USER MOD reduce.3.24.130724 H: found=0, std=0, add=1074, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1074 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 148 MET CE :methyl -166:sc= -0.0138 (180deg=-0.245) USER MOD Set 1.2: A 156 CYS SG : rot 4:sc= 0.849 USER MOD Set 2.1: A 91 CYS SG : rot -160:sc= -2.35! USER MOD Set 2.2: A 93 THR OG1 : rot 93:sc= 0.741 USER MOD Set 3.1: A 67 HIS : no HE2:sc= -0.327 K(o=-1.7,f=-3.2) USER MOD Set 3.2: A 98 CYS SG : rot -30:sc= -0.639! USER MOD Set 3.3: A 101 CYS SG : rot -129:sc= -0.728 USER MOD Set 4.1: A 38 HIS : no HD1:sc= -0.197 K(o=-4.2,f=-6) USER MOD Set 4.2: A 85 GLN : amide:sc= -4.05! C(o=-4.2!,f=-5.6!) USER MOD Single : A 31 CYS SG : rot 180:sc= -2.13! USER MOD Single : A 32 TYR OH : rot 50:sc= -1.63 USER MOD Single : A 37 MET CE :methyl 159:sc= -1.53 (180deg=-3.39!) USER MOD Single : A 39 ASN : amide:sc= -6.9! C(o=-6.9!,f=-9.8!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.0114 USER MOD Single : A 71 CYS SG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.135 USER MOD Single : A 94 SER OG : rot 180:sc= -0.223 USER MOD Single : A 96 SER OG : rot 180:sc= -3.28! USER MOD Single : A 100 SER OG : rot 76:sc= -0.134 USER MOD Single : A 103 GLN :FLIP amide:sc= 0 F(o=-1.2!,f=0) USER MOD Single : A 105 MET CE :methyl -131:sc= -4.72! (180deg=-11.8!) USER MOD Single : A 107 LYS NZ :NH3+ 158:sc= -0.0291 (180deg=-0.444) USER MOD Single : A 110 SER OG : rot 180:sc= -0.722 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= -0.15 K(o=-0.15,f=-1) USER MOD Single : A 113 LYS NZ :NH3+ 152:sc= -0.0149 (180deg=-0.948) USER MOD Single : A 114 HIS : no HD1:sc= -6.89! C(o=-6.9!,f=-12!) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 CYS SG : rot 180:sc=-0.00519 USER MOD Single : A 121 THR OG1 : rot -150:sc= -0.299 USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 GLN : amide:sc= -0.664 X(o=-0.66,f=-0.48) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ -162:sc= -0.0207 (180deg=-0.366) USER MOD Single : A 146 SER OG : rot 62:sc= 0.977 USER MOD Single : A 149 THR OG1 : rot 180:sc= 0.0545 USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= -0.913! USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 159 THR OG1 : rot 94:sc= 1.25 USER MOD Single : A 163 HIS :FLIP no HD1:sc= -3.2! C(o=-4.1!,f=-3.2!) USER MOD Single : A 164 GLN :FLIP amide:sc= 1.12 F(o=-0.11,f=1.1) USER MOD Single : A 166 CYS SG : rot 173:sc= 0.456 USER MOD Single : A 169 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 177 HIS : no HD1:sc= -0.583 K(o=-0.58,f=-1.5) USER MOD Single : A 178 SER OG : rot 180:sc= -0.0134 USER MOD Single : A 179 GLN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 182 SER OG : rot 180:sc= 0.166 USER MOD Single : A 190 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 191 ASN : amide:sc= -5.9! C(o=-5.9!,f=-9.1!) USER MOD Single : A 192 GLN :FLIP amide:sc= -2.75! C(o=-3.6!,f=-2.7!) USER MOD Single : A 194 ASN : amide:sc= -0.733 K(o=-0.73,f=-2.6!) USER MOD ----------------------------------------------------------------- ATOM 489 N LEU A 30 3.842 -5.103 -5.266 1.00 0.00 N ATOM 490 CA LEU A 30 3.500 -4.283 -4.108 1.00 0.00 C ATOM 491 C LEU A 30 3.381 -5.166 -2.873 1.00 0.00 C ATOM 492 O LEU A 30 3.473 -6.389 -2.973 1.00 0.00 O ATOM 493 CB LEU A 30 2.183 -3.532 -4.353 1.00 0.00 C ATOM 494 CG LEU A 30 0.991 -4.510 -4.366 1.00 0.00 C ATOM 495 CD1 LEU A 30 0.224 -4.435 -3.037 1.00 0.00 C ATOM 496 CD2 LEU A 30 0.037 -4.133 -5.501 1.00 0.00 C ATOM 0 HA LEU A 30 4.289 -3.549 -3.948 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.036 -2.782 -3.575 1.00 0.00 H new ATOM 0 HB3 LEU A 30 2.233 -3.000 -5.303 1.00 0.00 H new ATOM 0 HG LEU A 30 1.372 -5.521 -4.509 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.615 -5.131 -3.061 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.891 -4.699 -2.216 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.150 -3.422 -2.889 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.806 -4.823 -5.512 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -0.327 -3.117 -5.348 1.00 0.00 H new ATOM 0 HD23 LEU A 30 0.564 -4.189 -6.453 1.00 0.00 H new ATOM 508 N CYS A 31 3.182 -4.553 -1.709 1.00 0.00 N ATOM 509 CA CYS A 31 3.056 -5.319 -0.473 1.00 0.00 C ATOM 510 C CYS A 31 1.766 -4.933 0.231 1.00 0.00 C ATOM 511 O CYS A 31 1.247 -3.836 0.026 1.00 0.00 O ATOM 512 CB CYS A 31 4.252 -5.042 0.438 1.00 0.00 C ATOM 513 SG CYS A 31 3.880 -5.613 2.114 1.00 0.00 S ATOM 0 H CYS A 31 3.105 -3.542 -1.596 1.00 0.00 H new ATOM 0 HA CYS A 31 3.034 -6.383 -0.708 1.00 0.00 H new ATOM 0 HB2 CYS A 31 5.138 -5.551 0.057 1.00 0.00 H new ATOM 0 HB3 CYS A 31 4.476 -3.975 0.447 1.00 0.00 H new ATOM 0 HG CYS A 31 4.898 -5.379 2.888 1.00 0.00 H new ATOM 519 N TYR A 32 1.236 -5.832 1.051 1.00 0.00 N ATOM 520 CA TYR A 32 -0.003 -5.534 1.746 1.00 0.00 C ATOM 521 C TYR A 32 -0.075 -6.303 3.057 1.00 0.00 C ATOM 522 O TYR A 32 0.153 -7.512 3.107 1.00 0.00 O ATOM 523 CB TYR A 32 -1.191 -5.858 0.813 1.00 0.00 C ATOM 524 CG TYR A 32 -2.097 -6.924 1.392 1.00 0.00 C ATOM 525 CD1 TYR A 32 -1.657 -8.249 1.498 1.00 0.00 C ATOM 526 CD2 TYR A 32 -3.382 -6.581 1.803 1.00 0.00 C ATOM 527 CE1 TYR A 32 -2.506 -9.228 2.019 1.00 0.00 C ATOM 528 CE2 TYR A 32 -4.237 -7.560 2.319 1.00 0.00 C ATOM 529 CZ TYR A 32 -3.799 -8.887 2.428 1.00 0.00 C ATOM 530 OH TYR A 32 -4.641 -9.855 2.933 1.00 0.00 O ATOM 0 H TYR A 32 1.635 -6.750 1.246 1.00 0.00 H new ATOM 0 HA TYR A 32 -0.046 -4.475 2.000 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -1.768 -4.951 0.634 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -0.812 -6.191 -0.153 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -0.661 -8.514 1.177 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -3.719 -5.558 1.723 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -2.164 -10.249 2.106 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -5.235 -7.293 2.634 1.00 0.00 H new ATOM 0 HH TYR A 32 -4.175 -10.363 3.630 1.00 0.00 H new ATOM 540 N GLU A 33 -0.379 -5.575 4.116 1.00 0.00 N ATOM 541 CA GLU A 33 -0.475 -6.148 5.440 1.00 0.00 C ATOM 542 C GLU A 33 -1.823 -5.820 6.044 1.00 0.00 C ATOM 543 O GLU A 33 -2.185 -4.652 6.173 1.00 0.00 O ATOM 544 CB GLU A 33 0.639 -5.556 6.290 1.00 0.00 C ATOM 545 CG GLU A 33 1.956 -6.201 5.879 1.00 0.00 C ATOM 546 CD GLU A 33 3.046 -5.867 6.890 1.00 0.00 C ATOM 547 OE1 GLU A 33 3.035 -6.454 7.959 1.00 0.00 O ATOM 548 OE2 GLU A 33 3.875 -5.027 6.582 1.00 0.00 O ATOM 0 H GLU A 33 -0.565 -4.573 4.080 1.00 0.00 H new ATOM 0 HA GLU A 33 -0.375 -7.232 5.394 1.00 0.00 H new ATOM 0 HB2 GLU A 33 0.687 -4.476 6.152 1.00 0.00 H new ATOM 0 HB3 GLU A 33 0.444 -5.734 7.347 1.00 0.00 H new ATOM 0 HG2 GLU A 33 1.833 -7.282 5.810 1.00 0.00 H new ATOM 0 HG3 GLU A 33 2.248 -5.849 4.890 1.00 0.00 H new ATOM 555 N VAL A 34 -2.577 -6.848 6.409 1.00 0.00 N ATOM 556 CA VAL A 34 -3.891 -6.621 6.985 1.00 0.00 C ATOM 557 C VAL A 34 -4.107 -7.423 8.251 1.00 0.00 C ATOM 558 O VAL A 34 -3.728 -8.589 8.346 1.00 0.00 O ATOM 559 CB VAL A 34 -4.987 -6.969 5.978 1.00 0.00 C ATOM 560 CG1 VAL A 34 -4.728 -8.345 5.359 1.00 0.00 C ATOM 561 CG2 VAL A 34 -6.340 -6.963 6.703 1.00 0.00 C ATOM 0 H VAL A 34 -2.307 -7.827 6.318 1.00 0.00 H new ATOM 0 HA VAL A 34 -3.943 -5.562 7.239 1.00 0.00 H new ATOM 0 HB VAL A 34 -4.992 -6.232 5.175 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -5.518 -8.577 4.644 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -3.766 -8.338 4.847 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -4.716 -9.101 6.144 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -7.132 -7.210 5.996 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -6.326 -7.701 7.505 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -6.523 -5.974 7.123 1.00 0.00 H new ATOM 571 N GLU A 35 -4.757 -6.780 9.214 1.00 0.00 N ATOM 572 CA GLU A 35 -5.071 -7.416 10.477 1.00 0.00 C ATOM 573 C GLU A 35 -6.574 -7.576 10.609 1.00 0.00 C ATOM 574 O GLU A 35 -7.343 -6.822 10.009 1.00 0.00 O ATOM 575 CB GLU A 35 -4.536 -6.579 11.638 1.00 0.00 C ATOM 576 CG GLU A 35 -3.015 -6.497 11.537 1.00 0.00 C ATOM 577 CD GLU A 35 -2.418 -6.183 12.904 1.00 0.00 C ATOM 578 OE1 GLU A 35 -3.128 -5.625 13.724 1.00 0.00 O ATOM 579 OE2 GLU A 35 -1.258 -6.504 13.110 1.00 0.00 O ATOM 0 H GLU A 35 -5.076 -5.814 9.138 1.00 0.00 H new ATOM 0 HA GLU A 35 -4.599 -8.398 10.505 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -4.969 -5.579 11.611 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -4.826 -7.026 12.589 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -2.616 -7.440 11.165 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -2.731 -5.726 10.821 1.00 0.00 H new ATOM 586 N ARG A 36 -6.991 -8.565 11.382 1.00 0.00 N ATOM 587 CA ARG A 36 -8.413 -8.824 11.572 1.00 0.00 C ATOM 588 C ARG A 36 -8.813 -8.647 13.033 1.00 0.00 C ATOM 589 O ARG A 36 -8.081 -9.032 13.946 1.00 0.00 O ATOM 590 CB ARG A 36 -8.738 -10.252 11.113 1.00 0.00 C ATOM 591 CG ARG A 36 -7.484 -11.124 11.224 1.00 0.00 C ATOM 592 CD ARG A 36 -7.833 -12.588 10.900 1.00 0.00 C ATOM 593 NE ARG A 36 -9.262 -12.730 10.643 1.00 0.00 N ATOM 594 CZ ARG A 36 -9.877 -13.896 10.808 1.00 0.00 C ATOM 595 NH1 ARG A 36 -9.204 -14.940 11.209 1.00 0.00 N ATOM 596 NH2 ARG A 36 -11.157 -13.997 10.571 1.00 0.00 N ATOM 0 H ARG A 36 -6.372 -9.199 11.886 1.00 0.00 H new ATOM 0 HA ARG A 36 -8.978 -8.107 10.977 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -9.538 -10.668 11.725 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -9.096 -10.241 10.084 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -6.718 -10.763 10.538 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -7.070 -11.054 12.230 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -7.267 -12.918 10.029 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -7.542 -13.230 11.732 1.00 0.00 H new ATOM 0 HE ARG A 36 -9.798 -11.920 10.331 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -8.204 -14.861 11.396 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -9.678 -15.834 11.335 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -11.684 -13.181 10.259 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -11.630 -14.892 10.697 1.00 0.00 H new ATOM 610 N MET A 37 -9.998 -8.082 13.242 1.00 0.00 N ATOM 611 CA MET A 37 -10.511 -7.881 14.588 1.00 0.00 C ATOM 612 C MET A 37 -11.604 -8.895 14.867 1.00 0.00 C ATOM 613 O MET A 37 -12.384 -9.229 13.976 1.00 0.00 O ATOM 614 CB MET A 37 -11.080 -6.480 14.756 1.00 0.00 C ATOM 615 CG MET A 37 -9.968 -5.438 14.591 1.00 0.00 C ATOM 616 SD MET A 37 -10.551 -3.829 15.181 1.00 0.00 S ATOM 617 CE MET A 37 -10.879 -4.325 16.888 1.00 0.00 C ATOM 0 H MET A 37 -10.617 -7.757 12.499 1.00 0.00 H new ATOM 0 HA MET A 37 -9.686 -8.008 15.289 1.00 0.00 H new ATOM 0 HB2 MET A 37 -11.864 -6.307 14.019 1.00 0.00 H new ATOM 0 HB3 MET A 37 -11.539 -6.381 15.740 1.00 0.00 H new ATOM 0 HG2 MET A 37 -9.084 -5.743 15.151 1.00 0.00 H new ATOM 0 HG3 MET A 37 -9.674 -5.368 13.544 1.00 0.00 H new ATOM 0 HE1 MET A 37 -10.890 -3.442 17.528 1.00 0.00 H new ATOM 0 HE2 MET A 37 -11.846 -4.825 16.942 1.00 0.00 H new ATOM 0 HE3 MET A 37 -10.099 -5.007 17.225 1.00 0.00 H new ATOM 627 N HIS A 38 -11.667 -9.374 16.105 1.00 0.00 N ATOM 628 CA HIS A 38 -12.678 -10.349 16.484 1.00 0.00 C ATOM 629 C HIS A 38 -13.570 -9.757 17.552 1.00 0.00 C ATOM 630 O HIS A 38 -13.195 -9.691 18.715 1.00 0.00 O ATOM 631 CB HIS A 38 -12.007 -11.616 17.017 1.00 0.00 C ATOM 632 CG HIS A 38 -13.058 -12.644 17.328 1.00 0.00 C ATOM 633 ND1 HIS A 38 -13.680 -13.387 16.338 1.00 0.00 N ATOM 634 CD2 HIS A 38 -13.608 -13.065 18.514 1.00 0.00 C ATOM 635 CE1 HIS A 38 -14.560 -14.210 16.939 1.00 0.00 C ATOM 636 NE2 HIS A 38 -14.556 -14.053 18.265 1.00 0.00 N ATOM 0 H HIS A 38 -11.033 -9.104 16.857 1.00 0.00 H new ATOM 0 HA HIS A 38 -13.276 -10.606 15.610 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -11.306 -12.008 16.279 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -11.431 -11.386 17.913 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -13.345 -12.687 19.491 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -15.191 -14.911 16.413 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -15.126 -14.551 18.949 1.00 0.00 H new ATOM 645 N ASN A 39 -14.742 -9.306 17.160 1.00 0.00 N ATOM 646 CA ASN A 39 -15.633 -8.708 18.126 1.00 0.00 C ATOM 647 C ASN A 39 -15.024 -7.412 18.640 1.00 0.00 C ATOM 648 O ASN A 39 -14.179 -6.802 17.986 1.00 0.00 O ATOM 649 CB ASN A 39 -15.844 -9.664 19.304 1.00 0.00 C ATOM 650 CG ASN A 39 -17.140 -9.338 20.022 1.00 0.00 C ATOM 651 OD1 ASN A 39 -17.805 -8.353 19.700 1.00 0.00 O ATOM 652 ND2 ASN A 39 -17.537 -10.114 20.986 1.00 0.00 N ATOM 0 H ASN A 39 -15.093 -9.340 16.203 1.00 0.00 H new ATOM 0 HA ASN A 39 -16.592 -8.505 17.649 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -15.868 -10.693 18.946 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -15.007 -9.587 19.998 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -18.405 -9.909 21.481 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -16.981 -10.928 21.247 1.00 0.00 H new ATOM 659 N ASP A 40 -15.468 -7.006 19.809 1.00 0.00 N ATOM 660 CA ASP A 40 -14.984 -5.787 20.435 1.00 0.00 C ATOM 661 C ASP A 40 -13.465 -5.780 20.620 1.00 0.00 C ATOM 662 O ASP A 40 -12.952 -4.915 21.330 1.00 0.00 O ATOM 663 CB ASP A 40 -15.641 -5.630 21.806 1.00 0.00 C ATOM 664 CG ASP A 40 -17.034 -5.029 21.653 1.00 0.00 C ATOM 665 OD1 ASP A 40 -17.974 -5.791 21.498 1.00 0.00 O ATOM 666 OD2 ASP A 40 -17.142 -3.814 21.693 1.00 0.00 O ATOM 0 H ASP A 40 -16.171 -7.506 20.353 1.00 0.00 H new ATOM 0 HA ASP A 40 -15.243 -4.961 19.772 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -15.707 -6.600 22.300 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -15.028 -4.990 22.441 1.00 0.00 H new ATOM 671 N THR A 41 -12.732 -6.737 20.032 1.00 0.00 N ATOM 672 CA THR A 41 -11.291 -6.764 20.231 1.00 0.00 C ATOM 673 C THR A 41 -10.519 -6.974 18.940 1.00 0.00 C ATOM 674 O THR A 41 -11.094 -7.164 17.869 1.00 0.00 O ATOM 675 CB THR A 41 -10.950 -7.832 21.261 1.00 0.00 C ATOM 676 OG1 THR A 41 -9.747 -7.480 21.930 1.00 0.00 O ATOM 677 CG2 THR A 41 -10.783 -9.190 20.589 1.00 0.00 C ATOM 0 H THR A 41 -13.105 -7.476 19.436 1.00 0.00 H new ATOM 0 HA THR A 41 -10.983 -5.786 20.601 1.00 0.00 H new ATOM 0 HB THR A 41 -11.766 -7.897 21.981 1.00 0.00 H new ATOM 0 HG1 THR A 41 -9.529 -8.167 22.594 1.00 0.00 H new ATOM 0 HG21 THR A 41 -10.540 -9.941 21.341 1.00 0.00 H new ATOM 0 HG22 THR A 41 -11.712 -9.465 20.089 1.00 0.00 H new ATOM 0 HG23 THR A 41 -9.978 -9.137 19.856 1.00 0.00 H new ATOM 685 N TRP A 42 -9.202 -6.894 19.068 1.00 0.00 N ATOM 686 CA TRP A 42 -8.304 -7.027 17.924 1.00 0.00 C ATOM 687 C TRP A 42 -7.520 -8.337 17.948 1.00 0.00 C ATOM 688 O TRP A 42 -7.309 -8.935 19.003 1.00 0.00 O ATOM 689 CB TRP A 42 -7.328 -5.851 17.922 1.00 0.00 C ATOM 690 CG TRP A 42 -7.003 -5.476 19.332 1.00 0.00 C ATOM 691 CD1 TRP A 42 -6.184 -6.173 20.154 1.00 0.00 C ATOM 692 CD2 TRP A 42 -7.480 -4.334 20.101 1.00 0.00 C ATOM 693 NE1 TRP A 42 -6.128 -5.528 21.378 1.00 0.00 N ATOM 694 CE2 TRP A 42 -6.908 -4.393 21.393 1.00 0.00 C ATOM 695 CE3 TRP A 42 -8.342 -3.264 19.806 1.00 0.00 C ATOM 696 CZ2 TRP A 42 -7.180 -3.429 22.358 1.00 0.00 C ATOM 697 CZ3 TRP A 42 -8.620 -2.287 20.777 1.00 0.00 C ATOM 698 CH2 TRP A 42 -8.039 -2.371 22.051 1.00 0.00 C ATOM 0 H TRP A 42 -8.727 -6.737 19.957 1.00 0.00 H new ATOM 0 HA TRP A 42 -8.913 -7.030 17.020 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -6.418 -6.120 17.386 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -7.766 -5.001 17.399 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -5.661 -7.082 19.897 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -5.576 -5.854 22.172 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -8.793 -3.192 18.827 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -6.730 -3.498 23.338 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -9.284 -1.468 20.541 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -8.256 -1.618 22.794 1.00 0.00 H new ATOM 709 N VAL A 43 -7.077 -8.763 16.762 1.00 0.00 N ATOM 710 CA VAL A 43 -6.294 -9.990 16.625 1.00 0.00 C ATOM 711 C VAL A 43 -5.004 -9.700 15.861 1.00 0.00 C ATOM 712 O VAL A 43 -4.935 -8.746 15.085 1.00 0.00 O ATOM 713 CB VAL A 43 -7.107 -11.048 15.880 1.00 0.00 C ATOM 714 CG1 VAL A 43 -6.561 -12.438 16.214 1.00 0.00 C ATOM 715 CG2 VAL A 43 -8.573 -10.961 16.309 1.00 0.00 C ATOM 0 H VAL A 43 -7.248 -8.274 15.883 1.00 0.00 H new ATOM 0 HA VAL A 43 -6.046 -10.364 17.618 1.00 0.00 H new ATOM 0 HB VAL A 43 -7.031 -10.875 14.807 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -7.140 -13.194 15.683 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -5.516 -12.501 15.910 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -6.637 -12.610 17.288 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -9.153 -11.716 15.778 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -8.649 -11.134 17.382 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -8.963 -9.971 16.073 1.00 0.00 H new ATOM 1080 N ARG A 66 -7.131 -3.895 -10.529 1.00 0.00 N ATOM 1081 CA ARG A 66 -7.292 -3.762 -9.085 1.00 0.00 C ATOM 1082 C ARG A 66 -5.980 -3.332 -8.437 1.00 0.00 C ATOM 1083 O ARG A 66 -4.977 -4.042 -8.507 1.00 0.00 O ATOM 1084 CB ARG A 66 -7.751 -5.098 -8.482 1.00 0.00 C ATOM 1085 CG ARG A 66 -9.280 -5.176 -8.494 1.00 0.00 C ATOM 1086 CD ARG A 66 -9.725 -6.569 -8.041 1.00 0.00 C ATOM 1087 NE ARG A 66 -11.168 -6.717 -8.198 1.00 0.00 N ATOM 1088 CZ ARG A 66 -11.770 -7.879 -7.964 1.00 0.00 C ATOM 1089 NH1 ARG A 66 -11.071 -8.913 -7.583 1.00 0.00 N ATOM 1090 NH2 ARG A 66 -13.063 -7.984 -8.114 1.00 0.00 N ATOM 0 HA ARG A 66 -8.046 -2.999 -8.892 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -7.331 -5.927 -9.051 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -7.381 -5.193 -7.461 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -9.698 -4.417 -7.834 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -9.657 -4.970 -9.496 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -9.209 -7.331 -8.625 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -9.448 -6.725 -6.998 1.00 0.00 H new ATOM 0 HE ARG A 66 -11.725 -5.915 -8.493 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -10.061 -8.830 -7.464 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -11.534 -9.804 -7.404 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -13.609 -7.175 -8.410 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -13.527 -8.875 -7.935 1.00 0.00 H new ATOM 1104 N HIS A 67 -5.999 -2.167 -7.798 1.00 0.00 N ATOM 1105 CA HIS A 67 -4.816 -1.649 -7.131 1.00 0.00 C ATOM 1106 C HIS A 67 -4.845 -2.041 -5.654 1.00 0.00 C ATOM 1107 O HIS A 67 -5.911 -2.269 -5.085 1.00 0.00 O ATOM 1108 CB HIS A 67 -4.782 -0.125 -7.277 1.00 0.00 C ATOM 1109 CG HIS A 67 -4.375 0.268 -8.674 1.00 0.00 C ATOM 1110 ND1 HIS A 67 -4.518 1.571 -9.133 1.00 0.00 N ATOM 1111 CD2 HIS A 67 -3.848 -0.445 -9.727 1.00 0.00 C ATOM 1112 CE1 HIS A 67 -4.085 1.600 -10.407 1.00 0.00 C ATOM 1113 NE2 HIS A 67 -3.666 0.401 -10.817 1.00 0.00 N ATOM 0 H HIS A 67 -6.821 -1.566 -7.729 1.00 0.00 H new ATOM 0 HA HIS A 67 -3.920 -2.071 -7.586 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -5.764 0.289 -7.049 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -4.082 0.299 -6.556 1.00 0.00 H new ATOM 0 HD1 HIS A 67 -4.884 2.361 -8.602 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -3.612 -1.499 -9.710 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -4.078 2.487 -11.023 1.00 0.00 H new ATOM 1121 N ALA A 68 -3.667 -2.131 -5.046 1.00 0.00 N ATOM 1122 CA ALA A 68 -3.562 -2.510 -3.638 1.00 0.00 C ATOM 1123 C ALA A 68 -4.776 -2.030 -2.836 1.00 0.00 C ATOM 1124 O ALA A 68 -5.229 -2.704 -1.908 1.00 0.00 O ATOM 1125 CB ALA A 68 -2.278 -1.929 -3.049 1.00 0.00 C ATOM 0 H ALA A 68 -2.773 -1.948 -5.502 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.535 -3.598 -3.576 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -2.199 -2.211 -1.999 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -1.419 -2.318 -3.595 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -2.299 -0.842 -3.132 1.00 0.00 H new ATOM 1131 N GLU A 69 -5.308 -0.867 -3.202 1.00 0.00 N ATOM 1132 CA GLU A 69 -6.477 -0.327 -2.508 1.00 0.00 C ATOM 1133 C GLU A 69 -7.642 -1.314 -2.614 1.00 0.00 C ATOM 1134 O GLU A 69 -8.103 -1.862 -1.611 1.00 0.00 O ATOM 1135 CB GLU A 69 -6.882 1.043 -3.100 1.00 0.00 C ATOM 1136 CG GLU A 69 -5.937 1.411 -4.241 1.00 0.00 C ATOM 1137 CD GLU A 69 -4.527 1.642 -3.703 1.00 0.00 C ATOM 1138 OE1 GLU A 69 -4.412 2.085 -2.572 1.00 0.00 O ATOM 1139 OE2 GLU A 69 -3.586 1.373 -4.430 1.00 0.00 O ATOM 0 H GLU A 69 -4.956 -0.287 -3.963 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.223 -0.182 -1.458 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -7.909 1.003 -3.464 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -6.848 1.809 -2.325 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.925 0.614 -4.984 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -6.294 2.310 -4.744 1.00 0.00 H new ATOM 1146 N LEU A 70 -8.101 -1.537 -3.843 1.00 0.00 N ATOM 1147 CA LEU A 70 -9.207 -2.459 -4.086 1.00 0.00 C ATOM 1148 C LEU A 70 -8.803 -3.879 -3.703 1.00 0.00 C ATOM 1149 O LEU A 70 -9.655 -4.743 -3.495 1.00 0.00 O ATOM 1150 CB LEU A 70 -9.633 -2.436 -5.558 1.00 0.00 C ATOM 1151 CG LEU A 70 -9.698 -0.989 -6.084 1.00 0.00 C ATOM 1152 CD1 LEU A 70 -10.410 -0.082 -5.066 1.00 0.00 C ATOM 1153 CD2 LEU A 70 -8.280 -0.455 -6.360 1.00 0.00 C ATOM 0 H LEU A 70 -7.726 -1.094 -4.682 1.00 0.00 H new ATOM 0 HA LEU A 70 -10.048 -2.137 -3.472 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -8.927 -3.014 -6.155 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -10.607 -2.912 -5.667 1.00 0.00 H new ATOM 0 HG LEU A 70 -10.263 -0.986 -7.016 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -10.448 0.937 -5.451 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -11.424 -0.446 -4.901 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -9.863 -0.093 -4.123 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -8.342 0.568 -6.731 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.699 -0.472 -5.438 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.794 -1.083 -7.107 1.00 0.00 H new ATOM 1165 N CYS A 71 -7.497 -4.114 -3.623 1.00 0.00 N ATOM 1166 CA CYS A 71 -6.989 -5.440 -3.276 1.00 0.00 C ATOM 1167 C CYS A 71 -7.488 -5.896 -1.902 1.00 0.00 C ATOM 1168 O CYS A 71 -8.247 -6.867 -1.804 1.00 0.00 O ATOM 1169 CB CYS A 71 -5.461 -5.455 -3.306 1.00 0.00 C ATOM 1170 SG CYS A 71 -4.887 -7.158 -3.132 1.00 0.00 S ATOM 0 H CYS A 71 -6.776 -3.412 -3.792 1.00 0.00 H new ATOM 0 HA CYS A 71 -7.369 -6.138 -4.022 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -5.099 -5.029 -4.242 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -5.062 -4.839 -2.500 1.00 0.00 H new ATOM 0 HG CYS A 71 -3.588 -7.183 -3.158 1.00 0.00 H new ATOM 1176 N PHE A 72 -7.091 -5.207 -0.832 1.00 0.00 N ATOM 1177 CA PHE A 72 -7.570 -5.622 0.482 1.00 0.00 C ATOM 1178 C PHE A 72 -9.073 -5.479 0.492 1.00 0.00 C ATOM 1179 O PHE A 72 -9.795 -6.355 0.953 1.00 0.00 O ATOM 1180 CB PHE A 72 -6.939 -4.824 1.625 1.00 0.00 C ATOM 1181 CG PHE A 72 -7.002 -3.342 1.361 1.00 0.00 C ATOM 1182 CD1 PHE A 72 -8.204 -2.643 1.538 1.00 0.00 C ATOM 1183 CD2 PHE A 72 -5.847 -2.658 0.964 1.00 0.00 C ATOM 1184 CE1 PHE A 72 -8.246 -1.271 1.313 1.00 0.00 C ATOM 1185 CE2 PHE A 72 -5.895 -1.288 0.741 1.00 0.00 C ATOM 1186 CZ PHE A 72 -7.093 -0.597 0.915 1.00 0.00 C ATOM 0 H PHE A 72 -6.470 -4.398 -0.844 1.00 0.00 H new ATOM 0 HA PHE A 72 -7.277 -6.658 0.651 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -7.455 -5.051 2.558 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -5.900 -5.128 1.753 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -9.095 -3.168 1.848 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -4.919 -3.195 0.831 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -9.171 -0.729 1.447 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -5.005 -0.759 0.433 1.00 0.00 H new ATOM 0 HZ PHE A 72 -7.128 0.468 0.740 1.00 0.00 H new ATOM 1196 N LEU A 73 -9.542 -4.389 -0.082 1.00 0.00 N ATOM 1197 CA LEU A 73 -10.961 -4.161 -0.203 1.00 0.00 C ATOM 1198 C LEU A 73 -11.648 -5.478 -0.559 1.00 0.00 C ATOM 1199 O LEU A 73 -12.814 -5.703 -0.235 1.00 0.00 O ATOM 1200 CB LEU A 73 -11.147 -3.152 -1.323 1.00 0.00 C ATOM 1201 CG LEU A 73 -12.365 -2.265 -1.072 1.00 0.00 C ATOM 1202 CD1 LEU A 73 -12.084 -1.293 0.094 1.00 0.00 C ATOM 1203 CD2 LEU A 73 -12.656 -1.486 -2.363 1.00 0.00 C ATOM 0 H LEU A 73 -8.958 -3.649 -0.471 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.392 -3.788 0.726 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -10.254 -2.532 -1.409 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -11.265 -3.676 -2.272 1.00 0.00 H new ATOM 0 HG LEU A 73 -13.228 -2.873 -0.799 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -12.959 -0.666 0.264 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -11.865 -1.862 0.997 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -11.229 -0.664 -0.155 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -13.523 -0.843 -2.212 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -11.791 -0.875 -2.622 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -12.860 -2.187 -3.173 1.00 0.00 H new ATOM 1215 N ASP A 74 -10.891 -6.335 -1.241 1.00 0.00 N ATOM 1216 CA ASP A 74 -11.392 -7.636 -1.668 1.00 0.00 C ATOM 1217 C ASP A 74 -11.047 -8.736 -0.665 1.00 0.00 C ATOM 1218 O ASP A 74 -11.702 -9.776 -0.647 1.00 0.00 O ATOM 1219 CB ASP A 74 -10.807 -7.993 -3.035 1.00 0.00 C ATOM 1220 CG ASP A 74 -11.528 -9.208 -3.612 1.00 0.00 C ATOM 1221 OD1 ASP A 74 -12.719 -9.332 -3.380 1.00 0.00 O ATOM 1222 OD2 ASP A 74 -10.877 -9.995 -4.281 1.00 0.00 O ATOM 0 H ASP A 74 -9.925 -6.149 -1.510 1.00 0.00 H new ATOM 0 HA ASP A 74 -12.478 -7.566 -1.731 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -10.905 -7.146 -3.714 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -9.742 -8.204 -2.940 1.00 0.00 H new ATOM 1227 N VAL A 75 -10.020 -8.535 0.164 1.00 0.00 N ATOM 1228 CA VAL A 75 -9.665 -9.568 1.120 1.00 0.00 C ATOM 1229 C VAL A 75 -10.655 -9.623 2.292 1.00 0.00 C ATOM 1230 O VAL A 75 -11.138 -10.676 2.664 1.00 0.00 O ATOM 1231 CB VAL A 75 -8.247 -9.372 1.664 1.00 0.00 C ATOM 1232 CG1 VAL A 75 -8.239 -8.385 2.834 1.00 0.00 C ATOM 1233 CG2 VAL A 75 -7.764 -10.725 2.148 1.00 0.00 C ATOM 0 H VAL A 75 -9.442 -7.695 0.190 1.00 0.00 H new ATOM 0 HA VAL A 75 -9.708 -10.513 0.579 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.602 -8.969 0.883 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -7.220 -8.264 3.201 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -8.621 -7.421 2.499 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -8.871 -8.766 3.636 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.753 -10.630 2.545 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -8.429 -11.090 2.931 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.762 -11.430 1.316 1.00 0.00 H new ATOM 1243 N ILE A 76 -10.930 -8.482 2.891 1.00 0.00 N ATOM 1244 CA ILE A 76 -11.848 -8.440 4.038 1.00 0.00 C ATOM 1245 C ILE A 76 -13.022 -9.424 3.857 1.00 0.00 C ATOM 1246 O ILE A 76 -13.268 -10.245 4.740 1.00 0.00 O ATOM 1247 CB ILE A 76 -12.385 -7.011 4.281 1.00 0.00 C ATOM 1248 CG1 ILE A 76 -11.483 -5.982 3.603 1.00 0.00 C ATOM 1249 CG2 ILE A 76 -12.429 -6.706 5.776 1.00 0.00 C ATOM 1250 CD1 ILE A 76 -10.105 -5.982 4.271 1.00 0.00 C ATOM 0 H ILE A 76 -10.544 -7.579 2.617 1.00 0.00 H new ATOM 0 HA ILE A 76 -11.276 -8.745 4.914 1.00 0.00 H new ATOM 0 HB ILE A 76 -13.390 -6.955 3.863 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -11.384 -6.214 2.543 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -11.931 -4.991 3.672 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -12.809 -5.696 5.930 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -13.084 -7.421 6.274 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -11.425 -6.783 6.193 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -9.465 -5.246 3.784 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.212 -5.729 5.326 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.656 -6.971 4.179 1.00 0.00 H new ATOM 1262 N PRO A 77 -13.745 -9.380 2.753 1.00 0.00 N ATOM 1263 CA PRO A 77 -14.890 -10.313 2.516 1.00 0.00 C ATOM 1264 C PRO A 77 -14.396 -11.740 2.323 1.00 0.00 C ATOM 1265 O PRO A 77 -15.174 -12.692 2.318 1.00 0.00 O ATOM 1266 CB PRO A 77 -15.538 -9.772 1.238 1.00 0.00 C ATOM 1267 CG PRO A 77 -14.455 -9.057 0.528 1.00 0.00 C ATOM 1268 CD PRO A 77 -13.570 -8.464 1.614 1.00 0.00 C ATOM 0 HA PRO A 77 -15.586 -10.354 3.354 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -15.942 -10.580 0.629 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -16.366 -9.103 1.469 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -13.890 -9.737 -0.109 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -14.859 -8.277 -0.117 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -12.528 -8.415 1.298 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -13.875 -7.449 1.867 1.00 0.00 H new ATOM 1276 N PHE A 78 -13.087 -11.857 2.164 1.00 0.00 N ATOM 1277 CA PHE A 78 -12.434 -13.156 1.970 1.00 0.00 C ATOM 1278 C PHE A 78 -12.511 -14.000 3.237 1.00 0.00 C ATOM 1279 O PHE A 78 -12.869 -15.178 3.180 1.00 0.00 O ATOM 1280 CB PHE A 78 -10.971 -12.928 1.583 1.00 0.00 C ATOM 1281 CG PHE A 78 -10.394 -14.126 0.894 1.00 0.00 C ATOM 1282 CD1 PHE A 78 -10.534 -14.262 -0.487 1.00 0.00 C ATOM 1283 CD2 PHE A 78 -9.716 -15.094 1.635 1.00 0.00 C ATOM 1284 CE1 PHE A 78 -9.996 -15.380 -1.137 1.00 0.00 C ATOM 1285 CE2 PHE A 78 -9.177 -16.214 0.992 1.00 0.00 C ATOM 1286 CZ PHE A 78 -9.319 -16.358 -0.396 1.00 0.00 C ATOM 0 H PHE A 78 -12.445 -11.064 2.165 1.00 0.00 H new ATOM 0 HA PHE A 78 -12.949 -13.694 1.175 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -10.898 -12.060 0.928 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -10.388 -12.704 2.476 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -11.057 -13.506 -1.054 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -9.607 -14.979 2.703 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -10.103 -15.488 -2.206 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -8.653 -16.966 1.563 1.00 0.00 H new ATOM 0 HZ PHE A 78 -8.906 -17.223 -0.894 1.00 0.00 H new ATOM 1296 N TRP A 79 -12.187 -13.403 4.386 1.00 0.00 N ATOM 1297 CA TRP A 79 -12.247 -14.141 5.638 1.00 0.00 C ATOM 1298 C TRP A 79 -13.710 -14.336 6.045 1.00 0.00 C ATOM 1299 O TRP A 79 -14.040 -15.212 6.845 1.00 0.00 O ATOM 1300 CB TRP A 79 -11.501 -13.397 6.751 1.00 0.00 C ATOM 1301 CG TRP A 79 -10.450 -12.479 6.203 1.00 0.00 C ATOM 1302 CD1 TRP A 79 -9.625 -12.719 5.157 1.00 0.00 C ATOM 1303 CD2 TRP A 79 -10.106 -11.163 6.699 1.00 0.00 C ATOM 1304 NE1 TRP A 79 -8.791 -11.617 4.989 1.00 0.00 N ATOM 1305 CE2 TRP A 79 -9.058 -10.628 5.920 1.00 0.00 C ATOM 1306 CE3 TRP A 79 -10.613 -10.396 7.748 1.00 0.00 C ATOM 1307 CZ2 TRP A 79 -8.530 -9.355 6.187 1.00 0.00 C ATOM 1308 CZ3 TRP A 79 -10.095 -9.124 8.020 1.00 0.00 C ATOM 1309 CH2 TRP A 79 -9.059 -8.604 7.244 1.00 0.00 C ATOM 0 H TRP A 79 -11.887 -12.432 4.471 1.00 0.00 H new ATOM 0 HA TRP A 79 -11.769 -15.109 5.491 1.00 0.00 H new ATOM 0 HB2 TRP A 79 -12.213 -12.822 7.343 1.00 0.00 H new ATOM 0 HB3 TRP A 79 -11.038 -14.119 7.423 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -9.615 -13.615 4.554 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -8.072 -11.547 4.269 1.00 0.00 H new ATOM 0 HE3 TRP A 79 -11.414 -10.788 8.357 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -7.726 -8.960 5.585 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 -10.500 -8.542 8.835 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -8.665 -7.622 7.458 1.00 0.00 H new ATOM 1320 N LYS A 80 -14.575 -13.514 5.460 1.00 0.00 N ATOM 1321 CA LYS A 80 -16.008 -13.573 5.711 1.00 0.00 C ATOM 1322 C LYS A 80 -16.367 -13.463 7.201 1.00 0.00 C ATOM 1323 O LYS A 80 -17.078 -14.316 7.731 1.00 0.00 O ATOM 1324 CB LYS A 80 -16.583 -14.871 5.130 1.00 0.00 C ATOM 1325 CG LYS A 80 -15.643 -15.429 4.062 1.00 0.00 C ATOM 1326 CD LYS A 80 -16.432 -16.333 3.110 1.00 0.00 C ATOM 1327 CE LYS A 80 -17.092 -15.481 2.020 1.00 0.00 C ATOM 1328 NZ LYS A 80 -18.349 -16.143 1.568 1.00 0.00 N ATOM 0 H LYS A 80 -14.301 -12.788 4.798 1.00 0.00 H new ATOM 0 HA LYS A 80 -16.451 -12.708 5.218 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -16.720 -15.605 5.924 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -17.566 -14.681 4.698 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -15.181 -14.613 3.506 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -14.836 -15.992 4.531 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -15.768 -17.069 2.658 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -17.191 -16.886 3.663 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -17.310 -14.485 2.404 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -16.411 -15.356 1.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -18.798 -15.566 0.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -18.128 -17.085 1.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -18.999 -16.240 2.374 1.00 0.00 H new ATOM 1342 N LEU A 81 -15.912 -12.404 7.874 1.00 0.00 N ATOM 1343 CA LEU A 81 -16.253 -12.232 9.280 1.00 0.00 C ATOM 1344 C LEU A 81 -17.739 -11.998 9.443 1.00 0.00 C ATOM 1345 O LEU A 81 -18.574 -12.508 8.695 1.00 0.00 O ATOM 1346 CB LEU A 81 -15.561 -11.015 9.878 1.00 0.00 C ATOM 1347 CG LEU A 81 -14.128 -10.915 9.373 1.00 0.00 C ATOM 1348 CD1 LEU A 81 -14.081 -10.308 7.956 1.00 0.00 C ATOM 1349 CD2 LEU A 81 -13.374 -10.039 10.361 1.00 0.00 C ATOM 0 H LEU A 81 -15.322 -11.672 7.478 1.00 0.00 H new ATOM 0 HA LEU A 81 -15.933 -13.143 9.786 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -16.110 -10.111 9.614 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -15.566 -11.085 10.966 1.00 0.00 H new ATOM 0 HG LEU A 81 -13.674 -11.904 9.304 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -13.046 -10.248 7.620 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -14.649 -10.938 7.271 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -14.515 -9.308 7.974 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -12.337 -9.938 10.040 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -13.839 -9.054 10.403 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -13.404 -10.497 11.350 1.00 0.00 H new ATOM 1361 N ASP A 82 -18.020 -11.153 10.413 1.00 0.00 N ATOM 1362 CA ASP A 82 -19.354 -10.720 10.724 1.00 0.00 C ATOM 1363 C ASP A 82 -19.314 -9.201 10.810 1.00 0.00 C ATOM 1364 O ASP A 82 -18.367 -8.569 10.342 1.00 0.00 O ATOM 1365 CB ASP A 82 -19.809 -11.317 12.062 1.00 0.00 C ATOM 1366 CG ASP A 82 -20.568 -12.618 11.824 1.00 0.00 C ATOM 1367 OD1 ASP A 82 -19.945 -13.573 11.390 1.00 0.00 O ATOM 1368 OD2 ASP A 82 -21.761 -12.641 12.079 1.00 0.00 O ATOM 0 H ASP A 82 -17.307 -10.743 11.017 1.00 0.00 H new ATOM 0 HA ASP A 82 -20.059 -11.049 9.961 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -18.944 -11.503 12.699 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -20.446 -10.606 12.588 1.00 0.00 H new ATOM 1373 N LEU A 83 -20.321 -8.626 11.415 1.00 0.00 N ATOM 1374 CA LEU A 83 -20.381 -7.186 11.574 1.00 0.00 C ATOM 1375 C LEU A 83 -19.765 -6.774 12.909 1.00 0.00 C ATOM 1376 O LEU A 83 -19.053 -5.775 12.998 1.00 0.00 O ATOM 1377 CB LEU A 83 -21.832 -6.734 11.509 1.00 0.00 C ATOM 1378 CG LEU A 83 -21.894 -5.285 11.020 1.00 0.00 C ATOM 1379 CD1 LEU A 83 -23.346 -4.896 10.793 1.00 0.00 C ATOM 1380 CD2 LEU A 83 -21.261 -4.352 12.063 1.00 0.00 C ATOM 0 H LEU A 83 -21.116 -9.130 11.809 1.00 0.00 H new ATOM 0 HA LEU A 83 -19.815 -6.712 10.772 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -22.396 -7.380 10.836 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -22.294 -6.817 12.493 1.00 0.00 H new ATOM 0 HG LEU A 83 -21.341 -5.193 10.085 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -23.396 -3.864 10.445 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -23.786 -5.554 10.044 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -23.898 -4.990 11.728 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -21.309 -3.323 11.707 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -21.804 -4.436 13.004 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -20.220 -4.634 12.219 1.00 0.00 H new ATOM 1392 N ASP A 84 -20.051 -7.555 13.946 1.00 0.00 N ATOM 1393 CA ASP A 84 -19.532 -7.270 15.280 1.00 0.00 C ATOM 1394 C ASP A 84 -18.007 -7.217 15.281 1.00 0.00 C ATOM 1395 O ASP A 84 -17.399 -6.637 16.180 1.00 0.00 O ATOM 1396 CB ASP A 84 -20.007 -8.345 16.259 1.00 0.00 C ATOM 1397 CG ASP A 84 -19.765 -7.886 17.693 1.00 0.00 C ATOM 1398 OD1 ASP A 84 -18.645 -7.503 17.990 1.00 0.00 O ATOM 1399 OD2 ASP A 84 -20.704 -7.923 18.472 1.00 0.00 O ATOM 0 H ASP A 84 -20.637 -8.388 13.889 1.00 0.00 H new ATOM 0 HA ASP A 84 -19.908 -6.295 15.589 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -21.068 -8.545 16.106 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -19.476 -9.279 16.073 1.00 0.00 H new ATOM 1404 N GLN A 85 -17.389 -7.827 14.274 1.00 0.00 N ATOM 1405 CA GLN A 85 -15.935 -7.841 14.184 1.00 0.00 C ATOM 1406 C GLN A 85 -15.449 -6.627 13.384 1.00 0.00 C ATOM 1407 O GLN A 85 -16.257 -5.796 12.968 1.00 0.00 O ATOM 1408 CB GLN A 85 -15.457 -9.151 13.528 1.00 0.00 C ATOM 1409 CG GLN A 85 -16.589 -10.185 13.533 1.00 0.00 C ATOM 1410 CD GLN A 85 -16.019 -11.592 13.384 1.00 0.00 C ATOM 1411 OE1 GLN A 85 -16.532 -12.389 12.599 1.00 0.00 O ATOM 1412 NE2 GLN A 85 -14.983 -11.947 14.092 1.00 0.00 N ATOM 0 H GLN A 85 -17.868 -8.313 13.516 1.00 0.00 H new ATOM 0 HA GLN A 85 -15.515 -7.786 15.188 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -15.134 -8.958 12.505 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -14.594 -9.543 14.066 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -17.155 -10.111 14.462 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -17.284 -9.978 12.719 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -14.559 -11.285 14.742 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -14.597 -12.886 13.995 1.00 0.00 H new ATOM 1421 N ASP A 86 -14.135 -6.513 13.180 1.00 0.00 N ATOM 1422 CA ASP A 86 -13.597 -5.369 12.436 1.00 0.00 C ATOM 1423 C ASP A 86 -12.353 -5.767 11.632 1.00 0.00 C ATOM 1424 O ASP A 86 -11.871 -6.893 11.736 1.00 0.00 O ATOM 1425 CB ASP A 86 -13.250 -4.232 13.422 1.00 0.00 C ATOM 1426 CG ASP A 86 -14.268 -3.097 13.316 1.00 0.00 C ATOM 1427 OD1 ASP A 86 -15.272 -3.162 14.007 1.00 0.00 O ATOM 1428 OD2 ASP A 86 -14.028 -2.182 12.546 1.00 0.00 O ATOM 0 H ASP A 86 -13.437 -7.180 13.510 1.00 0.00 H new ATOM 0 HA ASP A 86 -14.355 -5.025 11.732 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -13.234 -4.619 14.441 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -12.251 -3.852 13.210 1.00 0.00 H new ATOM 1433 N TYR A 87 -11.839 -4.826 10.839 1.00 0.00 N ATOM 1434 CA TYR A 87 -10.647 -5.085 10.029 1.00 0.00 C ATOM 1435 C TYR A 87 -9.708 -3.879 10.032 1.00 0.00 C ATOM 1436 O TYR A 87 -10.068 -2.798 9.566 1.00 0.00 O ATOM 1437 CB TYR A 87 -11.033 -5.414 8.573 1.00 0.00 C ATOM 1438 CG TYR A 87 -12.526 -5.581 8.450 1.00 0.00 C ATOM 1439 CD1 TYR A 87 -13.122 -6.811 8.733 1.00 0.00 C ATOM 1440 CD2 TYR A 87 -13.310 -4.503 8.031 1.00 0.00 C ATOM 1441 CE1 TYR A 87 -14.505 -6.968 8.598 1.00 0.00 C ATOM 1442 CE2 TYR A 87 -14.693 -4.656 7.894 1.00 0.00 C ATOM 1443 CZ TYR A 87 -15.292 -5.890 8.177 1.00 0.00 C ATOM 1444 OH TYR A 87 -16.657 -6.041 8.041 1.00 0.00 O ATOM 0 H TYR A 87 -12.224 -3.887 10.740 1.00 0.00 H new ATOM 0 HA TYR A 87 -10.136 -5.940 10.471 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -10.694 -4.617 7.911 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -10.531 -6.328 8.255 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -12.514 -7.643 9.057 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -12.848 -3.552 7.813 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -14.965 -7.920 8.818 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -15.299 -3.823 7.570 1.00 0.00 H new ATOM 0 HH TYR A 87 -17.051 -5.195 7.741 1.00 0.00 H new ATOM 1454 N ARG A 88 -8.490 -4.089 10.518 1.00 0.00 N ATOM 1455 CA ARG A 88 -7.487 -3.030 10.528 1.00 0.00 C ATOM 1456 C ARG A 88 -6.491 -3.321 9.414 1.00 0.00 C ATOM 1457 O ARG A 88 -5.504 -4.029 9.618 1.00 0.00 O ATOM 1458 CB ARG A 88 -6.761 -2.997 11.876 1.00 0.00 C ATOM 1459 CG ARG A 88 -7.522 -2.102 12.857 1.00 0.00 C ATOM 1460 CD ARG A 88 -6.794 -2.096 14.203 1.00 0.00 C ATOM 1461 NE ARG A 88 -5.636 -1.209 14.144 1.00 0.00 N ATOM 1462 CZ ARG A 88 -4.558 -1.433 14.890 1.00 0.00 C ATOM 1463 NH1 ARG A 88 -4.522 -2.461 15.693 1.00 0.00 N ATOM 1464 NH2 ARG A 88 -3.537 -0.625 14.819 1.00 0.00 N ATOM 0 H ARG A 88 -8.174 -4.977 10.908 1.00 0.00 H new ATOM 0 HA ARG A 88 -7.963 -2.062 10.375 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -6.679 -4.006 12.280 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -5.746 -2.624 11.743 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -7.592 -1.088 12.463 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -8.542 -2.466 12.983 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -7.473 -1.769 14.991 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -6.475 -3.107 14.457 1.00 0.00 H new ATOM 0 HE ARG A 88 -5.654 -0.403 13.519 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -5.321 -3.093 15.749 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -3.695 -2.633 16.265 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -3.565 0.179 14.191 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -2.710 -0.797 15.391 1.00 0.00 H new ATOM 1478 N VAL A 89 -6.782 -2.811 8.225 1.00 0.00 N ATOM 1479 CA VAL A 89 -5.937 -3.067 7.068 1.00 0.00 C ATOM 1480 C VAL A 89 -4.775 -2.074 6.951 1.00 0.00 C ATOM 1481 O VAL A 89 -4.878 -0.918 7.364 1.00 0.00 O ATOM 1482 CB VAL A 89 -6.794 -3.013 5.808 1.00 0.00 C ATOM 1483 CG1 VAL A 89 -6.211 -3.929 4.728 1.00 0.00 C ATOM 1484 CG2 VAL A 89 -8.222 -3.459 6.142 1.00 0.00 C ATOM 0 H VAL A 89 -7.592 -2.221 8.037 1.00 0.00 H new ATOM 0 HA VAL A 89 -5.494 -4.055 7.192 1.00 0.00 H new ATOM 0 HB VAL A 89 -6.806 -1.990 5.433 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.833 -3.880 3.835 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -5.199 -3.605 4.484 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -6.185 -4.955 5.096 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -8.835 -3.421 5.242 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -8.204 -4.479 6.526 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -8.643 -2.795 6.897 1.00 0.00 H new ATOM 1494 N THR A 90 -3.668 -2.550 6.373 1.00 0.00 N ATOM 1495 CA THR A 90 -2.474 -1.729 6.182 1.00 0.00 C ATOM 1496 C THR A 90 -1.806 -2.076 4.843 1.00 0.00 C ATOM 1497 O THR A 90 -1.330 -3.193 4.653 1.00 0.00 O ATOM 1498 CB THR A 90 -1.501 -1.973 7.349 1.00 0.00 C ATOM 1499 OG1 THR A 90 -1.891 -1.171 8.454 1.00 0.00 O ATOM 1500 CG2 THR A 90 -0.066 -1.614 6.948 1.00 0.00 C ATOM 0 H THR A 90 -3.577 -3.506 6.028 1.00 0.00 H new ATOM 0 HA THR A 90 -2.753 -0.675 6.163 1.00 0.00 H new ATOM 0 HB THR A 90 -1.533 -3.029 7.616 1.00 0.00 H new ATOM 0 HG1 THR A 90 -1.276 -1.323 9.202 1.00 0.00 H new ATOM 0 HG21 THR A 90 0.603 -1.795 7.789 1.00 0.00 H new ATOM 0 HG22 THR A 90 0.240 -2.229 6.102 1.00 0.00 H new ATOM 0 HG23 THR A 90 -0.019 -0.562 6.667 1.00 0.00 H new ATOM 1508 N CYS A 91 -1.774 -1.120 3.917 1.00 0.00 N ATOM 1509 CA CYS A 91 -1.165 -1.355 2.608 1.00 0.00 C ATOM 1510 C CYS A 91 0.239 -0.759 2.534 1.00 0.00 C ATOM 1511 O CYS A 91 0.464 0.380 2.943 1.00 0.00 O ATOM 1512 CB CYS A 91 -2.034 -0.733 1.510 1.00 0.00 C ATOM 1513 SG CYS A 91 -1.274 -1.043 -0.103 1.00 0.00 S ATOM 0 H CYS A 91 -2.158 -0.184 4.046 1.00 0.00 H new ATOM 0 HA CYS A 91 -1.093 -2.433 2.462 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -3.037 -1.158 1.540 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -2.137 0.339 1.676 1.00 0.00 H new ATOM 0 HG CYS A 91 -1.740 -0.196 -0.972 1.00 0.00 H new ATOM 1519 N PHE A 92 1.176 -1.534 1.989 1.00 0.00 N ATOM 1520 CA PHE A 92 2.558 -1.076 1.839 1.00 0.00 C ATOM 1521 C PHE A 92 2.954 -1.082 0.368 1.00 0.00 C ATOM 1522 O PHE A 92 3.254 -2.134 -0.196 1.00 0.00 O ATOM 1523 CB PHE A 92 3.519 -1.984 2.612 1.00 0.00 C ATOM 1524 CG PHE A 92 3.416 -1.737 4.103 1.00 0.00 C ATOM 1525 CD1 PHE A 92 3.883 -0.538 4.656 1.00 0.00 C ATOM 1526 CD2 PHE A 92 2.880 -2.725 4.936 1.00 0.00 C ATOM 1527 CE1 PHE A 92 3.812 -0.331 6.041 1.00 0.00 C ATOM 1528 CE2 PHE A 92 2.807 -2.516 6.319 1.00 0.00 C ATOM 1529 CZ PHE A 92 3.274 -1.321 6.871 1.00 0.00 C ATOM 0 H PHE A 92 1.005 -2.479 1.645 1.00 0.00 H new ATOM 0 HA PHE A 92 2.621 -0.064 2.238 1.00 0.00 H new ATOM 0 HB2 PHE A 92 3.292 -3.028 2.396 1.00 0.00 H new ATOM 0 HB3 PHE A 92 4.541 -1.805 2.280 1.00 0.00 H new ATOM 0 HD1 PHE A 92 4.298 0.227 4.016 1.00 0.00 H new ATOM 0 HD2 PHE A 92 2.522 -3.651 4.512 1.00 0.00 H new ATOM 0 HE1 PHE A 92 4.173 0.593 6.468 1.00 0.00 H new ATOM 0 HE2 PHE A 92 2.389 -3.279 6.959 1.00 0.00 H new ATOM 0 HZ PHE A 92 3.220 -1.161 7.938 1.00 0.00 H new ATOM 1539 N THR A 93 2.960 0.093 -0.253 1.00 0.00 N ATOM 1540 CA THR A 93 3.331 0.192 -1.664 1.00 0.00 C ATOM 1541 C THR A 93 4.154 1.450 -1.916 1.00 0.00 C ATOM 1542 O THR A 93 4.322 2.279 -1.024 1.00 0.00 O ATOM 1543 CB THR A 93 2.075 0.206 -2.541 1.00 0.00 C ATOM 1544 OG1 THR A 93 1.171 -0.790 -2.086 1.00 0.00 O ATOM 1545 CG2 THR A 93 2.457 -0.075 -3.998 1.00 0.00 C ATOM 0 H THR A 93 2.716 0.979 0.189 1.00 0.00 H new ATOM 0 HA THR A 93 3.936 -0.677 -1.921 1.00 0.00 H new ATOM 0 HB THR A 93 1.601 1.186 -2.477 1.00 0.00 H new ATOM 0 HG1 THR A 93 0.539 -0.393 -1.451 1.00 0.00 H new ATOM 0 HG21 THR A 93 1.560 -0.064 -4.618 1.00 0.00 H new ATOM 0 HG22 THR A 93 3.149 0.692 -4.347 1.00 0.00 H new ATOM 0 HG23 THR A 93 2.934 -1.053 -4.067 1.00 0.00 H new ATOM 1553 N SER A 94 4.679 1.578 -3.130 1.00 0.00 N ATOM 1554 CA SER A 94 5.494 2.736 -3.478 1.00 0.00 C ATOM 1555 C SER A 94 4.638 3.864 -4.051 1.00 0.00 C ATOM 1556 O SER A 94 5.080 5.012 -4.106 1.00 0.00 O ATOM 1557 CB SER A 94 6.562 2.338 -4.496 1.00 0.00 C ATOM 1558 OG SER A 94 5.973 1.524 -5.500 1.00 0.00 O ATOM 0 H SER A 94 4.556 0.901 -3.883 1.00 0.00 H new ATOM 0 HA SER A 94 5.972 3.095 -2.566 1.00 0.00 H new ATOM 0 HB2 SER A 94 7.002 3.228 -4.945 1.00 0.00 H new ATOM 0 HB3 SER A 94 7.369 1.798 -4.001 1.00 0.00 H new ATOM 0 HG SER A 94 6.655 1.268 -6.156 1.00 0.00 H new ATOM 1564 N TRP A 95 3.415 3.544 -4.482 1.00 0.00 N ATOM 1565 CA TRP A 95 2.532 4.565 -5.050 1.00 0.00 C ATOM 1566 C TRP A 95 1.202 4.642 -4.304 1.00 0.00 C ATOM 1567 O TRP A 95 0.698 3.648 -3.780 1.00 0.00 O ATOM 1568 CB TRP A 95 2.269 4.284 -6.535 1.00 0.00 C ATOM 1569 CG TRP A 95 2.052 2.827 -6.746 1.00 0.00 C ATOM 1570 CD1 TRP A 95 3.023 1.902 -6.689 1.00 0.00 C ATOM 1571 CD2 TRP A 95 0.819 2.111 -7.055 1.00 0.00 C ATOM 1572 NE1 TRP A 95 2.472 0.656 -6.925 1.00 0.00 N ATOM 1573 CE2 TRP A 95 1.117 0.735 -7.159 1.00 0.00 C ATOM 1574 CE3 TRP A 95 -0.515 2.512 -7.249 1.00 0.00 C ATOM 1575 CZ2 TRP A 95 0.135 -0.208 -7.442 1.00 0.00 C ATOM 1576 CZ3 TRP A 95 -1.507 1.557 -7.536 1.00 0.00 C ATOM 1577 CH2 TRP A 95 -1.180 0.203 -7.629 1.00 0.00 C ATOM 0 H TRP A 95 3.019 2.604 -4.450 1.00 0.00 H new ATOM 0 HA TRP A 95 3.040 5.524 -4.944 1.00 0.00 H new ATOM 0 HB2 TRP A 95 1.395 4.843 -6.870 1.00 0.00 H new ATOM 0 HB3 TRP A 95 3.114 4.625 -7.133 1.00 0.00 H new ATOM 0 HD1 TRP A 95 4.066 2.099 -6.491 1.00 0.00 H new ATOM 0 HE1 TRP A 95 3.004 -0.215 -6.926 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -0.779 3.557 -7.177 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 0.392 -1.254 -7.516 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -2.529 1.873 -7.685 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -1.948 -0.525 -7.846 1.00 0.00 H new ATOM 1588 N SER A 96 0.644 5.848 -4.284 1.00 0.00 N ATOM 1589 CA SER A 96 -0.632 6.119 -3.634 1.00 0.00 C ATOM 1590 C SER A 96 -1.772 5.587 -4.519 1.00 0.00 C ATOM 1591 O SER A 96 -1.502 4.835 -5.452 1.00 0.00 O ATOM 1592 CB SER A 96 -0.736 7.624 -3.388 1.00 0.00 C ATOM 1593 OG SER A 96 -1.425 7.861 -2.168 1.00 0.00 O ATOM 0 H SER A 96 1.066 6.668 -4.720 1.00 0.00 H new ATOM 0 HA SER A 96 -0.706 5.613 -2.672 1.00 0.00 H new ATOM 0 HB2 SER A 96 0.260 8.066 -3.347 1.00 0.00 H new ATOM 0 HB3 SER A 96 -1.263 8.102 -4.214 1.00 0.00 H new ATOM 0 HG SER A 96 -1.489 8.826 -2.011 1.00 0.00 H new ATOM 1599 N PRO A 97 -3.029 5.892 -4.254 1.00 0.00 N ATOM 1600 CA PRO A 97 -4.150 5.343 -5.066 1.00 0.00 C ATOM 1601 C PRO A 97 -4.332 6.135 -6.355 1.00 0.00 C ATOM 1602 O PRO A 97 -3.356 6.637 -6.913 1.00 0.00 O ATOM 1603 CB PRO A 97 -5.343 5.480 -4.132 1.00 0.00 C ATOM 1604 CG PRO A 97 -5.062 6.712 -3.354 1.00 0.00 C ATOM 1605 CD PRO A 97 -3.542 6.798 -3.203 1.00 0.00 C ATOM 0 HA PRO A 97 -3.992 4.316 -5.395 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -6.276 5.566 -4.689 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -5.439 4.612 -3.480 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -5.450 7.591 -3.868 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -5.546 6.673 -2.378 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -3.183 7.818 -3.344 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -3.220 6.482 -2.211 1.00 0.00 H new ATOM 1613 N CYS A 98 -5.565 6.258 -6.838 1.00 0.00 N ATOM 1614 CA CYS A 98 -5.786 7.005 -8.068 1.00 0.00 C ATOM 1615 C CYS A 98 -7.176 7.635 -8.120 1.00 0.00 C ATOM 1616 O CYS A 98 -8.107 7.188 -7.457 1.00 0.00 O ATOM 1617 CB CYS A 98 -5.598 6.088 -9.277 1.00 0.00 C ATOM 1618 SG CYS A 98 -4.119 5.071 -9.041 1.00 0.00 S ATOM 0 H CYS A 98 -6.402 5.863 -6.411 1.00 0.00 H new ATOM 0 HA CYS A 98 -5.054 7.812 -8.091 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -6.474 5.451 -9.403 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -5.502 6.682 -10.186 1.00 0.00 H new ATOM 0 HG CYS A 98 -3.255 5.722 -8.320 1.00 0.00 H new ATOM 1623 N PHE A 99 -7.287 8.684 -8.928 1.00 0.00 N ATOM 1624 CA PHE A 99 -8.541 9.414 -9.101 1.00 0.00 C ATOM 1625 C PHE A 99 -9.756 8.503 -8.982 1.00 0.00 C ATOM 1626 O PHE A 99 -10.655 8.755 -8.183 1.00 0.00 O ATOM 1627 CB PHE A 99 -8.551 10.074 -10.478 1.00 0.00 C ATOM 1628 CG PHE A 99 -8.515 9.007 -11.545 1.00 0.00 C ATOM 1629 CD1 PHE A 99 -7.326 8.312 -11.798 1.00 0.00 C ATOM 1630 CD2 PHE A 99 -9.669 8.710 -12.280 1.00 0.00 C ATOM 1631 CE1 PHE A 99 -7.289 7.321 -12.786 1.00 0.00 C ATOM 1632 CE2 PHE A 99 -9.632 7.719 -13.269 1.00 0.00 C ATOM 1633 CZ PHE A 99 -8.443 7.024 -13.521 1.00 0.00 C ATOM 0 H PHE A 99 -6.513 9.053 -9.481 1.00 0.00 H new ATOM 0 HA PHE A 99 -8.602 10.161 -8.309 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -9.444 10.689 -10.593 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -7.692 10.737 -10.582 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -6.436 8.541 -11.230 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -10.587 9.245 -12.085 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -6.371 6.786 -12.981 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -10.521 7.491 -13.838 1.00 0.00 H new ATOM 0 HZ PHE A 99 -8.416 6.259 -14.283 1.00 0.00 H new ATOM 1643 N SER A 100 -9.792 7.461 -9.797 1.00 0.00 N ATOM 1644 CA SER A 100 -10.926 6.543 -9.782 1.00 0.00 C ATOM 1645 C SER A 100 -10.707 5.411 -8.784 1.00 0.00 C ATOM 1646 O SER A 100 -11.434 5.287 -7.799 1.00 0.00 O ATOM 1647 CB SER A 100 -11.140 5.954 -11.177 1.00 0.00 C ATOM 1648 OG SER A 100 -11.780 6.920 -12.002 1.00 0.00 O ATOM 0 H SER A 100 -9.061 7.229 -10.470 1.00 0.00 H new ATOM 0 HA SER A 100 -11.809 7.106 -9.479 1.00 0.00 H new ATOM 0 HB2 SER A 100 -10.184 5.663 -11.612 1.00 0.00 H new ATOM 0 HB3 SER A 100 -11.749 5.052 -11.114 1.00 0.00 H new ATOM 0 HG SER A 100 -11.128 7.596 -12.280 1.00 0.00 H new ATOM 1654 N CYS A 101 -9.711 4.579 -9.047 1.00 0.00 N ATOM 1655 CA CYS A 101 -9.424 3.455 -8.165 1.00 0.00 C ATOM 1656 C CYS A 101 -9.559 3.876 -6.707 1.00 0.00 C ATOM 1657 O CYS A 101 -9.837 3.050 -5.828 1.00 0.00 O ATOM 1658 CB CYS A 101 -8.008 2.916 -8.458 1.00 0.00 C ATOM 1659 SG CYS A 101 -6.846 3.329 -7.126 1.00 0.00 S ATOM 0 H CYS A 101 -9.093 4.658 -9.855 1.00 0.00 H new ATOM 0 HA CYS A 101 -10.145 2.659 -8.350 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -8.049 1.834 -8.583 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -7.647 3.332 -9.398 1.00 0.00 H new ATOM 0 HG CYS A 101 -5.780 3.873 -7.633 1.00 0.00 H new ATOM 1664 N ALA A 102 -9.383 5.163 -6.453 1.00 0.00 N ATOM 1665 CA ALA A 102 -9.498 5.656 -5.095 1.00 0.00 C ATOM 1666 C ALA A 102 -10.957 5.679 -4.704 1.00 0.00 C ATOM 1667 O ALA A 102 -11.330 5.270 -3.607 1.00 0.00 O ATOM 1668 CB ALA A 102 -8.902 7.062 -4.969 1.00 0.00 C ATOM 0 H ALA A 102 -9.165 5.870 -7.155 1.00 0.00 H new ATOM 0 HA ALA A 102 -8.943 4.995 -4.430 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -9.001 7.408 -3.940 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -7.847 7.036 -5.243 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -9.433 7.743 -5.634 1.00 0.00 H new ATOM 1674 N GLN A 103 -11.780 6.144 -5.626 1.00 0.00 N ATOM 1675 CA GLN A 103 -13.204 6.199 -5.391 1.00 0.00 C ATOM 1676 C GLN A 103 -13.703 4.821 -5.020 1.00 0.00 C ATOM 1677 O GLN A 103 -14.225 4.618 -3.924 1.00 0.00 O ATOM 1678 CB GLN A 103 -13.910 6.682 -6.647 1.00 0.00 C ATOM 1679 CG GLN A 103 -13.694 8.179 -6.773 1.00 0.00 C ATOM 1680 CD GLN A 103 -14.443 8.722 -7.985 1.00 0.00 C ATOM 1681 OE1 GLN A 103 -15.176 7.915 -8.701 1.00 0.00 O flip ATOM 1682 NE2 GLN A 103 -14.359 9.912 -8.286 1.00 0.00 N flip ATOM 0 H GLN A 103 -11.485 6.487 -6.540 1.00 0.00 H new ATOM 0 HA GLN A 103 -13.414 6.891 -4.576 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -13.518 6.167 -7.524 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -14.975 6.456 -6.594 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -14.039 8.680 -5.869 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -12.630 8.393 -6.869 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -13.785 10.541 -7.724 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -14.863 10.270 -9.097 1.00 0.00 H new ATOM 1691 N GLU A 104 -13.509 3.870 -5.935 1.00 0.00 N ATOM 1692 CA GLU A 104 -13.922 2.487 -5.687 1.00 0.00 C ATOM 1693 C GLU A 104 -13.707 2.171 -4.213 1.00 0.00 C ATOM 1694 O GLU A 104 -14.650 1.871 -3.470 1.00 0.00 O ATOM 1695 CB GLU A 104 -13.098 1.528 -6.556 1.00 0.00 C ATOM 1696 CG GLU A 104 -13.805 1.309 -7.896 1.00 0.00 C ATOM 1697 CD GLU A 104 -14.965 0.334 -7.719 1.00 0.00 C ATOM 1698 OE1 GLU A 104 -16.043 0.785 -7.369 1.00 0.00 O ATOM 1699 OE2 GLU A 104 -14.757 -0.848 -7.937 1.00 0.00 O ATOM 0 H GLU A 104 -13.074 4.028 -6.844 1.00 0.00 H new ATOM 0 HA GLU A 104 -14.975 2.364 -5.942 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -12.102 1.938 -6.722 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -12.969 0.576 -6.042 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -14.173 2.259 -8.282 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -13.100 0.919 -8.630 1.00 0.00 H new ATOM 1706 N MET A 105 -12.455 2.281 -3.791 1.00 0.00 N ATOM 1707 CA MET A 105 -12.114 2.050 -2.411 1.00 0.00 C ATOM 1708 C MET A 105 -12.935 2.986 -1.515 1.00 0.00 C ATOM 1709 O MET A 105 -13.831 2.521 -0.822 1.00 0.00 O ATOM 1710 CB MET A 105 -10.598 2.233 -2.261 1.00 0.00 C ATOM 1711 CG MET A 105 -10.002 1.253 -1.240 1.00 0.00 C ATOM 1712 SD MET A 105 -10.121 1.955 0.419 1.00 0.00 S ATOM 1713 CE MET A 105 -8.945 3.304 0.175 1.00 0.00 C ATOM 0 H MET A 105 -11.667 2.528 -4.389 1.00 0.00 H new ATOM 0 HA MET A 105 -12.360 1.036 -2.096 1.00 0.00 H new ATOM 0 HB2 MET A 105 -10.117 2.087 -3.228 1.00 0.00 H new ATOM 0 HB3 MET A 105 -10.385 3.256 -1.950 1.00 0.00 H new ATOM 0 HG2 MET A 105 -10.533 0.302 -1.282 1.00 0.00 H new ATOM 0 HG3 MET A 105 -8.960 1.047 -1.484 1.00 0.00 H new ATOM 0 HE1 MET A 105 -8.230 3.317 0.998 1.00 0.00 H new ATOM 0 HE2 MET A 105 -8.414 3.158 -0.765 1.00 0.00 H new ATOM 0 HE3 MET A 105 -9.481 4.253 0.145 1.00 0.00 H new ATOM 1723 N ALA A 106 -12.661 4.292 -1.537 1.00 0.00 N ATOM 1724 CA ALA A 106 -13.422 5.229 -0.696 1.00 0.00 C ATOM 1725 C ALA A 106 -14.865 4.758 -0.481 1.00 0.00 C ATOM 1726 O ALA A 106 -15.338 4.705 0.640 1.00 0.00 O ATOM 1727 CB ALA A 106 -13.504 6.620 -1.321 1.00 0.00 C ATOM 0 H ALA A 106 -11.936 4.721 -2.112 1.00 0.00 H new ATOM 0 HA ALA A 106 -12.884 5.267 0.251 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -14.074 7.280 -0.667 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -12.498 7.020 -1.452 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -13.998 6.555 -2.291 1.00 0.00 H new ATOM 1733 N LYS A 107 -15.587 4.423 -1.543 1.00 0.00 N ATOM 1734 CA LYS A 107 -16.956 3.978 -1.342 1.00 0.00 C ATOM 1735 C LYS A 107 -16.973 2.941 -0.257 1.00 0.00 C ATOM 1736 O LYS A 107 -17.430 3.172 0.860 1.00 0.00 O ATOM 1737 CB LYS A 107 -17.482 3.321 -2.597 1.00 0.00 C ATOM 1738 CG LYS A 107 -17.877 4.390 -3.632 1.00 0.00 C ATOM 1739 CD LYS A 107 -17.208 4.081 -4.964 1.00 0.00 C ATOM 1740 CE LYS A 107 -17.825 2.817 -5.549 1.00 0.00 C ATOM 1741 NZ LYS A 107 -19.217 3.104 -5.998 1.00 0.00 N ATOM 0 H LYS A 107 -15.265 4.449 -2.511 1.00 0.00 H new ATOM 0 HA LYS A 107 -17.569 4.841 -1.083 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -16.722 2.661 -3.017 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -18.345 2.701 -2.357 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -18.960 4.411 -3.753 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -17.576 5.378 -3.283 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -17.337 4.916 -5.653 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -16.135 3.946 -4.824 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -17.227 2.463 -6.388 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -17.829 2.023 -4.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -19.505 2.401 -6.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -19.861 3.057 -5.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -19.258 4.055 -6.417 1.00 0.00 H new ATOM 1755 N PHE A 108 -16.447 1.793 -0.617 1.00 0.00 N ATOM 1756 CA PHE A 108 -16.371 0.677 0.307 1.00 0.00 C ATOM 1757 C PHE A 108 -16.113 1.183 1.727 1.00 0.00 C ATOM 1758 O PHE A 108 -16.533 0.571 2.709 1.00 0.00 O ATOM 1759 CB PHE A 108 -15.240 -0.236 -0.133 1.00 0.00 C ATOM 1760 CG PHE A 108 -15.772 -1.175 -1.174 1.00 0.00 C ATOM 1761 CD1 PHE A 108 -16.235 -0.677 -2.397 1.00 0.00 C ATOM 1762 CD2 PHE A 108 -15.834 -2.536 -0.900 1.00 0.00 C ATOM 1763 CE1 PHE A 108 -16.757 -1.552 -3.349 1.00 0.00 C ATOM 1764 CE2 PHE A 108 -16.358 -3.415 -1.846 1.00 0.00 C ATOM 1765 CZ PHE A 108 -16.822 -2.926 -3.076 1.00 0.00 C ATOM 0 H PHE A 108 -16.064 1.604 -1.543 1.00 0.00 H new ATOM 0 HA PHE A 108 -17.314 0.131 0.305 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -14.414 0.350 -0.536 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -14.849 -0.794 0.718 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -16.188 0.382 -2.603 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -15.476 -2.913 0.047 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -17.111 -1.172 -4.296 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -16.407 -4.472 -1.632 1.00 0.00 H new ATOM 0 HZ PHE A 108 -17.228 -3.606 -3.811 1.00 0.00 H new ATOM 1775 N ILE A 109 -15.405 2.306 1.809 1.00 0.00 N ATOM 1776 CA ILE A 109 -15.059 2.923 3.075 1.00 0.00 C ATOM 1777 C ILE A 109 -16.160 3.889 3.528 1.00 0.00 C ATOM 1778 O ILE A 109 -16.892 3.614 4.479 1.00 0.00 O ATOM 1779 CB ILE A 109 -13.740 3.661 2.848 1.00 0.00 C ATOM 1780 CG1 ILE A 109 -12.600 2.688 2.987 1.00 0.00 C ATOM 1781 CG2 ILE A 109 -13.548 4.791 3.830 1.00 0.00 C ATOM 1782 CD1 ILE A 109 -12.814 1.539 2.020 1.00 0.00 C ATOM 0 H ILE A 109 -15.057 2.811 0.994 1.00 0.00 H new ATOM 0 HA ILE A 109 -14.957 2.177 3.863 1.00 0.00 H new ATOM 0 HB ILE A 109 -13.764 4.089 1.846 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -11.653 3.185 2.778 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -12.545 2.315 4.010 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -12.598 5.288 3.632 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -14.362 5.508 3.723 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -13.545 4.394 4.845 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -11.993 0.828 2.113 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -13.755 1.039 2.251 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -12.848 1.923 1.000 1.00 0.00 H new ATOM 1794 N SER A 110 -16.269 5.014 2.829 1.00 0.00 N ATOM 1795 CA SER A 110 -17.273 6.025 3.136 1.00 0.00 C ATOM 1796 C SER A 110 -18.636 5.375 3.342 1.00 0.00 C ATOM 1797 O SER A 110 -19.438 5.828 4.157 1.00 0.00 O ATOM 1798 CB SER A 110 -17.349 7.033 1.983 1.00 0.00 C ATOM 1799 OG SER A 110 -18.636 6.976 1.383 1.00 0.00 O ATOM 0 H SER A 110 -15.668 5.249 2.039 1.00 0.00 H new ATOM 0 HA SER A 110 -16.990 6.539 4.055 1.00 0.00 H new ATOM 0 HB2 SER A 110 -17.154 8.039 2.353 1.00 0.00 H new ATOM 0 HB3 SER A 110 -16.581 6.811 1.242 1.00 0.00 H new ATOM 0 HG SER A 110 -18.683 7.622 0.648 1.00 0.00 H new ATOM 1805 N LYS A 111 -18.887 4.308 2.597 1.00 0.00 N ATOM 1806 CA LYS A 111 -20.149 3.595 2.702 1.00 0.00 C ATOM 1807 C LYS A 111 -20.169 2.754 3.974 1.00 0.00 C ATOM 1808 O LYS A 111 -21.205 2.613 4.623 1.00 0.00 O ATOM 1809 CB LYS A 111 -20.338 2.675 1.496 1.00 0.00 C ATOM 1810 CG LYS A 111 -20.372 3.437 0.150 1.00 0.00 C ATOM 1811 CD LYS A 111 -20.894 4.878 0.287 1.00 0.00 C ATOM 1812 CE LYS A 111 -22.353 4.881 0.769 1.00 0.00 C ATOM 1813 NZ LYS A 111 -23.253 5.156 -0.386 1.00 0.00 N ATOM 0 H LYS A 111 -18.235 3.919 1.916 1.00 0.00 H new ATOM 0 HA LYS A 111 -20.957 4.326 2.732 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -19.529 1.945 1.473 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -21.267 2.117 1.614 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -19.368 3.459 -0.274 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -21.003 2.893 -0.553 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -20.272 5.431 0.991 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -20.821 5.390 -0.673 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -22.602 3.919 1.218 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -22.491 5.638 1.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -24.242 5.159 -0.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -23.020 6.083 -0.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -23.127 4.418 -1.108 1.00 0.00 H new ATOM 1827 N ASN A 112 -19.013 2.199 4.320 1.00 0.00 N ATOM 1828 CA ASN A 112 -18.894 1.369 5.517 1.00 0.00 C ATOM 1829 C ASN A 112 -17.645 1.737 6.314 1.00 0.00 C ATOM 1830 O ASN A 112 -16.599 1.102 6.180 1.00 0.00 O ATOM 1831 CB ASN A 112 -18.831 -0.107 5.126 1.00 0.00 C ATOM 1832 CG ASN A 112 -20.084 -0.495 4.352 1.00 0.00 C ATOM 1833 OD1 ASN A 112 -20.211 -0.174 3.170 1.00 0.00 O ATOM 1834 ND2 ASN A 112 -21.025 -1.170 4.952 1.00 0.00 N ATOM 0 H ASN A 112 -18.147 2.307 3.792 1.00 0.00 H new ATOM 0 HA ASN A 112 -19.771 1.546 6.140 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -17.946 -0.293 4.518 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -18.740 -0.725 6.019 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -21.868 -1.433 4.442 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -20.918 -1.435 5.931 1.00 0.00 H new ATOM 1841 N LYS A 113 -17.766 2.769 7.141 1.00 0.00 N ATOM 1842 CA LYS A 113 -16.650 3.228 7.959 1.00 0.00 C ATOM 1843 C LYS A 113 -16.087 2.103 8.831 1.00 0.00 C ATOM 1844 O LYS A 113 -15.144 2.321 9.591 1.00 0.00 O ATOM 1845 CB LYS A 113 -17.112 4.366 8.862 1.00 0.00 C ATOM 1846 CG LYS A 113 -17.219 5.670 8.061 1.00 0.00 C ATOM 1847 CD LYS A 113 -18.427 5.618 7.114 1.00 0.00 C ATOM 1848 CE LYS A 113 -19.007 7.026 6.941 1.00 0.00 C ATOM 1849 NZ LYS A 113 -17.895 8.003 6.762 1.00 0.00 N ATOM 0 H LYS A 113 -18.626 3.304 7.263 1.00 0.00 H new ATOM 0 HA LYS A 113 -15.864 3.568 7.285 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -18.079 4.121 9.302 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -16.410 4.494 9.686 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -17.318 6.515 8.742 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -16.306 5.828 7.488 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -18.126 5.217 6.146 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -19.187 4.948 7.515 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -19.672 7.053 6.078 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -19.604 7.294 7.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -18.229 8.810 6.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -17.576 8.340 7.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -17.103 7.542 6.270 1.00 0.00 H new ATOM 1863 N HIS A 114 -16.668 0.910 8.735 1.00 0.00 N ATOM 1864 CA HIS A 114 -16.200 -0.215 9.545 1.00 0.00 C ATOM 1865 C HIS A 114 -14.844 -0.718 9.057 1.00 0.00 C ATOM 1866 O HIS A 114 -14.351 -1.746 9.521 1.00 0.00 O ATOM 1867 CB HIS A 114 -17.220 -1.357 9.514 1.00 0.00 C ATOM 1868 CG HIS A 114 -17.340 -1.910 8.118 1.00 0.00 C ATOM 1869 ND1 HIS A 114 -16.389 -1.675 7.139 1.00 0.00 N ATOM 1870 CD2 HIS A 114 -18.297 -2.699 7.530 1.00 0.00 C ATOM 1871 CE1 HIS A 114 -16.790 -2.311 6.022 1.00 0.00 C ATOM 1872 NE2 HIS A 114 -17.948 -2.950 6.206 1.00 0.00 N ATOM 0 H HIS A 114 -17.450 0.697 8.116 1.00 0.00 H new ATOM 0 HA HIS A 114 -16.088 0.137 10.571 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -16.914 -2.146 10.201 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -18.191 -0.997 9.855 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -19.186 -3.069 8.020 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -16.242 -2.305 5.091 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -18.466 -3.503 5.523 1.00 0.00 H new ATOM 1881 N VAL A 115 -14.248 0.011 8.120 1.00 0.00 N ATOM 1882 CA VAL A 115 -12.952 -0.360 7.570 1.00 0.00 C ATOM 1883 C VAL A 115 -11.901 0.689 7.932 1.00 0.00 C ATOM 1884 O VAL A 115 -12.208 1.877 8.037 1.00 0.00 O ATOM 1885 CB VAL A 115 -13.091 -0.499 6.039 1.00 0.00 C ATOM 1886 CG1 VAL A 115 -11.831 -0.025 5.333 1.00 0.00 C ATOM 1887 CG2 VAL A 115 -13.318 -1.962 5.667 1.00 0.00 C ATOM 0 H VAL A 115 -14.644 0.864 7.725 1.00 0.00 H new ATOM 0 HA VAL A 115 -12.625 -1.311 7.991 1.00 0.00 H new ATOM 0 HB VAL A 115 -13.938 0.113 5.727 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -11.955 -0.133 4.256 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -11.651 1.023 5.574 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -10.982 -0.624 5.663 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -13.415 -2.051 4.585 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -12.472 -2.559 6.006 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -14.230 -2.321 6.144 1.00 0.00 H new ATOM 1897 N SER A 116 -10.659 0.242 8.109 1.00 0.00 N ATOM 1898 CA SER A 116 -9.571 1.155 8.444 1.00 0.00 C ATOM 1899 C SER A 116 -8.328 0.847 7.609 1.00 0.00 C ATOM 1900 O SER A 116 -7.581 -0.082 7.920 1.00 0.00 O ATOM 1901 CB SER A 116 -9.227 1.034 9.926 1.00 0.00 C ATOM 1902 OG SER A 116 -10.324 1.498 10.702 1.00 0.00 O ATOM 0 H SER A 116 -10.384 -0.737 8.027 1.00 0.00 H new ATOM 0 HA SER A 116 -9.899 2.171 8.225 1.00 0.00 H new ATOM 0 HB2 SER A 116 -9.003 -0.003 10.176 1.00 0.00 H new ATOM 0 HB3 SER A 116 -8.334 1.617 10.153 1.00 0.00 H new ATOM 0 HG SER A 116 -10.107 1.420 11.655 1.00 0.00 H new ATOM 1908 N LEU A 117 -8.101 1.634 6.560 1.00 0.00 N ATOM 1909 CA LEU A 117 -6.936 1.431 5.712 1.00 0.00 C ATOM 1910 C LEU A 117 -5.807 2.342 6.146 1.00 0.00 C ATOM 1911 O LEU A 117 -6.008 3.536 6.360 1.00 0.00 O ATOM 1912 CB LEU A 117 -7.211 1.772 4.244 1.00 0.00 C ATOM 1913 CG LEU A 117 -8.455 1.081 3.674 1.00 0.00 C ATOM 1914 CD1 LEU A 117 -8.663 -0.330 4.232 1.00 0.00 C ATOM 1915 CD2 LEU A 117 -9.678 1.925 3.965 1.00 0.00 C ATOM 0 H LEU A 117 -8.703 2.409 6.281 1.00 0.00 H new ATOM 0 HA LEU A 117 -6.679 0.376 5.809 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -7.329 2.851 4.147 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -6.344 1.491 3.646 1.00 0.00 H new ATOM 0 HG LEU A 117 -8.302 0.980 2.599 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -9.559 -0.767 3.791 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -7.799 -0.949 3.988 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -8.779 -0.280 5.315 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -10.563 1.435 3.560 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -9.790 2.044 5.043 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -9.562 2.905 3.502 1.00 0.00 H new ATOM 1927 N CYS A 118 -4.610 1.790 6.216 1.00 0.00 N ATOM 1928 CA CYS A 118 -3.438 2.577 6.555 1.00 0.00 C ATOM 1929 C CYS A 118 -2.430 2.411 5.430 1.00 0.00 C ATOM 1930 O CYS A 118 -1.642 1.464 5.420 1.00 0.00 O ATOM 1931 CB CYS A 118 -2.841 2.094 7.874 1.00 0.00 C ATOM 1932 SG CYS A 118 -3.765 2.809 9.256 1.00 0.00 S ATOM 0 H CYS A 118 -4.423 0.802 6.043 1.00 0.00 H new ATOM 0 HA CYS A 118 -3.706 3.627 6.674 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -2.876 1.006 7.924 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -1.792 2.382 7.937 1.00 0.00 H new ATOM 0 HG CYS A 118 -3.257 2.395 10.378 1.00 0.00 H new ATOM 1938 N ILE A 119 -2.498 3.309 4.454 1.00 0.00 N ATOM 1939 CA ILE A 119 -1.638 3.232 3.302 1.00 0.00 C ATOM 1940 C ILE A 119 -0.312 3.938 3.489 1.00 0.00 C ATOM 1941 O ILE A 119 -0.258 5.114 3.850 1.00 0.00 O ATOM 1942 CB ILE A 119 -2.367 3.851 2.132 1.00 0.00 C ATOM 1943 CG1 ILE A 119 -3.826 3.369 2.179 1.00 0.00 C ATOM 1944 CG2 ILE A 119 -1.674 3.418 0.837 1.00 0.00 C ATOM 1945 CD1 ILE A 119 -4.447 3.426 0.797 1.00 0.00 C ATOM 0 H ILE A 119 -3.145 4.097 4.447 1.00 0.00 H new ATOM 0 HA ILE A 119 -1.407 2.180 3.133 1.00 0.00 H new ATOM 0 HB ILE A 119 -2.352 4.940 2.176 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -3.866 2.349 2.561 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -4.399 3.990 2.868 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -2.190 3.858 -0.016 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -0.638 3.756 0.848 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -1.700 2.331 0.756 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -5.480 3.081 0.848 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -4.424 4.452 0.430 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -3.884 2.785 0.118 1.00 0.00 H new ATOM 1957 N PHE A 120 0.752 3.213 3.179 1.00 0.00 N ATOM 1958 CA PHE A 120 2.092 3.760 3.244 1.00 0.00 C ATOM 1959 C PHE A 120 2.626 3.811 1.824 1.00 0.00 C ATOM 1960 O PHE A 120 3.012 2.792 1.252 1.00 0.00 O ATOM 1961 CB PHE A 120 2.976 2.879 4.125 1.00 0.00 C ATOM 1962 CG PHE A 120 2.783 3.270 5.570 1.00 0.00 C ATOM 1963 CD1 PHE A 120 3.225 4.518 6.024 1.00 0.00 C ATOM 1964 CD2 PHE A 120 2.152 2.387 6.456 1.00 0.00 C ATOM 1965 CE1 PHE A 120 3.039 4.882 7.362 1.00 0.00 C ATOM 1966 CE2 PHE A 120 1.965 2.755 7.794 1.00 0.00 C ATOM 1967 CZ PHE A 120 2.409 4.002 8.246 1.00 0.00 C ATOM 0 H PHE A 120 0.709 2.239 2.879 1.00 0.00 H new ATOM 0 HA PHE A 120 2.086 4.758 3.682 1.00 0.00 H new ATOM 0 HB2 PHE A 120 2.720 1.829 3.983 1.00 0.00 H new ATOM 0 HB3 PHE A 120 4.022 2.994 3.841 1.00 0.00 H new ATOM 0 HD1 PHE A 120 3.710 5.200 5.341 1.00 0.00 H new ATOM 0 HD2 PHE A 120 1.810 1.424 6.107 1.00 0.00 H new ATOM 0 HE1 PHE A 120 3.383 5.844 7.712 1.00 0.00 H new ATOM 0 HE2 PHE A 120 1.478 2.076 8.477 1.00 0.00 H new ATOM 0 HZ PHE A 120 2.265 4.285 9.278 1.00 0.00 H new ATOM 1977 N THR A 121 2.592 5.000 1.245 1.00 0.00 N ATOM 1978 CA THR A 121 3.019 5.193 -0.135 1.00 0.00 C ATOM 1979 C THR A 121 4.268 6.071 -0.196 1.00 0.00 C ATOM 1980 O THR A 121 4.364 7.084 0.498 1.00 0.00 O ATOM 1981 CB THR A 121 1.858 5.817 -0.936 1.00 0.00 C ATOM 1982 OG1 THR A 121 2.277 7.050 -1.503 1.00 0.00 O ATOM 1983 CG2 THR A 121 0.652 6.056 -0.012 1.00 0.00 C ATOM 0 H THR A 121 2.272 5.850 1.709 1.00 0.00 H new ATOM 0 HA THR A 121 3.279 4.230 -0.576 1.00 0.00 H new ATOM 0 HB THR A 121 1.567 5.133 -1.733 1.00 0.00 H new ATOM 0 HG1 THR A 121 1.507 7.652 -1.583 1.00 0.00 H new ATOM 0 HG21 THR A 121 -0.164 6.497 -0.585 1.00 0.00 H new ATOM 0 HG22 THR A 121 0.325 5.107 0.413 1.00 0.00 H new ATOM 0 HG23 THR A 121 0.938 6.734 0.792 1.00 0.00 H new ATOM 1991 N ALA A 122 5.233 5.651 -1.011 1.00 0.00 N ATOM 1992 CA ALA A 122 6.494 6.375 -1.141 1.00 0.00 C ATOM 1993 C ALA A 122 6.330 7.693 -1.890 1.00 0.00 C ATOM 1994 O ALA A 122 6.425 8.763 -1.290 1.00 0.00 O ATOM 1995 CB ALA A 122 7.522 5.501 -1.858 1.00 0.00 C ATOM 0 H ALA A 122 5.166 4.814 -1.590 1.00 0.00 H new ATOM 0 HA ALA A 122 6.839 6.610 -0.134 1.00 0.00 H new ATOM 0 HB1 ALA A 122 8.461 6.047 -1.952 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.688 4.589 -1.284 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.151 5.243 -2.850 1.00 0.00 H new ATOM 2001 N ARG A 123 6.114 7.627 -3.203 1.00 0.00 N ATOM 2002 CA ARG A 123 5.974 8.851 -3.983 1.00 0.00 C ATOM 2003 C ARG A 123 5.114 8.646 -5.229 1.00 0.00 C ATOM 2004 O ARG A 123 5.121 7.577 -5.837 1.00 0.00 O ATOM 2005 CB ARG A 123 7.360 9.354 -4.392 1.00 0.00 C ATOM 2006 CG ARG A 123 7.860 8.554 -5.601 1.00 0.00 C ATOM 2007 CD ARG A 123 9.391 8.536 -5.620 1.00 0.00 C ATOM 2008 NE ARG A 123 9.885 7.317 -4.991 1.00 0.00 N ATOM 2009 CZ ARG A 123 9.604 6.120 -5.497 1.00 0.00 C ATOM 2010 NH1 ARG A 123 8.858 6.021 -6.563 1.00 0.00 N ATOM 2011 NH2 ARG A 123 10.072 5.046 -4.925 1.00 0.00 N ATOM 0 H ARG A 123 6.034 6.761 -3.736 1.00 0.00 H new ATOM 0 HA ARG A 123 5.472 9.588 -3.356 1.00 0.00 H new ATOM 0 HB2 ARG A 123 7.315 10.415 -4.638 1.00 0.00 H new ATOM 0 HB3 ARG A 123 8.056 9.249 -3.560 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.477 7.535 -5.557 1.00 0.00 H new ATOM 0 HG3 ARG A 123 7.482 8.997 -6.522 1.00 0.00 H new ATOM 0 HD2 ARG A 123 9.751 8.596 -6.647 1.00 0.00 H new ATOM 0 HD3 ARG A 123 9.779 9.409 -5.095 1.00 0.00 H new ATOM 0 HE ARG A 123 10.456 7.384 -4.148 1.00 0.00 H new ATOM 0 HH11 ARG A 123 8.490 6.862 -7.008 1.00 0.00 H new ATOM 0 HH12 ARG A 123 8.642 5.103 -6.951 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.653 5.125 -4.090 1.00 0.00 H new ATOM 0 HH22 ARG A 123 9.857 4.127 -5.312 1.00 0.00 H new ATOM 2025 N ILE A 124 4.382 9.695 -5.599 1.00 0.00 N ATOM 2026 CA ILE A 124 3.516 9.658 -6.772 1.00 0.00 C ATOM 2027 C ILE A 124 3.774 10.873 -7.657 1.00 0.00 C ATOM 2028 O ILE A 124 3.627 12.012 -7.216 1.00 0.00 O ATOM 2029 CB ILE A 124 2.060 9.669 -6.326 1.00 0.00 C ATOM 2030 CG1 ILE A 124 1.815 10.925 -5.469 1.00 0.00 C ATOM 2031 CG2 ILE A 124 1.777 8.404 -5.514 1.00 0.00 C ATOM 2032 CD1 ILE A 124 0.640 10.703 -4.517 1.00 0.00 C ATOM 0 H ILE A 124 4.373 10.584 -5.100 1.00 0.00 H new ATOM 0 HA ILE A 124 3.727 8.751 -7.338 1.00 0.00 H new ATOM 0 HB ILE A 124 1.395 9.689 -7.189 1.00 0.00 H new ATOM 0 HG12 ILE A 124 2.713 11.164 -4.899 1.00 0.00 H new ATOM 0 HG13 ILE A 124 1.611 11.779 -6.115 1.00 0.00 H new ATOM 0 HG21 ILE A 124 0.736 8.404 -5.191 1.00 0.00 H new ATOM 0 HG22 ILE A 124 1.965 7.526 -6.131 1.00 0.00 H new ATOM 0 HG23 ILE A 124 2.428 8.379 -4.640 1.00 0.00 H new ATOM 0 HD11 ILE A 124 0.481 11.601 -3.919 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -0.260 10.487 -5.093 1.00 0.00 H new ATOM 0 HD13 ILE A 124 0.859 9.863 -3.858 1.00 0.00 H new ATOM 2044 N TYR A 125 4.158 10.626 -8.907 1.00 0.00 N ATOM 2045 CA TYR A 125 4.432 11.717 -9.841 1.00 0.00 C ATOM 2046 C TYR A 125 3.453 11.676 -11.011 1.00 0.00 C ATOM 2047 O TYR A 125 3.617 10.893 -11.946 1.00 0.00 O ATOM 2048 CB TYR A 125 5.875 11.605 -10.360 1.00 0.00 C ATOM 2049 CG TYR A 125 6.792 12.465 -9.518 1.00 0.00 C ATOM 2050 CD1 TYR A 125 7.031 12.133 -8.179 1.00 0.00 C ATOM 2051 CD2 TYR A 125 7.398 13.594 -10.079 1.00 0.00 C ATOM 2052 CE1 TYR A 125 7.878 12.932 -7.401 1.00 0.00 C ATOM 2053 CE2 TYR A 125 8.244 14.394 -9.302 1.00 0.00 C ATOM 2054 CZ TYR A 125 8.485 14.062 -7.962 1.00 0.00 C ATOM 2055 OH TYR A 125 9.318 14.852 -7.196 1.00 0.00 O ATOM 0 H TYR A 125 4.286 9.691 -9.294 1.00 0.00 H new ATOM 0 HA TYR A 125 4.309 12.666 -9.319 1.00 0.00 H new ATOM 0 HB2 TYR A 125 6.203 10.566 -10.326 1.00 0.00 H new ATOM 0 HB3 TYR A 125 5.922 11.920 -11.402 1.00 0.00 H new ATOM 0 HD1 TYR A 125 6.562 11.261 -7.746 1.00 0.00 H new ATOM 0 HD2 TYR A 125 7.213 13.849 -11.112 1.00 0.00 H new ATOM 0 HE1 TYR A 125 8.063 12.676 -6.368 1.00 0.00 H new ATOM 0 HE2 TYR A 125 8.711 15.266 -9.735 1.00 0.00 H new ATOM 0 HH TYR A 125 9.656 15.594 -7.740 1.00 0.00 H new ATOM 2065 N ASP A 126 2.443 12.541 -10.957 1.00 0.00 N ATOM 2066 CA ASP A 126 1.447 12.617 -12.018 1.00 0.00 C ATOM 2067 C ASP A 126 1.656 13.894 -12.821 1.00 0.00 C ATOM 2068 O ASP A 126 2.700 14.537 -12.713 1.00 0.00 O ATOM 2069 CB ASP A 126 0.038 12.602 -11.418 1.00 0.00 C ATOM 2070 CG ASP A 126 -0.411 11.165 -11.174 1.00 0.00 C ATOM 2071 OD1 ASP A 126 0.411 10.373 -10.746 1.00 0.00 O ATOM 2072 OD2 ASP A 126 -1.572 10.879 -11.420 1.00 0.00 O ATOM 0 H ASP A 126 2.294 13.197 -10.190 1.00 0.00 H new ATOM 0 HA ASP A 126 1.557 11.755 -12.676 1.00 0.00 H new ATOM 0 HB2 ASP A 126 0.027 13.159 -10.481 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -0.659 13.100 -12.093 1.00 0.00 H new ATOM 2148 N GLN A 132 -8.026 14.436 -8.871 1.00 0.00 N ATOM 2149 CA GLN A 132 -7.746 14.117 -7.475 1.00 0.00 C ATOM 2150 C GLN A 132 -9.030 13.805 -6.708 1.00 0.00 C ATOM 2151 O GLN A 132 -8.975 13.373 -5.556 1.00 0.00 O ATOM 2152 CB GLN A 132 -7.024 15.286 -6.804 1.00 0.00 C ATOM 2153 CG GLN A 132 -7.675 16.602 -7.228 1.00 0.00 C ATOM 2154 CD GLN A 132 -7.335 17.699 -6.223 1.00 0.00 C ATOM 2155 OE1 GLN A 132 -6.509 18.566 -6.506 1.00 0.00 O ATOM 2156 NE2 GLN A 132 -7.928 17.713 -5.061 1.00 0.00 N ATOM 0 HA GLN A 132 -7.110 13.232 -7.457 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -7.068 15.180 -5.720 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -5.970 15.284 -7.082 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -7.327 16.886 -8.221 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -8.756 16.479 -7.292 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -8.612 16.993 -4.829 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -7.707 18.444 -4.385 1.00 0.00 H new ATOM 2165 N GLU A 133 -10.178 14.051 -7.336 1.00 0.00 N ATOM 2166 CA GLU A 133 -11.463 13.816 -6.684 1.00 0.00 C ATOM 2167 C GLU A 133 -11.384 12.633 -5.719 1.00 0.00 C ATOM 2168 O GLU A 133 -11.470 12.812 -4.504 1.00 0.00 O ATOM 2169 CB GLU A 133 -12.551 13.566 -7.739 1.00 0.00 C ATOM 2170 CG GLU A 133 -11.927 12.996 -9.004 1.00 0.00 C ATOM 2171 CD GLU A 133 -13.020 12.592 -9.987 1.00 0.00 C ATOM 2172 OE1 GLU A 133 -13.970 13.346 -10.129 1.00 0.00 O ATOM 2173 OE2 GLU A 133 -12.895 11.535 -10.583 1.00 0.00 O ATOM 0 H GLU A 133 -10.244 14.410 -8.288 1.00 0.00 H new ATOM 0 HA GLU A 133 -11.719 14.705 -6.108 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -13.297 12.874 -7.348 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -13.069 14.497 -7.967 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -11.271 13.736 -9.461 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -11.310 12.132 -8.758 1.00 0.00 H new ATOM 2180 N GLY A 134 -11.213 11.433 -6.257 1.00 0.00 N ATOM 2181 CA GLY A 134 -11.120 10.245 -5.421 1.00 0.00 C ATOM 2182 C GLY A 134 -10.085 10.435 -4.319 1.00 0.00 C ATOM 2183 O GLY A 134 -10.394 10.309 -3.136 1.00 0.00 O ATOM 0 H GLY A 134 -11.137 11.257 -7.259 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -12.093 10.030 -4.979 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -10.851 9.385 -6.034 1.00 0.00 H new ATOM 2187 N LEU A 135 -8.857 10.738 -4.724 1.00 0.00 N ATOM 2188 CA LEU A 135 -7.767 10.943 -3.773 1.00 0.00 C ATOM 2189 C LEU A 135 -8.287 11.567 -2.478 1.00 0.00 C ATOM 2190 O LEU A 135 -8.231 10.959 -1.413 1.00 0.00 O ATOM 2191 CB LEU A 135 -6.711 11.870 -4.407 1.00 0.00 C ATOM 2192 CG LEU A 135 -5.307 11.257 -4.290 1.00 0.00 C ATOM 2193 CD1 LEU A 135 -4.297 12.181 -4.985 1.00 0.00 C ATOM 2194 CD2 LEU A 135 -4.921 11.085 -2.806 1.00 0.00 C ATOM 0 H LEU A 135 -8.590 10.847 -5.702 1.00 0.00 H new ATOM 0 HA LEU A 135 -7.321 9.977 -3.534 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -6.952 12.040 -5.456 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -6.731 12.842 -3.914 1.00 0.00 H new ATOM 0 HG LEU A 135 -5.301 10.277 -4.767 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -3.298 11.753 -4.906 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -4.564 12.287 -6.036 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -4.311 13.160 -4.507 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -3.924 10.650 -2.737 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -4.927 12.057 -2.313 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.639 10.426 -2.317 1.00 0.00 H new ATOM 2206 N ARG A 136 -8.777 12.793 -2.581 1.00 0.00 N ATOM 2207 CA ARG A 136 -9.291 13.498 -1.426 1.00 0.00 C ATOM 2208 C ARG A 136 -10.487 12.769 -0.820 1.00 0.00 C ATOM 2209 O ARG A 136 -10.802 12.943 0.359 1.00 0.00 O ATOM 2210 CB ARG A 136 -9.711 14.912 -1.842 1.00 0.00 C ATOM 2211 CG ARG A 136 -10.151 15.706 -0.606 1.00 0.00 C ATOM 2212 CD ARG A 136 -11.680 15.740 -0.508 1.00 0.00 C ATOM 2213 NE ARG A 136 -12.094 16.647 0.556 1.00 0.00 N ATOM 2214 CZ ARG A 136 -12.109 17.964 0.370 1.00 0.00 C ATOM 2215 NH1 ARG A 136 -11.758 18.464 -0.783 1.00 0.00 N ATOM 2216 NH2 ARG A 136 -12.475 18.756 1.341 1.00 0.00 N ATOM 0 H ARG A 136 -8.828 13.317 -3.455 1.00 0.00 H new ATOM 0 HA ARG A 136 -8.504 13.545 -0.673 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -8.881 15.418 -2.334 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -10.527 14.862 -2.563 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -9.733 15.253 0.293 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -9.761 16.722 -0.661 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -12.106 16.063 -1.458 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -12.062 14.738 -0.312 1.00 0.00 H new ATOM 0 HE ARG A 136 -12.377 16.265 1.458 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -11.472 17.845 -1.542 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -11.770 19.474 -0.926 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -12.749 18.365 2.242 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -12.487 19.766 1.199 1.00 0.00 H new ATOM 2230 N THR A 137 -11.160 11.970 -1.637 1.00 0.00 N ATOM 2231 CA THR A 137 -12.338 11.242 -1.186 1.00 0.00 C ATOM 2232 C THR A 137 -11.968 9.986 -0.394 1.00 0.00 C ATOM 2233 O THR A 137 -12.406 9.844 0.733 1.00 0.00 O ATOM 2234 CB THR A 137 -13.242 10.964 -2.406 1.00 0.00 C ATOM 2235 OG1 THR A 137 -14.486 11.619 -2.210 1.00 0.00 O ATOM 2236 CG2 THR A 137 -13.499 9.474 -2.626 1.00 0.00 C ATOM 0 H THR A 137 -10.911 11.810 -2.613 1.00 0.00 H new ATOM 0 HA THR A 137 -12.902 11.850 -0.479 1.00 0.00 H new ATOM 0 HB THR A 137 -12.725 11.340 -3.289 1.00 0.00 H new ATOM 0 HG1 THR A 137 -15.069 11.451 -2.980 1.00 0.00 H new ATOM 0 HG21 THR A 137 -14.140 9.340 -3.497 1.00 0.00 H new ATOM 0 HG22 THR A 137 -12.551 8.962 -2.791 1.00 0.00 H new ATOM 0 HG23 THR A 137 -13.989 9.056 -1.747 1.00 0.00 H new ATOM 2244 N LEU A 138 -11.166 9.089 -0.947 1.00 0.00 N ATOM 2245 CA LEU A 138 -10.796 7.886 -0.199 1.00 0.00 C ATOM 2246 C LEU A 138 -9.874 8.235 0.971 1.00 0.00 C ATOM 2247 O LEU A 138 -9.812 7.498 1.951 1.00 0.00 O ATOM 2248 CB LEU A 138 -10.188 6.827 -1.156 1.00 0.00 C ATOM 2249 CG LEU A 138 -8.707 6.638 -0.892 1.00 0.00 C ATOM 2250 CD1 LEU A 138 -8.117 5.595 -1.863 1.00 0.00 C ATOM 2251 CD2 LEU A 138 -7.974 7.982 -1.059 1.00 0.00 C ATOM 0 H LEU A 138 -10.766 9.161 -1.883 1.00 0.00 H new ATOM 0 HA LEU A 138 -11.691 7.443 0.239 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -10.707 5.877 -1.029 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -10.339 7.137 -2.190 1.00 0.00 H new ATOM 0 HG LEU A 138 -8.575 6.279 0.129 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -7.053 5.471 -1.661 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -8.626 4.641 -1.726 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -8.254 5.935 -2.889 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -6.910 7.842 -0.868 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -8.115 8.350 -2.075 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -8.377 8.707 -0.352 1.00 0.00 H new ATOM 2263 N ALA A 139 -9.175 9.361 0.877 1.00 0.00 N ATOM 2264 CA ALA A 139 -8.279 9.772 1.949 1.00 0.00 C ATOM 2265 C ALA A 139 -9.080 10.332 3.116 1.00 0.00 C ATOM 2266 O ALA A 139 -8.777 10.061 4.278 1.00 0.00 O ATOM 2267 CB ALA A 139 -7.300 10.833 1.441 1.00 0.00 C ATOM 0 H ALA A 139 -9.211 9.997 0.081 1.00 0.00 H new ATOM 0 HA ALA A 139 -7.718 8.901 2.286 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -6.635 11.132 2.251 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -6.711 10.422 0.621 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -7.856 11.702 1.088 1.00 0.00 H new ATOM 2273 N GLU A 140 -10.103 11.116 2.797 1.00 0.00 N ATOM 2274 CA GLU A 140 -10.943 11.715 3.822 1.00 0.00 C ATOM 2275 C GLU A 140 -12.075 10.797 4.198 1.00 0.00 C ATOM 2276 O GLU A 140 -12.469 10.709 5.361 1.00 0.00 O ATOM 2277 CB GLU A 140 -11.533 13.005 3.291 1.00 0.00 C ATOM 2278 CG GLU A 140 -10.426 14.037 3.139 1.00 0.00 C ATOM 2279 CD GLU A 140 -10.124 14.682 4.487 1.00 0.00 C ATOM 2280 OE1 GLU A 140 -10.942 15.465 4.942 1.00 0.00 O ATOM 2281 OE2 GLU A 140 -9.081 14.384 5.044 1.00 0.00 O ATOM 0 H GLU A 140 -10.369 11.350 1.840 1.00 0.00 H new ATOM 0 HA GLU A 140 -10.327 11.901 4.702 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -12.017 12.829 2.330 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -12.300 13.375 3.971 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -9.527 13.563 2.744 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -10.725 14.800 2.421 1.00 0.00 H new ATOM 2288 N ALA A 141 -12.612 10.138 3.198 1.00 0.00 N ATOM 2289 CA ALA A 141 -13.725 9.248 3.416 1.00 0.00 C ATOM 2290 C ALA A 141 -13.390 8.227 4.489 1.00 0.00 C ATOM 2291 O ALA A 141 -14.287 7.730 5.171 1.00 0.00 O ATOM 2292 CB ALA A 141 -14.118 8.565 2.117 1.00 0.00 C ATOM 0 H ALA A 141 -12.297 10.202 2.230 1.00 0.00 H new ATOM 0 HA ALA A 141 -14.576 9.833 3.764 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -14.960 7.896 2.298 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -14.404 9.318 1.382 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -13.273 7.990 1.738 1.00 0.00 H new ATOM 2298 N GLY A 142 -12.105 7.927 4.674 1.00 0.00 N ATOM 2299 CA GLY A 142 -11.746 6.978 5.722 1.00 0.00 C ATOM 2300 C GLY A 142 -10.403 6.290 5.504 1.00 0.00 C ATOM 2301 O GLY A 142 -9.932 5.582 6.395 1.00 0.00 O ATOM 0 H GLY A 142 -11.326 8.309 4.137 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -11.724 7.500 6.678 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -12.524 6.218 5.792 1.00 0.00 H new ATOM 2305 N ALA A 143 -9.769 6.475 4.351 1.00 0.00 N ATOM 2306 CA ALA A 143 -8.479 5.820 4.144 1.00 0.00 C ATOM 2307 C ALA A 143 -7.356 6.654 4.737 1.00 0.00 C ATOM 2308 O ALA A 143 -7.134 7.790 4.319 1.00 0.00 O ATOM 2309 CB ALA A 143 -8.202 5.601 2.659 1.00 0.00 C ATOM 0 H ALA A 143 -10.106 7.046 3.576 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.522 4.852 4.644 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -7.235 5.112 2.537 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.983 4.972 2.232 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -8.189 6.562 2.146 1.00 0.00 H new ATOM 2315 N LYS A 144 -6.641 6.088 5.708 1.00 0.00 N ATOM 2316 CA LYS A 144 -5.542 6.799 6.327 1.00 0.00 C ATOM 2317 C LYS A 144 -4.295 6.686 5.469 1.00 0.00 C ATOM 2318 O LYS A 144 -3.661 5.633 5.408 1.00 0.00 O ATOM 2319 CB LYS A 144 -5.262 6.236 7.698 1.00 0.00 C ATOM 2320 CG LYS A 144 -6.495 6.451 8.568 1.00 0.00 C ATOM 2321 CD LYS A 144 -6.432 5.526 9.764 1.00 0.00 C ATOM 2322 CE LYS A 144 -7.786 5.501 10.472 1.00 0.00 C ATOM 2323 NZ LYS A 144 -8.180 6.892 10.837 1.00 0.00 N ATOM 0 H LYS A 144 -6.806 5.150 6.074 1.00 0.00 H new ATOM 0 HA LYS A 144 -5.820 7.849 6.421 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -5.026 5.174 7.631 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -4.396 6.728 8.140 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -6.544 7.488 8.899 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -7.399 6.257 7.991 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -6.161 4.520 9.443 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -5.657 5.861 10.454 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -8.540 5.056 9.823 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -7.730 4.881 11.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -8.921 6.863 11.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -7.352 7.402 11.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -8.543 7.382 9.995 1.00 0.00 H new ATOM 2337 N ILE A 145 -3.952 7.774 4.802 1.00 0.00 N ATOM 2338 CA ILE A 145 -2.784 7.786 3.940 1.00 0.00 C ATOM 2339 C ILE A 145 -1.571 8.301 4.703 1.00 0.00 C ATOM 2340 O ILE A 145 -1.691 9.163 5.574 1.00 0.00 O ATOM 2341 CB ILE A 145 -3.031 8.690 2.730 1.00 0.00 C ATOM 2342 CG1 ILE A 145 -4.493 8.620 2.278 1.00 0.00 C ATOM 2343 CG2 ILE A 145 -2.134 8.254 1.577 1.00 0.00 C ATOM 2344 CD1 ILE A 145 -4.974 7.165 2.234 1.00 0.00 C ATOM 0 H ILE A 145 -4.463 8.656 4.840 1.00 0.00 H new ATOM 0 HA ILE A 145 -2.596 6.766 3.603 1.00 0.00 H new ATOM 0 HB ILE A 145 -2.803 9.716 3.020 1.00 0.00 H new ATOM 0 HG12 ILE A 145 -5.118 9.195 2.961 1.00 0.00 H new ATOM 0 HG13 ILE A 145 -4.597 9.073 1.292 1.00 0.00 H new ATOM 0 HG21 ILE A 145 -2.310 8.898 0.715 1.00 0.00 H new ATOM 0 HG22 ILE A 145 -1.090 8.330 1.880 1.00 0.00 H new ATOM 0 HG23 ILE A 145 -2.360 7.222 1.311 1.00 0.00 H new ATOM 0 HD11 ILE A 145 -6.015 7.135 1.911 1.00 0.00 H new ATOM 0 HD12 ILE A 145 -4.360 6.600 1.533 1.00 0.00 H new ATOM 0 HD13 ILE A 145 -4.890 6.724 3.227 1.00 0.00 H new ATOM 2356 N SER A 146 -0.400 7.776 4.364 1.00 0.00 N ATOM 2357 CA SER A 146 0.829 8.196 5.013 1.00 0.00 C ATOM 2358 C SER A 146 1.949 8.339 3.992 1.00 0.00 C ATOM 2359 O SER A 146 2.179 7.453 3.170 1.00 0.00 O ATOM 2360 CB SER A 146 1.215 7.180 6.091 1.00 0.00 C ATOM 2361 OG SER A 146 0.404 6.020 5.955 1.00 0.00 O ATOM 0 H SER A 146 -0.279 7.062 3.646 1.00 0.00 H new ATOM 0 HA SER A 146 0.669 9.168 5.481 1.00 0.00 H new ATOM 0 HB2 SER A 146 2.268 6.915 5.997 1.00 0.00 H new ATOM 0 HB3 SER A 146 1.084 7.616 7.081 1.00 0.00 H new ATOM 0 HG SER A 146 0.562 5.611 5.079 1.00 0.00 H new ATOM 2367 N ILE A 147 2.645 9.462 4.064 1.00 0.00 N ATOM 2368 CA ILE A 147 3.749 9.731 3.161 1.00 0.00 C ATOM 2369 C ILE A 147 5.027 9.135 3.745 1.00 0.00 C ATOM 2370 O ILE A 147 5.563 9.637 4.734 1.00 0.00 O ATOM 2371 CB ILE A 147 3.921 11.251 2.959 1.00 0.00 C ATOM 2372 CG1 ILE A 147 2.659 11.938 2.338 1.00 0.00 C ATOM 2373 CG2 ILE A 147 5.135 11.516 2.047 1.00 0.00 C ATOM 2374 CD1 ILE A 147 1.482 10.982 2.102 1.00 0.00 C ATOM 0 H ILE A 147 2.463 10.203 4.741 1.00 0.00 H new ATOM 0 HA ILE A 147 3.540 9.277 2.192 1.00 0.00 H new ATOM 0 HB ILE A 147 4.071 11.683 3.948 1.00 0.00 H new ATOM 0 HG12 ILE A 147 2.334 12.742 2.998 1.00 0.00 H new ATOM 0 HG13 ILE A 147 2.937 12.397 1.389 1.00 0.00 H new ATOM 0 HG21 ILE A 147 5.256 12.590 1.905 1.00 0.00 H new ATOM 0 HG22 ILE A 147 6.034 11.108 2.510 1.00 0.00 H new ATOM 0 HG23 ILE A 147 4.975 11.038 1.081 1.00 0.00 H new ATOM 0 HD11 ILE A 147 0.647 11.533 1.670 1.00 0.00 H new ATOM 0 HD12 ILE A 147 1.787 10.191 1.417 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.175 10.542 3.051 1.00 0.00 H new ATOM 2386 N MET A 148 5.493 8.043 3.140 1.00 0.00 N ATOM 2387 CA MET A 148 6.690 7.364 3.624 1.00 0.00 C ATOM 2388 C MET A 148 7.956 8.180 3.361 1.00 0.00 C ATOM 2389 O MET A 148 8.495 8.170 2.255 1.00 0.00 O ATOM 2390 CB MET A 148 6.814 5.984 2.964 1.00 0.00 C ATOM 2391 CG MET A 148 7.645 5.060 3.861 1.00 0.00 C ATOM 2392 SD MET A 148 8.533 3.868 2.828 1.00 0.00 S ATOM 2393 CE MET A 148 7.082 2.969 2.229 1.00 0.00 C ATOM 0 H MET A 148 5.063 7.614 2.321 1.00 0.00 H new ATOM 0 HA MET A 148 6.588 7.249 4.703 1.00 0.00 H new ATOM 0 HB2 MET A 148 5.824 5.557 2.802 1.00 0.00 H new ATOM 0 HB3 MET A 148 7.285 6.078 1.986 1.00 0.00 H new ATOM 0 HG2 MET A 148 8.351 5.645 4.451 1.00 0.00 H new ATOM 0 HG3 MET A 148 6.997 4.538 4.565 1.00 0.00 H new ATOM 0 HE1 MET A 148 7.398 2.033 1.770 1.00 0.00 H new ATOM 0 HE2 MET A 148 6.415 2.756 3.065 1.00 0.00 H new ATOM 0 HE3 MET A 148 6.557 3.576 1.491 1.00 0.00 H new ATOM 2403 N THR A 149 8.430 8.872 4.397 1.00 0.00 N ATOM 2404 CA THR A 149 9.644 9.679 4.291 1.00 0.00 C ATOM 2405 C THR A 149 10.836 8.924 4.887 1.00 0.00 C ATOM 2406 O THR A 149 10.694 7.789 5.340 1.00 0.00 O ATOM 2407 CB THR A 149 9.451 11.007 5.033 1.00 0.00 C ATOM 2408 OG1 THR A 149 8.560 10.810 6.121 1.00 0.00 O ATOM 2409 CG2 THR A 149 8.868 12.052 4.080 1.00 0.00 C ATOM 0 H THR A 149 7.992 8.890 5.318 1.00 0.00 H new ATOM 0 HA THR A 149 9.843 9.878 3.238 1.00 0.00 H new ATOM 0 HB THR A 149 10.414 11.358 5.405 1.00 0.00 H new ATOM 0 HG1 THR A 149 8.435 11.656 6.599 1.00 0.00 H new ATOM 0 HG21 THR A 149 8.733 12.994 4.612 1.00 0.00 H new ATOM 0 HG22 THR A 149 9.550 12.202 3.243 1.00 0.00 H new ATOM 0 HG23 THR A 149 7.905 11.705 3.705 1.00 0.00 H new ATOM 2417 N TYR A 150 12.009 9.560 4.871 1.00 0.00 N ATOM 2418 CA TYR A 150 13.222 8.939 5.400 1.00 0.00 C ATOM 2419 C TYR A 150 12.925 8.033 6.594 1.00 0.00 C ATOM 2420 O TYR A 150 13.106 6.818 6.513 1.00 0.00 O ATOM 2421 CB TYR A 150 14.228 10.021 5.808 1.00 0.00 C ATOM 2422 CG TYR A 150 13.598 10.968 6.792 1.00 0.00 C ATOM 2423 CD1 TYR A 150 12.761 11.991 6.334 1.00 0.00 C ATOM 2424 CD2 TYR A 150 13.859 10.829 8.156 1.00 0.00 C ATOM 2425 CE1 TYR A 150 12.181 12.878 7.247 1.00 0.00 C ATOM 2426 CE2 TYR A 150 13.281 11.716 9.071 1.00 0.00 C ATOM 2427 CZ TYR A 150 12.442 12.741 8.617 1.00 0.00 C ATOM 2428 OH TYR A 150 11.871 13.616 9.519 1.00 0.00 O ATOM 0 H TYR A 150 12.143 10.500 4.499 1.00 0.00 H new ATOM 0 HA TYR A 150 13.646 8.319 4.610 1.00 0.00 H new ATOM 0 HB2 TYR A 150 15.111 9.559 6.250 1.00 0.00 H new ATOM 0 HB3 TYR A 150 14.562 10.569 4.927 1.00 0.00 H new ATOM 0 HD1 TYR A 150 12.563 12.096 5.277 1.00 0.00 H new ATOM 0 HD2 TYR A 150 14.506 10.038 8.505 1.00 0.00 H new ATOM 0 HE1 TYR A 150 11.533 13.668 6.896 1.00 0.00 H new ATOM 0 HE2 TYR A 150 13.482 11.610 10.127 1.00 0.00 H new ATOM 0 HH TYR A 150 12.154 13.380 10.427 1.00 0.00 H new ATOM 2438 N SER A 151 12.479 8.619 7.699 1.00 0.00 N ATOM 2439 CA SER A 151 12.177 7.833 8.892 1.00 0.00 C ATOM 2440 C SER A 151 11.243 6.684 8.540 1.00 0.00 C ATOM 2441 O SER A 151 11.568 5.511 8.741 1.00 0.00 O ATOM 2442 CB SER A 151 11.527 8.721 9.958 1.00 0.00 C ATOM 2443 OG SER A 151 10.138 8.423 10.039 1.00 0.00 O ATOM 0 H SER A 151 12.320 9.622 7.795 1.00 0.00 H new ATOM 0 HA SER A 151 13.108 7.426 9.287 1.00 0.00 H new ATOM 0 HB2 SER A 151 12.003 8.555 10.925 1.00 0.00 H new ATOM 0 HB3 SER A 151 11.671 9.772 9.708 1.00 0.00 H new ATOM 0 HG SER A 151 9.721 8.989 10.722 1.00 0.00 H new ATOM 2449 N GLU A 152 10.087 7.036 8.005 1.00 0.00 N ATOM 2450 CA GLU A 152 9.100 6.046 7.608 1.00 0.00 C ATOM 2451 C GLU A 152 9.714 5.068 6.616 1.00 0.00 C ATOM 2452 O GLU A 152 9.177 3.988 6.375 1.00 0.00 O ATOM 2453 CB GLU A 152 7.908 6.747 6.967 1.00 0.00 C ATOM 2454 CG GLU A 152 7.202 7.623 8.006 1.00 0.00 C ATOM 2455 CD GLU A 152 6.167 6.801 8.767 1.00 0.00 C ATOM 2456 OE1 GLU A 152 6.565 6.034 9.629 1.00 0.00 O ATOM 2457 OE2 GLU A 152 4.992 6.951 8.477 1.00 0.00 O ATOM 0 H GLU A 152 9.808 8.002 7.835 1.00 0.00 H new ATOM 0 HA GLU A 152 8.769 5.496 8.489 1.00 0.00 H new ATOM 0 HB2 GLU A 152 8.242 7.358 6.129 1.00 0.00 H new ATOM 0 HB3 GLU A 152 7.213 6.009 6.567 1.00 0.00 H new ATOM 0 HG2 GLU A 152 7.932 8.036 8.701 1.00 0.00 H new ATOM 0 HG3 GLU A 152 6.718 8.466 7.514 1.00 0.00 H new ATOM 2464 N PHE A 153 10.846 5.458 6.044 1.00 0.00 N ATOM 2465 CA PHE A 153 11.531 4.610 5.083 1.00 0.00 C ATOM 2466 C PHE A 153 12.246 3.476 5.812 1.00 0.00 C ATOM 2467 O PHE A 153 11.815 2.323 5.776 1.00 0.00 O ATOM 2468 CB PHE A 153 12.540 5.447 4.278 1.00 0.00 C ATOM 2469 CG PHE A 153 12.536 5.009 2.832 1.00 0.00 C ATOM 2470 CD1 PHE A 153 11.403 5.222 2.037 1.00 0.00 C ATOM 2471 CD2 PHE A 153 13.664 4.386 2.294 1.00 0.00 C ATOM 2472 CE1 PHE A 153 11.402 4.807 0.701 1.00 0.00 C ATOM 2473 CE2 PHE A 153 13.663 3.972 0.958 1.00 0.00 C ATOM 2474 CZ PHE A 153 12.532 4.182 0.160 1.00 0.00 C ATOM 0 H PHE A 153 11.305 6.350 6.228 1.00 0.00 H new ATOM 0 HA PHE A 153 10.802 4.181 4.396 1.00 0.00 H new ATOM 0 HB2 PHE A 153 12.285 6.505 4.347 1.00 0.00 H new ATOM 0 HB3 PHE A 153 13.539 5.332 4.699 1.00 0.00 H new ATOM 0 HD1 PHE A 153 10.532 5.705 2.454 1.00 0.00 H new ATOM 0 HD2 PHE A 153 14.537 4.224 2.909 1.00 0.00 H new ATOM 0 HE1 PHE A 153 10.529 4.969 0.086 1.00 0.00 H new ATOM 0 HE2 PHE A 153 14.535 3.490 0.542 1.00 0.00 H new ATOM 0 HZ PHE A 153 12.531 3.862 -0.872 1.00 0.00 H new ATOM 2484 N LYS A 154 13.330 3.806 6.499 1.00 0.00 N ATOM 2485 CA LYS A 154 14.057 2.797 7.233 1.00 0.00 C ATOM 2486 C LYS A 154 13.048 1.966 8.029 1.00 0.00 C ATOM 2487 O LYS A 154 13.334 0.841 8.442 1.00 0.00 O ATOM 2488 CB LYS A 154 15.134 3.482 8.119 1.00 0.00 C ATOM 2489 CG LYS A 154 14.954 3.175 9.611 1.00 0.00 C ATOM 2490 CD LYS A 154 13.875 4.087 10.201 1.00 0.00 C ATOM 2491 CE LYS A 154 13.841 3.920 11.721 1.00 0.00 C ATOM 2492 NZ LYS A 154 12.601 4.544 12.264 1.00 0.00 N ATOM 0 H LYS A 154 13.715 4.748 6.560 1.00 0.00 H new ATOM 0 HA LYS A 154 14.592 2.117 6.570 1.00 0.00 H new ATOM 0 HB2 LYS A 154 16.123 3.153 7.801 1.00 0.00 H new ATOM 0 HB3 LYS A 154 15.092 4.560 7.966 1.00 0.00 H new ATOM 0 HG2 LYS A 154 14.674 2.130 9.746 1.00 0.00 H new ATOM 0 HG3 LYS A 154 15.896 3.323 10.138 1.00 0.00 H new ATOM 0 HD2 LYS A 154 14.081 5.126 9.943 1.00 0.00 H new ATOM 0 HD3 LYS A 154 12.902 3.840 9.775 1.00 0.00 H new ATOM 0 HE2 LYS A 154 13.872 2.862 11.982 1.00 0.00 H new ATOM 0 HE3 LYS A 154 14.720 4.385 12.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 12.579 4.430 13.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 12.590 5.557 12.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 11.768 4.081 11.847 1.00 0.00 H new ATOM 2506 N HIS A 155 11.852 2.525 8.204 1.00 0.00 N ATOM 2507 CA HIS A 155 10.790 1.829 8.917 1.00 0.00 C ATOM 2508 C HIS A 155 10.172 0.807 7.990 1.00 0.00 C ATOM 2509 O HIS A 155 9.890 -0.328 8.377 1.00 0.00 O ATOM 2510 CB HIS A 155 9.719 2.821 9.365 1.00 0.00 C ATOM 2511 CG HIS A 155 8.758 2.139 10.302 1.00 0.00 C ATOM 2512 ND1 HIS A 155 9.104 1.792 11.598 1.00 0.00 N ATOM 2513 CD2 HIS A 155 7.455 1.734 10.140 1.00 0.00 C ATOM 2514 CE1 HIS A 155 8.031 1.206 12.161 1.00 0.00 C ATOM 2515 NE2 HIS A 155 6.999 1.145 11.316 1.00 0.00 N ATOM 0 H HIS A 155 11.598 3.452 7.863 1.00 0.00 H new ATOM 0 HA HIS A 155 11.204 1.338 9.797 1.00 0.00 H new ATOM 0 HB2 HIS A 155 10.183 3.673 9.861 1.00 0.00 H new ATOM 0 HB3 HIS A 155 9.184 3.209 8.499 1.00 0.00 H new ATOM 0 HD2 HIS A 155 6.873 1.854 9.238 1.00 0.00 H new ATOM 0 HE1 HIS A 155 8.008 0.831 13.173 1.00 0.00 H new ATOM 0 HE2 HIS A 155 6.075 0.751 11.494 1.00 0.00 H new ATOM 2524 N CYS A 156 9.976 1.230 6.750 1.00 0.00 N ATOM 2525 CA CYS A 156 9.402 0.364 5.737 1.00 0.00 C ATOM 2526 C CYS A 156 10.209 -0.926 5.632 1.00 0.00 C ATOM 2527 O CYS A 156 9.681 -1.960 5.222 1.00 0.00 O ATOM 2528 CB CYS A 156 9.374 1.089 4.389 1.00 0.00 C ATOM 2529 SG CYS A 156 9.293 -0.118 3.041 1.00 0.00 S ATOM 0 H CYS A 156 10.207 2.168 6.423 1.00 0.00 H new ATOM 0 HA CYS A 156 8.380 0.111 6.020 1.00 0.00 H new ATOM 0 HB2 CYS A 156 8.514 1.757 4.343 1.00 0.00 H new ATOM 0 HB3 CYS A 156 10.264 1.709 4.281 1.00 0.00 H new ATOM 0 HG CYS A 156 9.199 -1.316 3.536 1.00 0.00 H new ATOM 2535 N TRP A 157 11.479 -0.874 6.033 1.00 0.00 N ATOM 2536 CA TRP A 157 12.310 -2.064 6.003 1.00 0.00 C ATOM 2537 C TRP A 157 12.005 -2.871 7.247 1.00 0.00 C ATOM 2538 O TRP A 157 11.522 -3.999 7.191 1.00 0.00 O ATOM 2539 CB TRP A 157 13.800 -1.681 6.014 1.00 0.00 C ATOM 2540 CG TRP A 157 14.324 -1.606 4.620 1.00 0.00 C ATOM 2541 CD1 TRP A 157 15.240 -2.444 4.097 1.00 0.00 C ATOM 2542 CD2 TRP A 157 13.994 -0.659 3.577 1.00 0.00 C ATOM 2543 NE1 TRP A 157 15.483 -2.078 2.786 1.00 0.00 N ATOM 2544 CE2 TRP A 157 14.738 -0.983 2.422 1.00 0.00 C ATOM 2545 CE3 TRP A 157 13.123 0.437 3.521 1.00 0.00 C ATOM 2546 CZ2 TRP A 157 14.624 -0.249 1.249 1.00 0.00 C ATOM 2547 CZ3 TRP A 157 13.003 1.187 2.340 1.00 0.00 C ATOM 2548 CH2 TRP A 157 13.754 0.841 1.204 1.00 0.00 C ATOM 0 H TRP A 157 11.943 -0.033 6.376 1.00 0.00 H new ATOM 0 HA TRP A 157 12.103 -2.635 5.098 1.00 0.00 H new ATOM 0 HB2 TRP A 157 13.932 -0.720 6.512 1.00 0.00 H new ATOM 0 HB3 TRP A 157 14.368 -2.416 6.584 1.00 0.00 H new ATOM 0 HD1 TRP A 157 15.708 -3.267 4.617 1.00 0.00 H new ATOM 0 HE1 TRP A 157 16.134 -2.561 2.167 1.00 0.00 H new ATOM 0 HE3 TRP A 157 12.541 0.706 4.390 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 15.204 -0.519 0.379 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 12.332 2.032 2.305 1.00 0.00 H new ATOM 0 HH2 TRP A 157 13.658 1.418 0.296 1.00 0.00 H new ATOM 2559 N ASP A 158 12.289 -2.239 8.367 1.00 0.00 N ATOM 2560 CA ASP A 158 12.068 -2.819 9.677 1.00 0.00 C ATOM 2561 C ASP A 158 10.684 -3.448 9.778 1.00 0.00 C ATOM 2562 O ASP A 158 10.403 -4.221 10.692 1.00 0.00 O ATOM 2563 CB ASP A 158 12.205 -1.686 10.694 1.00 0.00 C ATOM 2564 CG ASP A 158 11.530 -2.036 12.019 1.00 0.00 C ATOM 2565 OD1 ASP A 158 10.340 -2.305 12.007 1.00 0.00 O ATOM 2566 OD2 ASP A 158 12.210 -2.012 13.027 1.00 0.00 O ATOM 0 H ASP A 158 12.684 -1.299 8.395 1.00 0.00 H new ATOM 0 HA ASP A 158 12.793 -3.611 9.864 1.00 0.00 H new ATOM 0 HB2 ASP A 158 13.261 -1.477 10.867 1.00 0.00 H new ATOM 0 HB3 ASP A 158 11.762 -0.776 10.288 1.00 0.00 H new ATOM 2571 N THR A 159 9.823 -3.084 8.848 1.00 0.00 N ATOM 2572 CA THR A 159 8.452 -3.583 8.843 1.00 0.00 C ATOM 2573 C THR A 159 8.332 -4.920 8.109 1.00 0.00 C ATOM 2574 O THR A 159 7.607 -5.811 8.551 1.00 0.00 O ATOM 2575 CB THR A 159 7.545 -2.540 8.177 1.00 0.00 C ATOM 2576 OG1 THR A 159 7.547 -1.355 8.959 1.00 0.00 O ATOM 2577 CG2 THR A 159 6.114 -3.073 8.061 1.00 0.00 C ATOM 0 H THR A 159 10.043 -2.445 8.084 1.00 0.00 H new ATOM 0 HA THR A 159 8.146 -3.751 9.876 1.00 0.00 H new ATOM 0 HB THR A 159 7.921 -2.327 7.176 1.00 0.00 H new ATOM 0 HG1 THR A 159 8.222 -0.735 8.612 1.00 0.00 H new ATOM 0 HG21 THR A 159 5.483 -2.321 7.587 1.00 0.00 H new ATOM 0 HG22 THR A 159 6.112 -3.981 7.459 1.00 0.00 H new ATOM 0 HG23 THR A 159 5.727 -3.296 9.055 1.00 0.00 H new ATOM 2585 N PHE A 160 9.023 -5.051 6.978 1.00 0.00 N ATOM 2586 CA PHE A 160 8.957 -6.281 6.186 1.00 0.00 C ATOM 2587 C PHE A 160 10.311 -6.998 6.159 1.00 0.00 C ATOM 2588 O PHE A 160 10.433 -8.082 5.587 1.00 0.00 O ATOM 2589 CB PHE A 160 8.488 -5.925 4.755 1.00 0.00 C ATOM 2590 CG PHE A 160 9.470 -6.416 3.711 1.00 0.00 C ATOM 2591 CD1 PHE A 160 9.393 -7.733 3.244 1.00 0.00 C ATOM 2592 CD2 PHE A 160 10.456 -5.554 3.217 1.00 0.00 C ATOM 2593 CE1 PHE A 160 10.302 -8.187 2.282 1.00 0.00 C ATOM 2594 CE2 PHE A 160 11.365 -6.008 2.255 1.00 0.00 C ATOM 2595 CZ PHE A 160 11.288 -7.325 1.787 1.00 0.00 C ATOM 0 H PHE A 160 9.630 -4.329 6.591 1.00 0.00 H new ATOM 0 HA PHE A 160 8.244 -6.967 6.644 1.00 0.00 H new ATOM 0 HB2 PHE A 160 7.509 -6.367 4.571 1.00 0.00 H new ATOM 0 HB3 PHE A 160 8.372 -4.845 4.667 1.00 0.00 H new ATOM 0 HD1 PHE A 160 8.633 -8.398 3.626 1.00 0.00 H new ATOM 0 HD2 PHE A 160 10.515 -4.538 3.579 1.00 0.00 H new ATOM 0 HE1 PHE A 160 10.243 -9.203 1.921 1.00 0.00 H new ATOM 0 HE2 PHE A 160 12.126 -5.343 1.874 1.00 0.00 H new ATOM 0 HZ PHE A 160 11.989 -7.676 1.044 1.00 0.00 H new ATOM 2605 N VAL A 161 11.320 -6.384 6.756 1.00 0.00 N ATOM 2606 CA VAL A 161 12.649 -6.958 6.775 1.00 0.00 C ATOM 2607 C VAL A 161 12.916 -7.669 8.098 1.00 0.00 C ATOM 2608 O VAL A 161 12.508 -7.197 9.160 1.00 0.00 O ATOM 2609 CB VAL A 161 13.657 -5.835 6.571 1.00 0.00 C ATOM 2610 CG1 VAL A 161 15.067 -6.390 6.666 1.00 0.00 C ATOM 2611 CG2 VAL A 161 13.443 -5.206 5.189 1.00 0.00 C ATOM 0 H VAL A 161 11.240 -5.486 7.234 1.00 0.00 H new ATOM 0 HA VAL A 161 12.739 -7.697 5.978 1.00 0.00 H new ATOM 0 HB VAL A 161 13.518 -5.077 7.342 1.00 0.00 H new ATOM 0 HG11 VAL A 161 15.786 -5.584 6.520 1.00 0.00 H new ATOM 0 HG12 VAL A 161 15.217 -6.836 7.649 1.00 0.00 H new ATOM 0 HG13 VAL A 161 15.212 -7.149 5.897 1.00 0.00 H new ATOM 0 HG21 VAL A 161 14.163 -4.402 5.040 1.00 0.00 H new ATOM 0 HG22 VAL A 161 13.582 -5.965 4.419 1.00 0.00 H new ATOM 0 HG23 VAL A 161 12.432 -4.804 5.125 1.00 0.00 H new ATOM 2621 N ASP A 162 13.605 -8.805 8.026 1.00 0.00 N ATOM 2622 CA ASP A 162 13.923 -9.572 9.226 1.00 0.00 C ATOM 2623 C ASP A 162 14.993 -8.864 10.044 1.00 0.00 C ATOM 2624 O ASP A 162 15.771 -9.494 10.759 1.00 0.00 O ATOM 2625 CB ASP A 162 14.407 -10.972 8.844 1.00 0.00 C ATOM 2626 CG ASP A 162 14.727 -11.776 10.100 1.00 0.00 C ATOM 2627 OD1 ASP A 162 13.794 -12.226 10.744 1.00 0.00 O ATOM 2628 OD2 ASP A 162 15.900 -11.929 10.399 1.00 0.00 O ATOM 0 H ASP A 162 13.951 -9.212 7.157 1.00 0.00 H new ATOM 0 HA ASP A 162 13.019 -9.657 9.829 1.00 0.00 H new ATOM 0 HB2 ASP A 162 13.641 -11.483 8.261 1.00 0.00 H new ATOM 0 HB3 ASP A 162 15.293 -10.900 8.213 1.00 0.00 H new ATOM 2633 N HIS A 163 15.009 -7.548 9.931 1.00 0.00 N ATOM 2634 CA HIS A 163 15.967 -6.728 10.656 1.00 0.00 C ATOM 2635 C HIS A 163 15.395 -5.335 10.894 1.00 0.00 C ATOM 2636 O HIS A 163 15.233 -4.548 9.962 1.00 0.00 O ATOM 2637 CB HIS A 163 17.267 -6.608 9.867 1.00 0.00 C ATOM 2638 CG HIS A 163 17.667 -7.961 9.342 1.00 0.00 C ATOM 2639 ND1 HIS A 163 18.186 -9.067 9.967 1.00 0.00 N flip ATOM 2640 CD2 HIS A 163 17.551 -8.303 8.002 1.00 0.00 C flip ATOM 2641 CE1 HIS A 163 18.390 -10.081 9.036 1.00 0.00 C flip ATOM 2642 NE2 HIS A 163 17.992 -9.569 7.869 1.00 0.00 N flip ATOM 0 H HIS A 163 14.366 -7.020 9.341 1.00 0.00 H new ATOM 0 HA HIS A 163 16.169 -7.206 11.614 1.00 0.00 H new ATOM 0 HB2 HIS A 163 17.139 -5.909 9.040 1.00 0.00 H new ATOM 0 HB3 HIS A 163 18.055 -6.207 10.504 1.00 0.00 H new ATOM 0 HD2 HIS A 163 17.176 -7.670 7.211 1.00 0.00 H new ATOM 0 HE1 HIS A 163 18.785 -11.069 9.218 1.00 0.00 H new ATOM 0 HE2 HIS A 163 18.019 -10.075 6.984 1.00 0.00 H new ATOM 2651 N GLN A 164 15.095 -5.044 12.149 1.00 0.00 N ATOM 2652 CA GLN A 164 14.541 -3.750 12.520 1.00 0.00 C ATOM 2653 C GLN A 164 15.609 -2.666 12.405 1.00 0.00 C ATOM 2654 O GLN A 164 15.421 -1.542 12.870 1.00 0.00 O ATOM 2655 CB GLN A 164 14.008 -3.809 13.956 1.00 0.00 C ATOM 2656 CG GLN A 164 12.662 -4.553 13.987 1.00 0.00 C ATOM 2657 CD GLN A 164 11.890 -4.181 15.248 1.00 0.00 C ATOM 2658 OE1 GLN A 164 11.848 -5.020 16.245 1.00 0.00 O flip ATOM 2659 NE2 GLN A 164 11.306 -3.099 15.324 1.00 0.00 N flip ATOM 0 H GLN A 164 15.226 -5.687 12.930 1.00 0.00 H new ATOM 0 HA GLN A 164 13.722 -3.507 11.842 1.00 0.00 H new ATOM 0 HB2 GLN A 164 14.728 -4.315 14.599 1.00 0.00 H new ATOM 0 HB3 GLN A 164 13.884 -2.800 14.349 1.00 0.00 H new ATOM 0 HG2 GLN A 164 12.076 -4.299 13.104 1.00 0.00 H new ATOM 0 HG3 GLN A 164 12.831 -5.629 13.958 1.00 0.00 H new ATOM 0 HE21 GLN A 164 11.341 -2.445 14.542 1.00 0.00 H new ATOM 0 HE22 GLN A 164 10.788 -2.857 16.169 1.00 0.00 H new ATOM 2668 N GLY A 165 16.726 -3.014 11.773 1.00 0.00 N ATOM 2669 CA GLY A 165 17.822 -2.068 11.591 1.00 0.00 C ATOM 2670 C GLY A 165 18.568 -2.348 10.291 1.00 0.00 C ATOM 2671 O GLY A 165 19.798 -2.375 10.259 1.00 0.00 O ATOM 0 H GLY A 165 16.896 -3.940 11.380 1.00 0.00 H new ATOM 0 HA2 GLY A 165 17.432 -1.050 11.580 1.00 0.00 H new ATOM 0 HA3 GLY A 165 18.511 -2.136 12.433 1.00 0.00 H new ATOM 2675 N CYS A 166 17.808 -2.559 9.224 1.00 0.00 N ATOM 2676 CA CYS A 166 18.390 -2.841 7.914 1.00 0.00 C ATOM 2677 C CYS A 166 19.506 -1.841 7.594 1.00 0.00 C ATOM 2678 O CYS A 166 19.479 -0.706 8.070 1.00 0.00 O ATOM 2679 CB CYS A 166 17.296 -2.766 6.847 1.00 0.00 C ATOM 2680 SG CYS A 166 17.027 -1.040 6.370 1.00 0.00 S ATOM 0 H CYS A 166 16.788 -2.541 9.238 1.00 0.00 H new ATOM 0 HA CYS A 166 18.821 -3.842 7.925 1.00 0.00 H new ATOM 0 HB2 CYS A 166 17.584 -3.354 5.975 1.00 0.00 H new ATOM 0 HB3 CYS A 166 16.371 -3.196 7.230 1.00 0.00 H new ATOM 0 HG CYS A 166 16.208 -0.991 5.362 1.00 0.00 H new ATOM 2686 N PRO A 167 20.486 -2.235 6.812 1.00 0.00 N ATOM 2687 CA PRO A 167 21.629 -1.345 6.447 1.00 0.00 C ATOM 2688 C PRO A 167 21.262 -0.289 5.402 1.00 0.00 C ATOM 2689 O PRO A 167 22.127 0.449 4.932 1.00 0.00 O ATOM 2690 CB PRO A 167 22.668 -2.317 5.889 1.00 0.00 C ATOM 2691 CG PRO A 167 21.875 -3.446 5.325 1.00 0.00 C ATOM 2692 CD PRO A 167 20.623 -3.570 6.193 1.00 0.00 C ATOM 0 HA PRO A 167 21.976 -0.767 7.304 1.00 0.00 H new ATOM 0 HB2 PRO A 167 23.280 -1.843 5.122 1.00 0.00 H new ATOM 0 HB3 PRO A 167 23.346 -2.662 6.670 1.00 0.00 H new ATOM 0 HG2 PRO A 167 21.609 -3.253 4.286 1.00 0.00 H new ATOM 0 HG3 PRO A 167 22.451 -4.371 5.340 1.00 0.00 H new ATOM 0 HD2 PRO A 167 19.747 -3.826 5.597 1.00 0.00 H new ATOM 0 HD3 PRO A 167 20.735 -4.350 6.946 1.00 0.00 H new ATOM 2700 N PHE A 168 19.983 -0.213 5.042 1.00 0.00 N ATOM 2701 CA PHE A 168 19.546 0.771 4.054 1.00 0.00 C ATOM 2702 C PHE A 168 19.736 2.182 4.595 1.00 0.00 C ATOM 2703 O PHE A 168 19.802 2.389 5.806 1.00 0.00 O ATOM 2704 CB PHE A 168 18.074 0.562 3.695 1.00 0.00 C ATOM 2705 CG PHE A 168 17.779 1.217 2.367 1.00 0.00 C ATOM 2706 CD1 PHE A 168 17.483 2.584 2.311 1.00 0.00 C ATOM 2707 CD2 PHE A 168 17.797 0.456 1.191 1.00 0.00 C ATOM 2708 CE1 PHE A 168 17.205 3.190 1.080 1.00 0.00 C ATOM 2709 CE2 PHE A 168 17.519 1.063 -0.041 1.00 0.00 C ATOM 2710 CZ PHE A 168 17.223 2.430 -0.096 1.00 0.00 C ATOM 0 H PHE A 168 19.242 -0.809 5.412 1.00 0.00 H new ATOM 0 HA PHE A 168 20.152 0.640 3.158 1.00 0.00 H new ATOM 0 HB2 PHE A 168 17.849 -0.503 3.644 1.00 0.00 H new ATOM 0 HB3 PHE A 168 17.436 0.986 4.471 1.00 0.00 H new ATOM 0 HD1 PHE A 168 17.469 3.171 3.217 1.00 0.00 H new ATOM 0 HD2 PHE A 168 18.025 -0.599 1.234 1.00 0.00 H new ATOM 0 HE1 PHE A 168 16.976 4.245 1.037 1.00 0.00 H new ATOM 0 HE2 PHE A 168 17.533 0.476 -0.948 1.00 0.00 H new ATOM 0 HZ PHE A 168 17.009 2.898 -1.045 1.00 0.00 H new ATOM 2720 N GLN A 169 19.833 3.151 3.690 1.00 0.00 N ATOM 2721 CA GLN A 169 20.023 4.542 4.090 1.00 0.00 C ATOM 2722 C GLN A 169 19.183 5.487 3.225 1.00 0.00 C ATOM 2723 O GLN A 169 18.797 5.143 2.109 1.00 0.00 O ATOM 2724 CB GLN A 169 21.507 4.910 3.980 1.00 0.00 C ATOM 2725 CG GLN A 169 22.144 4.882 5.369 1.00 0.00 C ATOM 2726 CD GLN A 169 23.635 5.176 5.273 1.00 0.00 C ATOM 2727 OE1 GLN A 169 24.056 6.000 4.461 1.00 0.00 O ATOM 2728 NE2 GLN A 169 24.462 4.549 6.060 1.00 0.00 N ATOM 0 H GLN A 169 19.784 3.001 2.682 1.00 0.00 H new ATOM 0 HA GLN A 169 19.694 4.651 5.124 1.00 0.00 H new ATOM 0 HB2 GLN A 169 22.018 4.209 3.320 1.00 0.00 H new ATOM 0 HB3 GLN A 169 21.615 5.901 3.539 1.00 0.00 H new ATOM 0 HG2 GLN A 169 21.662 5.618 6.012 1.00 0.00 H new ATOM 0 HG3 GLN A 169 21.988 3.906 5.829 1.00 0.00 H new ATOM 0 HE21 GLN A 169 24.109 3.867 6.731 1.00 0.00 H new ATOM 0 HE22 GLN A 169 25.462 4.740 6.005 1.00 0.00 H new ATOM 2737 N PRO A 170 18.897 6.665 3.727 1.00 0.00 N ATOM 2738 CA PRO A 170 18.091 7.688 3.004 1.00 0.00 C ATOM 2739 C PRO A 170 18.946 8.579 2.103 1.00 0.00 C ATOM 2740 O PRO A 170 19.980 9.089 2.531 1.00 0.00 O ATOM 2741 CB PRO A 170 17.520 8.499 4.161 1.00 0.00 C ATOM 2742 CG PRO A 170 18.618 8.526 5.159 1.00 0.00 C ATOM 2743 CD PRO A 170 19.307 7.170 5.055 1.00 0.00 C ATOM 0 HA PRO A 170 17.350 7.251 2.335 1.00 0.00 H new ATOM 0 HB2 PRO A 170 17.244 9.505 3.845 1.00 0.00 H new ATOM 0 HB3 PRO A 170 16.622 8.035 4.569 1.00 0.00 H new ATOM 0 HG2 PRO A 170 19.316 9.336 4.950 1.00 0.00 H new ATOM 0 HG3 PRO A 170 18.229 8.691 6.164 1.00 0.00 H new ATOM 0 HD2 PRO A 170 20.390 7.265 5.129 1.00 0.00 H new ATOM 0 HD3 PRO A 170 18.991 6.499 5.853 1.00 0.00 H new ATOM 2751 N TRP A 171 18.508 8.776 0.860 1.00 0.00 N ATOM 2752 CA TRP A 171 19.252 9.623 -0.067 1.00 0.00 C ATOM 2753 C TRP A 171 18.738 11.061 -0.003 1.00 0.00 C ATOM 2754 O TRP A 171 17.588 11.305 0.373 1.00 0.00 O ATOM 2755 CB TRP A 171 19.130 9.087 -1.494 1.00 0.00 C ATOM 2756 CG TRP A 171 17.706 9.131 -1.926 1.00 0.00 C ATOM 2757 CD1 TRP A 171 17.171 10.030 -2.781 1.00 0.00 C ATOM 2758 CD2 TRP A 171 16.635 8.242 -1.542 1.00 0.00 C ATOM 2759 NE1 TRP A 171 15.818 9.753 -2.925 1.00 0.00 N ATOM 2760 CE2 TRP A 171 15.447 8.650 -2.184 1.00 0.00 C ATOM 2761 CE3 TRP A 171 16.586 7.132 -0.699 1.00 0.00 C ATOM 2762 CZ2 TRP A 171 14.246 7.967 -1.989 1.00 0.00 C ATOM 2763 CZ3 TRP A 171 15.396 6.445 -0.499 1.00 0.00 C ATOM 2764 CH2 TRP A 171 14.226 6.856 -1.142 1.00 0.00 C ATOM 0 H TRP A 171 17.655 8.367 0.477 1.00 0.00 H new ATOM 0 HA TRP A 171 20.302 9.612 0.224 1.00 0.00 H new ATOM 0 HB2 TRP A 171 19.744 9.682 -2.170 1.00 0.00 H new ATOM 0 HB3 TRP A 171 19.503 8.064 -1.542 1.00 0.00 H new ATOM 0 HD1 TRP A 171 17.706 10.830 -3.271 1.00 0.00 H new ATOM 0 HE1 TRP A 171 15.179 10.296 -3.505 1.00 0.00 H new ATOM 0 HE3 TRP A 171 17.483 6.803 -0.196 1.00 0.00 H new ATOM 0 HZ2 TRP A 171 13.344 8.293 -2.486 1.00 0.00 H new ATOM 0 HZ3 TRP A 171 15.375 5.588 0.158 1.00 0.00 H new ATOM 0 HH2 TRP A 171 13.305 6.314 -0.984 1.00 0.00 H new ATOM 2775 N ASP A 172 19.604 12.006 -0.359 1.00 0.00 N ATOM 2776 CA ASP A 172 19.249 13.423 -0.323 1.00 0.00 C ATOM 2777 C ASP A 172 18.208 13.775 -1.380 1.00 0.00 C ATOM 2778 O ASP A 172 18.303 14.809 -2.042 1.00 0.00 O ATOM 2779 CB ASP A 172 20.494 14.272 -0.545 1.00 0.00 C ATOM 2780 CG ASP A 172 21.397 14.206 0.682 1.00 0.00 C ATOM 2781 OD1 ASP A 172 21.329 13.215 1.391 1.00 0.00 O ATOM 2782 OD2 ASP A 172 22.143 15.147 0.896 1.00 0.00 O ATOM 0 H ASP A 172 20.555 11.817 -0.675 1.00 0.00 H new ATOM 0 HA ASP A 172 18.820 13.629 0.658 1.00 0.00 H new ATOM 0 HB2 ASP A 172 21.034 13.918 -1.423 1.00 0.00 H new ATOM 0 HB3 ASP A 172 20.209 15.306 -0.742 1.00 0.00 H new ATOM 2787 N GLY A 173 17.208 12.922 -1.512 1.00 0.00 N ATOM 2788 CA GLY A 173 16.128 13.149 -2.471 1.00 0.00 C ATOM 2789 C GLY A 173 14.781 12.959 -1.791 1.00 0.00 C ATOM 2790 O GLY A 173 13.809 13.642 -2.116 1.00 0.00 O ATOM 0 H GLY A 173 17.116 12.063 -0.969 1.00 0.00 H new ATOM 0 HA2 GLY A 173 16.199 14.157 -2.880 1.00 0.00 H new ATOM 0 HA3 GLY A 173 16.223 12.458 -3.308 1.00 0.00 H new ATOM 2794 N LEU A 174 14.731 12.034 -0.834 1.00 0.00 N ATOM 2795 CA LEU A 174 13.508 11.774 -0.108 1.00 0.00 C ATOM 2796 C LEU A 174 12.782 13.081 0.171 1.00 0.00 C ATOM 2797 O LEU A 174 11.553 13.134 0.236 1.00 0.00 O ATOM 2798 CB LEU A 174 13.847 11.103 1.208 1.00 0.00 C ATOM 2799 CG LEU A 174 14.211 9.645 0.937 1.00 0.00 C ATOM 2800 CD1 LEU A 174 15.020 9.106 2.103 1.00 0.00 C ATOM 2801 CD2 LEU A 174 12.946 8.802 0.755 1.00 0.00 C ATOM 0 H LEU A 174 15.524 11.459 -0.551 1.00 0.00 H new ATOM 0 HA LEU A 174 12.865 11.127 -0.705 1.00 0.00 H new ATOM 0 HB2 LEU A 174 14.679 11.616 1.690 1.00 0.00 H new ATOM 0 HB3 LEU A 174 12.999 11.160 1.890 1.00 0.00 H new ATOM 0 HG LEU A 174 14.800 9.591 0.021 1.00 0.00 H new ATOM 0 HD11 LEU A 174 15.282 8.065 1.914 1.00 0.00 H new ATOM 0 HD12 LEU A 174 15.930 9.694 2.217 1.00 0.00 H new ATOM 0 HD13 LEU A 174 14.429 9.171 3.017 1.00 0.00 H new ATOM 0 HD21 LEU A 174 13.224 7.766 0.563 1.00 0.00 H new ATOM 0 HD22 LEU A 174 12.341 8.853 1.660 1.00 0.00 H new ATOM 0 HD23 LEU A 174 12.371 9.186 -0.088 1.00 0.00 H new ATOM 2813 N ASP A 175 13.574 14.130 0.338 1.00 0.00 N ATOM 2814 CA ASP A 175 13.051 15.455 0.617 1.00 0.00 C ATOM 2815 C ASP A 175 12.150 15.916 -0.512 1.00 0.00 C ATOM 2816 O ASP A 175 10.941 16.075 -0.343 1.00 0.00 O ATOM 2817 CB ASP A 175 14.214 16.434 0.759 1.00 0.00 C ATOM 2818 CG ASP A 175 15.262 16.158 -0.314 1.00 0.00 C ATOM 2819 OD1 ASP A 175 15.722 15.030 -0.387 1.00 0.00 O ATOM 2820 OD2 ASP A 175 15.589 17.078 -1.044 1.00 0.00 O ATOM 0 H ASP A 175 14.592 14.085 0.284 1.00 0.00 H new ATOM 0 HA ASP A 175 12.473 15.420 1.541 1.00 0.00 H new ATOM 0 HB2 ASP A 175 13.851 17.458 0.670 1.00 0.00 H new ATOM 0 HB3 ASP A 175 14.661 16.339 1.749 1.00 0.00 H new ATOM 2825 N GLU A 176 12.760 16.124 -1.667 1.00 0.00 N ATOM 2826 CA GLU A 176 12.024 16.566 -2.841 1.00 0.00 C ATOM 2827 C GLU A 176 10.836 15.656 -3.081 1.00 0.00 C ATOM 2828 O GLU A 176 9.702 16.113 -3.223 1.00 0.00 O ATOM 2829 CB GLU A 176 12.930 16.546 -4.062 1.00 0.00 C ATOM 2830 CG GLU A 176 12.261 17.307 -5.209 1.00 0.00 C ATOM 2831 CD GLU A 176 13.122 17.224 -6.464 1.00 0.00 C ATOM 2832 OE1 GLU A 176 13.046 16.215 -7.146 1.00 0.00 O ATOM 2833 OE2 GLU A 176 13.846 18.171 -6.725 1.00 0.00 O ATOM 0 H GLU A 176 13.761 15.994 -1.817 1.00 0.00 H new ATOM 0 HA GLU A 176 11.671 17.583 -2.670 1.00 0.00 H new ATOM 0 HB2 GLU A 176 13.891 17.001 -3.822 1.00 0.00 H new ATOM 0 HB3 GLU A 176 13.130 15.517 -4.362 1.00 0.00 H new ATOM 0 HG2 GLU A 176 11.274 16.888 -5.407 1.00 0.00 H new ATOM 0 HG3 GLU A 176 12.114 18.350 -4.927 1.00 0.00 H new ATOM 2840 N HIS A 177 11.110 14.362 -3.114 1.00 0.00 N ATOM 2841 CA HIS A 177 10.058 13.378 -3.328 1.00 0.00 C ATOM 2842 C HIS A 177 8.917 13.621 -2.349 1.00 0.00 C ATOM 2843 O HIS A 177 7.753 13.691 -2.741 1.00 0.00 O ATOM 2844 CB HIS A 177 10.614 11.964 -3.147 1.00 0.00 C ATOM 2845 CG HIS A 177 11.557 11.656 -4.276 1.00 0.00 C ATOM 2846 ND1 HIS A 177 12.923 11.533 -4.085 1.00 0.00 N ATOM 2847 CD2 HIS A 177 11.346 11.457 -5.618 1.00 0.00 C ATOM 2848 CE1 HIS A 177 13.479 11.271 -5.281 1.00 0.00 C ATOM 2849 NE2 HIS A 177 12.562 11.214 -6.251 1.00 0.00 N ATOM 0 H HIS A 177 12.044 13.969 -2.996 1.00 0.00 H new ATOM 0 HA HIS A 177 9.681 13.478 -4.346 1.00 0.00 H new ATOM 0 HB2 HIS A 177 11.133 11.884 -2.192 1.00 0.00 H new ATOM 0 HB3 HIS A 177 9.800 11.240 -3.129 1.00 0.00 H new ATOM 0 HD2 HIS A 177 10.384 11.485 -6.108 1.00 0.00 H new ATOM 0 HE1 HIS A 177 14.537 11.125 -5.438 1.00 0.00 H new ATOM 0 HE2 HIS A 177 12.719 11.032 -7.242 1.00 0.00 H new ATOM 2858 N SER A 178 9.261 13.769 -1.074 1.00 0.00 N ATOM 2859 CA SER A 178 8.257 14.027 -0.050 1.00 0.00 C ATOM 2860 C SER A 178 7.379 15.197 -0.477 1.00 0.00 C ATOM 2861 O SER A 178 6.185 15.038 -0.719 1.00 0.00 O ATOM 2862 CB SER A 178 8.937 14.359 1.276 1.00 0.00 C ATOM 2863 OG SER A 178 7.961 14.376 2.307 1.00 0.00 O ATOM 0 H SER A 178 10.219 13.715 -0.728 1.00 0.00 H new ATOM 0 HA SER A 178 7.642 13.136 0.076 1.00 0.00 H new ATOM 0 HB2 SER A 178 9.707 13.620 1.499 1.00 0.00 H new ATOM 0 HB3 SER A 178 9.433 15.327 1.212 1.00 0.00 H new ATOM 0 HG SER A 178 8.392 14.587 3.162 1.00 0.00 H new ATOM 2869 N GLN A 179 7.993 16.370 -0.581 1.00 0.00 N ATOM 2870 CA GLN A 179 7.281 17.572 -0.997 1.00 0.00 C ATOM 2871 C GLN A 179 6.219 17.230 -2.028 1.00 0.00 C ATOM 2872 O GLN A 179 5.095 17.729 -1.983 1.00 0.00 O ATOM 2873 CB GLN A 179 8.268 18.548 -1.634 1.00 0.00 C ATOM 2874 CG GLN A 179 7.614 19.924 -1.774 1.00 0.00 C ATOM 2875 CD GLN A 179 8.560 20.879 -2.493 1.00 0.00 C ATOM 2876 OE1 GLN A 179 9.464 20.403 -3.303 1.00 0.00 O flip ATOM 2877 NE2 GLN A 179 8.470 22.094 -2.313 1.00 0.00 N flip ATOM 0 H GLN A 179 8.983 16.514 -0.383 1.00 0.00 H new ATOM 0 HA GLN A 179 6.810 18.016 -0.120 1.00 0.00 H new ATOM 0 HB2 GLN A 179 9.167 18.622 -1.022 1.00 0.00 H new ATOM 0 HB3 GLN A 179 8.578 18.181 -2.612 1.00 0.00 H new ATOM 0 HG2 GLN A 179 6.680 19.837 -2.329 1.00 0.00 H new ATOM 0 HG3 GLN A 179 7.364 20.319 -0.789 1.00 0.00 H new ATOM 0 HE21 GLN A 179 7.762 22.465 -1.679 1.00 0.00 H new ATOM 0 HE22 GLN A 179 9.103 22.730 -2.798 1.00 0.00 H new ATOM 2886 N ASP A 180 6.609 16.387 -2.969 1.00 0.00 N ATOM 2887 CA ASP A 180 5.726 15.977 -4.041 1.00 0.00 C ATOM 2888 C ASP A 180 4.513 15.221 -3.504 1.00 0.00 C ATOM 2889 O ASP A 180 3.390 15.722 -3.568 1.00 0.00 O ATOM 2890 CB ASP A 180 6.515 15.115 -5.020 1.00 0.00 C ATOM 2891 CG ASP A 180 5.868 15.163 -6.401 1.00 0.00 C ATOM 2892 OD1 ASP A 180 5.625 16.257 -6.882 1.00 0.00 O ATOM 2893 OD2 ASP A 180 5.624 14.104 -6.956 1.00 0.00 O ATOM 0 H ASP A 180 7.540 15.972 -3.009 1.00 0.00 H new ATOM 0 HA ASP A 180 5.347 16.862 -4.553 1.00 0.00 H new ATOM 0 HB2 ASP A 180 7.544 15.468 -5.080 1.00 0.00 H new ATOM 0 HB3 ASP A 180 6.552 14.086 -4.663 1.00 0.00 H new ATOM 2898 N LEU A 181 4.732 14.024 -2.967 1.00 0.00 N ATOM 2899 CA LEU A 181 3.630 13.248 -2.433 1.00 0.00 C ATOM 2900 C LEU A 181 2.937 14.027 -1.331 1.00 0.00 C ATOM 2901 O LEU A 181 1.726 14.214 -1.349 1.00 0.00 O ATOM 2902 CB LEU A 181 4.160 11.943 -1.855 1.00 0.00 C ATOM 2903 CG LEU A 181 3.052 10.875 -1.722 1.00 0.00 C ATOM 2904 CD1 LEU A 181 3.404 9.933 -0.571 1.00 0.00 C ATOM 2905 CD2 LEU A 181 1.670 11.483 -1.414 1.00 0.00 C ATOM 0 H LEU A 181 5.648 13.581 -2.893 1.00 0.00 H new ATOM 0 HA LEU A 181 2.922 13.040 -3.235 1.00 0.00 H new ATOM 0 HB2 LEU A 181 4.957 11.561 -2.494 1.00 0.00 H new ATOM 0 HB3 LEU A 181 4.600 12.133 -0.876 1.00 0.00 H new ATOM 0 HG LEU A 181 2.996 10.356 -2.679 1.00 0.00 H new ATOM 0 HD11 LEU A 181 2.627 9.176 -0.470 1.00 0.00 H new ATOM 0 HD12 LEU A 181 4.358 9.448 -0.776 1.00 0.00 H new ATOM 0 HD13 LEU A 181 3.478 10.502 0.355 1.00 0.00 H new ATOM 0 HD21 LEU A 181 0.932 10.685 -1.332 1.00 0.00 H new ATOM 0 HD22 LEU A 181 1.716 12.033 -0.474 1.00 0.00 H new ATOM 0 HD23 LEU A 181 1.383 12.161 -2.218 1.00 0.00 H new ATOM 2917 N SER A 182 3.720 14.460 -0.354 1.00 0.00 N ATOM 2918 CA SER A 182 3.173 15.200 0.765 1.00 0.00 C ATOM 2919 C SER A 182 2.492 16.472 0.282 1.00 0.00 C ATOM 2920 O SER A 182 1.274 16.590 0.326 1.00 0.00 O ATOM 2921 CB SER A 182 4.285 15.562 1.747 1.00 0.00 C ATOM 2922 OG SER A 182 3.733 16.304 2.826 1.00 0.00 O ATOM 0 H SER A 182 4.728 14.311 -0.316 1.00 0.00 H new ATOM 0 HA SER A 182 2.437 14.571 1.265 1.00 0.00 H new ATOM 0 HB2 SER A 182 4.765 14.658 2.120 1.00 0.00 H new ATOM 0 HB3 SER A 182 5.055 16.147 1.244 1.00 0.00 H new ATOM 0 HG SER A 182 4.443 16.537 3.460 1.00 0.00 H new ATOM 2928 N GLY A 183 3.277 17.422 -0.199 1.00 0.00 N ATOM 2929 CA GLY A 183 2.710 18.676 -0.679 1.00 0.00 C ATOM 2930 C GLY A 183 1.398 18.417 -1.390 1.00 0.00 C ATOM 2931 O GLY A 183 0.497 19.253 -1.376 1.00 0.00 O ATOM 0 H GLY A 183 4.292 17.354 -0.268 1.00 0.00 H new ATOM 0 HA2 GLY A 183 2.551 19.356 0.158 1.00 0.00 H new ATOM 0 HA3 GLY A 183 3.410 19.164 -1.357 1.00 0.00 H new ATOM 2935 N ARG A 184 1.288 17.241 -1.995 1.00 0.00 N ATOM 2936 CA ARG A 184 0.071 16.880 -2.688 1.00 0.00 C ATOM 2937 C ARG A 184 -0.979 16.372 -1.713 1.00 0.00 C ATOM 2938 O ARG A 184 -2.018 17.003 -1.540 1.00 0.00 O ATOM 2939 CB ARG A 184 0.343 15.809 -3.728 1.00 0.00 C ATOM 2940 CG ARG A 184 1.028 16.443 -4.941 1.00 0.00 C ATOM 2941 CD ARG A 184 -0.029 16.922 -5.933 1.00 0.00 C ATOM 2942 NE ARG A 184 0.576 17.789 -6.939 1.00 0.00 N ATOM 2943 CZ ARG A 184 -0.157 18.666 -7.618 1.00 0.00 C ATOM 2944 NH1 ARG A 184 -1.439 18.753 -7.397 1.00 0.00 N ATOM 2945 NH2 ARG A 184 0.406 19.436 -8.508 1.00 0.00 N ATOM 0 H ARG A 184 2.021 16.532 -2.017 1.00 0.00 H new ATOM 0 HA ARG A 184 -0.303 17.777 -3.182 1.00 0.00 H new ATOM 0 HB2 ARG A 184 0.976 15.028 -3.306 1.00 0.00 H new ATOM 0 HB3 ARG A 184 -0.590 15.334 -4.030 1.00 0.00 H new ATOM 0 HG2 ARG A 184 1.650 17.280 -4.624 1.00 0.00 H new ATOM 0 HG3 ARG A 184 1.688 15.719 -5.419 1.00 0.00 H new ATOM 0 HD2 ARG A 184 -0.498 16.065 -6.416 1.00 0.00 H new ATOM 0 HD3 ARG A 184 -0.816 17.461 -5.405 1.00 0.00 H new ATOM 0 HE ARG A 184 1.577 17.721 -7.124 1.00 0.00 H new ATOM 0 HH11 ARG A 184 -1.879 18.148 -6.703 1.00 0.00 H new ATOM 0 HH12 ARG A 184 -2.002 19.426 -7.918 1.00 0.00 H new ATOM 0 HH21 ARG A 184 1.408 19.365 -8.683 1.00 0.00 H new ATOM 0 HH22 ARG A 184 -0.156 20.109 -9.029 1.00 0.00 H new ATOM 2959 N LEU A 185 -0.699 15.231 -1.072 1.00 0.00 N ATOM 2960 CA LEU A 185 -1.640 14.656 -0.111 1.00 0.00 C ATOM 2961 C LEU A 185 -2.275 15.779 0.675 1.00 0.00 C ATOM 2962 O LEU A 185 -3.484 15.823 0.883 1.00 0.00 O ATOM 2963 CB LEU A 185 -0.937 13.693 0.832 1.00 0.00 C ATOM 2964 CG LEU A 185 -1.994 12.909 1.638 1.00 0.00 C ATOM 2965 CD1 LEU A 185 -2.081 11.466 1.128 1.00 0.00 C ATOM 2966 CD2 LEU A 185 -1.620 12.914 3.126 1.00 0.00 C ATOM 0 H LEU A 185 0.160 14.696 -1.200 1.00 0.00 H new ATOM 0 HA LEU A 185 -2.404 14.095 -0.650 1.00 0.00 H new ATOM 0 HB2 LEU A 185 -0.309 13.004 0.266 1.00 0.00 H new ATOM 0 HB3 LEU A 185 -0.280 14.241 1.507 1.00 0.00 H new ATOM 0 HG LEU A 185 -2.965 13.388 1.510 1.00 0.00 H new ATOM 0 HD11 LEU A 185 -2.830 10.921 1.703 1.00 0.00 H new ATOM 0 HD12 LEU A 185 -2.364 11.469 0.075 1.00 0.00 H new ATOM 0 HD13 LEU A 185 -1.112 10.981 1.242 1.00 0.00 H new ATOM 0 HD21 LEU A 185 -2.369 12.359 3.691 1.00 0.00 H new ATOM 0 HD22 LEU A 185 -0.645 12.445 3.258 1.00 0.00 H new ATOM 0 HD23 LEU A 185 -1.580 13.941 3.488 1.00 0.00 H new ATOM 2978 N ARG A 186 -1.442 16.721 1.051 1.00 0.00 N ATOM 2979 CA ARG A 186 -1.894 17.897 1.737 1.00 0.00 C ATOM 2980 C ARG A 186 -2.882 18.587 0.857 1.00 0.00 C ATOM 2981 O ARG A 186 -4.068 18.657 1.130 1.00 0.00 O ATOM 2982 CB ARG A 186 -0.687 18.790 1.898 1.00 0.00 C ATOM 2983 CG ARG A 186 0.348 18.167 2.849 1.00 0.00 C ATOM 2984 CD ARG A 186 0.192 16.644 3.064 1.00 0.00 C ATOM 2985 NE ARG A 186 1.034 16.217 4.174 1.00 0.00 N ATOM 2986 CZ ARG A 186 0.625 16.336 5.432 1.00 0.00 C ATOM 2987 NH1 ARG A 186 -0.548 16.849 5.691 1.00 0.00 N ATOM 2988 NH2 ARG A 186 1.395 15.941 6.408 1.00 0.00 N ATOM 0 H ARG A 186 -0.436 16.689 0.888 1.00 0.00 H new ATOM 0 HA ARG A 186 -2.347 17.663 2.700 1.00 0.00 H new ATOM 0 HB2 ARG A 186 -0.230 18.965 0.924 1.00 0.00 H new ATOM 0 HB3 ARG A 186 -0.999 19.761 2.283 1.00 0.00 H new ATOM 0 HG2 ARG A 186 1.346 18.365 2.458 1.00 0.00 H new ATOM 0 HG3 ARG A 186 0.280 18.666 3.816 1.00 0.00 H new ATOM 0 HD2 ARG A 186 -0.850 16.401 3.271 1.00 0.00 H new ATOM 0 HD3 ARG A 186 0.470 16.108 2.156 1.00 0.00 H new ATOM 0 HE ARG A 186 1.954 15.820 3.981 1.00 0.00 H new ATOM 0 HH11 ARG A 186 -1.149 17.158 4.927 1.00 0.00 H new ATOM 0 HH12 ARG A 186 -0.863 16.941 6.657 1.00 0.00 H new ATOM 0 HH21 ARG A 186 2.311 15.541 6.205 1.00 0.00 H new ATOM 0 HH22 ARG A 186 1.081 16.032 7.374 1.00 0.00 H new ATOM 3002 N ALA A 187 -2.339 19.071 -0.217 1.00 0.00 N ATOM 3003 CA ALA A 187 -3.109 19.784 -1.224 1.00 0.00 C ATOM 3004 C ALA A 187 -4.460 19.135 -1.487 1.00 0.00 C ATOM 3005 O ALA A 187 -5.503 19.745 -1.250 1.00 0.00 O ATOM 3006 CB ALA A 187 -2.340 19.807 -2.532 1.00 0.00 C ATOM 0 H ALA A 187 -1.346 18.989 -0.433 1.00 0.00 H new ATOM 0 HA ALA A 187 -3.275 20.791 -0.841 1.00 0.00 H new ATOM 0 HB1 ALA A 187 -2.919 20.342 -3.285 1.00 0.00 H new ATOM 0 HB2 ALA A 187 -1.385 20.310 -2.384 1.00 0.00 H new ATOM 0 HB3 ALA A 187 -2.163 18.785 -2.868 1.00 0.00 H new ATOM 3012 N ILE A 188 -4.444 17.916 -2.022 1.00 0.00 N ATOM 3013 CA ILE A 188 -5.688 17.250 -2.351 1.00 0.00 C ATOM 3014 C ILE A 188 -6.674 17.331 -1.181 1.00 0.00 C ATOM 3015 O ILE A 188 -7.839 17.672 -1.375 1.00 0.00 O ATOM 3016 CB ILE A 188 -5.462 15.775 -2.767 1.00 0.00 C ATOM 3017 CG1 ILE A 188 -4.448 15.093 -1.828 1.00 0.00 C ATOM 3018 CG2 ILE A 188 -4.935 15.695 -4.210 1.00 0.00 C ATOM 3019 CD1 ILE A 188 -5.189 14.214 -0.821 1.00 0.00 C ATOM 0 H ILE A 188 -3.599 17.384 -2.231 1.00 0.00 H new ATOM 0 HA ILE A 188 -6.116 17.771 -3.207 1.00 0.00 H new ATOM 0 HB ILE A 188 -6.421 15.261 -2.699 1.00 0.00 H new ATOM 0 HG12 ILE A 188 -3.750 14.489 -2.408 1.00 0.00 H new ATOM 0 HG13 ILE A 188 -3.859 15.846 -1.304 1.00 0.00 H new ATOM 0 HG21 ILE A 188 -4.782 14.651 -4.484 1.00 0.00 H new ATOM 0 HG22 ILE A 188 -5.660 16.146 -4.888 1.00 0.00 H new ATOM 0 HG23 ILE A 188 -3.989 16.231 -4.282 1.00 0.00 H new ATOM 0 HD11 ILE A 188 -4.469 13.733 -0.159 1.00 0.00 H new ATOM 0 HD12 ILE A 188 -5.869 14.829 -0.232 1.00 0.00 H new ATOM 0 HD13 ILE A 188 -5.758 13.452 -1.353 1.00 0.00 H new ATOM 3031 N LEU A 189 -6.205 17.030 0.032 1.00 0.00 N ATOM 3032 CA LEU A 189 -7.072 17.089 1.211 1.00 0.00 C ATOM 3033 C LEU A 189 -7.433 18.544 1.528 1.00 0.00 C ATOM 3034 O LEU A 189 -8.606 18.913 1.590 1.00 0.00 O ATOM 3035 CB LEU A 189 -6.335 16.463 2.413 1.00 0.00 C ATOM 3036 CG LEU A 189 -7.164 15.327 3.028 1.00 0.00 C ATOM 3037 CD1 LEU A 189 -7.121 14.097 2.122 1.00 0.00 C ATOM 3038 CD2 LEU A 189 -6.581 14.962 4.392 1.00 0.00 C ATOM 0 H LEU A 189 -5.244 16.747 0.223 1.00 0.00 H new ATOM 0 HA LEU A 189 -7.989 16.535 1.012 1.00 0.00 H new ATOM 0 HB2 LEU A 189 -5.366 16.080 2.092 1.00 0.00 H new ATOM 0 HB3 LEU A 189 -6.142 17.227 3.166 1.00 0.00 H new ATOM 0 HG LEU A 189 -8.197 15.657 3.137 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -7.712 13.297 2.567 1.00 0.00 H new ATOM 0 HD12 LEU A 189 -7.531 14.351 1.144 1.00 0.00 H new ATOM 0 HD13 LEU A 189 -6.089 13.765 2.007 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -7.166 14.155 4.834 1.00 0.00 H new ATOM 0 HD22 LEU A 189 -5.548 14.637 4.271 1.00 0.00 H new ATOM 0 HD23 LEU A 189 -6.613 15.833 5.046 1.00 0.00 H new ATOM 3050 N GLN A 190 -6.400 19.350 1.734 1.00 0.00 N ATOM 3051 CA GLN A 190 -6.546 20.760 2.055 1.00 0.00 C ATOM 3052 C GLN A 190 -7.242 21.532 0.947 1.00 0.00 C ATOM 3053 O GLN A 190 -7.197 22.762 0.918 1.00 0.00 O ATOM 3054 CB GLN A 190 -5.157 21.350 2.338 1.00 0.00 C ATOM 3055 CG GLN A 190 -4.922 21.432 3.844 1.00 0.00 C ATOM 3056 CD GLN A 190 -3.605 22.147 4.131 1.00 0.00 C ATOM 3057 OE1 GLN A 190 -2.541 21.530 4.090 1.00 0.00 O ATOM 3058 NE2 GLN A 190 -3.612 23.420 4.419 1.00 0.00 N ATOM 0 H GLN A 190 -5.430 19.039 1.682 1.00 0.00 H new ATOM 0 HA GLN A 190 -7.177 20.850 2.939 1.00 0.00 H new ATOM 0 HB2 GLN A 190 -4.389 20.731 1.875 1.00 0.00 H new ATOM 0 HB3 GLN A 190 -5.077 22.342 1.894 1.00 0.00 H new ATOM 0 HG2 GLN A 190 -5.745 21.965 4.320 1.00 0.00 H new ATOM 0 HG3 GLN A 190 -4.901 20.430 4.272 1.00 0.00 H new ATOM 0 HE21 GLN A 190 -4.494 23.930 4.453 1.00 0.00 H new ATOM 0 HE22 GLN A 190 -2.735 23.904 4.610 1.00 0.00 H new ATOM 3067 N ASN A 191 -7.898 20.804 0.063 1.00 0.00 N ATOM 3068 CA ASN A 191 -8.630 21.404 -1.039 1.00 0.00 C ATOM 3069 C ASN A 191 -8.019 22.744 -1.448 1.00 0.00 C ATOM 3070 O ASN A 191 -8.728 23.729 -1.660 1.00 0.00 O ATOM 3071 CB ASN A 191 -10.091 21.577 -0.622 1.00 0.00 C ATOM 3072 CG ASN A 191 -10.299 22.873 0.148 1.00 0.00 C ATOM 3073 OD1 ASN A 191 -9.340 23.513 0.576 1.00 0.00 O ATOM 3074 ND2 ASN A 191 -11.511 23.294 0.353 1.00 0.00 N ATOM 0 H ASN A 191 -7.939 19.785 0.087 1.00 0.00 H new ATOM 0 HA ASN A 191 -8.571 20.748 -1.908 1.00 0.00 H new ATOM 0 HB2 ASN A 191 -10.727 21.572 -1.507 1.00 0.00 H new ATOM 0 HB3 ASN A 191 -10.397 20.732 -0.005 1.00 0.00 H new ATOM 0 HD21 ASN A 191 -11.670 24.158 0.871 1.00 0.00 H new ATOM 0 HD22 ASN A 191 -12.304 22.760 -0.004 1.00 0.00 H new ATOM 3081 N GLN A 192 -6.697 22.767 -1.547 1.00 0.00 N ATOM 3082 CA GLN A 192 -5.979 23.971 -1.915 1.00 0.00 C ATOM 3083 C GLN A 192 -6.502 24.545 -3.231 1.00 0.00 C ATOM 3084 O GLN A 192 -6.175 24.050 -4.309 1.00 0.00 O ATOM 3085 CB GLN A 192 -4.498 23.626 -2.044 1.00 0.00 C ATOM 3086 CG GLN A 192 -3.646 24.839 -1.685 1.00 0.00 C ATOM 3087 CD GLN A 192 -3.999 26.015 -2.588 1.00 0.00 C ATOM 3088 OE1 GLN A 192 -3.632 26.000 -3.840 1.00 0.00 O flip ATOM 3089 NE2 GLN A 192 -4.627 26.975 -2.142 1.00 0.00 N flip ATOM 0 H GLN A 192 -6.100 21.958 -1.376 1.00 0.00 H new ATOM 0 HA GLN A 192 -6.127 24.729 -1.145 1.00 0.00 H new ATOM 0 HB2 GLN A 192 -4.252 22.792 -1.387 1.00 0.00 H new ATOM 0 HB3 GLN A 192 -4.278 23.306 -3.062 1.00 0.00 H new ATOM 0 HG2 GLN A 192 -3.808 25.111 -0.642 1.00 0.00 H new ATOM 0 HG3 GLN A 192 -2.589 24.594 -1.790 1.00 0.00 H new ATOM 0 HE21 GLN A 192 -4.914 26.987 -1.163 1.00 0.00 H new ATOM 0 HE22 GLN A 192 -4.861 27.759 -2.751 1.00 0.00 H new ATOM 3098 N GLU A 193 -7.313 25.594 -3.131 1.00 0.00 N ATOM 3099 CA GLU A 193 -7.874 26.233 -4.314 1.00 0.00 C ATOM 3100 C GLU A 193 -6.786 26.505 -5.346 1.00 0.00 C ATOM 3101 O GLU A 193 -5.627 26.139 -5.153 1.00 0.00 O ATOM 3102 CB GLU A 193 -8.546 27.550 -3.923 1.00 0.00 C ATOM 3103 CG GLU A 193 -9.908 27.256 -3.298 1.00 0.00 C ATOM 3104 CD GLU A 193 -10.586 28.557 -2.887 1.00 0.00 C ATOM 3105 OE1 GLU A 193 -11.286 29.124 -3.710 1.00 0.00 O ATOM 3106 OE2 GLU A 193 -10.396 28.971 -1.755 1.00 0.00 O ATOM 0 H GLU A 193 -7.595 26.017 -2.247 1.00 0.00 H new ATOM 0 HA GLU A 193 -8.612 25.560 -4.751 1.00 0.00 H new ATOM 0 HB2 GLU A 193 -7.920 28.096 -3.217 1.00 0.00 H new ATOM 0 HB3 GLU A 193 -8.665 28.185 -4.801 1.00 0.00 H new ATOM 0 HG2 GLU A 193 -10.535 26.719 -4.009 1.00 0.00 H new ATOM 0 HG3 GLU A 193 -9.786 26.610 -2.429 1.00 0.00 H new ATOM 3113 N ASN A 194 -7.170 27.148 -6.443 1.00 0.00 N ATOM 3114 CA ASN A 194 -6.222 27.464 -7.501 1.00 0.00 C ATOM 3115 C ASN A 194 -5.152 28.428 -6.999 1.00 0.00 C ATOM 3116 O ASN A 194 -5.516 29.418 -6.387 1.00 0.00 O ATOM 3117 CB ASN A 194 -6.949 28.081 -8.690 1.00 0.00 C ATOM 3118 CG ASN A 194 -5.947 28.467 -9.773 1.00 0.00 C ATOM 3119 OD1 ASN A 194 -5.165 29.400 -9.591 1.00 0.00 O ATOM 3120 ND2 ASN A 194 -5.925 27.802 -10.895 1.00 0.00 N ATOM 3121 OXT ASN A 194 -3.985 28.162 -7.235 1.00 0.00 O ATOM 0 H ASN A 194 -8.125 27.458 -6.621 1.00 0.00 H new ATOM 0 HA ASN A 194 -5.740 26.538 -7.813 1.00 0.00 H new ATOM 0 HB2 ASN A 194 -7.674 27.373 -9.090 1.00 0.00 H new ATOM 0 HB3 ASN A 194 -7.506 28.961 -8.369 1.00 0.00 H new ATOM 0 HD21 ASN A 194 -5.258 28.055 -11.625 1.00 0.00 H new ATOM 0 HD22 ASN A 194 -6.574 27.029 -11.043 1.00 0.00 H new