898 1.00 0.00 C ATOM 1337 CG LEU A 84 5.359 -20.593 -9.008 1.00 0.00 C ATOM 1338 CD1 LEU A 84 6.236 -20.892 -7.800 1.00 0.00 C ATOM 1339 CD2 LEU A 84 4.283 -21.658 -9.181 1.00 0.00 C ATOM 0 H LEU A 84 3.453 -20.893 -7.244 1.00 0.00 H new ATOM 0 HA LEU A 84 4.474 -18.140 -7.066 1.00 0.00 H new ATOM 0 HB2 LEU A 84 4.071 -19.053 -9.755 1.00 0.00 H new ATOM 0 HB3 LEU A 84 5.524 -18.457 -8.979 1.00 0.00 H new ATOM 0 HG LEU A 84 5.996 -20.609 -9.893 1.00 0.00 H new ATOM 0 HD11 LEU A 84 6.671 -21.886 -7.903 1.00 0.00 H new ATOM 0 HD12 LEU A 84 7.034 -20.152 -7.738 1.00 0.00 H new ATOM 0 HD13 LEU A 84 5.632 -20.852 -6.893 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.751 -22.639 -9.257 1.00 0.00 H new ATOM 0 HD22 LEU A 84 3.613 -21.641 -8.321 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.714 -21.456 -10.089 1.00 0.00 H new ATOM 1351 N SER A 85 2.246 -17.220 -7.482 1.00 0.00 N ATOM 1352 CA SER A 85 0.964 -16.564 -7.715 1.00 0.00 C ATOM 1353 C SER A 85 0.747 -15.493 -6.664 1.00 0.00 C ATOM 1354 O SER A 85 0.381 -14.366 -6.987 1.00 0.00 O ATOM 1355 CB SER A 85 -0.188 -17.567 -7.692 1.00 0.00 C ATOM 1356 OG SER A 85 -0.707 -17.779 -8.993 1.00 0.00 O ATOM 0 H SER A 85 2.879 -16.687 -6.886 1.00 0.00 H new ATOM 0 HA SER A 85 0.985 -16.108 -8.705 1.00 0.00 H new ATOM 0 HB2 SER A 85 0.158 -18.513 -7.277 1.00 0.00 H new ATOM 0 HB3 SER A 85 -0.979 -17.202 -7.037 1.00 0.00 H new ATOM 0 HG SER A 85 -0.069 -18.305 -9.518 1.00 0.00 H new ATOM 1362 N ASN A 86 1.015 -15.839 -5.402 1.00 0.00 N ATOM 1363 CA ASN A 86 0.888 -14.882 -4.312 1.00 0.00 C ATOM 1364 C ASN A 86 1.918 -13.784 -4.534 1.00 0.00 C ATOM 1365 O ASN A 86 2.253 -13.505 -5.681 1.00 0.00 O ATOM 1366 CB ASN A 86 1.100 -15.565 -2.959 1.00 0.00 C ATOM 1367 CG ASN A 86 -0.035 -16.500 -2.610 1.00 0.00 C ATOM 1368 OD1 ASN A 86 -1.101 -16.443 -3.218 1.00 0.00 O ATOM 1369 ND2 ASN A 86 0.185 -17.362 -1.624 1.00 0.00 N ATOM 0 H ASN A 86 1.319 -16.770 -5.116 1.00 0.00 H new ATOM 0 HA ASN A 86 -0.116 -14.457 -4.300 1.00 0.00 H new ATOM 0 HB2 ASN A 86 2.036 -16.123 -2.978 1.00 0.00 H new ATOM 0 HB3 ASN A 86 1.197 -14.807 -2.182 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -0.548 -18.013 -1.343 1.00 0.00 H new ATOM 0 HD22 ASN A 86 1.087 -17.373 -1.148 1.00 0.00 H new ATOM 1376 N LYS A 87 2.437 -13.163 -3.472 1.00 0.00 N ATOM 1377 CA LYS A 87 3.445 -12.116 -3.642 1.00 0.00 C ATOM 1378 C LYS A 87 4.536 -12.631 -4.573 1.00 0.00 C ATOM 1379 O LYS A 87 5.635 -12.975 -4.136 1.00 0.00 O ATOM 1380 CB LYS A 87 4.044 -11.716 -2.291 1.00 0.00 C ATOM 1381 CG LYS A 87 3.014 -11.221 -1.289 1.00 0.00 C ATOM 1382 CD LYS A 87 3.552 -11.272 0.132 1.00 0.00 C ATOM 1383 CE LYS A 87 2.789 -10.334 1.053 1.00 0.00 C ATOM 1384 NZ LYS A 87 3.212 -8.916 0.879 1.00 0.00 N ATOM 0 H LYS A 87 2.182 -13.362 -2.505 1.00 0.00 H new ATOM 0 HA LYS A 87 2.978 -11.231 -4.075 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.567 -12.573 -1.867 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.788 -10.935 -2.450 1.00 0.00 H new ATOM 0 HG2 LYS A 87 2.728 -10.198 -1.535 1.00 0.00 H new ATOM 0 HG3 LYS A 87 2.113 -11.830 -1.360 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.483 -12.291 0.512 1.00 0.00 H new ATOM 0 HD3 LYS A 87 4.608 -11.003 0.132 1.00 0.00 H new ATOM 0 HE2 LYS A 87 1.721 -10.421 0.855 1.00 0.00 H new ATOM 0 HE3 LYS A 87 2.947 -10.635 2.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 2.680 -8.312 1.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 4.230 -8.831 1.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 3.022 -8.615 -0.098 1.00 0.00 H new ATOM 1398 N HIS A 88 4.192 -12.740 -5.854 1.00 0.00 N ATOM 1399 CA HIS A 88 5.104 -13.279 -6.843 1.00 0.00 C ATOM 1400 C HIS A 88 5.959 -12.229 -7.525 1.00 0.00 C ATOM 1401 O HIS A 88 6.970 -12.563 -8.144 1.00 0.00 O ATOM 1402 CB HIS A 88 4.362 -14.072 -7.895 1.00 0.00 C ATOM 1403 CG HIS A 88 5.347 -14.795 -8.739 1.00 0.00 C ATOM 1404 ND1 HIS A 88 5.753 -16.077 -8.467 1.00 0.00 N ATOM 1405 CD2 HIS A 88 6.131 -14.353 -9.747 1.00 0.00 C ATOM 1406 CE1 HIS A 88 6.753 -16.394 -9.262 1.00 0.00 C ATOM 1407 NE2 HIS A 88 7.004 -15.367 -10.056 1.00 0.00 N ATOM 0 H HIS A 88 3.285 -12.460 -6.226 1.00 0.00 H new ATOM 0 HA HIS A 88 5.775 -13.931 -6.284 1.00 0.00 H new ATOM 0 HB2 HIS A 88 3.680 -14.779 -7.422 1.00 0.00 H new ATOM 0 HB3 HIS A 88 3.756 -13.407 -8.510 1.00 0.00 H new ATOM 0 HD1 HIS A 88 5.344 -16.688 -7.760 1.00 0.00 H new ATOM 0 HD2 HIS A 88 6.080 -13.384 -10.221 1.00 0.00 H new ATOM 0 HE1 HIS A 88 7.281 -17.336 -9.265 1.00 0.00 H new ATOM 1416 N PHE A 89 5.593 -10.976 -7.415 1.00 0.00 N ATOM 1417 CA PHE A 89 6.415 -9.933 -8.020 1.00 0.00 C ATOM 1418 C PHE A 89 5.909 -8.549 -7.701 1.00 0.00 C ATOM 1419 O PHE A 89 4.730 -8.342 -7.417 1.00 0.00 O ATOM 1420 CB PHE A 89 6.586 -10.163 -9.525 1.00 0.00 C ATOM 1421 CG PHE A 89 6.665 -8.929 -10.387 1.00 0.00 C ATOM 1422 CD1 PHE A 89 7.764 -8.090 -10.325 1.00 0.00 C ATOM 1423 CD2 PHE A 89 5.649 -8.627 -11.277 1.00 0.00 C ATOM 1424 CE1 PHE A 89 7.846 -6.969 -11.129 1.00 0.00 C ATOM 1425 CE2 PHE A 89 5.726 -7.510 -12.087 1.00 0.00 C ATOM 1426 CZ PHE A 89 6.825 -6.679 -12.012 1.00 0.00 C ATOM 0 H PHE A 89 4.758 -10.650 -6.929 1.00 0.00 H new ATOM 0 HA PHE A 89 7.406 -10.000 -7.572 1.00 0.00 H new ATOM 0 HB2 PHE A 89 7.493 -10.747 -9.680 1.00 0.00 H new ATOM 0 HB3 PHE A 89 5.752 -10.771 -9.875 1.00 0.00 H new ATOM 0 HD1 PHE A 89 8.568 -8.314 -9.639 1.00 0.00 H new ATOM 0 HD2 PHE A 89 4.785 -9.272 -11.339 1.00 0.00 H new ATOM 0 HE1 PHE A 89 8.708 -6.321 -11.067 1.00 0.00 H new ATOM 0 HE2 PHE A 89 4.927 -7.288 -12.778 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.886 -5.804 -12.642 1.00 0.00 H new ATOM 1436 N GLN A 90 6.838 -7.611 -7.708 1.00 0.00 N ATOM 1437 CA GLN A 90 6.511 -6.228 -7.368 1.00 0.00 C ATOM 1438 C GLN A 90 7.161 -5.206 -8.299 1.00 0.00 C ATOM 1439 O GLN A 90 8.217 -5.447 -8.880 1.00 0.00 O ATOM 1440 CB GLN A 90 6.937 -5.948 -5.926 1.00 0.00 C ATOM 1441 CG GLN A 90 6.101 -4.885 -5.240 1.00 0.00 C ATOM 1442 CD GLN A 90 6.545 -4.627 -3.815 1.00 0.00 C ATOM 1443 OE1 GLN A 90 7.690 -4.252 -3.567 1.00 0.00 O ATOM 1444 NE2 GLN A 90 5.636 -4.829 -2.869 1.00 0.00 N ATOM 0 H GLN A 90 7.817 -7.773 -7.942 1.00 0.00 H new ATOM 0 HA GLN A 90 5.433 -6.118 -7.485 1.00 0.00 H new ATOM 0 HB2 GLN A 90 6.876 -6.873 -5.352 1.00 0.00 H new ATOM 0 HB3 GLN A 90 7.982 -5.637 -5.919 1.00 0.00 H new ATOM 0 HG2 GLN A 90 6.161 -3.957 -5.809 1.00 0.00 H new ATOM 0 HG3 GLN A 90 5.055 -5.193 -5.241 1.00 0.00 H new ATOM 0 HE21 GLN A 90 4.698 -5.140 -3.121 1.00 0.00 H new ATOM 0 HE22 GLN A 90 5.876 -4.673 -1.890 1.00 0.00 H new ATOM 1453 N ILE A 91 6.514 -4.049 -8.415 1.00 0.00 N ATOM 1454 CA ILE A 91 7.007 -2.960 -9.243 1.00 0.00 C ATOM 1455 C ILE A 91 7.168 -1.689 -8.404 1.00 0.00 C ATOM 1456 O ILE A 91 6.264 -1.319 -7.664 1.00 0.00 O ATOM 1457 CB ILE A 91 6.036 -2.669 -10.394 1.00 0.00 C ATOM 1458 CG1 ILE A 91 5.877 -3.890 -11.300 1.00 0.00 C ATOM 1459 CG2 ILE A 91 6.501 -1.469 -11.182 1.00 0.00 C ATOM 1460 CD1 ILE A 91 4.554 -3.923 -12.037 1.00 0.00 C ATOM 0 H ILE A 91 5.636 -3.844 -7.938 1.00 0.00 H new ATOM 0 HA ILE A 91 7.972 -3.261 -9.651 1.00 0.00 H new ATOM 0 HB ILE A 91 5.058 -2.443 -9.968 1.00 0.00 H new ATOM 0 HG12 ILE A 91 6.690 -3.903 -12.026 1.00 0.00 H new ATOM 0 HG13 ILE A 91 5.972 -4.794 -10.699 1.00 0.00 H new ATOM 0 HG21 ILE A 91 5.802 -1.275 -11.995 1.00 0.00 H new ATOM 0 HG22 ILE A 91 6.546 -0.599 -10.527 1.00 0.00 H new ATOM 0 HG23 ILE A 91 7.491 -1.665 -11.594 1.00 0.00 H new ATOM 0 HD11 ILE A 91 4.508 -4.815 -12.661 1.00 0.00 H new ATOM 0 HD12 ILE A 91 3.736 -3.941 -11.316 1.00 0.00 H new ATOM 0 HD13 ILE A 91 4.465 -3.036 -12.664 1.00 0.00 H new ATOM 1472 N LEU A 92 8.314 -1.023 -8.519 1.00 0.00 N ATOM 1473 CA LEU A 92 8.560 0.195 -7.750 1.00 0.00 C ATOM 1474 C LEU A 92 8.539 1.439 -8.635 1.00 0.00 C ATOM 1475 O LEU A 92 8.992 1.412 -9.779 1.00 0.00 O ATOM 1476 CB LEU A 92 9.904 0.103 -7.026 1.00 0.00 C ATOM 1477 CG LEU A 92 10.284 -1.294 -6.525 1.00 0.00 C ATOM 1478 CD1 LEU A 92 11.534 -1.794 -7.233 1.00 0.00 C ATOM 1479 CD2 LEU A 92 10.492 -1.286 -5.018 1.00 0.00 C ATOM 0 H LEU A 92 9.081 -1.302 -9.131 1.00 0.00 H new ATOM 0 HA LEU A 92 7.756 0.286 -7.020 1.00 0.00 H new ATOM 0 HB2 LEU A 92 10.686 0.454 -7.700 1.00 0.00 H new ATOM 0 HB3 LEU A 92 9.887 0.784 -6.175 1.00 0.00 H new ATOM 0 HG LEU A 92 9.463 -1.974 -6.754 1.00 0.00 H new ATOM 0 HD11 LEU A 92 11.788 -2.788 -6.864 1.00 0.00 H new ATOM 0 HD12 LEU A 92 11.350 -1.842 -8.306 1.00 0.00 H new ATOM 0 HD13 LEU A 92 12.361 -1.111 -7.037 1.00 0.00 H new ATOM 0 HD21 LEU A 92 10.761 -2.288 -4.683 1.00 0.00 H new ATOM 0 HD22 LEU A 92 11.293 -0.591 -4.765 1.00 0.00 H new ATOM 0 HD23 LEU A 92 9.571 -0.974 -4.525 1.00 0.00 H new ATOM 1491 N LEU A 93 8.022 2.535 -8.086 1.00 0.00 N ATOM 1492 CA LEU A 93 7.953 3.799 -8.811 1.00 0.00 C ATOM 1493 C LEU A 93 8.618 4.909 -8.003 1.00 0.00 C ATOM 1494 O LEU A 93 8.235 5.177 -6.863 1.00 0.00 O ATOM 1495 CB LEU A 93 6.494 4.162 -9.123 1.00 0.00 C ATOM 1496 CG LEU A 93 6.224 5.637 -9.455 1.00 0.00 C ATOM 1497 CD1 LEU A 93 6.104 6.458 -8.180 1.00 0.00 C ATOM 1498 CD2 LEU A 93 7.315 6.201 -10.358 1.00 0.00 C ATOM 0 H LEU A 93 7.644 2.572 -7.139 1.00 0.00 H new ATOM 0 HA LEU A 93 8.488 3.687 -9.754 1.00 0.00 H new ATOM 0 HB2 LEU A 93 6.161 3.554 -9.964 1.00 0.00 H new ATOM 0 HB3 LEU A 93 5.880 3.885 -8.266 1.00 0.00 H new ATOM 0 HG LEU A 93 5.278 5.696 -9.993 1.00 0.00 H new ATOM 0 HD11 LEU A 93 5.913 7.500 -8.435 1.00 0.00 H new ATOM 0 HD12 LEU A 93 5.281 6.075 -7.577 1.00 0.00 H new ATOM 0 HD13 LEU A 93 7.032 6.388 -7.613 1.00 0.00 H new ATOM 0 HD21 LEU A 93 7.100 7.247 -10.578 1.00 0.00 H new ATOM 0 HD22 LEU A 93 8.279 6.127 -9.854 1.00 0.00 H new ATOM 0 HD23 LEU A 93 7.347 5.633 -11.288 1.00 0.00 H new ATOM 1510 N GLY A 94 9.615 5.551 -8.601 1.00 0.00 N ATOM 1511 CA GLY A 94 10.319 6.625 -7.924 1.00 0.00 C ATOM 1512 C GLY A 94 11.758 6.265 -7.612 1.00 0.00 C ATOM 1513 O GLY A 94 12.459 5.700 -8.451 1.00 0.00 O ATOM 0 H GLY A 94 9.949 5.347 -9.543 1.00 0.00 H new ATOM 0 HA2 GLY A 94 10.298 7.519 -8.547 1.00 0.00 H new ATOM 0 HA3 GLY A 94 9.799 6.869 -6.998 1.00 0.00 H new ATOM 1565 N LEU A 99 11.498 4.693 -13.041 1.00 0.00 N ATOM 1566 CA LEU A 99 10.747 3.587 -12.459 1.00 0.00 C ATOM 1567 C LEU A 99 11.663 2.407 -12.158 1.00 0.00 C ATOM 1568 O LEU A 99 12.718 2.254 -12.775 1.00 0.00 O ATOM 1569 CB LEU A 99 9.629 3.146 -13.406 1.00 0.00 C ATOM 1570 CG LEU A 99 8.343 3.975 -13.325 1.00 0.00 C ATOM 1571 CD1 LEU A 99 8.185 4.842 -14.564 1.00 0.00 C ATOM 1572 CD2 LEU A 99 7.133 3.069 -13.150 1.00 0.00 C ATOM 0 HA LEU A 99 10.308 3.934 -11.524 1.00 0.00 H new ATOM 0 HB2 LEU A 99 10.004 3.185 -14.429 1.00 0.00 H new ATOM 0 HB3 LEU A 99 9.385 2.105 -13.195 1.00 0.00 H new ATOM 0 HG LEU A 99 8.412 4.629 -12.456 1.00 0.00 H new ATOM 0 HD11 LEU A 99 7.266 5.423 -14.487 1.00 0.00 H new ATOM 0 HD12 LEU A 99 9.036 5.518 -14.646 1.00 0.00 H new ATOM 0 HD13 LEU A 99 8.140 4.207 -15.449 1.00 0.00 H new ATOM 0 HD21 LEU A 99 6.229 3.676 -13.094 1.00 0.00 H new ATOM 0 HD22 LEU A 99 7.062 2.389 -13.999 1.00 0.00 H new ATOM 0 HD23 LEU A 99 7.240 2.492 -12.231 1.00 0.00 H new ATOM 1584 N LEU A 100 11.254 1.572 -11.210 1.00 0.00 N ATOM 1585 CA LEU A 100 12.036 0.404 -10.833 1.00 0.00 C ATOM 1586 C LEU A 100 11.143 -0.825 -10.737 1.00 0.00 C ATOM 1587 O LEU A 100 9.970 -0.719 -10.384 1.00 0.00 O ATOM 1588 CB LEU A 100 12.746 0.645 -9.498 1.00 0.00 C ATOM 1589 CG LEU A 100 14.066 1.412 -9.596 1.00 0.00 C ATOM 1590 CD1 LEU A 100 14.564 1.791 -8.210 1.00 0.00 C ATOM 1591 CD2 LEU A 100 15.110 0.585 -10.330 1.00 0.00 C ATOM 0 H LEU A 100 10.384 1.684 -10.689 1.00 0.00 H new ATOM 0 HA LEU A 100 12.788 0.230 -11.603 1.00 0.00 H new ATOM 0 HB2 LEU A 100 12.073 1.194 -8.840 1.00 0.00 H new ATOM 0 HB3 LEU A 100 12.938 -0.319 -9.027 1.00 0.00 H new ATOM 0 HG LEU A 100 13.892 2.327 -10.162 1.00 0.00 H new ATOM 0 HD11 LEU A 100 15.504 2.336 -8.298 1.00 0.00 H new ATOM 0 HD12 LEU A 100 13.824 2.421 -7.717 1.00 0.00 H new ATOM 0 HD13 LEU A 100 14.722 0.888 -7.621 1.00 0.00 H new ATOM 0 HD21 LEU A 100 16.042 1.146 -10.390 1.00 0.00 H new ATOM 0 HD22 LEU A 100 15.281 -0.346 -9.790 1.00 0.00 H new ATOM 0 HD23 LEU A 100 14.755 0.361 -11.336 1.00 0.00 H new ATOM 1603 N LEU A 101 11.691 -1.992 -11.051 1.00 0.00 N ATOM 1604 CA LEU A 101 10.914 -3.227 -10.986 1.00 0.00 C ATOM 1605 C LEU A 101 11.506 -4.154 -9.941 1.00 0.00 C ATOM 1606 O LEU A 101 12.715 -4.380 -9.929 1.00 0.00 O ATOM 1607 CB LEU A 101 10.891 -3.919 -12.350 1.00 0.00 C ATOM 1608 CG LEU A 101 9.851 -3.376 -13.331 1.00 0.00 C ATOM 1609 CD1 LEU A 101 10.423 -2.210 -14.121 1.00 0.00 C ATOM 1610 CD2 LEU A 101 9.379 -4.478 -14.268 1.00 0.00 C ATOM 0 H LEU A 101 12.659 -2.111 -11.350 1.00 0.00 H new ATOM 0 HA LEU A 101 9.890 -2.981 -10.707 1.00 0.00 H new ATOM 0 HB2 LEU A 101 11.878 -3.829 -12.803 1.00 0.00 H new ATOM 0 HB3 LEU A 101 10.706 -4.982 -12.198 1.00 0.00 H new ATOM 0 HG LEU A 101 8.993 -3.017 -12.763 1.00 0.00 H new ATOM 0 HD11 LEU A 101 9.670 -1.836 -14.814 1.00 0.00 H new ATOM 0 HD12 LEU A 101 10.713 -1.414 -13.436 1.00 0.00 H new ATOM 0 HD13 LEU A 101 11.297 -2.543 -14.680 1.00 0.00 H new ATOM 0 HD21 LEU A 101 8.639 -4.075 -14.960 1.00 0.00 H new ATOM 0 HD22 LEU A 101 10.228 -4.866 -14.830 1.00 0.00 H new ATOM 0 HD23 LEU A 101 8.931 -5.283 -13.686 1.00 0.00 H new ATOM 1622 N ASN A 102 10.670 -4.704 -9.065 1.00 0.00 N ATOM 1623 CA ASN A 102 11.182 -5.602 -8.050 1.00 0.00 C ATOM 1624 C ASN A 102 10.644 -6.992 -8.278 1.00 0.00 C ATOM 1625 O ASN A 102 9.456 -7.244 -8.083 1.00 0.00 O ATOM 1626 CB ASN A 102 10.779 -5.111 -6.660 1.00 0.00 C ATOM 1627 CG ASN A 102 11.802 -5.459 -5.604 1.00 0.00 C ATOM 1628 OD1 ASN A 102 12.983 -5.639 -5.900 1.00 0.00 O ATOM 1629 ND2 ASN A 102 11.352 -5.556 -4.361 1.00 0.00 N ATOM 0 H ASN A 102 9.663 -4.546 -9.040 1.00 0.00 H new ATOM 0 HA ASN A 102 12.270 -5.624 -8.114 1.00 0.00 H new ATOM 0 HB2 ASN A 102 10.642 -4.030 -6.686 1.00 0.00 H new ATOM 0 HB3 ASN A 102 9.818 -5.548 -6.388 1.00 0.00 H new ATOM 0 HD21 ASN A 102 11.994 -5.788 -3.603 1.00 0.00 H new ATOM 0 HD22 ASN A 102 10.364 -5.398 -4.163 1.00 0.00 H new ATOM 1636 N ASP A 103 11.514 -7.905 -8.673 1.00 0.00 N ATOM 1637 CA ASP A 103 11.075 -9.259 -8.902 1.00 0.00 C ATOM 1638 C ASP A 103 11.008 -9.993 -7.585 1.00 0.00 C ATOM 1639 O ASP A 103 12.035 -10.295 -6.978 1.00 0.00 O ATOM 1640 CB ASP A 103 12.031 -9.977 -9.852 1.00 0.00 C ATOM 1641 CG ASP A 103 11.746 -9.666 -11.309 1.00 0.00 C ATOM 1642 OD1 ASP A 103 10.680 -9.081 -11.594 1.00 0.00 O ATOM 1643 OD2 ASP A 103 12.589 -10.008 -12.166 1.00 0.00 O ATOM 0 H ASP A 103 12.506 -7.734 -8.837 1.00 0.00 H new ATOM 0 HA ASP A 103 10.086 -9.240 -9.359 1.00 0.00 H new ATOM 0 HB2 ASP A 103 13.056 -9.690 -9.616 1.00 0.00 H new ATOM 0 HB3 ASP A 103 11.957 -11.053 -9.692 1.00 0.00 H new ATOM 1648 N ILE A 104 9.798 -10.322 -7.164 1.00 0.00 N ATOM 1649 CA ILE A 104 9.627 -11.068 -5.943 1.00 0.00 C ATOM 1650 C ILE A 104 8.850 -12.330 -6.249 1.00 0.00 C ATOM 1651 O ILE A 104 7.663 -12.300 -6.488 1.00 0.00 O ATOM 1652 CB ILE A 104 8.939 -10.220 -4.826 1.00 0.00 C ATOM 1653 CG1 ILE A 104 7.597 -10.816 -4.382 1.00 0.00 C ATOM 1654 CG2 ILE A 104 8.740 -8.781 -5.281 1.00 0.00 C ATOM 1655 CD1 ILE A 104 6.987 -10.102 -3.196 1.00 0.00 C ATOM 0 H ILE A 104 8.932 -10.084 -7.648 1.00 0.00 H new ATOM 0 HA ILE A 104 10.608 -11.334 -5.550 1.00 0.00 H new ATOM 0 HB ILE A 104 9.609 -10.237 -3.967 1.00 0.00 H new ATOM 0 HG12 ILE A 104 6.898 -10.781 -5.217 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.740 -11.867 -4.130 1.00 0.00 H new ATOM 0 HG21 ILE A 104 8.259 -8.211 -4.486 1.00 0.00 H new ATOM 0 HG22 ILE A 104 9.707 -8.336 -5.513 1.00 0.00 H new ATOM 0 HG23 ILE A 104 8.111 -8.764 -6.171 1.00 0.00 H new ATOM 0 HD11 ILE A 104 6.040 -10.574 -2.935 1.00 0.00 H new ATOM 0 HD12 ILE A 104 7.668 -10.160 -2.347 1.00 0.00 H new ATOM 0 HD13 ILE A 104 6.813 -9.057 -3.451 1.00 0.00 H new ATOM 1667 N SER A 105 9.545 -13.423 -6.207 1.00 0.00 N ATOM 1668 CA SER A 105 8.968 -14.739 -6.467 1.00 0.00 C ATOM 1669 C SER A 105 9.376 -15.692 -5.362 1.00 0.00 C ATOM 1670 O SER A 105 10.226 -15.351 -4.539 1.00 0.00 O ATOM 1671 CB SER A 105 9.449 -15.260 -7.812 1.00 0.00 C ATOM 1672 OG SER A 105 9.015 -14.425 -8.870 1.00 0.00 O ATOM 0 H SER A 105 10.541 -13.445 -5.990 1.00 0.00 H new ATOM 0 HA SER A 105 7.881 -14.661 -6.492 1.00 0.00 H new ATOM 0 HB2 SER A 105 10.537 -15.318 -7.814 1.00 0.00 H new ATOM 0 HB3 SER A 105 9.076 -16.272 -7.967 1.00 0.00 H new ATOM 0 HG SER A 105 8.492 -14.952 -9.509 1.00 0.00 H new ATOM 1678 N THR A 106 8.780 -16.876 -5.318 1.00 0.00 N ATOM 1679 CA THR A 106 9.136 -17.805 -4.265 1.00 0.00 C ATOM 1680 C THR A 106 10.549 -18.340 -4.453 1.00 0.00 C ATOM 1681 O THR A 106 11.416 -18.098 -3.614 1.00 0.00 O ATOM 1682 CB THR A 106 8.161 -18.995 -4.208 1.00 0.00 C ATOM 1683 OG1 THR A 106 6.810 -18.520 -4.175 1.00 0.00 O ATOM 1684 CG2 THR A 106 8.431 -19.855 -2.984 1.00 0.00 C ATOM 0 H THR A 106 8.073 -17.204 -5.976 1.00 0.00 H new ATOM 0 HA THR A 106 9.080 -17.249 -3.329 1.00 0.00 H new ATOM 0 HB THR A 106 8.310 -19.603 -5.100 1.00 0.00 H new ATOM 0 HG1 THR A 106 6.212 -19.210 -4.530 1.00 0.00 H new ATOM 0 HG21 THR A 106 7.730 -20.690 -2.964 1.00 0.00 H new ATOM 0 HG22 THR A 106 9.451 -20.238 -3.026 1.00 0.00 H new ATOM 0 HG23 THR A 106 8.306 -19.255 -2.083 1.00 0.00 H new ATOM 1692 N ASN A 107 10.803 -19.055 -5.554 1.00 0.00 N ATOM 1693 CA ASN A 107 12.146 -19.572 -5.784 1.00 0.00 C ATOM 1694 C ASN A 107 12.888 -18.926 -6.963 1.00 0.00 C ATOM 1695 O ASN A 107 14.113 -18.808 -6.927 1.00 0.00 O ATOM 1696 CB ASN A 107 12.066 -21.083 -6.002 1.00 0.00 C ATOM 1697 CG ASN A 107 11.037 -21.463 -7.032 1.00 0.00 C ATOM 1698 OD1 ASN A 107 11.295 -21.412 -8.235 1.00 0.00 O ATOM 1699 ND2 ASN A 107 9.862 -21.845 -6.571 1.00 0.00 N ATOM 0 H ASN A 107 10.118 -19.281 -6.275 1.00 0.00 H new ATOM 0 HA ASN A 107 12.725 -19.321 -4.896 1.00 0.00 H new ATOM 0 HB2 ASN A 107 13.042 -21.454 -6.314 1.00 0.00 H new ATOM 0 HB3 ASN A 107 11.827 -21.571 -5.057 1.00 0.00 H new ATOM 0 HD21 ASN A 107 9.122 -22.114 -7.220 1.00 0.00 H new ATOM 0 HD22 ASN A 107 9.693 -21.872 -5.565 1.00 0.00 H new ATOM 1706 N GLY A 108 12.166 -18.540 -8.024 1.00 0.00 N ATOM 1707 CA GLY A 108 12.836 -17.962 -9.175 1.00 0.00 C ATOM 1708 C GLY A 108 12.072 -16.892 -9.949 1.00 0.00 C ATOM 1709 O GLY A 108 10.947 -17.131 -10.388 1.00 0.00 O ATOM 0 H GLY A 108 11.152 -18.617 -8.101 1.00 0.00 H new ATOM 0 HA2 GLY A 108 13.778 -17.530 -8.838 1.00 0.00 H new ATOM 0 HA3 GLY A 108 13.084 -18.769 -9.865 1.00 0.00 H new ATOM 1713 N THR A 109 12.720 -15.757 -10.212 1.00 0.00 N ATOM 1714 CA THR A 109 12.127 -14.710 -11.050 1.00 0.00 C ATOM 1715 C THR A 109 13.033 -14.459 -12.251 1.00 0.00 C ATOM 1716 O THR A 109 14.256 -14.439 -12.111 1.00 0.00 O ATOM 1717 CB THR A 109 11.875 -13.377 -10.322 1.00 0.00 C ATOM 1718 OG1 THR A 109 11.333 -13.619 -9.018 1.00 0.00 O ATOM 1719 CG2 THR A 109 10.911 -12.509 -11.137 1.00 0.00 C ATOM 0 H THR A 109 13.652 -15.538 -9.859 1.00 0.00 H new ATOM 0 HA THR A 109 11.147 -15.081 -11.351 1.00 0.00 H new ATOM 0 HB THR A 109 12.824 -12.851 -10.216 1.00 0.00 H new ATOM 0 HG1 THR A 109 10.358 -13.525 -9.046 1.00 0.00 H new ATOM 0 HG21 THR A 109 10.738 -11.568 -10.615 1.00 0.00 H new ATOM 0 HG22 THR A 109 11.344 -12.306 -12.117 1.00 0.00 H new ATOM 0 HG23 THR A 109 9.964 -13.034 -11.260 1.00 0.00 H new ATOM 1727 N TRP A 110 12.451 -14.298 -13.434 1.00 0.00 N ATOM 1728 CA TRP A 110 13.250 -14.085 -14.639 1.00 0.00 C ATOM 1729 C TRP A 110 12.948 -12.772 -15.337 1.00 0.00 C ATOM 1730 O TRP A 110 11.817 -12.293 -15.341 1.00 0.00 O ATOM 1731 CB TRP A 110 13.025 -15.216 -15.632 1.00 0.00 C ATOM 1732 CG TRP A 110 13.986 -16.327 -15.477 1.00 0.00 C ATOM 1733 CD1 TRP A 110 15.042 -16.604 -16.280 1.00 0.00 C ATOM 1734 CD2 TRP A 110 13.974 -17.314 -14.453 1.00 0.00 C ATOM 1735 NE1 TRP A 110 15.697 -17.708 -15.816 1.00 0.00 N ATOM 1736 CE2 TRP A 110 15.056 -18.171 -14.695 1.00 0.00 C ATOM 1737 CE3 TRP A 110 13.149 -17.552 -13.354 1.00 0.00 C ATOM 1738 CZ2 TRP A 110 15.339 -19.260 -13.875 1.00 0.00 C ATOM 1739 CZ3 TRP A 110 13.427 -18.629 -12.541 1.00 0.00 C ATOM 1740 CH2 TRP A 110 14.514 -19.473 -12.803 1.00 0.00 C ATOM 0 H TRP A 110 11.442 -14.310 -13.586 1.00 0.00 H new ATOM 0 HA TRP A 110 14.287 -14.058 -14.305 1.00 0.00 H new ATOM 0 HB2 TRP A 110 12.012 -15.601 -15.511 1.00 0.00 H new ATOM 0 HB3 TRP A 110 13.097 -14.821 -16.645 1.00 0.00 H new ATOM 0 HD1 TRP A 110 15.323 -16.037 -17.155 1.00 0.00 H new ATOM 0 HE1 TRP A 110 16.529 -18.122 -16.235 1.00 0.00 H new ATOM 0 HE3 TRP A 110 12.310 -16.905 -13.145 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 16.177 -19.911 -14.077 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 12.796 -18.826 -11.687 1.00 0.00 H new ATOM 0 HH2 TRP A 110 14.705 -20.309 -12.146 1.00 0.00 H new ATOM 1751 N LEU A 111 13.976 -12.229 -15.976 1.00 0.00 N ATOM 1752 CA LEU A 111 13.847 -11.006 -16.739 1.00 0.00 C ATOM 1753 C LEU A 111 14.283 -11.283 -18.177 1.00 0.00 C ATOM 1754 O LEU A 111 15.456 -11.547 -18.442 1.00 0.00 O ATOM 1755 CB LEU A 111 14.691 -9.891 -16.103 1.00 0.00 C ATOM 1756 CG LEU A 111 15.447 -8.988 -17.081 1.00 0.00 C ATOM 1757 CD1 LEU A 111 14.477 -8.275 -18.009 1.00 0.00 C ATOM 1758 CD2 LEU A 111 16.303 -7.983 -16.325 1.00 0.00 C ATOM 0 H LEU A 111 14.916 -12.626 -15.977 1.00 0.00 H new ATOM 0 HA LEU A 111 12.810 -10.669 -16.739 1.00 0.00 H new ATOM 0 HB2 LEU A 111 14.036 -9.268 -15.494 1.00 0.00 H new ATOM 0 HB3 LEU A 111 15.414 -10.349 -15.427 1.00 0.00 H new ATOM 0 HG LEU A 111 16.104 -9.611 -17.687 1.00 0.00 H new ATOM 0 HD11 LEU A 111 15.033 -7.638 -18.697 1.00 0.00 H new ATOM 0 HD12 LEU A 111 13.908 -9.012 -18.576 1.00 0.00 H new ATOM 0 HD13 LEU A 111 13.793 -7.663 -17.420 1.00 0.00 H new ATOM 0 HD21 LEU A 111 16.833 -7.349 -17.036 1.00 0.00 H new ATOM 0 HD22 LEU A 111 15.666 -7.365 -15.693 1.00 0.00 H new ATOM 0 HD23 LEU A 111 17.024 -8.514 -15.704 1.00 0.00 H new ATOM 1770 N ASN A 112 13.328 -11.235 -19.095 1.00 0.00 N ATOM 1771 CA ASN A 112 13.597 -11.490 -20.507 1.00 0.00 C ATOM 1772 C ASN A 112 14.426 -12.762 -20.716 1.00 0.00 C ATOM 1773 O ASN A 112 15.346 -12.782 -21.535 1.00 0.00 O ATOM 1774 CB ASN A 112 14.310 -10.292 -21.137 1.00 0.00 C ATOM 1775 CG ASN A 112 13.349 -9.184 -21.520 1.00 0.00 C ATOM 1776 OD1 ASN A 112 12.228 -9.444 -21.958 1.00 0.00 O ATOM 1777 ND2 ASN A 112 13.784 -7.940 -21.357 1.00 0.00 N ATOM 0 H ASN A 112 12.353 -11.020 -18.887 1.00 0.00 H new ATOM 0 HA ASN A 112 12.635 -11.639 -20.997 1.00 0.00 H new ATOM 0 HB2 ASN A 112 15.049 -9.903 -20.436 1.00 0.00 H new ATOM 0 HB3 ASN A 112 14.853 -10.621 -22.023 1.00 0.00 H new ATOM 0 HD21 ASN A 112 13.181 -7.153 -21.598 1.00 0.00 H new ATOM 0 HD22 ASN A 112 14.721 -7.771 -20.991 1.00 0.00 H new ATOM 1784 N GLY A 113 14.090 -13.825 -19.987 1.00 0.00 N ATOM 1785 CA GLY A 113 14.802 -15.074 -20.129 1.00 0.00 C ATOM 1786 C GLY A 113 16.093 -15.117 -19.336 1.00 0.00 C ATOM 1787 O GLY A 113 16.835 -16.097 -19.407 1.00 0.00 O ATOM 0 H GLY A 113 13.335 -13.838 -19.301 1.00 0.00 H new ATOM 0 HA2 GLY A 113 14.157 -15.891 -19.806 1.00 0.00 H new ATOM 0 HA3 GLY A 113 15.024 -15.241 -21.183 1.00 0.00 H new ATOM 1791 N GLN A 114 16.364 -14.062 -18.576 1.00 0.00 N ATOM 1792 CA GLN A 114 17.574 -14.001 -17.770 1.00 0.00 C ATOM 1793 C GLN A 114 17.234 -13.906 -16.290 1.00 0.00 C ATOM 1794 O GLN A 114 16.907 -12.834 -15.781 1.00 0.00 O ATOM 1795 CB GLN A 114 18.434 -12.810 -18.186 1.00 0.00 C ATOM 1796 CG GLN A 114 19.850 -13.193 -18.588 1.00 0.00 C ATOM 1797 CD GLN A 114 20.588 -13.932 -17.488 1.00 0.00 C ATOM 1798 OE1 GLN A 114 21.121 -15.019 -17.705 1.00 0.00 O ATOM 1799 NE2 GLN A 114 20.621 -13.342 -16.299 1.00 0.00 N ATOM 0 H GLN A 114 15.764 -13.241 -18.502 1.00 0.00 H new ATOM 0 HA GLN A 114 18.138 -14.919 -17.938 1.00 0.00 H new ATOM 0 HB2 GLN A 114 17.954 -12.300 -19.021 1.00 0.00 H new ATOM 0 HB3 GLN A 114 18.479 -12.099 -17.361 1.00 0.00 H new ATOM 0 HG2 GLN A 114 19.814 -13.818 -19.480 1.00 0.00 H new ATOM 0 HG3 GLN A 114 20.405 -12.293 -18.852 1.00 0.00 H new ATOM 0 HE21 GLN A 114 20.165 -12.440 -16.165 1.00 0.00 H new ATOM 0 HE22 GLN A 114 21.103 -13.791 -15.520 1.00 0.00 H new ATOM 1808 N LYS A 115 17.317 -15.040 -15.607 1.00 0.00 N ATOM 1809 CA LYS A 115 17.026 -15.115 -14.185 1.00 0.00 C ATOM 1810 C LYS A 115 17.679 -13.955 -13.429 1.00 0.00 C ATOM 1811 O LYS A 115 18.812 -13.573 -13.720 1.00 0.00 O ATOM 1812 CB LYS A 115 17.498 -16.474 -13.658 1.00 0.00 C ATOM 1813 CG LYS A 115 18.057 -16.457 -12.241 1.00 0.00 C ATOM 1814 CD LYS A 115 17.817 -17.781 -11.533 1.00 0.00 C ATOM 1815 CE LYS A 115 16.512 -17.769 -10.750 1.00 0.00 C ATOM 1816 NZ LYS A 115 16.726 -17.431 -9.315 1.00 0.00 N ATOM 0 H LYS A 115 17.587 -15.931 -16.024 1.00 0.00 H new ATOM 0 HA LYS A 115 15.952 -15.026 -14.023 1.00 0.00 H new ATOM 0 HB2 LYS A 115 16.661 -17.171 -13.694 1.00 0.00 H new ATOM 0 HB3 LYS A 115 18.264 -16.861 -14.330 1.00 0.00 H new ATOM 0 HG2 LYS A 115 19.126 -16.249 -12.273 1.00 0.00 H new ATOM 0 HG3 LYS A 115 17.592 -15.650 -11.675 1.00 0.00 H new ATOM 0 HD2 LYS A 115 17.795 -18.587 -12.266 1.00 0.00 H new ATOM 0 HD3 LYS A 115 18.646 -17.988 -10.856 1.00 0.00 H new ATOM 0 HE2 LYS A 115 15.829 -17.046 -11.195 1.00 0.00 H new ATOM 0 HE3 LYS A 115 16.035 -18.746 -10.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 15.865 -16.993 -8.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 16.942 -18.298 -8.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 17.521 -16.766 -9.230 1.00 0.00 H new ATOM 1830 N VAL A 116 16.947 -13.391 -12.472 1.00 0.00 N ATOM 1831 CA VAL A 116 17.450 -12.263 -11.692 1.00 0.00 C ATOM 1832 C VAL A 116 17.352 -12.524 -10.193 1.00 0.00 C ATOM 1833 O VAL A 116 16.873 -13.572 -9.760 1.00 0.00 O ATOM 1834 CB VAL A 116 16.683 -10.970 -12.022 1.00 0.00 C ATOM 1835 CG1 VAL A 116 16.919 -10.562 -13.467 1.00 0.00 C ATOM 1836 CG2 VAL A 116 15.198 -11.143 -11.744 1.00 0.00 C ATOM 0 H VAL A 116 16.007 -13.695 -12.218 1.00 0.00 H new ATOM 0 HA VAL A 116 18.499 -12.144 -11.964 1.00 0.00 H new ATOM 0 HB VAL A 116 17.058 -10.174 -11.379 1.00 0.00 H new ATOM 0 HG11 VAL A 116 16.368 -9.646 -13.681 1.00 0.00 H new ATOM 0 HG12 VAL A 116 17.984 -10.392 -13.628 1.00 0.00 H new ATOM 0 HG13 VAL A 116 16.574 -11.356 -14.130 1.00 0.00 H new ATOM 0 HG21 VAL A 116 14.673 -10.218 -11.983 1.00 0.00 H new ATOM 0 HG22 VAL A 116 14.805 -11.953 -12.358 1.00 0.00 H new ATOM 0 HG23 VAL A 116 15.050 -11.382 -10.691 1.00 0.00 H new ATOM 1846 N GLU A 117 17.811 -11.553 -9.408 1.00 0.00 N ATOM 1847 CA GLU A 117 17.782 -11.658 -7.954 1.00 0.00 C ATOM 1848 C GLU A 117 16.422 -11.237 -7.409 1.00 0.00 C ATOM 1849 O GLU A 117 15.838 -10.257 -7.870 1.00 0.00 O ATOM 1850 CB GLU A 117 18.874 -10.779 -7.339 1.00 0.00 C ATOM 1851 CG GLU A 117 20.243 -10.981 -7.968 1.00 0.00 C ATOM 1852 CD GLU A 117 21.353 -10.326 -7.171 1.00 0.00 C ATOM 1853 OE1 GLU A 117 21.228 -10.251 -5.929 1.00 0.00 O ATOM 1854 OE2 GLU A 117 22.347 -9.887 -7.786 1.00 0.00 O ATOM 0 H GLU A 117 18.209 -10.681 -9.758 1.00 0.00 H new ATOM 0 HA GLU A 117 17.961 -12.699 -7.685 1.00 0.00 H new ATOM 0 HB2 GLU A 117 18.587 -9.732 -7.441 1.00 0.00 H new ATOM 0 HB3 GLU A 117 18.939 -10.989 -6.271 1.00 0.00 H new ATOM 0 HG2 GLU A 117 20.445 -12.049 -8.055 1.00 0.00 H new ATOM 0 HG3 GLU A 117 20.238 -10.574 -8.979 1.00 0.00 H new ATOM 1861 N LYS A 118 15.927 -11.971 -6.419 1.00 0.00 N ATOM 1862 CA LYS A 118 14.642 -11.648 -5.816 1.00 0.00 C ATOM 1863 C LYS A 118 14.696 -10.272 -5.179 1.00 0.00 C ATOM 1864 O LYS A 118 15.771 -9.685 -5.046 1.00 0.00 O ATOM 1865 CB LYS A 118 14.253 -12.687 -4.766 1.00 0.00 C ATOM 1866 CG LYS A 118 12.780 -13.059 -4.786 1.00 0.00 C ATOM 1867 CD LYS A 118 12.352 -13.713 -3.482 1.00 0.00 C ATOM 1868 CE LYS A 118 11.072 -13.097 -2.942 1.00 0.00 C ATOM 1869 NZ LYS A 118 10.267 -14.076 -2.160 1.00 0.00 N ATOM 0 H LYS A 118 16.392 -12.787 -6.020 1.00 0.00 H new ATOM 0 HA LYS A 118 13.888 -11.653 -6.603 1.00 0.00 H new ATOM 0 HB2 LYS A 118 14.847 -13.587 -4.922 1.00 0.00 H new ATOM 0 HB3 LYS A 118 14.508 -12.304 -3.778 1.00 0.00 H new ATOM 0 HG2 LYS A 118 12.180 -12.165 -4.960 1.00 0.00 H new ATOM 0 HG3 LYS A 118 12.587 -13.739 -5.616 1.00 0.00 H new ATOM 0 HD2 LYS A 118 12.204 -14.781 -3.641 1.00 0.00 H new ATOM 0 HD3 LYS A 118 13.147 -13.608 -2.744 1.00 0.00 H new ATOM 0 HE2 LYS A 118 11.319 -12.244 -2.310 1.00 0.00 H new ATOM 0 HE3 LYS A 118 10.475 -12.717 -3.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 9.420 -13.606 -1.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 9.980 -14.862 -2.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 10.838 -14.445 -1.373 1.00 0.00 H new ATOM 1883 N ASN A 119 13.530 -9.769 -4.786 1.00 0.00 N ATOM 1884 CA ASN A 119 13.409 -8.453 -4.157 1.00 0.00 C ATOM 1885 C ASN A 119 14.513 -7.505 -4.623 1.00 0.00 C ATOM 1886 O ASN A 119 15.095 -6.765 -3.829 1.00 0.00 O ATOM 1887 CB ASN A 119 13.431 -8.596 -2.634 1.00 0.00 C ATOM 1888 CG ASN A 119 14.818 -8.886 -2.089 1.00 0.00 C ATOM 1889 OD1 ASN A 119 15.547 -7.975 -1.699 1.00 0.00 O ATOM 1890 ND2 ASN A 119 15.188 -10.161 -2.061 1.00 0.00 N ATOM 0 H ASN A 119 12.642 -10.259 -4.893 1.00 0.00 H new ATOM 0 HA ASN A 119 12.456 -8.020 -4.460 1.00 0.00 H new ATOM 0 HB2 ASN A 119 13.053 -7.679 -2.182 1.00 0.00 H new ATOM 0 HB3 ASN A 119 12.755 -9.399 -2.339 1.00 0.00 H new ATOM 0 HD21 ASN A 119 16.109 -10.417 -1.706 1.00 0.00 H new ATOM 0 HD22 ASN A 119 14.551 -10.884 -2.395 1.00 0.00 H new ATOM 1897 N SER A 120 14.802 -7.555 -5.918 1.00 0.00 N ATOM 1898 CA SER A 120 15.845 -6.725 -6.510 1.00 0.00 C ATOM 1899 C SER A 120 15.248 -5.664 -7.432 1.00 0.00 C ATOM 1900 O SER A 120 14.718 -5.982 -8.495 1.00 0.00 O ATOM 1901 CB SER A 120 16.831 -7.610 -7.284 1.00 0.00 C ATOM 1902 OG SER A 120 16.423 -7.777 -8.632 1.00 0.00 O ATOM 0 H SER A 120 14.326 -8.165 -6.582 1.00 0.00 H new ATOM 0 HA SER A 120 16.374 -6.210 -5.708 1.00 0.00 H new ATOM 0 HB2 SER A 120 17.825 -7.163 -7.255 1.00 0.00 H new ATOM 0 HB3 SER A 120 16.906 -8.584 -6.801 1.00 0.00 H new ATOM 0 HG SER A 120 16.099 -8.692 -8.765 1.00 0.00 H new ATOM 1908 N ASN A 121 15.345 -4.403 -7.022 1.00 0.00 N ATOM 1909 CA ASN A 121 14.822 -3.301 -7.821 1.00 0.00 C ATOM 1910 C ASN A 121 15.560 -3.222 -9.152 1.00 0.00 C ATOM 1911 O ASN A 121 16.788 -3.304 -9.192 1.00 0.00 O ATOM 1912 CB ASN A 121 14.967 -1.979 -7.066 1.00 0.00 C ATOM 1913 CG ASN A 121 14.225 -1.986 -5.746 1.00 0.00 C ATOM 1914 OD1 ASN A 121 14.244 -2.976 -5.014 1.00 0.00 O ATOM 1915 ND2 ASN A 121 13.564 -0.878 -5.435 1.00 0.00 N ATOM 0 H ASN A 121 15.780 -4.120 -6.144 1.00 0.00 H new ATOM 0 HA ASN A 121 13.764 -3.482 -8.011 1.00 0.00 H new ATOM 0 HB2 ASN A 121 16.023 -1.781 -6.885 1.00 0.00 H new ATOM 0 HB3 ASN A 121 14.592 -1.166 -7.687 1.00 0.00 H new ATOM 0 HD21 ASN A 121 13.044 -0.823 -4.559 1.00 0.00 H new ATOM 0 HD22 ASN A 121 13.576 -0.081 -6.072 1.00 0.00 H new ATOM 1922 N GLN A 122 14.816 -3.074 -10.242 1.00 0.00 N ATOM 1923 CA GLN A 122 15.430 -3.001 -11.562 1.00 0.00 C ATOM 1924 C GLN A 122 14.944 -1.810 -12.365 1.00 0.00 C ATOM 1925 O GLN A 122 13.790 -1.404 -12.268 1.00 0.00 O ATOM 1926 CB GLN A 122 15.180 -4.285 -12.352 1.00 0.00 C ATOM 1927 CG GLN A 122 15.535 -5.550 -11.593 1.00 0.00 C ATOM 1928 CD GLN A 122 17.025 -5.835 -11.602 1.00 0.00 C ATOM 1929 OE1 GLN A 122 17.727 -5.502 -12.556 1.00 0.00 O ATOM 1930 NE2 GLN A 122 17.511 -6.455 -10.535 1.00 0.00 N ATOM 0 H GLN A 122 13.798 -3.003 -10.239 1.00 0.00 H new ATOM 0 HA GLN A 122 16.500 -2.877 -11.395 1.00 0.00 H new ATOM 0 HB2 GLN A 122 14.129 -4.326 -12.637 1.00 0.00 H new ATOM 0 HB3 GLN A 122 15.759 -4.251 -13.275 1.00 0.00 H new ATOM 0 HG2 GLN A 122 15.192 -5.460 -10.562 1.00 0.00 H new ATOM 0 HG3 GLN A 122 15.004 -6.395 -12.033 1.00 0.00 H new ATOM 0 HE21 GLN A 122 16.890 -6.712 -9.768 1.00 0.00 H new ATOM 0 HE22 GLN A 122 18.506 -6.675 -10.482 1.00 0.00 H new ATOM 1939 N LEU A 123 15.838 -1.277 -13.184 1.00 0.00 N ATOM 1940 CA LEU A 123 15.512 -0.146 -14.040 1.00 0.00 C ATOM 1941 C LEU A 123 14.608 -0.613 -15.169 1.00 0.00 C ATOM 1942 O LEU A 123 15.016 -1.414 -16.011 1.00 0.00 O ATOM 1943 CB LEU A 123 16.788 0.481 -14.608 1.00 0.00 C ATOM 1944 CG LEU A 123 16.573 1.736 -15.457 1.00 0.00 C ATOM 1945 CD1 LEU A 123 17.470 2.868 -14.979 1.00 0.00 C ATOM 1946 CD2 LEU A 123 16.829 1.436 -16.927 1.00 0.00 C ATOM 0 H LEU A 123 16.798 -1.611 -13.274 1.00 0.00 H new ATOM 0 HA LEU A 123 14.993 0.610 -13.451 1.00 0.00 H new ATOM 0 HB2 LEU A 123 17.451 0.731 -13.780 1.00 0.00 H new ATOM 0 HB3 LEU A 123 17.302 -0.265 -15.214 1.00 0.00 H new ATOM 0 HG LEU A 123 15.536 2.051 -15.345 1.00 0.00 H new ATOM 0 HD11 LEU A 123 17.302 3.751 -15.596 1.00 0.00 H new ATOM 0 HD12 LEU A 123 17.238 3.102 -13.940 1.00 0.00 H new ATOM 0 HD13 LEU A 123 18.514 2.564 -15.058 1.00 0.00 H new ATOM 0 HD21 LEU A 123 16.671 2.340 -17.516 1.00 0.00 H new ATOM 0 HD22 LEU A 123 17.856 1.094 -17.055 1.00 0.00 H new ATOM 0 HD23 LEU A 123 16.143 0.659 -17.265 1.00 0.00 H new ATOM 1958 N LEU A 124 13.368 -0.137 -15.168 1.00 0.00 N ATOM 1959 CA LEU A 124 12.400 -0.539 -16.181 1.00 0.00 C ATOM 1960 C LEU A 124 12.986 -0.515 -17.582 1.00 0.00 C ATOM 1961 O LEU A 124 13.937 0.209 -17.876 1.00 0.00 O ATOM 1962 CB LEU A 124 11.154 0.339 -16.140 1.00 0.00 C ATOM 1963 CG LEU A 124 11.281 1.677 -16.867 1.00 0.00 C ATOM 1964 CD1 LEU A 124 9.973 2.447 -16.801 1.00 0.00 C ATOM 1965 CD2 LEU A 124 12.423 2.490 -16.280 1.00 0.00 C ATOM 0 H LEU A 124 13.010 0.525 -14.480 1.00 0.00 H new ATOM 0 HA LEU A 124 12.124 -1.566 -15.943 1.00 0.00 H new ATOM 0 HB2 LEU A 124 10.323 -0.216 -16.575 1.00 0.00 H new ATOM 0 HB3 LEU A 124 10.898 0.532 -15.098 1.00 0.00 H new ATOM 0 HG LEU A 124 11.504 1.484 -17.916 1.00 0.00 H new ATOM 0 HD11 LEU A 124 10.083 3.397 -17.324 1.00 0.00 H new ATOM 0 HD12 LEU A 124 9.183 1.863 -17.272 1.00 0.00 H new ATOM 0 HD13 LEU A 124 9.713 2.635 -15.759 1.00 0.00 H new ATOM 0 HD21 LEU A 124 12.502 3.441 -16.808 1.00 0.00 H new ATOM 0 HD22 LEU A 124 12.231 2.676 -15.223 1.00 0.00 H new ATOM 0 HD23 LEU A 124 13.356 1.937 -16.388 1.00 0.00 H new ATOM 1977 N SER A 125 12.379 -1.315 -18.431 1.00 0.00 N ATOM 1978 CA SER A 125 12.770 -1.430 -19.828 1.00 0.00 C ATOM 1979 C SER A 125 11.557 -1.222 -20.723 1.00 0.00 C ATOM 1980 O SER A 125 10.428 -1.485 -20.309 1.00 0.00 O ATOM 1981 CB SER A 125 13.408 -2.796 -20.102 1.00 0.00 C ATOM 1982 OG SER A 125 13.526 -3.555 -18.910 1.00 0.00 O ATOM 0 H SER A 125 11.593 -1.911 -18.174 1.00 0.00 H new ATOM 0 HA SER A 125 13.510 -0.660 -20.048 1.00 0.00 H new ATOM 0 HB2 SER A 125 12.805 -3.343 -20.827 1.00 0.00 H new ATOM 0 HB3 SER A 125 14.393 -2.657 -20.547 1.00 0.00 H new ATOM 0 HG SER A 125 13.934 -4.422 -19.114 1.00 0.00 H new ATOM 1988 N GLN A 126 11.776 -0.761 -21.947 1.00 0.00 N ATOM 1989 CA GLN A 126 10.669 -0.542 -22.867 1.00 0.00 C ATOM 1990 C GLN A 126 10.101 -1.883 -23.316 1.00 0.00 C ATOM 1991 O GLN A 126 10.774 -2.662 -23.989 1.00 0.00 O ATOM 1992 CB GLN A 126 11.131 0.273 -24.079 1.00 0.00 C ATOM 1993 CG GLN A 126 10.073 0.420 -25.165 1.00 0.00 C ATOM 1994 CD GLN A 126 8.696 0.742 -24.614 1.00 0.00 C ATOM 1995 OE1 GLN A 126 8.648 1.557 -23.566 1.00 0.00 O flip ATOM 1996 NE2 GLN A 126 7.684 0.261 -25.125 1.00 0.00 N flip ATOM 0 H GLN A 126 12.697 -0.534 -22.322 1.00 0.00 H new ATOM 0 HA GLN A 126 9.890 0.021 -22.354 1.00 0.00 H new ATOM 0 HB2 GLN A 126 11.433 1.265 -23.743 1.00 0.00 H new ATOM 0 HB3 GLN A 126 12.014 -0.201 -24.508 1.00 0.00 H new ATOM 0 HG2 GLN A 126 10.375 1.208 -25.854 1.00 0.00 H new ATOM 0 HG3 GLN A 126 10.021 -0.504 -25.741 1.00 0.00 H new ATOM 0 HE21 GLN A 126 7.765 -0.361 -25.929 1.00 0.00 H new ATOM 0 HE22 GLN A 126 6.765 0.485 -24.744 1.00 0.00 H new ATOM 2005 N GLY A 127 8.860 -2.151 -22.917 1.00 0.00 N ATOM 2006 CA GLY A 127 8.226 -3.402 -23.267 1.00 0.00 C ATOM 2007 C GLY A 127 8.859 -4.583 -22.554 1.00 0.00 C ATOM 2008 O GLY A 127 8.846 -5.705 -23.062 1.00 0.00 O ATOM 0 H GLY A 127 8.285 -1.521 -22.357 1.00 0.00 H new ATOM 0 HA2 GLY A 127 7.166 -3.353 -23.016 1.00 0.00 H new ATOM 0 HA3 GLY A 127 8.292 -3.552 -24.345 1.00 0.00 H new ATOM 2012 N ASP A 128 9.423 -4.324 -21.377 1.00 0.00 N ATOM 2013 CA ASP A 128 10.075 -5.359 -20.588 1.00 0.00 C ATOM 2014 C ASP A 128 9.113 -6.488 -20.243 1.00 0.00 C ATOM 2015 O ASP A 128 7.896 -6.317 -20.274 1.00 0.00 O ATOM 2016 CB ASP A 128 10.652 -4.764 -19.301 1.00 0.00 C ATOM 2017 CG ASP A 128 11.300 -5.808 -18.413 1.00 0.00 C ATOM 2018 OD1 ASP A 128 12.201 -6.524 -18.897 1.00 0.00 O ATOM 2019 OD2 ASP A 128 10.907 -5.909 -17.231 1.00 0.00 O ATOM 0 H ASP A 128 9.440 -3.399 -20.949 1.00 0.00 H new ATOM 0 HA ASP A 128 10.883 -5.771 -21.192 1.00 0.00 H new ATOM 0 HB2 ASP A 128 11.389 -4.002 -19.556 1.00 0.00 H new ATOM 0 HB3 ASP A 128 9.856 -4.265 -18.747 1.00 0.00 H new ATOM 2024 N GLU A 129 9.678 -7.644 -19.909 1.00 0.00 N ATOM 2025 CA GLU A 129 8.878 -8.808 -19.549 1.00 0.00 C ATOM 2026 C GLU A 129 9.588 -9.653 -18.487 1.00 0.00 C ATOM 2027 O GLU A 129 10.784 -9.923 -18.595 1.00 0.00 O ATOM 2028 CB GLU A 129 8.583 -9.644 -20.806 1.00 0.00 C ATOM 2029 CG GLU A 129 8.627 -11.152 -20.591 1.00 0.00 C ATOM 2030 CD GLU A 129 8.144 -11.928 -21.801 1.00 0.00 C ATOM 2031 OE1 GLU A 129 7.453 -11.329 -22.653 1.00 0.00 O ATOM 2032 OE2 GLU A 129 8.456 -13.133 -21.899 1.00 0.00 O ATOM 0 H GLU A 129 10.686 -7.799 -19.880 1.00 0.00 H new ATOM 0 HA GLU A 129 7.935 -8.467 -19.123 1.00 0.00 H new ATOM 0 HB2 GLU A 129 7.597 -9.373 -21.183 1.00 0.00 H new ATOM 0 HB3 GLU A 129 9.304 -9.380 -21.579 1.00 0.00 H new ATOM 0 HG2 GLU A 129 9.648 -11.452 -20.355 1.00 0.00 H new ATOM 0 HG3 GLU A 129 8.012 -11.410 -19.729 1.00 0.00 H new ATOM 2039 N ILE A 130 8.838 -10.081 -17.474 1.00 0.00 N ATOM 2040 CA ILE A 130 9.390 -10.908 -16.409 1.00 0.00 C ATOM 2041 C ILE A 130 8.864 -12.331 -16.525 1.00 0.00 C ATOM 2042 O ILE A 130 7.659 -12.548 -16.635 1.00 0.00 O ATOM 2043 CB ILE A 130 9.046 -10.357 -15.010 1.00 0.00 C ATOM 2044 CG1 ILE A 130 9.049 -8.828 -15.021 1.00 0.00 C ATOM 2045 CG2 ILE A 130 10.021 -10.885 -13.973 1.00 0.00 C ATOM 2046 CD1 ILE A 130 7.667 -8.222 -15.136 1.00 0.00 C ATOM 0 H ILE A 130 7.846 -9.867 -17.370 1.00 0.00 H new ATOM 0 HA ILE A 130 10.474 -10.896 -16.523 1.00 0.00 H new ATOM 0 HB ILE A 130 8.045 -10.697 -14.743 1.00 0.00 H new ATOM 0 HG12 ILE A 130 9.520 -8.467 -14.107 1.00 0.00 H new ATOM 0 HG13 ILE A 130 9.660 -8.480 -15.854 1.00 0.00 H new ATOM 0 HG21 ILE A 130 9.762 -10.485 -12.993 1.00 0.00 H new ATOM 0 HG22 ILE A 130 9.969 -11.973 -13.946 1.00 0.00 H new ATOM 0 HG23 ILE A 130 11.033 -10.576 -14.235 1.00 0.00 H new ATOM 0 HD11 ILE A 130 7.745 -7.135 -15.138 1.00 0.00 H new ATOM 0 HD12 ILE A 130 7.200 -8.554 -16.064 1.00 0.00 H new ATOM 0 HD13 ILE A 130 7.058 -8.541 -14.290 1.00 0.00 H new ATOM 2058 N THR A 131 9.768 -13.296 -16.505 1.00 0.00 N ATOM 2059 CA THR A 131 9.385 -14.698 -16.616 1.00 0.00 C ATOM 2060 C THR A 131 9.434 -15.373 -15.251 1.00 0.00 C ATOM 2061 O THR A 131 10.289 -15.063 -14.425 1.00 0.00 O ATOM 2062 CB THR A 131 10.299 -15.449 -17.608 1.00 0.00 C ATOM 2063 OG1 THR A 131 10.075 -14.968 -18.938 1.00 0.00 O ATOM 2064 CG2 THR A 131 10.050 -16.949 -17.563 1.00 0.00 C ATOM 0 H THR A 131 10.771 -13.137 -16.413 1.00 0.00 H new ATOM 0 HA THR A 131 8.364 -14.735 -16.995 1.00 0.00 H new ATOM 0 HB THR A 131 11.333 -15.263 -17.317 1.00 0.00 H new ATOM 0 HG1 THR A 131 10.659 -15.447 -19.562 1.00 0.00 H new ATOM 0 HG21 THR A 131 10.709 -17.449 -18.273 1.00 0.00 H new ATOM 0 HG22 THR A 131 10.250 -17.321 -16.558 1.00 0.00 H new ATOM 0 HG23 THR A 131 9.012 -17.154 -17.826 1.00 0.00 H new ATOM 2072 N VAL A 132 8.493 -16.278 -15.004 1.00 0.00 N ATOM 2073 CA VAL A 132 8.428 -16.963 -13.722 1.00 0.00 C ATOM 2074 C VAL A 132 8.053 -18.437 -13.866 1.00 0.00 C ATOM 2075 O VAL A 132 7.457 -18.845 -14.863 1.00 0.00 O ATOM 2076 CB VAL A 132 7.417 -16.271 -12.789 1.00 0.00 C ATOM 2077 CG1 VAL A 132 7.674 -14.771 -12.749 1.00 0.00 C ATOM 2078 CG2 VAL A 132 5.985 -16.555 -13.228 1.00 0.00 C ATOM 0 H VAL A 132 7.771 -16.552 -15.670 1.00 0.00 H new ATOM 0 HA VAL A 132 9.428 -16.911 -13.291 1.00 0.00 H new ATOM 0 HB VAL A 132 7.549 -16.675 -11.785 1.00 0.00 H new ATOM 0 HG11 VAL A 132 6.952 -14.296 -12.086 1.00 0.00 H new ATOM 0 HG12 VAL A 132 8.683 -14.584 -12.381 1.00 0.00 H new ATOM 0 HG13 VAL A 132 7.572 -14.357 -13.752 1.00 0.00 H new ATOM 0 HG21 VAL A 132 5.291 -16.055 -12.552 1.00 0.00 H new ATOM 0 HG22 VAL A 132 5.835 -16.184 -14.242 1.00 0.00 H new ATOM 0 HG23 VAL A 132 5.803 -17.630 -13.204 1.00 0.00 H new ATOM 2088 N GLY A 133 8.400 -19.222 -12.851 1.00 0.00 N ATOM 2089 CA GLY A 133 8.091 -20.636 -12.856 1.00 0.00 C ATOM 2090 C GLY A 133 8.886 -21.390 -13.893 1.00 0.00 C ATOM 2091 O GLY A 133 8.348 -22.224 -14.619 1.00 0.00 O ATOM 0 H GLY A 133 8.894 -18.898 -12.019 1.00 0.00 H new ATOM 0 HA2 GLY A 133 8.295 -21.054 -11.870 1.00 0.00 H new ATOM 0 HA3 GLY A 133 7.027 -20.773 -13.047 1.00 0.00 H new ATOM 2095 N VAL A 134 10.170 -21.082 -13.972 1.00 0.00 N ATOM 2096 CA VAL A 134 11.044 -21.715 -14.936 1.00 0.00 C ATOM 2097 C VAL A 134 11.487 -23.102 -14.489 1.00 0.00 C ATOM 2098 O VAL A 134 11.518 -23.414 -13.299 1.00 0.00 O ATOM 2099 CB VAL A 134 12.269 -20.835 -15.226 1.00 0.00 C ATOM 2100 CG1 VAL A 134 13.247 -21.541 -16.157 1.00 0.00 C ATOM 2101 CG2 VAL A 134 11.813 -19.514 -15.820 1.00 0.00 C ATOM 0 H VAL A 134 10.629 -20.393 -13.375 1.00 0.00 H new ATOM 0 HA VAL A 134 10.468 -21.834 -15.853 1.00 0.00 H new ATOM 0 HB VAL A 134 12.794 -20.644 -14.290 1.00 0.00 H new ATOM 0 HG11 VAL A 134 14.104 -20.893 -16.344 1.00 0.00 H new ATOM 0 HG12 VAL A 134 13.587 -22.467 -15.693 1.00 0.00 H new ATOM 0 HG13 VAL A 134 12.751 -21.768 -17.101 1.00 0.00 H new ATOM 0 HG21 VAL A 134 12.682 -18.889 -16.026 1.00 0.00 H new ATOM 0 HG22 VAL A 134 11.271 -19.700 -16.747 1.00 0.00 H new ATOM 0 HG23 VAL A 134 11.158 -19.004 -15.113 1.00 0.00 H new ATOM 2111 N GLY A 135 11.812 -23.929 -15.473 1.00 0.00 N ATOM 2112 CA GLY A 135 12.233 -25.284 -15.225 1.00 0.00 C ATOM 2113 C GLY A 135 11.877 -26.175 -16.393 1.00 0.00 C ATOM 2114 O GLY A 135 12.678 -26.998 -16.836 1.00 0.00 O ATOM 0 H GLY A 135 11.789 -23.672 -16.460 1.00 0.00 H new ATOM 0 HA2 GLY A 135 13.309 -25.311 -15.055 1.00 0.00 H new ATOM 0 HA3 GLY A 135 11.758 -25.658 -14.318 1.00 0.00 H new ATOM 2118 N VAL A 136 10.666 -25.979 -16.906 1.00 0.00 N ATOM 2119 CA VAL A 136 10.172 -26.721 -18.042 1.00 0.00 C ATOM 2120 C VAL A 136 9.686 -25.757 -19.118 1.00 0.00 C ATOM 2121 O VAL A 136 8.955 -24.810 -18.828 1.00 0.00 O ATOM 2122 CB VAL A 136 9.025 -27.669 -17.647 1.00 0.00 C ATOM 2123 CG1 VAL A 136 8.584 -28.506 -18.839 1.00 0.00 C ATOM 2124 CG2 VAL A 136 9.442 -28.559 -16.487 1.00 0.00 C ATOM 0 H VAL A 136 10.004 -25.296 -16.538 1.00 0.00 H new ATOM 0 HA VAL A 136 10.994 -27.325 -18.426 1.00 0.00 H new ATOM 0 HB VAL A 136 8.177 -27.065 -17.325 1.00 0.00 H new ATOM 0 HG11 VAL A 136 7.773 -29.169 -18.538 1.00 0.00 H new ATOM 0 HG12 VAL A 136 8.238 -27.849 -19.637 1.00 0.00 H new ATOM 0 HG13 VAL A 136 9.424 -29.101 -19.197 1.00 0.00 H new ATOM 0 HG21 VAL A 136 8.618 -29.222 -16.222 1.00 0.00 H new ATOM 0 HG22 VAL A 136 10.307 -29.154 -16.778 1.00 0.00 H new ATOM 0 HG23 VAL A 136 9.700 -27.940 -15.628 1.00 0.00 H new ATOM 2134 N GLU A 137 10.102 -25.989 -20.357 1.00 0.00 N ATOM 2135 CA GLU A 137 9.714 -25.124 -21.467 1.00 0.00 C ATOM 2136 C GLU A 137 8.202 -24.924 -21.515 1.00 0.00 C ATOM 2137 O GLU A 137 7.719 -23.854 -21.887 1.00 0.00 O ATOM 2138 CB GLU A 137 10.204 -25.715 -22.791 1.00 0.00 C ATOM 2139 CG GLU A 137 9.861 -24.863 -24.002 1.00 0.00 C ATOM 2140 CD GLU A 137 10.427 -23.459 -23.906 1.00 0.00 C ATOM 2141 OE1 GLU A 137 11.434 -23.274 -23.190 1.00 0.00 O ATOM 2142 OE2 GLU A 137 9.864 -22.547 -24.546 1.00 0.00 O ATOM 0 H GLU A 137 10.707 -26.767 -20.619 1.00 0.00 H new ATOM 0 HA GLU A 137 10.179 -24.151 -21.311 1.00 0.00 H new ATOM 0 HB2 GLU A 137 11.285 -25.845 -22.743 1.00 0.00 H new ATOM 0 HB3 GLU A 137 9.769 -26.706 -22.920 1.00 0.00 H new ATOM 0 HG2 GLU A 137 10.245 -25.345 -24.901 1.00 0.00 H new ATOM 0 HG3 GLU A 137 8.778 -24.808 -24.108 1.00 0.00 H new ATOM 2149 N SER A 138 7.459 -25.962 -21.149 1.00 0.00 N ATOM 2150 CA SER A 138 6.008 -25.906 -21.164 1.00 0.00 C ATOM 2151 C SER A 138 5.428 -25.517 -19.802 1.00 0.00 C ATOM 2152 O SER A 138 4.212 -25.553 -19.615 1.00 0.00 O ATOM 2153 CB SER A 138 5.433 -27.253 -21.605 1.00 0.00 C ATOM 2154 OG SER A 138 4.017 -27.241 -21.563 1.00 0.00 O ATOM 0 H SER A 138 7.842 -26.854 -20.838 1.00 0.00 H new ATOM 0 HA SER A 138 5.724 -25.132 -21.876 1.00 0.00 H new ATOM 0 HB2 SER A 138 5.768 -27.481 -22.617 1.00 0.00 H new ATOM 0 HB3 SER A 138 5.813 -28.044 -20.958 1.00 0.00 H new ATOM 0 HG SER A 138 3.714 -26.533 -20.957 1.00 0.00 H new ATOM 2160 N ASP A 139 6.286 -25.159 -18.847 1.00 0.00 N ATOM 2161 CA ASP A 139 5.815 -24.790 -17.521 1.00 0.00 C ATOM 2162 C ASP A 139 6.340 -23.436 -17.073 1.00 0.00 C ATOM 2163 O ASP A 139 6.517 -23.186 -15.881 1.00 0.00 O ATOM 2164 CB ASP A 139 6.201 -25.853 -16.505 1.00 0.00 C ATOM 2165 CG ASP A 139 5.272 -25.873 -15.308 1.00 0.00 C ATOM 2166 OD1 ASP A 139 4.740 -24.801 -14.951 1.00 0.00 O ATOM 2167 OD2 ASP A 139 5.076 -26.962 -14.727 1.00 0.00 O ATOM 0 H ASP A 139 7.298 -25.118 -18.968 1.00 0.00 H new ATOM 0 HA ASP A 139 4.729 -24.717 -17.582 1.00 0.00 H new ATOM 0 HB2 ASP A 139 6.191 -26.831 -16.985 1.00 0.00 H new ATOM 0 HB3 ASP A 139 7.222 -25.674 -16.166 1.00 0.00 H new ATOM 2172 N ILE A 140 6.567 -22.568 -18.033 1.00 0.00 N ATOM 2173 CA ILE A 140 7.052 -21.228 -17.762 1.00 0.00 C ATOM 2174 C ILE A 140 5.957 -20.189 -17.975 1.00 0.00 C ATOM 2175 O ILE A 140 5.164 -20.276 -18.912 1.00 0.00 O ATOM 2176 CB ILE A 140 8.267 -20.846 -18.626 1.00 0.00 C ATOM 2177 CG1 ILE A 140 9.446 -21.778 -18.345 1.00 0.00 C ATOM 2178 CG2 ILE A 140 8.670 -19.401 -18.373 1.00 0.00 C ATOM 2179 CD1 ILE A 140 10.312 -22.042 -19.557 1.00 0.00 C ATOM 0 H ILE A 140 6.422 -22.768 -19.023 1.00 0.00 H new ATOM 0 HA ILE A 140 7.362 -21.235 -16.717 1.00 0.00 H new ATOM 0 HB ILE A 140 7.984 -20.952 -19.673 1.00 0.00 H new ATOM 0 HG12 ILE A 140 10.061 -21.344 -17.557 1.00 0.00 H new ATOM 0 HG13 ILE A 140 9.066 -22.727 -17.967 1.00 0.00 H new ATOM 0 HG21 ILE A 140 9.531 -19.149 -18.993 1.00 0.00 H new ATOM 0 HG22 ILE A 140 7.838 -18.742 -18.623 1.00 0.00 H new ATOM 0 HG23 ILE A 140 8.930 -19.275 -17.322 1.00 0.00 H new ATOM 0 HD11 ILE A 140 11.128 -22.711 -19.283 1.00 0.00 H new ATOM 0 HD12 ILE A 140 9.711 -22.505 -20.340 1.00 0.00 H new ATOM 0 HD13 ILE A 140 10.722 -21.101 -19.923 1.00 0.00 H new ATOM 2191 N LEU A 141 5.943 -19.206 -17.095 1.00 0.00 N ATOM 2192 CA LEU A 141 4.973 -18.117 -17.152 1.00 0.00 C ATOM 2193 C LEU A 141 5.695 -16.792 -17.372 1.00 0.00 C ATOM 2194 O LEU A 141 6.717 -16.527 -16.745 1.00 0.00 O ATOM 2195 CB LEU A 141 4.153 -18.062 -15.862 1.00 0.00 C ATOM 2196 CG LEU A 141 2.858 -18.877 -15.882 1.00 0.00 C ATOM 2197 CD1 LEU A 141 1.984 -18.460 -17.056 1.00 0.00 C ATOM 2198 CD2 LEU A 141 3.165 -20.365 -15.945 1.00 0.00 C ATOM 0 H LEU A 141 6.601 -19.135 -16.319 1.00 0.00 H new ATOM 0 HA LEU A 141 4.293 -18.296 -17.985 1.00 0.00 H new ATOM 0 HB2 LEU A 141 4.774 -18.416 -15.039 1.00 0.00 H new ATOM 0 HB3 LEU A 141 3.906 -17.022 -15.650 1.00 0.00 H new ATOM 0 HG LEU A 141 2.312 -18.679 -14.960 1.00 0.00 H new ATOM 0 HD11 LEU A 141 1.067 -19.050 -17.055 1.00 0.00 H new ATOM 0 HD12 LEU A 141 1.735 -17.403 -16.967 1.00 0.00 H new ATOM 0 HD13 LEU A 141 2.523 -18.629 -17.989 1.00 0.00 H new ATOM 0 HD21 LEU A 141 2.232 -20.929 -15.958 1.00 0.00 H new ATOM 0 HD22 LEU A 141 3.733 -20.581 -16.850 1.00 0.00 H new ATOM 0 HD23 LEU A 141 3.750 -20.653 -15.072 1.00 0.00 H new ATOM 2210 N SER A 142 5.178 -15.970 -18.279 1.00 0.00 N ATOM 2211 CA SER A 142 5.808 -14.690 -18.578 1.00 0.00 C ATOM 2212 C SER A 142 4.882 -13.503 -18.321 1.00 0.00 C ATOM 2213 O SER A 142 3.666 -13.586 -18.493 1.00 0.00 O ATOM 2214 CB SER A 142 6.294 -14.668 -20.021 1.00 0.00 C ATOM 2215 OG SER A 142 6.448 -15.980 -20.536 1.00 0.00 O ATOM 0 H SER A 142 4.332 -16.165 -18.815 1.00 0.00 H new ATOM 0 HA SER A 142 6.656 -14.588 -17.901 1.00 0.00 H new ATOM 0 HB2 SER A 142 5.585 -14.115 -20.637 1.00 0.00 H new ATOM 0 HB3 SER A 142 7.246 -14.139 -20.078 1.00 0.00 H new ATOM 0 HG SER A 142 6.759 -15.933 -21.464 1.00 0.00 H new ATOM 2221 N LEU A 143 5.493 -12.396 -17.913 1.00 0.00 N ATOM 2222 CA LEU A 143 4.788 -11.156 -17.625 1.00 0.00 C ATOM 2223 C LEU A 143 5.361 -10.036 -18.488 1.00 0.00 C ATOM 2224 O LEU A 143 6.549 -10.047 -18.803 1.00 0.00 O ATOM 2225 CB LEU A 143 4.946 -10.808 -16.145 1.00 0.00 C ATOM 2226 CG LEU A 143 4.530 -11.916 -15.178 1.00 0.00 C ATOM 2227 CD1 LEU A 143 5.744 -12.702 -14.708 1.00 0.00 C ATOM 2228 CD2 LEU A 143 3.784 -11.332 -13.991 1.00 0.00 C ATOM 0 H LEU A 143 6.501 -12.336 -17.772 1.00 0.00 H new ATOM 0 HA LEU A 143 3.728 -11.277 -17.850 1.00 0.00 H new ATOM 0 HB2 LEU A 143 5.989 -10.552 -15.956 1.00 0.00 H new ATOM 0 HB3 LEU A 143 4.355 -9.917 -15.931 1.00 0.00 H new ATOM 0 HG LEU A 143 3.863 -12.598 -15.705 1.00 0.00 H new ATOM 0 HD11 LEU A 143 5.426 -13.486 -14.021 1.00 0.00 H new ATOM 0 HD12 LEU A 143 6.241 -13.153 -15.567 1.00 0.00 H new ATOM 0 HD13 LEU A 143 6.437 -12.032 -14.199 1.00 0.00 H new ATOM 0 HD21 LEU A 143 3.495 -12.134 -13.312 1.00 0.00 H new ATOM 0 HD22 LEU A 143 4.430 -10.628 -13.466 1.00 0.00 H new ATOM 0 HD23 LEU A 143 2.891 -10.814 -14.341 1.00 0.00 H new ATOM 2240 N VAL A 144 4.527 -9.080 -18.884 1.00 0.00 N ATOM 2241 CA VAL A 144 4.993 -7.986 -19.721 1.00 0.00 C ATOM 2242 C VAL A 144 4.538 -6.635 -19.185 1.00 0.00 C ATOM 2243 O VAL A 144 3.409 -6.488 -18.722 1.00 0.00 O ATOM 2244 CB VAL A 144 4.492 -8.151 -21.164 1.00 0.00 C ATOM 2245 CG1 VAL A 144 5.122 -7.107 -22.074 1.00 0.00 C ATOM 2246 CG2 VAL A 144 4.785 -9.555 -21.672 1.00 0.00 C ATOM 0 H VAL A 144 3.537 -9.042 -18.641 1.00 0.00 H new ATOM 0 HA VAL A 144 6.082 -8.018 -19.708 1.00 0.00 H new ATOM 0 HB VAL A 144 3.412 -8.001 -21.172 1.00 0.00 H new ATOM 0 HG11 VAL A 144 4.754 -7.241 -23.091 1.00 0.00 H new ATOM 0 HG12 VAL A 144 4.858 -6.110 -21.721 1.00 0.00 H new ATOM 0 HG13 VAL A 144 6.206 -7.221 -22.062 1.00 0.00 H new ATOM 0 HG21 VAL A 144 4.423 -9.654 -22.695 1.00 0.00 H new ATOM 0 HG22 VAL A 144 5.860 -9.734 -21.648 1.00 0.00 H new ATOM 0 HG23 VAL A 144 4.282 -10.284 -21.037 1.00 0.00 H new ATOM 2256 N ILE A 145 5.424 -5.648 -19.258 1.00 0.00 N ATOM 2257 CA ILE A 145 5.112 -4.304 -18.787 1.00 0.00 C ATOM 2258 C ILE A 145 5.116 -3.308 -19.946 1.00 0.00 C ATOM 2259 O ILE A 145 5.964 -3.375 -20.835 1.00 0.00 O ATOM 2260 CB ILE A 145 6.099 -3.846 -17.686 1.00 0.00 C ATOM 2261 CG1 ILE A 145 5.334 -3.235 -16.508 1.00 0.00 C ATOM 2262 CG2 ILE A 145 7.117 -2.852 -18.234 1.00 0.00 C ATOM 2263 CD1 ILE A 145 5.315 -4.117 -15.278 1.00 0.00 C ATOM 0 H ILE A 145 6.364 -5.754 -19.639 1.00 0.00 H new ATOM 0 HA ILE A 145 4.112 -4.334 -18.354 1.00 0.00 H new ATOM 0 HB ILE A 145 6.644 -4.723 -17.336 1.00 0.00 H new ATOM 0 HG12 ILE A 145 5.784 -2.276 -16.251 1.00 0.00 H new ATOM 0 HG13 ILE A 145 4.308 -3.033 -16.817 1.00 0.00 H new ATOM 0 HG21 ILE A 145 7.796 -2.549 -17.437 1.00 0.00 H new ATOM 0 HG22 ILE A 145 7.686 -3.320 -19.037 1.00 0.00 H new ATOM 0 HG23 ILE A 145 6.598 -1.975 -18.621 1.00 0.00 H new ATOM 0 HD11 ILE A 145 4.756 -3.622 -14.484 1.00 0.00 H new ATOM 0 HD12 ILE A 145 4.838 -5.067 -15.519 1.00 0.00 H new ATOM 0 HD13 ILE A 145 6.337 -4.298 -14.944 1.00 0.00 H new ATOM 2275 N PHE A 146 4.160 -2.389 -19.926 1.00 0.00 N ATOM 2276 CA PHE A 146 4.042 -1.377 -20.970 1.00 0.00 C ATOM 2277 C PHE A 146 4.226 0.023 -20.394 1.00 0.00 C ATOM 2278 O PHE A 146 3.334 0.556 -19.733 1.00 0.00 O ATOM 2279 CB PHE A 146 2.679 -1.485 -21.660 1.00 0.00 C ATOM 2280 CG PHE A 146 2.480 -0.482 -22.761 1.00 0.00 C ATOM 2281 CD1 PHE A 146 2.074 0.811 -22.471 1.00 0.00 C ATOM 2282 CD2 PHE A 146 2.697 -0.832 -24.083 1.00 0.00 C ATOM 2283 CE1 PHE A 146 1.889 1.736 -23.482 1.00 0.00 C ATOM 2284 CE2 PHE A 146 2.513 0.088 -25.098 1.00 0.00 C ATOM 2285 CZ PHE A 146 2.109 1.374 -24.796 1.00 0.00 C ATOM 0 H PHE A 146 3.451 -2.323 -19.195 1.00 0.00 H new ATOM 0 HA PHE A 146 4.828 -1.553 -21.704 1.00 0.00 H new ATOM 0 HB2 PHE A 146 2.567 -2.489 -22.070 1.00 0.00 H new ATOM 0 HB3 PHE A 146 1.893 -1.356 -20.916 1.00 0.00 H new ATOM 0 HD1 PHE A 146 1.900 1.099 -21.445 1.00 0.00 H new ATOM 0 HD2 PHE A 146 3.014 -1.836 -24.324 1.00 0.00 H new ATOM 0 HE1 PHE A 146 1.573 2.741 -23.244 1.00 0.00 H new ATOM 0 HE2 PHE A 146 2.685 -0.198 -26.125 1.00 0.00 H new ATOM 0 HZ PHE A 146 1.965 2.095 -25.587 1.00 0.00 H new ATOM 2295 N ILE A 147 5.388 0.612 -20.650 1.00 0.00 N ATOM 2296 CA ILE A 147 5.694 1.949 -20.160 1.00 0.00 C ATOM 2297 C ILE A 147 5.471 2.999 -21.241 1.00 0.00 C ATOM 2298 O ILE A 147 5.949 2.856 -22.366 1.00 0.00 O ATOM 2299 CB ILE A 147 7.142 2.044 -19.672 1.00 0.00 C ATOM 2300 CG1 ILE A 147 7.481 0.860 -18.763 1.00 0.00 C ATOM 2301 CG2 ILE A 147 7.382 3.365 -18.956 1.00 0.00 C ATOM 2302 CD1 ILE A 147 8.157 -0.281 -19.489 1.00 0.00 C ATOM 0 H ILE A 147 6.135 0.183 -21.196 1.00 0.00 H new ATOM 0 HA ILE A 147 5.018 2.140 -19.326 1.00 0.00 H new ATOM 0 HB ILE A 147 7.801 2.006 -20.539 1.00 0.00 H new ATOM 0 HG12 ILE A 147 8.130 1.204 -17.958 1.00 0.00 H new ATOM 0 HG13 ILE A 147 6.565 0.494 -18.299 1.00 0.00 H new ATOM 0 HG21 ILE A 147 8.417 3.412 -18.617 1.00 0.00 H new ATOM 0 HG22 ILE A 147 7.186 4.191 -19.640 1.00 0.00 H new ATOM 0 HG23 ILE A 147 6.715 3.440 -18.097 1.00 0.00 H new ATOM 0 HD11 ILE A 147 8.369 -1.086 -18.785 1.00 0.00 H new ATOM 0 HD12 ILE A 147 7.500 -0.651 -20.276 1.00 0.00 H new ATOM 0 HD13 ILE A 147 9.090 0.070 -19.930 1.00 0.00 H new ATOM 2314 N ASN A 148 4.746 4.057 -20.894 1.00 0.00 N ATOM 2315 CA ASN A 148 4.466 5.130 -21.843 1.00 0.00 C ATOM 2316 C ASN A 148 5.560 6.194 -21.797 1.00 0.00 C ATOM 2317 O ASN A 148 5.969 6.634 -20.722 1.00 0.00 O ATOM 2318 CB ASN A 148 3.100 5.761 -21.551 1.00 0.00 C ATOM 2319 CG ASN A 148 3.101 6.608 -20.295 1.00 0.00 C ATOM 2320 OD1 ASN A 148 3.517 7.766 -20.314 1.00 0.00 O ATOM 2321 ND2 ASN A 148 2.634 6.035 -19.193 1.00 0.00 N ATOM 0 H ASN A 148 4.343 4.195 -19.967 1.00 0.00 H new ATOM 0 HA ASN A 148 4.446 4.701 -22.845 1.00 0.00 H new ATOM 0 HB2 ASN A 148 2.801 6.377 -22.399 1.00 0.00 H new ATOM 0 HB3 ASN A 148 2.354 4.972 -21.451 1.00 0.00 H new ATOM 0 HD21 ASN A 148 2.610 6.557 -18.317 1.00 0.00 H new ATOM 0 HD22 ASN A 148 2.299 5.072 -19.222 1.00 0.00 H new ATOM 2328 N ASP A 149 6.030 6.605 -22.971 1.00 0.00 N ATOM 2329 CA ASP A 149 7.076 7.617 -23.066 1.00 0.00 C ATOM 2330 C ASP A 149 6.571 8.981 -22.600 1.00 0.00 C ATOM 2331 O ASP A 149 7.362 9.860 -22.257 1.00 0.00 O ATOM 2332 CB ASP A 149 7.591 7.716 -24.503 1.00 0.00 C ATOM 2333 CG ASP A 149 6.466 7.834 -25.514 1.00 0.00 C ATOM 2334 OD1 ASP A 149 5.757 8.861 -25.494 1.00 0.00 O ATOM 2335 OD2 ASP A 149 6.295 6.898 -26.323 1.00 0.00 O ATOM 0 H ASP A 149 5.702 6.252 -23.870 1.00 0.00 H new ATOM 0 HA ASP A 149 7.893 7.314 -22.412 1.00 0.00 H new ATOM 0 HB2 ASP A 149 8.248 8.581 -24.592 1.00 0.00 H new ATOM 0 HB3 ASP A 149 8.191 6.835 -24.732 1.00 0.00 H new ATOM 2340 N LYS A 150 5.252 9.154 -22.589 1.00 0.00 N ATOM 2341 CA LYS A 150 4.651 10.411 -22.164 1.00 0.00 C ATOM 2342 C LYS A 150 5.085 10.760 -20.745 1.00 0.00 C ATOM 2343 O LYS A 150 5.410 11.910 -20.448 1.00 0.00 O ATOM 2344 CB LYS A 150 3.125 10.325 -22.243 1.00 0.00 C ATOM 2345 CG LYS A 150 2.523 11.204 -23.327 1.00 0.00 C ATOM 2346 CD LYS A 150 2.268 10.419 -24.604 1.00 0.00 C ATOM 2347 CE LYS A 150 1.329 11.165 -25.538 1.00 0.00 C ATOM 2348 NZ LYS A 150 2.061 11.799 -26.670 1.00 0.00 N ATOM 0 H LYS A 150 4.581 8.439 -22.870 1.00 0.00 H new ATOM 0 HA LYS A 150 4.993 11.199 -22.835 1.00 0.00 H new ATOM 0 HB2 LYS A 150 2.836 9.290 -22.424 1.00 0.00 H new ATOM 0 HB3 LYS A 150 2.703 10.610 -21.279 1.00 0.00 H new ATOM 0 HG2 LYS A 150 1.587 11.634 -22.970 1.00 0.00 H new ATOM 0 HG3 LYS A 150 3.196 12.035 -23.538 1.00 0.00 H new ATOM 0 HD2 LYS A 150 3.214 10.231 -25.112 1.00 0.00 H new ATOM 0 HD3 LYS A 150 1.840 9.448 -24.356 1.00 0.00 H new ATOM 0 HE2 LYS A 150 0.582 10.475 -25.930 1.00 0.00 H new ATOM 0 HE3 LYS A 150 0.792 11.931 -24.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 1.386 12.298 -27.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 2.756 12.477 -26.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 2.552 11.066 -27.220 1.00 0.00 H new ATOM 2362 N PHE A 151 5.089 9.756 -19.877 1.00 0.00 N ATOM 2363 CA PHE A 151 5.485 9.945 -18.490 1.00 0.00 C ATOM 2364 C PHE A 151 6.911 10.474 -18.403 1.00 0.00 C ATOM 2365 O PHE A 151 7.204 11.378 -17.620 1.00 0.00 O ATOM 2366 CB PHE A 151 5.370 8.628 -17.723 1.00 0.00 C ATOM 2367 CG PHE A 151 5.399 8.794 -16.231 1.00 0.00 C ATOM 2368 CD1 PHE A 151 6.602 8.784 -15.543 1.00 0.00 C ATOM 2369 CD2 PHE A 151 4.225 8.963 -15.517 1.00 0.00 C ATOM 2370 CE1 PHE A 151 6.632 8.938 -14.170 1.00 0.00 C ATOM 2371 CE2 PHE A 151 4.248 9.118 -14.144 1.00 0.00 C ATOM 2372 CZ PHE A 151 5.453 9.105 -13.469 1.00 0.00 C ATOM 0 H PHE A 151 4.821 8.800 -20.112 1.00 0.00 H new ATOM 0 HA PHE A 151 4.815 10.678 -18.041 1.00 0.00 H new ATOM 0 HB2 PHE A 151 4.441 8.133 -18.007 1.00 0.00 H new ATOM 0 HB3 PHE A 151 6.186 7.971 -18.023 1.00 0.00 H new ATOM 0 HD1 PHE A 151 7.527 8.654 -16.086 1.00 0.00 H new ATOM 0 HD2 PHE A 151 3.280 8.974 -16.039 1.00 0.00 H new ATOM 0 HE1 PHE A 151 7.576 8.928 -13.645 1.00 0.00 H new ATOM 0 HE2 PHE A 151 3.325 9.249 -13.599 1.00 0.00 H new ATOM 0 HZ PHE A 151 5.474 9.225 -12.396 1.00 0.00 H new