USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 1067 hydrogens (23 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 Single : A 19 SER OG : rot -45:sc= 0.525 USER MOD Single : A 20 ASN : amide:sc= -3.1! K(o=-3.1!,f=-2.5) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= -0.158 USER MOD Single : A 31 ASN : amide:sc= -2.86! K(o=-2.9!,f=-0.52) USER MOD Single : A 37 HIS : no HD1:sc= -9.68! C(o=-9.7!,f=-12!) USER MOD Single : A 49 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0972) USER MOD Single : B 19 SER OG : rot -47:sc= 0.57 USER MOD Single : B 20 ASN : amide:sc= -3.12! K(o=-3.1!,f=-2.5) USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 SER OG : rot 81:sc= -0.129 USER MOD Single : B 31 ASN : amide:sc= -1.77 K(o=-1.8,f=-0.046) USER MOD Single : B 37 HIS : no HD1:sc= -9.71! C(o=-9.7!,f=-12!) USER MOD Single : B 49 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0776) USER MOD Single : C 19 SER OG : rot -49:sc= 0.52 USER MOD Single : C 20 ASN : amide:sc= -3.11! K(o=-3.1!,f=-2.5) USER MOD Single : C 22 SER OG : rot 180:sc= 0 USER MOD Single : C 23 SER OG : rot 180:sc= -0.155 USER MOD Single : C 31 ASN : amide:sc= -3.29! K(o=-3.3!,f=-0.79) USER MOD Single : C 37 HIS : no HD1:sc= -9.57! C(o=-9.6!,f=-12!) USER MOD Single : C 49 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0995) USER MOD Single : D 19 SER OG : rot -51:sc= 0.547 USER MOD Single : D 20 ASN : amide:sc= -3.22! K(o=-3.2!,f=-2.6) USER MOD Single : D 22 SER OG : rot 180:sc= 0 USER MOD Single : D 23 SER OG : rot 180:sc= -0.142 USER MOD Single : D 31 ASN : amide:sc= -2.3! K(o=-2.3!,f=-0.17) USER MOD Single : D 37 HIS : no HD1:sc= -9.66! C(o=-9.7!,f=-12!) USER MOD Single : D 49 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0924) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 19 -9.012 22.108 -11.402 1.00 0.00 N ATOM 2 CA SER A 19 -7.707 21.616 -11.924 1.00 0.00 C ATOM 3 C SER A 19 -7.041 20.733 -10.875 1.00 0.00 C ATOM 4 O SER A 19 -5.823 20.559 -10.876 1.00 0.00 O ATOM 5 CB SER A 19 -6.807 22.810 -12.246 1.00 0.00 C ATOM 6 OG SER A 19 -5.660 22.356 -12.954 1.00 0.00 O ATOM 0 HA SER A 19 -7.870 21.034 -12.831 1.00 0.00 H new ATOM 0 HB2 SER A 19 -7.352 23.540 -12.844 1.00 0.00 H new ATOM 0 HB3 SER A 19 -6.506 23.312 -11.326 1.00 0.00 H new ATOM 0 HG SER A 19 -5.306 21.551 -12.521 1.00 0.00 H new ATOM 14 N ASN A 20 -7.849 20.175 -9.980 1.00 0.00 N ATOM 15 CA ASN A 20 -7.330 19.308 -8.927 1.00 0.00 C ATOM 16 C ASN A 20 -6.293 20.048 -8.087 1.00 0.00 C ATOM 17 O ASN A 20 -5.267 19.480 -7.710 1.00 0.00 O ATOM 18 CB ASN A 20 -6.692 18.064 -9.546 1.00 0.00 C ATOM 19 CG ASN A 20 -6.449 17.015 -8.467 1.00 0.00 C ATOM 20 OD1 ASN A 20 -7.277 16.838 -7.572 1.00 0.00 O ATOM 21 ND2 ASN A 20 -5.355 16.304 -8.497 1.00 0.00 N ATOM 0 H ASN A 20 -8.860 20.306 -9.962 1.00 0.00 H new ATOM 0 HA ASN A 20 -8.158 19.011 -8.283 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -7.343 17.658 -10.320 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -5.750 18.329 -10.027 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -5.184 15.600 -7.779 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -4.671 16.452 -9.239 1.00 0.00 H new ATOM 28 N ASP A 21 -6.564 21.315 -7.799 1.00 0.00 N ATOM 29 CA ASP A 21 -5.645 22.122 -7.002 1.00 0.00 C ATOM 30 C ASP A 21 -5.679 21.687 -5.540 1.00 0.00 C ATOM 31 O ASP A 21 -4.753 21.967 -4.778 1.00 0.00 O ATOM 32 CB ASP A 21 -6.026 23.599 -7.106 1.00 0.00 C ATOM 33 CG ASP A 21 -5.729 24.116 -8.510 1.00 0.00 C ATOM 34 OD1 ASP A 21 -5.020 23.433 -9.232 1.00 0.00 O ATOM 35 OD2 ASP A 21 -6.213 25.185 -8.842 1.00 0.00 O ATOM 0 H ASP A 21 -7.406 21.804 -8.102 1.00 0.00 H new ATOM 0 HA ASP A 21 -4.636 21.978 -7.388 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -7.084 23.727 -6.879 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -5.469 24.179 -6.370 1.00 0.00 H new ATOM 40 N SER A 22 -6.755 21.009 -5.154 1.00 0.00 N ATOM 41 CA SER A 22 -6.905 20.548 -3.776 1.00 0.00 C ATOM 42 C SER A 22 -5.818 19.538 -3.419 1.00 0.00 C ATOM 43 O SER A 22 -5.355 19.489 -2.280 1.00 0.00 O ATOM 44 CB SER A 22 -8.278 19.907 -3.586 1.00 0.00 C ATOM 45 OG SER A 22 -8.413 18.808 -4.479 1.00 0.00 O ATOM 0 H SER A 22 -7.531 20.767 -5.770 1.00 0.00 H new ATOM 0 HA SER A 22 -6.810 21.411 -3.117 1.00 0.00 H new ATOM 0 HB2 SER A 22 -8.395 19.570 -2.556 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.063 20.640 -3.772 1.00 0.00 H new ATOM 0 HG SER A 22 -9.293 18.394 -4.358 1.00 0.00 H new ATOM 51 N SER A 23 -5.414 18.736 -4.399 1.00 0.00 N ATOM 52 CA SER A 23 -4.383 17.730 -4.183 1.00 0.00 C ATOM 53 C SER A 23 -3.628 17.481 -5.481 1.00 0.00 C ATOM 54 O SER A 23 -4.231 17.358 -6.547 1.00 0.00 O ATOM 55 CB SER A 23 -5.017 16.429 -3.693 1.00 0.00 C ATOM 56 OG SER A 23 -5.814 16.698 -2.546 1.00 0.00 O ATOM 0 H SER A 23 -5.785 18.764 -5.349 1.00 0.00 H new ATOM 0 HA SER A 23 -3.686 18.091 -3.426 1.00 0.00 H new ATOM 0 HB2 SER A 23 -5.629 15.990 -4.481 1.00 0.00 H new ATOM 0 HB3 SER A 23 -4.242 15.702 -3.449 1.00 0.00 H new ATOM 0 HG SER A 23 -6.224 15.866 -2.230 1.00 0.00 H new ATOM 62 N ASP A 24 -2.311 17.416 -5.384 1.00 0.00 N ATOM 63 CA ASP A 24 -1.479 17.192 -6.560 1.00 0.00 C ATOM 64 C ASP A 24 -1.882 15.887 -7.269 1.00 0.00 C ATOM 65 O ASP A 24 -2.314 14.940 -6.612 1.00 0.00 O ATOM 66 CB ASP A 24 -0.007 17.116 -6.145 1.00 0.00 C ATOM 67 CG ASP A 24 0.305 18.203 -5.118 1.00 0.00 C ATOM 68 OD1 ASP A 24 0.528 19.330 -5.528 1.00 0.00 O ATOM 69 OD2 ASP A 24 0.320 17.891 -3.940 1.00 0.00 O ATOM 0 H ASP A 24 -1.795 17.514 -4.510 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.623 18.024 -7.250 1.00 0.00 H new ATOM 0 HB2 ASP A 24 0.210 16.134 -5.724 1.00 0.00 H new ATOM 0 HB3 ASP A 24 0.632 17.237 -7.020 1.00 0.00 H new ATOM 74 N PRO A 25 -1.737 15.803 -8.578 1.00 0.00 N ATOM 75 CA PRO A 25 -2.087 14.560 -9.332 1.00 0.00 C ATOM 76 C PRO A 25 -1.538 13.297 -8.661 1.00 0.00 C ATOM 77 O PRO A 25 -2.203 12.263 -8.618 1.00 0.00 O ATOM 78 CB PRO A 25 -1.418 14.768 -10.701 1.00 0.00 C ATOM 79 CG PRO A 25 -1.334 16.251 -10.885 1.00 0.00 C ATOM 80 CD PRO A 25 -1.250 16.868 -9.481 1.00 0.00 C ATOM 0 HA PRO A 25 -3.165 14.411 -9.387 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -0.428 14.313 -10.727 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -2.002 14.306 -11.497 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -0.459 16.518 -11.478 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -2.207 16.624 -11.420 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -0.229 17.159 -9.236 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -1.865 17.765 -9.404 1.00 0.00 H new ATOM 88 N LEU A 26 -0.317 13.387 -8.156 1.00 0.00 N ATOM 89 CA LEU A 26 0.309 12.247 -7.500 1.00 0.00 C ATOM 90 C LEU A 26 -0.426 11.882 -6.211 1.00 0.00 C ATOM 91 O LEU A 26 -0.624 10.704 -5.912 1.00 0.00 O ATOM 92 CB LEU A 26 1.772 12.574 -7.186 1.00 0.00 C ATOM 93 CG LEU A 26 2.566 12.730 -8.491 1.00 0.00 C ATOM 94 CD1 LEU A 26 3.945 13.307 -8.165 1.00 0.00 C ATOM 95 CD2 LEU A 26 2.727 11.367 -9.194 1.00 0.00 C ATOM 0 H LEU A 26 0.257 14.230 -8.187 1.00 0.00 H new ATOM 0 HA LEU A 26 0.259 11.393 -8.175 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.831 13.493 -6.603 1.00 0.00 H new ATOM 0 HB3 LEU A 26 2.208 11.782 -6.578 1.00 0.00 H new ATOM 0 HG LEU A 26 2.027 13.401 -9.160 1.00 0.00 H new ATOM 0 HD11 LEU A 26 4.518 13.422 -9.085 1.00 0.00 H new ATOM 0 HD12 LEU A 26 3.829 14.279 -7.686 1.00 0.00 H new ATOM 0 HD13 LEU A 26 4.472 12.631 -7.491 1.00 0.00 H new ATOM 0 HD21 LEU A 26 3.292 11.498 -10.117 1.00 0.00 H new ATOM 0 HD22 LEU A 26 3.259 10.679 -8.537 1.00 0.00 H new ATOM 0 HD23 LEU A 26 1.743 10.959 -9.426 1.00 0.00 H new ATOM 107 N VAL A 27 -0.815 12.897 -5.441 1.00 0.00 N ATOM 108 CA VAL A 27 -1.511 12.664 -4.178 1.00 0.00 C ATOM 109 C VAL A 27 -2.852 11.967 -4.408 1.00 0.00 C ATOM 110 O VAL A 27 -3.154 10.960 -3.767 1.00 0.00 O ATOM 111 CB VAL A 27 -1.748 14.004 -3.473 1.00 0.00 C ATOM 112 CG1 VAL A 27 -2.628 13.796 -2.237 1.00 0.00 C ATOM 113 CG2 VAL A 27 -0.407 14.604 -3.050 1.00 0.00 C ATOM 0 H VAL A 27 -0.662 13.880 -5.667 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.890 12.018 -3.557 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.251 14.684 -4.160 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.792 14.753 -1.742 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.587 13.375 -2.540 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.133 13.111 -1.549 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.577 15.557 -2.549 1.00 0.00 H new ATOM 0 HG22 VAL A 27 0.099 13.920 -2.368 1.00 0.00 H new ATOM 0 HG23 VAL A 27 0.215 14.763 -3.931 1.00 0.00 H new ATOM 123 N VAL A 28 -3.649 12.508 -5.322 1.00 0.00 N ATOM 124 CA VAL A 28 -4.952 11.925 -5.622 1.00 0.00 C ATOM 125 C VAL A 28 -4.786 10.592 -6.333 1.00 0.00 C ATOM 126 O VAL A 28 -5.488 9.624 -6.046 1.00 0.00 O ATOM 127 CB VAL A 28 -5.763 12.883 -6.493 1.00 0.00 C ATOM 128 CG1 VAL A 28 -5.072 13.073 -7.840 1.00 0.00 C ATOM 129 CG2 VAL A 28 -7.167 12.312 -6.711 1.00 0.00 C ATOM 0 H VAL A 28 -3.420 13.341 -5.864 1.00 0.00 H new ATOM 0 HA VAL A 28 -5.483 11.757 -4.685 1.00 0.00 H new ATOM 0 HB VAL A 28 -5.837 13.848 -5.991 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -5.656 13.757 -8.455 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -4.076 13.487 -7.683 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -4.990 12.111 -8.346 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -7.745 12.996 -7.332 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -7.093 11.344 -7.208 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -7.663 12.189 -5.748 1.00 0.00 H new ATOM 139 N ALA A 29 -3.850 10.559 -7.268 1.00 0.00 N ATOM 140 CA ALA A 29 -3.590 9.342 -8.031 1.00 0.00 C ATOM 141 C ALA A 29 -3.140 8.216 -7.110 1.00 0.00 C ATOM 142 O ALA A 29 -3.555 7.070 -7.269 1.00 0.00 O ATOM 143 CB ALA A 29 -2.506 9.599 -9.080 1.00 0.00 C ATOM 0 H ALA A 29 -3.260 11.353 -7.518 1.00 0.00 H new ATOM 0 HA ALA A 29 -4.515 9.048 -8.526 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -2.320 8.684 -9.643 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -2.837 10.383 -9.761 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -1.587 9.913 -8.584 1.00 0.00 H new ATOM 149 N ALA A 30 -2.288 8.545 -6.146 1.00 0.00 N ATOM 150 CA ALA A 30 -1.794 7.540 -5.213 1.00 0.00 C ATOM 151 C ALA A 30 -2.943 6.943 -4.409 1.00 0.00 C ATOM 152 O ALA A 30 -3.000 5.732 -4.196 1.00 0.00 O ATOM 153 CB ALA A 30 -0.778 8.169 -4.259 1.00 0.00 C ATOM 0 H ALA A 30 -1.929 9.487 -5.991 1.00 0.00 H new ATOM 0 HA ALA A 30 -1.314 6.746 -5.785 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -0.413 7.412 -3.565 1.00 0.00 H new ATOM 0 HB2 ALA A 30 0.059 8.570 -4.831 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -1.254 8.975 -3.700 1.00 0.00 H new ATOM 159 N ASN A 31 -3.857 7.799 -3.968 1.00 0.00 N ATOM 160 CA ASN A 31 -4.999 7.338 -3.189 1.00 0.00 C ATOM 161 C ASN A 31 -5.892 6.431 -4.028 1.00 0.00 C ATOM 162 O ASN A 31 -6.359 5.395 -3.556 1.00 0.00 O ATOM 163 CB ASN A 31 -5.810 8.540 -2.699 1.00 0.00 C ATOM 164 CG ASN A 31 -5.011 9.334 -1.670 1.00 0.00 C ATOM 165 OD1 ASN A 31 -5.182 10.550 -1.559 1.00 0.00 O ATOM 166 ND2 ASN A 31 -4.148 8.726 -0.904 1.00 0.00 N ATOM 0 H ASN A 31 -3.831 8.805 -4.134 1.00 0.00 H new ATOM 0 HA ASN A 31 -4.628 6.772 -2.335 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -6.069 9.181 -3.542 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -6.747 8.200 -2.258 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -3.616 9.256 -0.214 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -4.005 7.720 -0.995 1.00 0.00 H new ATOM 173 N ILE A 32 -6.126 6.824 -5.278 1.00 0.00 N ATOM 174 CA ILE A 32 -6.968 6.034 -6.170 1.00 0.00 C ATOM 175 C ILE A 32 -6.314 4.684 -6.462 1.00 0.00 C ATOM 176 O ILE A 32 -6.976 3.645 -6.439 1.00 0.00 O ATOM 177 CB ILE A 32 -7.197 6.796 -7.478 1.00 0.00 C ATOM 178 CG1 ILE A 32 -8.045 8.038 -7.198 1.00 0.00 C ATOM 179 CG2 ILE A 32 -7.932 5.899 -8.479 1.00 0.00 C ATOM 180 CD1 ILE A 32 -8.040 8.947 -8.428 1.00 0.00 C ATOM 0 H ILE A 32 -5.748 7.676 -5.692 1.00 0.00 H new ATOM 0 HA ILE A 32 -7.927 5.859 -5.683 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.235 7.091 -7.896 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -9.066 7.746 -6.952 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -7.650 8.574 -6.335 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -8.093 6.446 -9.408 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -7.333 5.011 -8.680 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -8.894 5.601 -8.062 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -8.644 9.832 -8.229 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -7.017 9.249 -8.653 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -8.455 8.409 -9.280 1.00 0.00 H new ATOM 192 N ILE A 33 -5.016 4.710 -6.739 1.00 0.00 N ATOM 193 CA ILE A 33 -4.281 3.487 -7.037 1.00 0.00 C ATOM 194 C ILE A 33 -4.264 2.554 -5.823 1.00 0.00 C ATOM 195 O ILE A 33 -4.465 1.347 -5.957 1.00 0.00 O ATOM 196 CB ILE A 33 -2.846 3.832 -7.454 1.00 0.00 C ATOM 197 CG1 ILE A 33 -2.862 4.532 -8.817 1.00 0.00 C ATOM 198 CG2 ILE A 33 -2.009 2.552 -7.548 1.00 0.00 C ATOM 199 CD1 ILE A 33 -1.482 5.132 -9.103 1.00 0.00 C ATOM 0 H ILE A 33 -4.453 5.560 -6.764 1.00 0.00 H new ATOM 0 HA ILE A 33 -4.782 2.973 -7.857 1.00 0.00 H new ATOM 0 HB ILE A 33 -2.407 4.495 -6.708 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -3.130 3.821 -9.599 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -3.619 5.316 -8.826 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -0.991 2.804 -7.845 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.992 2.056 -6.577 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -2.448 1.884 -8.289 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -1.495 5.629 -10.073 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -1.232 5.856 -8.327 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -0.735 4.338 -9.113 1.00 0.00 H new ATOM 211 N GLY A 34 -4.015 3.117 -4.645 1.00 0.00 N ATOM 212 CA GLY A 34 -3.968 2.316 -3.426 1.00 0.00 C ATOM 213 C GLY A 34 -5.318 1.662 -3.148 1.00 0.00 C ATOM 214 O GLY A 34 -5.396 0.469 -2.847 1.00 0.00 O ATOM 0 H GLY A 34 -3.844 4.113 -4.508 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -3.201 1.548 -3.521 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -3.685 2.947 -2.583 1.00 0.00 H new ATOM 218 N ILE A 35 -6.381 2.447 -3.260 1.00 0.00 N ATOM 219 CA ILE A 35 -7.724 1.934 -3.023 1.00 0.00 C ATOM 220 C ILE A 35 -8.067 0.860 -4.053 1.00 0.00 C ATOM 221 O ILE A 35 -8.627 -0.182 -3.714 1.00 0.00 O ATOM 222 CB ILE A 35 -8.738 3.079 -3.104 1.00 0.00 C ATOM 223 CG1 ILE A 35 -8.512 4.033 -1.926 1.00 0.00 C ATOM 224 CG2 ILE A 35 -10.158 2.511 -3.032 1.00 0.00 C ATOM 225 CD1 ILE A 35 -9.266 5.339 -2.175 1.00 0.00 C ATOM 0 H ILE A 35 -6.341 3.435 -3.512 1.00 0.00 H new ATOM 0 HA ILE A 35 -7.763 1.491 -2.028 1.00 0.00 H new ATOM 0 HB ILE A 35 -8.610 3.616 -4.044 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -8.857 3.573 -1.000 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -7.447 4.233 -1.805 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -10.879 3.326 -3.090 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -10.318 1.825 -3.864 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -10.289 1.977 -2.091 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -9.105 6.017 -1.337 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -8.900 5.801 -3.092 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -10.331 5.131 -2.274 1.00 0.00 H new ATOM 237 N LEU A 36 -7.720 1.121 -5.308 1.00 0.00 N ATOM 238 CA LEU A 36 -7.996 0.170 -6.379 1.00 0.00 C ATOM 239 C LEU A 36 -7.284 -1.147 -6.099 1.00 0.00 C ATOM 240 O LEU A 36 -7.824 -2.221 -6.363 1.00 0.00 O ATOM 241 CB LEU A 36 -7.530 0.736 -7.726 1.00 0.00 C ATOM 242 CG LEU A 36 -7.848 -0.251 -8.861 1.00 0.00 C ATOM 243 CD1 LEU A 36 -9.365 -0.504 -8.942 1.00 0.00 C ATOM 244 CD2 LEU A 36 -7.350 0.338 -10.185 1.00 0.00 C ATOM 0 H LEU A 36 -7.251 1.976 -5.608 1.00 0.00 H new ATOM 0 HA LEU A 36 -9.071 -0.005 -6.423 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -8.022 1.690 -7.917 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -6.458 0.931 -7.695 1.00 0.00 H new ATOM 0 HG LEU A 36 -7.349 -1.200 -8.665 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -9.574 -1.205 -9.750 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -9.715 -0.923 -7.999 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -9.881 0.437 -9.135 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -7.571 -0.355 -10.997 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -7.851 1.288 -10.372 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -6.274 0.500 -10.129 1.00 0.00 H new ATOM 256 N HIS A 37 -6.074 -1.058 -5.560 1.00 0.00 N ATOM 257 CA HIS A 37 -5.306 -2.257 -5.247 1.00 0.00 C ATOM 258 C HIS A 37 -6.095 -3.142 -4.294 1.00 0.00 C ATOM 259 O HIS A 37 -6.127 -4.363 -4.450 1.00 0.00 O ATOM 260 CB HIS A 37 -3.979 -1.874 -4.595 1.00 0.00 C ATOM 261 CG HIS A 37 -3.183 -3.120 -4.322 1.00 0.00 C ATOM 262 ND1 HIS A 37 -1.947 -3.353 -4.899 1.00 0.00 N ATOM 263 CD2 HIS A 37 -3.440 -4.217 -3.539 1.00 0.00 C ATOM 264 CE1 HIS A 37 -1.514 -4.547 -4.460 1.00 0.00 C ATOM 265 NE2 HIS A 37 -2.384 -5.115 -3.628 1.00 0.00 N ATOM 0 H HIS A 37 -5.608 -0.180 -5.333 1.00 0.00 H new ATOM 0 HA HIS A 37 -5.111 -2.799 -6.172 1.00 0.00 H new ATOM 0 HB2 HIS A 37 -3.418 -1.206 -5.249 1.00 0.00 H new ATOM 0 HB3 HIS A 37 -4.160 -1.333 -3.666 1.00 0.00 H new ATOM 0 HD2 HIS A 37 -4.329 -4.361 -2.943 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -0.573 -4.992 -4.748 1.00 0.00 H new ATOM 0 HE2 HIS A 37 -2.295 -6.015 -3.157 1.00 0.00 H new ATOM 273 N LEU A 38 -6.732 -2.525 -3.307 1.00 0.00 N ATOM 274 CA LEU A 38 -7.519 -3.277 -2.335 1.00 0.00 C ATOM 275 C LEU A 38 -8.650 -4.035 -3.015 1.00 0.00 C ATOM 276 O LEU A 38 -8.939 -5.168 -2.647 1.00 0.00 O ATOM 277 CB LEU A 38 -8.094 -2.324 -1.266 1.00 0.00 C ATOM 278 CG LEU A 38 -7.119 -2.200 -0.077 1.00 0.00 C ATOM 279 CD1 LEU A 38 -7.365 -0.887 0.663 1.00 0.00 C ATOM 280 CD2 LEU A 38 -7.327 -3.375 0.895 1.00 0.00 C ATOM 0 H LEU A 38 -6.721 -1.516 -3.158 1.00 0.00 H new ATOM 0 HA LEU A 38 -6.861 -4.002 -1.855 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -8.272 -1.341 -1.703 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -9.057 -2.697 -0.918 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.098 -2.218 -0.457 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.673 -0.807 1.501 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.209 -0.051 -0.018 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -8.389 -0.865 1.035 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.635 -3.281 1.732 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -8.351 -3.362 1.267 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -7.142 -4.315 0.375 1.00 0.00 H new ATOM 292 N ILE A 39 -9.291 -3.409 -3.990 1.00 0.00 N ATOM 293 CA ILE A 39 -10.401 -4.055 -4.683 1.00 0.00 C ATOM 294 C ILE A 39 -9.936 -5.341 -5.367 1.00 0.00 C ATOM 295 O ILE A 39 -10.596 -6.376 -5.271 1.00 0.00 O ATOM 296 CB ILE A 39 -10.970 -3.107 -5.735 1.00 0.00 C ATOM 297 CG1 ILE A 39 -11.286 -1.749 -5.091 1.00 0.00 C ATOM 298 CG2 ILE A 39 -12.244 -3.706 -6.339 1.00 0.00 C ATOM 299 CD1 ILE A 39 -12.191 -1.923 -3.866 1.00 0.00 C ATOM 0 H ILE A 39 -9.069 -2.469 -4.317 1.00 0.00 H new ATOM 0 HA ILE A 39 -11.168 -4.302 -3.949 1.00 0.00 H new ATOM 0 HB ILE A 39 -10.234 -2.965 -6.526 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -10.359 -1.257 -4.797 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -11.773 -1.101 -5.819 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -12.646 -3.025 -7.089 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -12.010 -4.663 -6.805 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -12.984 -3.857 -5.553 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -12.401 -0.948 -3.427 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -13.126 -2.394 -4.169 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -11.690 -2.552 -3.130 1.00 0.00 H new ATOM 311 N LEU A 40 -8.806 -5.278 -6.060 1.00 0.00 N ATOM 312 CA LEU A 40 -8.287 -6.458 -6.746 1.00 0.00 C ATOM 313 C LEU A 40 -7.690 -7.455 -5.751 1.00 0.00 C ATOM 314 O LEU A 40 -7.945 -8.656 -5.835 1.00 0.00 O ATOM 315 CB LEU A 40 -7.221 -6.048 -7.767 1.00 0.00 C ATOM 316 CG LEU A 40 -6.715 -7.281 -8.538 1.00 0.00 C ATOM 317 CD1 LEU A 40 -7.874 -7.957 -9.296 1.00 0.00 C ATOM 318 CD2 LEU A 40 -5.637 -6.833 -9.528 1.00 0.00 C ATOM 0 H LEU A 40 -8.238 -4.437 -6.162 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.118 -6.940 -7.262 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -7.637 -5.320 -8.464 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.388 -5.562 -7.258 1.00 0.00 H new ATOM 0 HG LEU A 40 -6.300 -8.003 -7.835 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -7.498 -8.826 -9.835 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.638 -8.273 -8.586 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -8.307 -7.250 -10.004 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -5.269 -7.697 -10.081 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -6.061 -6.110 -10.225 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -4.812 -6.373 -8.984 1.00 0.00 H new ATOM 330 N TRP A 41 -6.879 -6.950 -4.822 1.00 0.00 N ATOM 331 CA TRP A 41 -6.237 -7.811 -3.833 1.00 0.00 C ATOM 332 C TRP A 41 -7.270 -8.513 -2.956 1.00 0.00 C ATOM 333 O TRP A 41 -7.188 -9.722 -2.740 1.00 0.00 O ATOM 334 CB TRP A 41 -5.283 -6.981 -2.962 1.00 0.00 C ATOM 335 CG TRP A 41 -4.804 -7.793 -1.797 1.00 0.00 C ATOM 336 CD1 TRP A 41 -3.764 -8.660 -1.817 1.00 0.00 C ATOM 337 CD2 TRP A 41 -5.312 -7.802 -0.434 1.00 0.00 C ATOM 338 NE1 TRP A 41 -3.622 -9.216 -0.558 1.00 0.00 N ATOM 339 CE2 TRP A 41 -4.552 -8.714 0.329 1.00 0.00 C ATOM 340 CE3 TRP A 41 -6.358 -7.114 0.204 1.00 0.00 C ATOM 341 CZ2 TRP A 41 -4.817 -8.933 1.678 1.00 0.00 C ATOM 342 CZ3 TRP A 41 -6.621 -7.330 1.565 1.00 0.00 C ATOM 343 CH2 TRP A 41 -5.854 -8.237 2.298 1.00 0.00 C ATOM 0 H TRP A 41 -6.653 -5.959 -4.735 1.00 0.00 H new ATOM 0 HA TRP A 41 -5.671 -8.577 -4.364 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -4.432 -6.649 -3.557 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -5.792 -6.085 -2.605 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -3.147 -8.881 -2.675 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -2.916 -9.912 -0.315 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -6.962 -6.416 -0.356 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -4.223 -9.638 2.241 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -7.422 -6.791 2.049 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -6.064 -8.400 3.345 1.00 0.00 H new ATOM 354 N ILE A 42 -8.228 -7.754 -2.444 1.00 0.00 N ATOM 355 CA ILE A 42 -9.248 -8.331 -1.582 1.00 0.00 C ATOM 356 C ILE A 42 -10.116 -9.308 -2.372 1.00 0.00 C ATOM 357 O ILE A 42 -10.481 -10.372 -1.875 1.00 0.00 O ATOM 358 CB ILE A 42 -10.117 -7.217 -0.969 1.00 0.00 C ATOM 359 CG1 ILE A 42 -10.894 -7.766 0.229 1.00 0.00 C ATOM 360 CG2 ILE A 42 -11.115 -6.679 -2.008 1.00 0.00 C ATOM 361 CD1 ILE A 42 -11.572 -6.606 0.956 1.00 0.00 C ATOM 0 H ILE A 42 -8.320 -6.751 -2.607 1.00 0.00 H new ATOM 0 HA ILE A 42 -8.759 -8.876 -0.775 1.00 0.00 H new ATOM 0 HB ILE A 42 -9.462 -6.407 -0.648 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -11.639 -8.488 -0.105 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -10.220 -8.292 0.905 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -11.721 -5.893 -1.558 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -10.570 -6.274 -2.860 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -11.763 -7.489 -2.344 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -12.128 -6.988 1.812 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -10.816 -5.901 1.301 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -12.256 -6.100 0.275 1.00 0.00 H new ATOM 373 N LEU A 43 -10.441 -8.934 -3.606 1.00 0.00 N ATOM 374 CA LEU A 43 -11.265 -9.779 -4.457 1.00 0.00 C ATOM 375 C LEU A 43 -10.563 -11.101 -4.749 1.00 0.00 C ATOM 376 O LEU A 43 -11.187 -12.161 -4.735 1.00 0.00 O ATOM 377 CB LEU A 43 -11.572 -9.054 -5.774 1.00 0.00 C ATOM 378 CG LEU A 43 -12.390 -9.959 -6.710 1.00 0.00 C ATOM 379 CD1 LEU A 43 -13.679 -10.421 -6.010 1.00 0.00 C ATOM 380 CD2 LEU A 43 -12.748 -9.177 -7.977 1.00 0.00 C ATOM 0 H LEU A 43 -10.147 -8.056 -4.035 1.00 0.00 H new ATOM 0 HA LEU A 43 -12.197 -9.989 -3.933 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -12.125 -8.137 -5.571 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -10.641 -8.764 -6.261 1.00 0.00 H new ATOM 0 HG LEU A 43 -11.797 -10.836 -6.970 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -14.249 -11.061 -6.683 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -13.424 -10.978 -5.109 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -14.279 -9.551 -5.741 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -13.328 -9.813 -8.645 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -13.337 -8.300 -7.709 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -11.834 -8.861 -8.480 1.00 0.00 H new ATOM 392 N ASP A 44 -9.265 -11.030 -5.025 1.00 0.00 N ATOM 393 CA ASP A 44 -8.501 -12.231 -5.333 1.00 0.00 C ATOM 394 C ASP A 44 -8.572 -13.222 -4.176 1.00 0.00 C ATOM 395 O ASP A 44 -8.778 -14.417 -4.383 1.00 0.00 O ATOM 396 CB ASP A 44 -7.043 -11.863 -5.604 1.00 0.00 C ATOM 397 CG ASP A 44 -6.309 -13.059 -6.197 1.00 0.00 C ATOM 398 OD1 ASP A 44 -6.650 -13.450 -7.302 1.00 0.00 O ATOM 399 OD2 ASP A 44 -5.418 -13.569 -5.538 1.00 0.00 O ATOM 0 H ASP A 44 -8.726 -10.164 -5.042 1.00 0.00 H new ATOM 0 HA ASP A 44 -8.930 -12.696 -6.220 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -6.994 -11.018 -6.291 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -6.559 -11.551 -4.678 1.00 0.00 H new ATOM 404 N ARG A 45 -8.405 -12.715 -2.961 1.00 0.00 N ATOM 405 CA ARG A 45 -8.458 -13.568 -1.782 1.00 0.00 C ATOM 406 C ARG A 45 -9.873 -14.092 -1.559 1.00 0.00 C ATOM 407 O ARG A 45 -10.074 -15.084 -0.860 1.00 0.00 O ATOM 408 CB ARG A 45 -8.000 -12.784 -0.550 1.00 0.00 C ATOM 409 CG ARG A 45 -8.070 -13.685 0.685 1.00 0.00 C ATOM 410 CD ARG A 45 -7.401 -12.984 1.869 1.00 0.00 C ATOM 411 NE ARG A 45 -5.961 -12.897 1.652 1.00 0.00 N ATOM 412 CZ ARG A 45 -5.201 -12.101 2.396 1.00 0.00 C ATOM 413 NH1 ARG A 45 -5.738 -11.369 3.331 1.00 0.00 N ATOM 414 NH2 ARG A 45 -3.913 -12.052 2.188 1.00 0.00 N ATOM 0 H ARG A 45 -8.234 -11.728 -2.768 1.00 0.00 H new ATOM 0 HA ARG A 45 -7.792 -14.416 -1.941 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -6.981 -12.424 -0.693 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -8.631 -11.907 -0.409 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -9.109 -13.912 0.924 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -7.574 -14.635 0.484 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -7.819 -11.985 1.993 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -7.606 -13.532 2.789 1.00 0.00 H new ATOM 0 HE ARG A 45 -5.530 -13.457 0.916 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -6.744 -11.406 3.493 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -5.152 -10.759 3.901 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -3.493 -12.624 1.456 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -3.327 -11.442 2.758 1.00 0.00 H new ATOM 428 N LEU A 46 -10.856 -13.413 -2.144 1.00 0.00 N ATOM 429 CA LEU A 46 -12.244 -13.825 -1.981 1.00 0.00 C ATOM 430 C LEU A 46 -12.455 -15.224 -2.572 1.00 0.00 C ATOM 431 O LEU A 46 -13.004 -16.110 -1.918 1.00 0.00 O ATOM 432 CB LEU A 46 -13.164 -12.808 -2.682 1.00 0.00 C ATOM 433 CG LEU A 46 -14.557 -12.804 -2.036 1.00 0.00 C ATOM 434 CD1 LEU A 46 -15.430 -11.757 -2.734 1.00 0.00 C ATOM 435 CD2 LEU A 46 -15.209 -14.190 -2.162 1.00 0.00 C ATOM 0 H LEU A 46 -10.719 -12.587 -2.727 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.487 -13.859 -0.919 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -12.726 -11.812 -2.621 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -13.249 -13.055 -3.740 1.00 0.00 H new ATOM 0 HG LEU A 46 -14.461 -12.560 -0.978 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -16.421 -11.749 -2.280 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -14.974 -10.773 -2.627 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -15.518 -12.003 -3.792 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -16.196 -14.171 -1.699 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -15.307 -14.452 -3.216 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -14.587 -14.932 -1.660 1.00 0.00 H new ATOM 447 N PHE A 47 -11.999 -15.420 -3.809 1.00 0.00 N ATOM 448 CA PHE A 47 -12.134 -16.715 -4.469 1.00 0.00 C ATOM 449 C PHE A 47 -11.324 -17.784 -3.743 1.00 0.00 C ATOM 450 O PHE A 47 -11.808 -18.892 -3.511 1.00 0.00 O ATOM 451 CB PHE A 47 -11.672 -16.616 -5.925 1.00 0.00 C ATOM 452 CG PHE A 47 -12.671 -15.803 -6.717 1.00 0.00 C ATOM 453 CD1 PHE A 47 -13.793 -16.427 -7.271 1.00 0.00 C ATOM 454 CD2 PHE A 47 -12.475 -14.428 -6.893 1.00 0.00 C ATOM 455 CE1 PHE A 47 -14.723 -15.678 -8.004 1.00 0.00 C ATOM 456 CE2 PHE A 47 -13.403 -13.678 -7.625 1.00 0.00 C ATOM 457 CZ PHE A 47 -14.527 -14.302 -8.179 1.00 0.00 C ATOM 0 H PHE A 47 -11.537 -14.704 -4.369 1.00 0.00 H new ATOM 0 HA PHE A 47 -13.186 -17.000 -4.443 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -10.688 -16.151 -5.974 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -11.575 -17.613 -6.356 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -13.943 -17.488 -7.134 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -11.609 -13.946 -6.464 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -15.589 -16.160 -8.433 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -13.252 -12.618 -7.762 1.00 0.00 H new ATOM 0 HZ PHE A 47 -15.244 -13.722 -8.742 1.00 0.00 H new ATOM 467 N PHE A 48 -10.085 -17.447 -3.394 1.00 0.00 N ATOM 468 CA PHE A 48 -9.200 -18.382 -2.694 1.00 0.00 C ATOM 469 C PHE A 48 -8.983 -17.937 -1.254 1.00 0.00 C ATOM 470 O PHE A 48 -8.504 -16.834 -1.000 1.00 0.00 O ATOM 471 CB PHE A 48 -7.854 -18.446 -3.417 1.00 0.00 C ATOM 472 CG PHE A 48 -8.008 -19.231 -4.698 1.00 0.00 C ATOM 473 CD1 PHE A 48 -8.506 -18.606 -5.848 1.00 0.00 C ATOM 474 CD2 PHE A 48 -7.659 -20.587 -4.735 1.00 0.00 C ATOM 475 CE1 PHE A 48 -8.652 -19.335 -7.034 1.00 0.00 C ATOM 476 CE2 PHE A 48 -7.805 -21.316 -5.921 1.00 0.00 C ATOM 477 CZ PHE A 48 -8.302 -20.689 -7.071 1.00 0.00 C ATOM 0 H PHE A 48 -9.669 -16.535 -3.583 1.00 0.00 H new ATOM 0 HA PHE A 48 -9.665 -19.368 -2.689 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -7.498 -17.439 -3.635 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -7.107 -18.916 -2.777 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -8.778 -17.561 -5.820 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -7.277 -21.070 -3.848 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -9.035 -18.852 -7.921 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -7.535 -22.361 -5.950 1.00 0.00 H new ATOM 0 HZ PHE A 48 -8.415 -21.251 -7.986 1.00 0.00 H new ATOM 487 N LYS A 49 -9.338 -18.807 -0.318 1.00 0.00 N ATOM 488 CA LYS A 49 -9.180 -18.496 1.094 1.00 0.00 C ATOM 489 C LYS A 49 -7.701 -18.472 1.472 1.00 0.00 C ATOM 490 O LYS A 49 -6.941 -19.204 0.861 1.00 0.00 O ATOM 491 CB LYS A 49 -9.908 -19.546 1.939 1.00 0.00 C ATOM 492 CG LYS A 49 -11.376 -19.654 1.505 1.00 0.00 C ATOM 493 CD LYS A 49 -12.118 -18.344 1.797 1.00 0.00 C ATOM 494 CE LYS A 49 -13.628 -18.594 1.784 1.00 0.00 C ATOM 495 NZ LYS A 49 -14.051 -19.006 0.415 1.00 0.00 N ATOM 496 OXT LYS A 49 -7.350 -17.718 2.366 1.00 0.00 O ATOM 0 H LYS A 49 -9.734 -19.727 -0.510 1.00 0.00 H new ATOM 0 HA LYS A 49 -9.609 -17.512 1.285 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -9.418 -20.513 1.831 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -9.852 -19.276 2.994 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -11.431 -19.881 0.440 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -11.858 -20.478 2.032 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -11.813 -17.950 2.766 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -11.857 -17.593 1.051 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -13.885 -19.370 2.505 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -14.160 -17.691 2.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -15.089 -18.979 0.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -13.643 -18.354 -0.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -13.717 -19.972 0.225 1.00 0.00 H new TER 510 LYS A 49 ATOM 511 N SER B 19 14.022 21.288 -6.986 1.00 0.00 N ATOM 512 CA SER B 19 14.495 20.610 -5.746 1.00 0.00 C ATOM 513 C SER B 19 13.350 19.802 -5.144 1.00 0.00 C ATOM 514 O SER B 19 13.346 19.512 -3.949 1.00 0.00 O ATOM 515 CB SER B 19 14.974 21.663 -4.745 1.00 0.00 C ATOM 516 OG SER B 19 15.633 21.016 -3.665 1.00 0.00 O ATOM 0 HA SER B 19 15.321 19.939 -5.983 1.00 0.00 H new ATOM 0 HB2 SER B 19 15.652 22.364 -5.233 1.00 0.00 H new ATOM 0 HB3 SER B 19 14.128 22.242 -4.376 1.00 0.00 H new ATOM 0 HG SER B 19 15.092 20.258 -3.358 1.00 0.00 H new ATOM 524 N ASN B 20 12.384 19.439 -5.981 1.00 0.00 N ATOM 525 CA ASN B 20 11.239 18.663 -5.521 1.00 0.00 C ATOM 526 C ASN B 20 10.509 19.394 -4.399 1.00 0.00 C ATOM 527 O ASN B 20 10.076 18.780 -3.425 1.00 0.00 O ATOM 528 CB ASN B 20 11.705 17.295 -5.019 1.00 0.00 C ATOM 529 CG ASN B 20 10.508 16.365 -4.854 1.00 0.00 C ATOM 530 OD1 ASN B 20 9.590 16.382 -5.676 1.00 0.00 O ATOM 531 ND2 ASN B 20 10.459 15.554 -3.835 1.00 0.00 N ATOM 0 H ASN B 20 12.371 19.668 -6.975 1.00 0.00 H new ATOM 0 HA ASN B 20 10.554 18.531 -6.359 1.00 0.00 H new ATOM 0 HB2 ASN B 20 12.417 16.863 -5.722 1.00 0.00 H new ATOM 0 HB3 ASN B 20 12.224 17.405 -4.067 1.00 0.00 H new ATOM 0 HD21 ASN B 20 9.660 14.932 -3.717 1.00 0.00 H new ATOM 0 HD22 ASN B 20 11.220 15.542 -3.156 1.00 0.00 H new ATOM 538 N ASP B 21 10.376 20.708 -4.543 1.00 0.00 N ATOM 539 CA ASP B 21 9.696 21.512 -3.534 1.00 0.00 C ATOM 540 C ASP B 21 8.190 21.267 -3.576 1.00 0.00 C ATOM 541 O ASP B 21 7.479 21.544 -2.609 1.00 0.00 O ATOM 542 CB ASP B 21 9.979 22.996 -3.774 1.00 0.00 C ATOM 543 CG ASP B 21 11.438 23.305 -3.461 1.00 0.00 C ATOM 544 OD1 ASP B 21 12.079 22.474 -2.841 1.00 0.00 O ATOM 545 OD2 ASP B 21 11.895 24.368 -3.846 1.00 0.00 O ATOM 0 H ASP B 21 10.727 21.236 -5.342 1.00 0.00 H new ATOM 0 HA ASP B 21 10.072 21.223 -2.553 1.00 0.00 H new ATOM 0 HB2 ASP B 21 9.758 23.254 -4.810 1.00 0.00 H new ATOM 0 HB3 ASP B 21 9.327 23.605 -3.148 1.00 0.00 H new ATOM 550 N SER B 22 7.711 20.750 -4.703 1.00 0.00 N ATOM 551 CA SER B 22 6.285 20.478 -4.865 1.00 0.00 C ATOM 552 C SER B 22 5.818 19.419 -3.872 1.00 0.00 C ATOM 553 O SER B 22 4.686 19.464 -3.390 1.00 0.00 O ATOM 554 CB SER B 22 6.001 20.002 -6.288 1.00 0.00 C ATOM 555 OG SER B 22 6.746 18.820 -6.546 1.00 0.00 O ATOM 0 H SER B 22 8.284 20.512 -5.513 1.00 0.00 H new ATOM 0 HA SER B 22 5.739 21.402 -4.674 1.00 0.00 H new ATOM 0 HB2 SER B 22 4.936 19.809 -6.413 1.00 0.00 H new ATOM 0 HB3 SER B 22 6.270 20.779 -7.004 1.00 0.00 H new ATOM 0 HG SER B 22 6.564 18.511 -7.458 1.00 0.00 H new ATOM 561 N SER B 23 6.695 18.468 -3.567 1.00 0.00 N ATOM 562 CA SER B 23 6.367 17.401 -2.632 1.00 0.00 C ATOM 563 C SER B 23 7.632 16.919 -1.936 1.00 0.00 C ATOM 564 O SER B 23 8.669 16.725 -2.572 1.00 0.00 O ATOM 565 CB SER B 23 5.711 16.238 -3.377 1.00 0.00 C ATOM 566 OG SER B 23 4.594 16.722 -4.113 1.00 0.00 O ATOM 0 H SER B 23 7.637 18.416 -3.954 1.00 0.00 H new ATOM 0 HA SER B 23 5.671 17.783 -1.886 1.00 0.00 H new ATOM 0 HB2 SER B 23 6.430 15.770 -4.050 1.00 0.00 H new ATOM 0 HB3 SER B 23 5.391 15.472 -2.670 1.00 0.00 H new ATOM 0 HG SER B 23 4.904 17.124 -4.952 1.00 0.00 H new ATOM 572 N ASP B 24 7.542 16.739 -0.629 1.00 0.00 N ATOM 573 CA ASP B 24 8.692 16.292 0.149 1.00 0.00 C ATOM 574 C ASP B 24 9.227 14.955 -0.392 1.00 0.00 C ATOM 575 O ASP B 24 8.450 14.141 -0.897 1.00 0.00 O ATOM 576 CB ASP B 24 8.286 16.124 1.616 1.00 0.00 C ATOM 577 CG ASP B 24 7.406 17.291 2.054 1.00 0.00 C ATOM 578 OD1 ASP B 24 7.951 18.333 2.375 1.00 0.00 O ATOM 579 OD2 ASP B 24 6.197 17.124 2.064 1.00 0.00 O ATOM 0 H ASP B 24 6.693 16.893 -0.085 1.00 0.00 H new ATOM 0 HA ASP B 24 9.479 17.042 0.068 1.00 0.00 H new ATOM 0 HB2 ASP B 24 7.749 15.184 1.747 1.00 0.00 H new ATOM 0 HB3 ASP B 24 9.175 16.074 2.244 1.00 0.00 H new ATOM 584 N PRO B 25 10.516 14.696 -0.288 1.00 0.00 N ATOM 585 CA PRO B 25 11.105 13.410 -0.771 1.00 0.00 C ATOM 586 C PRO B 25 10.288 12.192 -0.331 1.00 0.00 C ATOM 587 O PRO B 25 10.109 11.239 -1.090 1.00 0.00 O ATOM 588 CB PRO B 25 12.496 13.380 -0.118 1.00 0.00 C ATOM 589 CG PRO B 25 12.866 14.812 0.103 1.00 0.00 C ATOM 590 CD PRO B 25 11.551 15.591 0.276 1.00 0.00 C ATOM 0 HA PRO B 25 11.129 13.362 -1.860 1.00 0.00 H new ATOM 0 HB2 PRO B 25 12.476 12.830 0.823 1.00 0.00 H new ATOM 0 HB3 PRO B 25 13.221 12.882 -0.762 1.00 0.00 H new ATOM 0 HG2 PRO B 25 13.496 14.916 0.986 1.00 0.00 H new ATOM 0 HG3 PRO B 25 13.436 15.199 -0.742 1.00 0.00 H new ATOM 0 HD2 PRO B 25 11.356 15.813 1.325 1.00 0.00 H new ATOM 0 HD3 PRO B 25 11.582 16.545 -0.251 1.00 0.00 H new ATOM 598 N LEU B 26 9.811 12.223 0.904 1.00 0.00 N ATOM 599 CA LEU B 26 9.027 11.117 1.436 1.00 0.00 C ATOM 600 C LEU B 26 7.692 10.987 0.699 1.00 0.00 C ATOM 601 O LEU B 26 7.246 9.880 0.397 1.00 0.00 O ATOM 602 CB LEU B 26 8.772 11.334 2.929 1.00 0.00 C ATOM 603 CG LEU B 26 10.094 11.250 3.704 1.00 0.00 C ATOM 604 CD1 LEU B 26 9.859 11.726 5.140 1.00 0.00 C ATOM 605 CD2 LEU B 26 10.625 9.802 3.719 1.00 0.00 C ATOM 0 H LEU B 26 9.951 12.997 1.554 1.00 0.00 H new ATOM 0 HA LEU B 26 9.592 10.196 1.291 1.00 0.00 H new ATOM 0 HB2 LEU B 26 8.308 12.307 3.090 1.00 0.00 H new ATOM 0 HB3 LEU B 26 8.075 10.583 3.300 1.00 0.00 H new ATOM 0 HG LEU B 26 10.835 11.883 3.215 1.00 0.00 H new ATOM 0 HD11 LEU B 26 10.793 11.670 5.699 1.00 0.00 H new ATOM 0 HD12 LEU B 26 9.504 12.757 5.128 1.00 0.00 H new ATOM 0 HD13 LEU B 26 9.112 11.091 5.616 1.00 0.00 H new ATOM 0 HD21 LEU B 26 11.563 9.764 4.273 1.00 0.00 H new ATOM 0 HD22 LEU B 26 9.894 9.151 4.198 1.00 0.00 H new ATOM 0 HD23 LEU B 26 10.794 9.466 2.696 1.00 0.00 H new ATOM 617 N VAL B 27 7.052 12.122 0.428 1.00 0.00 N ATOM 618 CA VAL B 27 5.761 12.115 -0.258 1.00 0.00 C ATOM 619 C VAL B 27 5.886 11.530 -1.664 1.00 0.00 C ATOM 620 O VAL B 27 5.122 10.644 -2.047 1.00 0.00 O ATOM 621 CB VAL B 27 5.226 13.550 -0.352 1.00 0.00 C ATOM 622 CG1 VAL B 27 3.964 13.580 -1.217 1.00 0.00 C ATOM 623 CG2 VAL B 27 4.896 14.063 1.051 1.00 0.00 C ATOM 0 H VAL B 27 7.401 13.050 0.670 1.00 0.00 H new ATOM 0 HA VAL B 27 5.073 11.493 0.314 1.00 0.00 H new ATOM 0 HB VAL B 27 5.985 14.187 -0.805 1.00 0.00 H new ATOM 0 HG11 VAL B 27 3.590 14.602 -1.279 1.00 0.00 H new ATOM 0 HG12 VAL B 27 4.200 13.218 -2.218 1.00 0.00 H new ATOM 0 HG13 VAL B 27 3.202 12.941 -0.771 1.00 0.00 H new ATOM 0 HG21 VAL B 27 4.516 15.082 0.986 1.00 0.00 H new ATOM 0 HG22 VAL B 27 4.140 13.422 1.504 1.00 0.00 H new ATOM 0 HG23 VAL B 27 5.797 14.050 1.664 1.00 0.00 H new ATOM 633 N VAL B 28 6.852 12.031 -2.427 1.00 0.00 N ATOM 634 CA VAL B 28 7.061 11.545 -3.788 1.00 0.00 C ATOM 635 C VAL B 28 7.603 10.126 -3.766 1.00 0.00 C ATOM 636 O VAL B 28 7.188 9.274 -4.552 1.00 0.00 O ATOM 637 CB VAL B 28 8.036 12.463 -4.524 1.00 0.00 C ATOM 638 CG1 VAL B 28 9.404 12.418 -3.850 1.00 0.00 C ATOM 639 CG2 VAL B 28 8.165 12.012 -5.980 1.00 0.00 C ATOM 0 H VAL B 28 7.496 12.765 -2.132 1.00 0.00 H new ATOM 0 HA VAL B 28 6.104 11.546 -4.310 1.00 0.00 H new ATOM 0 HB VAL B 28 7.657 13.485 -4.493 1.00 0.00 H new ATOM 0 HG11 VAL B 28 10.093 13.075 -4.381 1.00 0.00 H new ATOM 0 HG12 VAL B 28 9.311 12.749 -2.816 1.00 0.00 H new ATOM 0 HG13 VAL B 28 9.787 11.398 -3.871 1.00 0.00 H new ATOM 0 HG21 VAL B 28 8.861 12.668 -6.504 1.00 0.00 H new ATOM 0 HG22 VAL B 28 8.537 10.988 -6.012 1.00 0.00 H new ATOM 0 HG23 VAL B 28 7.189 12.058 -6.463 1.00 0.00 H new ATOM 649 N ALA B 29 8.539 9.886 -2.862 1.00 0.00 N ATOM 650 CA ALA B 29 9.146 8.567 -2.738 1.00 0.00 C ATOM 651 C ALA B 29 8.099 7.522 -2.374 1.00 0.00 C ATOM 652 O ALA B 29 8.110 6.411 -2.899 1.00 0.00 O ATOM 653 CB ALA B 29 10.235 8.586 -1.663 1.00 0.00 C ATOM 0 H ALA B 29 8.895 10.581 -2.206 1.00 0.00 H new ATOM 0 HA ALA B 29 9.587 8.307 -3.700 1.00 0.00 H new ATOM 0 HB1 ALA B 29 10.681 7.595 -1.580 1.00 0.00 H new ATOM 0 HB2 ALA B 29 11.004 9.308 -1.937 1.00 0.00 H new ATOM 0 HB3 ALA B 29 9.797 8.868 -0.706 1.00 0.00 H new ATOM 659 N ALA B 30 7.192 7.883 -1.475 1.00 0.00 N ATOM 660 CA ALA B 30 6.148 6.958 -1.055 1.00 0.00 C ATOM 661 C ALA B 30 5.263 6.579 -2.236 1.00 0.00 C ATOM 662 O ALA B 30 4.900 5.414 -2.401 1.00 0.00 O ATOM 663 CB ALA B 30 5.291 7.598 0.038 1.00 0.00 C ATOM 0 H ALA B 30 7.158 8.799 -1.027 1.00 0.00 H new ATOM 0 HA ALA B 30 6.623 6.058 -0.665 1.00 0.00 H new ATOM 0 HB1 ALA B 30 4.513 6.900 0.346 1.00 0.00 H new ATOM 0 HB2 ALA B 30 5.918 7.844 0.895 1.00 0.00 H new ATOM 0 HB3 ALA B 30 4.830 8.508 -0.347 1.00 0.00 H new ATOM 669 N ASN B 31 4.920 7.566 -3.055 1.00 0.00 N ATOM 670 CA ASN B 31 4.077 7.319 -4.216 1.00 0.00 C ATOM 671 C ASN B 31 4.787 6.406 -5.212 1.00 0.00 C ATOM 672 O ASN B 31 4.182 5.488 -5.766 1.00 0.00 O ATOM 673 CB ASN B 31 3.730 8.644 -4.896 1.00 0.00 C ATOM 674 CG ASN B 31 2.818 9.477 -4.002 1.00 0.00 C ATOM 675 OD1 ASN B 31 2.858 10.707 -4.049 1.00 0.00 O ATOM 676 ND2 ASN B 31 1.989 8.883 -3.185 1.00 0.00 N ATOM 0 H ASN B 31 5.210 8.537 -2.938 1.00 0.00 H new ATOM 0 HA ASN B 31 3.163 6.829 -3.881 1.00 0.00 H new ATOM 0 HB2 ASN B 31 4.643 9.199 -5.113 1.00 0.00 H new ATOM 0 HB3 ASN B 31 3.239 8.453 -5.850 1.00 0.00 H new ATOM 0 HD21 ASN B 31 1.376 9.438 -2.587 1.00 0.00 H new ATOM 0 HD22 ASN B 31 1.955 7.864 -3.145 1.00 0.00 H new ATOM 683 N ILE B 32 6.072 6.664 -5.437 1.00 0.00 N ATOM 684 CA ILE B 32 6.851 5.856 -6.371 1.00 0.00 C ATOM 685 C ILE B 32 6.980 4.423 -5.859 1.00 0.00 C ATOM 686 O ILE B 32 6.817 3.466 -6.617 1.00 0.00 O ATOM 687 CB ILE B 32 8.241 6.470 -6.555 1.00 0.00 C ATOM 688 CG1 ILE B 32 8.108 7.816 -7.272 1.00 0.00 C ATOM 689 CG2 ILE B 32 9.112 5.534 -7.398 1.00 0.00 C ATOM 690 CD1 ILE B 32 9.444 8.561 -7.210 1.00 0.00 C ATOM 0 H ILE B 32 6.593 7.419 -4.990 1.00 0.00 H new ATOM 0 HA ILE B 32 6.335 5.838 -7.331 1.00 0.00 H new ATOM 0 HB ILE B 32 8.704 6.615 -5.579 1.00 0.00 H new ATOM 0 HG12 ILE B 32 7.814 7.660 -8.310 1.00 0.00 H new ATOM 0 HG13 ILE B 32 7.324 8.413 -6.805 1.00 0.00 H new ATOM 0 HG21 ILE B 32 10.101 5.975 -7.527 1.00 0.00 H new ATOM 0 HG22 ILE B 32 9.206 4.572 -6.894 1.00 0.00 H new ATOM 0 HG23 ILE B 32 8.650 5.388 -8.374 1.00 0.00 H new ATOM 0 HD11 ILE B 32 9.350 9.520 -7.720 1.00 0.00 H new ATOM 0 HD12 ILE B 32 9.719 8.730 -6.169 1.00 0.00 H new ATOM 0 HD13 ILE B 32 10.216 7.965 -7.697 1.00 0.00 H new ATOM 702 N ILE B 33 7.271 4.287 -4.570 1.00 0.00 N ATOM 703 CA ILE B 33 7.421 2.968 -3.964 1.00 0.00 C ATOM 704 C ILE B 33 6.102 2.197 -4.007 1.00 0.00 C ATOM 705 O ILE B 33 6.082 1.009 -4.327 1.00 0.00 O ATOM 706 CB ILE B 33 7.895 3.116 -2.513 1.00 0.00 C ATOM 707 CG1 ILE B 33 9.335 3.644 -2.497 1.00 0.00 C ATOM 708 CG2 ILE B 33 7.844 1.758 -1.808 1.00 0.00 C ATOM 709 CD1 ILE B 33 9.709 4.067 -1.074 1.00 0.00 C ATOM 0 H ILE B 33 7.407 5.068 -3.928 1.00 0.00 H new ATOM 0 HA ILE B 33 8.163 2.407 -4.532 1.00 0.00 H new ATOM 0 HB ILE B 33 7.242 3.816 -1.992 1.00 0.00 H new ATOM 0 HG12 ILE B 33 10.020 2.873 -2.850 1.00 0.00 H new ATOM 0 HG13 ILE B 33 9.430 4.491 -3.176 1.00 0.00 H new ATOM 0 HG21 ILE B 33 8.182 1.870 -0.778 1.00 0.00 H new ATOM 0 HG22 ILE B 33 6.821 1.382 -1.815 1.00 0.00 H new ATOM 0 HG23 ILE B 33 8.493 1.053 -2.328 1.00 0.00 H new ATOM 0 HD11 ILE B 33 10.732 4.442 -1.063 1.00 0.00 H new ATOM 0 HD12 ILE B 33 9.031 4.852 -0.738 1.00 0.00 H new ATOM 0 HD13 ILE B 33 9.630 3.209 -0.407 1.00 0.00 H new ATOM 721 N GLY B 34 5.007 2.874 -3.677 1.00 0.00 N ATOM 722 CA GLY B 34 3.696 2.229 -3.678 1.00 0.00 C ATOM 723 C GLY B 34 3.324 1.749 -5.077 1.00 0.00 C ATOM 724 O GLY B 34 2.876 0.615 -5.262 1.00 0.00 O ATOM 0 H GLY B 34 4.999 3.858 -3.408 1.00 0.00 H new ATOM 0 HA2 GLY B 34 3.702 1.384 -2.989 1.00 0.00 H new ATOM 0 HA3 GLY B 34 2.942 2.929 -3.317 1.00 0.00 H new ATOM 728 N ILE B 35 3.520 2.616 -6.064 1.00 0.00 N ATOM 729 CA ILE B 35 3.206 2.269 -7.442 1.00 0.00 C ATOM 730 C ILE B 35 4.090 1.115 -7.909 1.00 0.00 C ATOM 731 O ILE B 35 3.617 0.182 -8.557 1.00 0.00 O ATOM 732 CB ILE B 35 3.416 3.489 -8.343 1.00 0.00 C ATOM 733 CG1 ILE B 35 2.369 4.553 -8.000 1.00 0.00 C ATOM 734 CG2 ILE B 35 3.259 3.075 -9.810 1.00 0.00 C ATOM 735 CD1 ILE B 35 2.769 5.888 -8.628 1.00 0.00 C ATOM 0 H ILE B 35 3.892 3.557 -5.936 1.00 0.00 H new ATOM 0 HA ILE B 35 2.163 1.956 -7.501 1.00 0.00 H new ATOM 0 HB ILE B 35 4.416 3.892 -8.186 1.00 0.00 H new ATOM 0 HG12 ILE B 35 1.390 4.246 -8.367 1.00 0.00 H new ATOM 0 HG13 ILE B 35 2.285 4.659 -6.918 1.00 0.00 H new ATOM 0 HG21 ILE B 35 3.409 3.944 -10.451 1.00 0.00 H new ATOM 0 HG22 ILE B 35 3.999 2.312 -10.054 1.00 0.00 H new ATOM 0 HG23 ILE B 35 2.258 2.674 -9.970 1.00 0.00 H new ATOM 0 HD11 ILE B 35 2.023 6.644 -8.383 1.00 0.00 H new ATOM 0 HD12 ILE B 35 3.739 6.197 -8.239 1.00 0.00 H new ATOM 0 HD13 ILE B 35 2.831 5.777 -9.711 1.00 0.00 H new ATOM 747 N LEU B 36 5.372 1.186 -7.570 1.00 0.00 N ATOM 748 CA LEU B 36 6.312 0.142 -7.960 1.00 0.00 C ATOM 749 C LEU B 36 5.879 -1.195 -7.372 1.00 0.00 C ATOM 750 O LEU B 36 5.999 -2.236 -8.018 1.00 0.00 O ATOM 751 CB LEU B 36 7.726 0.489 -7.473 1.00 0.00 C ATOM 752 CG LEU B 36 8.726 -0.594 -7.912 1.00 0.00 C ATOM 753 CD1 LEU B 36 8.758 -0.706 -9.447 1.00 0.00 C ATOM 754 CD2 LEU B 36 10.118 -0.224 -7.391 1.00 0.00 C ATOM 0 H LEU B 36 5.782 1.949 -7.031 1.00 0.00 H new ATOM 0 HA LEU B 36 6.321 0.070 -9.048 1.00 0.00 H new ATOM 0 HB2 LEU B 36 8.028 1.456 -7.874 1.00 0.00 H new ATOM 0 HB3 LEU B 36 7.731 0.579 -6.387 1.00 0.00 H new ATOM 0 HG LEU B 36 8.418 -1.556 -7.503 1.00 0.00 H new ATOM 0 HD11 LEU B 36 9.471 -1.477 -9.741 1.00 0.00 H new ATOM 0 HD12 LEU B 36 7.766 -0.970 -9.813 1.00 0.00 H new ATOM 0 HD13 LEU B 36 9.060 0.250 -9.875 1.00 0.00 H new ATOM 0 HD21 LEU B 36 10.835 -0.986 -7.697 1.00 0.00 H new ATOM 0 HD22 LEU B 36 10.416 0.741 -7.802 1.00 0.00 H new ATOM 0 HD23 LEU B 36 10.095 -0.163 -6.303 1.00 0.00 H new ATOM 766 N HIS B 37 5.370 -1.161 -6.144 1.00 0.00 N ATOM 767 CA HIS B 37 4.920 -2.382 -5.488 1.00 0.00 C ATOM 768 C HIS B 37 3.854 -3.061 -6.335 1.00 0.00 C ATOM 769 O HIS B 37 3.857 -4.282 -6.490 1.00 0.00 O ATOM 770 CB HIS B 37 4.338 -2.055 -4.113 1.00 0.00 C ATOM 771 CG HIS B 37 3.916 -3.330 -3.435 1.00 0.00 C ATOM 772 ND1 HIS B 37 4.467 -3.752 -2.238 1.00 0.00 N ATOM 773 CD2 HIS B 37 3.000 -4.291 -3.779 1.00 0.00 C ATOM 774 CE1 HIS B 37 3.886 -4.919 -1.914 1.00 0.00 C ATOM 775 NE2 HIS B 37 2.983 -5.292 -2.818 1.00 0.00 N ATOM 0 H HIS B 37 5.260 -0.312 -5.590 1.00 0.00 H new ATOM 0 HA HIS B 37 5.773 -3.050 -5.370 1.00 0.00 H new ATOM 0 HB2 HIS B 37 5.079 -1.535 -3.506 1.00 0.00 H new ATOM 0 HB3 HIS B 37 3.484 -1.385 -4.217 1.00 0.00 H new ATOM 0 HD2 HIS B 37 2.384 -4.272 -4.666 1.00 0.00 H new ATOM 0 HE1 HIS B 37 4.123 -5.487 -1.026 1.00 0.00 H new ATOM 0 HE2 HIS B 37 2.404 -6.132 -2.807 1.00 0.00 H new ATOM 783 N LEU B 38 2.946 -2.266 -6.887 1.00 0.00 N ATOM 784 CA LEU B 38 1.879 -2.813 -7.720 1.00 0.00 C ATOM 785 C LEU B 38 2.447 -3.534 -8.934 1.00 0.00 C ATOM 786 O LEU B 38 1.938 -4.580 -9.322 1.00 0.00 O ATOM 787 CB LEU B 38 0.930 -1.685 -8.177 1.00 0.00 C ATOM 788 CG LEU B 38 -0.225 -1.514 -7.169 1.00 0.00 C ATOM 789 CD1 LEU B 38 -0.802 -0.106 -7.272 1.00 0.00 C ATOM 790 CD2 LEU B 38 -1.333 -2.539 -7.473 1.00 0.00 C ATOM 0 H LEU B 38 2.925 -1.252 -6.776 1.00 0.00 H new ATOM 0 HA LEU B 38 1.321 -3.534 -7.123 1.00 0.00 H new ATOM 0 HB2 LEU B 38 1.483 -0.750 -8.268 1.00 0.00 H new ATOM 0 HB3 LEU B 38 0.529 -1.916 -9.164 1.00 0.00 H new ATOM 0 HG LEU B 38 0.158 -1.675 -6.161 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -1.617 0.006 -6.557 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -0.023 0.624 -7.052 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -1.179 0.060 -8.281 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -2.148 -2.416 -6.760 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -1.709 -2.380 -8.484 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -0.928 -3.548 -7.391 1.00 0.00 H new ATOM 802 N ILE B 39 3.484 -2.975 -9.535 1.00 0.00 N ATOM 803 CA ILE B 39 4.077 -3.589 -10.716 1.00 0.00 C ATOM 804 C ILE B 39 4.601 -4.988 -10.393 1.00 0.00 C ATOM 805 O ILE B 39 4.370 -5.934 -11.145 1.00 0.00 O ATOM 806 CB ILE B 39 5.233 -2.725 -11.217 1.00 0.00 C ATOM 807 CG1 ILE B 39 4.760 -1.275 -11.387 1.00 0.00 C ATOM 808 CG2 ILE B 39 5.742 -3.267 -12.556 1.00 0.00 C ATOM 809 CD1 ILE B 39 3.512 -1.209 -12.277 1.00 0.00 C ATOM 0 H ILE B 39 3.929 -2.109 -9.232 1.00 0.00 H new ATOM 0 HA ILE B 39 3.309 -3.668 -11.485 1.00 0.00 H new ATOM 0 HB ILE B 39 6.044 -2.753 -10.489 1.00 0.00 H new ATOM 0 HG12 ILE B 39 4.539 -0.843 -10.411 1.00 0.00 H new ATOM 0 HG13 ILE B 39 5.558 -0.677 -11.827 1.00 0.00 H new ATOM 0 HG21 ILE B 39 6.566 -2.648 -12.909 1.00 0.00 H new ATOM 0 HG22 ILE B 39 6.088 -4.292 -12.426 1.00 0.00 H new ATOM 0 HG23 ILE B 39 4.934 -3.247 -13.287 1.00 0.00 H new ATOM 0 HD11 ILE B 39 3.195 -0.171 -12.383 1.00 0.00 H new ATOM 0 HD12 ILE B 39 3.744 -1.620 -13.260 1.00 0.00 H new ATOM 0 HD13 ILE B 39 2.709 -1.789 -11.821 1.00 0.00 H new ATOM 821 N LEU B 40 5.311 -5.119 -9.278 1.00 0.00 N ATOM 822 CA LEU B 40 5.849 -6.421 -8.891 1.00 0.00 C ATOM 823 C LEU B 40 4.746 -7.342 -8.368 1.00 0.00 C ATOM 824 O LEU B 40 4.676 -8.512 -8.740 1.00 0.00 O ATOM 825 CB LEU B 40 6.924 -6.246 -7.814 1.00 0.00 C ATOM 826 CG LEU B 40 7.540 -7.606 -7.443 1.00 0.00 C ATOM 827 CD1 LEU B 40 8.198 -8.253 -8.678 1.00 0.00 C ATOM 828 CD2 LEU B 40 8.590 -7.390 -6.349 1.00 0.00 C ATOM 0 H LEU B 40 5.526 -4.356 -8.636 1.00 0.00 H new ATOM 0 HA LEU B 40 6.289 -6.879 -9.777 1.00 0.00 H new ATOM 0 HB2 LEU B 40 7.702 -5.574 -8.174 1.00 0.00 H new ATOM 0 HB3 LEU B 40 6.488 -5.784 -6.928 1.00 0.00 H new ATOM 0 HG LEU B 40 6.756 -8.272 -7.082 1.00 0.00 H new ATOM 0 HD11 LEU B 40 8.629 -9.214 -8.399 1.00 0.00 H new ATOM 0 HD12 LEU B 40 7.447 -8.404 -9.453 1.00 0.00 H new ATOM 0 HD13 LEU B 40 8.984 -7.599 -9.056 1.00 0.00 H new ATOM 0 HD21 LEU B 40 9.034 -8.347 -6.077 1.00 0.00 H new ATOM 0 HD22 LEU B 40 9.367 -6.721 -6.718 1.00 0.00 H new ATOM 0 HD23 LEU B 40 8.117 -6.948 -5.472 1.00 0.00 H new ATOM 840 N TRP B 41 3.894 -6.810 -7.491 1.00 0.00 N ATOM 841 CA TRP B 41 2.813 -7.600 -6.911 1.00 0.00 C ATOM 842 C TRP B 41 1.844 -8.085 -7.986 1.00 0.00 C ATOM 843 O TRP B 41 1.481 -9.262 -8.015 1.00 0.00 O ATOM 844 CB TRP B 41 2.062 -6.766 -5.863 1.00 0.00 C ATOM 845 CG TRP B 41 0.809 -7.473 -5.437 1.00 0.00 C ATOM 846 CD1 TRP B 41 0.732 -8.433 -4.485 1.00 0.00 C ATOM 847 CD2 TRP B 41 -0.548 -7.265 -5.916 1.00 0.00 C ATOM 848 NE1 TRP B 41 -0.587 -8.840 -4.369 1.00 0.00 N ATOM 849 CE2 TRP B 41 -1.412 -8.145 -5.228 1.00 0.00 C ATOM 850 CE3 TRP B 41 -1.107 -6.406 -6.876 1.00 0.00 C ATOM 851 CZ2 TRP B 41 -2.780 -8.171 -5.487 1.00 0.00 C ATOM 852 CZ3 TRP B 41 -2.487 -6.426 -7.132 1.00 0.00 C ATOM 853 CH2 TRP B 41 -3.318 -7.306 -6.439 1.00 0.00 C ATOM 0 H TRP B 41 3.932 -5.843 -7.170 1.00 0.00 H new ATOM 0 HA TRP B 41 3.251 -8.476 -6.432 1.00 0.00 H new ATOM 0 HB2 TRP B 41 2.703 -6.594 -4.998 1.00 0.00 H new ATOM 0 HB3 TRP B 41 1.814 -5.788 -6.276 1.00 0.00 H new ATOM 0 HD1 TRP B 41 1.562 -8.818 -3.911 1.00 0.00 H new ATOM 0 HE1 TRP B 41 -0.908 -9.565 -3.727 1.00 0.00 H new ATOM 0 HE3 TRP B 41 -0.470 -5.725 -7.421 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 -3.421 -8.857 -4.953 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 -2.907 -5.757 -7.869 1.00 0.00 H new ATOM 0 HH2 TRP B 41 -4.379 -7.317 -6.640 1.00 0.00 H new ATOM 864 N ILE B 42 1.419 -7.178 -8.854 1.00 0.00 N ATOM 865 CA ILE B 42 0.480 -7.544 -9.904 1.00 0.00 C ATOM 866 C ILE B 42 1.133 -8.522 -10.880 1.00 0.00 C ATOM 867 O ILE B 42 0.503 -9.476 -11.333 1.00 0.00 O ATOM 868 CB ILE B 42 0.003 -6.283 -10.648 1.00 0.00 C ATOM 869 CG1 ILE B 42 -1.266 -6.602 -11.447 1.00 0.00 C ATOM 870 CG2 ILE B 42 1.089 -5.784 -11.617 1.00 0.00 C ATOM 871 CD1 ILE B 42 -1.850 -5.299 -11.990 1.00 0.00 C ATOM 0 H ILE B 42 1.704 -6.199 -8.853 1.00 0.00 H new ATOM 0 HA ILE B 42 -0.383 -8.031 -9.451 1.00 0.00 H new ATOM 0 HB ILE B 42 -0.204 -5.507 -9.911 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -1.034 -7.282 -12.267 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -1.995 -7.106 -10.812 1.00 0.00 H new ATOM 0 HG21 ILE B 42 0.734 -4.892 -12.134 1.00 0.00 H new ATOM 0 HG22 ILE B 42 1.993 -5.543 -11.058 1.00 0.00 H new ATOM 0 HG23 ILE B 42 1.311 -6.562 -12.347 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -2.753 -5.515 -12.560 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -2.095 -4.636 -11.160 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -1.119 -4.815 -12.638 1.00 0.00 H new ATOM 883 N LEU B 43 2.400 -8.271 -11.197 1.00 0.00 N ATOM 884 CA LEU B 43 3.130 -9.130 -12.118 1.00 0.00 C ATOM 885 C LEU B 43 3.262 -10.539 -11.551 1.00 0.00 C ATOM 886 O LEU B 43 3.110 -11.523 -12.273 1.00 0.00 O ATOM 887 CB LEU B 43 4.524 -8.544 -12.385 1.00 0.00 C ATOM 888 CG LEU B 43 5.327 -9.475 -13.311 1.00 0.00 C ATOM 889 CD1 LEU B 43 4.559 -9.718 -14.620 1.00 0.00 C ATOM 890 CD2 LEU B 43 6.678 -8.823 -13.623 1.00 0.00 C ATOM 0 H LEU B 43 2.938 -7.485 -10.832 1.00 0.00 H new ATOM 0 HA LEU B 43 2.574 -9.184 -13.054 1.00 0.00 H new ATOM 0 HB2 LEU B 43 4.430 -7.559 -12.841 1.00 0.00 H new ATOM 0 HB3 LEU B 43 5.056 -8.410 -11.443 1.00 0.00 H new ATOM 0 HG LEU B 43 5.480 -10.432 -12.813 1.00 0.00 H new ATOM 0 HD11 LEU B 43 5.139 -10.378 -15.265 1.00 0.00 H new ATOM 0 HD12 LEU B 43 3.598 -10.181 -14.397 1.00 0.00 H new ATOM 0 HD13 LEU B 43 4.395 -8.767 -15.127 1.00 0.00 H new ATOM 0 HD21 LEU B 43 7.254 -9.476 -14.279 1.00 0.00 H new ATOM 0 HD22 LEU B 43 6.514 -7.865 -14.117 1.00 0.00 H new ATOM 0 HD23 LEU B 43 7.228 -8.664 -12.695 1.00 0.00 H new ATOM 902 N ASP B 44 3.559 -10.629 -10.260 1.00 0.00 N ATOM 903 CA ASP B 44 3.724 -11.929 -9.621 1.00 0.00 C ATOM 904 C ASP B 44 2.452 -12.757 -9.759 1.00 0.00 C ATOM 905 O ASP B 44 2.505 -13.944 -10.081 1.00 0.00 O ATOM 906 CB ASP B 44 4.055 -11.740 -8.143 1.00 0.00 C ATOM 907 CG ASP B 44 4.506 -13.066 -7.540 1.00 0.00 C ATOM 908 OD1 ASP B 44 5.542 -13.561 -7.952 1.00 0.00 O ATOM 909 OD2 ASP B 44 3.808 -13.569 -6.674 1.00 0.00 O ATOM 0 H ASP B 44 3.689 -9.828 -9.642 1.00 0.00 H new ATOM 0 HA ASP B 44 4.541 -12.457 -10.112 1.00 0.00 H new ATOM 0 HB2 ASP B 44 4.840 -10.993 -8.030 1.00 0.00 H new ATOM 0 HB3 ASP B 44 3.181 -11.367 -7.610 1.00 0.00 H new ATOM 914 N ARG B 45 1.311 -12.126 -9.518 1.00 0.00 N ATOM 915 CA ARG B 45 0.034 -12.816 -9.625 1.00 0.00 C ATOM 916 C ARG B 45 -0.269 -13.167 -11.080 1.00 0.00 C ATOM 917 O ARG B 45 -1.087 -14.043 -11.357 1.00 0.00 O ATOM 918 CB ARG B 45 -1.086 -11.935 -9.067 1.00 0.00 C ATOM 919 CG ARG B 45 -2.423 -12.668 -9.193 1.00 0.00 C ATOM 920 CD ARG B 45 -3.504 -11.895 -8.433 1.00 0.00 C ATOM 921 NE ARG B 45 -3.261 -11.976 -6.998 1.00 0.00 N ATOM 922 CZ ARG B 45 -3.889 -11.173 -6.145 1.00 0.00 C ATOM 923 NH1 ARG B 45 -4.734 -10.282 -6.588 1.00 0.00 N ATOM 924 NH2 ARG B 45 -3.660 -11.275 -4.864 1.00 0.00 N ATOM 0 H ARG B 45 1.244 -11.144 -9.249 1.00 0.00 H new ATOM 0 HA ARG B 45 0.093 -13.738 -9.046 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -0.888 -11.695 -8.022 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -1.125 -10.990 -9.609 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -2.700 -12.763 -10.243 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -2.335 -13.678 -8.793 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -3.508 -10.852 -8.751 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -4.487 -12.304 -8.667 1.00 0.00 H new ATOM 0 HE ARG B 45 -2.596 -12.662 -6.641 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -4.913 -10.202 -7.589 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -5.216 -9.666 -5.933 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -2.999 -11.971 -4.518 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -4.142 -10.659 -4.209 1.00 0.00 H new ATOM 938 N LEU B 46 0.384 -12.473 -12.005 1.00 0.00 N ATOM 939 CA LEU B 46 0.157 -12.723 -13.423 1.00 0.00 C ATOM 940 C LEU B 46 0.566 -14.158 -13.780 1.00 0.00 C ATOM 941 O LEU B 46 -0.199 -14.898 -14.397 1.00 0.00 O ATOM 942 CB LEU B 46 0.967 -11.716 -14.258 1.00 0.00 C ATOM 943 CG LEU B 46 0.311 -11.495 -15.629 1.00 0.00 C ATOM 944 CD1 LEU B 46 1.124 -10.462 -16.413 1.00 0.00 C ATOM 945 CD2 LEU B 46 0.256 -12.817 -16.413 1.00 0.00 C ATOM 0 H LEU B 46 1.066 -11.742 -11.803 1.00 0.00 H new ATOM 0 HA LEU B 46 -0.903 -12.601 -13.644 1.00 0.00 H new ATOM 0 HB2 LEU B 46 1.037 -10.767 -13.726 1.00 0.00 H new ATOM 0 HB3 LEU B 46 1.985 -12.082 -14.391 1.00 0.00 H new ATOM 0 HG LEU B 46 -0.707 -11.132 -15.486 1.00 0.00 H new ATOM 0 HD11 LEU B 46 0.664 -10.300 -17.388 1.00 0.00 H new ATOM 0 HD12 LEU B 46 1.146 -9.522 -15.862 1.00 0.00 H new ATOM 0 HD13 LEU B 46 2.142 -10.827 -16.549 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -0.211 -12.646 -17.383 1.00 0.00 H new ATOM 0 HD22 LEU B 46 1.268 -13.196 -16.559 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -0.327 -13.548 -15.853 1.00 0.00 H new ATOM 957 N PHE B 47 1.773 -14.545 -13.374 1.00 0.00 N ATOM 958 CA PHE B 47 2.266 -15.893 -13.649 1.00 0.00 C ATOM 959 C PHE B 47 1.422 -16.940 -12.928 1.00 0.00 C ATOM 960 O PHE B 47 1.049 -17.958 -13.508 1.00 0.00 O ATOM 961 CB PHE B 47 3.728 -16.017 -13.213 1.00 0.00 C ATOM 962 CG PHE B 47 4.602 -15.216 -14.148 1.00 0.00 C ATOM 963 CD1 PHE B 47 5.064 -15.792 -15.338 1.00 0.00 C ATOM 964 CD2 PHE B 47 4.949 -13.899 -13.827 1.00 0.00 C ATOM 965 CE1 PHE B 47 5.872 -15.050 -16.207 1.00 0.00 C ATOM 966 CE2 PHE B 47 5.758 -13.156 -14.696 1.00 0.00 C ATOM 967 CZ PHE B 47 6.219 -13.732 -15.887 1.00 0.00 C ATOM 0 H PHE B 47 2.423 -13.951 -12.858 1.00 0.00 H new ATOM 0 HA PHE B 47 2.193 -16.069 -14.722 1.00 0.00 H new ATOM 0 HB2 PHE B 47 3.845 -15.657 -12.191 1.00 0.00 H new ATOM 0 HB3 PHE B 47 4.033 -17.063 -13.220 1.00 0.00 H new ATOM 0 HD1 PHE B 47 4.797 -16.809 -15.585 1.00 0.00 H new ATOM 0 HD2 PHE B 47 4.593 -13.455 -12.909 1.00 0.00 H new ATOM 0 HE1 PHE B 47 6.228 -15.494 -17.125 1.00 0.00 H new ATOM 0 HE2 PHE B 47 6.026 -12.140 -14.448 1.00 0.00 H new ATOM 0 HZ PHE B 47 6.842 -13.159 -16.558 1.00 0.00 H new ATOM 977 N PHE B 48 1.130 -16.684 -11.653 1.00 0.00 N ATOM 978 CA PHE B 48 0.331 -17.609 -10.845 1.00 0.00 C ATOM 979 C PHE B 48 -1.039 -17.015 -10.554 1.00 0.00 C ATOM 980 O PHE B 48 -1.150 -15.940 -9.964 1.00 0.00 O ATOM 981 CB PHE B 48 1.056 -17.893 -9.530 1.00 0.00 C ATOM 982 CG PHE B 48 2.228 -18.812 -9.790 1.00 0.00 C ATOM 983 CD1 PHE B 48 3.440 -18.285 -10.253 1.00 0.00 C ATOM 984 CD2 PHE B 48 2.098 -20.189 -9.573 1.00 0.00 C ATOM 985 CE1 PHE B 48 4.524 -19.137 -10.495 1.00 0.00 C ATOM 986 CE2 PHE B 48 3.183 -21.040 -9.816 1.00 0.00 C ATOM 987 CZ PHE B 48 4.396 -20.513 -10.276 1.00 0.00 C ATOM 0 H PHE B 48 1.433 -15.846 -11.157 1.00 0.00 H new ATOM 0 HA PHE B 48 0.199 -18.537 -11.401 1.00 0.00 H new ATOM 0 HB2 PHE B 48 1.403 -16.961 -9.085 1.00 0.00 H new ATOM 0 HB3 PHE B 48 0.371 -18.352 -8.816 1.00 0.00 H new ATOM 0 HD1 PHE B 48 3.538 -17.223 -10.423 1.00 0.00 H new ATOM 0 HD2 PHE B 48 1.162 -20.594 -9.219 1.00 0.00 H new ATOM 0 HE1 PHE B 48 5.460 -18.732 -10.851 1.00 0.00 H new ATOM 0 HE2 PHE B 48 3.084 -22.102 -9.649 1.00 0.00 H new ATOM 0 HZ PHE B 48 5.233 -21.169 -10.462 1.00 0.00 H new ATOM 997 N LYS B 49 -2.081 -17.723 -10.967 1.00 0.00 N ATOM 998 CA LYS B 49 -3.442 -17.258 -10.747 1.00 0.00 C ATOM 999 C LYS B 49 -3.797 -17.331 -9.264 1.00 0.00 C ATOM 1000 O LYS B 49 -3.276 -18.207 -8.593 1.00 0.00 O ATOM 1001 CB LYS B 49 -4.421 -18.120 -11.551 1.00 0.00 C ATOM 1002 CG LYS B 49 -4.019 -18.138 -13.034 1.00 0.00 C ATOM 1003 CD LYS B 49 -4.155 -16.734 -13.640 1.00 0.00 C ATOM 1004 CE LYS B 49 -4.188 -16.839 -15.168 1.00 0.00 C ATOM 1005 NZ LYS B 49 -2.886 -17.373 -15.657 1.00 0.00 N ATOM 1006 OXT LYS B 49 -4.583 -16.510 -8.822 1.00 0.00 O ATOM 0 H LYS B 49 -2.010 -18.617 -11.454 1.00 0.00 H new ATOM 0 HA LYS B 49 -3.513 -16.221 -11.076 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -4.430 -19.136 -11.157 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -5.433 -17.728 -11.446 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -2.991 -18.487 -13.135 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -4.649 -18.840 -13.580 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -5.065 -16.256 -13.278 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -3.320 -16.108 -13.326 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -5.002 -17.493 -15.481 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -4.379 -15.860 -15.607 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -2.828 -17.256 -16.689 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -2.106 -16.854 -15.205 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -2.813 -18.383 -15.419 1.00 0.00 H new TER 1020 LYS B 49 ATOM 1021 N SER C 19 9.593 18.971 15.669 1.00 0.00 N ATOM 1022 CA SER C 19 8.272 18.423 16.089 1.00 0.00 C ATOM 1023 C SER C 19 7.579 17.794 14.884 1.00 0.00 C ATOM 1024 O SER C 19 6.356 17.663 14.859 1.00 0.00 O ATOM 1025 CB SER C 19 7.412 19.551 16.657 1.00 0.00 C ATOM 1026 OG SER C 19 6.254 18.998 17.270 1.00 0.00 O ATOM 0 HA SER C 19 8.415 17.662 16.856 1.00 0.00 H new ATOM 0 HB2 SER C 19 7.983 20.127 17.385 1.00 0.00 H new ATOM 0 HB3 SER C 19 7.123 20.239 15.862 1.00 0.00 H new ATOM 0 HG SER C 19 5.835 18.356 16.659 1.00 0.00 H new ATOM 1034 N ASN C 20 8.369 17.408 13.889 1.00 0.00 N ATOM 1035 CA ASN C 20 7.823 16.795 12.684 1.00 0.00 C ATOM 1036 C ASN C 20 6.811 17.724 12.021 1.00 0.00 C ATOM 1037 O ASN C 20 5.769 17.278 11.538 1.00 0.00 O ATOM 1038 CB ASN C 20 7.144 15.470 13.036 1.00 0.00 C ATOM 1039 CG ASN C 20 6.869 14.672 11.768 1.00 0.00 C ATOM 1040 OD1 ASN C 20 7.691 14.658 10.851 1.00 0.00 O ATOM 1041 ND2 ASN C 20 5.751 14.007 11.656 1.00 0.00 N ATOM 0 H ASN C 20 9.384 17.508 13.892 1.00 0.00 H new ATOM 0 HA ASN C 20 8.642 16.612 11.989 1.00 0.00 H new ATOM 0 HB2 ASN C 20 7.780 14.893 13.708 1.00 0.00 H new ATOM 0 HB3 ASN C 20 6.210 15.660 13.566 1.00 0.00 H new ATOM 0 HD21 ASN C 20 5.557 13.475 10.808 1.00 0.00 H new ATOM 0 HD22 ASN C 20 5.072 14.020 12.417 1.00 0.00 H new ATOM 1048 N ASP C 21 7.122 19.014 11.999 1.00 0.00 N ATOM 1049 CA ASP C 21 6.231 19.995 11.390 1.00 0.00 C ATOM 1050 C ASP C 21 6.254 19.872 9.870 1.00 0.00 C ATOM 1051 O ASP C 21 5.340 20.333 9.186 1.00 0.00 O ATOM 1052 CB ASP C 21 6.659 21.407 11.796 1.00 0.00 C ATOM 1053 CG ASP C 21 6.372 21.633 13.276 1.00 0.00 C ATOM 1054 OD1 ASP C 21 5.641 20.839 13.844 1.00 0.00 O ATOM 1055 OD2 ASP C 21 6.888 22.595 13.821 1.00 0.00 O ATOM 0 H ASP C 21 7.978 19.404 12.393 1.00 0.00 H new ATOM 0 HA ASP C 21 5.217 19.805 11.741 1.00 0.00 H new ATOM 0 HB2 ASP C 21 7.722 21.545 11.598 1.00 0.00 H new ATOM 0 HB3 ASP C 21 6.125 22.144 11.197 1.00 0.00 H new ATOM 1060 N SER C 22 7.309 19.254 9.346 1.00 0.00 N ATOM 1061 CA SER C 22 7.446 19.084 7.903 1.00 0.00 C ATOM 1062 C SER C 22 6.328 18.203 7.352 1.00 0.00 C ATOM 1063 O SER C 22 5.867 18.405 6.228 1.00 0.00 O ATOM 1064 CB SER C 22 8.799 18.453 7.577 1.00 0.00 C ATOM 1065 OG SER C 22 8.901 17.194 8.229 1.00 0.00 O ATOM 0 H SER C 22 8.076 18.865 9.894 1.00 0.00 H new ATOM 0 HA SER C 22 7.380 20.067 7.437 1.00 0.00 H new ATOM 0 HB2 SER C 22 8.904 18.327 6.499 1.00 0.00 H new ATOM 0 HB3 SER C 22 9.607 19.109 7.901 1.00 0.00 H new ATOM 0 HG SER C 22 9.767 16.787 8.020 1.00 0.00 H new ATOM 1071 N SER C 23 5.898 17.229 8.147 1.00 0.00 N ATOM 1072 CA SER C 23 4.835 16.323 7.733 1.00 0.00 C ATOM 1073 C SER C 23 4.072 15.834 8.955 1.00 0.00 C ATOM 1074 O SER C 23 4.669 15.475 9.971 1.00 0.00 O ATOM 1075 CB SER C 23 5.429 15.131 6.982 1.00 0.00 C ATOM 1076 OG SER C 23 6.234 15.606 5.909 1.00 0.00 O ATOM 0 H SER C 23 6.269 17.048 9.080 1.00 0.00 H new ATOM 0 HA SER C 23 4.151 16.855 7.072 1.00 0.00 H new ATOM 0 HB2 SER C 23 6.028 14.521 7.659 1.00 0.00 H new ATOM 0 HB3 SER C 23 4.632 14.493 6.599 1.00 0.00 H new ATOM 0 HG SER C 23 6.618 14.845 5.426 1.00 0.00 H new ATOM 1082 N ASP C 24 2.753 15.830 8.854 1.00 0.00 N ATOM 1083 CA ASP C 24 1.914 15.395 9.963 1.00 0.00 C ATOM 1084 C ASP C 24 2.273 13.961 10.384 1.00 0.00 C ATOM 1085 O ASP C 24 2.675 13.154 9.544 1.00 0.00 O ATOM 1086 CB ASP C 24 0.441 15.453 9.549 1.00 0.00 C ATOM 1087 CG ASP C 24 0.164 16.739 8.774 1.00 0.00 C ATOM 1088 OD1 ASP C 24 -0.024 17.762 9.413 1.00 0.00 O ATOM 1089 OD2 ASP C 24 0.139 16.681 7.555 1.00 0.00 O ATOM 0 H ASP C 24 2.241 16.121 8.021 1.00 0.00 H new ATOM 0 HA ASP C 24 2.084 16.061 10.809 1.00 0.00 H new ATOM 0 HB2 ASP C 24 0.194 14.588 8.934 1.00 0.00 H new ATOM 0 HB3 ASP C 24 -0.195 15.408 10.433 1.00 0.00 H new ATOM 1094 N PRO C 25 2.126 13.613 11.649 1.00 0.00 N ATOM 1095 CA PRO C 25 2.434 12.231 12.130 1.00 0.00 C ATOM 1096 C PRO C 25 1.846 11.151 11.214 1.00 0.00 C ATOM 1097 O PRO C 25 2.477 10.128 10.957 1.00 0.00 O ATOM 1098 CB PRO C 25 1.771 12.172 13.515 1.00 0.00 C ATOM 1099 CG PRO C 25 1.735 13.587 14.002 1.00 0.00 C ATOM 1100 CD PRO C 25 1.675 14.484 12.756 1.00 0.00 C ATOM 0 HA PRO C 25 3.507 12.040 12.149 1.00 0.00 H new ATOM 0 HB2 PRO C 25 0.767 11.753 13.452 1.00 0.00 H new ATOM 0 HB3 PRO C 25 2.339 11.537 14.195 1.00 0.00 H new ATOM 0 HG2 PRO C 25 0.868 13.754 14.641 1.00 0.00 H new ATOM 0 HG3 PRO C 25 2.619 13.813 14.599 1.00 0.00 H new ATOM 0 HD2 PRO C 25 0.665 14.855 12.583 1.00 0.00 H new ATOM 0 HD3 PRO C 25 2.321 15.356 12.863 1.00 0.00 H new ATOM 1108 N LEU C 26 0.628 11.380 10.745 1.00 0.00 N ATOM 1109 CA LEU C 26 -0.034 10.422 9.874 1.00 0.00 C ATOM 1110 C LEU C 26 0.691 10.308 8.531 1.00 0.00 C ATOM 1111 O LEU C 26 0.852 9.211 7.996 1.00 0.00 O ATOM 1112 CB LEU C 26 -1.483 10.853 9.642 1.00 0.00 C ATOM 1113 CG LEU C 26 -2.275 10.762 10.955 1.00 0.00 C ATOM 1114 CD1 LEU C 26 -3.635 11.437 10.762 1.00 0.00 C ATOM 1115 CD2 LEU C 26 -2.479 9.289 11.364 1.00 0.00 C ATOM 0 H LEU C 26 0.081 12.216 10.952 1.00 0.00 H new ATOM 0 HA LEU C 26 -0.013 9.446 10.359 1.00 0.00 H new ATOM 0 HB2 LEU C 26 -1.511 11.874 9.261 1.00 0.00 H new ATOM 0 HB3 LEU C 26 -1.943 10.218 8.885 1.00 0.00 H new ATOM 0 HG LEU C 26 -1.717 11.264 11.745 1.00 0.00 H new ATOM 0 HD11 LEU C 26 -4.205 11.378 11.689 1.00 0.00 H new ATOM 0 HD12 LEU C 26 -3.487 12.483 10.493 1.00 0.00 H new ATOM 0 HD13 LEU C 26 -4.182 10.932 9.966 1.00 0.00 H new ATOM 0 HD21 LEU C 26 -3.042 9.245 12.296 1.00 0.00 H new ATOM 0 HD22 LEU C 26 -3.031 8.767 10.582 1.00 0.00 H new ATOM 0 HD23 LEU C 26 -1.509 8.812 11.503 1.00 0.00 H new ATOM 1127 N VAL C 27 1.112 11.446 7.986 1.00 0.00 N ATOM 1128 CA VAL C 27 1.800 11.456 6.696 1.00 0.00 C ATOM 1129 C VAL C 27 3.119 10.686 6.770 1.00 0.00 C ATOM 1130 O VAL C 27 3.391 9.824 5.934 1.00 0.00 O ATOM 1131 CB VAL C 27 2.083 12.905 6.280 1.00 0.00 C ATOM 1132 CG1 VAL C 27 2.958 12.927 5.024 1.00 0.00 C ATOM 1133 CG2 VAL C 27 0.759 13.619 5.992 1.00 0.00 C ATOM 0 H VAL C 27 0.991 12.365 8.411 1.00 0.00 H new ATOM 0 HA VAL C 27 1.157 10.972 5.961 1.00 0.00 H new ATOM 0 HB VAL C 27 2.607 13.414 7.089 1.00 0.00 H new ATOM 0 HG11 VAL C 27 3.154 13.960 4.735 1.00 0.00 H new ATOM 0 HG12 VAL C 27 3.902 12.422 5.229 1.00 0.00 H new ATOM 0 HG13 VAL C 27 2.442 12.415 4.212 1.00 0.00 H new ATOM 0 HG21 VAL C 27 0.958 14.649 5.696 1.00 0.00 H new ATOM 0 HG22 VAL C 27 0.236 13.104 5.186 1.00 0.00 H new ATOM 0 HG23 VAL C 27 0.139 13.612 6.889 1.00 0.00 H new ATOM 1143 N VAL C 28 3.931 11.001 7.772 1.00 0.00 N ATOM 1144 CA VAL C 28 5.216 10.329 7.937 1.00 0.00 C ATOM 1145 C VAL C 28 5.006 8.885 8.360 1.00 0.00 C ATOM 1146 O VAL C 28 5.678 7.975 7.874 1.00 0.00 O ATOM 1147 CB VAL C 28 6.056 11.060 8.982 1.00 0.00 C ATOM 1148 CG1 VAL C 28 5.370 10.991 10.344 1.00 0.00 C ATOM 1149 CG2 VAL C 28 7.441 10.414 9.072 1.00 0.00 C ATOM 0 H VAL C 28 3.727 11.710 8.476 1.00 0.00 H new ATOM 0 HA VAL C 28 5.742 10.342 6.983 1.00 0.00 H new ATOM 0 HB VAL C 28 6.161 12.104 8.688 1.00 0.00 H new ATOM 0 HG11 VAL C 28 5.976 11.515 11.083 1.00 0.00 H new ATOM 0 HG12 VAL C 28 4.388 11.460 10.281 1.00 0.00 H new ATOM 0 HG13 VAL C 28 5.256 9.949 10.641 1.00 0.00 H new ATOM 0 HG21 VAL C 28 8.039 10.937 9.818 1.00 0.00 H new ATOM 0 HG22 VAL C 28 7.337 9.368 9.359 1.00 0.00 H new ATOM 0 HG23 VAL C 28 7.935 10.476 8.103 1.00 0.00 H new ATOM 1159 N ALA C 29 4.069 8.688 9.274 1.00 0.00 N ATOM 1160 CA ALA C 29 3.769 7.350 9.771 1.00 0.00 C ATOM 1161 C ALA C 29 3.284 6.451 8.640 1.00 0.00 C ATOM 1162 O ALA C 29 3.663 5.285 8.557 1.00 0.00 O ATOM 1163 CB ALA C 29 2.694 7.419 10.857 1.00 0.00 C ATOM 0 H ALA C 29 3.505 9.431 9.686 1.00 0.00 H new ATOM 0 HA ALA C 29 4.684 6.932 10.190 1.00 0.00 H new ATOM 0 HB1 ALA C 29 2.479 6.414 11.220 1.00 0.00 H new ATOM 0 HB2 ALA C 29 3.050 8.035 11.683 1.00 0.00 H new ATOM 0 HB3 ALA C 29 1.786 7.857 10.443 1.00 0.00 H new ATOM 1169 N ALA C 30 2.445 6.999 7.770 1.00 0.00 N ATOM 1170 CA ALA C 30 1.921 6.224 6.653 1.00 0.00 C ATOM 1171 C ALA C 30 3.049 5.771 5.738 1.00 0.00 C ATOM 1172 O ALA C 30 3.067 4.628 5.277 1.00 0.00 O ATOM 1173 CB ALA C 30 0.926 7.068 5.854 1.00 0.00 C ATOM 0 H ALA C 30 2.116 7.964 7.814 1.00 0.00 H new ATOM 0 HA ALA C 30 1.416 5.344 7.053 1.00 0.00 H new ATOM 0 HB1 ALA C 30 0.539 6.482 5.021 1.00 0.00 H new ATOM 0 HB2 ALA C 30 0.102 7.368 6.501 1.00 0.00 H new ATOM 0 HB3 ALA C 30 1.428 7.956 5.470 1.00 0.00 H new ATOM 1179 N ASN C 31 3.991 6.670 5.475 1.00 0.00 N ATOM 1180 CA ASN C 31 5.118 6.344 4.612 1.00 0.00 C ATOM 1181 C ASN C 31 5.980 5.256 5.242 1.00 0.00 C ATOM 1182 O ASN C 31 6.415 4.326 4.562 1.00 0.00 O ATOM 1183 CB ASN C 31 5.967 7.596 4.375 1.00 0.00 C ATOM 1184 CG ASN C 31 5.193 8.611 3.537 1.00 0.00 C ATOM 1185 OD1 ASN C 31 5.397 9.816 3.682 1.00 0.00 O ATOM 1186 ND2 ASN C 31 4.315 8.197 2.663 1.00 0.00 N ATOM 0 H ASN C 31 3.997 7.621 5.843 1.00 0.00 H new ATOM 0 HA ASN C 31 4.731 5.978 3.661 1.00 0.00 H new ATOM 0 HB2 ASN C 31 6.246 8.040 5.330 1.00 0.00 H new ATOM 0 HB3 ASN C 31 6.893 7.325 3.867 1.00 0.00 H new ATOM 0 HD21 ASN C 31 3.798 8.873 2.100 1.00 0.00 H new ATOM 0 HD22 ASN C 31 4.146 7.198 2.543 1.00 0.00 H new ATOM 1193 N ILE C 32 6.225 5.376 6.544 1.00 0.00 N ATOM 1194 CA ILE C 32 7.039 4.393 7.250 1.00 0.00 C ATOM 1195 C ILE C 32 6.346 3.033 7.261 1.00 0.00 C ATOM 1196 O ILE C 32 6.973 2.002 7.020 1.00 0.00 O ATOM 1197 CB ILE C 32 7.291 4.863 8.687 1.00 0.00 C ATOM 1198 CG1 ILE C 32 8.179 6.108 8.663 1.00 0.00 C ATOM 1199 CG2 ILE C 32 7.997 3.754 9.475 1.00 0.00 C ATOM 1200 CD1 ILE C 32 8.205 6.742 10.056 1.00 0.00 C ATOM 0 H ILE C 32 5.875 6.137 7.126 1.00 0.00 H new ATOM 0 HA ILE C 32 7.993 4.292 6.732 1.00 0.00 H new ATOM 0 HB ILE C 32 6.339 5.098 9.164 1.00 0.00 H new ATOM 0 HG12 ILE C 32 9.190 5.841 8.354 1.00 0.00 H new ATOM 0 HG13 ILE C 32 7.801 6.824 7.933 1.00 0.00 H new ATOM 0 HG21 ILE C 32 8.175 4.090 10.496 1.00 0.00 H new ATOM 0 HG22 ILE C 32 7.370 2.863 9.491 1.00 0.00 H new ATOM 0 HG23 ILE C 32 8.949 3.519 8.999 1.00 0.00 H new ATOM 0 HD11 ILE C 32 8.838 7.629 10.040 1.00 0.00 H new ATOM 0 HD12 ILE C 32 7.193 7.023 10.347 1.00 0.00 H new ATOM 0 HD13 ILE C 32 8.603 6.025 10.774 1.00 0.00 H new ATOM 1212 N ILE C 33 5.045 3.041 7.543 1.00 0.00 N ATOM 1213 CA ILE C 33 4.272 1.804 7.585 1.00 0.00 C ATOM 1214 C ILE C 33 4.227 1.145 6.208 1.00 0.00 C ATOM 1215 O ILE C 33 4.391 -0.070 6.087 1.00 0.00 O ATOM 1216 CB ILE C 33 2.848 2.099 8.072 1.00 0.00 C ATOM 1217 CG1 ILE C 33 2.888 2.507 9.550 1.00 0.00 C ATOM 1218 CG2 ILE C 33 1.972 0.854 7.912 1.00 0.00 C ATOM 1219 CD1 ILE C 33 1.530 3.085 9.960 1.00 0.00 C ATOM 0 H ILE C 33 4.508 3.884 7.744 1.00 0.00 H new ATOM 0 HA ILE C 33 4.756 1.116 8.278 1.00 0.00 H new ATOM 0 HB ILE C 33 2.428 2.911 7.478 1.00 0.00 H new ATOM 0 HG12 ILE C 33 3.129 1.643 10.170 1.00 0.00 H new ATOM 0 HG13 ILE C 33 3.673 3.245 9.713 1.00 0.00 H new ATOM 0 HG21 ILE C 33 0.962 1.072 8.260 1.00 0.00 H new ATOM 0 HG22 ILE C 33 1.939 0.565 6.862 1.00 0.00 H new ATOM 0 HG23 ILE C 33 2.390 0.037 8.500 1.00 0.00 H new ATOM 0 HD11 ILE C 33 1.560 3.374 11.010 1.00 0.00 H new ATOM 0 HD12 ILE C 33 1.307 3.960 9.349 1.00 0.00 H new ATOM 0 HD13 ILE C 33 0.755 2.333 9.813 1.00 0.00 H new ATOM 1231 N GLY C 34 3.998 1.948 5.173 1.00 0.00 N ATOM 1232 CA GLY C 34 3.928 1.419 3.813 1.00 0.00 C ATOM 1233 C GLY C 34 5.256 0.792 3.400 1.00 0.00 C ATOM 1234 O GLY C 34 5.296 -0.316 2.857 1.00 0.00 O ATOM 0 H GLY C 34 3.859 2.956 5.247 1.00 0.00 H new ATOM 0 HA2 GLY C 34 3.135 0.674 3.749 1.00 0.00 H new ATOM 0 HA3 GLY C 34 3.669 2.220 3.121 1.00 0.00 H new ATOM 1238 N ILE C 35 6.345 1.505 3.664 1.00 0.00 N ATOM 1239 CA ILE C 35 7.671 1.009 3.318 1.00 0.00 C ATOM 1240 C ILE C 35 7.978 -0.263 4.102 1.00 0.00 C ATOM 1241 O ILE C 35 8.505 -1.231 3.554 1.00 0.00 O ATOM 1242 CB ILE C 35 8.719 2.079 3.628 1.00 0.00 C ATOM 1243 CG1 ILE C 35 8.525 3.264 2.675 1.00 0.00 C ATOM 1244 CG2 ILE C 35 10.121 1.495 3.432 1.00 0.00 C ATOM 1245 CD1 ILE C 35 9.318 4.467 3.186 1.00 0.00 C ATOM 0 H ILE C 35 6.337 2.421 4.113 1.00 0.00 H new ATOM 0 HA ILE C 35 7.697 0.779 2.253 1.00 0.00 H new ATOM 0 HB ILE C 35 8.607 2.413 4.660 1.00 0.00 H new ATOM 0 HG12 ILE C 35 8.857 2.996 1.672 1.00 0.00 H new ATOM 0 HG13 ILE C 35 7.467 3.517 2.603 1.00 0.00 H new ATOM 0 HG21 ILE C 35 10.867 2.258 3.653 1.00 0.00 H new ATOM 0 HG22 ILE C 35 10.259 0.647 4.103 1.00 0.00 H new ATOM 0 HG23 ILE C 35 10.236 1.163 2.400 1.00 0.00 H new ATOM 0 HD11 ILE C 35 9.179 5.309 2.508 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.965 4.740 4.180 1.00 0.00 H new ATOM 0 HD13 ILE C 35 10.376 4.211 3.235 1.00 0.00 H new ATOM 1257 N LEU C 36 7.639 -0.257 5.387 1.00 0.00 N ATOM 1258 CA LEU C 36 7.881 -1.416 6.236 1.00 0.00 C ATOM 1259 C LEU C 36 7.130 -2.625 5.695 1.00 0.00 C ATOM 1260 O LEU C 36 7.634 -3.749 5.728 1.00 0.00 O ATOM 1261 CB LEU C 36 7.434 -1.126 7.674 1.00 0.00 C ATOM 1262 CG LEU C 36 7.721 -2.336 8.580 1.00 0.00 C ATOM 1263 CD1 LEU C 36 9.229 -2.645 8.600 1.00 0.00 C ATOM 1264 CD2 LEU C 36 7.239 -2.017 9.998 1.00 0.00 C ATOM 0 H LEU C 36 7.199 0.532 5.860 1.00 0.00 H new ATOM 0 HA LEU C 36 8.950 -1.630 6.236 1.00 0.00 H new ATOM 0 HB2 LEU C 36 7.956 -0.248 8.054 1.00 0.00 H new ATOM 0 HB3 LEU C 36 6.369 -0.896 7.691 1.00 0.00 H new ATOM 0 HG LEU C 36 7.195 -3.209 8.195 1.00 0.00 H new ATOM 0 HD11 LEU C 36 9.416 -3.503 9.245 1.00 0.00 H new ATOM 0 HD12 LEU C 36 9.568 -2.871 7.589 1.00 0.00 H new ATOM 0 HD13 LEU C 36 9.773 -1.780 8.980 1.00 0.00 H new ATOM 0 HD21 LEU C 36 7.437 -2.868 10.650 1.00 0.00 H new ATOM 0 HD22 LEU C 36 7.768 -1.141 10.374 1.00 0.00 H new ATOM 0 HD23 LEU C 36 6.168 -1.815 9.981 1.00 0.00 H new ATOM 1276 N HIS C 37 5.922 -2.391 5.193 1.00 0.00 N ATOM 1277 CA HIS C 37 5.117 -3.475 4.648 1.00 0.00 C ATOM 1278 C HIS C 37 5.877 -4.168 3.526 1.00 0.00 C ATOM 1279 O HIS C 37 5.872 -5.395 3.426 1.00 0.00 O ATOM 1280 CB HIS C 37 3.799 -2.925 4.100 1.00 0.00 C ATOM 1281 CG HIS C 37 2.967 -4.065 3.576 1.00 0.00 C ATOM 1282 ND1 HIS C 37 1.725 -4.374 4.100 1.00 0.00 N ATOM 1283 CD2 HIS C 37 3.190 -4.980 2.581 1.00 0.00 C ATOM 1284 CE1 HIS C 37 1.257 -5.439 3.425 1.00 0.00 C ATOM 1285 NE2 HIS C 37 2.109 -5.846 2.487 1.00 0.00 N ATOM 0 H HIS C 37 5.484 -1.471 5.153 1.00 0.00 H new ATOM 0 HA HIS C 37 4.907 -4.190 5.443 1.00 0.00 H new ATOM 0 HB2 HIS C 37 3.258 -2.395 4.884 1.00 0.00 H new ATOM 0 HB3 HIS C 37 3.994 -2.206 3.305 1.00 0.00 H new ATOM 0 HD2 HIS C 37 4.074 -5.021 1.962 1.00 0.00 H new ATOM 0 HE1 HIS C 37 0.304 -5.908 3.621 1.00 0.00 H new ATOM 0 HE2 HIS C 37 1.993 -6.625 1.839 1.00 0.00 H new ATOM 1293 N LEU C 38 6.535 -3.379 2.685 1.00 0.00 N ATOM 1294 CA LEU C 38 7.298 -3.937 1.572 1.00 0.00 C ATOM 1295 C LEU C 38 8.404 -4.856 2.076 1.00 0.00 C ATOM 1296 O LEU C 38 8.656 -5.897 1.478 1.00 0.00 O ATOM 1297 CB LEU C 38 7.905 -2.803 0.722 1.00 0.00 C ATOM 1298 CG LEU C 38 6.938 -2.405 -0.413 1.00 0.00 C ATOM 1299 CD1 LEU C 38 7.225 -0.974 -0.864 1.00 0.00 C ATOM 1300 CD2 LEU C 38 7.118 -3.358 -1.607 1.00 0.00 C ATOM 0 H LEU C 38 6.557 -2.361 2.750 1.00 0.00 H new ATOM 0 HA LEU C 38 6.618 -4.523 0.955 1.00 0.00 H new ATOM 0 HB2 LEU C 38 8.112 -1.938 1.352 1.00 0.00 H new ATOM 0 HB3 LEU C 38 8.857 -3.125 0.301 1.00 0.00 H new ATOM 0 HG LEU C 38 5.915 -2.470 -0.044 1.00 0.00 H new ATOM 0 HD11 LEU C 38 6.539 -0.700 -1.665 1.00 0.00 H new ATOM 0 HD12 LEU C 38 7.091 -0.294 -0.023 1.00 0.00 H new ATOM 0 HD13 LEU C 38 8.251 -0.905 -1.226 1.00 0.00 H new ATOM 0 HD21 LEU C 38 6.433 -3.073 -2.406 1.00 0.00 H new ATOM 0 HD22 LEU C 38 8.144 -3.297 -1.970 1.00 0.00 H new ATOM 0 HD23 LEU C 38 6.904 -4.380 -1.293 1.00 0.00 H new ATOM 1312 N ILE C 39 9.064 -4.466 3.154 1.00 0.00 N ATOM 1313 CA ILE C 39 10.152 -5.276 3.689 1.00 0.00 C ATOM 1314 C ILE C 39 9.645 -6.659 4.098 1.00 0.00 C ATOM 1315 O ILE C 39 10.271 -7.672 3.785 1.00 0.00 O ATOM 1316 CB ILE C 39 10.752 -4.583 4.912 1.00 0.00 C ATOM 1317 CG1 ILE C 39 11.113 -3.132 4.560 1.00 0.00 C ATOM 1318 CG2 ILE C 39 12.006 -5.333 5.371 1.00 0.00 C ATOM 1319 CD1 ILE C 39 12.012 -3.079 3.322 1.00 0.00 C ATOM 0 H ILE C 39 8.872 -3.608 3.671 1.00 0.00 H new ATOM 0 HA ILE C 39 10.910 -5.391 2.914 1.00 0.00 H new ATOM 0 HB ILE C 39 10.020 -4.585 5.720 1.00 0.00 H new ATOM 0 HG12 ILE C 39 10.203 -2.560 4.379 1.00 0.00 H new ATOM 0 HG13 ILE C 39 11.621 -2.664 5.404 1.00 0.00 H new ATOM 0 HG21 ILE C 39 12.429 -4.834 6.243 1.00 0.00 H new ATOM 0 HG22 ILE C 39 11.742 -6.358 5.632 1.00 0.00 H new ATOM 0 HG23 ILE C 39 12.740 -5.341 4.566 1.00 0.00 H new ATOM 0 HD11 ILE C 39 12.254 -2.041 3.092 1.00 0.00 H new ATOM 0 HD12 ILE C 39 12.931 -3.632 3.516 1.00 0.00 H new ATOM 0 HD13 ILE C 39 11.492 -3.526 2.475 1.00 0.00 H new ATOM 1331 N LEU C 40 8.518 -6.705 4.798 1.00 0.00 N ATOM 1332 CA LEU C 40 7.961 -7.985 5.227 1.00 0.00 C ATOM 1333 C LEU C 40 7.333 -8.736 4.052 1.00 0.00 C ATOM 1334 O LEU C 40 7.549 -9.935 3.885 1.00 0.00 O ATOM 1335 CB LEU C 40 6.908 -7.761 6.318 1.00 0.00 C ATOM 1336 CG LEU C 40 6.363 -9.107 6.819 1.00 0.00 C ATOM 1337 CD1 LEU C 40 7.499 -9.959 7.421 1.00 0.00 C ATOM 1338 CD2 LEU C 40 5.296 -8.839 7.887 1.00 0.00 C ATOM 0 H LEU C 40 7.978 -5.886 5.078 1.00 0.00 H new ATOM 0 HA LEU C 40 8.776 -8.590 5.625 1.00 0.00 H new ATOM 0 HB2 LEU C 40 7.347 -7.207 7.148 1.00 0.00 H new ATOM 0 HB3 LEU C 40 6.092 -7.154 5.926 1.00 0.00 H new ATOM 0 HG LEU C 40 5.928 -9.655 5.983 1.00 0.00 H new ATOM 0 HD11 LEU C 40 7.095 -10.909 7.771 1.00 0.00 H new ATOM 0 HD12 LEU C 40 8.257 -10.145 6.660 1.00 0.00 H new ATOM 0 HD13 LEU C 40 7.949 -9.426 8.258 1.00 0.00 H new ATOM 0 HD21 LEU C 40 4.900 -9.787 8.252 1.00 0.00 H new ATOM 0 HD22 LEU C 40 5.741 -8.289 8.716 1.00 0.00 H new ATOM 0 HD23 LEU C 40 4.487 -8.251 7.454 1.00 0.00 H new ATOM 1350 N TRP C 41 6.541 -8.025 3.250 1.00 0.00 N ATOM 1351 CA TRP C 41 5.872 -8.642 2.108 1.00 0.00 C ATOM 1352 C TRP C 41 6.883 -9.179 1.100 1.00 0.00 C ATOM 1353 O TRP C 41 6.763 -10.314 0.639 1.00 0.00 O ATOM 1354 CB TRP C 41 4.946 -7.620 1.431 1.00 0.00 C ATOM 1355 CG TRP C 41 4.444 -8.158 0.125 1.00 0.00 C ATOM 1356 CD1 TRP C 41 3.376 -8.977 -0.028 1.00 0.00 C ATOM 1357 CD2 TRP C 41 4.954 -7.902 -1.211 1.00 0.00 C ATOM 1358 NE1 TRP C 41 3.219 -9.256 -1.376 1.00 0.00 N ATOM 1359 CE2 TRP C 41 4.167 -8.611 -2.144 1.00 0.00 C ATOM 1360 CE3 TRP C 41 6.024 -7.129 -1.700 1.00 0.00 C ATOM 1361 CZ2 TRP C 41 4.430 -8.555 -3.511 1.00 0.00 C ATOM 1362 CZ3 TRP C 41 6.283 -7.069 -3.079 1.00 0.00 C ATOM 1363 CH2 TRP C 41 5.488 -7.781 -3.978 1.00 0.00 C ATOM 0 H TRP C 41 6.349 -7.030 3.369 1.00 0.00 H new ATOM 0 HA TRP C 41 5.280 -9.482 2.473 1.00 0.00 H new ATOM 0 HB2 TRP C 41 4.105 -7.392 2.086 1.00 0.00 H new ATOM 0 HB3 TRP C 41 5.483 -6.686 1.265 1.00 0.00 H new ATOM 0 HD1 TRP C 41 2.750 -9.351 0.769 1.00 0.00 H new ATOM 0 HE1 TRP C 41 2.492 -9.863 -1.754 1.00 0.00 H new ATOM 0 HE3 TRP C 41 6.649 -6.579 -1.011 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 3.816 -9.110 -4.205 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 7.102 -6.468 -3.446 1.00 0.00 H new ATOM 0 HH2 TRP C 41 5.694 -7.731 -5.037 1.00 0.00 H new ATOM 1374 N ILE C 42 7.864 -8.362 0.749 1.00 0.00 N ATOM 1375 CA ILE C 42 8.867 -8.779 -0.220 1.00 0.00 C ATOM 1376 C ILE C 42 9.701 -9.926 0.347 1.00 0.00 C ATOM 1377 O ILE C 42 10.032 -10.876 -0.362 1.00 0.00 O ATOM 1378 CB ILE C 42 9.771 -7.591 -0.592 1.00 0.00 C ATOM 1379 CG1 ILE C 42 10.531 -7.905 -1.885 1.00 0.00 C ATOM 1380 CG2 ILE C 42 10.787 -7.312 0.528 1.00 0.00 C ATOM 1381 CD1 ILE C 42 11.248 -6.639 -2.359 1.00 0.00 C ATOM 0 H ILE C 42 7.987 -7.418 1.115 1.00 0.00 H new ATOM 0 HA ILE C 42 8.363 -9.128 -1.121 1.00 0.00 H new ATOM 0 HB ILE C 42 9.142 -6.712 -0.732 1.00 0.00 H new ATOM 0 HG12 ILE C 42 11.252 -8.705 -1.714 1.00 0.00 H new ATOM 0 HG13 ILE C 42 9.841 -8.257 -2.652 1.00 0.00 H new ATOM 0 HG21 ILE C 42 11.417 -6.468 0.246 1.00 0.00 H new ATOM 0 HG22 ILE C 42 10.256 -7.076 1.450 1.00 0.00 H new ATOM 0 HG23 ILE C 42 11.409 -8.194 0.683 1.00 0.00 H new ATOM 0 HD11 ILE C 42 11.792 -6.852 -3.279 1.00 0.00 H new ATOM 0 HD12 ILE C 42 10.515 -5.854 -2.544 1.00 0.00 H new ATOM 0 HD13 ILE C 42 11.948 -6.308 -1.592 1.00 0.00 H new ATOM 1393 N LEU C 43 10.038 -9.824 1.628 1.00 0.00 N ATOM 1394 CA LEU C 43 10.835 -10.852 2.282 1.00 0.00 C ATOM 1395 C LEU C 43 10.089 -12.183 2.298 1.00 0.00 C ATOM 1396 O LEU C 43 10.679 -13.237 2.063 1.00 0.00 O ATOM 1397 CB LEU C 43 11.164 -10.426 3.718 1.00 0.00 C ATOM 1398 CG LEU C 43 11.955 -11.529 4.441 1.00 0.00 C ATOM 1399 CD1 LEU C 43 13.228 -11.875 3.654 1.00 0.00 C ATOM 1400 CD2 LEU C 43 12.334 -11.039 5.842 1.00 0.00 C ATOM 0 H LEU C 43 9.773 -9.044 2.230 1.00 0.00 H new ATOM 0 HA LEU C 43 11.761 -10.978 1.721 1.00 0.00 H new ATOM 0 HB2 LEU C 43 11.744 -9.503 3.706 1.00 0.00 H new ATOM 0 HB3 LEU C 43 10.243 -10.216 4.261 1.00 0.00 H new ATOM 0 HG LEU C 43 11.336 -12.423 4.516 1.00 0.00 H new ATOM 0 HD11 LEU C 43 13.778 -12.657 4.177 1.00 0.00 H new ATOM 0 HD12 LEU C 43 12.956 -12.227 2.659 1.00 0.00 H new ATOM 0 HD13 LEU C 43 13.854 -10.987 3.567 1.00 0.00 H new ATOM 0 HD21 LEU C 43 12.895 -11.817 6.360 1.00 0.00 H new ATOM 0 HD22 LEU C 43 12.948 -10.142 5.760 1.00 0.00 H new ATOM 0 HD23 LEU C 43 11.429 -10.809 6.404 1.00 0.00 H new ATOM 1412 N ASP C 44 8.795 -12.130 2.592 1.00 0.00 N ATOM 1413 CA ASP C 44 7.992 -13.342 2.649 1.00 0.00 C ATOM 1414 C ASP C 44 8.031 -14.075 1.313 1.00 0.00 C ATOM 1415 O ASP C 44 8.196 -15.294 1.267 1.00 0.00 O ATOM 1416 CB ASP C 44 6.546 -12.994 3.001 1.00 0.00 C ATOM 1417 CG ASP C 44 5.775 -14.263 3.343 1.00 0.00 C ATOM 1418 OD1 ASP C 44 6.102 -14.881 4.342 1.00 0.00 O ATOM 1419 OD2 ASP C 44 4.867 -14.598 2.599 1.00 0.00 O ATOM 0 H ASP C 44 8.285 -11.270 2.792 1.00 0.00 H new ATOM 0 HA ASP C 44 8.406 -13.993 3.419 1.00 0.00 H new ATOM 0 HB2 ASP C 44 6.524 -12.306 3.846 1.00 0.00 H new ATOM 0 HB3 ASP C 44 6.071 -12.484 2.163 1.00 0.00 H new ATOM 1424 N ARG C 45 7.884 -13.325 0.229 1.00 0.00 N ATOM 1425 CA ARG C 45 7.909 -13.916 -1.100 1.00 0.00 C ATOM 1426 C ARG C 45 9.308 -14.426 -1.435 1.00 0.00 C ATOM 1427 O ARG C 45 9.478 -15.259 -2.326 1.00 0.00 O ATOM 1428 CB ARG C 45 7.479 -12.881 -2.142 1.00 0.00 C ATOM 1429 CG ARG C 45 7.519 -13.510 -3.537 1.00 0.00 C ATOM 1430 CD ARG C 45 6.875 -12.560 -4.546 1.00 0.00 C ATOM 1431 NE ARG C 45 5.438 -12.473 -4.307 1.00 0.00 N ATOM 1432 CZ ARG C 45 4.703 -11.517 -4.864 1.00 0.00 C ATOM 1433 NH1 ARG C 45 5.265 -10.625 -5.632 1.00 0.00 N ATOM 1434 NH2 ARG C 45 3.418 -11.471 -4.643 1.00 0.00 N ATOM 0 H ARG C 45 7.747 -12.314 0.244 1.00 0.00 H new ATOM 0 HA ARG C 45 7.215 -14.756 -1.115 1.00 0.00 H new ATOM 0 HB2 ARG C 45 6.473 -12.524 -1.922 1.00 0.00 H new ATOM 0 HB3 ARG C 45 8.140 -12.015 -2.103 1.00 0.00 H new ATOM 0 HG2 ARG C 45 8.550 -13.717 -3.824 1.00 0.00 H new ATOM 0 HG3 ARG C 45 6.991 -14.464 -3.532 1.00 0.00 H new ATOM 0 HD2 ARG C 45 7.326 -11.571 -4.465 1.00 0.00 H new ATOM 0 HD3 ARG C 45 7.062 -12.913 -5.560 1.00 0.00 H new ATOM 0 HE ARG C 45 4.989 -13.160 -3.701 1.00 0.00 H new ATOM 0 HH11 ARG C 45 6.270 -10.661 -5.805 1.00 0.00 H new ATOM 0 HH12 ARG C 45 4.700 -9.891 -6.059 1.00 0.00 H new ATOM 0 HH21 ARG C 45 2.978 -12.169 -4.043 1.00 0.00 H new ATOM 0 HH22 ARG C 45 2.853 -10.737 -5.070 1.00 0.00 H new ATOM 1448 N LEU C 46 10.310 -13.914 -0.728 1.00 0.00 N ATOM 1449 CA LEU C 46 11.687 -14.328 -0.979 1.00 0.00 C ATOM 1450 C LEU C 46 11.852 -15.824 -0.693 1.00 0.00 C ATOM 1451 O LEU C 46 12.368 -16.573 -1.523 1.00 0.00 O ATOM 1452 CB LEU C 46 12.638 -13.509 -0.090 1.00 0.00 C ATOM 1453 CG LEU C 46 14.032 -13.416 -0.729 1.00 0.00 C ATOM 1454 CD1 LEU C 46 14.938 -12.564 0.165 1.00 0.00 C ATOM 1455 CD2 LEU C 46 14.638 -14.818 -0.896 1.00 0.00 C ATOM 0 H LEU C 46 10.199 -13.222 0.013 1.00 0.00 H new ATOM 0 HA LEU C 46 11.930 -14.149 -2.026 1.00 0.00 H new ATOM 0 HB2 LEU C 46 12.233 -12.508 0.059 1.00 0.00 H new ATOM 0 HB3 LEU C 46 12.713 -13.972 0.894 1.00 0.00 H new ATOM 0 HG LEU C 46 13.945 -12.956 -1.713 1.00 0.00 H new ATOM 0 HD11 LEU C 46 15.929 -12.494 -0.283 1.00 0.00 H new ATOM 0 HD12 LEU C 46 14.514 -11.565 0.266 1.00 0.00 H new ATOM 0 HD13 LEU C 46 15.016 -13.026 1.149 1.00 0.00 H new ATOM 0 HD21 LEU C 46 15.626 -14.736 -1.350 1.00 0.00 H new ATOM 0 HD22 LEU C 46 14.726 -15.295 0.080 1.00 0.00 H new ATOM 0 HD23 LEU C 46 13.993 -15.419 -1.537 1.00 0.00 H new ATOM 1467 N PHE C 47 11.391 -16.256 0.480 1.00 0.00 N ATOM 1468 CA PHE C 47 11.484 -17.665 0.856 1.00 0.00 C ATOM 1469 C PHE C 47 10.642 -18.535 -0.068 1.00 0.00 C ATOM 1470 O PHE C 47 11.090 -19.586 -0.528 1.00 0.00 O ATOM 1471 CB PHE C 47 11.024 -17.854 2.305 1.00 0.00 C ATOM 1472 CG PHE C 47 12.047 -17.255 3.242 1.00 0.00 C ATOM 1473 CD1 PHE C 47 13.150 -18.015 3.648 1.00 0.00 C ATOM 1474 CD2 PHE C 47 11.894 -15.940 3.701 1.00 0.00 C ATOM 1475 CE1 PHE C 47 14.101 -17.462 4.514 1.00 0.00 C ATOM 1476 CE2 PHE C 47 12.846 -15.387 4.568 1.00 0.00 C ATOM 1477 CZ PHE C 47 13.949 -16.149 4.974 1.00 0.00 C ATOM 0 H PHE C 47 10.953 -15.657 1.180 1.00 0.00 H new ATOM 0 HA PHE C 47 12.526 -17.971 0.763 1.00 0.00 H new ATOM 0 HB2 PHE C 47 10.055 -17.378 2.455 1.00 0.00 H new ATOM 0 HB3 PHE C 47 10.895 -18.915 2.521 1.00 0.00 H new ATOM 0 HD1 PHE C 47 13.268 -19.028 3.293 1.00 0.00 H new ATOM 0 HD2 PHE C 47 11.043 -15.353 3.387 1.00 0.00 H new ATOM 0 HE1 PHE C 47 14.952 -18.049 4.827 1.00 0.00 H new ATOM 0 HE2 PHE C 47 12.729 -14.374 4.923 1.00 0.00 H new ATOM 0 HZ PHE C 47 14.683 -15.723 5.642 1.00 0.00 H new ATOM 1487 N PHE C 48 9.414 -18.093 -0.333 1.00 0.00 N ATOM 1488 CA PHE C 48 8.499 -18.836 -1.205 1.00 0.00 C ATOM 1489 C PHE C 48 8.298 -18.098 -2.521 1.00 0.00 C ATOM 1490 O PHE C 48 7.853 -16.950 -2.539 1.00 0.00 O ATOM 1491 CB PHE C 48 7.152 -19.007 -0.503 1.00 0.00 C ATOM 1492 CG PHE C 48 7.281 -20.044 0.587 1.00 0.00 C ATOM 1493 CD1 PHE C 48 7.797 -19.687 1.837 1.00 0.00 C ATOM 1494 CD2 PHE C 48 6.890 -21.367 0.344 1.00 0.00 C ATOM 1495 CE1 PHE C 48 7.920 -20.648 2.846 1.00 0.00 C ATOM 1496 CE2 PHE C 48 7.011 -22.329 1.352 1.00 0.00 C ATOM 1497 CZ PHE C 48 7.526 -21.971 2.603 1.00 0.00 C ATOM 0 H PHE C 48 9.028 -17.226 0.041 1.00 0.00 H new ATOM 0 HA PHE C 48 8.932 -19.814 -1.416 1.00 0.00 H new ATOM 0 HB2 PHE C 48 6.827 -18.057 -0.079 1.00 0.00 H new ATOM 0 HB3 PHE C 48 6.391 -19.312 -1.222 1.00 0.00 H new ATOM 0 HD1 PHE C 48 8.101 -18.668 2.024 1.00 0.00 H new ATOM 0 HD2 PHE C 48 6.495 -21.644 -0.622 1.00 0.00 H new ATOM 0 HE1 PHE C 48 8.318 -20.371 3.811 1.00 0.00 H new ATOM 0 HE2 PHE C 48 6.707 -23.348 1.165 1.00 0.00 H new ATOM 0 HZ PHE C 48 7.620 -22.714 3.381 1.00 0.00 H new ATOM 1507 N LYS C 49 8.624 -18.765 -3.620 1.00 0.00 N ATOM 1508 CA LYS C 49 8.474 -18.166 -4.936 1.00 0.00 C ATOM 1509 C LYS C 49 6.997 -18.015 -5.291 1.00 0.00 C ATOM 1510 O LYS C 49 6.214 -18.833 -4.838 1.00 0.00 O ATOM 1511 CB LYS C 49 9.169 -19.039 -5.985 1.00 0.00 C ATOM 1512 CG LYS C 49 10.633 -19.282 -5.590 1.00 0.00 C ATOM 1513 CD LYS C 49 11.417 -17.965 -5.608 1.00 0.00 C ATOM 1514 CE LYS C 49 12.919 -18.260 -5.655 1.00 0.00 C ATOM 1515 NZ LYS C 49 13.327 -18.959 -4.403 1.00 0.00 N ATOM 1516 OXT LYS C 49 6.673 -17.086 -6.008 1.00 0.00 O ATOM 0 H LYS C 49 8.992 -19.716 -3.625 1.00 0.00 H new ATOM 0 HA LYS C 49 8.933 -17.178 -4.922 1.00 0.00 H new ATOM 0 HB2 LYS C 49 8.648 -19.992 -6.079 1.00 0.00 H new ATOM 0 HB3 LYS C 49 9.124 -18.554 -6.960 1.00 0.00 H new ATOM 0 HG2 LYS C 49 10.679 -19.726 -4.596 1.00 0.00 H new ATOM 0 HG3 LYS C 49 11.089 -19.993 -6.279 1.00 0.00 H new ATOM 0 HD2 LYS C 49 11.126 -17.369 -6.473 1.00 0.00 H new ATOM 0 HD3 LYS C 49 11.180 -17.377 -4.722 1.00 0.00 H new ATOM 0 HE2 LYS C 49 13.152 -18.878 -6.522 1.00 0.00 H new ATOM 0 HE3 LYS C 49 13.480 -17.332 -5.765 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 14.364 -18.964 -4.331 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 12.925 -18.463 -3.582 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 12.977 -19.938 -4.422 1.00 0.00 H new TER 1530 LYS C 49 ATOM 1531 N SER D 19 -13.431 19.765 11.380 1.00 0.00 N ATOM 1532 CA SER D 19 -13.918 19.383 10.025 1.00 0.00 C ATOM 1533 C SER D 19 -12.797 18.681 9.264 1.00 0.00 C ATOM 1534 O SER D 19 -12.790 18.654 8.033 1.00 0.00 O ATOM 1535 CB SER D 19 -14.355 20.637 9.270 1.00 0.00 C ATOM 1536 OG SER D 19 -15.029 20.256 8.077 1.00 0.00 O ATOM 0 HA SER D 19 -14.768 18.707 10.116 1.00 0.00 H new ATOM 0 HB2 SER D 19 -15.012 21.242 9.895 1.00 0.00 H new ATOM 0 HB3 SER D 19 -13.488 21.252 9.031 1.00 0.00 H new ATOM 0 HG SER D 19 -14.481 19.611 7.583 1.00 0.00 H new ATOM 1544 N ASN D 20 -11.849 18.117 10.006 1.00 0.00 N ATOM 1545 CA ASN D 20 -10.725 17.418 9.391 1.00 0.00 C ATOM 1546 C ASN D 20 -9.963 18.347 8.451 1.00 0.00 C ATOM 1547 O ASN D 20 -9.541 17.939 7.369 1.00 0.00 O ATOM 1548 CB ASN D 20 -11.231 16.205 8.609 1.00 0.00 C ATOM 1549 CG ASN D 20 -10.064 15.293 8.251 1.00 0.00 C ATOM 1550 OD1 ASN D 20 -9.153 15.104 9.057 1.00 0.00 O ATOM 1551 ND2 ASN D 20 -10.034 14.717 7.081 1.00 0.00 N ATOM 0 H ASN D 20 -11.836 18.129 11.026 1.00 0.00 H new ATOM 0 HA ASN D 20 -10.051 17.088 10.182 1.00 0.00 H new ATOM 0 HB2 ASN D 20 -11.962 15.657 9.204 1.00 0.00 H new ATOM 0 HB3 ASN D 20 -11.739 16.533 7.702 1.00 0.00 H new ATOM 0 HD21 ASN D 20 -9.254 14.108 6.832 1.00 0.00 H new ATOM 0 HD22 ASN D 20 -10.790 14.875 6.415 1.00 0.00 H new ATOM 1558 N ASP D 21 -9.790 19.595 8.872 1.00 0.00 N ATOM 1559 CA ASP D 21 -9.077 20.572 8.057 1.00 0.00 C ATOM 1560 C ASP D 21 -7.580 20.274 8.047 1.00 0.00 C ATOM 1561 O ASP D 21 -6.853 20.728 7.163 1.00 0.00 O ATOM 1562 CB ASP D 21 -9.315 21.979 8.607 1.00 0.00 C ATOM 1563 CG ASP D 21 -10.760 22.397 8.362 1.00 0.00 C ATOM 1564 OD1 ASP D 21 -11.420 21.740 7.572 1.00 0.00 O ATOM 1565 OD2 ASP D 21 -11.187 23.368 8.965 1.00 0.00 O ATOM 0 H ASP D 21 -10.130 19.952 9.765 1.00 0.00 H new ATOM 0 HA ASP D 21 -9.453 20.511 7.036 1.00 0.00 H new ATOM 0 HB2 ASP D 21 -9.097 22.003 9.675 1.00 0.00 H new ATOM 0 HB3 ASP D 21 -8.637 22.685 8.128 1.00 0.00 H new ATOM 1570 N SER D 22 -7.126 19.513 9.039 1.00 0.00 N ATOM 1571 CA SER D 22 -5.712 19.167 9.139 1.00 0.00 C ATOM 1572 C SER D 22 -5.272 18.327 7.944 1.00 0.00 C ATOM 1573 O SER D 22 -4.136 18.437 7.484 1.00 0.00 O ATOM 1574 CB SER D 22 -5.455 18.388 10.430 1.00 0.00 C ATOM 1575 OG SER D 22 -6.241 17.206 10.430 1.00 0.00 O ATOM 0 H SER D 22 -7.712 19.127 9.780 1.00 0.00 H new ATOM 0 HA SER D 22 -5.136 20.092 9.148 1.00 0.00 H new ATOM 0 HB2 SER D 22 -4.398 18.135 10.511 1.00 0.00 H new ATOM 0 HB3 SER D 22 -5.703 19.003 11.295 1.00 0.00 H new ATOM 0 HG SER D 22 -6.077 16.704 11.256 1.00 0.00 H new ATOM 1581 N SER D 23 -6.177 17.489 7.445 1.00 0.00 N ATOM 1582 CA SER D 23 -5.874 16.637 6.305 1.00 0.00 C ATOM 1583 C SER D 23 -7.150 16.355 5.521 1.00 0.00 C ATOM 1584 O SER D 23 -8.196 16.061 6.101 1.00 0.00 O ATOM 1585 CB SER D 23 -5.261 15.321 6.784 1.00 0.00 C ATOM 1586 OG SER D 23 -4.137 15.602 7.607 1.00 0.00 O ATOM 0 H SER D 23 -7.123 17.384 7.813 1.00 0.00 H new ATOM 0 HA SER D 23 -5.159 17.147 5.659 1.00 0.00 H new ATOM 0 HB2 SER D 23 -5.999 14.743 7.340 1.00 0.00 H new ATOM 0 HB3 SER D 23 -4.959 14.714 5.930 1.00 0.00 H new ATOM 0 HG SER D 23 -3.741 14.761 7.918 1.00 0.00 H new ATOM 1592 N ASP D 24 -7.058 16.458 4.206 1.00 0.00 N ATOM 1593 CA ASP D 24 -8.215 16.224 3.350 1.00 0.00 C ATOM 1594 C ASP D 24 -8.799 14.823 3.596 1.00 0.00 C ATOM 1595 O ASP D 24 -8.055 13.896 3.919 1.00 0.00 O ATOM 1596 CB ASP D 24 -7.805 16.357 1.880 1.00 0.00 C ATOM 1597 CG ASP D 24 -6.883 17.561 1.700 1.00 0.00 C ATOM 1598 OD1 ASP D 24 -7.393 18.665 1.607 1.00 0.00 O ATOM 1599 OD2 ASP D 24 -5.680 17.360 1.654 1.00 0.00 O ATOM 0 H ASP D 24 -6.202 16.700 3.708 1.00 0.00 H new ATOM 0 HA ASP D 24 -8.977 16.966 3.588 1.00 0.00 H new ATOM 0 HB2 ASP D 24 -7.299 15.449 1.552 1.00 0.00 H new ATOM 0 HB3 ASP D 24 -8.691 16.471 1.256 1.00 0.00 H new ATOM 1604 N PRO D 25 -10.096 14.634 3.436 1.00 0.00 N ATOM 1605 CA PRO D 25 -10.730 13.295 3.636 1.00 0.00 C ATOM 1606 C PRO D 25 -9.950 12.173 2.947 1.00 0.00 C ATOM 1607 O PRO D 25 -9.808 11.075 3.487 1.00 0.00 O ATOM 1608 CB PRO D 25 -12.116 13.452 2.991 1.00 0.00 C ATOM 1609 CG PRO D 25 -12.436 14.912 3.079 1.00 0.00 C ATOM 1610 CD PRO D 25 -11.097 15.662 3.073 1.00 0.00 C ATOM 0 HA PRO D 25 -10.763 13.017 4.689 1.00 0.00 H new ATOM 0 HB2 PRO D 25 -12.107 13.114 1.955 1.00 0.00 H new ATOM 0 HB3 PRO D 25 -12.862 12.855 3.515 1.00 0.00 H new ATOM 0 HG2 PRO D 25 -13.057 15.223 2.239 1.00 0.00 H new ATOM 0 HG3 PRO D 25 -12.997 15.130 3.988 1.00 0.00 H new ATOM 0 HD2 PRO D 25 -10.887 16.092 2.094 1.00 0.00 H new ATOM 0 HD3 PRO D 25 -11.099 16.484 3.789 1.00 0.00 H new ATOM 1618 N LEU D 26 -9.464 12.448 1.746 1.00 0.00 N ATOM 1619 CA LEU D 26 -8.712 11.453 0.993 1.00 0.00 C ATOM 1620 C LEU D 26 -7.388 11.126 1.687 1.00 0.00 C ATOM 1621 O LEU D 26 -6.982 9.965 1.747 1.00 0.00 O ATOM 1622 CB LEU D 26 -8.438 11.975 -0.419 1.00 0.00 C ATOM 1623 CG LEU D 26 -9.756 12.103 -1.196 1.00 0.00 C ATOM 1624 CD1 LEU D 26 -9.494 12.862 -2.499 1.00 0.00 C ATOM 1625 CD2 LEU D 26 -10.333 10.709 -1.519 1.00 0.00 C ATOM 0 H LEU D 26 -9.575 13.345 1.274 1.00 0.00 H new ATOM 0 HA LEU D 26 -9.306 10.541 0.939 1.00 0.00 H new ATOM 0 HB2 LEU D 26 -7.941 12.944 -0.367 1.00 0.00 H new ATOM 0 HB3 LEU D 26 -7.763 11.298 -0.941 1.00 0.00 H new ATOM 0 HG LEU D 26 -10.478 12.644 -0.585 1.00 0.00 H new ATOM 0 HD11 LEU D 26 -10.425 12.958 -3.058 1.00 0.00 H new ATOM 0 HD12 LEU D 26 -9.104 13.854 -2.270 1.00 0.00 H new ATOM 0 HD13 LEU D 26 -8.766 12.316 -3.098 1.00 0.00 H new ATOM 0 HD21 LEU D 26 -11.267 10.821 -2.070 1.00 0.00 H new ATOM 0 HD22 LEU D 26 -9.619 10.151 -2.125 1.00 0.00 H new ATOM 0 HD23 LEU D 26 -10.521 10.169 -0.591 1.00 0.00 H new ATOM 1637 N VAL D 27 -6.712 12.155 2.193 1.00 0.00 N ATOM 1638 CA VAL D 27 -5.426 11.958 2.861 1.00 0.00 C ATOM 1639 C VAL D 27 -5.582 11.093 4.110 1.00 0.00 C ATOM 1640 O VAL D 27 -4.851 10.119 4.296 1.00 0.00 O ATOM 1641 CB VAL D 27 -4.842 13.320 3.254 1.00 0.00 C ATOM 1642 CG1 VAL D 27 -3.586 13.126 4.107 1.00 0.00 C ATOM 1643 CG2 VAL D 27 -4.481 14.104 1.990 1.00 0.00 C ATOM 0 H VAL D 27 -7.028 13.124 2.155 1.00 0.00 H new ATOM 0 HA VAL D 27 -4.755 11.447 2.171 1.00 0.00 H new ATOM 0 HB VAL D 27 -5.584 13.872 3.831 1.00 0.00 H new ATOM 0 HG11 VAL D 27 -3.178 14.099 4.381 1.00 0.00 H new ATOM 0 HG12 VAL D 27 -3.842 12.572 5.010 1.00 0.00 H new ATOM 0 HG13 VAL D 27 -2.842 12.568 3.538 1.00 0.00 H new ATOM 0 HG21 VAL D 27 -4.066 15.072 2.269 1.00 0.00 H new ATOM 0 HG22 VAL D 27 -3.744 13.545 1.414 1.00 0.00 H new ATOM 0 HG23 VAL D 27 -5.376 14.253 1.386 1.00 0.00 H new ATOM 1653 N VAL D 28 -6.536 11.452 4.962 1.00 0.00 N ATOM 1654 CA VAL D 28 -6.772 10.696 6.188 1.00 0.00 C ATOM 1655 C VAL D 28 -7.362 9.334 5.865 1.00 0.00 C ATOM 1656 O VAL D 28 -6.982 8.321 6.451 1.00 0.00 O ATOM 1657 CB VAL D 28 -7.723 11.469 7.102 1.00 0.00 C ATOM 1658 CG1 VAL D 28 -9.085 11.617 6.432 1.00 0.00 C ATOM 1659 CG2 VAL D 28 -7.880 10.724 8.428 1.00 0.00 C ATOM 0 H VAL D 28 -7.153 12.253 4.829 1.00 0.00 H new ATOM 0 HA VAL D 28 -5.819 10.554 6.698 1.00 0.00 H new ATOM 0 HB VAL D 28 -7.310 12.460 7.290 1.00 0.00 H new ATOM 0 HG11 VAL D 28 -9.756 12.169 7.090 1.00 0.00 H new ATOM 0 HG12 VAL D 28 -8.972 12.158 5.493 1.00 0.00 H new ATOM 0 HG13 VAL D 28 -9.502 10.630 6.234 1.00 0.00 H new ATOM 0 HG21 VAL D 28 -8.558 11.277 9.078 1.00 0.00 H new ATOM 0 HG22 VAL D 28 -8.286 9.730 8.241 1.00 0.00 H new ATOM 0 HG23 VAL D 28 -6.907 10.633 8.912 1.00 0.00 H new ATOM 1669 N ALA D 29 -8.296 9.323 4.928 1.00 0.00 N ATOM 1670 CA ALA D 29 -8.946 8.081 4.526 1.00 0.00 C ATOM 1671 C ALA D 29 -7.929 7.103 3.951 1.00 0.00 C ATOM 1672 O ALA D 29 -7.981 5.907 4.230 1.00 0.00 O ATOM 1673 CB ALA D 29 -10.024 8.365 3.479 1.00 0.00 C ATOM 0 H ALA D 29 -8.621 10.153 4.433 1.00 0.00 H new ATOM 0 HA ALA D 29 -9.405 7.637 5.409 1.00 0.00 H new ATOM 0 HB1 ALA D 29 -10.502 7.430 3.186 1.00 0.00 H new ATOM 0 HB2 ALA D 29 -10.771 9.039 3.899 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -9.568 8.829 2.604 1.00 0.00 H new ATOM 1679 N ALA D 30 -7.005 7.614 3.149 1.00 0.00 N ATOM 1680 CA ALA D 30 -5.989 6.764 2.544 1.00 0.00 C ATOM 1681 C ALA D 30 -5.127 6.113 3.617 1.00 0.00 C ATOM 1682 O ALA D 30 -4.803 4.928 3.534 1.00 0.00 O ATOM 1683 CB ALA D 30 -5.102 7.591 1.612 1.00 0.00 C ATOM 0 H ALA D 30 -6.938 8.602 2.904 1.00 0.00 H new ATOM 0 HA ALA D 30 -6.491 5.984 1.972 1.00 0.00 H new ATOM 0 HB1 ALA D 30 -4.345 6.947 1.164 1.00 0.00 H new ATOM 0 HB2 ALA D 30 -5.713 8.034 0.826 1.00 0.00 H new ATOM 0 HB3 ALA D 30 -4.614 8.382 2.181 1.00 0.00 H new ATOM 1689 N ASN D 31 -4.758 6.894 4.628 1.00 0.00 N ATOM 1690 CA ASN D 31 -3.932 6.375 5.711 1.00 0.00 C ATOM 1691 C ASN D 31 -4.681 5.297 6.489 1.00 0.00 C ATOM 1692 O ASN D 31 -4.112 4.263 6.835 1.00 0.00 O ATOM 1693 CB ASN D 31 -3.548 7.514 6.659 1.00 0.00 C ATOM 1694 CG ASN D 31 -2.601 8.488 5.963 1.00 0.00 C ATOM 1695 OD1 ASN D 31 -2.595 9.677 6.275 1.00 0.00 O ATOM 1696 ND2 ASN D 31 -1.789 8.053 5.034 1.00 0.00 N ATOM 0 H ASN D 31 -5.015 7.877 4.719 1.00 0.00 H new ATOM 0 HA ASN D 31 -3.032 5.936 5.280 1.00 0.00 H new ATOM 0 HB2 ASN D 31 -4.444 8.040 6.988 1.00 0.00 H new ATOM 0 HB3 ASN D 31 -3.071 7.108 7.551 1.00 0.00 H new ATOM 0 HD21 ASN D 31 -1.152 8.700 4.570 1.00 0.00 H new ATOM 0 HD22 ASN D 31 -1.793 7.067 4.774 1.00 0.00 H new ATOM 1703 N ILE D 32 -5.958 5.546 6.762 1.00 0.00 N ATOM 1704 CA ILE D 32 -6.768 4.585 7.504 1.00 0.00 C ATOM 1705 C ILE D 32 -6.942 3.299 6.697 1.00 0.00 C ATOM 1706 O ILE D 32 -6.819 2.198 7.233 1.00 0.00 O ATOM 1707 CB ILE D 32 -8.140 5.193 7.814 1.00 0.00 C ATOM 1708 CG1 ILE D 32 -7.970 6.348 8.804 1.00 0.00 C ATOM 1709 CG2 ILE D 32 -9.048 4.127 8.438 1.00 0.00 C ATOM 1710 CD1 ILE D 32 -9.279 7.134 8.902 1.00 0.00 C ATOM 0 H ILE D 32 -6.450 6.395 6.484 1.00 0.00 H new ATOM 0 HA ILE D 32 -6.259 4.346 8.438 1.00 0.00 H new ATOM 0 HB ILE D 32 -8.589 5.559 6.891 1.00 0.00 H new ATOM 0 HG12 ILE D 32 -7.691 5.962 9.785 1.00 0.00 H new ATOM 0 HG13 ILE D 32 -7.163 7.004 8.478 1.00 0.00 H new ATOM 0 HG21 ILE D 32 -10.023 4.562 8.657 1.00 0.00 H new ATOM 0 HG22 ILE D 32 -9.169 3.299 7.740 1.00 0.00 H new ATOM 0 HG23 ILE D 32 -8.598 3.761 9.361 1.00 0.00 H new ATOM 0 HD11 ILE D 32 -9.158 7.956 9.607 1.00 0.00 H new ATOM 0 HD12 ILE D 32 -9.539 7.532 7.921 1.00 0.00 H new ATOM 0 HD13 ILE D 32 -10.075 6.474 9.248 1.00 0.00 H new ATOM 1722 N ILE D 33 -7.227 3.451 5.409 1.00 0.00 N ATOM 1723 CA ILE D 33 -7.415 2.298 4.536 1.00 0.00 C ATOM 1724 C ILE D 33 -6.123 1.490 4.415 1.00 0.00 C ATOM 1725 O ILE D 33 -6.144 0.261 4.474 1.00 0.00 O ATOM 1726 CB ILE D 33 -7.873 2.768 3.149 1.00 0.00 C ATOM 1727 CG1 ILE D 33 -9.294 3.335 3.243 1.00 0.00 C ATOM 1728 CG2 ILE D 33 -7.859 1.592 2.170 1.00 0.00 C ATOM 1729 CD1 ILE D 33 -9.643 4.065 1.943 1.00 0.00 C ATOM 0 H ILE D 33 -7.332 4.355 4.948 1.00 0.00 H new ATOM 0 HA ILE D 33 -8.180 1.655 4.971 1.00 0.00 H new ATOM 0 HB ILE D 33 -7.193 3.542 2.792 1.00 0.00 H new ATOM 0 HG12 ILE D 33 -10.006 2.530 3.422 1.00 0.00 H new ATOM 0 HG13 ILE D 33 -9.368 4.020 4.088 1.00 0.00 H new ATOM 0 HG21 ILE D 33 -8.185 1.933 1.187 1.00 0.00 H new ATOM 0 HG22 ILE D 33 -6.848 1.191 2.098 1.00 0.00 H new ATOM 0 HG23 ILE D 33 -8.534 0.814 2.527 1.00 0.00 H new ATOM 0 HD11 ILE D 33 -10.654 4.467 2.012 1.00 0.00 H new ATOM 0 HD12 ILE D 33 -8.938 4.881 1.783 1.00 0.00 H new ATOM 0 HD13 ILE D 33 -9.586 3.367 1.107 1.00 0.00 H new ATOM 1741 N GLY D 34 -5.004 2.185 4.237 1.00 0.00 N ATOM 1742 CA GLY D 34 -3.716 1.510 4.103 1.00 0.00 C ATOM 1743 C GLY D 34 -3.370 0.732 5.369 1.00 0.00 C ATOM 1744 O GLY D 34 -2.962 -0.431 5.308 1.00 0.00 O ATOM 0 H GLY D 34 -4.961 3.203 4.183 1.00 0.00 H new ATOM 0 HA2 GLY D 34 -3.745 0.831 3.251 1.00 0.00 H new ATOM 0 HA3 GLY D 34 -2.937 2.244 3.899 1.00 0.00 H new ATOM 1748 N ILE D 35 -3.544 1.375 6.516 1.00 0.00 N ATOM 1749 CA ILE D 35 -3.253 0.734 7.791 1.00 0.00 C ATOM 1750 C ILE D 35 -4.179 -0.463 8.001 1.00 0.00 C ATOM 1751 O ILE D 35 -3.743 -1.529 8.437 1.00 0.00 O ATOM 1752 CB ILE D 35 -3.431 1.739 8.931 1.00 0.00 C ATOM 1753 CG1 ILE D 35 -2.346 2.817 8.826 1.00 0.00 C ATOM 1754 CG2 ILE D 35 -3.299 1.018 10.276 1.00 0.00 C ATOM 1755 CD1 ILE D 35 -2.707 3.995 9.733 1.00 0.00 C ATOM 0 H ILE D 35 -3.883 2.334 6.590 1.00 0.00 H new ATOM 0 HA ILE D 35 -2.221 0.383 7.783 1.00 0.00 H new ATOM 0 HB ILE D 35 -4.417 2.199 8.861 1.00 0.00 H new ATOM 0 HG12 ILE D 35 -1.379 2.404 9.115 1.00 0.00 H new ATOM 0 HG13 ILE D 35 -2.252 3.154 7.794 1.00 0.00 H new ATOM 0 HG21 ILE D 35 -3.426 1.735 11.087 1.00 0.00 H new ATOM 0 HG22 ILE D 35 -4.064 0.246 10.351 1.00 0.00 H new ATOM 0 HG23 ILE D 35 -2.313 0.560 10.348 1.00 0.00 H new ATOM 0 HD11 ILE D 35 -1.936 4.761 9.658 1.00 0.00 H new ATOM 0 HD12 ILE D 35 -3.665 4.413 9.423 1.00 0.00 H new ATOM 0 HD13 ILE D 35 -2.778 3.651 10.765 1.00 0.00 H new ATOM 1767 N LEU D 36 -5.455 -0.280 7.684 1.00 0.00 N ATOM 1768 CA LEU D 36 -6.433 -1.349 7.842 1.00 0.00 C ATOM 1769 C LEU D 36 -6.039 -2.544 6.982 1.00 0.00 C ATOM 1770 O LEU D 36 -6.198 -3.695 7.391 1.00 0.00 O ATOM 1771 CB LEU D 36 -7.829 -0.859 7.439 1.00 0.00 C ATOM 1772 CG LEU D 36 -8.868 -1.975 7.634 1.00 0.00 C ATOM 1773 CD1 LEU D 36 -8.916 -2.411 9.110 1.00 0.00 C ATOM 1774 CD2 LEU D 36 -10.244 -1.457 7.203 1.00 0.00 C ATOM 0 H LEU D 36 -5.835 0.593 7.318 1.00 0.00 H new ATOM 0 HA LEU D 36 -6.454 -1.650 8.889 1.00 0.00 H new ATOM 0 HB2 LEU D 36 -8.103 0.010 8.038 1.00 0.00 H new ATOM 0 HB3 LEU D 36 -7.822 -0.539 6.397 1.00 0.00 H new ATOM 0 HG LEU D 36 -8.589 -2.836 7.027 1.00 0.00 H new ATOM 0 HD11 LEU D 36 -9.656 -3.202 9.232 1.00 0.00 H new ATOM 0 HD12 LEU D 36 -7.936 -2.781 9.412 1.00 0.00 H new ATOM 0 HD13 LEU D 36 -9.189 -1.559 9.732 1.00 0.00 H new ATOM 0 HD21 LEU D 36 -10.987 -2.243 7.338 1.00 0.00 H new ATOM 0 HD22 LEU D 36 -10.514 -0.593 7.811 1.00 0.00 H new ATOM 0 HD23 LEU D 36 -10.211 -1.166 6.153 1.00 0.00 H new ATOM 1786 N HIS D 37 -5.519 -2.268 5.791 1.00 0.00 N ATOM 1787 CA HIS D 37 -5.107 -3.336 4.890 1.00 0.00 C ATOM 1788 C HIS D 37 -4.069 -4.215 5.572 1.00 0.00 C ATOM 1789 O HIS D 37 -4.113 -5.440 5.464 1.00 0.00 O ATOM 1790 CB HIS D 37 -4.504 -2.744 3.617 1.00 0.00 C ATOM 1791 CG HIS D 37 -4.122 -3.860 2.682 1.00 0.00 C ATOM 1792 ND1 HIS D 37 -4.683 -3.999 1.426 1.00 0.00 N ATOM 1793 CD2 HIS D 37 -3.240 -4.900 2.813 1.00 0.00 C ATOM 1794 CE1 HIS D 37 -4.136 -5.087 0.859 1.00 0.00 C ATOM 1795 NE2 HIS D 37 -3.251 -5.674 1.661 1.00 0.00 N ATOM 0 H HIS D 37 -5.374 -1.325 5.431 1.00 0.00 H new ATOM 0 HA HIS D 37 -5.981 -3.934 4.633 1.00 0.00 H new ATOM 0 HB2 HIS D 37 -5.222 -2.080 3.135 1.00 0.00 H new ATOM 0 HB3 HIS D 37 -3.628 -2.143 3.861 1.00 0.00 H new ATOM 0 HD2 HIS D 37 -2.628 -5.089 3.682 1.00 0.00 H new ATOM 0 HE1 HIS D 37 -4.385 -5.443 -0.130 1.00 0.00 H new ATOM 0 HE2 HIS D 37 -2.700 -6.511 1.470 1.00 0.00 H new ATOM 1803 N LEU D 38 -3.138 -3.587 6.282 1.00 0.00 N ATOM 1804 CA LEU D 38 -2.095 -4.333 6.981 1.00 0.00 C ATOM 1805 C LEU D 38 -2.696 -5.277 8.013 1.00 0.00 C ATOM 1806 O LEU D 38 -2.222 -6.397 8.169 1.00 0.00 O ATOM 1807 CB LEU D 38 -1.113 -3.359 7.667 1.00 0.00 C ATOM 1808 CG LEU D 38 0.055 -3.014 6.718 1.00 0.00 C ATOM 1809 CD1 LEU D 38 0.677 -1.679 7.121 1.00 0.00 C ATOM 1810 CD2 LEU D 38 1.126 -4.116 6.790 1.00 0.00 C ATOM 0 H LEU D 38 -3.083 -2.574 6.389 1.00 0.00 H new ATOM 0 HA LEU D 38 -1.555 -4.929 6.246 1.00 0.00 H new ATOM 0 HB2 LEU D 38 -1.637 -2.448 7.955 1.00 0.00 H new ATOM 0 HB3 LEU D 38 -0.726 -3.807 8.582 1.00 0.00 H new ATOM 0 HG LEU D 38 -0.327 -2.942 5.700 1.00 0.00 H new ATOM 0 HD11 LEU D 38 1.500 -1.443 6.447 1.00 0.00 H new ATOM 0 HD12 LEU D 38 -0.077 -0.894 7.062 1.00 0.00 H new ATOM 0 HD13 LEU D 38 1.052 -1.746 8.142 1.00 0.00 H new ATOM 0 HD21 LEU D 38 1.948 -3.869 6.119 1.00 0.00 H new ATOM 0 HD22 LEU D 38 1.501 -4.193 7.811 1.00 0.00 H new ATOM 0 HD23 LEU D 38 0.688 -5.069 6.492 1.00 0.00 H new ATOM 1822 N ILE D 39 -3.720 -4.823 8.719 1.00 0.00 N ATOM 1823 CA ILE D 39 -4.341 -5.653 9.743 1.00 0.00 C ATOM 1824 C ILE D 39 -4.908 -6.935 9.130 1.00 0.00 C ATOM 1825 O ILE D 39 -4.714 -8.026 9.666 1.00 0.00 O ATOM 1826 CB ILE D 39 -5.473 -4.879 10.415 1.00 0.00 C ATOM 1827 CG1 ILE D 39 -4.954 -3.514 10.890 1.00 0.00 C ATOM 1828 CG2 ILE D 39 -6.009 -5.676 11.608 1.00 0.00 C ATOM 1829 CD1 ILE D 39 -3.711 -3.680 11.773 1.00 0.00 C ATOM 0 H ILE D 39 -4.135 -3.898 8.606 1.00 0.00 H new ATOM 0 HA ILE D 39 -3.581 -5.917 10.478 1.00 0.00 H new ATOM 0 HB ILE D 39 -6.280 -4.726 9.698 1.00 0.00 H new ATOM 0 HG12 ILE D 39 -4.713 -2.892 10.028 1.00 0.00 H new ATOM 0 HG13 ILE D 39 -5.735 -2.997 11.448 1.00 0.00 H new ATOM 0 HG21 ILE D 39 -6.816 -5.120 12.084 1.00 0.00 H new ATOM 0 HG22 ILE D 39 -6.386 -6.639 11.263 1.00 0.00 H new ATOM 0 HG23 ILE D 39 -5.206 -5.838 12.328 1.00 0.00 H new ATOM 0 HD11 ILE D 39 -3.362 -2.700 12.097 1.00 0.00 H new ATOM 0 HD12 ILE D 39 -3.963 -4.283 12.646 1.00 0.00 H new ATOM 0 HD13 ILE D 39 -2.924 -4.176 11.204 1.00 0.00 H new ATOM 1841 N LEU D 40 -5.612 -6.804 8.012 1.00 0.00 N ATOM 1842 CA LEU D 40 -6.190 -7.975 7.357 1.00 0.00 C ATOM 1843 C LEU D 40 -5.112 -8.800 6.652 1.00 0.00 C ATOM 1844 O LEU D 40 -5.083 -10.025 6.766 1.00 0.00 O ATOM 1845 CB LEU D 40 -7.252 -7.539 6.342 1.00 0.00 C ATOM 1846 CG LEU D 40 -7.908 -8.770 5.694 1.00 0.00 C ATOM 1847 CD1 LEU D 40 -8.598 -9.641 6.762 1.00 0.00 C ATOM 1848 CD2 LEU D 40 -8.942 -8.292 4.667 1.00 0.00 C ATOM 0 H LEU D 40 -5.795 -5.916 7.545 1.00 0.00 H new ATOM 0 HA LEU D 40 -6.653 -8.596 8.124 1.00 0.00 H new ATOM 0 HB2 LEU D 40 -8.010 -6.932 6.837 1.00 0.00 H new ATOM 0 HB3 LEU D 40 -6.796 -6.915 5.574 1.00 0.00 H new ATOM 0 HG LEU D 40 -7.142 -9.372 5.204 1.00 0.00 H new ATOM 0 HD11 LEU D 40 -9.056 -10.507 6.285 1.00 0.00 H new ATOM 0 HD12 LEU D 40 -7.860 -9.977 7.490 1.00 0.00 H new ATOM 0 HD13 LEU D 40 -9.367 -9.056 7.267 1.00 0.00 H new ATOM 0 HD21 LEU D 40 -9.416 -9.155 4.199 1.00 0.00 H new ATOM 0 HD22 LEU D 40 -9.700 -7.689 5.167 1.00 0.00 H new ATOM 0 HD23 LEU D 40 -8.446 -7.692 3.904 1.00 0.00 H new ATOM 1860 N TRP D 41 -4.240 -8.121 5.910 1.00 0.00 N ATOM 1861 CA TRP D 41 -3.180 -8.807 5.174 1.00 0.00 C ATOM 1862 C TRP D 41 -2.236 -9.540 6.122 1.00 0.00 C ATOM 1863 O TRP D 41 -1.909 -10.707 5.900 1.00 0.00 O ATOM 1864 CB TRP D 41 -2.396 -7.793 4.326 1.00 0.00 C ATOM 1865 CG TRP D 41 -1.163 -8.436 3.761 1.00 0.00 C ATOM 1866 CD1 TRP D 41 -1.111 -9.174 2.629 1.00 0.00 C ATOM 1867 CD2 TRP D 41 0.198 -8.378 4.273 1.00 0.00 C ATOM 1868 NE1 TRP D 41 0.192 -9.593 2.429 1.00 0.00 N ATOM 1869 CE2 TRP D 41 1.037 -9.123 3.415 1.00 0.00 C ATOM 1870 CE3 TRP D 41 0.778 -7.761 5.393 1.00 0.00 C ATOM 1871 CZ2 TRP D 41 2.400 -9.249 3.661 1.00 0.00 C ATOM 1872 CZ3 TRP D 41 2.154 -7.882 5.638 1.00 0.00 C ATOM 1873 CH2 TRP D 41 2.961 -8.624 4.774 1.00 0.00 C ATOM 0 H TRP D 41 -4.245 -7.107 5.803 1.00 0.00 H new ATOM 0 HA TRP D 41 -3.641 -9.547 4.520 1.00 0.00 H new ATOM 0 HB2 TRP D 41 -3.025 -7.421 3.517 1.00 0.00 H new ATOM 0 HB3 TRP D 41 -2.120 -6.933 4.936 1.00 0.00 H new ATOM 0 HD1 TRP D 41 -1.949 -9.399 1.986 1.00 0.00 H new ATOM 0 HE1 TRP D 41 0.492 -10.178 1.649 1.00 0.00 H new ATOM 0 HE3 TRP D 41 0.161 -7.189 6.070 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 3.021 -9.828 2.993 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 2.591 -7.399 6.499 1.00 0.00 H new ATOM 0 HH2 TRP D 41 4.020 -8.714 4.968 1.00 0.00 H new ATOM 1884 N ILE D 42 -1.787 -8.854 7.162 1.00 0.00 N ATOM 1885 CA ILE D 42 -0.868 -9.466 8.112 1.00 0.00 C ATOM 1886 C ILE D 42 -1.561 -10.605 8.856 1.00 0.00 C ATOM 1887 O ILE D 42 -0.967 -11.655 9.095 1.00 0.00 O ATOM 1888 CB ILE D 42 -0.358 -8.409 9.106 1.00 0.00 C ATOM 1889 CG1 ILE D 42 0.894 -8.932 9.820 1.00 0.00 C ATOM 1890 CG2 ILE D 42 -1.433 -8.089 10.157 1.00 0.00 C ATOM 1891 CD1 ILE D 42 1.516 -7.796 10.631 1.00 0.00 C ATOM 0 H ILE D 42 -2.039 -7.887 7.369 1.00 0.00 H new ATOM 0 HA ILE D 42 -0.017 -9.875 7.568 1.00 0.00 H new ATOM 0 HB ILE D 42 -0.121 -7.502 8.550 1.00 0.00 H new ATOM 0 HG12 ILE D 42 0.634 -9.764 10.475 1.00 0.00 H new ATOM 0 HG13 ILE D 42 1.611 -9.312 9.092 1.00 0.00 H new ATOM 0 HG21 ILE D 42 -1.052 -7.339 10.850 1.00 0.00 H new ATOM 0 HG22 ILE D 42 -2.324 -7.705 9.661 1.00 0.00 H new ATOM 0 HG23 ILE D 42 -1.686 -8.996 10.706 1.00 0.00 H new ATOM 0 HD11 ILE D 42 2.407 -8.160 11.142 1.00 0.00 H new ATOM 0 HD12 ILE D 42 1.789 -6.979 9.963 1.00 0.00 H new ATOM 0 HD13 ILE D 42 0.796 -7.438 11.367 1.00 0.00 H new ATOM 1903 N LEU D 43 -2.820 -10.386 9.218 1.00 0.00 N ATOM 1904 CA LEU D 43 -3.587 -11.395 9.936 1.00 0.00 C ATOM 1905 C LEU D 43 -3.760 -12.646 9.082 1.00 0.00 C ATOM 1906 O LEU D 43 -3.646 -13.767 9.578 1.00 0.00 O ATOM 1907 CB LEU D 43 -4.962 -10.834 10.319 1.00 0.00 C ATOM 1908 CG LEU D 43 -5.805 -11.911 11.024 1.00 0.00 C ATOM 1909 CD1 LEU D 43 -5.056 -12.452 12.254 1.00 0.00 C ATOM 1910 CD2 LEU D 43 -7.137 -11.295 11.465 1.00 0.00 C ATOM 0 H LEU D 43 -3.329 -9.523 9.027 1.00 0.00 H new ATOM 0 HA LEU D 43 -3.042 -11.663 10.841 1.00 0.00 H new ATOM 0 HB2 LEU D 43 -4.840 -9.972 10.975 1.00 0.00 H new ATOM 0 HB3 LEU D 43 -5.480 -10.484 9.426 1.00 0.00 H new ATOM 0 HG LEU D 43 -5.987 -12.735 10.333 1.00 0.00 H new ATOM 0 HD11 LEU D 43 -5.663 -13.213 12.744 1.00 0.00 H new ATOM 0 HD12 LEU D 43 -4.109 -12.890 11.940 1.00 0.00 H new ATOM 0 HD13 LEU D 43 -4.865 -11.636 12.951 1.00 0.00 H new ATOM 0 HD21 LEU D 43 -7.740 -12.052 11.966 1.00 0.00 H new ATOM 0 HD22 LEU D 43 -6.947 -10.470 12.152 1.00 0.00 H new ATOM 0 HD23 LEU D 43 -7.673 -10.923 10.592 1.00 0.00 H new ATOM 1922 N ASP D 44 -4.050 -12.452 7.802 1.00 0.00 N ATOM 1923 CA ASP D 44 -4.252 -13.577 6.900 1.00 0.00 C ATOM 1924 C ASP D 44 -3.009 -14.458 6.859 1.00 0.00 C ATOM 1925 O ASP D 44 -3.104 -15.686 6.921 1.00 0.00 O ATOM 1926 CB ASP D 44 -4.566 -13.068 5.494 1.00 0.00 C ATOM 1927 CG ASP D 44 -5.056 -14.219 4.623 1.00 0.00 C ATOM 1928 OD1 ASP D 44 -6.115 -14.748 4.915 1.00 0.00 O ATOM 1929 OD2 ASP D 44 -4.363 -14.555 3.677 1.00 0.00 O ATOM 0 H ASP D 44 -4.150 -11.534 7.368 1.00 0.00 H new ATOM 0 HA ASP D 44 -5.091 -14.168 7.267 1.00 0.00 H new ATOM 0 HB2 ASP D 44 -5.325 -12.288 5.542 1.00 0.00 H new ATOM 0 HB3 ASP D 44 -3.676 -12.620 5.053 1.00 0.00 H new ATOM 1934 N ARG D 45 -1.847 -13.830 6.760 1.00 0.00 N ATOM 1935 CA ARG D 45 -0.593 -14.572 6.718 1.00 0.00 C ATOM 1936 C ARG D 45 -0.314 -15.232 8.064 1.00 0.00 C ATOM 1937 O ARG D 45 0.473 -16.173 8.151 1.00 0.00 O ATOM 1938 CB ARG D 45 0.559 -13.630 6.360 1.00 0.00 C ATOM 1939 CG ARG D 45 1.871 -14.417 6.328 1.00 0.00 C ATOM 1940 CD ARG D 45 2.980 -13.538 5.751 1.00 0.00 C ATOM 1941 NE ARG D 45 2.748 -13.305 4.331 1.00 0.00 N ATOM 1942 CZ ARG D 45 3.407 -12.358 3.671 1.00 0.00 C ATOM 1943 NH1 ARG D 45 4.273 -11.609 4.294 1.00 0.00 N ATOM 1944 NH2 ARG D 45 3.186 -12.180 2.397 1.00 0.00 N ATOM 0 H ARG D 45 -1.745 -12.817 6.708 1.00 0.00 H new ATOM 0 HA ARG D 45 -0.678 -15.348 5.957 1.00 0.00 H new ATOM 0 HB2 ARG D 45 0.376 -13.167 5.390 1.00 0.00 H new ATOM 0 HB3 ARG D 45 0.624 -12.824 7.091 1.00 0.00 H new ATOM 0 HG2 ARG D 45 2.137 -14.742 7.334 1.00 0.00 H new ATOM 0 HG3 ARG D 45 1.753 -15.316 5.723 1.00 0.00 H new ATOM 0 HD2 ARG D 45 3.014 -12.587 6.282 1.00 0.00 H new ATOM 0 HD3 ARG D 45 3.948 -14.019 5.895 1.00 0.00 H new ATOM 0 HE ARG D 45 2.067 -13.880 3.834 1.00 0.00 H new ATOM 0 HH11 ARG D 45 4.446 -11.749 5.289 1.00 0.00 H new ATOM 0 HH12 ARG D 45 4.778 -10.883 3.786 1.00 0.00 H new ATOM 0 HH21 ARG D 45 2.509 -12.767 1.910 1.00 0.00 H new ATOM 0 HH22 ARG D 45 3.691 -11.454 1.888 1.00 0.00 H new ATOM 1958 N LEU D 46 -0.952 -14.729 9.117 1.00 0.00 N ATOM 1959 CA LEU D 46 -0.743 -15.283 10.450 1.00 0.00 C ATOM 1960 C LEU D 46 -1.202 -16.745 10.493 1.00 0.00 C ATOM 1961 O LEU D 46 -0.465 -17.625 10.939 1.00 0.00 O ATOM 1962 CB LEU D 46 -1.527 -14.449 11.478 1.00 0.00 C ATOM 1963 CG LEU D 46 -0.874 -14.547 12.866 1.00 0.00 C ATOM 1964 CD1 LEU D 46 -1.659 -13.677 13.851 1.00 0.00 C ATOM 1965 CD2 LEU D 46 -0.869 -16.005 13.351 1.00 0.00 C ATOM 0 H LEU D 46 -1.609 -13.950 9.075 1.00 0.00 H new ATOM 0 HA LEU D 46 0.319 -15.248 10.693 1.00 0.00 H new ATOM 0 HB2 LEU D 46 -1.561 -13.407 11.159 1.00 0.00 H new ATOM 0 HB3 LEU D 46 -2.557 -14.800 11.529 1.00 0.00 H new ATOM 0 HG LEU D 46 0.157 -14.198 12.804 1.00 0.00 H new ATOM 0 HD11 LEU D 46 -1.201 -13.742 14.838 1.00 0.00 H new ATOM 0 HD12 LEU D 46 -1.646 -12.641 13.512 1.00 0.00 H new ATOM 0 HD13 LEU D 46 -2.690 -14.028 13.905 1.00 0.00 H new ATOM 0 HD21 LEU D 46 -0.404 -16.059 14.335 1.00 0.00 H new ATOM 0 HD22 LEU D 46 -1.894 -16.371 13.413 1.00 0.00 H new ATOM 0 HD23 LEU D 46 -0.306 -16.620 12.649 1.00 0.00 H new ATOM 1977 N PHE D 47 -2.418 -16.999 10.011 1.00 0.00 N ATOM 1978 CA PHE D 47 -2.955 -18.357 9.995 1.00 0.00 C ATOM 1979 C PHE D 47 -2.142 -19.254 9.069 1.00 0.00 C ATOM 1980 O PHE D 47 -1.806 -20.385 9.419 1.00 0.00 O ATOM 1981 CB PHE D 47 -4.418 -18.337 9.541 1.00 0.00 C ATOM 1982 CG PHE D 47 -5.272 -17.722 10.625 1.00 0.00 C ATOM 1983 CD1 PHE D 47 -5.762 -18.521 11.664 1.00 0.00 C ATOM 1984 CD2 PHE D 47 -5.574 -16.355 10.591 1.00 0.00 C ATOM 1985 CE1 PHE D 47 -6.553 -17.956 12.671 1.00 0.00 C ATOM 1986 CE2 PHE D 47 -6.365 -15.788 11.599 1.00 0.00 C ATOM 1987 CZ PHE D 47 -6.855 -16.589 12.638 1.00 0.00 C ATOM 0 H PHE D 47 -3.044 -16.289 9.630 1.00 0.00 H new ATOM 0 HA PHE D 47 -2.894 -18.758 11.007 1.00 0.00 H new ATOM 0 HB2 PHE D 47 -4.516 -17.766 8.618 1.00 0.00 H new ATOM 0 HB3 PHE D 47 -4.757 -19.350 9.326 1.00 0.00 H new ATOM 0 HD1 PHE D 47 -5.529 -19.575 11.689 1.00 0.00 H new ATOM 0 HD2 PHE D 47 -5.197 -15.738 9.788 1.00 0.00 H new ATOM 0 HE1 PHE D 47 -6.930 -18.574 13.473 1.00 0.00 H new ATOM 0 HE2 PHE D 47 -6.597 -14.733 11.575 1.00 0.00 H new ATOM 0 HZ PHE D 47 -7.466 -16.152 13.414 1.00 0.00 H new ATOM 1997 N PHE D 48 -1.830 -18.743 7.878 1.00 0.00 N ATOM 1998 CA PHE D 48 -1.054 -19.500 6.892 1.00 0.00 C ATOM 1999 C PHE D 48 0.337 -18.905 6.734 1.00 0.00 C ATOM 2000 O PHE D 48 0.485 -17.733 6.388 1.00 0.00 O ATOM 2001 CB PHE D 48 -1.779 -19.477 5.545 1.00 0.00 C ATOM 2002 CG PHE D 48 -2.982 -20.387 5.604 1.00 0.00 C ATOM 2003 CD1 PHE D 48 -4.179 -19.931 6.167 1.00 0.00 C ATOM 2004 CD2 PHE D 48 -2.896 -21.690 5.097 1.00 0.00 C ATOM 2005 CE1 PHE D 48 -5.292 -20.777 6.223 1.00 0.00 C ATOM 2006 CE2 PHE D 48 -4.009 -22.536 5.153 1.00 0.00 C ATOM 2007 CZ PHE D 48 -5.208 -22.078 5.715 1.00 0.00 C ATOM 0 H PHE D 48 -2.102 -17.809 7.571 1.00 0.00 H new ATOM 0 HA PHE D 48 -0.955 -20.528 7.239 1.00 0.00 H new ATOM 0 HB2 PHE D 48 -2.090 -18.460 5.305 1.00 0.00 H new ATOM 0 HB3 PHE D 48 -1.105 -19.799 4.752 1.00 0.00 H new ATOM 0 HD1 PHE D 48 -4.244 -18.926 6.558 1.00 0.00 H new ATOM 0 HD2 PHE D 48 -1.971 -22.041 4.663 1.00 0.00 H new ATOM 0 HE1 PHE D 48 -6.216 -20.426 6.658 1.00 0.00 H new ATOM 0 HE2 PHE D 48 -3.944 -23.541 4.763 1.00 0.00 H new ATOM 0 HZ PHE D 48 -6.068 -22.730 5.756 1.00 0.00 H new ATOM 2017 N LYS D 49 1.352 -19.719 6.989 1.00 0.00 N ATOM 2018 CA LYS D 49 2.729 -19.265 6.873 1.00 0.00 C ATOM 2019 C LYS D 49 3.091 -19.034 5.408 1.00 0.00 C ATOM 2020 O LYS D 49 2.548 -19.728 4.566 1.00 0.00 O ATOM 2021 CB LYS D 49 3.671 -20.311 7.477 1.00 0.00 C ATOM 2022 CG LYS D 49 3.257 -20.629 8.921 1.00 0.00 C ATOM 2023 CD LYS D 49 3.431 -19.394 9.811 1.00 0.00 C ATOM 2024 CE LYS D 49 3.450 -19.819 11.284 1.00 0.00 C ATOM 2025 NZ LYS D 49 2.125 -20.398 11.648 1.00 0.00 N ATOM 2026 OXT LYS D 49 3.909 -18.165 5.152 1.00 0.00 O ATOM 0 H LYS D 49 1.248 -20.692 7.276 1.00 0.00 H new ATOM 0 HA LYS D 49 2.834 -18.325 7.414 1.00 0.00 H new ATOM 0 HB2 LYS D 49 3.649 -21.220 6.876 1.00 0.00 H new ATOM 0 HB3 LYS D 49 4.696 -19.941 7.458 1.00 0.00 H new ATOM 0 HG2 LYS D 49 2.218 -20.958 8.944 1.00 0.00 H new ATOM 0 HG3 LYS D 49 3.860 -21.451 9.306 1.00 0.00 H new ATOM 0 HD2 LYS D 49 4.358 -18.879 9.559 1.00 0.00 H new ATOM 0 HD3 LYS D 49 2.618 -18.690 9.636 1.00 0.00 H new ATOM 0 HE2 LYS D 49 4.239 -20.552 11.452 1.00 0.00 H new ATOM 0 HE3 LYS D 49 3.671 -18.961 11.919 1.00 0.00 H new ATOM 0 HZ1 LYS D 49 2.075 -20.530 12.678 1.00 0.00 H new ATOM 0 HZ2 LYS D 49 1.369 -19.752 11.345 1.00 0.00 H new ATOM 0 HZ3 LYS D 49 2.006 -21.317 11.175 1.00 0.00 H new TER 2040 LYS D 49 HETATM 2041 O A2Y A 100 -0.298 11.416 2.984 1.00 0.00 O HETATM 2042 S A2Y A 100 -0.797 14.241 2.756 1.00 0.00 S HETATM 2043 C1 A2Y A 100 -0.552 15.546 2.131 1.00 0.00 C HETATM 2044 N1 A2Y A 100 -0.057 10.128 2.804 1.00 0.00 N HETATM 2045 C2 A2Y A 100 0.219 15.463 1.045 1.00 0.00 C HETATM 2046 N2 A2Y A 100 -0.260 7.693 1.178 1.00 0.00 N HETATM 2047 C3 A2Y A 100 0.542 14.190 0.858 1.00 0.00 C HETATM 2048 C4 A2Y A 100 0.586 11.124 1.090 1.00 0.00 C HETATM 2049 C5 A2Y A 100 0.882 8.608 1.137 1.00 0.00 C HETATM 2050 C9 A2Y A 100 0.472 9.940 1.672 1.00 0.00 C HETATM 2051 C10 A2Y A 100 -0.032 6.268 0.854 1.00 0.00 C HETATM 2052 C11 A2Y A 100 0.081 12.030 1.974 1.00 0.00 C HETATM 2053 C12 A2Y A 100 -0.023 13.404 1.827 1.00 0.00 C HETATM 2054 C61 A2Y A 100 0.990 5.597 1.825 1.00 0.00 C HETATM 2055 C62 A2Y A 100 0.500 6.067 -0.599 1.00 0.00 C HETATM 2056 C63 A2Y A 100 -1.354 5.468 0.962 1.00 0.00 C HETATM 2057 C71 A2Y A 100 1.194 4.108 1.486 1.00 0.00 C HETATM 2058 C72 A2Y A 100 0.711 4.571 -0.916 1.00 0.00 C HETATM 2059 C73 A2Y A 100 -1.142 3.972 0.635 1.00 0.00 C HETATM 2060 C81 A2Y A 100 1.733 3.971 0.057 1.00 0.00 C HETATM 2061 C82 A2Y A 100 -0.618 3.820 -0.796 1.00 0.00 C HETATM 2062 C83 A2Y A 100 -0.135 3.358 1.608 1.00 0.00 C HETATM 0 H683 A2Y A 100 0.007 2.300 1.386 1.00 0.00 H new HETATM 0 H663 A2Y A 100 -1.759 5.567 1.969 1.00 0.00 H new HETATM 0 H583 A2Y A 100 -0.511 3.421 2.629 1.00 0.00 H new HETATM 0 H563 A2Y A 100 -2.092 5.889 0.279 1.00 0.00 H new HETATM 0 H482 A2Y A 100 -1.342 4.217 -1.507 1.00 0.00 H new HETATM 0 H462 A2Y A 100 -0.206 6.496 -1.310 1.00 0.00 H new HETATM 0 H382 A2Y A 100 -0.479 2.766 -1.037 1.00 0.00 H new HETATM 0 H373 A2Y A 100 -2.097 3.456 0.731 1.00 0.00 H new HETATM 0 H362 A2Y A 100 1.441 6.603 -0.722 1.00 0.00 H new HETATM 0 H2N2 A2Y A 100 -0.661 7.738 2.115 1.00 0.00 H new HETATM 0 H281 A2Y A 100 2.690 4.485 -0.036 1.00 0.00 H new HETATM 0 H272 A2Y A 100 1.086 4.474 -1.935 1.00 0.00 H new HETATM 0 H261 A2Y A 100 1.945 6.119 1.768 1.00 0.00 H new HETATM 0 H1N2 A2Y A 100 -0.966 8.049 0.534 1.00 0.00 H new HETATM 0 H181 A2Y A 100 1.910 2.922 -0.181 1.00 0.00 H new HETATM 0 H171 A2Y A 100 1.912 3.680 2.185 1.00 0.00 H new HETATM 0 H161 A2Y A 100 0.636 5.693 2.851 1.00 0.00 H new HETATM 0 H44 A2Y A 100 1.000 11.332 0.103 1.00 0.00 H new HETATM 0 H3 A2Y A 100 1.169 13.821 0.047 1.00 0.00 H new HETATM 0 H25 A2Y A 100 1.706 8.205 1.727 1.00 0.00 H new HETATM 0 H2 A2Y A 100 0.530 16.299 0.418 1.00 0.00 H new HETATM 0 H15 A2Y A 100 1.243 8.711 0.114 1.00 0.00 H new HETATM 0 H1 A2Y A 100 -0.957 16.483 2.513 1.00 0.00 H new