USER MOD reduce.3.24.130724 H: found=0, std=0, add=1307, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1309 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: B 74 SER OG : rot 73:sc= 2.2 USER MOD Set 1.2: B 78 LYS NZ :NH3+ -114:sc= 1.5 (180deg=-0.81!) USER MOD Set 2.1: B 56 HIS : no HD1:sc= 0.0865 K(o=-0.072,f=-0.98) USER MOD Set 2.2: B 60 CYS SG : rot -120:sc= 0 USER MOD Set 2.3: B 97 MET CE :methyl -152:sc= -0.158 (180deg=-0.489) USER MOD Set 3.1: A 56 HIS : no HD1:sc= 0.132 K(o=-0.24,f=-1.7) USER MOD Set 3.2: A 60 CYS SG : rot -110:sc= -0.0777 USER MOD Set 3.3: A 97 MET CE :methyl -144:sc= -0.293 (180deg=-0.659) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 55:sc= -1.91! USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 ASN : amide:sc= 0.789 K(o=0.79,f=-1.4) USER MOD Single : A 46 TYR OH : rot 180:sc= -0.474 USER MOD Single : A 48 SER OG : rot 140:sc=-0.00686 USER MOD Single : A 49 THR OG1 : rot 180:sc= -0.64 USER MOD Single : A 51 GLN : amide:sc= 0.195 K(o=0.2,f=-1) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -3.42! C(o=-3.4!,f=-5.3!) USER MOD Single : A 67 THR OG1 : rot 170:sc= -2.69! USER MOD Single : A 70 CYS SG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -172:sc= 1.06 (180deg=0.877) USER MOD Single : A 74 SER OG : rot -31:sc= 0.101 USER MOD Single : A 76 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 78 LYS NZ :NH3+ 169:sc= 0.202 (180deg=-0.262) USER MOD Single : A 80 TYR OH : rot 13:sc= 1.82 USER MOD Single : A 82 TYR OH : rot -176:sc= -4.59! USER MOD Single : A 89 ASN : amide:sc= -0.28 K(o=-0.28,f=-7.7!) USER MOD Single : A 90 SER OG : rot 180:sc= -1.43 USER MOD Single : A 100 THR OG1 : rot -58:sc= -0.034 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ -174:sc= 1.17 (180deg=1.07) USER MOD Single : A 112 LYS NZ :NH3+ 149:sc= 2.39 (180deg=1.63) USER MOD Single : B 24 GLN : amide:sc= -0.204 X(o=-0.2,f=-0.31) USER MOD Single : B 27 SER OG : rot 143:sc= 0.607 USER MOD Single : B 31 LYS NZ :NH3+ -159:sc= -0.0832 (180deg=-0.453) USER MOD Single : B 32 LYS NZ :NH3+ -135:sc= 0.153 (180deg=-0.116) USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 38 SER OG : rot 74:sc= 0.98 USER MOD Single : B 40 TYR OH : rot 180:sc= 0 USER MOD Single : B 43 ASN : amide:sc= 1.31 K(o=1.3,f=-3.6!) USER MOD Single : B 46 TYR OH : rot 15:sc= -0.239 USER MOD Single : B 48 SER OG : rot 55:sc= 1.08 USER MOD Single : B 49 THR OG1 : rot 180:sc= -0.114 USER MOD Single : B 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 58 SER OG : rot 180:sc= 0 USER MOD Single : B 59 SER OG : rot 180:sc= 0 USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 64 ASN : amide:sc= -4.72! C(o=-4.7!,f=-9.7!) USER MOD Single : B 67 THR OG1 : rot 178:sc= -2.67! USER MOD Single : B 70 CYS SG : rot -153:sc= 0.0492 USER MOD Single : B 72 LYS NZ :NH3+ -141:sc= -0.394 (180deg=-2.19!) USER MOD Single : B 76 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 80 TYR OH : rot 16:sc= 1.61 USER MOD Single : B 82 TYR OH : rot 180:sc= 0 USER MOD Single : B 89 ASN : amide:sc= 0.111 K(o=0.11,f=-5.4!) USER MOD Single : B 90 SER OG : rot 13:sc= -2.65! USER MOD Single : B 100 THR OG1 : rot -62:sc= 0.372 USER MOD Single : B 106 THR OG1 : rot 180:sc= 0 USER MOD Single : B 108 LYS NZ :NH3+ -139:sc= 0 (180deg=-0.56) USER MOD Single : B 112 LYS NZ :NH3+ -136:sc= 1.57 (180deg=-0.286) USER MOD ----------------------------------------------------------------- ATOM 468 N GLU A 33 -15.372 9.049 8.765 1.00 75.34 N ATOM 469 CA GLU A 33 -16.143 9.154 7.549 1.00 25.21 C ATOM 470 C GLU A 33 -15.549 8.285 6.447 1.00 2.35 C ATOM 471 O GLU A 33 -16.257 7.473 5.857 1.00 73.41 O ATOM 472 CB GLU A 33 -16.257 10.608 7.107 1.00 72.31 C ATOM 473 CG GLU A 33 -17.157 11.449 7.992 1.00 70.13 C ATOM 474 CD GLU A 33 -18.604 11.200 7.730 1.00 33.41 C ATOM 475 OE1 GLU A 33 -19.120 10.186 8.171 1.00 24.32 O ATOM 476 OE2 GLU A 33 -19.245 12.005 7.033 1.00 52.45 O ATOM 0 HA GLU A 33 -17.149 8.785 7.751 1.00 25.21 H new ATOM 0 HB2 GLU A 33 -15.262 11.052 7.091 1.00 72.31 H new ATOM 0 HB3 GLU A 33 -16.636 10.639 6.086 1.00 72.31 H new ATOM 0 HG2 GLU A 33 -16.938 11.234 9.038 1.00 70.13 H new ATOM 0 HG3 GLU A 33 -16.938 12.504 7.831 1.00 70.13 H new ATOM 483 N ILE A 34 -14.243 8.410 6.222 1.00 64.54 N ATOM 484 CA ILE A 34 -13.580 7.681 5.137 1.00 14.12 C ATOM 485 C ILE A 34 -13.555 6.178 5.378 1.00 33.01 C ATOM 486 O ILE A 34 -13.675 5.407 4.428 1.00 31.43 O ATOM 487 CB ILE A 34 -12.171 8.208 4.745 1.00 51.55 C ATOM 488 CG1 ILE A 34 -11.187 8.092 5.908 1.00 0.54 C ATOM 489 CG2 ILE A 34 -12.267 9.650 4.244 1.00 11.31 C ATOM 490 CD1 ILE A 34 -9.782 8.558 5.586 1.00 54.53 C ATOM 0 H ILE A 34 -13.623 9.005 6.772 1.00 64.54 H new ATOM 0 HA ILE A 34 -14.210 7.883 4.271 1.00 14.12 H new ATOM 0 HB ILE A 34 -11.788 7.586 3.936 1.00 51.55 H new ATOM 0 HG12 ILE A 34 -11.566 8.673 6.748 1.00 0.54 H new ATOM 0 HG13 ILE A 34 -11.147 7.052 6.232 1.00 0.54 H new ATOM 0 HG21 ILE A 34 -11.274 10.008 3.973 1.00 11.31 H new ATOM 0 HG22 ILE A 34 -12.918 9.689 3.371 1.00 11.31 H new ATOM 0 HG23 ILE A 34 -12.678 10.282 5.031 1.00 11.31 H new ATOM 0 HD11 ILE A 34 -9.149 8.441 6.466 1.00 54.53 H new ATOM 0 HD12 ILE A 34 -9.379 7.961 4.768 1.00 54.53 H new ATOM 0 HD13 ILE A 34 -9.805 9.607 5.292 1.00 54.53 H new ATOM 502 N ASP A 35 -13.417 5.755 6.651 1.00 34.30 N ATOM 503 CA ASP A 35 -13.444 4.322 6.978 1.00 21.24 C ATOM 504 C ASP A 35 -14.760 3.718 6.547 1.00 31.44 C ATOM 505 O ASP A 35 -14.802 2.632 5.988 1.00 64.13 O ATOM 506 CB ASP A 35 -13.263 4.019 8.483 1.00 64.14 C ATOM 507 CG ASP A 35 -11.871 4.225 9.062 1.00 42.03 C ATOM 508 OD1 ASP A 35 -10.908 3.633 8.537 1.00 31.52 O ATOM 509 OD2 ASP A 35 -11.747 4.947 10.085 1.00 35.30 O ATOM 0 H ASP A 35 -13.288 6.374 7.452 1.00 34.30 H new ATOM 0 HA ASP A 35 -12.600 3.887 6.443 1.00 21.24 H new ATOM 0 HB2 ASP A 35 -13.959 4.645 9.042 1.00 64.14 H new ATOM 0 HB3 ASP A 35 -13.554 2.983 8.658 1.00 64.14 H new ATOM 514 N LYS A 36 -15.825 4.477 6.762 1.00 45.44 N ATOM 515 CA LYS A 36 -17.181 4.031 6.452 1.00 63.20 C ATOM 516 C LYS A 36 -17.437 4.097 4.951 1.00 30.40 C ATOM 517 O LYS A 36 -18.447 3.590 4.461 1.00 23.34 O ATOM 518 CB LYS A 36 -18.225 4.884 7.179 1.00 42.11 C ATOM 519 CG LYS A 36 -18.142 4.856 8.688 1.00 55.24 C ATOM 520 CD LYS A 36 -19.175 5.792 9.287 1.00 75.42 C ATOM 521 CE LYS A 36 -19.079 5.826 10.791 1.00 60.31 C ATOM 522 NZ LYS A 36 -20.072 6.747 11.380 1.00 72.12 N ATOM 0 H LYS A 36 -15.777 5.417 7.155 1.00 45.44 H new ATOM 0 HA LYS A 36 -17.271 2.999 6.792 1.00 63.20 H new ATOM 0 HB2 LYS A 36 -18.124 5.917 6.845 1.00 42.11 H new ATOM 0 HB3 LYS A 36 -19.218 4.548 6.879 1.00 42.11 H new ATOM 0 HG2 LYS A 36 -18.307 3.841 9.050 1.00 55.24 H new ATOM 0 HG3 LYS A 36 -17.143 5.151 9.010 1.00 55.24 H new ATOM 0 HD2 LYS A 36 -19.032 6.797 8.889 1.00 75.42 H new ATOM 0 HD3 LYS A 36 -20.174 5.471 8.992 1.00 75.42 H new ATOM 0 HE2 LYS A 36 -19.232 4.823 11.188 1.00 60.31 H new ATOM 0 HE3 LYS A 36 -18.076 6.135 11.085 1.00 60.31 H new ATOM 0 HZ1 LYS A 36 -19.976 6.744 12.416 1.00 72.12 H new ATOM 0 HZ2 LYS A 36 -19.910 7.709 11.020 1.00 72.12 H new ATOM 0 HZ3 LYS A 36 -21.030 6.437 11.120 1.00 72.12 H new ATOM 536 N ARG A 37 -16.527 4.737 4.217 1.00 2.21 N ATOM 537 CA ARG A 37 -16.666 4.875 2.779 1.00 2.51 C ATOM 538 C ARG A 37 -15.825 3.800 2.091 1.00 22.34 C ATOM 539 O ARG A 37 -15.686 3.800 0.881 1.00 11.04 O ATOM 540 CB ARG A 37 -16.100 6.212 2.270 1.00 50.12 C ATOM 541 CG ARG A 37 -16.549 7.520 2.914 1.00 51.43 C ATOM 542 CD ARG A 37 -18.037 7.742 2.897 1.00 53.10 C ATOM 543 NE ARG A 37 -18.362 9.145 3.215 1.00 41.21 N ATOM 544 CZ ARG A 37 -18.777 9.620 4.402 1.00 70.33 C ATOM 545 NH1 ARG A 37 -18.865 8.817 5.465 1.00 72.33 N ATOM 546 NH2 ARG A 37 -19.056 10.909 4.529 1.00 42.31 N ATOM 0 H ARG A 37 -15.686 5.167 4.602 1.00 2.21 H new ATOM 0 HA ARG A 37 -17.731 4.801 2.559 1.00 2.51 H new ATOM 0 HB2 ARG A 37 -15.015 6.161 2.360 1.00 50.12 H new ATOM 0 HB3 ARG A 37 -16.329 6.278 1.206 1.00 50.12 H new ATOM 0 HG2 ARG A 37 -16.203 7.540 3.947 1.00 51.43 H new ATOM 0 HG3 ARG A 37 -16.064 8.350 2.399 1.00 51.43 H new ATOM 0 HD2 ARG A 37 -18.436 7.485 1.916 1.00 53.10 H new ATOM 0 HD3 ARG A 37 -18.516 7.081 3.619 1.00 53.10 H new ATOM 0 HE ARG A 37 -18.262 9.822 2.459 1.00 41.21 H new ATOM 0 HH11 ARG A 37 -18.616 7.831 5.382 1.00 72.33 H new ATOM 0 HH12 ARG A 37 -19.181 9.189 6.360 1.00 72.33 H new ATOM 0 HH21 ARG A 37 -18.955 11.534 3.729 1.00 42.31 H new ATOM 0 HH22 ARG A 37 -19.371 11.276 5.427 1.00 42.31 H new ATOM 560 N SER A 38 -15.248 2.918 2.852 1.00 71.11 N ATOM 561 CA SER A 38 -14.349 1.939 2.294 1.00 1.41 C ATOM 562 C SER A 38 -14.911 0.507 2.305 1.00 15.34 C ATOM 563 O SER A 38 -15.879 0.195 3.008 1.00 71.02 O ATOM 564 CB SER A 38 -13.030 2.017 3.052 1.00 64.21 C ATOM 565 OG SER A 38 -12.072 1.075 2.594 1.00 41.02 O ATOM 0 H SER A 38 -15.381 2.852 3.861 1.00 71.11 H new ATOM 0 HA SER A 38 -14.204 2.176 1.240 1.00 1.41 H new ATOM 0 HB2 SER A 38 -12.619 3.022 2.954 1.00 64.21 H new ATOM 0 HB3 SER A 38 -13.216 1.851 4.113 1.00 64.21 H new ATOM 0 HG SER A 38 -11.941 1.184 1.629 1.00 41.02 H new ATOM 571 N VAL A 39 -14.266 -0.354 1.525 1.00 51.55 N ATOM 572 CA VAL A 39 -14.596 -1.752 1.434 1.00 15.43 C ATOM 573 C VAL A 39 -13.335 -2.586 1.484 1.00 53.54 C ATOM 574 O VAL A 39 -12.243 -2.093 1.219 1.00 14.04 O ATOM 575 CB VAL A 39 -15.382 -2.165 0.142 1.00 14.13 C ATOM 576 CG1 VAL A 39 -16.723 -1.475 0.071 1.00 53.22 C ATOM 577 CG2 VAL A 39 -14.573 -1.853 -1.111 1.00 61.23 C ATOM 0 H VAL A 39 -13.484 -0.083 0.930 1.00 51.55 H new ATOM 0 HA VAL A 39 -15.252 -1.935 2.285 1.00 15.43 H new ATOM 0 HB VAL A 39 -15.550 -3.241 0.195 1.00 14.13 H new ATOM 0 HG11 VAL A 39 -17.243 -1.783 -0.836 1.00 53.22 H new ATOM 0 HG12 VAL A 39 -17.319 -1.748 0.941 1.00 53.22 H new ATOM 0 HG13 VAL A 39 -16.576 -0.395 0.057 1.00 53.22 H new ATOM 0 HG21 VAL A 39 -15.140 -2.149 -1.993 1.00 61.23 H new ATOM 0 HG22 VAL A 39 -14.367 -0.784 -1.154 1.00 61.23 H new ATOM 0 HG23 VAL A 39 -13.632 -2.403 -1.083 1.00 61.23 H new ATOM 587 N TYR A 40 -13.513 -3.831 1.770 1.00 1.20 N ATOM 588 CA TYR A 40 -12.473 -4.817 1.818 1.00 30.22 C ATOM 589 C TYR A 40 -12.672 -5.747 0.659 1.00 52.10 C ATOM 590 O TYR A 40 -13.755 -6.300 0.487 1.00 1.12 O ATOM 591 CB TYR A 40 -12.550 -5.615 3.135 1.00 11.23 C ATOM 592 CG TYR A 40 -11.774 -6.942 3.134 1.00 3.24 C ATOM 593 CD1 TYR A 40 -10.420 -6.996 3.398 1.00 63.11 C ATOM 594 CD2 TYR A 40 -12.431 -8.138 2.854 1.00 54.12 C ATOM 595 CE1 TYR A 40 -9.732 -8.202 3.387 1.00 23.12 C ATOM 596 CE2 TYR A 40 -11.769 -9.342 2.835 1.00 64.44 C ATOM 597 CZ TYR A 40 -10.410 -9.376 3.103 1.00 24.32 C ATOM 598 OH TYR A 40 -9.721 -10.590 3.077 1.00 60.43 O ATOM 0 H TYR A 40 -14.433 -4.214 1.989 1.00 1.20 H new ATOM 0 HA TYR A 40 -11.498 -4.333 1.767 1.00 30.22 H new ATOM 0 HB2 TYR A 40 -12.172 -4.990 3.944 1.00 11.23 H new ATOM 0 HB3 TYR A 40 -13.597 -5.823 3.356 1.00 11.23 H new ATOM 0 HD1 TYR A 40 -9.886 -6.083 3.617 1.00 63.11 H new ATOM 0 HD2 TYR A 40 -13.491 -8.118 2.646 1.00 54.12 H new ATOM 0 HE1 TYR A 40 -8.673 -8.225 3.599 1.00 23.12 H new ATOM 0 HE2 TYR A 40 -12.303 -10.254 2.613 1.00 64.44 H new ATOM 0 HH TYR A 40 -10.344 -11.315 2.863 1.00 60.43 H new ATOM 608 N VAL A 41 -11.672 -5.887 -0.131 1.00 44.11 N ATOM 609 CA VAL A 41 -11.670 -6.760 -1.260 1.00 11.31 C ATOM 610 C VAL A 41 -10.717 -7.897 -0.972 1.00 4.42 C ATOM 611 O VAL A 41 -9.521 -7.674 -0.789 1.00 23.24 O ATOM 612 CB VAL A 41 -11.134 -6.012 -2.490 1.00 61.42 C ATOM 613 CG1 VAL A 41 -11.158 -6.897 -3.737 1.00 13.12 C ATOM 614 CG2 VAL A 41 -11.938 -4.751 -2.718 1.00 64.51 C ATOM 0 H VAL A 41 -10.795 -5.380 -0.010 1.00 44.11 H new ATOM 0 HA VAL A 41 -12.682 -7.118 -1.447 1.00 11.31 H new ATOM 0 HB VAL A 41 -10.095 -5.743 -2.298 1.00 61.42 H new ATOM 0 HG11 VAL A 41 -10.772 -6.336 -4.588 1.00 13.12 H new ATOM 0 HG12 VAL A 41 -10.537 -7.777 -3.571 1.00 13.12 H new ATOM 0 HG13 VAL A 41 -12.182 -7.209 -3.942 1.00 13.12 H new ATOM 0 HG21 VAL A 41 -11.552 -4.226 -3.592 1.00 64.51 H new ATOM 0 HG22 VAL A 41 -12.983 -5.011 -2.884 1.00 64.51 H new ATOM 0 HG23 VAL A 41 -11.859 -4.106 -1.843 1.00 64.51 H new ATOM 624 N GLY A 42 -11.218 -9.080 -0.901 1.00 20.33 N ATOM 625 CA GLY A 42 -10.373 -10.192 -0.660 1.00 24.32 C ATOM 626 C GLY A 42 -10.221 -11.059 -1.875 1.00 35.20 C ATOM 627 O GLY A 42 -10.986 -10.931 -2.840 1.00 71.24 O ATOM 0 H GLY A 42 -12.208 -9.301 -1.006 1.00 20.33 H new ATOM 0 HA2 GLY A 42 -9.392 -9.839 -0.342 1.00 24.32 H new ATOM 0 HA3 GLY A 42 -10.780 -10.785 0.159 1.00 24.32 H new ATOM 631 N ASN A 43 -9.246 -11.938 -1.802 1.00 44.41 N ATOM 632 CA ASN A 43 -8.903 -12.931 -2.836 1.00 34.51 C ATOM 633 C ASN A 43 -8.332 -12.297 -4.139 1.00 25.20 C ATOM 634 O ASN A 43 -8.280 -12.931 -5.180 1.00 11.24 O ATOM 635 CB ASN A 43 -10.103 -13.857 -3.133 1.00 14.41 C ATOM 636 CG ASN A 43 -9.702 -15.090 -3.919 1.00 74.42 C ATOM 637 OD1 ASN A 43 -8.582 -15.587 -3.782 1.00 64.40 O ATOM 638 ND2 ASN A 43 -10.595 -15.603 -4.721 1.00 12.10 N ATOM 0 H ASN A 43 -8.633 -11.995 -0.989 1.00 44.41 H new ATOM 0 HA ASN A 43 -8.095 -13.536 -2.425 1.00 34.51 H new ATOM 0 HB2 ASN A 43 -10.564 -14.162 -2.194 1.00 14.41 H new ATOM 0 HB3 ASN A 43 -10.857 -13.302 -3.692 1.00 14.41 H new ATOM 0 HD21 ASN A 43 -10.376 -16.441 -5.259 1.00 12.10 H new ATOM 0 HD22 ASN A 43 -11.512 -15.165 -4.810 1.00 12.10 H new ATOM 645 N VAL A 44 -7.880 -11.065 -4.062 1.00 10.11 N ATOM 646 CA VAL A 44 -7.230 -10.451 -5.225 1.00 51.40 C ATOM 647 C VAL A 44 -5.834 -11.059 -5.393 1.00 75.01 C ATOM 648 O VAL A 44 -4.979 -10.943 -4.527 1.00 41.22 O ATOM 649 CB VAL A 44 -7.201 -8.884 -5.158 1.00 35.42 C ATOM 650 CG1 VAL A 44 -6.492 -8.360 -3.928 1.00 20.31 C ATOM 651 CG2 VAL A 44 -6.582 -8.313 -6.407 1.00 55.32 C ATOM 0 H VAL A 44 -7.942 -10.472 -3.234 1.00 10.11 H new ATOM 0 HA VAL A 44 -7.824 -10.675 -6.111 1.00 51.40 H new ATOM 0 HB VAL A 44 -8.238 -8.555 -5.087 1.00 35.42 H new ATOM 0 HG11 VAL A 44 -6.504 -7.270 -3.938 1.00 20.31 H new ATOM 0 HG12 VAL A 44 -7.000 -8.721 -3.034 1.00 20.31 H new ATOM 0 HG13 VAL A 44 -5.460 -8.711 -3.926 1.00 20.31 H new ATOM 0 HG21 VAL A 44 -6.570 -7.225 -6.343 1.00 55.32 H new ATOM 0 HG22 VAL A 44 -5.561 -8.681 -6.508 1.00 55.32 H new ATOM 0 HG23 VAL A 44 -7.166 -8.619 -7.275 1.00 55.32 H new ATOM 661 N ASP A 45 -5.624 -11.731 -6.496 1.00 51.53 N ATOM 662 CA ASP A 45 -4.399 -12.477 -6.682 1.00 74.01 C ATOM 663 C ASP A 45 -3.361 -11.676 -7.437 1.00 2.22 C ATOM 664 O ASP A 45 -3.663 -10.608 -8.023 1.00 42.24 O ATOM 665 CB ASP A 45 -4.637 -13.828 -7.384 1.00 21.51 C ATOM 666 CG ASP A 45 -4.867 -13.729 -8.883 1.00 55.20 C ATOM 667 OD1 ASP A 45 -5.942 -13.242 -9.317 1.00 15.13 O ATOM 668 OD2 ASP A 45 -3.973 -14.187 -9.661 1.00 71.23 O ATOM 0 H ASP A 45 -6.279 -11.779 -7.276 1.00 51.53 H new ATOM 0 HA ASP A 45 -4.017 -12.681 -5.682 1.00 74.01 H new ATOM 0 HB2 ASP A 45 -3.777 -14.473 -7.203 1.00 21.51 H new ATOM 0 HB3 ASP A 45 -5.500 -14.312 -6.928 1.00 21.51 H new ATOM 673 N TYR A 46 -2.151 -12.202 -7.424 1.00 61.43 N ATOM 674 CA TYR A 46 -1.014 -11.595 -8.088 1.00 42.30 C ATOM 675 C TYR A 46 -1.214 -11.570 -9.590 1.00 32.21 C ATOM 676 O TYR A 46 -0.978 -12.564 -10.288 1.00 11.12 O ATOM 677 CB TYR A 46 0.299 -12.286 -7.710 1.00 22.22 C ATOM 678 CG TYR A 46 0.857 -11.879 -6.366 1.00 13.02 C ATOM 679 CD1 TYR A 46 0.082 -11.881 -5.216 1.00 30.30 C ATOM 680 CD2 TYR A 46 2.181 -11.493 -6.258 1.00 21.22 C ATOM 681 CE1 TYR A 46 0.617 -11.504 -4.006 1.00 60.24 C ATOM 682 CE2 TYR A 46 2.724 -11.116 -5.057 1.00 31.41 C ATOM 683 CZ TYR A 46 1.946 -11.119 -3.936 1.00 41.12 C ATOM 684 OH TYR A 46 2.498 -10.755 -2.733 1.00 32.40 O ATOM 0 H TYR A 46 -1.928 -13.075 -6.945 1.00 61.43 H new ATOM 0 HA TYR A 46 -0.943 -10.564 -7.742 1.00 42.30 H new ATOM 0 HB2 TYR A 46 0.141 -13.364 -7.712 1.00 22.22 H new ATOM 0 HB3 TYR A 46 1.042 -12.071 -8.478 1.00 22.22 H new ATOM 0 HD1 TYR A 46 -0.954 -12.182 -5.271 1.00 30.30 H new ATOM 0 HD2 TYR A 46 2.802 -11.489 -7.142 1.00 21.22 H new ATOM 0 HE1 TYR A 46 0.005 -11.508 -3.116 1.00 60.24 H new ATOM 0 HE2 TYR A 46 3.761 -10.819 -4.998 1.00 31.41 H new ATOM 0 HH TYR A 46 3.439 -10.515 -2.864 1.00 32.40 H new ATOM 694 N GLY A 47 -1.681 -10.447 -10.060 1.00 21.02 N ATOM 695 CA GLY A 47 -1.976 -10.262 -11.446 1.00 21.23 C ATOM 696 C GLY A 47 -2.914 -9.101 -11.620 1.00 24.41 C ATOM 697 O GLY A 47 -2.929 -8.444 -12.673 1.00 45.33 O ATOM 0 H GLY A 47 -1.868 -9.628 -9.482 1.00 21.02 H new ATOM 0 HA2 GLY A 47 -1.056 -10.083 -12.002 1.00 21.23 H new ATOM 0 HA3 GLY A 47 -2.425 -11.167 -11.855 1.00 21.23 H new ATOM 701 N SER A 48 -3.696 -8.828 -10.585 1.00 15.43 N ATOM 702 CA SER A 48 -4.592 -7.713 -10.612 1.00 53.15 C ATOM 703 C SER A 48 -3.807 -6.454 -10.197 1.00 52.33 C ATOM 704 O SER A 48 -3.021 -6.494 -9.246 1.00 24.31 O ATOM 705 CB SER A 48 -5.730 -7.988 -9.654 1.00 2.30 C ATOM 706 OG SER A 48 -6.320 -9.261 -9.935 1.00 22.05 O ATOM 0 H SER A 48 -3.718 -9.372 -9.722 1.00 15.43 H new ATOM 0 HA SER A 48 -5.007 -7.557 -11.608 1.00 53.15 H new ATOM 0 HB2 SER A 48 -5.363 -7.968 -8.628 1.00 2.30 H new ATOM 0 HB3 SER A 48 -6.483 -7.204 -9.738 1.00 2.30 H new ATOM 0 HG SER A 48 -6.534 -9.715 -9.093 1.00 22.05 H new ATOM 712 N THR A 49 -3.991 -5.373 -10.915 1.00 34.44 N ATOM 713 CA THR A 49 -3.239 -4.157 -10.665 1.00 3.54 C ATOM 714 C THR A 49 -4.109 -3.103 -9.985 1.00 14.32 C ATOM 715 O THR A 49 -5.322 -3.280 -9.893 1.00 10.24 O ATOM 716 CB THR A 49 -2.652 -3.615 -11.979 1.00 22.34 C ATOM 717 OG1 THR A 49 -3.699 -3.442 -12.942 1.00 74.34 O ATOM 718 CG2 THR A 49 -1.631 -4.584 -12.539 1.00 75.33 C ATOM 0 H THR A 49 -4.659 -5.306 -11.683 1.00 34.44 H new ATOM 0 HA THR A 49 -2.418 -4.395 -9.989 1.00 3.54 H new ATOM 0 HB THR A 49 -2.171 -2.659 -11.774 1.00 22.34 H new ATOM 0 HG1 THR A 49 -3.321 -3.095 -13.777 1.00 74.34 H new ATOM 0 HG21 THR A 49 -1.224 -4.187 -13.469 1.00 75.33 H new ATOM 0 HG22 THR A 49 -0.824 -4.719 -11.819 1.00 75.33 H new ATOM 0 HG23 THR A 49 -2.109 -5.544 -12.733 1.00 75.33 H new ATOM 726 N ALA A 50 -3.506 -1.997 -9.521 1.00 34.33 N ATOM 727 CA ALA A 50 -4.241 -0.958 -8.807 1.00 71.52 C ATOM 728 C ALA A 50 -5.275 -0.300 -9.709 1.00 11.32 C ATOM 729 O ALA A 50 -6.430 -0.182 -9.332 1.00 4.34 O ATOM 730 CB ALA A 50 -3.253 0.077 -8.261 1.00 13.11 C ATOM 0 H ALA A 50 -2.510 -1.805 -9.631 1.00 34.33 H new ATOM 0 HA ALA A 50 -4.779 -1.412 -7.975 1.00 71.52 H new ATOM 0 HB1 ALA A 50 -3.799 0.855 -7.727 1.00 13.11 H new ATOM 0 HB2 ALA A 50 -2.556 -0.410 -7.579 1.00 13.11 H new ATOM 0 HB3 ALA A 50 -2.700 0.524 -9.087 1.00 13.11 H new ATOM 736 N GLN A 51 -4.856 0.129 -10.890 1.00 52.44 N ATOM 737 CA GLN A 51 -5.777 0.711 -11.871 1.00 54.32 C ATOM 738 C GLN A 51 -6.886 -0.249 -12.267 1.00 74.32 C ATOM 739 O GLN A 51 -8.031 0.154 -12.429 1.00 14.23 O ATOM 740 CB GLN A 51 -5.039 1.179 -13.112 1.00 33.41 C ATOM 741 CG GLN A 51 -4.105 2.328 -12.882 1.00 73.20 C ATOM 742 CD GLN A 51 -3.456 2.804 -14.158 1.00 4.03 C ATOM 743 OE1 GLN A 51 -4.003 2.661 -15.240 1.00 4.05 O ATOM 744 NE2 GLN A 51 -2.344 3.420 -14.039 1.00 15.33 N ATOM 0 H GLN A 51 -3.885 0.088 -11.198 1.00 52.44 H new ATOM 0 HA GLN A 51 -6.236 1.571 -11.383 1.00 54.32 H new ATOM 0 HB2 GLN A 51 -4.472 0.342 -13.520 1.00 33.41 H new ATOM 0 HB3 GLN A 51 -5.770 1.467 -13.867 1.00 33.41 H new ATOM 0 HG2 GLN A 51 -4.653 3.153 -12.426 1.00 73.20 H new ATOM 0 HG3 GLN A 51 -3.332 2.029 -12.174 1.00 73.20 H new ATOM 0 HE21 GLN A 51 -1.913 3.522 -13.120 1.00 15.33 H new ATOM 0 HE22 GLN A 51 -1.886 3.810 -14.863 1.00 15.33 H new ATOM 753 N ASP A 52 -6.533 -1.513 -12.401 1.00 0.21 N ATOM 754 CA ASP A 52 -7.487 -2.564 -12.793 1.00 74.05 C ATOM 755 C ASP A 52 -8.558 -2.717 -11.699 1.00 41.21 C ATOM 756 O ASP A 52 -9.754 -2.868 -11.975 1.00 51.15 O ATOM 757 CB ASP A 52 -6.709 -3.867 -13.022 1.00 40.03 C ATOM 758 CG ASP A 52 -7.507 -5.010 -13.604 1.00 2.21 C ATOM 759 OD1 ASP A 52 -8.387 -4.773 -14.443 1.00 44.02 O ATOM 760 OD2 ASP A 52 -7.207 -6.180 -13.263 1.00 13.32 O ATOM 0 H ASP A 52 -5.584 -1.852 -12.245 1.00 0.21 H new ATOM 0 HA ASP A 52 -8.000 -2.302 -13.718 1.00 74.05 H new ATOM 0 HB2 ASP A 52 -5.871 -3.657 -13.687 1.00 40.03 H new ATOM 0 HB3 ASP A 52 -6.287 -4.190 -12.070 1.00 40.03 H new ATOM 765 N LEU A 53 -8.115 -2.589 -10.464 1.00 21.43 N ATOM 766 CA LEU A 53 -8.990 -2.643 -9.307 1.00 2.24 C ATOM 767 C LEU A 53 -9.831 -1.381 -9.202 1.00 40.30 C ATOM 768 O LEU A 53 -11.053 -1.449 -9.004 1.00 52.15 O ATOM 769 CB LEU A 53 -8.147 -2.819 -8.038 1.00 30.34 C ATOM 770 CG LEU A 53 -7.601 -4.210 -7.788 1.00 53.24 C ATOM 771 CD1 LEU A 53 -6.544 -4.160 -6.696 1.00 65.33 C ATOM 772 CD2 LEU A 53 -8.747 -5.102 -7.344 1.00 24.33 C ATOM 0 H LEU A 53 -7.132 -2.444 -10.232 1.00 21.43 H new ATOM 0 HA LEU A 53 -9.665 -3.491 -9.419 1.00 2.24 H new ATOM 0 HB2 LEU A 53 -7.308 -2.124 -8.084 1.00 30.34 H new ATOM 0 HB3 LEU A 53 -8.754 -2.529 -7.180 1.00 30.34 H new ATOM 0 HG LEU A 53 -7.149 -4.602 -8.699 1.00 53.24 H new ATOM 0 HD11 LEU A 53 -6.155 -5.163 -6.520 1.00 65.33 H new ATOM 0 HD12 LEU A 53 -5.731 -3.504 -7.007 1.00 65.33 H new ATOM 0 HD13 LEU A 53 -6.988 -3.777 -5.777 1.00 65.33 H new ATOM 0 HD21 LEU A 53 -8.373 -6.109 -7.159 1.00 24.33 H new ATOM 0 HD22 LEU A 53 -9.185 -4.703 -6.429 1.00 24.33 H new ATOM 0 HD23 LEU A 53 -9.506 -5.135 -8.125 1.00 24.33 H new ATOM 784 N GLU A 54 -9.182 -0.237 -9.340 1.00 0.11 N ATOM 785 CA GLU A 54 -9.821 1.058 -9.229 1.00 34.03 C ATOM 786 C GLU A 54 -10.896 1.225 -10.294 1.00 21.53 C ATOM 787 O GLU A 54 -12.011 1.548 -9.974 1.00 12.01 O ATOM 788 CB GLU A 54 -8.700 2.114 -9.349 1.00 31.30 C ATOM 789 CG GLU A 54 -9.019 3.574 -8.978 1.00 1.15 C ATOM 790 CD GLU A 54 -9.910 4.315 -9.949 1.00 4.20 C ATOM 791 OE1 GLU A 54 -9.425 4.712 -11.021 1.00 3.13 O ATOM 792 OE2 GLU A 54 -11.074 4.541 -9.653 1.00 34.30 O ATOM 0 H GLU A 54 -8.182 -0.184 -9.535 1.00 0.11 H new ATOM 0 HA GLU A 54 -10.336 1.171 -8.275 1.00 34.03 H new ATOM 0 HB2 GLU A 54 -7.870 1.787 -8.723 1.00 31.30 H new ATOM 0 HB3 GLU A 54 -8.345 2.104 -10.380 1.00 31.30 H new ATOM 0 HG2 GLU A 54 -9.493 3.585 -7.996 1.00 1.15 H new ATOM 0 HG3 GLU A 54 -8.080 4.120 -8.885 1.00 1.15 H new ATOM 799 N ALA A 55 -10.563 0.938 -11.540 1.00 12.43 N ATOM 800 CA ALA A 55 -11.534 1.030 -12.635 1.00 12.14 C ATOM 801 C ALA A 55 -12.769 0.166 -12.350 1.00 61.12 C ATOM 802 O ALA A 55 -13.931 0.620 -12.499 1.00 42.51 O ATOM 803 CB ALA A 55 -10.891 0.612 -13.950 1.00 71.24 C ATOM 0 H ALA A 55 -9.631 0.639 -11.827 1.00 12.43 H new ATOM 0 HA ALA A 55 -11.856 2.068 -12.714 1.00 12.14 H new ATOM 0 HB1 ALA A 55 -11.624 0.686 -14.753 1.00 71.24 H new ATOM 0 HB2 ALA A 55 -10.048 1.268 -14.167 1.00 71.24 H new ATOM 0 HB3 ALA A 55 -10.540 -0.417 -13.872 1.00 71.24 H new ATOM 809 N HIS A 56 -12.515 -1.044 -11.873 1.00 45.44 N ATOM 810 CA HIS A 56 -13.591 -1.995 -11.613 1.00 40.11 C ATOM 811 C HIS A 56 -14.516 -1.483 -10.499 1.00 14.43 C ATOM 812 O HIS A 56 -15.734 -1.626 -10.578 1.00 0.13 O ATOM 813 CB HIS A 56 -13.036 -3.396 -11.275 1.00 65.04 C ATOM 814 CG HIS A 56 -14.100 -4.463 -11.135 1.00 1.35 C ATOM 815 ND1 HIS A 56 -14.448 -5.314 -12.154 1.00 74.13 N ATOM 816 CD2 HIS A 56 -14.884 -4.809 -10.087 1.00 22.23 C ATOM 817 CE1 HIS A 56 -15.392 -6.130 -11.751 1.00 65.30 C ATOM 818 NE2 HIS A 56 -15.683 -5.848 -10.495 1.00 72.22 N ATOM 0 H HIS A 56 -11.580 -1.391 -11.659 1.00 45.44 H new ATOM 0 HA HIS A 56 -14.180 -2.088 -12.526 1.00 40.11 H new ATOM 0 HB2 HIS A 56 -12.336 -3.696 -12.055 1.00 65.04 H new ATOM 0 HB3 HIS A 56 -12.471 -3.337 -10.345 1.00 65.04 H new ATOM 0 HD2 HIS A 56 -14.881 -4.351 -9.109 1.00 22.23 H new ATOM 0 HE1 HIS A 56 -15.854 -6.903 -12.347 1.00 65.30 H new ATOM 0 HE2 HIS A 56 -16.383 -6.322 -9.924 1.00 72.22 H new ATOM 827 N PHE A 57 -13.935 -0.889 -9.478 1.00 64.42 N ATOM 828 CA PHE A 57 -14.693 -0.354 -8.361 1.00 70.41 C ATOM 829 C PHE A 57 -15.266 1.017 -8.631 1.00 41.13 C ATOM 830 O PHE A 57 -16.246 1.425 -8.015 1.00 40.24 O ATOM 831 CB PHE A 57 -13.934 -0.423 -7.053 1.00 35.24 C ATOM 832 CG PHE A 57 -13.964 -1.782 -6.441 1.00 42.23 C ATOM 833 CD1 PHE A 57 -15.024 -2.137 -5.654 1.00 2.01 C ATOM 834 CD2 PHE A 57 -12.960 -2.701 -6.649 1.00 44.04 C ATOM 835 CE1 PHE A 57 -15.096 -3.379 -5.074 1.00 53.52 C ATOM 836 CE2 PHE A 57 -13.026 -3.955 -6.070 1.00 10.44 C ATOM 837 CZ PHE A 57 -14.098 -4.286 -5.283 1.00 54.00 C ATOM 0 H PHE A 57 -12.926 -0.762 -9.397 1.00 64.42 H new ATOM 0 HA PHE A 57 -15.553 -1.014 -8.249 1.00 70.41 H new ATOM 0 HB2 PHE A 57 -12.898 -0.128 -7.223 1.00 35.24 H new ATOM 0 HB3 PHE A 57 -14.359 0.296 -6.353 1.00 35.24 H new ATOM 0 HD1 PHE A 57 -15.820 -1.427 -5.485 1.00 2.01 H new ATOM 0 HD2 PHE A 57 -12.115 -2.441 -7.269 1.00 44.04 H new ATOM 0 HE1 PHE A 57 -15.941 -3.638 -4.453 1.00 53.52 H new ATOM 0 HE2 PHE A 57 -12.235 -4.671 -6.237 1.00 10.44 H new ATOM 0 HZ PHE A 57 -14.153 -5.264 -4.828 1.00 54.00 H new ATOM 847 N SER A 58 -14.668 1.709 -9.563 1.00 41.42 N ATOM 848 CA SER A 58 -15.062 3.054 -9.911 1.00 3.14 C ATOM 849 C SER A 58 -16.406 3.017 -10.612 1.00 30.00 C ATOM 850 O SER A 58 -17.138 4.008 -10.637 1.00 61.43 O ATOM 851 CB SER A 58 -14.005 3.734 -10.786 1.00 44.32 C ATOM 852 OG SER A 58 -14.336 5.091 -11.052 1.00 73.11 O ATOM 0 H SER A 58 -13.884 1.354 -10.110 1.00 41.42 H new ATOM 0 HA SER A 58 -15.150 3.643 -8.998 1.00 3.14 H new ATOM 0 HB2 SER A 58 -13.036 3.686 -10.289 1.00 44.32 H new ATOM 0 HB3 SER A 58 -13.908 3.192 -11.727 1.00 44.32 H new ATOM 0 HG SER A 58 -13.639 5.494 -11.611 1.00 73.11 H new ATOM 858 N SER A 59 -16.729 1.877 -11.207 1.00 25.35 N ATOM 859 CA SER A 59 -18.048 1.673 -11.770 1.00 64.51 C ATOM 860 C SER A 59 -19.131 1.833 -10.656 1.00 65.21 C ATOM 861 O SER A 59 -20.269 2.234 -10.921 1.00 33.00 O ATOM 862 CB SER A 59 -18.113 0.265 -12.356 1.00 11.24 C ATOM 863 OG SER A 59 -17.022 0.031 -13.243 1.00 10.21 O ATOM 0 H SER A 59 -16.095 1.084 -11.310 1.00 25.35 H new ATOM 0 HA SER A 59 -18.238 2.411 -12.550 1.00 64.51 H new ATOM 0 HB2 SER A 59 -18.096 -0.469 -11.551 1.00 11.24 H new ATOM 0 HB3 SER A 59 -19.055 0.132 -12.889 1.00 11.24 H new ATOM 0 HG SER A 59 -17.084 -0.878 -13.605 1.00 10.21 H new ATOM 869 N CYS A 60 -18.744 1.547 -9.415 1.00 55.03 N ATOM 870 CA CYS A 60 -19.640 1.618 -8.267 1.00 35.21 C ATOM 871 C CYS A 60 -19.556 2.983 -7.545 1.00 53.30 C ATOM 872 O CYS A 60 -20.198 3.182 -6.510 1.00 3.15 O ATOM 873 CB CYS A 60 -19.280 0.499 -7.289 1.00 53.32 C ATOM 874 SG CYS A 60 -19.284 -1.153 -8.025 1.00 55.23 S ATOM 0 H CYS A 60 -17.795 1.258 -9.178 1.00 55.03 H new ATOM 0 HA CYS A 60 -20.662 1.503 -8.628 1.00 35.21 H new ATOM 0 HB2 CYS A 60 -18.292 0.698 -6.874 1.00 53.32 H new ATOM 0 HB3 CYS A 60 -19.985 0.517 -6.458 1.00 53.32 H new ATOM 0 HG CYS A 60 -20.287 -1.834 -7.557 1.00 55.23 H new ATOM 880 N GLY A 61 -18.803 3.920 -8.094 1.00 41.23 N ATOM 881 CA GLY A 61 -18.675 5.205 -7.434 1.00 73.32 C ATOM 882 C GLY A 61 -17.317 5.846 -7.583 1.00 23.22 C ATOM 883 O GLY A 61 -16.504 5.418 -8.398 1.00 24.55 O ATOM 0 H GLY A 61 -18.286 3.821 -8.968 1.00 41.23 H new ATOM 0 HA2 GLY A 61 -19.430 5.882 -7.834 1.00 73.32 H new ATOM 0 HA3 GLY A 61 -18.890 5.079 -6.373 1.00 73.32 H new ATOM 887 N SER A 62 -17.064 6.864 -6.794 1.00 13.35 N ATOM 888 CA SER A 62 -15.824 7.586 -6.879 1.00 13.55 C ATOM 889 C SER A 62 -14.857 7.113 -5.807 1.00 14.01 C ATOM 890 O SER A 62 -15.170 7.148 -4.605 1.00 23.24 O ATOM 891 CB SER A 62 -16.079 9.086 -6.739 1.00 15.00 C ATOM 892 OG SER A 62 -14.884 9.827 -6.892 1.00 52.44 O ATOM 0 H SER A 62 -17.708 7.210 -6.082 1.00 13.35 H new ATOM 0 HA SER A 62 -15.376 7.395 -7.854 1.00 13.55 H new ATOM 0 HB2 SER A 62 -16.805 9.405 -7.487 1.00 15.00 H new ATOM 0 HB3 SER A 62 -16.515 9.293 -5.762 1.00 15.00 H new ATOM 0 HG SER A 62 -15.078 10.783 -6.799 1.00 52.44 H new ATOM 898 N ILE A 63 -13.702 6.673 -6.239 1.00 50.53 N ATOM 899 CA ILE A 63 -12.685 6.179 -5.353 1.00 3.15 C ATOM 900 C ILE A 63 -11.831 7.301 -4.754 1.00 13.04 C ATOM 901 O ILE A 63 -11.398 8.227 -5.449 1.00 1.24 O ATOM 902 CB ILE A 63 -11.821 5.102 -6.049 1.00 32.41 C ATOM 903 CG1 ILE A 63 -12.706 3.895 -6.360 1.00 24.41 C ATOM 904 CG2 ILE A 63 -10.634 4.690 -5.182 1.00 13.33 C ATOM 905 CD1 ILE A 63 -12.006 2.780 -7.067 1.00 41.45 C ATOM 0 H ILE A 63 -13.441 6.649 -7.225 1.00 50.53 H new ATOM 0 HA ILE A 63 -13.193 5.707 -4.512 1.00 3.15 H new ATOM 0 HB ILE A 63 -11.413 5.513 -6.972 1.00 32.41 H new ATOM 0 HG12 ILE A 63 -13.120 3.514 -5.427 1.00 24.41 H new ATOM 0 HG13 ILE A 63 -13.547 4.224 -6.970 1.00 24.41 H new ATOM 0 HG21 ILE A 63 -10.049 3.932 -5.703 1.00 13.33 H new ATOM 0 HG22 ILE A 63 -10.008 5.560 -4.985 1.00 13.33 H new ATOM 0 HG23 ILE A 63 -10.997 4.283 -4.238 1.00 13.33 H new ATOM 0 HD11 ILE A 63 -12.708 1.966 -7.248 1.00 41.45 H new ATOM 0 HD12 ILE A 63 -11.616 3.141 -8.019 1.00 41.45 H new ATOM 0 HD13 ILE A 63 -11.182 2.419 -6.451 1.00 41.45 H new ATOM 917 N ASN A 64 -11.625 7.196 -3.462 1.00 24.01 N ATOM 918 CA ASN A 64 -10.864 8.139 -2.666 1.00 41.11 C ATOM 919 C ASN A 64 -9.438 7.628 -2.460 1.00 43.42 C ATOM 920 O ASN A 64 -8.479 8.365 -2.634 1.00 24.04 O ATOM 921 CB ASN A 64 -11.604 8.345 -1.323 1.00 71.44 C ATOM 922 CG ASN A 64 -10.924 9.255 -0.317 1.00 72.04 C ATOM 923 OD1 ASN A 64 -10.131 10.097 -0.652 1.00 5.44 O ATOM 924 ND2 ASN A 64 -11.307 9.128 0.926 1.00 13.42 N ATOM 0 H ASN A 64 -11.997 6.422 -2.912 1.00 24.01 H new ATOM 0 HA ASN A 64 -10.785 9.098 -3.177 1.00 41.11 H new ATOM 0 HB2 ASN A 64 -12.594 8.748 -1.536 1.00 71.44 H new ATOM 0 HB3 ASN A 64 -11.750 7.370 -0.859 1.00 71.44 H new ATOM 0 HD21 ASN A 64 -10.933 9.751 1.641 1.00 13.42 H new ATOM 0 HD22 ASN A 64 -11.980 8.405 1.181 1.00 13.42 H new ATOM 931 N ARG A 65 -9.305 6.350 -2.128 1.00 2.14 N ATOM 932 CA ARG A 65 -7.992 5.717 -1.914 1.00 50.43 C ATOM 933 C ARG A 65 -8.148 4.229 -2.156 1.00 23.24 C ATOM 934 O ARG A 65 -9.257 3.741 -2.206 1.00 31.34 O ATOM 935 CB ARG A 65 -7.479 5.881 -0.454 1.00 55.41 C ATOM 936 CG ARG A 65 -7.532 7.283 0.149 1.00 51.42 C ATOM 937 CD ARG A 65 -6.956 7.284 1.559 1.00 52.53 C ATOM 938 NE ARG A 65 -5.500 7.066 1.608 1.00 71.13 N ATOM 939 CZ ARG A 65 -4.895 6.322 2.539 1.00 43.00 C ATOM 940 NH1 ARG A 65 -5.589 5.391 3.205 1.00 10.33 N ATOM 941 NH2 ARG A 65 -3.579 6.436 2.730 1.00 62.42 N ATOM 0 H ARG A 65 -10.095 5.718 -1.998 1.00 2.14 H new ATOM 0 HA ARG A 65 -7.282 6.194 -2.590 1.00 50.43 H new ATOM 0 HB2 ARG A 65 -8.060 5.216 0.185 1.00 55.41 H new ATOM 0 HB3 ARG A 65 -6.446 5.536 -0.418 1.00 55.41 H new ATOM 0 HG2 ARG A 65 -6.972 7.976 -0.479 1.00 51.42 H new ATOM 0 HG3 ARG A 65 -8.563 7.636 0.172 1.00 51.42 H new ATOM 0 HD2 ARG A 65 -7.187 8.237 2.035 1.00 52.53 H new ATOM 0 HD3 ARG A 65 -7.450 6.508 2.143 1.00 52.53 H new ATOM 0 HE ARG A 65 -4.922 7.507 0.892 1.00 71.13 H new ATOM 0 HH11 ARG A 65 -6.579 5.250 3.002 1.00 10.33 H new ATOM 0 HH12 ARG A 65 -5.128 4.823 3.916 1.00 10.33 H new ATOM 0 HH21 ARG A 65 -3.037 7.090 2.166 1.00 62.42 H new ATOM 0 HH22 ARG A 65 -3.116 5.869 3.440 1.00 62.42 H new ATOM 955 N ILE A 66 -7.058 3.520 -2.314 1.00 71.00 N ATOM 956 CA ILE A 66 -7.090 2.064 -2.372 1.00 15.12 C ATOM 957 C ILE A 66 -5.821 1.536 -1.734 1.00 31.24 C ATOM 958 O ILE A 66 -4.767 2.166 -1.838 1.00 34.22 O ATOM 959 CB ILE A 66 -7.264 1.395 -3.810 1.00 22.23 C ATOM 960 CG1 ILE A 66 -6.027 1.498 -4.679 1.00 32.04 C ATOM 961 CG2 ILE A 66 -8.451 1.954 -4.565 1.00 54.05 C ATOM 962 CD1 ILE A 66 -6.174 0.741 -5.995 1.00 1.02 C ATOM 0 H ILE A 66 -6.126 3.924 -2.406 1.00 71.00 H new ATOM 0 HA ILE A 66 -7.998 1.784 -1.839 1.00 15.12 H new ATOM 0 HB ILE A 66 -7.438 0.340 -3.599 1.00 22.23 H new ATOM 0 HG12 ILE A 66 -5.820 2.548 -4.888 1.00 32.04 H new ATOM 0 HG13 ILE A 66 -5.169 1.107 -4.132 1.00 32.04 H new ATOM 0 HG21 ILE A 66 -8.526 1.467 -5.537 1.00 54.05 H new ATOM 0 HG22 ILE A 66 -9.363 1.772 -3.996 1.00 54.05 H new ATOM 0 HG23 ILE A 66 -8.320 3.027 -4.706 1.00 54.05 H new ATOM 0 HD11 ILE A 66 -5.260 0.847 -6.580 1.00 1.02 H new ATOM 0 HD12 ILE A 66 -6.353 -0.314 -5.790 1.00 1.02 H new ATOM 0 HD13 ILE A 66 -7.014 1.149 -6.557 1.00 1.02 H new ATOM 974 N THR A 67 -5.921 0.439 -1.062 1.00 3.32 N ATOM 975 CA THR A 67 -4.788 -0.187 -0.448 1.00 52.31 C ATOM 976 C THR A 67 -4.733 -1.571 -1.029 1.00 62.13 C ATOM 977 O THR A 67 -5.761 -2.177 -1.216 1.00 22.24 O ATOM 978 CB THR A 67 -4.953 -0.330 1.112 1.00 64.22 C ATOM 979 OG1 THR A 67 -5.980 -1.262 1.416 1.00 21.41 O ATOM 980 CG2 THR A 67 -5.326 0.987 1.768 1.00 5.22 C ATOM 0 H THR A 67 -6.800 -0.058 -0.919 1.00 3.32 H new ATOM 0 HA THR A 67 -3.895 0.411 -0.630 1.00 52.31 H new ATOM 0 HB THR A 67 -3.990 -0.667 1.495 1.00 64.22 H new ATOM 0 HG1 THR A 67 -5.966 -1.463 2.375 1.00 21.41 H new ATOM 0 HG21 THR A 67 -5.429 0.841 2.843 1.00 5.22 H new ATOM 0 HG22 THR A 67 -4.546 1.723 1.575 1.00 5.22 H new ATOM 0 HG23 THR A 67 -6.271 1.343 1.358 1.00 5.22 H new ATOM 988 N ILE A 68 -3.593 -2.049 -1.378 1.00 43.11 N ATOM 989 CA ILE A 68 -3.487 -3.412 -1.808 1.00 23.32 C ATOM 990 C ILE A 68 -2.375 -4.003 -1.007 1.00 42.31 C ATOM 991 O ILE A 68 -1.242 -3.585 -1.139 1.00 44.31 O ATOM 992 CB ILE A 68 -3.148 -3.602 -3.342 1.00 71.20 C ATOM 993 CG1 ILE A 68 -3.988 -2.694 -4.247 1.00 40.55 C ATOM 994 CG2 ILE A 68 -3.363 -5.050 -3.761 1.00 44.32 C ATOM 995 CD1 ILE A 68 -3.405 -1.311 -4.438 1.00 73.43 C ATOM 0 H ILE A 68 -2.718 -1.525 -1.377 1.00 43.11 H new ATOM 0 HA ILE A 68 -4.457 -3.888 -1.663 1.00 23.32 H new ATOM 0 HB ILE A 68 -2.101 -3.326 -3.462 1.00 71.20 H new ATOM 0 HG12 ILE A 68 -4.097 -3.169 -5.222 1.00 40.55 H new ATOM 0 HG13 ILE A 68 -4.988 -2.601 -3.824 1.00 40.55 H new ATOM 0 HG21 ILE A 68 -3.125 -5.162 -4.819 1.00 44.32 H new ATOM 0 HG22 ILE A 68 -2.715 -5.699 -3.173 1.00 44.32 H new ATOM 0 HG23 ILE A 68 -4.404 -5.327 -3.592 1.00 44.32 H new ATOM 0 HD11 ILE A 68 -4.056 -0.729 -5.090 1.00 73.43 H new ATOM 0 HD12 ILE A 68 -3.322 -0.815 -3.471 1.00 73.43 H new ATOM 0 HD13 ILE A 68 -2.417 -1.392 -4.891 1.00 73.43 H new ATOM 1007 N LEU A 69 -2.681 -4.910 -0.147 1.00 32.04 N ATOM 1008 CA LEU A 69 -1.656 -5.499 0.660 1.00 74.14 C ATOM 1009 C LEU A 69 -1.581 -6.979 0.445 1.00 11.25 C ATOM 1010 O LEU A 69 -2.574 -7.698 0.572 1.00 75.11 O ATOM 1011 CB LEU A 69 -1.665 -5.092 2.158 1.00 35.41 C ATOM 1012 CG LEU A 69 -2.900 -5.386 3.015 1.00 33.15 C ATOM 1013 CD1 LEU A 69 -2.551 -5.130 4.469 1.00 65.44 C ATOM 1014 CD2 LEU A 69 -4.082 -4.504 2.615 1.00 33.14 C ATOM 0 H LEU A 69 -3.624 -5.262 0.020 1.00 32.04 H new ATOM 0 HA LEU A 69 -0.724 -5.062 0.302 1.00 74.14 H new ATOM 0 HB2 LEU A 69 -0.814 -5.580 2.634 1.00 35.41 H new ATOM 0 HB3 LEU A 69 -1.484 -4.018 2.205 1.00 35.41 H new ATOM 0 HG LEU A 69 -3.191 -6.425 2.863 1.00 33.15 H new ATOM 0 HD11 LEU A 69 -3.421 -5.335 5.093 1.00 65.44 H new ATOM 0 HD12 LEU A 69 -1.729 -5.782 4.766 1.00 65.44 H new ATOM 0 HD13 LEU A 69 -2.252 -4.089 4.594 1.00 65.44 H new ATOM 0 HD21 LEU A 69 -4.941 -4.740 3.244 1.00 33.14 H new ATOM 0 HD22 LEU A 69 -3.814 -3.455 2.745 1.00 33.14 H new ATOM 0 HD23 LEU A 69 -4.336 -4.687 1.571 1.00 33.14 H new ATOM 1026 N CYS A 70 -0.437 -7.419 0.079 1.00 31.20 N ATOM 1027 CA CYS A 70 -0.211 -8.788 -0.225 1.00 34.11 C ATOM 1028 C CYS A 70 0.808 -9.359 0.735 1.00 23.24 C ATOM 1029 O CYS A 70 1.806 -8.698 1.034 1.00 14.32 O ATOM 1030 CB CYS A 70 0.291 -8.889 -1.650 1.00 44.41 C ATOM 1031 SG CYS A 70 -0.840 -8.203 -2.882 1.00 33.43 S ATOM 0 H CYS A 70 0.389 -6.829 -0.021 1.00 31.20 H new ATOM 0 HA CYS A 70 -1.136 -9.356 -0.124 1.00 34.11 H new ATOM 0 HB2 CYS A 70 1.248 -8.373 -1.724 1.00 44.41 H new ATOM 0 HB3 CYS A 70 0.475 -9.937 -1.885 1.00 44.41 H new ATOM 0 HG CYS A 70 -0.322 -8.334 -4.067 1.00 33.43 H new ATOM 1037 N ASP A 71 0.573 -10.547 1.243 1.00 33.23 N ATOM 1038 CA ASP A 71 1.546 -11.162 2.126 1.00 52.14 C ATOM 1039 C ASP A 71 2.010 -12.457 1.551 1.00 23.11 C ATOM 1040 O ASP A 71 1.243 -13.157 0.922 1.00 25.45 O ATOM 1041 CB ASP A 71 1.013 -11.381 3.541 1.00 1.11 C ATOM 1042 CG ASP A 71 -0.079 -12.404 3.634 1.00 32.50 C ATOM 1043 OD1 ASP A 71 0.224 -13.610 3.788 1.00 22.41 O ATOM 1044 OD2 ASP A 71 -1.250 -12.019 3.594 1.00 75.51 O ATOM 0 H ASP A 71 -0.265 -11.101 1.067 1.00 33.23 H new ATOM 0 HA ASP A 71 2.382 -10.468 2.206 1.00 52.14 H new ATOM 0 HB2 ASP A 71 1.838 -11.687 4.185 1.00 1.11 H new ATOM 0 HB3 ASP A 71 0.641 -10.432 3.928 1.00 1.11 H new ATOM 1049 N LYS A 72 3.267 -12.763 1.729 1.00 54.40 N ATOM 1050 CA LYS A 72 3.808 -14.003 1.229 1.00 31.52 C ATOM 1051 C LYS A 72 4.467 -14.773 2.384 1.00 42.14 C ATOM 1052 O LYS A 72 5.059 -15.845 2.187 1.00 23.11 O ATOM 1053 CB LYS A 72 4.845 -13.706 0.124 1.00 11.23 C ATOM 1054 CG LYS A 72 5.308 -14.933 -0.660 1.00 15.04 C ATOM 1055 CD LYS A 72 6.492 -14.630 -1.576 1.00 4.23 C ATOM 1056 CE LYS A 72 6.173 -13.590 -2.635 1.00 62.31 C ATOM 1057 NZ LYS A 72 7.353 -13.341 -3.524 1.00 42.13 N ATOM 0 H LYS A 72 3.939 -12.171 2.217 1.00 54.40 H new ATOM 0 HA LYS A 72 3.008 -14.611 0.807 1.00 31.52 H new ATOM 0 HB2 LYS A 72 4.417 -12.986 -0.573 1.00 11.23 H new ATOM 0 HB3 LYS A 72 5.715 -13.232 0.578 1.00 11.23 H new ATOM 0 HG2 LYS A 72 5.586 -15.723 0.038 1.00 15.04 H new ATOM 0 HG3 LYS A 72 4.479 -15.313 -1.257 1.00 15.04 H new ATOM 0 HD2 LYS A 72 7.330 -14.281 -0.973 1.00 4.23 H new ATOM 0 HD3 LYS A 72 6.812 -15.551 -2.064 1.00 4.23 H new ATOM 0 HE2 LYS A 72 5.327 -13.926 -3.235 1.00 62.31 H new ATOM 0 HE3 LYS A 72 5.873 -12.658 -2.155 1.00 62.31 H new ATOM 0 HZ1 LYS A 72 7.153 -12.534 -4.148 1.00 42.13 H new ATOM 0 HZ2 LYS A 72 8.188 -13.129 -2.941 1.00 42.13 H new ATOM 0 HZ3 LYS A 72 7.538 -14.187 -4.100 1.00 42.13 H new ATOM 1071 N PHE A 73 4.332 -14.246 3.606 1.00 61.55 N ATOM 1072 CA PHE A 73 4.978 -14.853 4.773 1.00 11.55 C ATOM 1073 C PHE A 73 4.440 -16.230 5.070 1.00 13.31 C ATOM 1074 O PHE A 73 5.131 -17.054 5.668 1.00 21.31 O ATOM 1075 CB PHE A 73 4.892 -13.969 6.037 1.00 52.33 C ATOM 1076 CG PHE A 73 3.500 -13.690 6.585 1.00 4.23 C ATOM 1077 CD1 PHE A 73 2.848 -14.617 7.390 1.00 1.30 C ATOM 1078 CD2 PHE A 73 2.863 -12.499 6.310 1.00 23.15 C ATOM 1079 CE1 PHE A 73 1.593 -14.354 7.899 1.00 23.34 C ATOM 1080 CE2 PHE A 73 1.606 -12.231 6.821 1.00 20.45 C ATOM 1081 CZ PHE A 73 0.973 -13.160 7.614 1.00 0.34 C ATOM 0 H PHE A 73 3.787 -13.409 3.811 1.00 61.55 H new ATOM 0 HA PHE A 73 6.030 -14.943 4.503 1.00 11.55 H new ATOM 0 HB2 PHE A 73 5.478 -14.443 6.824 1.00 52.33 H new ATOM 0 HB3 PHE A 73 5.368 -13.014 5.817 1.00 52.33 H new ATOM 0 HD1 PHE A 73 3.330 -15.556 7.620 1.00 1.30 H new ATOM 0 HD2 PHE A 73 3.352 -11.765 5.687 1.00 23.15 H new ATOM 0 HE1 PHE A 73 1.098 -15.085 8.521 1.00 23.34 H new ATOM 0 HE2 PHE A 73 1.121 -11.292 6.597 1.00 20.45 H new ATOM 0 HZ PHE A 73 -0.009 -12.952 8.012 1.00 0.34 H new ATOM 1091 N SER A 74 3.217 -16.476 4.660 1.00 70.34 N ATOM 1092 CA SER A 74 2.585 -17.737 4.902 1.00 74.10 C ATOM 1093 C SER A 74 3.045 -18.786 3.864 1.00 30.01 C ATOM 1094 O SER A 74 2.757 -19.977 3.991 1.00 3.34 O ATOM 1095 CB SER A 74 1.055 -17.548 4.888 1.00 15.42 C ATOM 1096 OG SER A 74 0.374 -18.731 5.266 1.00 43.53 O ATOM 0 H SER A 74 2.640 -15.805 4.152 1.00 70.34 H new ATOM 0 HA SER A 74 2.877 -18.112 5.883 1.00 74.10 H new ATOM 0 HB2 SER A 74 0.783 -16.740 5.567 1.00 15.42 H new ATOM 0 HB3 SER A 74 0.735 -17.248 3.890 1.00 15.42 H new ATOM 0 HG SER A 74 0.897 -19.512 4.989 1.00 43.53 H new ATOM 1102 N GLY A 75 3.773 -18.337 2.855 1.00 35.13 N ATOM 1103 CA GLY A 75 4.249 -19.224 1.822 1.00 45.12 C ATOM 1104 C GLY A 75 3.663 -18.847 0.500 1.00 52.14 C ATOM 1105 O GLY A 75 4.380 -18.586 -0.464 1.00 60.41 O ATOM 0 H GLY A 75 4.044 -17.361 2.735 1.00 35.13 H new ATOM 0 HA2 GLY A 75 5.337 -19.181 1.770 1.00 45.12 H new ATOM 0 HA3 GLY A 75 3.982 -20.252 2.065 1.00 45.12 H new ATOM 1109 N HIS A 76 2.370 -18.793 0.461 1.00 44.43 N ATOM 1110 CA HIS A 76 1.672 -18.384 -0.732 1.00 2.14 C ATOM 1111 C HIS A 76 1.356 -16.941 -0.591 1.00 31.21 C ATOM 1112 O HIS A 76 0.911 -16.511 0.474 1.00 63.15 O ATOM 1113 CB HIS A 76 0.387 -19.184 -0.981 1.00 71.41 C ATOM 1114 CG HIS A 76 0.598 -20.638 -1.224 1.00 52.42 C ATOM 1115 ND1 HIS A 76 0.547 -21.210 -2.473 1.00 61.20 N ATOM 1116 CD2 HIS A 76 0.840 -21.645 -0.365 1.00 14.22 C ATOM 1117 CE1 HIS A 76 0.748 -22.502 -2.368 1.00 62.11 C ATOM 1118 NE2 HIS A 76 0.924 -22.790 -1.100 1.00 61.13 N ATOM 0 H HIS A 76 1.764 -19.028 1.247 1.00 44.43 H new ATOM 0 HA HIS A 76 2.313 -18.573 -1.593 1.00 2.14 H new ATOM 0 HB2 HIS A 76 -0.272 -19.065 -0.121 1.00 71.41 H new ATOM 0 HB3 HIS A 76 -0.130 -18.757 -1.840 1.00 71.41 H new ATOM 0 HD2 HIS A 76 0.948 -21.562 0.706 1.00 14.22 H new ATOM 0 HE1 HIS A 76 0.766 -23.208 -3.185 1.00 62.11 H new ATOM 0 HE2 HIS A 76 1.096 -23.722 -0.724 1.00 61.13 H new ATOM 1127 N PRO A 77 1.600 -16.154 -1.611 1.00 40.21 N ATOM 1128 CA PRO A 77 1.300 -14.762 -1.542 1.00 63.42 C ATOM 1129 C PRO A 77 -0.207 -14.511 -1.709 1.00 61.33 C ATOM 1130 O PRO A 77 -0.806 -14.825 -2.755 1.00 63.40 O ATOM 1131 CB PRO A 77 2.125 -14.182 -2.690 1.00 21.35 C ATOM 1132 CG PRO A 77 2.232 -15.279 -3.688 1.00 61.04 C ATOM 1133 CD PRO A 77 2.187 -16.558 -2.909 1.00 63.01 C ATOM 0 HA PRO A 77 1.543 -14.304 -0.583 1.00 63.42 H new ATOM 0 HB2 PRO A 77 1.640 -13.305 -3.119 1.00 21.35 H new ATOM 0 HB3 PRO A 77 3.110 -13.865 -2.346 1.00 21.35 H new ATOM 0 HG2 PRO A 77 1.414 -15.232 -4.407 1.00 61.04 H new ATOM 0 HG3 PRO A 77 3.160 -15.201 -4.255 1.00 61.04 H new ATOM 0 HD2 PRO A 77 1.577 -17.310 -3.408 1.00 63.01 H new ATOM 0 HD3 PRO A 77 3.181 -16.986 -2.783 1.00 63.01 H new ATOM 1141 N LYS A 78 -0.811 -13.961 -0.672 1.00 63.44 N ATOM 1142 CA LYS A 78 -2.226 -13.685 -0.650 1.00 12.25 C ATOM 1143 C LYS A 78 -2.450 -12.235 -0.928 1.00 73.21 C ATOM 1144 O LYS A 78 -1.639 -11.404 -0.536 1.00 62.10 O ATOM 1145 CB LYS A 78 -2.813 -13.981 0.735 1.00 3.21 C ATOM 1146 CG LYS A 78 -2.470 -15.346 1.313 1.00 15.32 C ATOM 1147 CD LYS A 78 -3.403 -15.707 2.478 1.00 15.24 C ATOM 1148 CE LYS A 78 -3.431 -14.639 3.583 1.00 20.32 C ATOM 1149 NZ LYS A 78 -2.176 -14.530 4.338 1.00 63.23 N ATOM 0 H LYS A 78 -0.325 -13.693 0.184 1.00 63.44 H new ATOM 0 HA LYS A 78 -2.706 -14.313 -1.401 1.00 12.25 H new ATOM 0 HB2 LYS A 78 -2.467 -13.215 1.429 1.00 3.21 H new ATOM 0 HB3 LYS A 78 -3.898 -13.892 0.677 1.00 3.21 H new ATOM 0 HG2 LYS A 78 -2.548 -16.104 0.533 1.00 15.32 H new ATOM 0 HG3 LYS A 78 -1.436 -15.348 1.658 1.00 15.32 H new ATOM 0 HD2 LYS A 78 -4.413 -15.851 2.095 1.00 15.24 H new ATOM 0 HD3 LYS A 78 -3.086 -16.657 2.908 1.00 15.24 H new ATOM 0 HE2 LYS A 78 -3.659 -13.672 3.134 1.00 20.32 H new ATOM 0 HE3 LYS A 78 -4.241 -14.868 4.275 1.00 20.32 H new ATOM 0 HZ1 LYS A 78 -2.201 -13.677 4.932 1.00 63.23 H new ATOM 0 HZ2 LYS A 78 -2.060 -15.369 4.942 1.00 63.23 H new ATOM 0 HZ3 LYS A 78 -1.377 -14.467 3.676 1.00 63.23 H new ATOM 1163 N GLY A 79 -3.534 -11.925 -1.575 1.00 14.52 N ATOM 1164 CA GLY A 79 -3.831 -10.567 -1.853 1.00 23.10 C ATOM 1165 C GLY A 79 -5.164 -10.142 -1.293 1.00 5.13 C ATOM 1166 O GLY A 79 -6.159 -10.879 -1.371 1.00 20.42 O ATOM 0 H GLY A 79 -4.221 -12.598 -1.916 1.00 14.52 H new ATOM 0 HA2 GLY A 79 -3.047 -9.934 -1.437 1.00 23.10 H new ATOM 0 HA3 GLY A 79 -3.827 -10.411 -2.932 1.00 23.10 H new ATOM 1170 N TYR A 80 -5.171 -8.977 -0.720 1.00 44.44 N ATOM 1171 CA TYR A 80 -6.348 -8.338 -0.189 1.00 52.13 C ATOM 1172 C TYR A 80 -6.192 -6.839 -0.290 1.00 34.43 C ATOM 1173 O TYR A 80 -5.087 -6.313 -0.141 1.00 35.33 O ATOM 1174 CB TYR A 80 -6.740 -8.853 1.231 1.00 64.23 C ATOM 1175 CG TYR A 80 -5.586 -9.069 2.198 1.00 30.31 C ATOM 1176 CD1 TYR A 80 -4.862 -10.248 2.146 1.00 3.45 C ATOM 1177 CD2 TYR A 80 -5.229 -8.121 3.151 1.00 31.12 C ATOM 1178 CE1 TYR A 80 -3.822 -10.489 2.989 1.00 43.42 C ATOM 1179 CE2 TYR A 80 -4.164 -8.355 4.022 1.00 34.25 C ATOM 1180 CZ TYR A 80 -3.461 -9.557 3.921 1.00 71.23 C ATOM 1181 OH TYR A 80 -2.391 -9.830 4.760 1.00 42.02 O ATOM 0 H TYR A 80 -4.325 -8.419 -0.602 1.00 44.44 H new ATOM 0 HA TYR A 80 -7.207 -8.619 -0.798 1.00 52.13 H new ATOM 0 HB2 TYR A 80 -7.434 -8.140 1.677 1.00 64.23 H new ATOM 0 HB3 TYR A 80 -7.277 -9.795 1.120 1.00 64.23 H new ATOM 0 HD1 TYR A 80 -5.130 -10.997 1.416 1.00 3.45 H new ATOM 0 HD2 TYR A 80 -5.781 -7.195 3.218 1.00 31.12 H new ATOM 0 HE1 TYR A 80 -3.280 -11.420 2.922 1.00 43.42 H new ATOM 0 HE2 TYR A 80 -3.888 -7.618 4.762 1.00 34.25 H new ATOM 0 HH TYR A 80 -1.899 -10.606 4.420 1.00 42.02 H new ATOM 1191 N ALA A 81 -7.261 -6.164 -0.577 1.00 21.11 N ATOM 1192 CA ALA A 81 -7.202 -4.761 -0.871 1.00 10.11 C ATOM 1193 C ALA A 81 -8.375 -4.015 -0.284 1.00 72.15 C ATOM 1194 O ALA A 81 -9.414 -4.585 -0.050 1.00 72.11 O ATOM 1195 CB ALA A 81 -7.186 -4.577 -2.387 1.00 11.45 C ATOM 0 H ALA A 81 -8.198 -6.566 -0.615 1.00 21.11 H new ATOM 0 HA ALA A 81 -6.295 -4.354 -0.424 1.00 10.11 H new ATOM 0 HB1 ALA A 81 -7.141 -3.514 -2.624 1.00 11.45 H new ATOM 0 HB2 ALA A 81 -6.314 -5.079 -2.805 1.00 11.45 H new ATOM 0 HB3 ALA A 81 -8.092 -5.006 -2.815 1.00 11.45 H new ATOM 1201 N TYR A 82 -8.188 -2.760 -0.024 1.00 2.31 N ATOM 1202 CA TYR A 82 -9.248 -1.885 0.417 1.00 50.51 C ATOM 1203 C TYR A 82 -9.483 -0.824 -0.560 1.00 11.10 C ATOM 1204 O TYR A 82 -8.573 -0.116 -0.938 1.00 64.13 O ATOM 1205 CB TYR A 82 -8.963 -1.260 1.767 1.00 70.32 C ATOM 1206 CG TYR A 82 -9.290 -2.147 2.885 1.00 40.55 C ATOM 1207 CD1 TYR A 82 -8.552 -3.275 3.146 1.00 32.01 C ATOM 1208 CD2 TYR A 82 -10.368 -1.863 3.685 1.00 40.23 C ATOM 1209 CE1 TYR A 82 -8.897 -4.096 4.168 1.00 20.44 C ATOM 1210 CE2 TYR A 82 -10.708 -2.670 4.705 1.00 31.04 C ATOM 1211 CZ TYR A 82 -9.985 -3.778 4.943 1.00 3.22 C ATOM 1212 OH TYR A 82 -10.367 -4.586 5.935 1.00 51.12 O ATOM 0 H TYR A 82 -7.282 -2.299 -0.111 1.00 2.31 H new ATOM 0 HA TYR A 82 -10.138 -2.507 0.514 1.00 50.51 H new ATOM 0 HB2 TYR A 82 -7.909 -0.989 1.821 1.00 70.32 H new ATOM 0 HB3 TYR A 82 -9.535 -0.337 1.863 1.00 70.32 H new ATOM 0 HD1 TYR A 82 -7.693 -3.509 2.535 1.00 32.01 H new ATOM 0 HD2 TYR A 82 -10.953 -0.976 3.492 1.00 40.23 H new ATOM 0 HE1 TYR A 82 -8.324 -4.989 4.370 1.00 20.44 H new ATOM 0 HE2 TYR A 82 -11.556 -2.430 5.329 1.00 31.04 H new ATOM 0 HH TYR A 82 -11.190 -4.241 6.339 1.00 51.12 H new ATOM 1222 N ILE A 83 -10.680 -0.710 -0.992 1.00 50.05 N ATOM 1223 CA ILE A 83 -11.026 0.336 -1.872 1.00 32.12 C ATOM 1224 C ILE A 83 -11.776 1.362 -1.043 1.00 10.10 C ATOM 1225 O ILE A 83 -12.870 1.090 -0.556 1.00 13.41 O ATOM 1226 CB ILE A 83 -11.933 -0.169 -3.022 1.00 13.01 C ATOM 1227 CG1 ILE A 83 -11.331 -1.418 -3.711 1.00 43.05 C ATOM 1228 CG2 ILE A 83 -12.139 0.934 -4.040 1.00 11.23 C ATOM 1229 CD1 ILE A 83 -9.971 -1.219 -4.358 1.00 72.13 C ATOM 0 H ILE A 83 -11.446 -1.337 -0.746 1.00 50.05 H new ATOM 0 HA ILE A 83 -10.131 0.756 -2.331 1.00 32.12 H new ATOM 0 HB ILE A 83 -12.894 -0.452 -2.593 1.00 13.01 H new ATOM 0 HG12 ILE A 83 -11.249 -2.215 -2.971 1.00 43.05 H new ATOM 0 HG13 ILE A 83 -12.029 -1.762 -4.474 1.00 43.05 H new ATOM 0 HG21 ILE A 83 -12.778 0.571 -4.845 1.00 11.23 H new ATOM 0 HG22 ILE A 83 -12.613 1.790 -3.559 1.00 11.23 H new ATOM 0 HG23 ILE A 83 -11.175 1.236 -4.449 1.00 11.23 H new ATOM 0 HD11 ILE A 83 -9.643 -2.155 -4.810 1.00 72.13 H new ATOM 0 HD12 ILE A 83 -10.043 -0.450 -5.127 1.00 72.13 H new ATOM 0 HD13 ILE A 83 -9.250 -0.909 -3.601 1.00 72.13 H new ATOM 1241 N GLU A 84 -11.175 2.491 -0.830 1.00 31.02 N ATOM 1242 CA GLU A 84 -11.783 3.524 -0.042 1.00 45.02 C ATOM 1243 C GLU A 84 -12.450 4.511 -0.982 1.00 23.01 C ATOM 1244 O GLU A 84 -11.800 5.076 -1.847 1.00 30.14 O ATOM 1245 CB GLU A 84 -10.739 4.222 0.866 1.00 63.42 C ATOM 1246 CG GLU A 84 -9.922 3.243 1.731 1.00 10.42 C ATOM 1247 CD GLU A 84 -9.097 3.905 2.822 1.00 62.44 C ATOM 1248 OE1 GLU A 84 -8.024 4.479 2.522 1.00 62.44 O ATOM 1249 OE2 GLU A 84 -9.526 3.842 4.007 1.00 22.33 O ATOM 0 H GLU A 84 -10.252 2.725 -1.195 1.00 31.02 H new ATOM 0 HA GLU A 84 -12.532 3.091 0.621 1.00 45.02 H new ATOM 0 HB2 GLU A 84 -10.056 4.800 0.243 1.00 63.42 H new ATOM 0 HB3 GLU A 84 -11.252 4.929 1.518 1.00 63.42 H new ATOM 0 HG2 GLU A 84 -10.604 2.528 2.192 1.00 10.42 H new ATOM 0 HG3 GLU A 84 -9.255 2.675 1.083 1.00 10.42 H new ATOM 1256 N PHE A 85 -13.730 4.694 -0.837 1.00 33.24 N ATOM 1257 CA PHE A 85 -14.482 5.564 -1.722 1.00 60.24 C ATOM 1258 C PHE A 85 -14.709 6.917 -1.095 1.00 61.54 C ATOM 1259 O PHE A 85 -14.372 7.146 0.060 1.00 40.41 O ATOM 1260 CB PHE A 85 -15.839 4.966 -2.075 1.00 73.32 C ATOM 1261 CG PHE A 85 -15.802 3.677 -2.826 1.00 2.13 C ATOM 1262 CD1 PHE A 85 -15.696 3.671 -4.203 1.00 41.14 C ATOM 1263 CD2 PHE A 85 -15.908 2.470 -2.162 1.00 11.11 C ATOM 1264 CE1 PHE A 85 -15.695 2.488 -4.902 1.00 64.52 C ATOM 1265 CE2 PHE A 85 -15.902 1.286 -2.857 1.00 10.12 C ATOM 1266 CZ PHE A 85 -15.798 1.296 -4.228 1.00 41.31 C ATOM 0 H PHE A 85 -14.289 4.251 -0.108 1.00 33.24 H new ATOM 0 HA PHE A 85 -13.886 5.672 -2.628 1.00 60.24 H new ATOM 0 HB2 PHE A 85 -16.399 4.812 -1.152 1.00 73.32 H new ATOM 0 HB3 PHE A 85 -16.394 5.694 -2.667 1.00 73.32 H new ATOM 0 HD1 PHE A 85 -15.613 4.606 -4.736 1.00 41.14 H new ATOM 0 HD2 PHE A 85 -15.996 2.458 -1.086 1.00 11.11 H new ATOM 0 HE1 PHE A 85 -15.613 2.496 -5.979 1.00 64.52 H new ATOM 0 HE2 PHE A 85 -15.979 0.348 -2.327 1.00 10.12 H new ATOM 0 HZ PHE A 85 -15.797 0.365 -4.776 1.00 41.31 H new ATOM 1276 N ALA A 86 -15.215 7.825 -1.886 1.00 23.42 N ATOM 1277 CA ALA A 86 -15.622 9.120 -1.398 1.00 44.53 C ATOM 1278 C ALA A 86 -17.017 9.046 -0.769 1.00 1.41 C ATOM 1279 O ALA A 86 -17.271 9.650 0.279 1.00 73.34 O ATOM 1280 CB ALA A 86 -15.592 10.139 -2.527 1.00 10.21 C ATOM 0 H ALA A 86 -15.358 7.690 -2.887 1.00 23.42 H new ATOM 0 HA ALA A 86 -14.921 9.438 -0.626 1.00 44.53 H new ATOM 0 HB1 ALA A 86 -15.901 11.113 -2.147 1.00 10.21 H new ATOM 0 HB2 ALA A 86 -14.580 10.210 -2.926 1.00 10.21 H new ATOM 0 HB3 ALA A 86 -16.273 9.826 -3.318 1.00 10.21 H new ATOM 1286 N GLU A 87 -17.917 8.300 -1.404 1.00 5.24 N ATOM 1287 CA GLU A 87 -19.272 8.173 -0.921 1.00 75.30 C ATOM 1288 C GLU A 87 -19.479 6.862 -0.204 1.00 53.33 C ATOM 1289 O GLU A 87 -18.879 5.850 -0.550 1.00 51.42 O ATOM 1290 CB GLU A 87 -20.279 8.314 -2.062 1.00 43.02 C ATOM 1291 CG GLU A 87 -20.284 9.679 -2.718 1.00 10.13 C ATOM 1292 CD GLU A 87 -20.600 10.774 -1.731 1.00 21.41 C ATOM 1293 OE1 GLU A 87 -21.780 10.903 -1.325 1.00 14.22 O ATOM 1294 OE2 GLU A 87 -19.681 11.529 -1.338 1.00 41.11 O ATOM 0 H GLU A 87 -17.723 7.776 -2.257 1.00 5.24 H new ATOM 0 HA GLU A 87 -19.439 8.982 -0.210 1.00 75.30 H new ATOM 0 HB2 GLU A 87 -20.062 7.560 -2.819 1.00 43.02 H new ATOM 0 HB3 GLU A 87 -21.278 8.103 -1.679 1.00 43.02 H new ATOM 0 HG2 GLU A 87 -19.311 9.868 -3.171 1.00 10.13 H new ATOM 0 HG3 GLU A 87 -21.019 9.693 -3.523 1.00 10.13 H new ATOM 1301 N ARG A 88 -20.332 6.883 0.797 1.00 23.15 N ATOM 1302 CA ARG A 88 -20.623 5.700 1.591 1.00 23.15 C ATOM 1303 C ARG A 88 -21.515 4.791 0.735 1.00 4.44 C ATOM 1304 O ARG A 88 -21.405 3.565 0.752 1.00 24.35 O ATOM 1305 CB ARG A 88 -21.345 6.147 2.888 1.00 11.44 C ATOM 1306 CG ARG A 88 -21.298 5.174 4.088 1.00 1.11 C ATOM 1307 CD ARG A 88 -21.893 3.804 3.813 1.00 4.34 C ATOM 1308 NE ARG A 88 -23.287 3.865 3.366 1.00 21.45 N ATOM 1309 CZ ARG A 88 -24.037 2.798 3.071 1.00 14.02 C ATOM 1310 NH1 ARG A 88 -23.562 1.563 3.282 1.00 71.24 N ATOM 1311 NH2 ARG A 88 -25.265 2.961 2.594 1.00 32.11 N ATOM 0 H ARG A 88 -20.844 7.716 1.086 1.00 23.15 H new ATOM 0 HA ARG A 88 -19.721 5.158 1.875 1.00 23.15 H new ATOM 0 HB2 ARG A 88 -20.915 7.097 3.205 1.00 11.44 H new ATOM 0 HB3 ARG A 88 -22.391 6.336 2.646 1.00 11.44 H new ATOM 0 HG2 ARG A 88 -20.260 5.050 4.398 1.00 1.11 H new ATOM 0 HG3 ARG A 88 -21.829 5.625 4.926 1.00 1.11 H new ATOM 0 HD2 ARG A 88 -21.295 3.300 3.053 1.00 4.34 H new ATOM 0 HD3 ARG A 88 -21.833 3.200 4.718 1.00 4.34 H new ATOM 0 HE ARG A 88 -23.715 4.786 3.273 1.00 21.45 H new ATOM 0 HH11 ARG A 88 -22.627 1.435 3.668 1.00 71.24 H new ATOM 0 HH12 ARG A 88 -24.136 0.750 3.056 1.00 71.24 H new ATOM 0 HH21 ARG A 88 -25.637 3.900 2.452 1.00 32.11 H new ATOM 0 HH22 ARG A 88 -25.837 2.147 2.369 1.00 32.11 H new ATOM 1325 N ASN A 89 -22.345 5.414 -0.056 1.00 70.21 N ATOM 1326 CA ASN A 89 -23.214 4.711 -0.965 1.00 64.31 C ATOM 1327 C ASN A 89 -22.469 3.982 -2.056 1.00 42.21 C ATOM 1328 O ASN A 89 -23.004 3.045 -2.660 1.00 30.24 O ATOM 1329 CB ASN A 89 -24.427 5.533 -1.476 1.00 71.24 C ATOM 1330 CG ASN A 89 -24.198 7.012 -1.713 1.00 64.22 C ATOM 1331 OD1 ASN A 89 -23.369 7.657 -1.064 1.00 72.13 O ATOM 1332 ND2 ASN A 89 -24.961 7.567 -2.594 1.00 61.04 N ATOM 0 H ASN A 89 -22.439 6.429 -0.090 1.00 70.21 H new ATOM 0 HA ASN A 89 -23.672 3.934 -0.353 1.00 64.31 H new ATOM 0 HB2 ASN A 89 -24.770 5.088 -2.410 1.00 71.24 H new ATOM 0 HB3 ASN A 89 -25.238 5.426 -0.756 1.00 71.24 H new ATOM 0 HD21 ASN A 89 -24.890 8.569 -2.772 1.00 61.04 H new ATOM 0 HD22 ASN A 89 -25.635 7.004 -3.112 1.00 61.04 H new ATOM 1339 N SER A 90 -21.230 4.376 -2.312 1.00 53.01 N ATOM 1340 CA SER A 90 -20.400 3.680 -3.252 1.00 41.13 C ATOM 1341 C SER A 90 -20.083 2.278 -2.726 1.00 71.04 C ATOM 1342 O SER A 90 -20.026 1.318 -3.498 1.00 54.31 O ATOM 1343 CB SER A 90 -19.113 4.461 -3.473 1.00 31.55 C ATOM 1344 OG SER A 90 -19.388 5.792 -3.870 1.00 34.51 O ATOM 0 H SER A 90 -20.785 5.182 -1.872 1.00 53.01 H new ATOM 0 HA SER A 90 -20.927 3.588 -4.202 1.00 41.13 H new ATOM 0 HB2 SER A 90 -18.524 4.466 -2.556 1.00 31.55 H new ATOM 0 HB3 SER A 90 -18.511 3.968 -4.236 1.00 31.55 H new ATOM 0 HG SER A 90 -18.545 6.274 -4.004 1.00 34.51 H new ATOM 1350 N VAL A 91 -19.893 2.151 -1.394 1.00 53.33 N ATOM 1351 CA VAL A 91 -19.611 0.836 -0.823 1.00 62.23 C ATOM 1352 C VAL A 91 -20.816 -0.026 -0.994 1.00 40.31 C ATOM 1353 O VAL A 91 -20.701 -1.181 -1.333 1.00 14.14 O ATOM 1354 CB VAL A 91 -19.166 0.837 0.689 1.00 12.04 C ATOM 1355 CG1 VAL A 91 -18.135 1.865 0.955 1.00 4.14 C ATOM 1356 CG2 VAL A 91 -20.306 0.894 1.711 1.00 65.34 C ATOM 0 H VAL A 91 -19.930 2.919 -0.723 1.00 53.33 H new ATOM 0 HA VAL A 91 -18.749 0.449 -1.367 1.00 62.23 H new ATOM 0 HB VAL A 91 -18.722 -0.147 0.840 1.00 12.04 H new ATOM 0 HG11 VAL A 91 -17.854 1.835 2.008 1.00 4.14 H new ATOM 0 HG12 VAL A 91 -17.257 1.668 0.339 1.00 4.14 H new ATOM 0 HG13 VAL A 91 -18.533 2.851 0.714 1.00 4.14 H new ATOM 0 HG21 VAL A 91 -19.891 0.890 2.719 1.00 65.34 H new ATOM 0 HG22 VAL A 91 -20.885 1.805 1.560 1.00 65.34 H new ATOM 0 HG23 VAL A 91 -20.954 0.027 1.582 1.00 65.34 H new ATOM 1366 N ASP A 92 -21.992 0.569 -0.784 1.00 52.10 N ATOM 1367 CA ASP A 92 -23.278 -0.111 -0.937 1.00 20.52 C ATOM 1368 C ASP A 92 -23.402 -0.717 -2.339 1.00 2.23 C ATOM 1369 O ASP A 92 -23.931 -1.819 -2.519 1.00 21.23 O ATOM 1370 CB ASP A 92 -24.397 0.906 -0.702 1.00 65.03 C ATOM 1371 CG ASP A 92 -25.776 0.291 -0.661 1.00 44.30 C ATOM 1372 OD1 ASP A 92 -26.376 0.075 -1.701 1.00 35.21 O ATOM 1373 OD2 ASP A 92 -26.277 0.033 0.434 1.00 41.24 O ATOM 0 H ASP A 92 -22.078 1.545 -0.500 1.00 52.10 H new ATOM 0 HA ASP A 92 -23.352 -0.921 -0.212 1.00 20.52 H new ATOM 0 HB2 ASP A 92 -24.212 1.426 0.238 1.00 65.03 H new ATOM 0 HB3 ASP A 92 -24.366 1.656 -1.492 1.00 65.03 H new ATOM 1378 N ALA A 93 -22.911 0.003 -3.318 1.00 52.42 N ATOM 1379 CA ALA A 93 -22.906 -0.456 -4.688 1.00 42.42 C ATOM 1380 C ALA A 93 -21.848 -1.550 -4.910 1.00 21.32 C ATOM 1381 O ALA A 93 -22.085 -2.519 -5.626 1.00 61.23 O ATOM 1382 CB ALA A 93 -22.675 0.713 -5.625 1.00 34.31 C ATOM 0 H ALA A 93 -22.502 0.928 -3.188 1.00 52.42 H new ATOM 0 HA ALA A 93 -23.880 -0.895 -4.904 1.00 42.42 H new ATOM 0 HB1 ALA A 93 -22.673 0.358 -6.656 1.00 34.31 H new ATOM 0 HB2 ALA A 93 -23.471 1.446 -5.495 1.00 34.31 H new ATOM 0 HB3 ALA A 93 -21.715 1.176 -5.399 1.00 34.31 H new ATOM 1388 N ALA A 94 -20.701 -1.399 -4.263 1.00 23.04 N ATOM 1389 CA ALA A 94 -19.576 -2.317 -4.444 1.00 41.52 C ATOM 1390 C ALA A 94 -19.793 -3.649 -3.717 1.00 3.54 C ATOM 1391 O ALA A 94 -19.447 -4.706 -4.232 1.00 53.03 O ATOM 1392 CB ALA A 94 -18.274 -1.663 -3.997 1.00 2.12 C ATOM 0 H ALA A 94 -20.521 -0.644 -3.602 1.00 23.04 H new ATOM 0 HA ALA A 94 -19.509 -2.541 -5.509 1.00 41.52 H new ATOM 0 HB1 ALA A 94 -17.449 -2.361 -4.139 1.00 2.12 H new ATOM 0 HB2 ALA A 94 -18.096 -0.765 -4.589 1.00 2.12 H new ATOM 0 HB3 ALA A 94 -18.345 -1.395 -2.943 1.00 2.12 H new ATOM 1398 N VAL A 95 -20.354 -3.579 -2.513 1.00 24.21 N ATOM 1399 CA VAL A 95 -20.663 -4.775 -1.690 1.00 10.54 C ATOM 1400 C VAL A 95 -21.543 -5.791 -2.417 1.00 23.13 C ATOM 1401 O VAL A 95 -21.557 -6.959 -2.071 1.00 2.34 O ATOM 1402 CB VAL A 95 -21.255 -4.446 -0.299 1.00 14.44 C ATOM 1403 CG1 VAL A 95 -20.288 -3.606 0.505 1.00 20.41 C ATOM 1404 CG2 VAL A 95 -22.611 -3.769 -0.402 1.00 53.14 C ATOM 0 H VAL A 95 -20.612 -2.698 -2.068 1.00 24.21 H new ATOM 0 HA VAL A 95 -19.689 -5.234 -1.520 1.00 10.54 H new ATOM 0 HB VAL A 95 -21.410 -5.391 0.222 1.00 14.44 H new ATOM 0 HG11 VAL A 95 -20.722 -3.385 1.480 1.00 20.41 H new ATOM 0 HG12 VAL A 95 -19.355 -4.153 0.639 1.00 20.41 H new ATOM 0 HG13 VAL A 95 -20.089 -2.674 -0.024 1.00 20.41 H new ATOM 0 HG21 VAL A 95 -22.989 -3.557 0.598 1.00 53.14 H new ATOM 0 HG22 VAL A 95 -22.511 -2.837 -0.958 1.00 53.14 H new ATOM 0 HG23 VAL A 95 -23.308 -4.427 -0.921 1.00 53.14 H new ATOM 1414 N ALA A 96 -22.267 -5.334 -3.423 1.00 23.25 N ATOM 1415 CA ALA A 96 -23.098 -6.206 -4.253 1.00 41.41 C ATOM 1416 C ALA A 96 -22.212 -7.161 -5.085 1.00 14.45 C ATOM 1417 O ALA A 96 -22.706 -8.092 -5.719 1.00 31.32 O ATOM 1418 CB ALA A 96 -23.959 -5.355 -5.170 1.00 34.41 C ATOM 0 H ALA A 96 -22.300 -4.351 -3.692 1.00 23.25 H new ATOM 0 HA ALA A 96 -23.740 -6.808 -3.610 1.00 41.41 H new ATOM 0 HB1 ALA A 96 -24.580 -6.002 -5.790 1.00 34.41 H new ATOM 0 HB2 ALA A 96 -24.597 -4.706 -4.571 1.00 34.41 H new ATOM 0 HB3 ALA A 96 -23.319 -4.746 -5.808 1.00 34.41 H new ATOM 1424 N MET A 97 -20.909 -6.923 -5.080 1.00 75.35 N ATOM 1425 CA MET A 97 -19.981 -7.749 -5.820 1.00 3.42 C ATOM 1426 C MET A 97 -19.272 -8.801 -4.942 1.00 2.53 C ATOM 1427 O MET A 97 -18.392 -9.517 -5.425 1.00 64.54 O ATOM 1428 CB MET A 97 -18.945 -6.907 -6.583 1.00 23.32 C ATOM 1429 CG MET A 97 -19.528 -5.998 -7.659 1.00 65.04 C ATOM 1430 SD MET A 97 -18.249 -5.162 -8.638 1.00 21.53 S ATOM 1431 CE MET A 97 -17.372 -4.256 -7.375 1.00 24.02 C ATOM 0 H MET A 97 -20.473 -6.157 -4.566 1.00 75.35 H new ATOM 0 HA MET A 97 -20.590 -8.290 -6.544 1.00 3.42 H new ATOM 0 HB2 MET A 97 -18.397 -6.294 -5.867 1.00 23.32 H new ATOM 0 HB3 MET A 97 -18.222 -7.578 -7.047 1.00 23.32 H new ATOM 0 HG2 MET A 97 -20.161 -6.587 -8.323 1.00 65.04 H new ATOM 0 HG3 MET A 97 -20.167 -5.250 -7.190 1.00 65.04 H new ATOM 0 HE1 MET A 97 -17.048 -3.295 -7.775 1.00 24.02 H new ATOM 0 HE2 MET A 97 -18.031 -4.090 -6.522 1.00 24.02 H new ATOM 0 HE3 MET A 97 -16.501 -4.828 -7.055 1.00 24.02 H new ATOM 1441 N ASP A 98 -19.661 -8.925 -3.666 1.00 61.42 N ATOM 1442 CA ASP A 98 -19.071 -9.948 -2.697 1.00 30.22 C ATOM 1443 C ASP A 98 -19.432 -11.412 -3.081 1.00 71.50 C ATOM 1444 O ASP A 98 -19.339 -12.337 -2.269 1.00 3.04 O ATOM 1445 CB ASP A 98 -19.517 -9.666 -1.249 1.00 62.24 C ATOM 1446 CG ASP A 98 -20.886 -10.193 -0.873 1.00 10.41 C ATOM 1447 OD1 ASP A 98 -21.893 -9.737 -1.419 1.00 72.12 O ATOM 1448 OD2 ASP A 98 -20.947 -11.064 0.028 1.00 74.23 O ATOM 0 H ASP A 98 -20.385 -8.340 -3.248 1.00 61.42 H new ATOM 0 HA ASP A 98 -17.988 -9.843 -2.767 1.00 30.22 H new ATOM 0 HB2 ASP A 98 -18.782 -10.098 -0.570 1.00 62.24 H new ATOM 0 HB3 ASP A 98 -19.505 -8.588 -1.087 1.00 62.24 H new ATOM 1453 N GLU A 99 -19.714 -11.591 -4.328 1.00 32.25 N ATOM 1454 CA GLU A 99 -20.296 -12.805 -4.849 1.00 21.40 C ATOM 1455 C GLU A 99 -19.956 -12.927 -6.344 1.00 71.23 C ATOM 1456 O GLU A 99 -20.200 -13.968 -6.987 1.00 33.43 O ATOM 1457 CB GLU A 99 -21.813 -12.756 -4.613 1.00 22.53 C ATOM 1458 CG GLU A 99 -22.575 -14.023 -4.954 1.00 62.25 C ATOM 1459 CD GLU A 99 -24.038 -13.881 -4.643 1.00 11.40 C ATOM 1460 OE1 GLU A 99 -24.798 -13.433 -5.526 1.00 15.31 O ATOM 1461 OE2 GLU A 99 -24.445 -14.183 -3.501 1.00 71.42 O ATOM 0 H GLU A 99 -19.545 -10.882 -5.042 1.00 32.25 H new ATOM 0 HA GLU A 99 -19.894 -13.683 -4.343 1.00 21.40 H new ATOM 0 HB2 GLU A 99 -21.991 -12.518 -3.564 1.00 22.53 H new ATOM 0 HB3 GLU A 99 -22.227 -11.936 -5.200 1.00 22.53 H new ATOM 0 HG2 GLU A 99 -22.447 -14.254 -6.012 1.00 62.25 H new ATOM 0 HG3 GLU A 99 -22.161 -14.861 -4.393 1.00 62.25 H new ATOM 1468 N THR A 100 -19.371 -11.873 -6.882 1.00 25.12 N ATOM 1469 CA THR A 100 -19.032 -11.831 -8.281 1.00 65.10 C ATOM 1470 C THR A 100 -17.657 -12.412 -8.540 1.00 73.01 C ATOM 1471 O THR A 100 -16.875 -12.665 -7.604 1.00 15.25 O ATOM 1472 CB THR A 100 -19.101 -10.393 -8.849 1.00 52.30 C ATOM 1473 OG1 THR A 100 -18.212 -9.526 -8.131 1.00 64.31 O ATOM 1474 CG2 THR A 100 -20.517 -9.853 -8.769 1.00 64.22 C ATOM 0 H THR A 100 -19.122 -11.032 -6.362 1.00 25.12 H new ATOM 0 HA THR A 100 -19.775 -12.442 -8.794 1.00 65.10 H new ATOM 0 HB THR A 100 -18.796 -10.428 -9.895 1.00 52.30 H new ATOM 0 HG1 THR A 100 -18.450 -9.528 -7.180 1.00 64.31 H new ATOM 0 HG21 THR A 100 -20.544 -8.841 -9.173 1.00 64.22 H new ATOM 0 HG22 THR A 100 -21.184 -10.493 -9.347 1.00 64.22 H new ATOM 0 HG23 THR A 100 -20.842 -9.837 -7.729 1.00 64.22 H new ATOM 1482 N VAL A 101 -17.364 -12.613 -9.787 1.00 33.41 N ATOM 1483 CA VAL A 101 -16.111 -13.149 -10.204 1.00 40.34 C ATOM 1484 C VAL A 101 -15.254 -12.041 -10.831 1.00 43.14 C ATOM 1485 O VAL A 101 -15.736 -11.245 -11.636 1.00 61.23 O ATOM 1486 CB VAL A 101 -16.327 -14.340 -11.191 1.00 44.22 C ATOM 1487 CG1 VAL A 101 -17.168 -13.922 -12.368 1.00 40.45 C ATOM 1488 CG2 VAL A 101 -15.018 -14.918 -11.664 1.00 43.05 C ATOM 0 H VAL A 101 -18.002 -12.405 -10.555 1.00 33.41 H new ATOM 0 HA VAL A 101 -15.578 -13.538 -9.336 1.00 40.34 H new ATOM 0 HB VAL A 101 -16.858 -15.118 -10.642 1.00 44.22 H new ATOM 0 HG11 VAL A 101 -17.302 -14.771 -13.039 1.00 40.45 H new ATOM 0 HG12 VAL A 101 -18.141 -13.580 -12.016 1.00 40.45 H new ATOM 0 HG13 VAL A 101 -16.670 -13.113 -12.902 1.00 40.45 H new ATOM 0 HG21 VAL A 101 -15.211 -15.744 -12.349 1.00 43.05 H new ATOM 0 HG22 VAL A 101 -14.444 -14.147 -12.178 1.00 43.05 H new ATOM 0 HG23 VAL A 101 -14.450 -15.282 -10.808 1.00 43.05 H new ATOM 1498 N PHE A 102 -14.025 -11.971 -10.419 1.00 75.41 N ATOM 1499 CA PHE A 102 -13.082 -11.014 -10.930 1.00 20.13 C ATOM 1500 C PHE A 102 -11.845 -11.753 -11.384 1.00 31.52 C ATOM 1501 O PHE A 102 -11.262 -12.518 -10.611 1.00 71.21 O ATOM 1502 CB PHE A 102 -12.734 -9.983 -9.841 1.00 34.33 C ATOM 1503 CG PHE A 102 -11.734 -8.929 -10.252 1.00 30.31 C ATOM 1504 CD1 PHE A 102 -12.136 -7.817 -10.971 1.00 10.15 C ATOM 1505 CD2 PHE A 102 -10.392 -9.053 -9.914 1.00 21.52 C ATOM 1506 CE1 PHE A 102 -11.224 -6.849 -11.345 1.00 41.54 C ATOM 1507 CE2 PHE A 102 -9.478 -8.088 -10.285 1.00 45.22 C ATOM 1508 CZ PHE A 102 -9.893 -6.985 -11.002 1.00 24.21 C ATOM 0 H PHE A 102 -13.639 -12.588 -9.704 1.00 75.41 H new ATOM 0 HA PHE A 102 -13.513 -10.476 -11.775 1.00 20.13 H new ATOM 0 HB2 PHE A 102 -13.652 -9.487 -9.526 1.00 34.33 H new ATOM 0 HB3 PHE A 102 -12.343 -10.513 -8.972 1.00 34.33 H new ATOM 0 HD1 PHE A 102 -13.175 -7.705 -11.243 1.00 10.15 H new ATOM 0 HD2 PHE A 102 -10.060 -9.915 -9.354 1.00 21.52 H new ATOM 0 HE1 PHE A 102 -11.552 -5.986 -11.906 1.00 41.54 H new ATOM 0 HE2 PHE A 102 -8.438 -8.196 -10.014 1.00 45.22 H new ATOM 0 HZ PHE A 102 -9.179 -6.230 -11.294 1.00 24.21 H new ATOM 1518 N ARG A 103 -11.487 -11.561 -12.646 1.00 62.10 N ATOM 1519 CA ARG A 103 -10.321 -12.175 -13.287 1.00 40.44 C ATOM 1520 C ARG A 103 -10.354 -13.721 -13.139 1.00 21.20 C ATOM 1521 O ARG A 103 -9.327 -14.418 -13.096 1.00 52.02 O ATOM 1522 CB ARG A 103 -9.041 -11.542 -12.737 1.00 32.13 C ATOM 1523 CG ARG A 103 -7.806 -11.920 -13.513 1.00 51.21 C ATOM 1524 CD ARG A 103 -6.594 -11.212 -12.998 1.00 35.23 C ATOM 1525 NE ARG A 103 -5.392 -11.717 -13.645 1.00 65.22 N ATOM 1526 CZ ARG A 103 -4.569 -12.567 -13.062 1.00 12.33 C ATOM 1527 NH1 ARG A 103 -4.866 -13.014 -11.867 1.00 44.13 N ATOM 1528 NH2 ARG A 103 -3.478 -12.999 -13.685 1.00 20.20 N ATOM 0 H ARG A 103 -12.013 -10.955 -13.276 1.00 62.10 H new ATOM 0 HA ARG A 103 -10.344 -11.980 -14.359 1.00 40.44 H new ATOM 0 HB2 ARG A 103 -9.148 -10.457 -12.745 1.00 32.13 H new ATOM 0 HB3 ARG A 103 -8.914 -11.842 -11.697 1.00 32.13 H new ATOM 0 HG2 ARG A 103 -7.652 -12.997 -13.451 1.00 51.21 H new ATOM 0 HG3 ARG A 103 -7.949 -11.678 -14.566 1.00 51.21 H new ATOM 0 HD2 ARG A 103 -6.688 -10.141 -13.178 1.00 35.23 H new ATOM 0 HD3 ARG A 103 -6.517 -11.348 -11.919 1.00 35.23 H new ATOM 0 HE ARG A 103 -5.177 -11.400 -14.590 1.00 65.22 H new ATOM 0 HH11 ARG A 103 -5.721 -12.704 -11.404 1.00 44.13 H new ATOM 0 HH12 ARG A 103 -4.243 -13.672 -11.399 1.00 44.13 H new ATOM 0 HH21 ARG A 103 -3.267 -12.673 -14.628 1.00 20.20 H new ATOM 0 HH22 ARG A 103 -2.852 -13.656 -13.220 1.00 20.20 H new ATOM 1542 N GLY A 104 -11.560 -14.236 -13.140 1.00 23.41 N ATOM 1543 CA GLY A 104 -11.773 -15.656 -13.091 1.00 4.11 C ATOM 1544 C GLY A 104 -11.770 -16.244 -11.691 1.00 74.32 C ATOM 1545 O GLY A 104 -11.638 -17.451 -11.533 1.00 14.05 O ATOM 0 H GLY A 104 -12.416 -13.682 -13.175 1.00 23.41 H new ATOM 0 HA2 GLY A 104 -12.727 -15.884 -13.566 1.00 4.11 H new ATOM 0 HA3 GLY A 104 -10.999 -16.148 -13.680 1.00 4.11 H new ATOM 1549 N ARG A 105 -11.874 -15.416 -10.671 1.00 33.13 N ATOM 1550 CA ARG A 105 -11.999 -15.942 -9.326 1.00 61.31 C ATOM 1551 C ARG A 105 -13.064 -15.192 -8.557 1.00 40.13 C ATOM 1552 O ARG A 105 -13.294 -14.013 -8.804 1.00 43.31 O ATOM 1553 CB ARG A 105 -10.662 -15.923 -8.584 1.00 34.20 C ATOM 1554 CG ARG A 105 -10.075 -14.544 -8.297 1.00 55.45 C ATOM 1555 CD ARG A 105 -8.692 -14.675 -7.669 1.00 43.23 C ATOM 1556 NE ARG A 105 -7.716 -15.230 -8.615 1.00 30.20 N ATOM 1557 CZ ARG A 105 -7.342 -16.512 -8.692 1.00 11.43 C ATOM 1558 NH1 ARG A 105 -7.805 -17.405 -7.825 1.00 41.13 N ATOM 1559 NH2 ARG A 105 -6.480 -16.897 -9.623 1.00 50.04 N ATOM 0 H ARG A 105 -11.875 -14.399 -10.743 1.00 33.13 H new ATOM 0 HA ARG A 105 -12.306 -16.985 -9.405 1.00 61.31 H new ATOM 0 HB2 ARG A 105 -10.788 -16.447 -7.636 1.00 34.20 H new ATOM 0 HB3 ARG A 105 -9.937 -16.490 -9.168 1.00 34.20 H new ATOM 0 HG2 ARG A 105 -10.009 -13.970 -9.222 1.00 55.45 H new ATOM 0 HG3 ARG A 105 -10.735 -13.993 -7.627 1.00 55.45 H new ATOM 0 HD2 ARG A 105 -8.353 -13.697 -7.328 1.00 43.23 H new ATOM 0 HD3 ARG A 105 -8.751 -15.316 -6.789 1.00 43.23 H new ATOM 0 HE ARG A 105 -7.285 -14.580 -9.272 1.00 30.20 H new ATOM 0 HH11 ARG A 105 -8.452 -17.116 -7.092 1.00 41.13 H new ATOM 0 HH12 ARG A 105 -7.513 -18.380 -7.893 1.00 41.13 H new ATOM 0 HH21 ARG A 105 -6.102 -16.215 -10.281 1.00 50.04 H new ATOM 0 HH22 ARG A 105 -6.195 -17.875 -9.681 1.00 50.04 H new ATOM 1573 N THR A 106 -13.721 -15.868 -7.652 1.00 14.53 N ATOM 1574 CA THR A 106 -14.745 -15.246 -6.867 1.00 21.25 C ATOM 1575 C THR A 106 -14.090 -14.439 -5.761 1.00 14.03 C ATOM 1576 O THR A 106 -13.309 -14.977 -4.964 1.00 33.32 O ATOM 1577 CB THR A 106 -15.721 -16.292 -6.277 1.00 22.22 C ATOM 1578 OG1 THR A 106 -16.319 -17.047 -7.357 1.00 0.14 O ATOM 1579 CG2 THR A 106 -16.830 -15.616 -5.474 1.00 21.31 C ATOM 0 H THR A 106 -13.562 -16.853 -7.442 1.00 14.53 H new ATOM 0 HA THR A 106 -15.332 -14.587 -7.507 1.00 21.25 H new ATOM 0 HB THR A 106 -15.160 -16.950 -5.614 1.00 22.22 H new ATOM 0 HG1 THR A 106 -16.937 -17.712 -6.988 1.00 0.14 H new ATOM 0 HG21 THR A 106 -17.501 -16.374 -5.071 1.00 21.31 H new ATOM 0 HG22 THR A 106 -16.391 -15.047 -4.654 1.00 21.31 H new ATOM 0 HG23 THR A 106 -17.391 -14.943 -6.123 1.00 21.31 H new ATOM 1587 N ILE A 107 -14.369 -13.166 -5.736 1.00 34.31 N ATOM 1588 CA ILE A 107 -13.782 -12.292 -4.737 1.00 33.22 C ATOM 1589 C ILE A 107 -14.771 -11.976 -3.633 1.00 65.13 C ATOM 1590 O ILE A 107 -15.953 -12.336 -3.709 1.00 14.33 O ATOM 1591 CB ILE A 107 -13.267 -10.962 -5.353 1.00 3.44 C ATOM 1592 CG1 ILE A 107 -14.416 -10.197 -6.051 1.00 1.41 C ATOM 1593 CG2 ILE A 107 -12.114 -11.233 -6.317 1.00 62.04 C ATOM 1594 CD1 ILE A 107 -14.020 -8.843 -6.607 1.00 72.31 C ATOM 0 H ILE A 107 -14.998 -12.703 -6.392 1.00 34.31 H new ATOM 0 HA ILE A 107 -12.933 -12.833 -4.320 1.00 33.22 H new ATOM 0 HB ILE A 107 -12.892 -10.330 -4.548 1.00 3.44 H new ATOM 0 HG12 ILE A 107 -14.804 -10.811 -6.864 1.00 1.41 H new ATOM 0 HG13 ILE A 107 -15.230 -10.060 -5.339 1.00 1.41 H new ATOM 0 HG21 ILE A 107 -11.764 -10.291 -6.740 1.00 62.04 H new ATOM 0 HG22 ILE A 107 -11.297 -11.715 -5.780 1.00 62.04 H new ATOM 0 HG23 ILE A 107 -12.457 -11.886 -7.119 1.00 62.04 H new ATOM 0 HD11 ILE A 107 -14.885 -8.376 -7.079 1.00 72.31 H new ATOM 0 HD12 ILE A 107 -13.662 -8.208 -5.797 1.00 72.31 H new ATOM 0 HD13 ILE A 107 -13.229 -8.970 -7.346 1.00 72.31 H new ATOM 1606 N LYS A 108 -14.289 -11.327 -2.605 1.00 13.32 N ATOM 1607 CA LYS A 108 -15.101 -10.975 -1.475 1.00 22.32 C ATOM 1608 C LYS A 108 -14.995 -9.490 -1.264 1.00 4.03 C ATOM 1609 O LYS A 108 -13.903 -8.965 -1.194 1.00 52.44 O ATOM 1610 CB LYS A 108 -14.644 -11.727 -0.204 1.00 2.53 C ATOM 1611 CG LYS A 108 -15.434 -11.373 1.062 1.00 53.44 C ATOM 1612 CD LYS A 108 -16.915 -11.673 0.892 1.00 11.44 C ATOM 1613 CE LYS A 108 -17.722 -11.269 2.119 1.00 52.02 C ATOM 1614 NZ LYS A 108 -19.171 -11.569 1.962 1.00 63.51 N ATOM 0 H LYS A 108 -13.317 -11.027 -2.530 1.00 13.32 H new ATOM 0 HA LYS A 108 -16.135 -11.259 -1.669 1.00 22.32 H new ATOM 0 HB2 LYS A 108 -14.728 -12.799 -0.381 1.00 2.53 H new ATOM 0 HB3 LYS A 108 -13.589 -11.514 -0.030 1.00 2.53 H new ATOM 0 HG2 LYS A 108 -15.041 -11.937 1.908 1.00 53.44 H new ATOM 0 HG3 LYS A 108 -15.299 -10.316 1.294 1.00 53.44 H new ATOM 0 HD2 LYS A 108 -17.294 -11.144 0.018 1.00 11.44 H new ATOM 0 HD3 LYS A 108 -17.050 -12.738 0.703 1.00 11.44 H new ATOM 0 HE2 LYS A 108 -17.337 -11.793 2.994 1.00 52.02 H new ATOM 0 HE3 LYS A 108 -17.591 -10.203 2.303 1.00 52.02 H new ATOM 0 HZ1 LYS A 108 -19.695 -11.187 2.775 1.00 63.51 H new ATOM 0 HZ2 LYS A 108 -19.523 -11.132 1.087 1.00 63.51 H new ATOM 0 HZ3 LYS A 108 -19.309 -12.599 1.915 1.00 63.51 H new ATOM 1628 N VAL A 109 -16.115 -8.823 -1.191 1.00 61.31 N ATOM 1629 CA VAL A 109 -16.137 -7.395 -0.992 1.00 52.21 C ATOM 1630 C VAL A 109 -17.036 -7.106 0.209 1.00 25.45 C ATOM 1631 O VAL A 109 -18.229 -7.382 0.159 1.00 41.45 O ATOM 1632 CB VAL A 109 -16.701 -6.650 -2.251 1.00 75.34 C ATOM 1633 CG1 VAL A 109 -16.563 -5.144 -2.110 1.00 43.20 C ATOM 1634 CG2 VAL A 109 -16.028 -7.125 -3.533 1.00 31.50 C ATOM 0 H VAL A 109 -17.038 -9.251 -1.267 1.00 61.31 H new ATOM 0 HA VAL A 109 -15.120 -7.040 -0.823 1.00 52.21 H new ATOM 0 HB VAL A 109 -17.762 -6.893 -2.316 1.00 75.34 H new ATOM 0 HG11 VAL A 109 -16.963 -4.657 -2.999 1.00 43.20 H new ATOM 0 HG12 VAL A 109 -17.116 -4.809 -1.233 1.00 43.20 H new ATOM 0 HG13 VAL A 109 -15.511 -4.884 -1.997 1.00 43.20 H new ATOM 0 HG21 VAL A 109 -16.445 -6.586 -4.384 1.00 31.50 H new ATOM 0 HG22 VAL A 109 -14.956 -6.935 -3.473 1.00 31.50 H new ATOM 0 HG23 VAL A 109 -16.201 -8.194 -3.660 1.00 31.50 H new ATOM 1644 N LEU A 110 -16.493 -6.569 1.275 1.00 72.32 N ATOM 1645 CA LEU A 110 -17.315 -6.293 2.431 1.00 1.42 C ATOM 1646 C LEU A 110 -16.929 -4.935 3.005 1.00 32.31 C ATOM 1647 O LEU A 110 -15.764 -4.583 2.979 1.00 13.32 O ATOM 1648 CB LEU A 110 -17.406 -7.529 3.452 1.00 72.23 C ATOM 1649 CG LEU A 110 -16.613 -7.658 4.805 1.00 30.53 C ATOM 1650 CD1 LEU A 110 -15.158 -7.911 4.672 1.00 13.24 C ATOM 1651 CD2 LEU A 110 -16.898 -6.540 5.779 1.00 14.44 C ATOM 0 H LEU A 110 -15.509 -6.319 1.368 1.00 72.32 H new ATOM 0 HA LEU A 110 -18.361 -6.198 2.141 1.00 1.42 H new ATOM 0 HB2 LEU A 110 -18.460 -7.619 3.716 1.00 72.23 H new ATOM 0 HB3 LEU A 110 -17.147 -8.414 2.871 1.00 72.23 H new ATOM 0 HG LEU A 110 -17.019 -8.575 5.233 1.00 30.53 H new ATOM 0 HD11 LEU A 110 -14.709 -7.983 5.663 1.00 13.24 H new ATOM 0 HD12 LEU A 110 -14.999 -8.845 4.133 1.00 13.24 H new ATOM 0 HD13 LEU A 110 -14.695 -7.092 4.122 1.00 13.24 H new ATOM 0 HD21 LEU A 110 -16.318 -6.693 6.689 1.00 14.44 H new ATOM 0 HD22 LEU A 110 -16.622 -5.586 5.329 1.00 14.44 H new ATOM 0 HD23 LEU A 110 -17.960 -6.532 6.023 1.00 14.44 H new ATOM 1663 N PRO A 111 -17.901 -4.135 3.475 1.00 54.34 N ATOM 1664 CA PRO A 111 -17.649 -2.741 3.873 1.00 11.43 C ATOM 1665 C PRO A 111 -16.799 -2.595 5.132 1.00 44.51 C ATOM 1666 O PRO A 111 -16.959 -3.344 6.114 1.00 4.14 O ATOM 1667 CB PRO A 111 -19.052 -2.172 4.102 1.00 43.54 C ATOM 1668 CG PRO A 111 -19.886 -3.353 4.453 1.00 63.10 C ATOM 1669 CD PRO A 111 -19.311 -4.522 3.698 1.00 41.45 C ATOM 0 HA PRO A 111 -17.073 -2.220 3.108 1.00 11.43 H new ATOM 0 HB2 PRO A 111 -19.054 -1.434 4.904 1.00 43.54 H new ATOM 0 HB3 PRO A 111 -19.428 -1.673 3.209 1.00 43.54 H new ATOM 0 HG2 PRO A 111 -19.865 -3.537 5.527 1.00 63.10 H new ATOM 0 HG3 PRO A 111 -20.928 -3.188 4.178 1.00 63.10 H new ATOM 0 HD2 PRO A 111 -19.387 -5.446 4.272 1.00 41.45 H new ATOM 0 HD3 PRO A 111 -19.835 -4.687 2.756 1.00 41.45 H new ATOM 1677 N LYS A 112 -15.907 -1.631 5.112 1.00 63.33 N ATOM 1678 CA LYS A 112 -15.085 -1.364 6.250 1.00 31.32 C ATOM 1679 C LYS A 112 -15.835 -0.453 7.201 1.00 23.13 C ATOM 1680 O LYS A 112 -16.513 0.479 6.780 1.00 55.50 O ATOM 1681 CB LYS A 112 -13.709 -0.738 5.867 1.00 3.34 C ATOM 1682 CG LYS A 112 -12.865 -0.387 7.110 1.00 72.25 C ATOM 1683 CD LYS A 112 -11.482 0.242 6.842 1.00 25.42 C ATOM 1684 CE LYS A 112 -11.545 1.508 6.004 1.00 44.52 C ATOM 1685 NZ LYS A 112 -10.309 2.351 6.116 1.00 63.42 N ATOM 0 H LYS A 112 -15.738 -1.021 4.312 1.00 63.33 H new ATOM 0 HA LYS A 112 -14.866 -2.316 6.734 1.00 31.32 H new ATOM 0 HB2 LYS A 112 -13.156 -1.436 5.239 1.00 3.34 H new ATOM 0 HB3 LYS A 112 -13.873 0.162 5.275 1.00 3.34 H new ATOM 0 HG2 LYS A 112 -13.439 0.301 7.730 1.00 72.25 H new ATOM 0 HG3 LYS A 112 -12.720 -1.296 7.693 1.00 72.25 H new ATOM 0 HD2 LYS A 112 -11.004 0.470 7.795 1.00 25.42 H new ATOM 0 HD3 LYS A 112 -10.851 -0.489 6.336 1.00 25.42 H new ATOM 0 HE2 LYS A 112 -11.700 1.238 4.959 1.00 44.52 H new ATOM 0 HE3 LYS A 112 -12.409 2.098 6.312 1.00 44.52 H new ATOM 0 HZ1 LYS A 112 -10.152 2.858 5.222 1.00 63.42 H new ATOM 0 HZ2 LYS A 112 -10.426 3.038 6.888 1.00 63.42 H new ATOM 0 HZ3 LYS A 112 -9.490 1.742 6.317 1.00 63.42 H new ATOM 2166 N GLY B 21 -8.637 -3.948 8.863 1.00 45.15 N ATOM 2167 CA GLY B 21 -9.972 -4.518 8.815 1.00 24.31 C ATOM 2168 C GLY B 21 -10.164 -5.769 9.638 1.00 54.42 C ATOM 2169 O GLY B 21 -9.943 -5.753 10.857 1.00 20.21 O ATOM 0 HA2 GLY B 21 -10.684 -3.766 9.154 1.00 24.31 H new ATOM 0 HA3 GLY B 21 -10.217 -4.743 7.777 1.00 24.31 H new ATOM 2173 N PRO B 22 -10.633 -6.868 8.995 1.00 54.35 N ATOM 2174 CA PRO B 22 -10.825 -8.161 9.645 1.00 35.12 C ATOM 2175 C PRO B 22 -9.550 -8.746 10.324 1.00 14.44 C ATOM 2176 O PRO B 22 -9.689 -9.433 11.342 1.00 21.55 O ATOM 2177 CB PRO B 22 -11.320 -9.084 8.518 1.00 50.55 C ATOM 2178 CG PRO B 22 -11.864 -8.162 7.487 1.00 35.21 C ATOM 2179 CD PRO B 22 -11.043 -6.920 7.578 1.00 71.25 C ATOM 0 HA PRO B 22 -11.526 -8.061 10.474 1.00 35.12 H new ATOM 0 HB2 PRO B 22 -10.508 -9.691 8.118 1.00 50.55 H new ATOM 0 HB3 PRO B 22 -12.085 -9.772 8.877 1.00 50.55 H new ATOM 0 HG2 PRO B 22 -11.796 -8.604 6.493 1.00 35.21 H new ATOM 0 HG3 PRO B 22 -12.917 -7.949 7.670 1.00 35.21 H new ATOM 0 HD2 PRO B 22 -10.180 -6.962 6.914 1.00 71.25 H new ATOM 0 HD3 PRO B 22 -11.619 -6.039 7.296 1.00 71.25 H new ATOM 2187 N PRO B 23 -8.287 -8.560 9.749 1.00 43.24 N ATOM 2188 CA PRO B 23 -7.059 -9.000 10.412 1.00 52.32 C ATOM 2189 C PRO B 23 -6.992 -8.591 11.862 1.00 11.41 C ATOM 2190 O PRO B 23 -7.082 -7.409 12.209 1.00 51.23 O ATOM 2191 CB PRO B 23 -5.979 -8.299 9.621 1.00 23.04 C ATOM 2192 CG PRO B 23 -6.512 -8.241 8.255 1.00 41.22 C ATOM 2193 CD PRO B 23 -7.971 -7.989 8.407 1.00 75.41 C ATOM 0 HA PRO B 23 -6.975 -10.087 10.428 1.00 52.32 H new ATOM 0 HB2 PRO B 23 -5.782 -7.302 10.014 1.00 23.04 H new ATOM 0 HB3 PRO B 23 -5.038 -8.848 9.658 1.00 23.04 H new ATOM 0 HG2 PRO B 23 -6.034 -7.447 7.681 1.00 41.22 H new ATOM 0 HG3 PRO B 23 -6.328 -9.174 7.722 1.00 41.22 H new ATOM 0 HD2 PRO B 23 -8.201 -6.925 8.360 1.00 75.41 H new ATOM 0 HD3 PRO B 23 -8.546 -8.475 7.619 1.00 75.41 H new ATOM 2201 N GLN B 24 -6.826 -9.571 12.690 1.00 32.13 N ATOM 2202 CA GLN B 24 -6.732 -9.362 14.095 1.00 40.11 C ATOM 2203 C GLN B 24 -5.291 -9.175 14.462 1.00 55.32 C ATOM 2204 O GLN B 24 -4.415 -9.813 13.870 1.00 2.13 O ATOM 2205 CB GLN B 24 -7.349 -10.529 14.877 1.00 11.43 C ATOM 2206 CG GLN B 24 -8.857 -10.654 14.717 1.00 63.14 C ATOM 2207 CD GLN B 24 -9.603 -9.435 15.241 1.00 33.42 C ATOM 2208 OE1 GLN B 24 -9.862 -8.480 14.507 1.00 1.20 O ATOM 2209 NE2 GLN B 24 -9.942 -9.452 16.506 1.00 42.31 N ATOM 0 H GLN B 24 -6.751 -10.548 12.406 1.00 32.13 H new ATOM 0 HA GLN B 24 -7.296 -8.468 14.361 1.00 40.11 H new ATOM 0 HB2 GLN B 24 -6.881 -11.458 14.552 1.00 11.43 H new ATOM 0 HB3 GLN B 24 -7.115 -10.408 15.935 1.00 11.43 H new ATOM 0 HG2 GLN B 24 -9.096 -10.797 13.663 1.00 63.14 H new ATOM 0 HG3 GLN B 24 -9.203 -11.542 15.246 1.00 63.14 H new ATOM 0 HE21 GLN B 24 -9.712 -10.260 17.085 1.00 42.31 H new ATOM 0 HE22 GLN B 24 -10.436 -8.658 16.912 1.00 42.31 H new ATOM 2218 N PRO B 25 -5.015 -8.270 15.395 1.00 52.33 N ATOM 2219 CA PRO B 25 -3.668 -7.983 15.841 1.00 63.41 C ATOM 2220 C PRO B 25 -2.865 -9.232 16.197 1.00 12.44 C ATOM 2221 O PRO B 25 -3.245 -10.020 17.086 1.00 21.13 O ATOM 2222 CB PRO B 25 -3.861 -7.117 17.074 1.00 3.24 C ATOM 2223 CG PRO B 25 -5.179 -6.474 16.886 1.00 0.41 C ATOM 2224 CD PRO B 25 -6.011 -7.421 16.071 1.00 61.14 C ATOM 0 HA PRO B 25 -3.095 -7.503 15.048 1.00 63.41 H new ATOM 0 HB2 PRO B 25 -3.840 -7.716 17.984 1.00 3.24 H new ATOM 0 HB3 PRO B 25 -3.068 -6.374 17.163 1.00 3.24 H new ATOM 0 HG2 PRO B 25 -5.652 -6.273 17.847 1.00 0.41 H new ATOM 0 HG3 PRO B 25 -5.073 -5.516 16.377 1.00 0.41 H new ATOM 0 HD2 PRO B 25 -6.678 -8.010 16.700 1.00 61.14 H new ATOM 0 HD3 PRO B 25 -6.636 -6.889 15.354 1.00 61.14 H new ATOM 2232 N LEU B 26 -1.793 -9.414 15.445 1.00 12.41 N ATOM 2233 CA LEU B 26 -0.765 -10.448 15.676 1.00 64.32 C ATOM 2234 C LEU B 26 -0.166 -10.294 17.036 1.00 42.13 C ATOM 2235 O LEU B 26 -0.569 -9.422 17.825 1.00 33.32 O ATOM 2236 CB LEU B 26 0.409 -10.261 14.710 1.00 70.32 C ATOM 2237 CG LEU B 26 0.247 -10.612 13.243 1.00 63.41 C ATOM 2238 CD1 LEU B 26 -0.845 -9.830 12.600 1.00 3.11 C ATOM 2239 CD2 LEU B 26 1.536 -10.317 12.563 1.00 11.21 C ATOM 0 H LEU B 26 -1.596 -8.835 14.629 1.00 12.41 H new ATOM 0 HA LEU B 26 -1.256 -11.413 15.548 1.00 64.32 H new ATOM 0 HB2 LEU B 26 0.708 -9.214 14.762 1.00 70.32 H new ATOM 0 HB3 LEU B 26 1.242 -10.850 15.094 1.00 70.32 H new ATOM 0 HG LEU B 26 -0.018 -11.666 13.157 1.00 63.41 H new ATOM 0 HD11 LEU B 26 -0.926 -10.113 11.551 1.00 3.11 H new ATOM 0 HD12 LEU B 26 -1.788 -10.038 13.106 1.00 3.11 H new ATOM 0 HD13 LEU B 26 -0.622 -8.766 12.672 1.00 3.11 H new ATOM 0 HD21 LEU B 26 1.452 -10.559 11.504 1.00 11.21 H new ATOM 0 HD22 LEU B 26 1.773 -9.259 12.676 1.00 11.21 H new ATOM 0 HD23 LEU B 26 2.329 -10.916 13.011 1.00 11.21 H new ATOM 2251 N SER B 27 0.809 -11.098 17.328 1.00 62.40 N ATOM 2252 CA SER B 27 1.527 -10.880 18.514 1.00 63.01 C ATOM 2253 C SER B 27 2.275 -9.560 18.354 1.00 54.43 C ATOM 2254 O SER B 27 2.753 -9.227 17.249 1.00 53.13 O ATOM 2255 CB SER B 27 2.532 -11.982 18.688 1.00 62.43 C ATOM 2256 OG SER B 27 1.919 -13.250 18.636 1.00 42.22 O ATOM 0 H SER B 27 1.111 -11.893 16.764 1.00 62.40 H new ATOM 0 HA SER B 27 0.858 -10.855 19.375 1.00 63.01 H new ATOM 0 HB2 SER B 27 3.291 -11.911 17.909 1.00 62.43 H new ATOM 0 HB3 SER B 27 3.044 -11.862 19.643 1.00 62.43 H new ATOM 0 HG SER B 27 2.512 -13.881 18.177 1.00 42.22 H new ATOM 2262 N ALA B 28 2.355 -8.834 19.415 1.00 31.42 N ATOM 2263 CA ALA B 28 3.089 -7.593 19.437 1.00 64.12 C ATOM 2264 C ALA B 28 4.538 -7.815 19.003 1.00 13.15 C ATOM 2265 O ALA B 28 5.072 -7.074 18.199 1.00 65.11 O ATOM 2266 CB ALA B 28 3.018 -6.958 20.802 1.00 63.43 C ATOM 0 H ALA B 28 1.914 -9.076 20.303 1.00 31.42 H new ATOM 0 HA ALA B 28 2.629 -6.907 18.725 1.00 64.12 H new ATOM 0 HB1 ALA B 28 3.578 -6.023 20.798 1.00 63.43 H new ATOM 0 HB2 ALA B 28 1.977 -6.757 21.056 1.00 63.43 H new ATOM 0 HB3 ALA B 28 3.447 -7.635 21.541 1.00 63.43 H new ATOM 2272 N GLU B 29 5.136 -8.865 19.484 1.00 0.13 N ATOM 2273 CA GLU B 29 6.512 -9.170 19.151 1.00 42.15 C ATOM 2274 C GLU B 29 6.692 -9.572 17.690 1.00 22.11 C ATOM 2275 O GLU B 29 7.747 -9.308 17.099 1.00 12.14 O ATOM 2276 CB GLU B 29 7.064 -10.164 20.126 1.00 74.41 C ATOM 2277 CG GLU B 29 7.125 -9.573 21.512 1.00 23.12 C ATOM 2278 CD GLU B 29 8.171 -8.494 21.639 1.00 41.13 C ATOM 2279 OE1 GLU B 29 7.920 -7.349 21.230 1.00 3.11 O ATOM 2280 OE2 GLU B 29 9.271 -8.776 22.166 1.00 72.31 O ATOM 0 H GLU B 29 4.695 -9.535 20.114 1.00 0.13 H new ATOM 0 HA GLU B 29 7.102 -8.259 19.248 1.00 42.15 H new ATOM 0 HB2 GLU B 29 6.441 -11.058 20.134 1.00 74.41 H new ATOM 0 HB3 GLU B 29 8.061 -10.473 19.813 1.00 74.41 H new ATOM 0 HG2 GLU B 29 6.150 -9.160 21.770 1.00 23.12 H new ATOM 0 HG3 GLU B 29 7.336 -10.364 22.231 1.00 23.12 H new ATOM 2287 N GLU B 30 5.667 -10.196 17.102 1.00 31.45 N ATOM 2288 CA GLU B 30 5.680 -10.454 15.666 1.00 14.45 C ATOM 2289 C GLU B 30 5.633 -9.147 14.916 1.00 24.30 C ATOM 2290 O GLU B 30 6.337 -8.965 13.935 1.00 62.30 O ATOM 2291 CB GLU B 30 4.509 -11.349 15.214 1.00 22.13 C ATOM 2292 CG GLU B 30 4.771 -12.852 15.211 1.00 53.41 C ATOM 2293 CD GLU B 30 5.152 -13.429 16.547 1.00 32.14 C ATOM 2294 OE1 GLU B 30 6.345 -13.472 16.867 1.00 32.44 O ATOM 2295 OE2 GLU B 30 4.268 -13.877 17.283 1.00 33.23 O ATOM 0 H GLU B 30 4.834 -10.525 17.590 1.00 31.45 H new ATOM 0 HA GLU B 30 6.603 -10.989 15.443 1.00 14.45 H new ATOM 0 HB2 GLU B 30 3.656 -11.151 15.864 1.00 22.13 H new ATOM 0 HB3 GLU B 30 4.218 -11.050 14.207 1.00 22.13 H new ATOM 0 HG2 GLU B 30 3.877 -13.362 14.853 1.00 53.41 H new ATOM 0 HG3 GLU B 30 5.567 -13.066 14.498 1.00 53.41 H new ATOM 2302 N LYS B 31 4.835 -8.212 15.417 1.00 2.54 N ATOM 2303 CA LYS B 31 4.695 -6.940 14.770 1.00 34.33 C ATOM 2304 C LYS B 31 5.919 -6.090 14.874 1.00 0.30 C ATOM 2305 O LYS B 31 6.401 -5.610 13.864 1.00 22.40 O ATOM 2306 CB LYS B 31 3.454 -6.173 15.185 1.00 4.03 C ATOM 2307 CG LYS B 31 2.196 -6.648 14.499 1.00 15.15 C ATOM 2308 CD LYS B 31 1.030 -5.782 14.887 1.00 53.23 C ATOM 2309 CE LYS B 31 -0.180 -6.048 14.032 1.00 32.33 C ATOM 2310 NZ LYS B 31 0.071 -5.657 12.618 1.00 14.22 N ATOM 0 H LYS B 31 4.282 -8.322 16.267 1.00 2.54 H new ATOM 0 HA LYS B 31 4.564 -7.189 13.717 1.00 34.33 H new ATOM 0 HB2 LYS B 31 3.326 -6.261 16.264 1.00 4.03 H new ATOM 0 HB3 LYS B 31 3.600 -5.115 14.967 1.00 4.03 H new ATOM 0 HG2 LYS B 31 2.332 -6.623 13.418 1.00 15.15 H new ATOM 0 HG3 LYS B 31 1.994 -7.684 14.771 1.00 15.15 H new ATOM 0 HD2 LYS B 31 0.780 -5.958 15.933 1.00 53.23 H new ATOM 0 HD3 LYS B 31 1.313 -4.733 14.799 1.00 53.23 H new ATOM 0 HE2 LYS B 31 -0.439 -7.106 14.080 1.00 32.33 H new ATOM 0 HE3 LYS B 31 -1.034 -5.493 14.421 1.00 32.33 H new ATOM 0 HZ1 LYS B 31 -0.837 -5.508 12.133 1.00 14.22 H new ATOM 0 HZ2 LYS B 31 0.625 -4.777 12.594 1.00 14.22 H new ATOM 0 HZ3 LYS B 31 0.600 -6.413 12.138 1.00 14.22 H new ATOM 2324 N LYS B 32 6.468 -5.924 16.088 1.00 62.44 N ATOM 2325 CA LYS B 32 7.641 -5.084 16.249 1.00 20.51 C ATOM 2326 C LYS B 32 8.789 -5.514 15.368 1.00 60.22 C ATOM 2327 O LYS B 32 9.474 -4.672 14.804 1.00 12.11 O ATOM 2328 CB LYS B 32 8.117 -4.897 17.718 1.00 75.21 C ATOM 2329 CG LYS B 32 7.460 -3.757 18.568 1.00 42.11 C ATOM 2330 CD LYS B 32 6.050 -4.016 19.140 1.00 42.14 C ATOM 2331 CE LYS B 32 4.948 -4.190 18.116 1.00 65.31 C ATOM 2332 NZ LYS B 32 4.846 -3.062 17.139 1.00 41.15 N ATOM 0 H LYS B 32 6.121 -6.353 16.946 1.00 62.44 H new ATOM 0 HA LYS B 32 7.300 -4.103 15.919 1.00 20.51 H new ATOM 0 HB2 LYS B 32 7.956 -5.839 18.243 1.00 75.21 H new ATOM 0 HB3 LYS B 32 9.193 -4.722 17.700 1.00 75.21 H new ATOM 0 HG2 LYS B 32 8.125 -3.533 19.402 1.00 42.11 H new ATOM 0 HG3 LYS B 32 7.412 -2.861 17.949 1.00 42.11 H new ATOM 0 HD2 LYS B 32 6.089 -4.911 19.761 1.00 42.14 H new ATOM 0 HD3 LYS B 32 5.785 -3.185 19.794 1.00 42.14 H new ATOM 0 HE2 LYS B 32 5.117 -5.118 17.569 1.00 65.31 H new ATOM 0 HE3 LYS B 32 3.996 -4.295 18.636 1.00 65.31 H new ATOM 0 HZ1 LYS B 32 3.848 -2.793 17.022 1.00 41.15 H new ATOM 0 HZ2 LYS B 32 5.385 -2.246 17.493 1.00 41.15 H new ATOM 0 HZ3 LYS B 32 5.234 -3.361 16.222 1.00 41.15 H new ATOM 2346 N GLU B 33 8.992 -6.809 15.218 1.00 35.21 N ATOM 2347 CA GLU B 33 10.063 -7.250 14.374 1.00 24.14 C ATOM 2348 C GLU B 33 9.777 -7.023 12.901 1.00 35.54 C ATOM 2349 O GLU B 33 10.651 -6.564 12.170 1.00 74.23 O ATOM 2350 CB GLU B 33 10.521 -8.659 14.648 1.00 11.20 C ATOM 2351 CG GLU B 33 11.036 -8.849 16.052 1.00 64.20 C ATOM 2352 CD GLU B 33 12.005 -9.973 16.143 1.00 12.04 C ATOM 2353 OE1 GLU B 33 11.587 -11.111 16.062 1.00 10.35 O ATOM 2354 OE2 GLU B 33 13.214 -9.731 16.285 1.00 74.04 O ATOM 0 H GLU B 33 8.443 -7.547 15.658 1.00 35.21 H new ATOM 0 HA GLU B 33 10.906 -6.612 14.641 1.00 24.14 H new ATOM 0 HB2 GLU B 33 9.691 -9.345 14.475 1.00 11.20 H new ATOM 0 HB3 GLU B 33 11.306 -8.924 13.940 1.00 11.20 H new ATOM 0 HG2 GLU B 33 11.514 -7.930 16.390 1.00 64.20 H new ATOM 0 HG3 GLU B 33 10.198 -9.038 16.723 1.00 64.20 H new ATOM 2361 N ILE B 34 8.545 -7.295 12.473 1.00 24.23 N ATOM 2362 CA ILE B 34 8.204 -7.131 11.062 1.00 10.11 C ATOM 2363 C ILE B 34 8.195 -5.666 10.662 1.00 73.34 C ATOM 2364 O ILE B 34 8.617 -5.329 9.562 1.00 53.15 O ATOM 2365 CB ILE B 34 6.905 -7.857 10.589 1.00 44.21 C ATOM 2366 CG1 ILE B 34 5.667 -7.344 11.326 1.00 30.32 C ATOM 2367 CG2 ILE B 34 7.056 -9.369 10.749 1.00 20.12 C ATOM 2368 CD1 ILE B 34 4.358 -7.976 10.879 1.00 41.13 C ATOM 0 H ILE B 34 7.783 -7.622 13.067 1.00 24.23 H new ATOM 0 HA ILE B 34 9.006 -7.645 10.532 1.00 10.11 H new ATOM 0 HB ILE B 34 6.761 -7.632 9.532 1.00 44.21 H new ATOM 0 HG12 ILE B 34 5.796 -7.522 12.394 1.00 30.32 H new ATOM 0 HG13 ILE B 34 5.600 -6.265 11.189 1.00 30.32 H new ATOM 0 HG21 ILE B 34 6.143 -9.863 10.416 1.00 20.12 H new ATOM 0 HG22 ILE B 34 7.897 -9.716 10.148 1.00 20.12 H new ATOM 0 HG23 ILE B 34 7.236 -9.608 11.797 1.00 20.12 H new ATOM 0 HD11 ILE B 34 3.535 -7.553 11.455 1.00 41.13 H new ATOM 0 HD12 ILE B 34 4.200 -7.776 9.819 1.00 41.13 H new ATOM 0 HD13 ILE B 34 4.399 -9.053 11.042 1.00 41.13 H new ATOM 2380 N ASP B 35 7.761 -4.782 11.578 1.00 62.11 N ATOM 2381 CA ASP B 35 7.739 -3.340 11.299 1.00 32.44 C ATOM 2382 C ASP B 35 9.138 -2.860 10.992 1.00 72.14 C ATOM 2383 O ASP B 35 9.358 -2.153 10.026 1.00 11.13 O ATOM 2384 CB ASP B 35 7.207 -2.487 12.487 1.00 13.23 C ATOM 2385 CG ASP B 35 5.761 -2.724 12.894 1.00 2.44 C ATOM 2386 OD1 ASP B 35 4.872 -2.673 12.035 1.00 1.24 O ATOM 2387 OD2 ASP B 35 5.507 -2.889 14.100 1.00 52.01 O ATOM 0 H ASP B 35 7.425 -5.039 12.506 1.00 62.11 H new ATOM 0 HA ASP B 35 7.064 -3.209 10.454 1.00 32.44 H new ATOM 0 HB2 ASP B 35 7.841 -2.675 13.353 1.00 13.23 H new ATOM 0 HB3 ASP B 35 7.322 -1.434 12.230 1.00 13.23 H new ATOM 2392 N LYS B 36 10.087 -3.323 11.800 1.00 2.13 N ATOM 2393 CA LYS B 36 11.496 -2.888 11.716 1.00 65.24 C ATOM 2394 C LYS B 36 12.183 -3.407 10.475 1.00 31.40 C ATOM 2395 O LYS B 36 13.224 -2.890 10.070 1.00 44.01 O ATOM 2396 CB LYS B 36 12.279 -3.339 12.941 1.00 60.55 C ATOM 2397 CG LYS B 36 11.801 -2.754 14.242 1.00 3.45 C ATOM 2398 CD LYS B 36 12.606 -3.309 15.394 1.00 4.55 C ATOM 2399 CE LYS B 36 12.127 -2.764 16.712 1.00 53.41 C ATOM 2400 NZ LYS B 36 12.895 -3.311 17.844 1.00 22.32 N ATOM 0 H LYS B 36 9.911 -4.010 12.534 1.00 2.13 H new ATOM 0 HA LYS B 36 11.478 -1.799 11.669 1.00 65.24 H new ATOM 0 HB2 LYS B 36 12.230 -4.426 13.007 1.00 60.55 H new ATOM 0 HB3 LYS B 36 13.327 -3.075 12.803 1.00 60.55 H new ATOM 0 HG2 LYS B 36 11.892 -1.668 14.216 1.00 3.45 H new ATOM 0 HG3 LYS B 36 10.745 -2.982 14.385 1.00 3.45 H new ATOM 0 HD2 LYS B 36 12.533 -4.397 15.400 1.00 4.55 H new ATOM 0 HD3 LYS B 36 13.659 -3.061 15.257 1.00 4.55 H new ATOM 0 HE2 LYS B 36 12.211 -1.677 16.708 1.00 53.41 H new ATOM 0 HE3 LYS B 36 11.071 -3.002 16.841 1.00 53.41 H new ATOM 0 HZ1 LYS B 36 12.534 -2.911 18.734 1.00 22.32 H new ATOM 0 HZ2 LYS B 36 12.795 -4.346 17.864 1.00 22.32 H new ATOM 0 HZ3 LYS B 36 13.899 -3.063 17.735 1.00 22.32 H new ATOM 2414 N ARG B 37 11.620 -4.412 9.872 1.00 71.04 N ATOM 2415 CA ARG B 37 12.220 -4.982 8.711 1.00 23.02 C ATOM 2416 C ARG B 37 11.413 -4.677 7.466 1.00 21.35 C ATOM 2417 O ARG B 37 11.501 -5.366 6.469 1.00 61.21 O ATOM 2418 CB ARG B 37 12.510 -6.476 8.914 1.00 40.34 C ATOM 2419 CG ARG B 37 11.336 -7.345 9.263 1.00 2.21 C ATOM 2420 CD ARG B 37 11.793 -8.742 9.630 1.00 32.44 C ATOM 2421 NE ARG B 37 12.656 -8.708 10.822 1.00 44.44 N ATOM 2422 CZ ARG B 37 13.411 -9.712 11.287 1.00 24.12 C ATOM 2423 NH1 ARG B 37 13.490 -10.855 10.639 1.00 51.42 N ATOM 2424 NH2 ARG B 37 14.111 -9.542 12.397 1.00 2.41 N ATOM 0 H ARG B 37 10.748 -4.851 10.167 1.00 71.04 H new ATOM 0 HA ARG B 37 13.190 -4.510 8.553 1.00 23.02 H new ATOM 0 HB2 ARG B 37 12.961 -6.863 8.000 1.00 40.34 H new ATOM 0 HB3 ARG B 37 13.254 -6.575 9.704 1.00 40.34 H new ATOM 0 HG2 ARG B 37 10.787 -6.906 10.096 1.00 2.21 H new ATOM 0 HG3 ARG B 37 10.649 -7.392 8.418 1.00 2.21 H new ATOM 0 HD2 ARG B 37 10.927 -9.376 9.819 1.00 32.44 H new ATOM 0 HD3 ARG B 37 12.335 -9.184 8.794 1.00 32.44 H new ATOM 0 HE ARG B 37 12.682 -7.833 11.346 1.00 44.44 H new ATOM 0 HH11 ARG B 37 12.972 -10.985 9.770 1.00 51.42 H new ATOM 0 HH12 ARG B 37 14.069 -11.610 11.006 1.00 51.42 H new ATOM 0 HH21 ARG B 37 14.073 -8.651 12.892 1.00 2.41 H new ATOM 0 HH22 ARG B 37 14.688 -10.302 12.757 1.00 2.41 H new ATOM 2438 N SER B 38 10.667 -3.602 7.523 1.00 53.54 N ATOM 2439 CA SER B 38 9.944 -3.124 6.370 1.00 52.52 C ATOM 2440 C SER B 38 10.467 -1.738 5.923 1.00 24.34 C ATOM 2441 O SER B 38 11.269 -1.108 6.625 1.00 52.12 O ATOM 2442 CB SER B 38 8.495 -3.029 6.719 1.00 25.30 C ATOM 2443 OG SER B 38 8.026 -4.248 7.228 1.00 35.21 O ATOM 0 H SER B 38 10.544 -3.037 8.363 1.00 53.54 H new ATOM 0 HA SER B 38 10.089 -3.821 5.544 1.00 52.52 H new ATOM 0 HB2 SER B 38 8.344 -2.240 7.456 1.00 25.30 H new ATOM 0 HB3 SER B 38 7.920 -2.753 5.835 1.00 25.30 H new ATOM 0 HG SER B 38 8.359 -4.371 8.141 1.00 35.21 H new ATOM 2449 N VAL B 39 9.983 -1.260 4.783 1.00 54.13 N ATOM 2450 CA VAL B 39 10.384 0.035 4.220 1.00 74.25 C ATOM 2451 C VAL B 39 9.190 0.748 3.623 1.00 23.45 C ATOM 2452 O VAL B 39 8.167 0.139 3.351 1.00 2.21 O ATOM 2453 CB VAL B 39 11.489 -0.092 3.117 1.00 52.44 C ATOM 2454 CG1 VAL B 39 12.776 -0.646 3.657 1.00 35.32 C ATOM 2455 CG2 VAL B 39 11.005 -0.884 1.915 1.00 1.10 C ATOM 0 H VAL B 39 9.297 -1.758 4.216 1.00 54.13 H new ATOM 0 HA VAL B 39 10.798 0.607 5.051 1.00 74.25 H new ATOM 0 HB VAL B 39 11.698 0.922 2.776 1.00 52.44 H new ATOM 0 HG11 VAL B 39 13.509 -0.714 2.853 1.00 35.32 H new ATOM 0 HG12 VAL B 39 13.156 0.012 4.439 1.00 35.32 H new ATOM 0 HG13 VAL B 39 12.599 -1.638 4.072 1.00 35.32 H new ATOM 0 HG21 VAL B 39 11.803 -0.947 1.175 1.00 1.10 H new ATOM 0 HG22 VAL B 39 10.723 -1.888 2.231 1.00 1.10 H new ATOM 0 HG23 VAL B 39 10.141 -0.386 1.475 1.00 1.10 H new ATOM 2465 N TYR B 40 9.360 2.008 3.404 1.00 61.40 N ATOM 2466 CA TYR B 40 8.395 2.890 2.821 1.00 22.53 C ATOM 2467 C TYR B 40 8.905 3.307 1.473 1.00 22.05 C ATOM 2468 O TYR B 40 10.032 3.782 1.358 1.00 11.44 O ATOM 2469 CB TYR B 40 8.208 4.133 3.708 1.00 23.43 C ATOM 2470 CG TYR B 40 7.518 5.298 3.016 1.00 33.41 C ATOM 2471 CD1 TYR B 40 6.145 5.343 2.859 1.00 4.02 C ATOM 2472 CD2 TYR B 40 8.270 6.357 2.517 1.00 31.14 C ATOM 2473 CE1 TYR B 40 5.538 6.407 2.225 1.00 44.22 C ATOM 2474 CE2 TYR B 40 7.686 7.419 1.888 1.00 2.14 C ATOM 2475 CZ TYR B 40 6.307 7.443 1.741 1.00 3.24 C ATOM 2476 OH TYR B 40 5.697 8.501 1.122 1.00 5.34 O ATOM 0 H TYR B 40 10.231 2.484 3.641 1.00 61.40 H new ATOM 0 HA TYR B 40 7.434 2.384 2.729 1.00 22.53 H new ATOM 0 HB2 TYR B 40 7.628 3.853 4.588 1.00 23.43 H new ATOM 0 HB3 TYR B 40 9.185 4.463 4.062 1.00 23.43 H new ATOM 0 HD1 TYR B 40 5.539 4.533 3.238 1.00 4.02 H new ATOM 0 HD2 TYR B 40 9.344 6.339 2.630 1.00 31.14 H new ATOM 0 HE1 TYR B 40 4.465 6.428 2.108 1.00 44.22 H new ATOM 0 HE2 TYR B 40 8.290 8.230 1.510 1.00 2.14 H new ATOM 0 HH TYR B 40 6.375 9.149 0.838 1.00 5.34 H new ATOM 2486 N VAL B 41 8.111 3.104 0.483 1.00 34.43 N ATOM 2487 CA VAL B 41 8.418 3.463 -0.863 1.00 55.44 C ATOM 2488 C VAL B 41 7.458 4.548 -1.322 1.00 34.40 C ATOM 2489 O VAL B 41 6.250 4.327 -1.384 1.00 5.44 O ATOM 2490 CB VAL B 41 8.256 2.231 -1.772 1.00 50.22 C ATOM 2491 CG1 VAL B 41 8.583 2.554 -3.228 1.00 30.10 C ATOM 2492 CG2 VAL B 41 9.089 1.071 -1.267 1.00 74.22 C ATOM 0 H VAL B 41 7.195 2.668 0.588 1.00 34.43 H new ATOM 0 HA VAL B 41 9.444 3.827 -0.918 1.00 55.44 H new ATOM 0 HB VAL B 41 7.208 1.934 -1.736 1.00 50.22 H new ATOM 0 HG11 VAL B 41 8.457 1.659 -3.837 1.00 30.10 H new ATOM 0 HG12 VAL B 41 7.912 3.335 -3.587 1.00 30.10 H new ATOM 0 HG13 VAL B 41 9.614 2.900 -3.301 1.00 30.10 H new ATOM 0 HG21 VAL B 41 8.957 0.214 -1.927 1.00 74.22 H new ATOM 0 HG22 VAL B 41 10.140 1.358 -1.251 1.00 74.22 H new ATOM 0 HG23 VAL B 41 8.770 0.806 -0.259 1.00 74.22 H new ATOM 2502 N GLY B 42 7.973 5.707 -1.616 1.00 61.01 N ATOM 2503 CA GLY B 42 7.140 6.788 -2.059 1.00 3.31 C ATOM 2504 C GLY B 42 7.333 7.101 -3.530 1.00 22.51 C ATOM 2505 O GLY B 42 8.309 6.665 -4.138 1.00 61.12 O ATOM 0 H GLY B 42 8.967 5.928 -1.557 1.00 61.01 H new ATOM 0 HA2 GLY B 42 6.095 6.536 -1.878 1.00 3.31 H new ATOM 0 HA3 GLY B 42 7.360 7.678 -1.469 1.00 3.31 H new ATOM 2509 N ASN B 43 6.394 7.869 -4.071 1.00 14.15 N ATOM 2510 CA ASN B 43 6.335 8.322 -5.492 1.00 50.33 C ATOM 2511 C ASN B 43 6.316 7.147 -6.511 1.00 61.51 C ATOM 2512 O ASN B 43 6.617 7.329 -7.693 1.00 35.34 O ATOM 2513 CB ASN B 43 7.469 9.332 -5.810 1.00 72.34 C ATOM 2514 CG ASN B 43 7.280 10.056 -7.162 1.00 43.54 C ATOM 2515 OD1 ASN B 43 6.147 10.285 -7.620 1.00 24.33 O ATOM 2516 ND2 ASN B 43 8.364 10.409 -7.800 1.00 32.43 N ATOM 0 H ASN B 43 5.609 8.219 -3.522 1.00 14.15 H new ATOM 0 HA ASN B 43 5.381 8.836 -5.608 1.00 50.33 H new ATOM 0 HB2 ASN B 43 7.520 10.073 -5.013 1.00 72.34 H new ATOM 0 HB3 ASN B 43 8.423 8.806 -5.818 1.00 72.34 H new ATOM 0 HD21 ASN B 43 8.294 10.886 -8.699 1.00 32.43 H new ATOM 0 HD22 ASN B 43 9.280 10.208 -7.399 1.00 32.43 H new ATOM 2523 N VAL B 44 5.936 5.956 -6.049 1.00 1.45 N ATOM 2524 CA VAL B 44 5.758 4.814 -6.954 1.00 71.24 C ATOM 2525 C VAL B 44 4.748 5.165 -8.006 1.00 70.31 C ATOM 2526 O VAL B 44 3.660 5.699 -7.710 1.00 65.21 O ATOM 2527 CB VAL B 44 5.380 3.481 -6.214 1.00 64.15 C ATOM 2528 CG1 VAL B 44 4.114 3.611 -5.398 1.00 20.23 C ATOM 2529 CG2 VAL B 44 5.254 2.336 -7.202 1.00 54.30 C ATOM 0 H VAL B 44 5.747 5.755 -5.067 1.00 1.45 H new ATOM 0 HA VAL B 44 6.721 4.615 -7.423 1.00 71.24 H new ATOM 0 HB VAL B 44 6.192 3.266 -5.519 1.00 64.15 H new ATOM 0 HG11 VAL B 44 3.898 2.662 -4.907 1.00 20.23 H new ATOM 0 HG12 VAL B 44 4.245 4.387 -4.644 1.00 20.23 H new ATOM 0 HG13 VAL B 44 3.285 3.878 -6.053 1.00 20.23 H new ATOM 0 HG21 VAL B 44 4.992 1.422 -6.669 1.00 54.30 H new ATOM 0 HG22 VAL B 44 4.476 2.567 -7.930 1.00 54.30 H new ATOM 0 HG23 VAL B 44 6.204 2.195 -7.718 1.00 54.30 H new ATOM 2539 N ASP B 45 5.138 4.937 -9.237 1.00 52.43 N ATOM 2540 CA ASP B 45 4.325 5.231 -10.352 1.00 52.42 C ATOM 2541 C ASP B 45 3.060 4.420 -10.272 1.00 31.43 C ATOM 2542 O ASP B 45 3.093 3.239 -9.927 1.00 21.34 O ATOM 2543 CB ASP B 45 5.074 4.934 -11.641 1.00 32.12 C ATOM 2544 CG ASP B 45 4.283 5.326 -12.854 1.00 32.51 C ATOM 2545 OD1 ASP B 45 4.372 6.494 -13.276 1.00 5.50 O ATOM 2546 OD2 ASP B 45 3.562 4.497 -13.383 1.00 52.31 O ATOM 0 H ASP B 45 6.045 4.536 -9.477 1.00 52.43 H new ATOM 0 HA ASP B 45 4.068 6.290 -10.347 1.00 52.42 H new ATOM 0 HB2 ASP B 45 6.024 5.468 -11.640 1.00 32.12 H new ATOM 0 HB3 ASP B 45 5.307 3.870 -11.688 1.00 32.12 H new ATOM 2551 N TYR B 46 1.964 5.045 -10.609 1.00 74.23 N ATOM 2552 CA TYR B 46 0.643 4.451 -10.488 1.00 53.32 C ATOM 2553 C TYR B 46 0.442 3.317 -11.533 1.00 64.10 C ATOM 2554 O TYR B 46 -0.623 2.689 -11.609 1.00 63.31 O ATOM 2555 CB TYR B 46 -0.398 5.572 -10.625 1.00 61.30 C ATOM 2556 CG TYR B 46 -1.807 5.224 -10.215 1.00 70.13 C ATOM 2557 CD1 TYR B 46 -2.105 4.937 -8.891 1.00 33.42 C ATOM 2558 CD2 TYR B 46 -2.842 5.223 -11.130 1.00 21.11 C ATOM 2559 CE1 TYR B 46 -3.391 4.651 -8.495 1.00 2.21 C ATOM 2560 CE2 TYR B 46 -4.132 4.935 -10.742 1.00 11.01 C ATOM 2561 CZ TYR B 46 -4.402 4.648 -9.427 1.00 15.24 C ATOM 2562 OH TYR B 46 -5.689 4.364 -9.039 1.00 53.41 O ATOM 0 H TYR B 46 1.954 5.995 -10.981 1.00 74.23 H new ATOM 0 HA TYR B 46 0.525 3.978 -9.513 1.00 53.32 H new ATOM 0 HB2 TYR B 46 -0.067 6.422 -10.028 1.00 61.30 H new ATOM 0 HB3 TYR B 46 -0.414 5.900 -11.664 1.00 61.30 H new ATOM 0 HD1 TYR B 46 -1.313 4.938 -8.157 1.00 33.42 H new ATOM 0 HD2 TYR B 46 -2.637 5.452 -12.165 1.00 21.11 H new ATOM 0 HE1 TYR B 46 -3.605 4.430 -7.460 1.00 2.21 H new ATOM 0 HE2 TYR B 46 -4.929 4.935 -11.471 1.00 11.01 H new ATOM 0 HH TYR B 46 -5.757 4.424 -8.063 1.00 53.41 H new ATOM 2572 N GLY B 47 1.470 3.082 -12.333 1.00 2.30 N ATOM 2573 CA GLY B 47 1.472 2.014 -13.271 1.00 71.23 C ATOM 2574 C GLY B 47 2.402 0.879 -12.849 1.00 61.12 C ATOM 2575 O GLY B 47 2.521 -0.124 -13.573 1.00 24.25 O ATOM 0 H GLY B 47 2.323 3.641 -12.336 1.00 2.30 H new ATOM 0 HA2 GLY B 47 0.459 1.629 -13.383 1.00 71.23 H new ATOM 0 HA3 GLY B 47 1.780 2.390 -14.247 1.00 71.23 H new ATOM 2579 N SER B 48 3.089 1.013 -11.690 1.00 62.52 N ATOM 2580 CA SER B 48 3.913 -0.079 -11.233 1.00 63.10 C ATOM 2581 C SER B 48 2.994 -1.100 -10.553 1.00 33.22 C ATOM 2582 O SER B 48 1.976 -0.724 -9.953 1.00 2.04 O ATOM 2583 CB SER B 48 5.002 0.405 -10.264 1.00 12.10 C ATOM 2584 OG SER B 48 5.902 -0.645 -9.924 1.00 41.25 O ATOM 0 H SER B 48 3.079 1.839 -11.091 1.00 62.52 H new ATOM 0 HA SER B 48 4.429 -0.533 -12.079 1.00 63.10 H new ATOM 0 HB2 SER B 48 5.555 1.227 -10.718 1.00 12.10 H new ATOM 0 HB3 SER B 48 4.538 0.795 -9.358 1.00 12.10 H new ATOM 0 HG SER B 48 6.278 -1.031 -10.742 1.00 41.25 H new ATOM 2590 N THR B 49 3.315 -2.361 -10.668 1.00 44.04 N ATOM 2591 CA THR B 49 2.479 -3.386 -10.115 1.00 64.21 C ATOM 2592 C THR B 49 3.113 -3.951 -8.865 1.00 21.11 C ATOM 2593 O THR B 49 4.267 -3.645 -8.559 1.00 21.15 O ATOM 2594 CB THR B 49 2.287 -4.523 -11.124 1.00 61.35 C ATOM 2595 OG1 THR B 49 3.546 -5.141 -11.382 1.00 73.03 O ATOM 2596 CG2 THR B 49 1.728 -3.996 -12.431 1.00 71.41 C ATOM 0 H THR B 49 4.152 -2.701 -11.141 1.00 44.04 H new ATOM 0 HA THR B 49 1.512 -2.944 -9.876 1.00 64.21 H new ATOM 0 HB THR B 49 1.586 -5.243 -10.702 1.00 61.35 H new ATOM 0 HG1 THR B 49 3.427 -5.870 -12.026 1.00 73.03 H new ATOM 0 HG21 THR B 49 1.600 -4.821 -13.131 1.00 71.41 H new ATOM 0 HG22 THR B 49 0.763 -3.522 -12.249 1.00 71.41 H new ATOM 0 HG23 THR B 49 2.418 -3.265 -12.853 1.00 71.41 H new ATOM 2604 N ALA B 50 2.389 -4.803 -8.154 1.00 1.20 N ATOM 2605 CA ALA B 50 2.896 -5.408 -6.948 1.00 32.44 C ATOM 2606 C ALA B 50 4.104 -6.295 -7.259 1.00 12.31 C ATOM 2607 O ALA B 50 5.134 -6.183 -6.622 1.00 71.21 O ATOM 2608 CB ALA B 50 1.778 -6.216 -6.295 1.00 10.01 C ATOM 0 H ALA B 50 1.441 -5.088 -8.401 1.00 1.20 H new ATOM 0 HA ALA B 50 3.228 -4.632 -6.259 1.00 32.44 H new ATOM 0 HB1 ALA B 50 2.150 -6.679 -5.381 1.00 10.01 H new ATOM 0 HB2 ALA B 50 0.945 -5.556 -6.054 1.00 10.01 H new ATOM 0 HB3 ALA B 50 1.440 -6.991 -6.983 1.00 10.01 H new ATOM 2614 N GLN B 51 3.959 -7.180 -8.237 1.00 1.44 N ATOM 2615 CA GLN B 51 5.059 -8.067 -8.659 1.00 63.11 C ATOM 2616 C GLN B 51 6.267 -7.273 -9.174 1.00 45.11 C ATOM 2617 O GLN B 51 7.412 -7.667 -8.953 1.00 44.55 O ATOM 2618 CB GLN B 51 4.571 -9.041 -9.726 1.00 11.15 C ATOM 2619 CG GLN B 51 3.352 -9.829 -9.290 1.00 11.24 C ATOM 2620 CD GLN B 51 2.830 -10.770 -10.347 1.00 71.43 C ATOM 2621 OE1 GLN B 51 2.055 -10.380 -11.189 1.00 75.21 O ATOM 2622 NE2 GLN B 51 3.147 -12.007 -10.249 1.00 51.41 N ATOM 0 H GLN B 51 3.093 -7.310 -8.760 1.00 1.44 H new ATOM 0 HA GLN B 51 5.385 -8.628 -7.783 1.00 63.11 H new ATOM 0 HB2 GLN B 51 4.334 -8.488 -10.635 1.00 11.15 H new ATOM 0 HB3 GLN B 51 5.375 -9.733 -9.974 1.00 11.15 H new ATOM 0 HG2 GLN B 51 3.601 -10.402 -8.397 1.00 11.24 H new ATOM 0 HG3 GLN B 51 2.560 -9.133 -9.012 1.00 11.24 H new ATOM 0 HE21 GLN B 51 3.804 -12.310 -9.529 1.00 51.41 H new ATOM 0 HE22 GLN B 51 2.743 -12.689 -10.891 1.00 51.41 H new ATOM 2631 N ASP B 52 5.998 -6.165 -9.851 1.00 2.52 N ATOM 2632 CA ASP B 52 7.053 -5.283 -10.382 1.00 53.30 C ATOM 2633 C ASP B 52 7.851 -4.684 -9.225 1.00 15.53 C ATOM 2634 O ASP B 52 9.099 -4.663 -9.244 1.00 24.04 O ATOM 2635 CB ASP B 52 6.415 -4.194 -11.269 1.00 65.21 C ATOM 2636 CG ASP B 52 7.393 -3.275 -11.965 1.00 21.31 C ATOM 2637 OD1 ASP B 52 8.371 -3.770 -12.558 1.00 61.14 O ATOM 2638 OD2 ASP B 52 7.169 -2.044 -11.966 1.00 1.10 O ATOM 0 H ASP B 52 5.051 -5.845 -10.052 1.00 2.52 H new ATOM 0 HA ASP B 52 7.746 -5.853 -11.001 1.00 53.30 H new ATOM 0 HB2 ASP B 52 5.797 -4.679 -12.024 1.00 65.21 H new ATOM 0 HB3 ASP B 52 5.749 -3.590 -10.652 1.00 65.21 H new ATOM 2643 N LEU B 53 7.129 -4.253 -8.208 1.00 21.35 N ATOM 2644 CA LEU B 53 7.710 -3.722 -6.984 1.00 73.04 C ATOM 2645 C LEU B 53 8.440 -4.794 -6.186 1.00 73.14 C ATOM 2646 O LEU B 53 9.589 -4.592 -5.769 1.00 32.33 O ATOM 2647 CB LEU B 53 6.588 -3.119 -6.124 1.00 25.31 C ATOM 2648 CG LEU B 53 6.048 -1.785 -6.582 1.00 43.35 C ATOM 2649 CD1 LEU B 53 4.748 -1.477 -5.857 1.00 62.45 C ATOM 2650 CD2 LEU B 53 7.080 -0.718 -6.259 1.00 2.52 C ATOM 0 H LEU B 53 6.109 -4.261 -8.206 1.00 21.35 H new ATOM 0 HA LEU B 53 8.441 -2.961 -7.257 1.00 73.04 H new ATOM 0 HB2 LEU B 53 5.763 -3.830 -6.088 1.00 25.31 H new ATOM 0 HB3 LEU B 53 6.958 -3.008 -5.105 1.00 25.31 H new ATOM 0 HG LEU B 53 5.852 -1.808 -7.654 1.00 43.35 H new ATOM 0 HD11 LEU B 53 4.364 -0.513 -6.192 1.00 62.45 H new ATOM 0 HD12 LEU B 53 4.016 -2.255 -6.075 1.00 62.45 H new ATOM 0 HD13 LEU B 53 4.930 -1.441 -4.783 1.00 62.45 H new ATOM 0 HD21 LEU B 53 6.710 0.255 -6.582 1.00 2.52 H new ATOM 0 HD22 LEU B 53 7.260 -0.700 -5.184 1.00 2.52 H new ATOM 0 HD23 LEU B 53 8.011 -0.943 -6.779 1.00 2.52 H new ATOM 2662 N GLU B 54 7.788 -5.929 -5.994 1.00 61.22 N ATOM 2663 CA GLU B 54 8.321 -7.037 -5.215 1.00 12.34 C ATOM 2664 C GLU B 54 9.625 -7.549 -5.822 1.00 31.21 C ATOM 2665 O GLU B 54 10.616 -7.639 -5.138 1.00 32.52 O ATOM 2666 CB GLU B 54 7.206 -8.112 -5.165 1.00 43.31 C ATOM 2667 CG GLU B 54 7.330 -9.269 -4.153 1.00 24.50 C ATOM 2668 CD GLU B 54 8.326 -10.337 -4.514 1.00 1.21 C ATOM 2669 OE1 GLU B 54 7.926 -11.286 -5.238 1.00 2.24 O ATOM 2670 OE2 GLU B 54 9.454 -10.287 -4.074 1.00 63.02 O ATOM 0 H GLU B 54 6.861 -6.110 -6.380 1.00 61.22 H new ATOM 0 HA GLU B 54 8.582 -6.735 -4.201 1.00 12.34 H new ATOM 0 HB2 GLU B 54 6.264 -7.601 -4.967 1.00 43.31 H new ATOM 0 HB3 GLU B 54 7.127 -8.551 -6.159 1.00 43.31 H new ATOM 0 HG2 GLU B 54 7.604 -8.853 -3.183 1.00 24.50 H new ATOM 0 HG3 GLU B 54 6.351 -9.733 -4.036 1.00 24.50 H new ATOM 2677 N ALA B 55 9.630 -7.797 -7.122 1.00 30.34 N ATOM 2678 CA ALA B 55 10.848 -8.249 -7.808 1.00 12.05 C ATOM 2679 C ALA B 55 12.003 -7.261 -7.593 1.00 55.31 C ATOM 2680 O ALA B 55 13.152 -7.661 -7.259 1.00 1.24 O ATOM 2681 CB ALA B 55 10.581 -8.436 -9.296 1.00 33.34 C ATOM 0 H ALA B 55 8.815 -7.696 -7.727 1.00 30.34 H new ATOM 0 HA ALA B 55 11.140 -9.208 -7.380 1.00 12.05 H new ATOM 0 HB1 ALA B 55 11.493 -8.771 -9.790 1.00 33.34 H new ATOM 0 HB2 ALA B 55 9.798 -9.182 -9.434 1.00 33.34 H new ATOM 0 HB3 ALA B 55 10.260 -7.489 -9.730 1.00 33.34 H new ATOM 2687 N HIS B 56 11.685 -5.981 -7.702 1.00 43.34 N ATOM 2688 CA HIS B 56 12.700 -4.937 -7.598 1.00 41.13 C ATOM 2689 C HIS B 56 13.296 -4.898 -6.184 1.00 25.44 C ATOM 2690 O HIS B 56 14.498 -4.707 -6.009 1.00 74.22 O ATOM 2691 CB HIS B 56 12.130 -3.562 -8.000 1.00 22.33 C ATOM 2692 CG HIS B 56 13.160 -2.462 -8.075 1.00 35.11 C ATOM 2693 ND1 HIS B 56 13.805 -2.114 -9.240 1.00 33.30 N ATOM 2694 CD2 HIS B 56 13.643 -1.629 -7.126 1.00 31.32 C ATOM 2695 CE1 HIS B 56 14.634 -1.122 -9.007 1.00 34.22 C ATOM 2696 NE2 HIS B 56 14.557 -0.812 -7.732 1.00 70.30 N ATOM 0 H HIS B 56 10.738 -5.638 -7.862 1.00 43.34 H new ATOM 0 HA HIS B 56 13.502 -5.176 -8.296 1.00 41.13 H new ATOM 0 HB2 HIS B 56 11.642 -3.654 -8.970 1.00 22.33 H new ATOM 0 HB3 HIS B 56 11.361 -3.276 -7.282 1.00 22.33 H new ATOM 0 HD2 HIS B 56 13.360 -1.612 -6.084 1.00 31.32 H new ATOM 0 HE1 HIS B 56 15.270 -0.643 -9.737 1.00 34.22 H new ATOM 0 HE2 HIS B 56 15.094 -0.079 -7.268 1.00 70.30 H new ATOM 2705 N PHE B 57 12.458 -5.083 -5.193 1.00 64.45 N ATOM 2706 CA PHE B 57 12.898 -5.086 -3.812 1.00 75.15 C ATOM 2707 C PHE B 57 13.467 -6.414 -3.365 1.00 32.41 C ATOM 2708 O PHE B 57 14.253 -6.477 -2.426 1.00 14.31 O ATOM 2709 CB PHE B 57 11.849 -4.549 -2.864 1.00 43.20 C ATOM 2710 CG PHE B 57 11.783 -3.057 -2.874 1.00 43.11 C ATOM 2711 CD1 PHE B 57 12.634 -2.347 -2.078 1.00 21.12 C ATOM 2712 CD2 PHE B 57 10.891 -2.371 -3.668 1.00 14.13 C ATOM 2713 CE1 PHE B 57 12.612 -0.974 -2.058 1.00 4.20 C ATOM 2714 CE2 PHE B 57 10.865 -0.987 -3.655 1.00 22.11 C ATOM 2715 CZ PHE B 57 11.728 -0.296 -2.846 1.00 30.43 C ATOM 0 H PHE B 57 11.457 -5.235 -5.316 1.00 64.45 H new ATOM 0 HA PHE B 57 13.732 -4.386 -3.771 1.00 75.15 H new ATOM 0 HB2 PHE B 57 10.875 -4.955 -3.137 1.00 43.20 H new ATOM 0 HB3 PHE B 57 12.066 -4.894 -1.853 1.00 43.20 H new ATOM 0 HD1 PHE B 57 13.338 -2.875 -1.452 1.00 21.12 H new ATOM 0 HD2 PHE B 57 10.209 -2.915 -4.304 1.00 14.13 H new ATOM 0 HE1 PHE B 57 13.293 -0.432 -1.419 1.00 4.20 H new ATOM 0 HE2 PHE B 57 10.166 -0.453 -4.281 1.00 22.11 H new ATOM 0 HZ PHE B 57 11.709 0.784 -2.832 1.00 30.43 H new ATOM 2725 N SER B 58 13.088 -7.463 -4.056 1.00 40.02 N ATOM 2726 CA SER B 58 13.512 -8.808 -3.716 1.00 41.53 C ATOM 2727 C SER B 58 14.994 -8.965 -3.997 1.00 72.24 C ATOM 2728 O SER B 58 15.669 -9.800 -3.394 1.00 15.04 O ATOM 2729 CB SER B 58 12.694 -9.878 -4.464 1.00 51.45 C ATOM 2730 OG SER B 58 13.089 -11.194 -4.073 1.00 70.24 O ATOM 0 H SER B 58 12.477 -7.412 -4.871 1.00 40.02 H new ATOM 0 HA SER B 58 13.331 -8.960 -2.652 1.00 41.53 H new ATOM 0 HB2 SER B 58 11.633 -9.738 -4.259 1.00 51.45 H new ATOM 0 HB3 SER B 58 12.830 -9.758 -5.539 1.00 51.45 H new ATOM 0 HG SER B 58 12.554 -11.855 -4.561 1.00 70.24 H new ATOM 2736 N SER B 59 15.516 -8.167 -4.910 1.00 71.25 N ATOM 2737 CA SER B 59 16.943 -8.156 -5.142 1.00 74.31 C ATOM 2738 C SER B 59 17.699 -7.683 -3.867 1.00 72.12 C ATOM 2739 O SER B 59 18.856 -8.035 -3.653 1.00 10.43 O ATOM 2740 CB SER B 59 17.243 -7.234 -6.316 1.00 4.31 C ATOM 2741 OG SER B 59 16.469 -7.619 -7.442 1.00 12.10 O ATOM 0 H SER B 59 14.979 -7.527 -5.495 1.00 71.25 H new ATOM 0 HA SER B 59 17.283 -9.165 -5.376 1.00 74.31 H new ATOM 0 HB2 SER B 59 17.019 -6.202 -6.046 1.00 4.31 H new ATOM 0 HB3 SER B 59 18.304 -7.277 -6.561 1.00 4.31 H new ATOM 0 HG SER B 59 16.665 -7.021 -8.193 1.00 12.10 H new ATOM 2747 N CYS B 60 17.014 -6.910 -3.021 1.00 1.32 N ATOM 2748 CA CYS B 60 17.593 -6.379 -1.793 1.00 11.44 C ATOM 2749 C CYS B 60 17.246 -7.254 -0.559 1.00 12.14 C ATOM 2750 O CYS B 60 17.626 -6.926 0.574 1.00 51.32 O ATOM 2751 CB CYS B 60 17.077 -4.956 -1.580 1.00 25.21 C ATOM 2752 SG CYS B 60 17.365 -3.851 -2.984 1.00 45.02 S ATOM 0 H CYS B 60 16.043 -6.637 -3.171 1.00 1.32 H new ATOM 0 HA CYS B 60 18.678 -6.382 -1.897 1.00 11.44 H new ATOM 0 HB2 CYS B 60 16.007 -4.995 -1.375 1.00 25.21 H new ATOM 0 HB3 CYS B 60 17.556 -4.535 -0.696 1.00 25.21 H new ATOM 0 HG CYS B 60 18.100 -2.849 -2.604 1.00 45.02 H new ATOM 2758 N GLY B 61 16.565 -8.365 -0.779 1.00 65.41 N ATOM 2759 CA GLY B 61 16.195 -9.208 0.348 1.00 21.11 C ATOM 2760 C GLY B 61 14.966 -10.058 0.117 1.00 64.05 C ATOM 2761 O GLY B 61 14.436 -10.123 -0.982 1.00 23.42 O ATOM 0 H GLY B 61 16.264 -8.698 -1.695 1.00 65.41 H new ATOM 0 HA2 GLY B 61 17.034 -9.862 0.588 1.00 21.11 H new ATOM 0 HA3 GLY B 61 16.025 -8.575 1.219 1.00 21.11 H new ATOM 2765 N SER B 62 14.507 -10.699 1.160 1.00 11.30 N ATOM 2766 CA SER B 62 13.365 -11.578 1.076 1.00 2.40 C ATOM 2767 C SER B 62 12.119 -10.847 1.552 1.00 1.32 C ATOM 2768 O SER B 62 12.053 -10.397 2.700 1.00 40.54 O ATOM 2769 CB SER B 62 13.621 -12.800 1.935 1.00 11.40 C ATOM 2770 OG SER B 62 14.845 -13.418 1.556 1.00 51.41 O ATOM 0 H SER B 62 14.913 -10.628 2.093 1.00 11.30 H new ATOM 0 HA SER B 62 13.210 -11.890 0.043 1.00 2.40 H new ATOM 0 HB2 SER B 62 13.660 -12.513 2.986 1.00 11.40 H new ATOM 0 HB3 SER B 62 12.799 -13.508 1.828 1.00 11.40 H new ATOM 0 HG SER B 62 15.002 -14.205 2.118 1.00 51.41 H new ATOM 2776 N ILE B 63 11.155 -10.719 0.682 1.00 33.20 N ATOM 2777 CA ILE B 63 9.946 -9.991 0.990 1.00 50.12 C ATOM 2778 C ILE B 63 8.921 -10.831 1.764 1.00 13.52 C ATOM 2779 O ILE B 63 8.646 -11.985 1.429 1.00 70.35 O ATOM 2780 CB ILE B 63 9.339 -9.358 -0.282 1.00 12.20 C ATOM 2781 CG1 ILE B 63 10.371 -8.387 -0.882 1.00 50.50 C ATOM 2782 CG2 ILE B 63 8.013 -8.663 0.010 1.00 25.23 C ATOM 2783 CD1 ILE B 63 9.907 -7.636 -2.092 1.00 40.24 C ATOM 0 H ILE B 63 11.181 -11.113 -0.258 1.00 33.20 H new ATOM 0 HA ILE B 63 10.229 -9.181 1.662 1.00 50.12 H new ATOM 0 HB ILE B 63 9.114 -10.142 -1.005 1.00 12.20 H new ATOM 0 HG12 ILE B 63 10.659 -7.668 -0.115 1.00 50.50 H new ATOM 0 HG13 ILE B 63 11.267 -8.950 -1.144 1.00 50.50 H new ATOM 0 HG21 ILE B 63 7.619 -8.231 -0.910 1.00 25.23 H new ATOM 0 HG22 ILE B 63 7.301 -9.388 0.405 1.00 25.23 H new ATOM 0 HG23 ILE B 63 8.170 -7.873 0.744 1.00 25.23 H new ATOM 0 HD11 ILE B 63 10.704 -6.979 -2.440 1.00 40.24 H new ATOM 0 HD12 ILE B 63 9.648 -8.342 -2.881 1.00 40.24 H new ATOM 0 HD13 ILE B 63 9.031 -7.040 -1.837 1.00 40.24 H new ATOM 2795 N ASN B 64 8.407 -10.225 2.809 1.00 13.25 N ATOM 2796 CA ASN B 64 7.424 -10.801 3.718 1.00 51.12 C ATOM 2797 C ASN B 64 6.008 -10.399 3.256 1.00 4.33 C ATOM 2798 O ASN B 64 5.130 -11.250 3.061 1.00 14.42 O ATOM 2799 CB ASN B 64 7.702 -10.222 5.131 1.00 73.04 C ATOM 2800 CG ASN B 64 6.807 -10.724 6.252 1.00 62.43 C ATOM 2801 OD1 ASN B 64 5.694 -11.122 6.046 1.00 11.31 O ATOM 2802 ND2 ASN B 64 7.289 -10.632 7.456 1.00 32.40 N ATOM 0 H ASN B 64 8.670 -9.274 3.066 1.00 13.25 H new ATOM 0 HA ASN B 64 7.492 -11.889 3.731 1.00 51.12 H new ATOM 0 HB2 ASN B 64 8.736 -10.443 5.394 1.00 73.04 H new ATOM 0 HB3 ASN B 64 7.611 -9.137 5.080 1.00 73.04 H new ATOM 0 HD21 ASN B 64 6.717 -10.902 8.256 1.00 32.40 H new ATOM 0 HD22 ASN B 64 8.239 -10.290 7.600 1.00 32.40 H new ATOM 2809 N ARG B 65 5.819 -9.103 3.044 1.00 10.24 N ATOM 2810 CA ARG B 65 4.520 -8.532 2.650 1.00 1.01 C ATOM 2811 C ARG B 65 4.795 -7.264 1.882 1.00 21.13 C ATOM 2812 O ARG B 65 5.908 -6.772 1.907 1.00 23.42 O ATOM 2813 CB ARG B 65 3.662 -8.112 3.877 1.00 15.01 C ATOM 2814 CG ARG B 65 3.482 -9.140 4.974 1.00 21.03 C ATOM 2815 CD ARG B 65 2.598 -8.600 6.097 1.00 5.14 C ATOM 2816 NE ARG B 65 1.168 -8.498 5.737 1.00 4.31 N ATOM 2817 CZ ARG B 65 0.389 -7.447 6.024 1.00 21.20 C ATOM 2818 NH1 ARG B 65 0.935 -6.260 6.285 1.00 43.33 N ATOM 2819 NH2 ARG B 65 -0.945 -7.561 5.970 1.00 32.01 N ATOM 0 H ARG B 65 6.560 -8.408 3.139 1.00 10.24 H new ATOM 0 HA ARG B 65 3.984 -9.289 2.078 1.00 1.01 H new ATOM 0 HB2 ARG B 65 4.113 -7.222 4.317 1.00 15.01 H new ATOM 0 HB3 ARG B 65 2.674 -7.824 3.517 1.00 15.01 H new ATOM 0 HG2 ARG B 65 3.036 -10.044 4.559 1.00 21.03 H new ATOM 0 HG3 ARG B 65 4.455 -9.420 5.377 1.00 21.03 H new ATOM 0 HD2 ARG B 65 2.698 -9.248 6.968 1.00 5.14 H new ATOM 0 HD3 ARG B 65 2.960 -7.614 6.389 1.00 5.14 H new ATOM 0 HE ARG B 65 0.746 -9.280 5.237 1.00 4.31 H new ATOM 0 HH11 ARG B 65 1.949 -6.150 6.267 1.00 43.33 H new ATOM 0 HH12 ARG B 65 0.339 -5.461 6.503 1.00 43.33 H new ATOM 0 HH21 ARG B 65 -1.371 -8.451 5.710 1.00 32.01 H new ATOM 0 HH22 ARG B 65 -1.535 -6.758 6.189 1.00 32.01 H new ATOM 2833 N ILE B 66 3.802 -6.737 1.213 1.00 44.02 N ATOM 2834 CA ILE B 66 3.918 -5.430 0.594 1.00 63.31 C ATOM 2835 C ILE B 66 2.562 -4.769 0.639 1.00 75.32 C ATOM 2836 O ILE B 66 1.530 -5.446 0.528 1.00 24.42 O ATOM 2837 CB ILE B 66 4.483 -5.369 -0.898 1.00 44.03 C ATOM 2838 CG1 ILE B 66 3.511 -5.883 -1.942 1.00 20.43 C ATOM 2839 CG2 ILE B 66 5.811 -6.089 -1.049 1.00 1.10 C ATOM 2840 CD1 ILE B 66 4.034 -5.698 -3.363 1.00 11.15 C ATOM 0 H ILE B 66 2.898 -7.190 1.079 1.00 44.02 H new ATOM 0 HA ILE B 66 4.680 -4.912 1.177 1.00 63.31 H new ATOM 0 HB ILE B 66 4.633 -4.305 -1.081 1.00 44.03 H new ATOM 0 HG12 ILE B 66 3.316 -6.941 -1.764 1.00 20.43 H new ATOM 0 HG13 ILE B 66 2.560 -5.362 -1.837 1.00 20.43 H new ATOM 0 HG21 ILE B 66 6.149 -6.016 -2.083 1.00 1.10 H new ATOM 0 HG22 ILE B 66 6.550 -5.630 -0.392 1.00 1.10 H new ATOM 0 HG23 ILE B 66 5.689 -7.138 -0.780 1.00 1.10 H new ATOM 0 HD11 ILE B 66 3.302 -6.082 -4.073 1.00 11.15 H new ATOM 0 HD12 ILE B 66 4.203 -4.638 -3.553 1.00 11.15 H new ATOM 0 HD13 ILE B 66 4.972 -6.242 -3.479 1.00 11.15 H new ATOM 2852 N THR B 67 2.551 -3.494 0.825 1.00 12.13 N ATOM 2853 CA THR B 67 1.340 -2.744 0.850 1.00 53.22 C ATOM 2854 C THR B 67 1.484 -1.718 -0.238 1.00 15.25 C ATOM 2855 O THR B 67 2.553 -1.175 -0.404 1.00 43.13 O ATOM 2856 CB THR B 67 1.131 -1.980 2.212 1.00 3.21 C ATOM 2857 OG1 THR B 67 2.091 -0.939 2.350 1.00 3.53 O ATOM 2858 CG2 THR B 67 1.276 -2.898 3.410 1.00 55.10 C ATOM 0 H THR B 67 3.392 -2.935 0.966 1.00 12.13 H new ATOM 0 HA THR B 67 0.490 -3.414 0.722 1.00 53.22 H new ATOM 0 HB THR B 67 0.118 -1.578 2.187 1.00 3.21 H new ATOM 0 HG1 THR B 67 1.928 -0.452 3.185 1.00 3.53 H new ATOM 0 HG21 THR B 67 1.124 -2.327 4.326 1.00 55.10 H new ATOM 0 HG22 THR B 67 0.534 -3.694 3.351 1.00 55.10 H new ATOM 0 HG23 THR B 67 2.275 -3.334 3.416 1.00 55.10 H new ATOM 2866 N ILE B 68 0.483 -1.492 -1.010 1.00 72.43 N ATOM 2867 CA ILE B 68 0.545 -0.428 -1.967 1.00 74.40 C ATOM 2868 C ILE B 68 -0.703 0.369 -1.762 1.00 33.44 C ATOM 2869 O ILE B 68 -1.786 -0.136 -1.975 1.00 32.23 O ATOM 2870 CB ILE B 68 0.579 -0.879 -3.478 1.00 55.41 C ATOM 2871 CG1 ILE B 68 1.545 -2.038 -3.778 1.00 60.22 C ATOM 2872 CG2 ILE B 68 0.951 0.298 -4.372 1.00 63.52 C ATOM 2873 CD1 ILE B 68 1.023 -3.400 -3.393 1.00 21.32 C ATOM 0 H ILE B 68 -0.388 -2.022 -1.005 1.00 72.43 H new ATOM 0 HA ILE B 68 1.477 0.111 -1.801 1.00 74.40 H new ATOM 0 HB ILE B 68 -0.428 -1.240 -3.687 1.00 55.41 H new ATOM 0 HG12 ILE B 68 1.773 -2.038 -4.844 1.00 60.22 H new ATOM 0 HG13 ILE B 68 2.482 -1.859 -3.251 1.00 60.22 H new ATOM 0 HG21 ILE B 68 0.971 -0.027 -5.412 1.00 63.52 H new ATOM 0 HG22 ILE B 68 0.213 1.092 -4.254 1.00 63.52 H new ATOM 0 HG23 ILE B 68 1.935 0.672 -4.090 1.00 63.52 H new ATOM 0 HD11 ILE B 68 1.767 -4.158 -3.639 1.00 21.32 H new ATOM 0 HD12 ILE B 68 0.822 -3.423 -2.322 1.00 21.32 H new ATOM 0 HD13 ILE B 68 0.102 -3.605 -3.939 1.00 21.32 H new ATOM 2885 N LEU B 69 -0.580 1.561 -1.309 1.00 34.11 N ATOM 2886 CA LEU B 69 -1.747 2.367 -1.083 1.00 63.01 C ATOM 2887 C LEU B 69 -1.708 3.629 -1.892 1.00 40.30 C ATOM 2888 O LEU B 69 -0.755 4.405 -1.819 1.00 41.35 O ATOM 2889 CB LEU B 69 -2.135 2.591 0.409 1.00 12.04 C ATOM 2890 CG LEU B 69 -1.139 3.268 1.358 1.00 4.00 C ATOM 2891 CD1 LEU B 69 -1.839 3.583 2.676 1.00 50.45 C ATOM 2892 CD2 LEU B 69 0.070 2.371 1.630 1.00 72.31 C ATOM 0 H LEU B 69 0.308 2.010 -1.084 1.00 34.11 H new ATOM 0 HA LEU B 69 -2.580 1.768 -1.452 1.00 63.01 H new ATOM 0 HB2 LEU B 69 -3.051 3.182 0.422 1.00 12.04 H new ATOM 0 HB3 LEU B 69 -2.378 1.616 0.832 1.00 12.04 H new ATOM 0 HG LEU B 69 -0.784 4.184 0.886 1.00 4.00 H new ATOM 0 HD11 LEU B 69 -1.136 4.065 3.355 1.00 50.45 H new ATOM 0 HD12 LEU B 69 -2.680 4.251 2.491 1.00 50.45 H new ATOM 0 HD13 LEU B 69 -2.202 2.659 3.125 1.00 50.45 H new ATOM 0 HD21 LEU B 69 0.756 2.881 2.306 1.00 72.31 H new ATOM 0 HD22 LEU B 69 -0.264 1.439 2.086 1.00 72.31 H new ATOM 0 HD23 LEU B 69 0.580 2.153 0.692 1.00 72.31 H new ATOM 2904 N CYS B 70 -2.706 3.815 -2.680 1.00 5.35 N ATOM 2905 CA CYS B 70 -2.787 4.940 -3.550 1.00 21.24 C ATOM 2906 C CYS B 70 -3.985 5.779 -3.183 1.00 62.50 C ATOM 2907 O CYS B 70 -5.061 5.239 -2.943 1.00 45.43 O ATOM 2908 CB CYS B 70 -2.906 4.461 -4.986 1.00 70.31 C ATOM 2909 SG CYS B 70 -1.541 3.406 -5.523 1.00 75.01 S ATOM 0 H CYS B 70 -3.503 3.182 -2.742 1.00 5.35 H new ATOM 0 HA CYS B 70 -1.886 5.546 -3.449 1.00 21.24 H new ATOM 0 HB2 CYS B 70 -3.842 3.913 -5.099 1.00 70.31 H new ATOM 0 HB3 CYS B 70 -2.962 5.328 -5.644 1.00 70.31 H new ATOM 0 HG CYS B 70 -1.389 3.514 -6.810 1.00 75.01 H new ATOM 2915 N ASP B 71 -3.825 7.072 -3.115 1.00 42.41 N ATOM 2916 CA ASP B 71 -4.958 7.924 -2.830 1.00 25.30 C ATOM 2917 C ASP B 71 -5.244 8.796 -4.004 1.00 53.20 C ATOM 2918 O ASP B 71 -4.332 9.267 -4.671 1.00 74.44 O ATOM 2919 CB ASP B 71 -4.785 8.767 -1.569 1.00 34.02 C ATOM 2920 CG ASP B 71 -3.744 9.842 -1.680 1.00 64.43 C ATOM 2921 OD1 ASP B 71 -4.063 10.951 -2.163 1.00 21.34 O ATOM 2922 OD2 ASP B 71 -2.607 9.618 -1.253 1.00 34.22 O ATOM 0 H ASP B 71 -2.938 7.558 -3.250 1.00 42.41 H new ATOM 0 HA ASP B 71 -5.805 7.265 -2.639 1.00 25.30 H new ATOM 0 HB2 ASP B 71 -5.741 9.228 -1.321 1.00 34.02 H new ATOM 0 HB3 ASP B 71 -4.524 8.109 -0.740 1.00 34.02 H new ATOM 2927 N LYS B 72 -6.495 8.985 -4.283 1.00 5.51 N ATOM 2928 CA LYS B 72 -6.911 9.777 -5.404 1.00 0.45 C ATOM 2929 C LYS B 72 -7.589 11.040 -4.932 1.00 63.42 C ATOM 2930 O LYS B 72 -8.115 11.807 -5.739 1.00 34.13 O ATOM 2931 CB LYS B 72 -7.841 8.952 -6.310 1.00 10.45 C ATOM 2932 CG LYS B 72 -7.192 7.660 -6.774 1.00 51.21 C ATOM 2933 CD LYS B 72 -8.060 6.780 -7.687 1.00 70.44 C ATOM 2934 CE LYS B 72 -8.295 7.350 -9.105 1.00 53.01 C ATOM 2935 NZ LYS B 72 -9.241 8.487 -9.164 1.00 73.35 N ATOM 0 H LYS B 72 -7.263 8.593 -3.738 1.00 5.51 H new ATOM 0 HA LYS B 72 -6.034 10.066 -5.984 1.00 0.45 H new ATOM 0 HB2 LYS B 72 -8.760 8.722 -5.771 1.00 10.45 H new ATOM 0 HB3 LYS B 72 -8.122 9.548 -7.178 1.00 10.45 H new ATOM 0 HG2 LYS B 72 -6.271 7.905 -7.302 1.00 51.21 H new ATOM 0 HG3 LYS B 72 -6.911 7.078 -5.896 1.00 51.21 H new ATOM 0 HD2 LYS B 72 -7.590 5.801 -7.778 1.00 70.44 H new ATOM 0 HD3 LYS B 72 -9.027 6.626 -7.208 1.00 70.44 H new ATOM 0 HE2 LYS B 72 -7.338 7.669 -9.517 1.00 53.01 H new ATOM 0 HE3 LYS B 72 -8.667 6.551 -9.746 1.00 53.01 H new ATOM 0 HZ1 LYS B 72 -9.835 8.401 -10.013 1.00 73.35 H new ATOM 0 HZ2 LYS B 72 -9.845 8.481 -8.317 1.00 73.35 H new ATOM 0 HZ3 LYS B 72 -8.709 9.380 -9.203 1.00 73.35 H new ATOM 2949 N PHE B 73 -7.547 11.285 -3.616 1.00 0.14 N ATOM 2950 CA PHE B 73 -8.163 12.489 -3.052 1.00 2.22 C ATOM 2951 C PHE B 73 -7.338 13.718 -3.388 1.00 44.02 C ATOM 2952 O PHE B 73 -7.773 14.845 -3.216 1.00 2.13 O ATOM 2953 CB PHE B 73 -8.414 12.380 -1.522 1.00 41.12 C ATOM 2954 CG PHE B 73 -7.201 12.249 -0.612 1.00 73.43 C ATOM 2955 CD1 PHE B 73 -6.362 13.332 -0.369 1.00 50.54 C ATOM 2956 CD2 PHE B 73 -6.925 11.052 0.017 1.00 33.12 C ATOM 2957 CE1 PHE B 73 -5.275 13.215 0.474 1.00 50.02 C ATOM 2958 CE2 PHE B 73 -5.839 10.933 0.871 1.00 11.31 C ATOM 2959 CZ PHE B 73 -5.015 12.015 1.094 1.00 10.04 C ATOM 0 H PHE B 73 -7.100 10.675 -2.932 1.00 0.14 H new ATOM 0 HA PHE B 73 -9.145 12.589 -3.515 1.00 2.22 H new ATOM 0 HB2 PHE B 73 -8.973 13.262 -1.210 1.00 41.12 H new ATOM 0 HB3 PHE B 73 -9.058 11.518 -1.349 1.00 41.12 H new ATOM 0 HD1 PHE B 73 -6.564 14.279 -0.847 1.00 50.54 H new ATOM 0 HD2 PHE B 73 -7.562 10.198 -0.158 1.00 33.12 H new ATOM 0 HE1 PHE B 73 -4.630 14.064 0.646 1.00 50.02 H new ATOM 0 HE2 PHE B 73 -5.639 9.992 1.362 1.00 11.31 H new ATOM 0 HZ PHE B 73 -4.166 11.921 1.755 1.00 10.04 H new ATOM 2969 N SER B 74 -6.158 13.473 -3.891 1.00 2.43 N ATOM 2970 CA SER B 74 -5.243 14.516 -4.277 1.00 25.30 C ATOM 2971 C SER B 74 -5.505 14.937 -5.739 1.00 13.40 C ATOM 2972 O SER B 74 -4.723 15.677 -6.339 1.00 5.13 O ATOM 2973 CB SER B 74 -3.821 13.986 -4.134 1.00 61.25 C ATOM 2974 OG SER B 74 -3.600 13.485 -2.815 1.00 33.52 O ATOM 0 H SER B 74 -5.799 12.531 -4.047 1.00 2.43 H new ATOM 0 HA SER B 74 -5.383 15.388 -3.638 1.00 25.30 H new ATOM 0 HB2 SER B 74 -3.647 13.194 -4.863 1.00 61.25 H new ATOM 0 HB3 SER B 74 -3.108 14.781 -4.351 1.00 61.25 H new ATOM 0 HG SER B 74 -4.073 12.634 -2.705 1.00 33.52 H new ATOM 2980 N GLY B 75 -6.609 14.437 -6.303 1.00 60.03 N ATOM 2981 CA GLY B 75 -6.948 14.693 -7.703 1.00 72.44 C ATOM 2982 C GLY B 75 -6.184 13.742 -8.591 1.00 52.52 C ATOM 2983 O GLY B 75 -6.748 13.047 -9.432 1.00 34.44 O ATOM 0 H GLY B 75 -7.283 13.852 -5.809 1.00 60.03 H new ATOM 0 HA2 GLY B 75 -8.020 14.568 -7.857 1.00 72.44 H new ATOM 0 HA3 GLY B 75 -6.706 15.723 -7.964 1.00 72.44 H new ATOM 2987 N HIS B 76 -4.904 13.709 -8.357 1.00 50.40 N ATOM 2988 CA HIS B 76 -4.009 12.791 -8.999 1.00 13.53 C ATOM 2989 C HIS B 76 -3.847 11.643 -8.045 1.00 72.11 C ATOM 2990 O HIS B 76 -3.880 11.855 -6.825 1.00 71.42 O ATOM 2991 CB HIS B 76 -2.626 13.405 -9.275 1.00 22.12 C ATOM 2992 CG HIS B 76 -2.612 14.590 -10.182 1.00 33.10 C ATOM 2993 ND1 HIS B 76 -2.604 14.492 -11.550 1.00 53.32 N ATOM 2994 CD2 HIS B 76 -2.566 15.906 -9.905 1.00 45.22 C ATOM 2995 CE1 HIS B 76 -2.553 15.693 -12.076 1.00 2.23 C ATOM 2996 NE2 HIS B 76 -2.530 16.566 -11.102 1.00 72.32 N ATOM 0 H HIS B 76 -4.442 14.336 -7.698 1.00 50.40 H new ATOM 0 HA HIS B 76 -4.418 12.497 -9.965 1.00 13.53 H new ATOM 0 HB2 HIS B 76 -2.181 13.694 -8.323 1.00 22.12 H new ATOM 0 HB3 HIS B 76 -1.986 12.634 -9.705 1.00 22.12 H new ATOM 0 HD2 HIS B 76 -2.559 16.356 -8.923 1.00 45.22 H new ATOM 0 HE1 HIS B 76 -2.533 15.921 -13.131 1.00 2.23 H new ATOM 0 HE2 HIS B 76 -2.491 17.579 -11.217 1.00 72.32 H new ATOM 3005 N PRO B 77 -3.699 10.430 -8.531 1.00 52.14 N ATOM 3006 CA PRO B 77 -3.492 9.308 -7.657 1.00 1.44 C ATOM 3007 C PRO B 77 -2.051 9.275 -7.157 1.00 10.43 C ATOM 3008 O PRO B 77 -1.101 9.170 -7.958 1.00 65.42 O ATOM 3009 CB PRO B 77 -3.775 8.107 -8.560 1.00 63.52 C ATOM 3010 CG PRO B 77 -3.473 8.578 -9.944 1.00 21.21 C ATOM 3011 CD PRO B 77 -3.723 10.054 -9.957 1.00 63.21 C ATOM 0 HA PRO B 77 -4.121 9.335 -6.767 1.00 1.44 H new ATOM 0 HB2 PRO B 77 -3.151 7.255 -8.289 1.00 63.52 H new ATOM 0 HB3 PRO B 77 -4.812 7.784 -8.472 1.00 63.52 H new ATOM 0 HG2 PRO B 77 -2.440 8.358 -10.212 1.00 21.21 H new ATOM 0 HG3 PRO B 77 -4.106 8.071 -10.673 1.00 21.21 H new ATOM 0 HD2 PRO B 77 -2.957 10.584 -10.523 1.00 63.21 H new ATOM 0 HD3 PRO B 77 -4.682 10.293 -10.417 1.00 63.21 H new ATOM 3019 N LYS B 78 -1.864 9.388 -5.863 1.00 23.13 N ATOM 3020 CA LYS B 78 -0.541 9.316 -5.315 1.00 1.02 C ATOM 3021 C LYS B 78 -0.283 7.909 -4.913 1.00 50.44 C ATOM 3022 O LYS B 78 -1.154 7.267 -4.342 1.00 4.43 O ATOM 3023 CB LYS B 78 -0.354 10.217 -4.081 1.00 34.10 C ATOM 3024 CG LYS B 78 -0.795 11.661 -4.255 1.00 25.42 C ATOM 3025 CD LYS B 78 -0.155 12.589 -3.206 1.00 3.12 C ATOM 3026 CE LYS B 78 -0.361 12.162 -1.739 1.00 20.11 C ATOM 3027 NZ LYS B 78 -1.768 12.180 -1.307 1.00 24.53 N ATOM 0 H LYS B 78 -2.608 9.529 -5.179 1.00 23.13 H new ATOM 0 HA LYS B 78 0.155 9.661 -6.080 1.00 1.02 H new ATOM 0 HB2 LYS B 78 -0.908 9.784 -3.248 1.00 34.10 H new ATOM 0 HB3 LYS B 78 0.700 10.208 -3.802 1.00 34.10 H new ATOM 0 HG2 LYS B 78 -0.527 12.004 -5.254 1.00 25.42 H new ATOM 0 HG3 LYS B 78 -1.881 11.721 -4.178 1.00 25.42 H new ATOM 0 HD2 LYS B 78 0.915 12.650 -3.403 1.00 3.12 H new ATOM 0 HD3 LYS B 78 -0.561 13.592 -3.336 1.00 3.12 H new ATOM 0 HE2 LYS B 78 0.038 11.157 -1.603 1.00 20.11 H new ATOM 0 HE3 LYS B 78 0.216 12.824 -1.093 1.00 20.11 H new ATOM 0 HZ1 LYS B 78 -1.899 12.913 -0.581 1.00 24.53 H new ATOM 0 HZ2 LYS B 78 -2.379 12.387 -2.123 1.00 24.53 H new ATOM 0 HZ3 LYS B 78 -2.022 11.252 -0.911 1.00 24.53 H new ATOM 3041 N GLY B 79 0.880 7.429 -5.199 1.00 55.54 N ATOM 3042 CA GLY B 79 1.194 6.093 -4.864 1.00 14.40 C ATOM 3043 C GLY B 79 2.303 6.018 -3.867 1.00 45.15 C ATOM 3044 O GLY B 79 3.317 6.712 -3.997 1.00 62.00 O ATOM 0 H GLY B 79 1.625 7.947 -5.664 1.00 55.54 H new ATOM 0 HA2 GLY B 79 0.309 5.602 -4.461 1.00 14.40 H new ATOM 0 HA3 GLY B 79 1.478 5.549 -5.765 1.00 14.40 H new ATOM 3048 N TYR B 80 2.100 5.214 -2.873 1.00 62.10 N ATOM 3049 CA TYR B 80 3.078 4.923 -1.861 1.00 24.53 C ATOM 3050 C TYR B 80 2.897 3.505 -1.382 1.00 5.52 C ATOM 3051 O TYR B 80 1.776 3.007 -1.303 1.00 21.01 O ATOM 3052 CB TYR B 80 3.121 5.989 -0.726 1.00 50.40 C ATOM 3053 CG TYR B 80 1.773 6.505 -0.240 1.00 30.31 C ATOM 3054 CD1 TYR B 80 1.165 7.573 -0.889 1.00 74.21 C ATOM 3055 CD2 TYR B 80 1.124 5.953 0.854 1.00 75.13 C ATOM 3056 CE1 TYR B 80 -0.044 8.072 -0.474 1.00 41.51 C ATOM 3057 CE2 TYR B 80 -0.102 6.456 1.280 1.00 63.44 C ATOM 3058 CZ TYR B 80 -0.679 7.514 0.606 1.00 14.44 C ATOM 3059 OH TYR B 80 -1.895 8.032 1.023 1.00 34.33 O ATOM 0 H TYR B 80 1.218 4.721 -2.734 1.00 62.10 H new ATOM 0 HA TYR B 80 4.073 4.992 -2.301 1.00 24.53 H new ATOM 0 HB2 TYR B 80 3.652 5.563 0.125 1.00 50.40 H new ATOM 0 HB3 TYR B 80 3.708 6.839 -1.075 1.00 50.40 H new ATOM 0 HD1 TYR B 80 1.656 8.021 -1.740 1.00 74.21 H new ATOM 0 HD2 TYR B 80 1.574 5.125 1.381 1.00 75.13 H new ATOM 0 HE1 TYR B 80 -0.495 8.903 -0.997 1.00 41.51 H new ATOM 0 HE2 TYR B 80 -0.600 6.021 2.134 1.00 63.44 H new ATOM 0 HH TYR B 80 -2.271 8.596 0.315 1.00 34.33 H new ATOM 3069 N ALA B 81 3.979 2.847 -1.108 1.00 33.34 N ATOM 3070 CA ALA B 81 3.944 1.444 -0.806 1.00 44.54 C ATOM 3071 C ALA B 81 4.909 1.086 0.295 1.00 64.31 C ATOM 3072 O ALA B 81 5.870 1.778 0.519 1.00 43.42 O ATOM 3073 CB ALA B 81 4.300 0.664 -2.069 1.00 74.23 C ATOM 0 H ALA B 81 4.911 3.262 -1.086 1.00 33.34 H new ATOM 0 HA ALA B 81 2.941 1.188 -0.463 1.00 44.54 H new ATOM 0 HB1 ALA B 81 4.278 -0.405 -1.855 1.00 74.23 H new ATOM 0 HB2 ALA B 81 3.578 0.892 -2.853 1.00 74.23 H new ATOM 0 HB3 ALA B 81 5.299 0.947 -2.402 1.00 74.23 H new ATOM 3079 N TYR B 82 4.624 0.031 0.988 1.00 63.51 N ATOM 3080 CA TYR B 82 5.517 -0.517 1.979 1.00 54.13 C ATOM 3081 C TYR B 82 5.937 -1.870 1.598 1.00 21.04 C ATOM 3082 O TYR B 82 5.113 -2.725 1.335 1.00 40.24 O ATOM 3083 CB TYR B 82 4.894 -0.563 3.361 1.00 72.20 C ATOM 3084 CG TYR B 82 4.953 0.719 4.088 1.00 43.41 C ATOM 3085 CD1 TYR B 82 4.210 1.808 3.694 1.00 43.23 C ATOM 3086 CD2 TYR B 82 5.764 0.838 5.191 1.00 20.03 C ATOM 3087 CE1 TYR B 82 4.287 2.986 4.386 1.00 4.30 C ATOM 3088 CE2 TYR B 82 5.846 1.998 5.884 1.00 1.25 C ATOM 3089 CZ TYR B 82 5.118 3.069 5.488 1.00 13.42 C ATOM 3090 OH TYR B 82 5.218 4.223 6.184 1.00 53.30 O ATOM 0 H TYR B 82 3.752 -0.488 0.886 1.00 63.51 H new ATOM 0 HA TYR B 82 6.380 0.148 2.020 1.00 54.13 H new ATOM 0 HB2 TYR B 82 3.852 -0.869 3.269 1.00 72.20 H new ATOM 0 HB3 TYR B 82 5.400 -1.327 3.951 1.00 72.20 H new ATOM 0 HD1 TYR B 82 3.562 1.733 2.833 1.00 43.23 H new ATOM 0 HD2 TYR B 82 6.348 -0.012 5.512 1.00 20.03 H new ATOM 0 HE1 TYR B 82 3.705 3.841 4.075 1.00 4.30 H new ATOM 0 HE2 TYR B 82 6.489 2.069 6.749 1.00 1.25 H new ATOM 0 HH TYR B 82 5.845 4.103 6.927 1.00 53.30 H new ATOM 3100 N ILE B 83 7.200 -2.073 1.533 1.00 54.40 N ATOM 3101 CA ILE B 83 7.705 -3.362 1.257 1.00 74.04 C ATOM 3102 C ILE B 83 8.184 -3.931 2.575 1.00 4.33 C ATOM 3103 O ILE B 83 9.155 -3.437 3.152 1.00 5.22 O ATOM 3104 CB ILE B 83 8.888 -3.303 0.260 1.00 41.51 C ATOM 3105 CG1 ILE B 83 8.521 -2.470 -0.992 1.00 42.03 C ATOM 3106 CG2 ILE B 83 9.294 -4.704 -0.145 1.00 14.10 C ATOM 3107 CD1 ILE B 83 7.360 -3.000 -1.811 1.00 15.32 C ATOM 0 H ILE B 83 7.909 -1.353 1.669 1.00 54.40 H new ATOM 0 HA ILE B 83 6.929 -3.979 0.804 1.00 74.04 H new ATOM 0 HB ILE B 83 9.728 -2.816 0.755 1.00 41.51 H new ATOM 0 HG12 ILE B 83 8.285 -1.454 -0.675 1.00 42.03 H new ATOM 0 HG13 ILE B 83 9.399 -2.408 -1.636 1.00 42.03 H new ATOM 0 HG21 ILE B 83 10.127 -4.653 -0.846 1.00 14.10 H new ATOM 0 HG22 ILE B 83 9.598 -5.265 0.739 1.00 14.10 H new ATOM 0 HG23 ILE B 83 8.450 -5.205 -0.620 1.00 14.10 H new ATOM 0 HD11 ILE B 83 7.187 -2.343 -2.664 1.00 15.32 H new ATOM 0 HD12 ILE B 83 7.594 -4.003 -2.167 1.00 15.32 H new ATOM 0 HD13 ILE B 83 6.464 -3.035 -1.192 1.00 15.32 H new ATOM 3119 N GLU B 84 7.491 -4.907 3.068 1.00 10.55 N ATOM 3120 CA GLU B 84 7.823 -5.496 4.326 1.00 51.21 C ATOM 3121 C GLU B 84 8.682 -6.716 4.071 1.00 54.43 C ATOM 3122 O GLU B 84 8.273 -7.626 3.364 1.00 53.24 O ATOM 3123 CB GLU B 84 6.537 -5.851 5.118 1.00 4.10 C ATOM 3124 CG GLU B 84 5.571 -4.654 5.266 1.00 35.25 C ATOM 3125 CD GLU B 84 4.428 -4.877 6.243 1.00 42.20 C ATOM 3126 OE1 GLU B 84 3.475 -5.610 5.919 1.00 34.43 O ATOM 3127 OE2 GLU B 84 4.467 -4.287 7.348 1.00 44.35 O ATOM 0 H GLU B 84 6.678 -5.319 2.610 1.00 10.55 H new ATOM 0 HA GLU B 84 8.384 -4.789 4.938 1.00 51.21 H new ATOM 0 HB2 GLU B 84 6.020 -6.668 4.614 1.00 4.10 H new ATOM 0 HB3 GLU B 84 6.815 -6.212 6.108 1.00 4.10 H new ATOM 0 HG2 GLU B 84 6.141 -3.782 5.588 1.00 35.25 H new ATOM 0 HG3 GLU B 84 5.153 -4.418 4.287 1.00 35.25 H new ATOM 3134 N PHE B 85 9.875 -6.729 4.601 1.00 34.52 N ATOM 3135 CA PHE B 85 10.783 -7.829 4.371 1.00 12.00 C ATOM 3136 C PHE B 85 10.773 -8.791 5.528 1.00 62.02 C ATOM 3137 O PHE B 85 10.297 -8.481 6.610 1.00 65.43 O ATOM 3138 CB PHE B 85 12.217 -7.345 4.151 1.00 11.40 C ATOM 3139 CG PHE B 85 12.427 -6.468 2.959 1.00 22.33 C ATOM 3140 CD1 PHE B 85 12.675 -7.021 1.715 1.00 10.24 C ATOM 3141 CD2 PHE B 85 12.400 -5.094 3.084 1.00 31.01 C ATOM 3142 CE1 PHE B 85 12.895 -6.218 0.623 1.00 3.05 C ATOM 3143 CE2 PHE B 85 12.615 -4.285 1.995 1.00 62.15 C ATOM 3144 CZ PHE B 85 12.865 -4.848 0.763 1.00 44.42 C ATOM 0 H PHE B 85 10.245 -5.989 5.198 1.00 34.52 H new ATOM 0 HA PHE B 85 10.435 -8.333 3.469 1.00 12.00 H new ATOM 0 HB2 PHE B 85 12.539 -6.802 5.040 1.00 11.40 H new ATOM 0 HB3 PHE B 85 12.865 -8.216 4.057 1.00 11.40 H new ATOM 0 HD1 PHE B 85 12.696 -8.095 1.602 1.00 10.24 H new ATOM 0 HD2 PHE B 85 12.208 -4.650 4.049 1.00 31.01 H new ATOM 0 HE1 PHE B 85 13.091 -6.659 -0.343 1.00 3.05 H new ATOM 0 HE2 PHE B 85 12.588 -3.211 2.104 1.00 62.15 H new ATOM 0 HZ PHE B 85 13.038 -4.214 -0.094 1.00 44.42 H new ATOM 3154 N ALA B 86 11.262 -9.974 5.279 1.00 13.41 N ATOM 3155 CA ALA B 86 11.427 -10.964 6.308 1.00 1.14 C ATOM 3156 C ALA B 86 12.752 -10.743 7.038 1.00 32.01 C ATOM 3157 O ALA B 86 13.015 -11.357 8.063 1.00 65.20 O ATOM 3158 CB ALA B 86 11.376 -12.359 5.704 1.00 3.44 C ATOM 0 H ALA B 86 11.559 -10.280 4.353 1.00 13.41 H new ATOM 0 HA ALA B 86 10.614 -10.869 7.027 1.00 1.14 H new ATOM 0 HB1 ALA B 86 11.502 -13.101 6.492 1.00 3.44 H new ATOM 0 HB2 ALA B 86 10.413 -12.509 5.215 1.00 3.44 H new ATOM 0 HB3 ALA B 86 12.176 -12.468 4.972 1.00 3.44 H new ATOM 3164 N GLU B 87 13.593 -9.885 6.481 1.00 54.11 N ATOM 3165 CA GLU B 87 14.897 -9.573 7.062 1.00 54.10 C ATOM 3166 C GLU B 87 15.051 -8.057 7.298 1.00 12.42 C ATOM 3167 O GLU B 87 14.634 -7.255 6.472 1.00 25.32 O ATOM 3168 CB GLU B 87 15.968 -10.047 6.089 1.00 5.21 C ATOM 3169 CG GLU B 87 17.381 -9.839 6.526 1.00 32.40 C ATOM 3170 CD GLU B 87 18.361 -10.267 5.471 1.00 4.35 C ATOM 3171 OE1 GLU B 87 18.535 -9.518 4.469 1.00 14.20 O ATOM 3172 OE2 GLU B 87 18.985 -11.327 5.628 1.00 1.11 O ATOM 0 H GLU B 87 13.395 -9.384 5.615 1.00 54.11 H new ATOM 0 HA GLU B 87 14.994 -10.073 8.026 1.00 54.10 H new ATOM 0 HB2 GLU B 87 15.818 -11.110 5.903 1.00 5.21 H new ATOM 0 HB3 GLU B 87 15.822 -9.533 5.139 1.00 5.21 H new ATOM 0 HG2 GLU B 87 17.537 -8.786 6.761 1.00 32.40 H new ATOM 0 HG3 GLU B 87 17.565 -10.401 7.442 1.00 32.40 H new ATOM 3179 N ARG B 88 15.665 -7.677 8.420 1.00 73.15 N ATOM 3180 CA ARG B 88 15.885 -6.264 8.753 1.00 23.31 C ATOM 3181 C ARG B 88 17.033 -5.748 7.864 1.00 63.31 C ATOM 3182 O ARG B 88 17.026 -4.600 7.398 1.00 34.21 O ATOM 3183 CB ARG B 88 16.256 -6.137 10.262 1.00 53.23 C ATOM 3184 CG ARG B 88 15.961 -4.771 10.953 1.00 4.12 C ATOM 3185 CD ARG B 88 16.651 -3.568 10.319 1.00 24.31 C ATOM 3186 NE ARG B 88 18.117 -3.699 10.282 1.00 74.03 N ATOM 3187 CZ ARG B 88 18.960 -2.772 9.798 1.00 41.10 C ATOM 3188 NH1 ARG B 88 18.493 -1.591 9.368 1.00 32.32 N ATOM 3189 NH2 ARG B 88 20.270 -3.024 9.753 1.00 5.35 N ATOM 0 H ARG B 88 16.021 -8.330 9.118 1.00 73.15 H new ATOM 0 HA ARG B 88 14.985 -5.674 8.576 1.00 23.31 H new ATOM 0 HB2 ARG B 88 15.722 -6.915 10.808 1.00 53.23 H new ATOM 0 HB3 ARG B 88 17.320 -6.347 10.368 1.00 53.23 H new ATOM 0 HG2 ARG B 88 14.884 -4.601 10.943 1.00 4.12 H new ATOM 0 HG3 ARG B 88 16.264 -4.836 11.998 1.00 4.12 H new ATOM 0 HD2 ARG B 88 16.278 -3.436 9.303 1.00 24.31 H new ATOM 0 HD3 ARG B 88 16.386 -2.669 10.876 1.00 24.31 H new ATOM 0 HE ARG B 88 18.523 -4.558 10.652 1.00 74.03 H new ATOM 0 HH11 ARG B 88 17.493 -1.393 9.408 1.00 32.32 H new ATOM 0 HH12 ARG B 88 19.138 -0.891 9.001 1.00 32.32 H new ATOM 0 HH21 ARG B 88 20.629 -3.919 10.086 1.00 5.35 H new ATOM 0 HH22 ARG B 88 20.912 -2.322 9.386 1.00 5.35 H new ATOM 3203 N ASN B 89 17.996 -6.631 7.598 1.00 75.42 N ATOM 3204 CA ASN B 89 19.170 -6.296 6.766 1.00 61.03 C ATOM 3205 C ASN B 89 18.689 -5.938 5.380 1.00 44.34 C ATOM 3206 O ASN B 89 19.330 -5.171 4.671 1.00 10.33 O ATOM 3207 CB ASN B 89 20.118 -7.481 6.538 1.00 42.30 C ATOM 3208 CG ASN B 89 20.418 -8.378 7.705 1.00 64.53 C ATOM 3209 OD1 ASN B 89 19.635 -8.521 8.642 1.00 60.40 O ATOM 3210 ND2 ASN B 89 21.520 -9.053 7.607 1.00 62.24 N ATOM 0 H ASN B 89 17.993 -7.590 7.945 1.00 75.42 H new ATOM 0 HA ASN B 89 19.690 -5.497 7.294 1.00 61.03 H new ATOM 0 HB2 ASN B 89 19.698 -8.097 5.743 1.00 42.30 H new ATOM 0 HB3 ASN B 89 21.064 -7.086 6.169 1.00 42.30 H new ATOM 0 HD21 ASN B 89 21.766 -9.735 8.325 1.00 62.24 H new ATOM 0 HD22 ASN B 89 22.141 -8.903 6.812 1.00 62.24 H new ATOM 3217 N SER B 90 17.551 -6.512 4.985 1.00 43.35 N ATOM 3218 CA SER B 90 16.994 -6.283 3.694 1.00 71.24 C ATOM 3219 C SER B 90 16.608 -4.825 3.518 1.00 51.03 C ATOM 3220 O SER B 90 16.768 -4.263 2.435 1.00 22.20 O ATOM 3221 CB SER B 90 15.797 -7.193 3.451 1.00 70.23 C ATOM 3222 OG SER B 90 16.169 -8.569 3.475 1.00 64.24 O ATOM 0 H SER B 90 17.005 -7.146 5.568 1.00 43.35 H new ATOM 0 HA SER B 90 17.757 -6.520 2.953 1.00 71.24 H new ATOM 0 HB2 SER B 90 15.038 -7.008 4.211 1.00 70.23 H new ATOM 0 HB3 SER B 90 15.348 -6.954 2.487 1.00 70.23 H new ATOM 0 HG SER B 90 17.072 -8.657 3.846 1.00 64.24 H new ATOM 3228 N VAL B 91 16.114 -4.190 4.600 1.00 60.23 N ATOM 3229 CA VAL B 91 15.744 -2.792 4.504 1.00 13.10 C ATOM 3230 C VAL B 91 16.977 -1.990 4.296 1.00 61.13 C ATOM 3231 O VAL B 91 16.988 -1.085 3.499 1.00 41.42 O ATOM 3232 CB VAL B 91 14.937 -2.229 5.729 1.00 14.32 C ATOM 3233 CG1 VAL B 91 13.848 -3.149 6.116 1.00 44.25 C ATOM 3234 CG2 VAL B 91 15.782 -1.806 6.935 1.00 31.12 C ATOM 0 H VAL B 91 15.971 -4.618 5.515 1.00 60.23 H new ATOM 0 HA VAL B 91 15.060 -2.713 3.659 1.00 13.10 H new ATOM 0 HB VAL B 91 14.503 -1.295 5.372 1.00 14.32 H new ATOM 0 HG11 VAL B 91 13.306 -2.734 6.966 1.00 44.25 H new ATOM 0 HG12 VAL B 91 13.164 -3.276 5.277 1.00 44.25 H new ATOM 0 HG13 VAL B 91 14.269 -4.116 6.391 1.00 44.25 H new ATOM 0 HG21 VAL B 91 15.129 -1.433 7.724 1.00 31.12 H new ATOM 0 HG22 VAL B 91 16.344 -2.664 7.305 1.00 31.12 H new ATOM 0 HG23 VAL B 91 16.475 -1.020 6.636 1.00 31.12 H new ATOM 3244 N ASP B 92 18.041 -2.370 5.001 1.00 12.42 N ATOM 3245 CA ASP B 92 19.335 -1.714 4.897 1.00 31.33 C ATOM 3246 C ASP B 92 19.840 -1.729 3.453 1.00 62.34 C ATOM 3247 O ASP B 92 20.428 -0.761 2.971 1.00 75.05 O ATOM 3248 CB ASP B 92 20.326 -2.415 5.824 1.00 64.32 C ATOM 3249 CG ASP B 92 21.670 -1.729 5.874 1.00 5.21 C ATOM 3250 OD1 ASP B 92 21.726 -0.543 6.206 1.00 74.45 O ATOM 3251 OD2 ASP B 92 22.671 -2.357 5.557 1.00 72.22 O ATOM 0 H ASP B 92 18.025 -3.146 5.663 1.00 12.42 H new ATOM 0 HA ASP B 92 19.234 -0.671 5.198 1.00 31.33 H new ATOM 0 HB2 ASP B 92 19.908 -2.457 6.830 1.00 64.32 H new ATOM 0 HB3 ASP B 92 20.461 -3.444 5.492 1.00 64.32 H new ATOM 3256 N ALA B 93 19.585 -2.821 2.771 1.00 33.41 N ATOM 3257 CA ALA B 93 19.952 -2.958 1.377 1.00 61.33 C ATOM 3258 C ALA B 93 19.029 -2.128 0.467 1.00 34.42 C ATOM 3259 O ALA B 93 19.478 -1.532 -0.515 1.00 33.35 O ATOM 3260 CB ALA B 93 19.930 -4.420 0.971 1.00 4.32 C ATOM 0 H ALA B 93 19.119 -3.639 3.164 1.00 33.41 H new ATOM 0 HA ALA B 93 20.965 -2.573 1.256 1.00 61.33 H new ATOM 0 HB1 ALA B 93 20.208 -4.510 -0.079 1.00 4.32 H new ATOM 0 HB2 ALA B 93 20.639 -4.978 1.583 1.00 4.32 H new ATOM 0 HB3 ALA B 93 18.928 -4.823 1.117 1.00 4.32 H new ATOM 3266 N ALA B 94 17.750 -2.078 0.822 1.00 52.13 N ATOM 3267 CA ALA B 94 16.740 -1.391 0.017 1.00 20.12 C ATOM 3268 C ALA B 94 16.829 0.130 0.167 1.00 73.51 C ATOM 3269 O ALA B 94 16.689 0.863 -0.805 1.00 44.04 O ATOM 3270 CB ALA B 94 15.344 -1.890 0.368 1.00 31.45 C ATOM 0 H ALA B 94 17.383 -2.509 1.670 1.00 52.13 H new ATOM 0 HA ALA B 94 16.940 -1.625 -1.029 1.00 20.12 H new ATOM 0 HB1 ALA B 94 14.607 -1.367 -0.241 1.00 31.45 H new ATOM 0 HB2 ALA B 94 15.281 -2.961 0.174 1.00 31.45 H new ATOM 0 HB3 ALA B 94 15.144 -1.700 1.422 1.00 31.45 H new ATOM 3276 N VAL B 95 17.051 0.590 1.395 1.00 2.23 N ATOM 3277 CA VAL B 95 17.203 2.029 1.706 1.00 33.13 C ATOM 3278 C VAL B 95 18.297 2.703 0.881 1.00 72.30 C ATOM 3279 O VAL B 95 18.300 3.914 0.731 1.00 71.11 O ATOM 3280 CB VAL B 95 17.409 2.331 3.211 1.00 23.53 C ATOM 3281 CG1 VAL B 95 16.232 1.833 4.024 1.00 41.12 C ATOM 3282 CG2 VAL B 95 18.715 1.754 3.722 1.00 23.14 C ATOM 0 H VAL B 95 17.133 -0.016 2.211 1.00 2.23 H new ATOM 0 HA VAL B 95 16.243 2.461 1.422 1.00 33.13 H new ATOM 0 HB VAL B 95 17.467 3.413 3.328 1.00 23.53 H new ATOM 0 HG11 VAL B 95 16.398 2.055 5.078 1.00 41.12 H new ATOM 0 HG12 VAL B 95 15.321 2.329 3.687 1.00 41.12 H new ATOM 0 HG13 VAL B 95 16.129 0.756 3.892 1.00 41.12 H new ATOM 0 HG21 VAL B 95 18.825 1.986 4.781 1.00 23.14 H new ATOM 0 HG22 VAL B 95 18.713 0.673 3.585 1.00 23.14 H new ATOM 0 HG23 VAL B 95 19.547 2.188 3.167 1.00 23.14 H new ATOM 3292 N ALA B 96 19.230 1.914 0.359 1.00 14.54 N ATOM 3293 CA ALA B 96 20.292 2.442 -0.494 1.00 63.42 C ATOM 3294 C ALA B 96 19.725 2.965 -1.828 1.00 60.14 C ATOM 3295 O ALA B 96 20.388 3.674 -2.579 1.00 72.24 O ATOM 3296 CB ALA B 96 21.363 1.394 -0.735 1.00 42.52 C ATOM 0 H ALA B 96 19.274 0.906 0.511 1.00 14.54 H new ATOM 0 HA ALA B 96 20.751 3.283 0.026 1.00 63.42 H new ATOM 0 HB1 ALA B 96 22.143 1.811 -1.373 1.00 42.52 H new ATOM 0 HB2 ALA B 96 21.797 1.091 0.218 1.00 42.52 H new ATOM 0 HB3 ALA B 96 20.920 0.526 -1.224 1.00 42.52 H new ATOM 3302 N MET B 97 18.478 2.602 -2.098 1.00 3.43 N ATOM 3303 CA MET B 97 17.782 3.042 -3.288 1.00 21.11 C ATOM 3304 C MET B 97 16.904 4.243 -2.964 1.00 5.21 C ATOM 3305 O MET B 97 16.097 4.669 -3.799 1.00 72.43 O ATOM 3306 CB MET B 97 16.910 1.920 -3.891 1.00 15.02 C ATOM 3307 CG MET B 97 17.681 0.689 -4.347 1.00 33.12 C ATOM 3308 SD MET B 97 16.632 -0.530 -5.198 1.00 33.54 S ATOM 3309 CE MET B 97 15.429 -0.913 -3.929 1.00 61.11 C ATOM 0 H MET B 97 17.925 1.994 -1.494 1.00 3.43 H new ATOM 0 HA MET B 97 18.537 3.319 -4.024 1.00 21.11 H new ATOM 0 HB2 MET B 97 16.171 1.615 -3.150 1.00 15.02 H new ATOM 0 HB3 MET B 97 16.361 2.323 -4.742 1.00 15.02 H new ATOM 0 HG2 MET B 97 18.485 0.997 -5.015 1.00 33.12 H new ATOM 0 HG3 MET B 97 18.148 0.218 -3.482 1.00 33.12 H new ATOM 0 HE1 MET B 97 15.058 -1.928 -4.074 1.00 61.11 H new ATOM 0 HE2 MET B 97 15.898 -0.835 -2.948 1.00 61.11 H new ATOM 0 HE3 MET B 97 14.598 -0.210 -3.991 1.00 61.11 H new ATOM 3319 N ASP B 98 17.087 4.783 -1.742 1.00 34.43 N ATOM 3320 CA ASP B 98 16.300 5.909 -1.188 1.00 3.34 C ATOM 3321 C ASP B 98 15.895 6.971 -2.176 1.00 2.53 C ATOM 3322 O ASP B 98 14.765 7.385 -2.136 1.00 63.21 O ATOM 3323 CB ASP B 98 16.972 6.568 0.035 1.00 12.23 C ATOM 3324 CG ASP B 98 18.204 7.388 -0.284 1.00 35.22 C ATOM 3325 OD1 ASP B 98 19.260 6.814 -0.632 1.00 41.22 O ATOM 3326 OD2 ASP B 98 18.151 8.628 -0.145 1.00 13.01 O ATOM 0 H ASP B 98 17.801 4.443 -1.097 1.00 34.43 H new ATOM 0 HA ASP B 98 15.379 5.418 -0.874 1.00 3.34 H new ATOM 0 HB2 ASP B 98 16.244 7.210 0.530 1.00 12.23 H new ATOM 0 HB3 ASP B 98 17.245 5.788 0.746 1.00 12.23 H new ATOM 3331 N GLU B 99 16.781 7.455 -3.020 1.00 73.30 N ATOM 3332 CA GLU B 99 16.346 8.418 -3.999 1.00 52.22 C ATOM 3333 C GLU B 99 16.787 7.995 -5.418 1.00 4.00 C ATOM 3334 O GLU B 99 17.219 8.808 -6.237 1.00 12.31 O ATOM 3335 CB GLU B 99 16.861 9.814 -3.608 1.00 32.21 C ATOM 3336 CG GLU B 99 16.264 10.938 -4.424 1.00 1.10 C ATOM 3337 CD GLU B 99 16.697 12.283 -3.970 1.00 41.01 C ATOM 3338 OE1 GLU B 99 17.722 12.783 -4.459 1.00 14.40 O ATOM 3339 OE2 GLU B 99 16.007 12.878 -3.117 1.00 22.22 O ATOM 0 H GLU B 99 17.770 7.208 -3.048 1.00 73.30 H new ATOM 0 HA GLU B 99 15.257 8.459 -4.017 1.00 52.22 H new ATOM 0 HB2 GLU B 99 16.644 9.988 -2.554 1.00 32.21 H new ATOM 0 HB3 GLU B 99 17.945 9.834 -3.718 1.00 32.21 H new ATOM 0 HG2 GLU B 99 16.543 10.807 -5.470 1.00 1.10 H new ATOM 0 HG3 GLU B 99 15.177 10.877 -4.374 1.00 1.10 H new ATOM 3346 N THR B 100 16.655 6.720 -5.703 1.00 4.31 N ATOM 3347 CA THR B 100 16.942 6.212 -7.037 1.00 41.13 C ATOM 3348 C THR B 100 15.765 6.484 -7.990 1.00 74.40 C ATOM 3349 O THR B 100 14.718 7.005 -7.574 1.00 72.33 O ATOM 3350 CB THR B 100 17.266 4.698 -7.024 1.00 33.21 C ATOM 3351 OG1 THR B 100 16.215 3.951 -6.374 1.00 50.34 O ATOM 3352 CG2 THR B 100 18.602 4.429 -6.351 1.00 30.15 C ATOM 0 H THR B 100 16.352 6.012 -5.035 1.00 4.31 H new ATOM 0 HA THR B 100 17.825 6.742 -7.395 1.00 41.13 H new ATOM 0 HB THR B 100 17.334 4.366 -8.060 1.00 33.21 H new ATOM 0 HG1 THR B 100 16.146 4.231 -5.437 1.00 50.34 H new ATOM 0 HG21 THR B 100 18.803 3.358 -6.357 1.00 30.15 H new ATOM 0 HG22 THR B 100 19.393 4.949 -6.891 1.00 30.15 H new ATOM 0 HG23 THR B 100 18.570 4.787 -5.322 1.00 30.15 H new ATOM 3360 N VAL B 101 15.921 6.132 -9.241 1.00 34.14 N ATOM 3361 CA VAL B 101 14.883 6.358 -10.210 1.00 32.24 C ATOM 3362 C VAL B 101 14.251 5.026 -10.615 1.00 44.43 C ATOM 3363 O VAL B 101 14.951 4.031 -10.856 1.00 72.23 O ATOM 3364 CB VAL B 101 15.396 7.181 -11.446 1.00 41.33 C ATOM 3365 CG1 VAL B 101 16.560 6.507 -12.126 1.00 64.13 C ATOM 3366 CG2 VAL B 101 14.277 7.464 -12.442 1.00 74.12 C ATOM 0 H VAL B 101 16.760 5.686 -9.612 1.00 34.14 H new ATOM 0 HA VAL B 101 14.109 6.973 -9.750 1.00 32.24 H new ATOM 0 HB VAL B 101 15.747 8.138 -11.059 1.00 41.33 H new ATOM 0 HG11 VAL B 101 16.884 7.109 -12.975 1.00 64.13 H new ATOM 0 HG12 VAL B 101 17.384 6.403 -11.420 1.00 64.13 H new ATOM 0 HG13 VAL B 101 16.256 5.521 -12.476 1.00 64.13 H new ATOM 0 HG21 VAL B 101 14.673 8.035 -13.282 1.00 74.12 H new ATOM 0 HG22 VAL B 101 13.866 6.522 -12.805 1.00 74.12 H new ATOM 0 HG23 VAL B 101 13.490 8.038 -11.952 1.00 74.12 H new ATOM 3376 N PHE B 102 12.948 5.004 -10.626 1.00 34.43 N ATOM 3377 CA PHE B 102 12.179 3.832 -10.924 1.00 31.33 C ATOM 3378 C PHE B 102 10.979 4.229 -11.774 1.00 21.15 C ATOM 3379 O PHE B 102 10.215 5.119 -11.392 1.00 2.02 O ATOM 3380 CB PHE B 102 11.719 3.201 -9.598 1.00 13.31 C ATOM 3381 CG PHE B 102 10.883 1.955 -9.720 1.00 21.24 C ATOM 3382 CD1 PHE B 102 11.480 0.715 -9.828 1.00 24.53 C ATOM 3383 CD2 PHE B 102 9.499 2.027 -9.708 1.00 51.31 C ATOM 3384 CE1 PHE B 102 10.716 -0.429 -9.927 1.00 74.41 C ATOM 3385 CE2 PHE B 102 8.733 0.888 -9.806 1.00 25.01 C ATOM 3386 CZ PHE B 102 9.342 -0.343 -9.917 1.00 10.31 C ATOM 0 H PHE B 102 12.377 5.824 -10.422 1.00 34.43 H new ATOM 0 HA PHE B 102 12.775 3.107 -11.479 1.00 31.33 H new ATOM 0 HB2 PHE B 102 12.602 2.966 -9.004 1.00 13.31 H new ATOM 0 HB3 PHE B 102 11.149 3.945 -9.042 1.00 13.31 H new ATOM 0 HD1 PHE B 102 12.557 0.640 -9.835 1.00 24.53 H new ATOM 0 HD2 PHE B 102 9.016 2.989 -9.621 1.00 51.31 H new ATOM 0 HE1 PHE B 102 11.196 -1.393 -10.012 1.00 74.41 H new ATOM 0 HE2 PHE B 102 7.655 0.959 -9.796 1.00 25.01 H new ATOM 0 HZ PHE B 102 8.743 -1.238 -9.996 1.00 10.31 H new ATOM 3396 N ARG B 103 10.830 3.582 -12.918 1.00 34.33 N ATOM 3397 CA ARG B 103 9.734 3.833 -13.851 1.00 74.35 C ATOM 3398 C ARG B 103 9.545 5.324 -14.201 1.00 5.53 C ATOM 3399 O ARG B 103 8.485 5.930 -13.973 1.00 35.32 O ATOM 3400 CB ARG B 103 8.433 3.095 -13.471 1.00 74.31 C ATOM 3401 CG ARG B 103 7.330 3.229 -14.506 1.00 54.32 C ATOM 3402 CD ARG B 103 6.149 2.344 -14.192 1.00 4.10 C ATOM 3403 NE ARG B 103 5.092 2.523 -15.174 1.00 41.51 N ATOM 3404 CZ ARG B 103 4.544 1.552 -15.905 1.00 71.34 C ATOM 3405 NH1 ARG B 103 5.006 0.296 -15.824 1.00 43.05 N ATOM 3406 NH2 ARG B 103 3.556 1.844 -16.743 1.00 21.21 N ATOM 0 H ARG B 103 11.474 2.856 -13.233 1.00 34.33 H new ATOM 0 HA ARG B 103 10.042 3.380 -14.793 1.00 74.35 H new ATOM 0 HB2 ARG B 103 8.655 2.038 -13.325 1.00 74.31 H new ATOM 0 HB3 ARG B 103 8.073 3.480 -12.517 1.00 74.31 H new ATOM 0 HG2 ARG B 103 7.002 4.267 -14.554 1.00 54.32 H new ATOM 0 HG3 ARG B 103 7.723 2.973 -15.490 1.00 54.32 H new ATOM 0 HD2 ARG B 103 6.465 1.301 -14.177 1.00 4.10 H new ATOM 0 HD3 ARG B 103 5.770 2.576 -13.197 1.00 4.10 H new ATOM 0 HE ARG B 103 4.741 3.470 -15.315 1.00 41.51 H new ATOM 0 HH11 ARG B 103 5.782 0.077 -15.200 1.00 43.05 H new ATOM 0 HH12 ARG B 103 4.581 -0.441 -16.387 1.00 43.05 H new ATOM 0 HH21 ARG B 103 3.223 2.805 -16.823 1.00 21.21 H new ATOM 0 HH22 ARG B 103 3.131 1.108 -17.306 1.00 21.21 H new ATOM 3420 N GLY B 104 10.625 5.913 -14.663 1.00 12.14 N ATOM 3421 CA GLY B 104 10.626 7.296 -15.110 1.00 2.44 C ATOM 3422 C GLY B 104 10.659 8.345 -14.004 1.00 4.52 C ATOM 3423 O GLY B 104 10.802 9.535 -14.295 1.00 4.54 O ATOM 0 H GLY B 104 11.530 5.450 -14.741 1.00 12.14 H new ATOM 0 HA2 GLY B 104 11.489 7.449 -15.758 1.00 2.44 H new ATOM 0 HA3 GLY B 104 9.737 7.463 -15.719 1.00 2.44 H new ATOM 3427 N ARG B 105 10.533 7.944 -12.764 1.00 23.02 N ATOM 3428 CA ARG B 105 10.536 8.904 -11.672 1.00 62.12 C ATOM 3429 C ARG B 105 11.357 8.489 -10.485 1.00 23.00 C ATOM 3430 O ARG B 105 11.656 7.326 -10.298 1.00 61.30 O ATOM 3431 CB ARG B 105 9.136 9.355 -11.271 1.00 32.01 C ATOM 3432 CG ARG B 105 8.073 8.273 -11.233 1.00 15.12 C ATOM 3433 CD ARG B 105 6.810 8.851 -10.656 1.00 31.32 C ATOM 3434 NE ARG B 105 5.594 8.264 -11.187 1.00 62.21 N ATOM 3435 CZ ARG B 105 4.379 8.612 -10.777 1.00 74.40 C ATOM 3436 NH1 ARG B 105 4.233 9.345 -9.674 1.00 32.01 N ATOM 3437 NH2 ARG B 105 3.314 8.198 -11.451 1.00 45.55 N ATOM 0 H ARG B 105 10.428 6.970 -12.480 1.00 23.02 H new ATOM 0 HA ARG B 105 11.044 9.776 -12.083 1.00 62.12 H new ATOM 0 HB2 ARG B 105 9.193 9.815 -10.285 1.00 32.01 H new ATOM 0 HB3 ARG B 105 8.813 10.130 -11.966 1.00 32.01 H new ATOM 0 HG2 ARG B 105 7.888 7.891 -12.237 1.00 15.12 H new ATOM 0 HG3 ARG B 105 8.413 7.432 -10.629 1.00 15.12 H new ATOM 0 HD2 ARG B 105 6.823 8.717 -9.574 1.00 31.32 H new ATOM 0 HD3 ARG B 105 6.795 9.924 -10.845 1.00 31.32 H new ATOM 0 HE ARG B 105 5.676 7.549 -11.910 1.00 62.21 H new ATOM 0 HH11 ARG B 105 5.054 9.639 -9.145 1.00 32.01 H new ATOM 0 HH12 ARG B 105 3.300 9.612 -9.359 1.00 32.01 H new ATOM 0 HH21 ARG B 105 3.430 7.615 -12.280 1.00 45.55 H new ATOM 0 HH22 ARG B 105 2.379 8.462 -11.140 1.00 45.55 H new ATOM 3451 N THR B 106 11.711 9.453 -9.696 1.00 61.30 N ATOM 3452 CA THR B 106 12.542 9.258 -8.556 1.00 53.41 C ATOM 3453 C THR B 106 11.689 8.883 -7.349 1.00 52.43 C ATOM 3454 O THR B 106 10.807 9.647 -6.935 1.00 22.41 O ATOM 3455 CB THR B 106 13.313 10.554 -8.278 1.00 45.41 C ATOM 3456 OG1 THR B 106 13.996 10.946 -9.481 1.00 61.54 O ATOM 3457 CG2 THR B 106 14.330 10.355 -7.180 1.00 31.41 C ATOM 0 H THR B 106 11.421 10.422 -9.832 1.00 61.30 H new ATOM 0 HA THR B 106 13.246 8.448 -8.746 1.00 53.41 H new ATOM 0 HB THR B 106 12.608 11.323 -7.961 1.00 45.41 H new ATOM 0 HG1 THR B 106 14.493 11.775 -9.320 1.00 61.54 H new ATOM 0 HG21 THR B 106 14.862 11.290 -7.003 1.00 31.41 H new ATOM 0 HG22 THR B 106 13.823 10.048 -6.265 1.00 31.41 H new ATOM 0 HG23 THR B 106 15.040 9.584 -7.477 1.00 31.41 H new ATOM 3465 N ILE B 107 11.956 7.739 -6.790 1.00 32.40 N ATOM 3466 CA ILE B 107 11.193 7.246 -5.662 1.00 73.32 C ATOM 3467 C ILE B 107 11.957 7.458 -4.376 1.00 41.35 C ATOM 3468 O ILE B 107 13.109 7.890 -4.397 1.00 52.41 O ATOM 3469 CB ILE B 107 10.857 5.734 -5.803 1.00 22.15 C ATOM 3470 CG1 ILE B 107 12.150 4.887 -5.896 1.00 51.24 C ATOM 3471 CG2 ILE B 107 9.953 5.501 -7.016 1.00 43.34 C ATOM 3472 CD1 ILE B 107 11.914 3.390 -5.938 1.00 44.01 C ATOM 0 H ILE B 107 12.705 7.117 -7.096 1.00 32.40 H new ATOM 0 HA ILE B 107 10.259 7.808 -5.641 1.00 73.32 H new ATOM 0 HB ILE B 107 10.318 5.414 -4.911 1.00 22.15 H new ATOM 0 HG12 ILE B 107 12.700 5.181 -6.790 1.00 51.24 H new ATOM 0 HG13 ILE B 107 12.785 5.119 -5.041 1.00 51.24 H new ATOM 0 HG21 ILE B 107 9.726 4.438 -7.102 1.00 43.34 H new ATOM 0 HG22 ILE B 107 9.026 6.061 -6.892 1.00 43.34 H new ATOM 0 HG23 ILE B 107 10.462 5.838 -7.919 1.00 43.34 H new ATOM 0 HD11 ILE B 107 12.871 2.872 -6.003 1.00 44.01 H new ATOM 0 HD12 ILE B 107 11.394 3.078 -5.032 1.00 44.01 H new ATOM 0 HD13 ILE B 107 11.307 3.142 -6.809 1.00 44.01 H new ATOM 3484 N LYS B 108 11.302 7.201 -3.270 1.00 13.02 N ATOM 3485 CA LYS B 108 11.880 7.370 -1.952 1.00 45.03 C ATOM 3486 C LYS B 108 11.741 6.076 -1.190 1.00 71.02 C ATOM 3487 O LYS B 108 10.663 5.515 -1.142 1.00 22.03 O ATOM 3488 CB LYS B 108 11.185 8.527 -1.192 1.00 52.54 C ATOM 3489 CG LYS B 108 11.657 8.746 0.255 1.00 53.22 C ATOM 3490 CD LYS B 108 13.151 9.042 0.341 1.00 2.42 C ATOM 3491 CE LYS B 108 13.596 9.241 1.784 1.00 44.01 C ATOM 3492 NZ LYS B 108 15.053 9.506 1.892 1.00 44.13 N ATOM 0 H LYS B 108 10.339 6.864 -3.256 1.00 13.02 H new ATOM 0 HA LYS B 108 12.935 7.626 -2.049 1.00 45.03 H new ATOM 0 HB2 LYS B 108 11.341 9.450 -1.750 1.00 52.54 H new ATOM 0 HB3 LYS B 108 10.112 8.338 -1.181 1.00 52.54 H new ATOM 0 HG2 LYS B 108 11.100 9.573 0.695 1.00 53.22 H new ATOM 0 HG3 LYS B 108 11.431 7.859 0.846 1.00 53.22 H new ATOM 0 HD2 LYS B 108 13.712 8.221 -0.104 1.00 2.42 H new ATOM 0 HD3 LYS B 108 13.380 9.936 -0.239 1.00 2.42 H new ATOM 0 HE2 LYS B 108 13.044 10.073 2.221 1.00 44.01 H new ATOM 0 HE3 LYS B 108 13.346 8.353 2.365 1.00 44.01 H new ATOM 0 HZ1 LYS B 108 15.441 8.987 2.705 1.00 44.13 H new ATOM 0 HZ2 LYS B 108 15.528 9.192 1.022 1.00 44.13 H new ATOM 0 HZ3 LYS B 108 15.212 10.525 2.024 1.00 44.13 H new ATOM 3506 N VAL B 109 12.825 5.598 -0.618 1.00 61.34 N ATOM 3507 CA VAL B 109 12.803 4.369 0.158 1.00 25.40 C ATOM 3508 C VAL B 109 13.361 4.688 1.550 1.00 22.34 C ATOM 3509 O VAL B 109 14.491 5.164 1.682 1.00 64.44 O ATOM 3510 CB VAL B 109 13.630 3.230 -0.506 1.00 53.43 C ATOM 3511 CG1 VAL B 109 13.397 1.906 0.205 1.00 10.01 C ATOM 3512 CG2 VAL B 109 13.294 3.104 -1.989 1.00 31.10 C ATOM 0 H VAL B 109 13.741 6.043 -0.675 1.00 61.34 H new ATOM 0 HA VAL B 109 11.777 4.006 0.217 1.00 25.40 H new ATOM 0 HB VAL B 109 14.685 3.488 -0.415 1.00 53.43 H new ATOM 0 HG11 VAL B 109 13.986 1.126 -0.277 1.00 10.01 H new ATOM 0 HG12 VAL B 109 13.699 1.995 1.249 1.00 10.01 H new ATOM 0 HG13 VAL B 109 12.340 1.647 0.154 1.00 10.01 H new ATOM 0 HG21 VAL B 109 13.885 2.301 -2.429 1.00 31.10 H new ATOM 0 HG22 VAL B 109 12.234 2.879 -2.104 1.00 31.10 H new ATOM 0 HG23 VAL B 109 13.522 4.042 -2.495 1.00 31.10 H new ATOM 3522 N LEU B 110 12.576 4.443 2.553 1.00 73.21 N ATOM 3523 CA LEU B 110 12.846 4.859 3.929 1.00 65.32 C ATOM 3524 C LEU B 110 12.408 3.683 4.830 1.00 4.35 C ATOM 3525 O LEU B 110 11.368 3.132 4.595 1.00 0.40 O ATOM 3526 CB LEU B 110 11.907 6.075 4.080 1.00 34.42 C ATOM 3527 CG LEU B 110 11.782 6.971 5.314 1.00 22.31 C ATOM 3528 CD1 LEU B 110 10.528 7.781 5.115 1.00 53.03 C ATOM 3529 CD2 LEU B 110 11.707 6.238 6.634 1.00 52.11 C ATOM 0 H LEU B 110 11.698 3.933 2.452 1.00 73.21 H new ATOM 0 HA LEU B 110 13.878 5.106 4.178 1.00 65.32 H new ATOM 0 HB2 LEU B 110 12.157 6.743 3.256 1.00 34.42 H new ATOM 0 HB3 LEU B 110 10.903 5.696 3.889 1.00 34.42 H new ATOM 0 HG LEU B 110 12.687 7.573 5.388 1.00 22.31 H new ATOM 0 HD11 LEU B 110 10.384 8.444 5.968 1.00 53.03 H new ATOM 0 HD12 LEU B 110 10.619 8.375 4.205 1.00 53.03 H new ATOM 0 HD13 LEU B 110 9.672 7.111 5.027 1.00 53.03 H new ATOM 0 HD21 LEU B 110 11.620 6.959 7.446 1.00 52.11 H new ATOM 0 HD22 LEU B 110 10.837 5.582 6.637 1.00 52.11 H new ATOM 0 HD23 LEU B 110 12.610 5.643 6.772 1.00 52.11 H new ATOM 3541 N PRO B 111 13.193 3.272 5.839 1.00 3.43 N ATOM 3542 CA PRO B 111 12.831 2.115 6.691 1.00 71.23 C ATOM 3543 C PRO B 111 11.615 2.373 7.619 1.00 70.21 C ATOM 3544 O PRO B 111 11.431 3.475 8.154 1.00 13.44 O ATOM 3545 CB PRO B 111 14.094 1.851 7.501 1.00 5.12 C ATOM 3546 CG PRO B 111 14.821 3.154 7.520 1.00 71.31 C ATOM 3547 CD PRO B 111 14.479 3.869 6.242 1.00 51.02 C ATOM 0 HA PRO B 111 12.514 1.267 6.083 1.00 71.23 H new ATOM 0 HB2 PRO B 111 13.853 1.519 8.511 1.00 5.12 H new ATOM 0 HB3 PRO B 111 14.699 1.068 7.044 1.00 5.12 H new ATOM 0 HG2 PRO B 111 14.525 3.748 8.385 1.00 71.31 H new ATOM 0 HG3 PRO B 111 15.897 2.994 7.596 1.00 71.31 H new ATOM 0 HD2 PRO B 111 14.390 4.944 6.397 1.00 51.02 H new ATOM 0 HD3 PRO B 111 15.246 3.719 5.482 1.00 51.02 H new ATOM 3555 N LYS B 112 10.807 1.342 7.804 1.00 13.31 N ATOM 3556 CA LYS B 112 9.592 1.404 8.611 1.00 21.53 C ATOM 3557 C LYS B 112 9.893 1.021 10.058 1.00 20.25 C ATOM 3558 O LYS B 112 10.803 0.249 10.331 1.00 51.40 O ATOM 3559 CB LYS B 112 8.563 0.380 8.064 1.00 70.22 C ATOM 3560 CG LYS B 112 7.237 0.269 8.864 1.00 2.31 C ATOM 3561 CD LYS B 112 6.508 -1.051 8.561 1.00 20.03 C ATOM 3562 CE LYS B 112 5.209 -1.200 9.343 1.00 3.14 C ATOM 3563 NZ LYS B 112 4.667 -2.602 9.282 1.00 32.02 N ATOM 0 H LYS B 112 10.976 0.424 7.393 1.00 13.31 H new ATOM 0 HA LYS B 112 9.202 2.421 8.566 1.00 21.53 H new ATOM 0 HB2 LYS B 112 8.324 0.647 7.034 1.00 70.22 H new ATOM 0 HB3 LYS B 112 9.034 -0.603 8.038 1.00 70.22 H new ATOM 0 HG2 LYS B 112 7.448 0.333 9.931 1.00 2.31 H new ATOM 0 HG3 LYS B 112 6.589 1.110 8.616 1.00 2.31 H new ATOM 0 HD2 LYS B 112 6.293 -1.105 7.494 1.00 20.03 H new ATOM 0 HD3 LYS B 112 7.167 -1.887 8.796 1.00 20.03 H new ATOM 0 HE2 LYS B 112 5.379 -0.923 10.383 1.00 3.14 H new ATOM 0 HE3 LYS B 112 4.467 -0.508 8.946 1.00 3.14 H new ATOM 0 HZ1 LYS B 112 3.641 -2.571 9.112 1.00 32.02 H new ATOM 0 HZ2 LYS B 112 5.131 -3.120 8.508 1.00 32.02 H new ATOM 0 HZ3 LYS B 112 4.854 -3.086 10.183 1.00 32.02 H new