USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 927 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 MET CE :methyl 168:sc= -0.0253 (180deg=-0.233) USER MOD Single : A 5 SER OG : rot 180:sc= -0.0324 USER MOD Single : A 7 GLN : amide:sc= -2.28! C(o=-2.3!,f=-1.5!) USER MOD Single : A 20 TYR OH : rot -86:sc= 1.02 USER MOD Single : A 23 SER OG : rot -160:sc= 1.03 USER MOD Single : B 25 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 27 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : B 28 GLN : amide:sc= -1.67! K(o=-1.7!,f=-0.18) USER MOD Single : B 34 TYR OH : rot -33:sc= 0.414 USER MOD Single : B 37 LYS NZ :NH3+ 159:sc= 1.15 (180deg=0.696) USER MOD Single : B 38 MET CE :methyl -143:sc= -0.0247 (180deg=-0.631) USER MOD Single : B 39 LYS NZ :NH3+ 161:sc= -0.149 (180deg=-0.613) USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 TYR OH : rot -148:sc= 0.513 USER MOD Single : B 47 LYS NZ :NH3+ -157:sc= 2.35 (180deg=1.64) USER MOD Single : B 54 ASN : amide:sc= -3.21! C(o=-3.2!,f=-3.7!) USER MOD Single : B 55 LYS NZ :NH3+ 178:sc= 1.27 (180deg=1.08) USER MOD Single : B 58 ASN : amide:sc= -3.97! C(o=-4!,f=-3.6!) USER MOD Single : B 59 SER OG : rot 180:sc= -1.69! USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot 180:sc= 0 USER MOD Single : B 67 SER OG : rot 180:sc= -0.237 USER MOD Single : B 68 TYR OH : rot 180:sc=-0.00209 USER MOD Single : B 69 ASN : amide:sc= -2.87! K(o=-2.9!,f=-0.5) USER MOD Single : B 73 ASN : amide:sc= -2.78 K(o=-2.8,f=-1.5) USER MOD Single : B 76 TYR OH : rot 77:sc= 0.0685 USER MOD Single : B 78 ASN : amide:sc= 0.195 K(o=0.19,f=-8.7!) USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 82 SER OG : rot 180:sc= -0.644 USER MOD Single : B 92 ASN : amide:sc= -2.25! K(o=-2.3!,f=-0.96) USER MOD Single : B 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 100 HIS : no HD1:sc= -0.194 K(o=-0.19,f=-1.7!) USER MOD Single : B 103 LYS NZ :NH3+ -141:sc= 0.778 (180deg=0.092) USER MOD Single : B 106 THR OG1 : rot 57:sc= 0.00668 USER MOD Single : B 108 TYR OH : rot -140:sc= 0.385 USER MOD Single : B 110 TYR OH : rot -161:sc= 1.02 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 14.996 16.223 -3.374 1.00 0.00 N ATOM 2 CA GLY A 1 14.113 17.101 -4.177 1.00 0.00 C ATOM 3 C GLY A 1 12.887 17.540 -3.398 1.00 0.00 C ATOM 4 O GLY A 1 11.979 16.740 -3.171 1.00 0.00 O ATOM 0 H1 GLY A 1 15.821 15.946 -3.943 1.00 0.00 H new ATOM 0 H2 GLY A 1 15.316 16.734 -2.527 1.00 0.00 H new ATOM 0 H3 GLY A 1 14.472 15.372 -3.088 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.672 17.980 -4.499 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.800 16.574 -5.078 1.00 0.00 H new ATOM 10 N PRO A 2 12.829 18.820 -2.985 1.00 0.00 N ATOM 11 CA PRO A 2 11.725 19.347 -2.171 1.00 0.00 C ATOM 12 C PRO A 2 10.418 19.469 -2.952 1.00 0.00 C ATOM 13 O PRO A 2 9.367 19.731 -2.376 1.00 0.00 O ATOM 14 CB PRO A 2 12.223 20.731 -1.749 1.00 0.00 C ATOM 15 CG PRO A 2 13.190 21.126 -2.810 1.00 0.00 C ATOM 16 CD PRO A 2 13.841 19.854 -3.276 1.00 0.00 C ATOM 0 HA PRO A 2 11.491 18.686 -1.337 1.00 0.00 H new ATOM 0 HB2 PRO A 2 11.401 21.443 -1.678 1.00 0.00 H new ATOM 0 HB3 PRO A 2 12.701 20.698 -0.770 1.00 0.00 H new ATOM 0 HG2 PRO A 2 12.682 21.628 -3.633 1.00 0.00 H new ATOM 0 HG3 PRO A 2 13.932 21.824 -2.421 1.00 0.00 H new ATOM 0 HD2 PRO A 2 14.081 19.892 -4.339 1.00 0.00 H new ATOM 0 HD3 PRO A 2 14.774 19.663 -2.745 1.00 0.00 H new ATOM 24 N HIS A 3 10.491 19.295 -4.264 1.00 0.00 N ATOM 25 CA HIS A 3 9.306 19.335 -5.111 1.00 0.00 C ATOM 26 C HIS A 3 9.331 18.191 -6.115 1.00 0.00 C ATOM 27 O HIS A 3 8.800 18.308 -7.215 1.00 0.00 O ATOM 28 CB HIS A 3 9.200 20.668 -5.860 1.00 0.00 C ATOM 29 CG HIS A 3 8.790 21.831 -5.011 1.00 0.00 C ATOM 30 ND1 HIS A 3 7.482 22.240 -4.879 1.00 0.00 N ATOM 31 CD2 HIS A 3 9.526 22.691 -4.267 1.00 0.00 C ATOM 32 CE1 HIS A 3 7.431 23.302 -4.096 1.00 0.00 C ATOM 33 NE2 HIS A 3 8.658 23.596 -3.710 1.00 0.00 N ATOM 0 H HIS A 3 11.362 19.124 -4.767 1.00 0.00 H new ATOM 0 HA HIS A 3 8.436 19.231 -4.462 1.00 0.00 H new ATOM 0 HB2 HIS A 3 10.165 20.891 -6.316 1.00 0.00 H new ATOM 0 HB3 HIS A 3 8.481 20.557 -6.672 1.00 0.00 H new ATOM 0 HD2 HIS A 3 10.598 22.669 -4.136 1.00 0.00 H new ATOM 0 HE1 HIS A 3 6.536 23.839 -3.818 1.00 0.00 H new ATOM 0 HE2 HIS A 3 8.919 24.369 -3.098 1.00 0.00 H new ATOM 42 N MET A 4 9.961 17.089 -5.736 1.00 0.00 N ATOM 43 CA MET A 4 10.084 15.943 -6.628 1.00 0.00 C ATOM 44 C MET A 4 9.205 14.794 -6.159 1.00 0.00 C ATOM 45 O MET A 4 9.192 14.453 -4.976 1.00 0.00 O ATOM 46 CB MET A 4 11.543 15.490 -6.718 1.00 0.00 C ATOM 47 CG MET A 4 11.750 14.239 -7.562 1.00 0.00 C ATOM 48 SD MET A 4 11.082 14.397 -9.233 1.00 0.00 S ATOM 49 CE MET A 4 12.085 15.731 -9.886 1.00 0.00 C ATOM 0 H MET A 4 10.394 16.963 -4.821 1.00 0.00 H new ATOM 0 HA MET A 4 9.749 16.248 -7.619 1.00 0.00 H new ATOM 0 HB2 MET A 4 12.140 16.301 -7.136 1.00 0.00 H new ATOM 0 HB3 MET A 4 11.918 15.304 -5.712 1.00 0.00 H new ATOM 0 HG2 MET A 4 12.816 14.020 -7.622 1.00 0.00 H new ATOM 0 HG3 MET A 4 11.278 13.391 -7.066 1.00 0.00 H new ATOM 0 HE1 MET A 4 11.941 15.800 -10.964 1.00 0.00 H new ATOM 0 HE2 MET A 4 11.790 16.671 -9.419 1.00 0.00 H new ATOM 0 HE3 MET A 4 13.136 15.534 -9.672 1.00 0.00 H new ATOM 59 N SER A 5 8.470 14.206 -7.091 1.00 0.00 N ATOM 60 CA SER A 5 7.590 13.093 -6.785 1.00 0.00 C ATOM 61 C SER A 5 7.554 12.119 -7.958 1.00 0.00 C ATOM 62 O SER A 5 7.501 12.533 -9.117 1.00 0.00 O ATOM 63 CB SER A 5 6.178 13.602 -6.478 1.00 0.00 C ATOM 64 OG SER A 5 6.220 14.735 -5.629 1.00 0.00 O ATOM 0 H SER A 5 8.468 14.485 -8.072 1.00 0.00 H new ATOM 0 HA SER A 5 7.972 12.574 -5.906 1.00 0.00 H new ATOM 0 HB2 SER A 5 5.670 13.858 -7.408 1.00 0.00 H new ATOM 0 HB3 SER A 5 5.597 12.810 -6.005 1.00 0.00 H new ATOM 0 HG SER A 5 5.307 15.043 -5.449 1.00 0.00 H new ATOM 70 N VAL A 6 7.599 10.832 -7.658 1.00 0.00 N ATOM 71 CA VAL A 6 7.591 9.805 -8.688 1.00 0.00 C ATOM 72 C VAL A 6 6.437 8.837 -8.474 1.00 0.00 C ATOM 73 O VAL A 6 6.008 8.603 -7.348 1.00 0.00 O ATOM 74 CB VAL A 6 8.915 9.014 -8.717 1.00 0.00 C ATOM 75 CG1 VAL A 6 10.072 9.910 -9.129 1.00 0.00 C ATOM 76 CG2 VAL A 6 9.193 8.371 -7.367 1.00 0.00 C ATOM 0 H VAL A 6 7.642 10.471 -6.705 1.00 0.00 H new ATOM 0 HA VAL A 6 7.470 10.315 -9.644 1.00 0.00 H new ATOM 0 HB VAL A 6 8.815 8.221 -9.458 1.00 0.00 H new ATOM 0 HG11 VAL A 6 10.995 9.330 -9.142 1.00 0.00 H new ATOM 0 HG12 VAL A 6 9.883 10.314 -10.124 1.00 0.00 H new ATOM 0 HG13 VAL A 6 10.169 10.730 -8.417 1.00 0.00 H new ATOM 0 HG21 VAL A 6 10.132 7.819 -7.413 1.00 0.00 H new ATOM 0 HG22 VAL A 6 9.264 9.145 -6.603 1.00 0.00 H new ATOM 0 HG23 VAL A 6 8.382 7.687 -7.116 1.00 0.00 H new ATOM 86 N GLN A 7 5.938 8.282 -9.559 1.00 0.00 N ATOM 87 CA GLN A 7 4.846 7.324 -9.497 1.00 0.00 C ATOM 88 C GLN A 7 5.406 5.910 -9.397 1.00 0.00 C ATOM 89 O GLN A 7 6.408 5.587 -10.038 1.00 0.00 O ATOM 90 CB GLN A 7 3.934 7.455 -10.727 1.00 0.00 C ATOM 91 CG GLN A 7 4.562 6.987 -12.037 1.00 0.00 C ATOM 92 CD GLN A 7 5.735 7.842 -12.487 1.00 0.00 C ATOM 93 OE1 GLN A 7 5.565 8.823 -13.210 1.00 0.00 O ATOM 94 NE2 GLN A 7 6.936 7.470 -12.072 1.00 0.00 N ATOM 0 H GLN A 7 6.272 8.478 -10.503 1.00 0.00 H new ATOM 0 HA GLN A 7 4.247 7.533 -8.611 1.00 0.00 H new ATOM 0 HB2 GLN A 7 3.024 6.882 -10.551 1.00 0.00 H new ATOM 0 HB3 GLN A 7 3.638 8.499 -10.834 1.00 0.00 H new ATOM 0 HG2 GLN A 7 4.897 5.956 -11.922 1.00 0.00 H new ATOM 0 HG3 GLN A 7 3.801 6.990 -12.817 1.00 0.00 H new ATOM 0 HE21 GLN A 7 7.037 6.651 -11.473 1.00 0.00 H new ATOM 0 HE22 GLN A 7 7.760 8.003 -12.351 1.00 0.00 H new ATOM 103 N ILE A 8 4.786 5.078 -8.576 1.00 0.00 N ATOM 104 CA ILE A 8 5.251 3.711 -8.412 1.00 0.00 C ATOM 105 C ILE A 8 4.251 2.739 -9.028 1.00 0.00 C ATOM 106 O ILE A 8 3.086 2.704 -8.628 1.00 0.00 O ATOM 107 CB ILE A 8 5.446 3.335 -6.926 1.00 0.00 C ATOM 108 CG1 ILE A 8 6.007 4.512 -6.119 1.00 0.00 C ATOM 109 CG2 ILE A 8 6.373 2.130 -6.814 1.00 0.00 C ATOM 110 CD1 ILE A 8 7.359 4.993 -6.588 1.00 0.00 C ATOM 0 H ILE A 8 3.968 5.322 -8.018 1.00 0.00 H new ATOM 0 HA ILE A 8 6.215 3.643 -8.917 1.00 0.00 H new ATOM 0 HB ILE A 8 4.471 3.081 -6.510 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.301 5.341 -6.168 1.00 0.00 H new ATOM 0 HG13 ILE A 8 6.081 4.218 -5.072 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.506 1.870 -5.764 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.936 1.284 -7.345 1.00 0.00 H new ATOM 0 HG23 ILE A 8 7.340 2.373 -7.253 1.00 0.00 H new ATOM 0 HD11 ILE A 8 7.685 5.826 -5.966 1.00 0.00 H new ATOM 0 HD12 ILE A 8 8.081 4.180 -6.512 1.00 0.00 H new ATOM 0 HD13 ILE A 8 7.289 5.320 -7.625 1.00 0.00 H new ATOM 122 N PRO A 9 4.680 1.954 -10.025 1.00 0.00 N ATOM 123 CA PRO A 9 3.818 0.954 -10.652 1.00 0.00 C ATOM 124 C PRO A 9 3.490 -0.199 -9.707 1.00 0.00 C ATOM 125 O PRO A 9 4.381 -0.799 -9.100 1.00 0.00 O ATOM 126 CB PRO A 9 4.640 0.458 -11.843 1.00 0.00 C ATOM 127 CG PRO A 9 6.055 0.751 -11.484 1.00 0.00 C ATOM 128 CD PRO A 9 6.025 1.987 -10.627 1.00 0.00 C ATOM 0 HA PRO A 9 2.853 1.372 -10.937 1.00 0.00 H new ATOM 0 HB2 PRO A 9 4.488 -0.608 -12.011 1.00 0.00 H new ATOM 0 HB3 PRO A 9 4.352 0.969 -12.762 1.00 0.00 H new ATOM 0 HG2 PRO A 9 6.501 -0.085 -10.945 1.00 0.00 H new ATOM 0 HG3 PRO A 9 6.658 0.912 -12.378 1.00 0.00 H new ATOM 0 HD2 PRO A 9 6.806 1.968 -9.867 1.00 0.00 H new ATOM 0 HD3 PRO A 9 6.178 2.890 -11.218 1.00 0.00 H new ATOM 136 N VAL A 10 2.207 -0.493 -9.579 1.00 0.00 N ATOM 137 CA VAL A 10 1.755 -1.568 -8.712 1.00 0.00 C ATOM 138 C VAL A 10 1.331 -2.781 -9.530 1.00 0.00 C ATOM 139 O VAL A 10 0.660 -2.657 -10.558 1.00 0.00 O ATOM 140 CB VAL A 10 0.593 -1.113 -7.792 1.00 0.00 C ATOM 141 CG1 VAL A 10 -0.499 -0.421 -8.589 1.00 0.00 C ATOM 142 CG2 VAL A 10 0.015 -2.291 -7.017 1.00 0.00 C ATOM 0 H VAL A 10 1.458 -0.001 -10.066 1.00 0.00 H new ATOM 0 HA VAL A 10 2.597 -1.846 -8.078 1.00 0.00 H new ATOM 0 HB VAL A 10 1.001 -0.398 -7.078 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -1.300 -0.113 -7.917 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -0.086 0.456 -9.087 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -0.896 -1.109 -9.336 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -0.798 -1.943 -6.380 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -0.365 -3.035 -7.717 1.00 0.00 H new ATOM 0 HG23 VAL A 10 0.794 -2.738 -6.400 1.00 0.00 H new ATOM 152 N VAL A 11 1.758 -3.948 -9.085 1.00 0.00 N ATOM 153 CA VAL A 11 1.408 -5.188 -9.723 1.00 0.00 C ATOM 154 C VAL A 11 0.085 -5.698 -9.179 1.00 0.00 C ATOM 155 O VAL A 11 -0.272 -5.401 -8.047 1.00 0.00 O ATOM 156 CB VAL A 11 2.489 -6.258 -9.485 1.00 0.00 C ATOM 157 CG1 VAL A 11 3.871 -5.636 -9.360 1.00 0.00 C ATOM 158 CG2 VAL A 11 2.165 -7.125 -8.284 1.00 0.00 C ATOM 0 H VAL A 11 2.359 -4.055 -8.268 1.00 0.00 H new ATOM 0 HA VAL A 11 1.325 -5.000 -10.793 1.00 0.00 H new ATOM 0 HB VAL A 11 2.498 -6.906 -10.361 1.00 0.00 H new ATOM 0 HG11 VAL A 11 4.609 -6.420 -9.193 1.00 0.00 H new ATOM 0 HG12 VAL A 11 4.113 -5.100 -10.278 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.883 -4.941 -8.520 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.951 -7.868 -8.149 1.00 0.00 H new ATOM 0 HG22 VAL A 11 2.098 -6.501 -7.393 1.00 0.00 H new ATOM 0 HG23 VAL A 11 1.213 -7.630 -8.446 1.00 0.00 H new ATOM 168 N GLU A 12 -0.666 -6.411 -9.987 1.00 0.00 N ATOM 169 CA GLU A 12 -1.806 -7.136 -9.466 1.00 0.00 C ATOM 170 C GLU A 12 -1.601 -8.626 -9.659 1.00 0.00 C ATOM 171 O GLU A 12 -1.884 -9.179 -10.719 1.00 0.00 O ATOM 172 CB GLU A 12 -3.112 -6.661 -10.097 1.00 0.00 C ATOM 173 CG GLU A 12 -3.474 -5.249 -9.680 1.00 0.00 C ATOM 174 CD GLU A 12 -4.899 -4.880 -10.017 1.00 0.00 C ATOM 175 OE1 GLU A 12 -5.812 -5.367 -9.320 1.00 0.00 O ATOM 176 OE2 GLU A 12 -5.113 -4.094 -10.961 1.00 0.00 O ATOM 0 H GLU A 12 -0.514 -6.505 -10.991 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.885 -6.934 -8.398 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -3.025 -6.706 -11.183 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -3.917 -7.339 -9.813 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -3.322 -5.143 -8.606 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -2.798 -4.547 -10.168 1.00 0.00 H new ATOM 183 N VAL A 13 -1.083 -9.261 -8.618 1.00 0.00 N ATOM 184 CA VAL A 13 -0.768 -10.683 -8.659 1.00 0.00 C ATOM 185 C VAL A 13 -1.637 -11.476 -7.690 1.00 0.00 C ATOM 186 O VAL A 13 -2.589 -10.942 -7.112 1.00 0.00 O ATOM 187 CB VAL A 13 0.724 -10.943 -8.347 1.00 0.00 C ATOM 188 CG1 VAL A 13 1.597 -10.433 -9.477 1.00 0.00 C ATOM 189 CG2 VAL A 13 1.135 -10.302 -7.025 1.00 0.00 C ATOM 0 H VAL A 13 -0.870 -8.811 -7.728 1.00 0.00 H new ATOM 0 HA VAL A 13 -0.977 -11.020 -9.674 1.00 0.00 H new ATOM 0 HB VAL A 13 0.863 -12.020 -8.253 1.00 0.00 H new ATOM 0 HG11 VAL A 13 2.644 -10.623 -9.242 1.00 0.00 H new ATOM 0 HG12 VAL A 13 1.333 -10.947 -10.401 1.00 0.00 H new ATOM 0 HG13 VAL A 13 1.442 -9.361 -9.601 1.00 0.00 H new ATOM 0 HG21 VAL A 13 2.189 -10.503 -6.835 1.00 0.00 H new ATOM 0 HG22 VAL A 13 0.975 -9.225 -7.078 1.00 0.00 H new ATOM 0 HG23 VAL A 13 0.535 -10.719 -6.216 1.00 0.00 H new ATOM 199 N ASP A 14 -1.306 -12.750 -7.522 1.00 0.00 N ATOM 200 CA ASP A 14 -2.059 -13.635 -6.646 1.00 0.00 C ATOM 201 C ASP A 14 -1.295 -13.844 -5.342 1.00 0.00 C ATOM 202 O ASP A 14 -1.881 -14.174 -4.312 1.00 0.00 O ATOM 203 CB ASP A 14 -2.307 -14.974 -7.347 1.00 0.00 C ATOM 204 CG ASP A 14 -3.318 -15.845 -6.628 1.00 0.00 C ATOM 205 OD1 ASP A 14 -4.526 -15.538 -6.694 1.00 0.00 O ATOM 206 OD2 ASP A 14 -2.913 -16.857 -6.015 1.00 0.00 O ATOM 0 H ASP A 14 -0.514 -13.195 -7.986 1.00 0.00 H new ATOM 0 HA ASP A 14 -3.023 -13.181 -6.415 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -2.656 -14.786 -8.363 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -1.364 -15.514 -7.429 1.00 0.00 H new ATOM 211 N GLU A 15 0.021 -13.637 -5.403 1.00 0.00 N ATOM 212 CA GLU A 15 0.881 -13.730 -4.227 1.00 0.00 C ATOM 213 C GLU A 15 2.279 -13.212 -4.554 1.00 0.00 C ATOM 214 O GLU A 15 2.639 -13.082 -5.725 1.00 0.00 O ATOM 215 CB GLU A 15 0.949 -15.173 -3.724 1.00 0.00 C ATOM 216 CG GLU A 15 1.521 -16.158 -4.728 1.00 0.00 C ATOM 217 CD GLU A 15 1.505 -17.575 -4.203 1.00 0.00 C ATOM 218 OE1 GLU A 15 0.402 -18.129 -4.017 1.00 0.00 O ATOM 219 OE2 GLU A 15 2.587 -18.147 -3.975 1.00 0.00 O ATOM 0 H GLU A 15 0.516 -13.402 -6.263 1.00 0.00 H new ATOM 0 HA GLU A 15 0.456 -13.112 -3.436 1.00 0.00 H new ATOM 0 HB2 GLU A 15 1.555 -15.202 -2.819 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -0.054 -15.496 -3.446 1.00 0.00 H new ATOM 0 HG2 GLU A 15 0.947 -16.108 -5.653 1.00 0.00 H new ATOM 0 HG3 GLU A 15 2.544 -15.873 -4.972 1.00 0.00 H new ATOM 226 N LEU A 16 3.047 -12.884 -3.518 1.00 0.00 N ATOM 227 CA LEU A 16 4.412 -12.405 -3.699 1.00 0.00 C ATOM 228 C LEU A 16 5.361 -13.573 -3.928 1.00 0.00 C ATOM 229 O LEU A 16 5.136 -14.676 -3.425 1.00 0.00 O ATOM 230 CB LEU A 16 4.896 -11.611 -2.478 1.00 0.00 C ATOM 231 CG LEU A 16 4.023 -10.437 -2.028 1.00 0.00 C ATOM 232 CD1 LEU A 16 3.244 -9.850 -3.189 1.00 0.00 C ATOM 233 CD2 LEU A 16 3.094 -10.859 -0.911 1.00 0.00 C ATOM 0 H LEU A 16 2.746 -12.942 -2.545 1.00 0.00 H new ATOM 0 HA LEU A 16 4.409 -11.750 -4.570 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.994 -12.302 -1.641 1.00 0.00 H new ATOM 0 HB3 LEU A 16 5.894 -11.229 -2.695 1.00 0.00 H new ATOM 0 HG LEU A 16 4.683 -9.657 -1.648 1.00 0.00 H new ATOM 0 HD11 LEU A 16 2.634 -9.019 -2.835 1.00 0.00 H new ATOM 0 HD12 LEU A 16 3.938 -9.493 -3.950 1.00 0.00 H new ATOM 0 HD13 LEU A 16 2.598 -10.616 -3.618 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.482 -10.010 -0.606 1.00 0.00 H new ATOM 0 HD22 LEU A 16 2.448 -11.665 -1.260 1.00 0.00 H new ATOM 0 HD23 LEU A 16 3.681 -11.207 -0.061 1.00 0.00 H new ATOM 245 N PRO A 17 6.440 -13.336 -4.687 1.00 0.00 N ATOM 246 CA PRO A 17 7.475 -14.341 -4.929 1.00 0.00 C ATOM 247 C PRO A 17 8.348 -14.577 -3.697 1.00 0.00 C ATOM 248 O PRO A 17 8.211 -13.880 -2.684 1.00 0.00 O ATOM 249 CB PRO A 17 8.297 -13.741 -6.069 1.00 0.00 C ATOM 250 CG PRO A 17 8.100 -12.270 -5.963 1.00 0.00 C ATOM 251 CD PRO A 17 6.733 -12.059 -5.368 1.00 0.00 C ATOM 0 HA PRO A 17 7.051 -15.317 -5.167 1.00 0.00 H new ATOM 0 HB2 PRO A 17 9.351 -14.005 -5.975 1.00 0.00 H new ATOM 0 HB3 PRO A 17 7.960 -14.114 -7.036 1.00 0.00 H new ATOM 0 HG2 PRO A 17 8.869 -11.821 -5.335 1.00 0.00 H new ATOM 0 HG3 PRO A 17 8.173 -11.798 -6.943 1.00 0.00 H new ATOM 0 HD2 PRO A 17 6.727 -11.223 -4.669 1.00 0.00 H new ATOM 0 HD3 PRO A 17 5.993 -11.837 -6.137 1.00 0.00 H new ATOM 259 N GLU A 18 9.240 -15.559 -3.782 1.00 0.00 N ATOM 260 CA GLU A 18 10.109 -15.896 -2.662 1.00 0.00 C ATOM 261 C GLU A 18 10.964 -14.698 -2.271 1.00 0.00 C ATOM 262 O GLU A 18 11.354 -13.893 -3.119 1.00 0.00 O ATOM 263 CB GLU A 18 11.010 -17.093 -2.988 1.00 0.00 C ATOM 264 CG GLU A 18 11.932 -16.877 -4.179 1.00 0.00 C ATOM 265 CD GLU A 18 11.306 -17.305 -5.486 1.00 0.00 C ATOM 266 OE1 GLU A 18 10.477 -16.553 -6.034 1.00 0.00 O ATOM 267 OE2 GLU A 18 11.647 -18.402 -5.975 1.00 0.00 O ATOM 0 H GLU A 18 9.379 -16.134 -4.613 1.00 0.00 H new ATOM 0 HA GLU A 18 9.469 -16.171 -1.823 1.00 0.00 H new ATOM 0 HB2 GLU A 18 11.616 -17.326 -2.112 1.00 0.00 H new ATOM 0 HB3 GLU A 18 10.383 -17.963 -3.182 1.00 0.00 H new ATOM 0 HG2 GLU A 18 12.202 -15.823 -4.238 1.00 0.00 H new ATOM 0 HG3 GLU A 18 12.856 -17.434 -4.024 1.00 0.00 H new ATOM 274 N GLY A 19 11.239 -14.580 -0.986 1.00 0.00 N ATOM 275 CA GLY A 19 12.012 -13.462 -0.494 1.00 0.00 C ATOM 276 C GLY A 19 11.125 -12.430 0.159 1.00 0.00 C ATOM 277 O GLY A 19 11.597 -11.564 0.897 1.00 0.00 O ATOM 0 H GLY A 19 10.940 -15.242 -0.270 1.00 0.00 H new ATOM 0 HA2 GLY A 19 12.752 -13.816 0.224 1.00 0.00 H new ATOM 0 HA3 GLY A 19 12.560 -13.005 -1.318 1.00 0.00 H new ATOM 281 N TYR A 20 9.830 -12.526 -0.113 1.00 0.00 N ATOM 282 CA TYR A 20 8.856 -11.625 0.477 1.00 0.00 C ATOM 283 C TYR A 20 8.195 -12.251 1.690 1.00 0.00 C ATOM 284 O TYR A 20 8.101 -13.473 1.799 1.00 0.00 O ATOM 285 CB TYR A 20 7.798 -11.238 -0.549 1.00 0.00 C ATOM 286 CG TYR A 20 8.300 -10.248 -1.566 1.00 0.00 C ATOM 287 CD1 TYR A 20 8.300 -8.892 -1.284 1.00 0.00 C ATOM 288 CD2 TYR A 20 8.783 -10.666 -2.795 1.00 0.00 C ATOM 289 CE1 TYR A 20 8.770 -7.974 -2.196 1.00 0.00 C ATOM 290 CE2 TYR A 20 9.252 -9.756 -3.717 1.00 0.00 C ATOM 291 CZ TYR A 20 9.248 -8.411 -3.414 1.00 0.00 C ATOM 292 OH TYR A 20 9.734 -7.506 -4.329 1.00 0.00 O ATOM 0 H TYR A 20 9.431 -13.223 -0.742 1.00 0.00 H new ATOM 0 HA TYR A 20 9.385 -10.728 0.799 1.00 0.00 H new ATOM 0 HB2 TYR A 20 7.453 -12.135 -1.063 1.00 0.00 H new ATOM 0 HB3 TYR A 20 6.936 -10.815 -0.033 1.00 0.00 H new ATOM 0 HD1 TYR A 20 7.924 -8.549 -0.331 1.00 0.00 H new ATOM 0 HD2 TYR A 20 8.792 -11.719 -3.034 1.00 0.00 H new ATOM 0 HE1 TYR A 20 8.765 -6.920 -1.960 1.00 0.00 H new ATOM 0 HE2 TYR A 20 9.621 -10.095 -4.674 1.00 0.00 H new ATOM 0 HH TYR A 20 8.993 -7.151 -4.863 1.00 0.00 H new ATOM 302 N ASP A 21 7.737 -11.405 2.598 1.00 0.00 N ATOM 303 CA ASP A 21 7.097 -11.873 3.816 1.00 0.00 C ATOM 304 C ASP A 21 5.612 -11.549 3.784 1.00 0.00 C ATOM 305 O ASP A 21 5.202 -10.408 4.024 1.00 0.00 O ATOM 306 CB ASP A 21 7.742 -11.240 5.049 1.00 0.00 C ATOM 307 CG ASP A 21 7.253 -11.870 6.339 1.00 0.00 C ATOM 308 OD1 ASP A 21 6.218 -11.430 6.873 1.00 0.00 O ATOM 309 OD2 ASP A 21 7.907 -12.814 6.823 1.00 0.00 O ATOM 0 H ASP A 21 7.797 -10.390 2.515 1.00 0.00 H new ATOM 0 HA ASP A 21 7.227 -12.954 3.876 1.00 0.00 H new ATOM 0 HB2 ASP A 21 8.825 -11.344 4.984 1.00 0.00 H new ATOM 0 HB3 ASP A 21 7.524 -10.172 5.063 1.00 0.00 H new ATOM 314 N ARG A 22 4.816 -12.552 3.466 1.00 0.00 N ATOM 315 CA ARG A 22 3.376 -12.398 3.393 1.00 0.00 C ATOM 316 C ARG A 22 2.727 -12.936 4.660 1.00 0.00 C ATOM 317 O ARG A 22 3.196 -13.916 5.236 1.00 0.00 O ATOM 318 CB ARG A 22 2.843 -13.117 2.153 1.00 0.00 C ATOM 319 CG ARG A 22 1.330 -13.119 2.032 1.00 0.00 C ATOM 320 CD ARG A 22 0.900 -13.309 0.592 1.00 0.00 C ATOM 321 NE ARG A 22 -0.537 -13.533 0.468 1.00 0.00 N ATOM 322 CZ ARG A 22 -1.080 -14.648 -0.028 1.00 0.00 C ATOM 323 NH1 ARG A 22 -0.303 -15.638 -0.457 1.00 0.00 N ATOM 324 NH2 ARG A 22 -2.402 -14.778 -0.084 1.00 0.00 N ATOM 0 H ARG A 22 5.148 -13.493 3.252 1.00 0.00 H new ATOM 0 HA ARG A 22 3.128 -11.340 3.311 1.00 0.00 H new ATOM 0 HB2 ARG A 22 3.266 -12.647 1.265 1.00 0.00 H new ATOM 0 HB3 ARG A 22 3.196 -14.148 2.166 1.00 0.00 H new ATOM 0 HG2 ARG A 22 0.914 -13.916 2.648 1.00 0.00 H new ATOM 0 HG3 ARG A 22 0.930 -12.180 2.414 1.00 0.00 H new ATOM 0 HD2 ARG A 22 1.180 -12.429 0.013 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.436 -14.156 0.164 1.00 0.00 H new ATOM 0 HE ARG A 22 -1.165 -12.792 0.779 1.00 0.00 H new ATOM 0 HH11 ARG A 22 0.712 -15.548 -0.408 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -0.722 -16.488 -0.835 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -3.003 -14.026 0.252 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -2.815 -15.630 -0.463 1.00 0.00 H new ATOM 338 N SER A 23 1.656 -12.289 5.088 1.00 0.00 N ATOM 339 CA SER A 23 0.994 -12.652 6.330 1.00 0.00 C ATOM 340 C SER A 23 -0.506 -12.812 6.110 1.00 0.00 C ATOM 341 O SER A 23 -1.256 -11.833 6.319 1.00 0.00 O ATOM 342 CB SER A 23 1.277 -11.596 7.401 1.00 0.00 C ATOM 343 OG SER A 23 2.672 -11.478 7.641 1.00 0.00 O ATOM 344 OXT SER A 23 -0.928 -13.915 5.708 1.00 0.00 O ATOM 0 H SER A 23 1.226 -11.508 4.593 1.00 0.00 H new ATOM 0 HA SER A 23 1.388 -13.609 6.673 1.00 0.00 H new ATOM 0 HB2 SER A 23 0.876 -10.634 7.083 1.00 0.00 H new ATOM 0 HB3 SER A 23 0.766 -11.864 8.326 1.00 0.00 H new ATOM 0 HG SER A 23 2.819 -11.057 8.514 1.00 0.00 H new TER 350 SER A 23 ATOM 351 N PRO B 24 -23.177 14.668 1.860 1.00 0.00 N ATOM 352 CA PRO B 24 -23.236 15.294 0.522 1.00 0.00 C ATOM 353 C PRO B 24 -24.513 14.893 -0.206 1.00 0.00 C ATOM 354 O PRO B 24 -24.461 14.357 -1.313 1.00 0.00 O ATOM 355 CB PRO B 24 -22.014 14.862 -0.275 1.00 0.00 C ATOM 356 CG PRO B 24 -21.219 14.056 0.694 1.00 0.00 C ATOM 357 CD PRO B 24 -22.191 13.579 1.750 1.00 0.00 C ATOM 0 HA PRO B 24 -23.241 16.379 0.630 1.00 0.00 H new ATOM 0 HB2 PRO B 24 -22.295 14.273 -1.148 1.00 0.00 H new ATOM 0 HB3 PRO B 24 -21.450 15.721 -0.638 1.00 0.00 H new ATOM 0 HG2 PRO B 24 -20.740 13.212 0.197 1.00 0.00 H new ATOM 0 HG3 PRO B 24 -20.425 14.656 1.139 1.00 0.00 H new ATOM 0 HD2 PRO B 24 -22.665 12.642 1.459 1.00 0.00 H new ATOM 0 HD3 PRO B 24 -21.689 13.400 2.701 1.00 0.00 H new ATOM 367 N HIS B 25 -25.658 15.161 0.431 1.00 0.00 N ATOM 368 CA HIS B 25 -26.981 14.807 -0.101 1.00 0.00 C ATOM 369 C HIS B 25 -27.206 13.299 -0.076 1.00 0.00 C ATOM 370 O HIS B 25 -28.130 12.815 0.575 1.00 0.00 O ATOM 371 CB HIS B 25 -27.190 15.355 -1.516 1.00 0.00 C ATOM 372 CG HIS B 25 -27.314 16.847 -1.573 1.00 0.00 C ATOM 373 ND1 HIS B 25 -28.522 17.500 -1.669 1.00 0.00 N ATOM 374 CD2 HIS B 25 -26.368 17.816 -1.552 1.00 0.00 C ATOM 375 CE1 HIS B 25 -28.316 18.802 -1.704 1.00 0.00 C ATOM 376 NE2 HIS B 25 -27.017 19.022 -1.634 1.00 0.00 N ATOM 0 H HIS B 25 -25.694 15.632 1.335 1.00 0.00 H new ATOM 0 HA HIS B 25 -27.719 15.274 0.552 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -26.354 15.045 -2.143 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -28.089 14.908 -1.940 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -25.301 17.667 -1.483 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -29.081 19.560 -1.778 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -26.569 19.938 -1.640 1.00 0.00 H new ATOM 385 N GLU B 26 -26.372 12.562 -0.785 1.00 0.00 N ATOM 386 CA GLU B 26 -26.455 11.115 -0.781 1.00 0.00 C ATOM 387 C GLU B 26 -25.408 10.540 0.163 1.00 0.00 C ATOM 388 O GLU B 26 -24.248 10.964 0.155 1.00 0.00 O ATOM 389 CB GLU B 26 -26.264 10.560 -2.195 1.00 0.00 C ATOM 390 CG GLU B 26 -26.424 9.048 -2.287 1.00 0.00 C ATOM 391 CD GLU B 26 -27.792 8.577 -1.828 1.00 0.00 C ATOM 392 OE1 GLU B 26 -28.032 8.541 -0.604 1.00 0.00 O ATOM 393 OE2 GLU B 26 -28.629 8.231 -2.690 1.00 0.00 O ATOM 0 H GLU B 26 -25.629 12.942 -1.371 1.00 0.00 H new ATOM 0 HA GLU B 26 -27.445 10.821 -0.432 1.00 0.00 H new ATOM 0 HB2 GLU B 26 -26.984 11.034 -2.862 1.00 0.00 H new ATOM 0 HB3 GLU B 26 -25.271 10.834 -2.552 1.00 0.00 H new ATOM 0 HG2 GLU B 26 -26.261 8.731 -3.317 1.00 0.00 H new ATOM 0 HG3 GLU B 26 -25.656 8.567 -1.681 1.00 0.00 H new ATOM 400 N GLN B 27 -25.826 9.589 0.979 1.00 0.00 N ATOM 401 CA GLN B 27 -24.927 8.939 1.915 1.00 0.00 C ATOM 402 C GLN B 27 -24.250 7.760 1.236 1.00 0.00 C ATOM 403 O GLN B 27 -24.761 7.224 0.249 1.00 0.00 O ATOM 404 CB GLN B 27 -25.688 8.474 3.161 1.00 0.00 C ATOM 405 CG GLN B 27 -26.783 7.461 2.866 1.00 0.00 C ATOM 406 CD GLN B 27 -27.528 7.024 4.110 1.00 0.00 C ATOM 407 OE1 GLN B 27 -26.972 7.006 5.211 1.00 0.00 O ATOM 408 NE2 GLN B 27 -28.792 6.671 3.946 1.00 0.00 N ATOM 0 H GLN B 27 -26.787 9.249 1.012 1.00 0.00 H new ATOM 0 HA GLN B 27 -24.167 9.654 2.230 1.00 0.00 H new ATOM 0 HB2 GLN B 27 -24.981 8.036 3.866 1.00 0.00 H new ATOM 0 HB3 GLN B 27 -26.130 9.342 3.651 1.00 0.00 H new ATOM 0 HG2 GLN B 27 -27.490 7.893 2.157 1.00 0.00 H new ATOM 0 HG3 GLN B 27 -26.343 6.587 2.385 1.00 0.00 H new ATOM 0 HE21 GLN B 27 -29.213 6.700 3.018 1.00 0.00 H new ATOM 0 HE22 GLN B 27 -29.345 6.369 4.748 1.00 0.00 H new ATOM 417 N GLN B 28 -23.101 7.361 1.749 1.00 0.00 N ATOM 418 CA GLN B 28 -22.350 6.276 1.149 1.00 0.00 C ATOM 419 C GLN B 28 -22.000 5.215 2.178 1.00 0.00 C ATOM 420 O GLN B 28 -21.948 5.478 3.381 1.00 0.00 O ATOM 421 CB GLN B 28 -21.081 6.810 0.496 1.00 0.00 C ATOM 422 CG GLN B 28 -20.266 7.675 1.431 1.00 0.00 C ATOM 423 CD GLN B 28 -19.177 8.466 0.727 1.00 0.00 C ATOM 424 OE1 GLN B 28 -18.133 8.763 1.310 1.00 0.00 O ATOM 425 NE2 GLN B 28 -19.407 8.815 -0.531 1.00 0.00 N ATOM 0 H GLN B 28 -22.669 7.771 2.577 1.00 0.00 H new ATOM 0 HA GLN B 28 -22.977 5.815 0.386 1.00 0.00 H new ATOM 0 HB2 GLN B 28 -20.471 5.973 0.157 1.00 0.00 H new ATOM 0 HB3 GLN B 28 -21.348 7.388 -0.389 1.00 0.00 H new ATOM 0 HG2 GLN B 28 -20.932 8.367 1.946 1.00 0.00 H new ATOM 0 HG3 GLN B 28 -19.810 7.043 2.194 1.00 0.00 H new ATOM 0 HE21 GLN B 28 -20.283 8.551 -0.981 1.00 0.00 H new ATOM 0 HE22 GLN B 28 -18.708 9.347 -1.049 1.00 0.00 H new ATOM 434 N GLU B 29 -21.767 4.024 1.679 1.00 0.00 N ATOM 435 CA GLU B 29 -21.408 2.882 2.502 1.00 0.00 C ATOM 436 C GLU B 29 -20.612 1.876 1.676 1.00 0.00 C ATOM 437 O GLU B 29 -20.032 0.929 2.208 1.00 0.00 O ATOM 438 CB GLU B 29 -22.666 2.238 3.076 1.00 0.00 C ATOM 439 CG GLU B 29 -23.604 1.672 2.026 1.00 0.00 C ATOM 440 CD GLU B 29 -24.809 0.988 2.635 1.00 0.00 C ATOM 441 OE1 GLU B 29 -24.709 -0.213 2.961 1.00 0.00 O ATOM 442 OE2 GLU B 29 -25.862 1.643 2.783 1.00 0.00 O ATOM 0 H GLU B 29 -21.820 3.814 0.682 1.00 0.00 H new ATOM 0 HA GLU B 29 -20.785 3.217 3.331 1.00 0.00 H new ATOM 0 HB2 GLU B 29 -22.374 1.438 3.757 1.00 0.00 H new ATOM 0 HB3 GLU B 29 -23.204 2.979 3.667 1.00 0.00 H new ATOM 0 HG2 GLU B 29 -23.939 2.476 1.371 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -23.061 0.960 1.404 1.00 0.00 H new ATOM 449 N ASP B 30 -20.579 2.115 0.366 1.00 0.00 N ATOM 450 CA ASP B 30 -19.788 1.312 -0.563 1.00 0.00 C ATOM 451 C ASP B 30 -18.330 1.730 -0.482 1.00 0.00 C ATOM 452 O ASP B 30 -17.458 1.168 -1.149 1.00 0.00 O ATOM 453 CB ASP B 30 -20.297 1.495 -1.994 1.00 0.00 C ATOM 454 CG ASP B 30 -20.109 2.912 -2.504 1.00 0.00 C ATOM 455 OD1 ASP B 30 -20.864 3.813 -2.070 1.00 0.00 O ATOM 456 OD2 ASP B 30 -19.213 3.138 -3.339 1.00 0.00 O ATOM 0 H ASP B 30 -21.100 2.870 -0.080 1.00 0.00 H new ATOM 0 HA ASP B 30 -19.883 0.261 -0.289 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -19.773 0.803 -2.653 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -21.355 1.235 -2.035 1.00 0.00 H new ATOM 461 N VAL B 31 -18.098 2.741 0.341 1.00 0.00 N ATOM 462 CA VAL B 31 -16.776 3.261 0.601 1.00 0.00 C ATOM 463 C VAL B 31 -15.860 2.153 1.095 1.00 0.00 C ATOM 464 O VAL B 31 -16.133 1.515 2.113 1.00 0.00 O ATOM 465 CB VAL B 31 -16.833 4.386 1.652 1.00 0.00 C ATOM 466 CG1 VAL B 31 -15.462 5.008 1.863 1.00 0.00 C ATOM 467 CG2 VAL B 31 -17.850 5.440 1.245 1.00 0.00 C ATOM 0 H VAL B 31 -18.836 3.226 0.851 1.00 0.00 H new ATOM 0 HA VAL B 31 -16.382 3.665 -0.331 1.00 0.00 H new ATOM 0 HB VAL B 31 -17.148 3.951 2.600 1.00 0.00 H new ATOM 0 HG11 VAL B 31 -15.532 5.799 2.610 1.00 0.00 H new ATOM 0 HG12 VAL B 31 -14.765 4.244 2.208 1.00 0.00 H new ATOM 0 HG13 VAL B 31 -15.104 5.428 0.923 1.00 0.00 H new ATOM 0 HG21 VAL B 31 -17.878 6.228 1.998 1.00 0.00 H new ATOM 0 HG22 VAL B 31 -17.566 5.867 0.283 1.00 0.00 H new ATOM 0 HG23 VAL B 31 -18.836 4.982 1.162 1.00 0.00 H new ATOM 477 N PRO B 32 -14.776 1.900 0.360 1.00 0.00 N ATOM 478 CA PRO B 32 -13.835 0.845 0.702 1.00 0.00 C ATOM 479 C PRO B 32 -13.107 1.140 2.004 1.00 0.00 C ATOM 480 O PRO B 32 -12.539 2.219 2.184 1.00 0.00 O ATOM 481 CB PRO B 32 -12.853 0.832 -0.473 1.00 0.00 C ATOM 482 CG PRO B 32 -12.982 2.174 -1.110 1.00 0.00 C ATOM 483 CD PRO B 32 -14.391 2.631 -0.857 1.00 0.00 C ATOM 0 HA PRO B 32 -14.332 -0.113 0.856 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -11.833 0.656 -0.131 1.00 0.00 H new ATOM 0 HB3 PRO B 32 -13.095 0.037 -1.179 1.00 0.00 H new ATOM 0 HG2 PRO B 32 -12.264 2.876 -0.685 1.00 0.00 H new ATOM 0 HG3 PRO B 32 -12.778 2.117 -2.179 1.00 0.00 H new ATOM 0 HD2 PRO B 32 -14.443 3.710 -0.710 1.00 0.00 H new ATOM 0 HD3 PRO B 32 -15.047 2.391 -1.694 1.00 0.00 H new ATOM 491 N GLU B 33 -13.115 0.174 2.903 1.00 0.00 N ATOM 492 CA GLU B 33 -12.448 0.322 4.174 1.00 0.00 C ATOM 493 C GLU B 33 -11.161 -0.476 4.172 1.00 0.00 C ATOM 494 O GLU B 33 -11.163 -1.700 4.291 1.00 0.00 O ATOM 495 CB GLU B 33 -13.353 -0.114 5.324 1.00 0.00 C ATOM 496 CG GLU B 33 -12.683 0.008 6.680 1.00 0.00 C ATOM 497 CD GLU B 33 -13.665 -0.019 7.827 1.00 0.00 C ATOM 498 OE1 GLU B 33 -14.364 0.995 8.030 1.00 0.00 O ATOM 499 OE2 GLU B 33 -13.722 -1.037 8.548 1.00 0.00 O ATOM 0 H GLU B 33 -13.580 -0.724 2.771 1.00 0.00 H new ATOM 0 HA GLU B 33 -12.212 1.376 4.323 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -14.259 0.491 5.316 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -13.659 -1.148 5.167 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -11.969 -0.806 6.801 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -12.115 0.938 6.716 1.00 0.00 H new ATOM 506 N TYR B 34 -10.069 0.222 3.982 1.00 0.00 N ATOM 507 CA TYR B 34 -8.759 -0.390 3.986 1.00 0.00 C ATOM 508 C TYR B 34 -8.221 -0.504 5.405 1.00 0.00 C ATOM 509 O TYR B 34 -8.638 0.227 6.303 1.00 0.00 O ATOM 510 CB TYR B 34 -7.795 0.415 3.121 1.00 0.00 C ATOM 511 CG TYR B 34 -8.154 0.425 1.653 1.00 0.00 C ATOM 512 CD1 TYR B 34 -7.847 -0.655 0.839 1.00 0.00 C ATOM 513 CD2 TYR B 34 -8.801 1.515 1.082 1.00 0.00 C ATOM 514 CE1 TYR B 34 -8.173 -0.653 -0.502 1.00 0.00 C ATOM 515 CE2 TYR B 34 -9.132 1.524 -0.259 1.00 0.00 C ATOM 516 CZ TYR B 34 -8.816 0.438 -1.047 1.00 0.00 C ATOM 517 OH TYR B 34 -9.149 0.438 -2.381 1.00 0.00 O ATOM 0 H TYR B 34 -10.061 1.229 3.820 1.00 0.00 H new ATOM 0 HA TYR B 34 -8.850 -1.394 3.571 1.00 0.00 H new ATOM 0 HB2 TYR B 34 -7.766 1.442 3.485 1.00 0.00 H new ATOM 0 HB3 TYR B 34 -6.791 0.007 3.237 1.00 0.00 H new ATOM 0 HD1 TYR B 34 -7.344 -1.512 1.262 1.00 0.00 H new ATOM 0 HD2 TYR B 34 -9.049 2.368 1.696 1.00 0.00 H new ATOM 0 HE1 TYR B 34 -7.926 -1.502 -1.122 1.00 0.00 H new ATOM 0 HE2 TYR B 34 -9.636 2.378 -0.688 1.00 0.00 H new ATOM 0 HH TYR B 34 -8.474 -0.061 -2.887 1.00 0.00 H new ATOM 527 N GLU B 35 -7.302 -1.429 5.592 1.00 0.00 N ATOM 528 CA GLU B 35 -6.698 -1.670 6.884 1.00 0.00 C ATOM 529 C GLU B 35 -5.183 -1.599 6.751 1.00 0.00 C ATOM 530 O GLU B 35 -4.579 -2.437 6.084 1.00 0.00 O ATOM 531 CB GLU B 35 -7.129 -3.044 7.396 1.00 0.00 C ATOM 532 CG GLU B 35 -6.738 -3.326 8.832 1.00 0.00 C ATOM 533 CD GLU B 35 -7.118 -4.725 9.260 1.00 0.00 C ATOM 534 OE1 GLU B 35 -6.338 -5.667 9.001 1.00 0.00 O ATOM 535 OE2 GLU B 35 -8.208 -4.896 9.844 1.00 0.00 O ATOM 0 H GLU B 35 -6.953 -2.036 4.850 1.00 0.00 H new ATOM 0 HA GLU B 35 -7.024 -0.913 7.597 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -8.212 -3.130 7.303 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -6.692 -3.811 6.756 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -5.663 -3.191 8.948 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -7.222 -2.602 9.488 1.00 0.00 H new ATOM 542 N VAL B 36 -4.589 -0.577 7.354 1.00 0.00 N ATOM 543 CA VAL B 36 -3.150 -0.357 7.276 1.00 0.00 C ATOM 544 C VAL B 36 -2.429 -0.996 8.461 1.00 0.00 C ATOM 545 O VAL B 36 -2.804 -0.785 9.613 1.00 0.00 O ATOM 546 CB VAL B 36 -2.826 1.152 7.245 1.00 0.00 C ATOM 547 CG1 VAL B 36 -1.325 1.385 7.156 1.00 0.00 C ATOM 548 CG2 VAL B 36 -3.544 1.831 6.088 1.00 0.00 C ATOM 0 H VAL B 36 -5.088 0.119 7.908 1.00 0.00 H new ATOM 0 HA VAL B 36 -2.802 -0.822 6.354 1.00 0.00 H new ATOM 0 HB VAL B 36 -3.181 1.593 8.176 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -1.124 2.456 7.136 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -0.836 0.940 8.023 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -0.939 0.926 6.246 1.00 0.00 H new ATOM 0 HG21 VAL B 36 -3.303 2.894 6.084 1.00 0.00 H new ATOM 0 HG22 VAL B 36 -3.224 1.382 5.148 1.00 0.00 H new ATOM 0 HG23 VAL B 36 -4.620 1.704 6.203 1.00 0.00 H new ATOM 558 N LYS B 37 -1.407 -1.790 8.167 1.00 0.00 N ATOM 559 CA LYS B 37 -0.584 -2.403 9.203 1.00 0.00 C ATOM 560 C LYS B 37 0.887 -2.153 8.901 1.00 0.00 C ATOM 561 O LYS B 37 1.388 -2.560 7.853 1.00 0.00 O ATOM 562 CB LYS B 37 -0.843 -3.914 9.311 1.00 0.00 C ATOM 563 CG LYS B 37 -2.307 -4.282 9.514 1.00 0.00 C ATOM 564 CD LYS B 37 -3.054 -4.338 8.191 1.00 0.00 C ATOM 565 CE LYS B 37 -3.111 -5.746 7.629 1.00 0.00 C ATOM 566 NZ LYS B 37 -3.890 -6.662 8.503 1.00 0.00 N ATOM 0 H LYS B 37 -1.127 -2.026 7.215 1.00 0.00 H new ATOM 0 HA LYS B 37 -0.850 -1.949 10.158 1.00 0.00 H new ATOM 0 HB2 LYS B 37 -0.480 -4.399 8.405 1.00 0.00 H new ATOM 0 HB3 LYS B 37 -0.261 -4.313 10.142 1.00 0.00 H new ATOM 0 HG2 LYS B 37 -2.375 -5.249 10.013 1.00 0.00 H new ATOM 0 HG3 LYS B 37 -2.780 -3.551 10.170 1.00 0.00 H new ATOM 0 HD2 LYS B 37 -4.068 -3.962 8.331 1.00 0.00 H new ATOM 0 HD3 LYS B 37 -2.567 -3.680 7.471 1.00 0.00 H new ATOM 0 HE2 LYS B 37 -3.560 -5.722 6.636 1.00 0.00 H new ATOM 0 HE3 LYS B 37 -2.098 -6.131 7.511 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 -4.209 -7.483 7.949 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 -3.290 -6.986 9.288 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 -4.717 -6.159 8.884 1.00 0.00 H new ATOM 580 N MET B 38 1.571 -1.478 9.809 1.00 0.00 N ATOM 581 CA MET B 38 2.960 -1.101 9.589 1.00 0.00 C ATOM 582 C MET B 38 3.888 -1.996 10.398 1.00 0.00 C ATOM 583 O MET B 38 3.593 -2.326 11.544 1.00 0.00 O ATOM 584 CB MET B 38 3.169 0.354 9.977 1.00 0.00 C ATOM 585 CG MET B 38 4.191 1.051 9.109 1.00 0.00 C ATOM 586 SD MET B 38 4.102 2.843 9.220 1.00 0.00 S ATOM 587 CE MET B 38 4.610 3.267 7.560 1.00 0.00 C ATOM 0 H MET B 38 1.189 -1.179 10.706 1.00 0.00 H new ATOM 0 HA MET B 38 3.193 -1.225 8.532 1.00 0.00 H new ATOM 0 HB2 MET B 38 2.219 0.884 9.908 1.00 0.00 H new ATOM 0 HB3 MET B 38 3.488 0.405 11.018 1.00 0.00 H new ATOM 0 HG2 MET B 38 5.189 0.724 9.399 1.00 0.00 H new ATOM 0 HG3 MET B 38 4.045 0.749 8.072 1.00 0.00 H new ATOM 0 HE1 MET B 38 5.223 4.168 7.586 1.00 0.00 H new ATOM 0 HE2 MET B 38 5.189 2.446 7.136 1.00 0.00 H new ATOM 0 HE3 MET B 38 3.729 3.446 6.944 1.00 0.00 H new ATOM 597 N LYS B 39 5.016 -2.377 9.812 1.00 0.00 N ATOM 598 CA LYS B 39 5.915 -3.327 10.457 1.00 0.00 C ATOM 599 C LYS B 39 7.364 -3.056 10.057 1.00 0.00 C ATOM 600 O LYS B 39 7.652 -2.771 8.897 1.00 0.00 O ATOM 601 CB LYS B 39 5.496 -4.753 10.076 1.00 0.00 C ATOM 602 CG LYS B 39 5.878 -5.824 11.089 1.00 0.00 C ATOM 603 CD LYS B 39 7.302 -6.316 10.906 1.00 0.00 C ATOM 604 CE LYS B 39 7.611 -7.469 11.847 1.00 0.00 C ATOM 605 NZ LYS B 39 6.632 -8.581 11.701 1.00 0.00 N ATOM 0 H LYS B 39 5.329 -2.047 8.899 1.00 0.00 H new ATOM 0 HA LYS B 39 5.848 -3.213 11.539 1.00 0.00 H new ATOM 0 HB2 LYS B 39 4.415 -4.774 9.937 1.00 0.00 H new ATOM 0 HB3 LYS B 39 5.946 -5.004 9.116 1.00 0.00 H new ATOM 0 HG2 LYS B 39 5.762 -5.424 12.096 1.00 0.00 H new ATOM 0 HG3 LYS B 39 5.192 -6.666 10.999 1.00 0.00 H new ATOM 0 HD2 LYS B 39 7.449 -6.636 9.874 1.00 0.00 H new ATOM 0 HD3 LYS B 39 7.998 -5.498 11.089 1.00 0.00 H new ATOM 0 HE2 LYS B 39 8.616 -7.841 11.648 1.00 0.00 H new ATOM 0 HE3 LYS B 39 7.602 -7.110 12.876 1.00 0.00 H new ATOM 0 HZ1 LYS B 39 7.036 -9.453 12.098 1.00 0.00 H new ATOM 0 HZ2 LYS B 39 5.757 -8.342 12.209 1.00 0.00 H new ATOM 0 HZ3 LYS B 39 6.419 -8.726 10.693 1.00 0.00 H new ATOM 619 N ARG B 40 8.266 -3.134 11.028 1.00 0.00 N ATOM 620 CA ARG B 40 9.678 -2.849 10.793 1.00 0.00 C ATOM 621 C ARG B 40 10.473 -4.131 10.599 1.00 0.00 C ATOM 622 O ARG B 40 10.294 -5.103 11.333 1.00 0.00 O ATOM 623 CB ARG B 40 10.277 -2.049 11.958 1.00 0.00 C ATOM 624 CG ARG B 40 9.902 -0.573 11.962 1.00 0.00 C ATOM 625 CD ARG B 40 8.413 -0.365 12.184 1.00 0.00 C ATOM 626 NE ARG B 40 8.024 1.031 12.011 1.00 0.00 N ATOM 627 CZ ARG B 40 6.787 1.489 12.189 1.00 0.00 C ATOM 628 NH1 ARG B 40 5.826 0.673 12.607 1.00 0.00 N ATOM 629 NH2 ARG B 40 6.517 2.768 11.964 1.00 0.00 N ATOM 0 H ARG B 40 8.044 -3.393 11.989 1.00 0.00 H new ATOM 0 HA ARG B 40 9.741 -2.254 9.882 1.00 0.00 H new ATOM 0 HB2 ARG B 40 9.951 -2.497 12.897 1.00 0.00 H new ATOM 0 HB3 ARG B 40 11.363 -2.136 11.923 1.00 0.00 H new ATOM 0 HG2 ARG B 40 10.461 -0.059 12.744 1.00 0.00 H new ATOM 0 HG3 ARG B 40 10.194 -0.122 11.013 1.00 0.00 H new ATOM 0 HD2 ARG B 40 7.852 -0.987 11.486 1.00 0.00 H new ATOM 0 HD3 ARG B 40 8.147 -0.694 13.189 1.00 0.00 H new ATOM 0 HE ARG B 40 8.746 1.698 11.736 1.00 0.00 H new ATOM 0 HH11 ARG B 40 6.035 -0.308 12.793 1.00 0.00 H new ATOM 0 HH12 ARG B 40 4.879 1.027 12.742 1.00 0.00 H new ATOM 0 HH21 ARG B 40 7.257 3.399 11.655 1.00 0.00 H new ATOM 0 HH22 ARG B 40 5.570 3.121 12.100 1.00 0.00 H new ATOM 643 N PHE B 41 11.345 -4.123 9.603 1.00 0.00 N ATOM 644 CA PHE B 41 12.230 -5.251 9.341 1.00 0.00 C ATOM 645 C PHE B 41 13.676 -4.844 9.559 1.00 0.00 C ATOM 646 O PHE B 41 14.060 -3.713 9.262 1.00 0.00 O ATOM 647 CB PHE B 41 12.046 -5.776 7.915 1.00 0.00 C ATOM 648 CG PHE B 41 10.818 -6.619 7.738 1.00 0.00 C ATOM 649 CD1 PHE B 41 9.558 -6.051 7.784 1.00 0.00 C ATOM 650 CD2 PHE B 41 10.928 -7.985 7.541 1.00 0.00 C ATOM 651 CE1 PHE B 41 8.429 -6.828 7.633 1.00 0.00 C ATOM 652 CE2 PHE B 41 9.802 -8.770 7.391 1.00 0.00 C ATOM 653 CZ PHE B 41 8.550 -8.190 7.437 1.00 0.00 C ATOM 0 H PHE B 41 11.460 -3.342 8.957 1.00 0.00 H new ATOM 0 HA PHE B 41 11.973 -6.050 10.036 1.00 0.00 H new ATOM 0 HB2 PHE B 41 11.998 -4.930 7.229 1.00 0.00 H new ATOM 0 HB3 PHE B 41 12.922 -6.362 7.637 1.00 0.00 H new ATOM 0 HD1 PHE B 41 9.457 -4.987 7.940 1.00 0.00 H new ATOM 0 HD2 PHE B 41 11.906 -8.442 7.504 1.00 0.00 H new ATOM 0 HE1 PHE B 41 7.451 -6.372 7.668 1.00 0.00 H new ATOM 0 HE2 PHE B 41 9.900 -9.835 7.238 1.00 0.00 H new ATOM 0 HZ PHE B 41 7.667 -8.800 7.320 1.00 0.00 H new ATOM 663 N LYS B 42 14.467 -5.762 10.086 1.00 0.00 N ATOM 664 CA LYS B 42 15.865 -5.490 10.379 1.00 0.00 C ATOM 665 C LYS B 42 16.755 -6.553 9.747 1.00 0.00 C ATOM 666 O LYS B 42 16.859 -7.670 10.256 1.00 0.00 O ATOM 667 CB LYS B 42 16.092 -5.450 11.894 1.00 0.00 C ATOM 668 CG LYS B 42 15.221 -4.438 12.629 1.00 0.00 C ATOM 669 CD LYS B 42 15.529 -3.011 12.208 1.00 0.00 C ATOM 670 CE LYS B 42 14.663 -2.011 12.958 1.00 0.00 C ATOM 671 NZ LYS B 42 14.984 -0.608 12.585 1.00 0.00 N ATOM 0 H LYS B 42 14.164 -6.707 10.321 1.00 0.00 H new ATOM 0 HA LYS B 42 16.124 -4.519 9.958 1.00 0.00 H new ATOM 0 HB2 LYS B 42 15.903 -6.442 12.305 1.00 0.00 H new ATOM 0 HB3 LYS B 42 17.140 -5.219 12.087 1.00 0.00 H new ATOM 0 HG2 LYS B 42 14.171 -4.655 12.435 1.00 0.00 H new ATOM 0 HG3 LYS B 42 15.374 -4.540 13.703 1.00 0.00 H new ATOM 0 HD2 LYS B 42 16.581 -2.794 12.394 1.00 0.00 H new ATOM 0 HD3 LYS B 42 15.366 -2.903 11.136 1.00 0.00 H new ATOM 0 HE2 LYS B 42 13.612 -2.211 12.747 1.00 0.00 H new ATOM 0 HE3 LYS B 42 14.804 -2.142 14.031 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 14.372 0.042 13.118 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 15.980 -0.408 12.809 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 14.826 -0.475 11.566 1.00 0.00 H new ATOM 685 N GLY B 43 17.375 -6.211 8.627 1.00 0.00 N ATOM 686 CA GLY B 43 18.275 -7.138 7.971 1.00 0.00 C ATOM 687 C GLY B 43 17.616 -7.871 6.822 1.00 0.00 C ATOM 688 O GLY B 43 17.941 -9.027 6.546 1.00 0.00 O ATOM 0 H GLY B 43 17.271 -5.310 8.161 1.00 0.00 H new ATOM 0 HA2 GLY B 43 19.144 -6.595 7.600 1.00 0.00 H new ATOM 0 HA3 GLY B 43 18.639 -7.863 8.699 1.00 0.00 H new ATOM 692 N ALA B 44 16.684 -7.207 6.157 1.00 0.00 N ATOM 693 CA ALA B 44 15.988 -7.787 5.023 1.00 0.00 C ATOM 694 C ALA B 44 16.069 -6.863 3.821 1.00 0.00 C ATOM 695 O ALA B 44 16.549 -5.732 3.940 1.00 0.00 O ATOM 696 CB ALA B 44 14.537 -8.077 5.377 1.00 0.00 C ATOM 0 H ALA B 44 16.391 -6.257 6.387 1.00 0.00 H new ATOM 0 HA ALA B 44 16.473 -8.729 4.767 1.00 0.00 H new ATOM 0 HB1 ALA B 44 14.032 -8.511 4.514 1.00 0.00 H new ATOM 0 HB2 ALA B 44 14.499 -8.778 6.211 1.00 0.00 H new ATOM 0 HB3 ALA B 44 14.039 -7.150 5.660 1.00 0.00 H new ATOM 702 N ALA B 45 15.615 -7.339 2.670 1.00 0.00 N ATOM 703 CA ALA B 45 15.586 -6.522 1.463 1.00 0.00 C ATOM 704 C ALA B 45 14.760 -5.263 1.690 1.00 0.00 C ATOM 705 O ALA B 45 15.007 -4.216 1.091 1.00 0.00 O ATOM 706 CB ALA B 45 15.024 -7.325 0.304 1.00 0.00 C ATOM 0 H ALA B 45 15.261 -8.288 2.546 1.00 0.00 H new ATOM 0 HA ALA B 45 16.605 -6.222 1.219 1.00 0.00 H new ATOM 0 HB1 ALA B 45 15.006 -6.706 -0.593 1.00 0.00 H new ATOM 0 HB2 ALA B 45 15.651 -8.199 0.129 1.00 0.00 H new ATOM 0 HB3 ALA B 45 14.010 -7.647 0.542 1.00 0.00 H new ATOM 712 N TYR B 46 13.813 -5.369 2.604 1.00 0.00 N ATOM 713 CA TYR B 46 12.931 -4.283 2.927 1.00 0.00 C ATOM 714 C TYR B 46 13.088 -3.949 4.394 1.00 0.00 C ATOM 715 O TYR B 46 13.329 -4.830 5.219 1.00 0.00 O ATOM 716 CB TYR B 46 11.480 -4.642 2.586 1.00 0.00 C ATOM 717 CG TYR B 46 11.162 -6.109 2.741 1.00 0.00 C ATOM 718 CD1 TYR B 46 10.935 -6.664 3.991 1.00 0.00 C ATOM 719 CD2 TYR B 46 11.091 -6.940 1.630 1.00 0.00 C ATOM 720 CE1 TYR B 46 10.646 -8.005 4.131 1.00 0.00 C ATOM 721 CE2 TYR B 46 10.802 -8.282 1.763 1.00 0.00 C ATOM 722 CZ TYR B 46 10.582 -8.809 3.016 1.00 0.00 C ATOM 723 OH TYR B 46 10.294 -10.145 3.157 1.00 0.00 O ATOM 0 H TYR B 46 13.640 -6.219 3.141 1.00 0.00 H new ATOM 0 HA TYR B 46 13.191 -3.407 2.333 1.00 0.00 H new ATOM 0 HB2 TYR B 46 10.813 -4.066 3.227 1.00 0.00 H new ATOM 0 HB3 TYR B 46 11.273 -4.342 1.559 1.00 0.00 H new ATOM 0 HD1 TYR B 46 10.985 -6.036 4.869 1.00 0.00 H new ATOM 0 HD2 TYR B 46 11.265 -6.529 0.647 1.00 0.00 H new ATOM 0 HE1 TYR B 46 10.471 -8.423 5.111 1.00 0.00 H new ATOM 0 HE2 TYR B 46 10.749 -8.916 0.890 1.00 0.00 H new ATOM 0 HH TYR B 46 10.754 -10.654 2.457 1.00 0.00 H new ATOM 733 N LYS B 47 12.998 -2.679 4.704 1.00 0.00 N ATOM 734 CA LYS B 47 13.208 -2.202 6.055 1.00 0.00 C ATOM 735 C LYS B 47 11.868 -1.924 6.705 1.00 0.00 C ATOM 736 O LYS B 47 11.739 -1.912 7.932 1.00 0.00 O ATOM 737 CB LYS B 47 14.062 -0.924 6.056 1.00 0.00 C ATOM 738 CG LYS B 47 15.519 -1.127 5.641 1.00 0.00 C ATOM 739 CD LYS B 47 15.661 -1.555 4.187 1.00 0.00 C ATOM 740 CE LYS B 47 15.210 -0.473 3.220 1.00 0.00 C ATOM 741 NZ LYS B 47 15.093 -0.996 1.837 1.00 0.00 N ATOM 0 H LYS B 47 12.778 -1.945 4.030 1.00 0.00 H new ATOM 0 HA LYS B 47 13.739 -2.970 6.618 1.00 0.00 H new ATOM 0 HB2 LYS B 47 13.605 -0.198 5.384 1.00 0.00 H new ATOM 0 HB3 LYS B 47 14.041 -0.490 7.056 1.00 0.00 H new ATOM 0 HG2 LYS B 47 16.070 -0.200 5.798 1.00 0.00 H new ATOM 0 HG3 LYS B 47 15.974 -1.881 6.284 1.00 0.00 H new ATOM 0 HD2 LYS B 47 16.702 -1.808 3.985 1.00 0.00 H new ATOM 0 HD3 LYS B 47 15.074 -2.458 4.018 1.00 0.00 H new ATOM 0 HE2 LYS B 47 14.248 -0.073 3.542 1.00 0.00 H new ATOM 0 HE3 LYS B 47 15.921 0.353 3.239 1.00 0.00 H new ATOM 0 HZ1 LYS B 47 15.172 -0.210 1.161 1.00 0.00 H new ATOM 0 HZ2 LYS B 47 15.854 -1.682 1.660 1.00 0.00 H new ATOM 0 HZ3 LYS B 47 14.171 -1.463 1.719 1.00 0.00 H new ATOM 755 N LEU B 48 10.876 -1.709 5.864 1.00 0.00 N ATOM 756 CA LEU B 48 9.540 -1.396 6.320 1.00 0.00 C ATOM 757 C LEU B 48 8.517 -2.140 5.471 1.00 0.00 C ATOM 758 O LEU B 48 8.616 -2.169 4.244 1.00 0.00 O ATOM 759 CB LEU B 48 9.312 0.120 6.231 1.00 0.00 C ATOM 760 CG LEU B 48 8.531 0.750 7.391 1.00 0.00 C ATOM 761 CD1 LEU B 48 7.122 0.203 7.466 1.00 0.00 C ATOM 762 CD2 LEU B 48 9.244 0.513 8.708 1.00 0.00 C ATOM 0 H LEU B 48 10.974 -1.747 4.849 1.00 0.00 H new ATOM 0 HA LEU B 48 9.424 -1.711 7.357 1.00 0.00 H new ATOM 0 HB2 LEU B 48 10.283 0.610 6.164 1.00 0.00 H new ATOM 0 HB3 LEU B 48 8.782 0.334 5.303 1.00 0.00 H new ATOM 0 HG LEU B 48 8.475 1.822 7.204 1.00 0.00 H new ATOM 0 HD11 LEU B 48 6.595 0.669 8.298 1.00 0.00 H new ATOM 0 HD12 LEU B 48 6.597 0.421 6.536 1.00 0.00 H new ATOM 0 HD13 LEU B 48 7.158 -0.876 7.618 1.00 0.00 H new ATOM 0 HD21 LEU B 48 8.673 0.968 9.518 1.00 0.00 H new ATOM 0 HD22 LEU B 48 9.334 -0.559 8.885 1.00 0.00 H new ATOM 0 HD23 LEU B 48 10.238 0.959 8.669 1.00 0.00 H new ATOM 774 N ARG B 49 7.558 -2.768 6.128 1.00 0.00 N ATOM 775 CA ARG B 49 6.472 -3.436 5.434 1.00 0.00 C ATOM 776 C ARG B 49 5.151 -2.813 5.849 1.00 0.00 C ATOM 777 O ARG B 49 4.882 -2.641 7.037 1.00 0.00 O ATOM 778 CB ARG B 49 6.457 -4.929 5.752 1.00 0.00 C ATOM 779 CG ARG B 49 5.507 -5.725 4.872 1.00 0.00 C ATOM 780 CD ARG B 49 5.318 -7.142 5.388 1.00 0.00 C ATOM 781 NE ARG B 49 4.557 -7.175 6.635 1.00 0.00 N ATOM 782 CZ ARG B 49 4.066 -8.286 7.182 1.00 0.00 C ATOM 783 NH1 ARG B 49 4.249 -9.463 6.595 1.00 0.00 N ATOM 784 NH2 ARG B 49 3.382 -8.220 8.315 1.00 0.00 N ATOM 0 H ARG B 49 7.510 -2.829 7.145 1.00 0.00 H new ATOM 0 HA ARG B 49 6.619 -3.316 4.361 1.00 0.00 H new ATOM 0 HB2 ARG B 49 7.465 -5.327 5.638 1.00 0.00 H new ATOM 0 HB3 ARG B 49 6.175 -5.068 6.796 1.00 0.00 H new ATOM 0 HG2 ARG B 49 4.541 -5.221 4.830 1.00 0.00 H new ATOM 0 HG3 ARG B 49 5.895 -5.757 3.854 1.00 0.00 H new ATOM 0 HD2 ARG B 49 4.803 -7.737 4.633 1.00 0.00 H new ATOM 0 HD3 ARG B 49 6.293 -7.603 5.546 1.00 0.00 H new ATOM 0 HE ARG B 49 4.391 -6.292 7.117 1.00 0.00 H new ATOM 0 HH11 ARG B 49 4.769 -9.521 5.719 1.00 0.00 H new ATOM 0 HH12 ARG B 49 3.870 -10.309 7.020 1.00 0.00 H new ATOM 0 HH21 ARG B 49 3.232 -7.319 8.768 1.00 0.00 H new ATOM 0 HH22 ARG B 49 3.006 -9.071 8.734 1.00 0.00 H new ATOM 798 N ILE B 50 4.342 -2.449 4.873 1.00 0.00 N ATOM 799 CA ILE B 50 3.042 -1.862 5.148 1.00 0.00 C ATOM 800 C ILE B 50 1.969 -2.675 4.440 1.00 0.00 C ATOM 801 O ILE B 50 2.072 -2.943 3.244 1.00 0.00 O ATOM 802 CB ILE B 50 2.938 -0.372 4.706 1.00 0.00 C ATOM 803 CG1 ILE B 50 4.110 0.477 5.219 1.00 0.00 C ATOM 804 CG2 ILE B 50 1.639 0.229 5.217 1.00 0.00 C ATOM 805 CD1 ILE B 50 5.428 0.243 4.516 1.00 0.00 C ATOM 0 H ILE B 50 4.561 -2.549 3.882 1.00 0.00 H new ATOM 0 HA ILE B 50 2.901 -1.883 6.229 1.00 0.00 H new ATOM 0 HB ILE B 50 2.966 -0.363 3.616 1.00 0.00 H new ATOM 0 HG12 ILE B 50 3.846 1.530 5.121 1.00 0.00 H new ATOM 0 HG13 ILE B 50 4.243 0.279 6.283 1.00 0.00 H new ATOM 0 HG21 ILE B 50 1.573 1.271 4.904 1.00 0.00 H new ATOM 0 HG22 ILE B 50 0.795 -0.327 4.808 1.00 0.00 H new ATOM 0 HG23 ILE B 50 1.616 0.175 6.305 1.00 0.00 H new ATOM 0 HD11 ILE B 50 6.191 0.889 4.950 1.00 0.00 H new ATOM 0 HD12 ILE B 50 5.724 -0.799 4.635 1.00 0.00 H new ATOM 0 HD13 ILE B 50 5.320 0.471 3.456 1.00 0.00 H new ATOM 817 N LEU B 51 0.957 -3.087 5.181 1.00 0.00 N ATOM 818 CA LEU B 51 -0.104 -3.903 4.631 1.00 0.00 C ATOM 819 C LEU B 51 -1.387 -3.107 4.575 1.00 0.00 C ATOM 820 O LEU B 51 -1.845 -2.598 5.593 1.00 0.00 O ATOM 821 CB LEU B 51 -0.306 -5.161 5.483 1.00 0.00 C ATOM 822 CG LEU B 51 0.358 -6.433 4.956 1.00 0.00 C ATOM 823 CD1 LEU B 51 -0.263 -6.840 3.636 1.00 0.00 C ATOM 824 CD2 LEU B 51 1.855 -6.242 4.796 1.00 0.00 C ATOM 0 H LEU B 51 0.849 -2.867 6.171 1.00 0.00 H new ATOM 0 HA LEU B 51 0.174 -4.206 3.622 1.00 0.00 H new ATOM 0 HB2 LEU B 51 0.074 -4.963 6.485 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -1.376 -5.345 5.578 1.00 0.00 H new ATOM 0 HG LEU B 51 0.194 -7.227 5.684 1.00 0.00 H new ATOM 0 HD11 LEU B 51 0.219 -7.747 3.272 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -1.328 -7.026 3.777 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -0.128 -6.040 2.908 1.00 0.00 H new ATOM 0 HD21 LEU B 51 2.301 -7.163 4.420 1.00 0.00 H new ATOM 0 HD22 LEU B 51 2.045 -5.432 4.092 1.00 0.00 H new ATOM 0 HD23 LEU B 51 2.295 -5.994 5.762 1.00 0.00 H new ATOM 836 N ILE B 52 -1.943 -2.968 3.387 1.00 0.00 N ATOM 837 CA ILE B 52 -3.205 -2.268 3.225 1.00 0.00 C ATOM 838 C ILE B 52 -4.197 -3.153 2.486 1.00 0.00 C ATOM 839 O ILE B 52 -4.122 -3.305 1.271 1.00 0.00 O ATOM 840 CB ILE B 52 -3.051 -0.939 2.449 1.00 0.00 C ATOM 841 CG1 ILE B 52 -1.958 -0.056 3.062 1.00 0.00 C ATOM 842 CG2 ILE B 52 -4.375 -0.194 2.426 1.00 0.00 C ATOM 843 CD1 ILE B 52 -0.582 -0.306 2.486 1.00 0.00 C ATOM 0 H ILE B 52 -1.543 -3.329 2.521 1.00 0.00 H new ATOM 0 HA ILE B 52 -3.567 -2.034 4.226 1.00 0.00 H new ATOM 0 HB ILE B 52 -2.754 -1.178 1.428 1.00 0.00 H new ATOM 0 HG12 ILE B 52 -2.221 0.991 2.910 1.00 0.00 H new ATOM 0 HG13 ILE B 52 -1.928 -0.225 4.138 1.00 0.00 H new ATOM 0 HG21 ILE B 52 -4.257 0.741 1.878 1.00 0.00 H new ATOM 0 HG22 ILE B 52 -5.130 -0.809 1.937 1.00 0.00 H new ATOM 0 HG23 ILE B 52 -4.689 0.022 3.447 1.00 0.00 H new ATOM 0 HD11 ILE B 52 0.139 0.354 2.967 1.00 0.00 H new ATOM 0 HD12 ILE B 52 -0.297 -1.344 2.661 1.00 0.00 H new ATOM 0 HD13 ILE B 52 -0.595 -0.109 1.414 1.00 0.00 H new ATOM 855 N GLU B 53 -5.126 -3.737 3.217 1.00 0.00 N ATOM 856 CA GLU B 53 -6.118 -4.605 2.607 1.00 0.00 C ATOM 857 C GLU B 53 -7.495 -3.979 2.685 1.00 0.00 C ATOM 858 O GLU B 53 -7.772 -3.164 3.558 1.00 0.00 O ATOM 859 CB GLU B 53 -6.125 -5.983 3.258 1.00 0.00 C ATOM 860 CG GLU B 53 -6.554 -5.977 4.705 1.00 0.00 C ATOM 861 CD GLU B 53 -6.427 -7.344 5.338 1.00 0.00 C ATOM 862 OE1 GLU B 53 -5.311 -7.709 5.758 1.00 0.00 O ATOM 863 OE2 GLU B 53 -7.441 -8.067 5.403 1.00 0.00 O ATOM 0 H GLU B 53 -5.216 -3.629 4.227 1.00 0.00 H new ATOM 0 HA GLU B 53 -5.849 -4.730 1.558 1.00 0.00 H new ATOM 0 HB2 GLU B 53 -6.792 -6.636 2.695 1.00 0.00 H new ATOM 0 HB3 GLU B 53 -5.125 -6.412 3.188 1.00 0.00 H new ATOM 0 HG2 GLU B 53 -5.947 -5.262 5.260 1.00 0.00 H new ATOM 0 HG3 GLU B 53 -7.588 -5.639 4.775 1.00 0.00 H new ATOM 870 N ASN B 54 -8.345 -4.365 1.761 1.00 0.00 N ATOM 871 CA ASN B 54 -9.675 -3.790 1.655 1.00 0.00 C ATOM 872 C ASN B 54 -10.700 -4.697 2.307 1.00 0.00 C ATOM 873 O ASN B 54 -10.977 -5.788 1.811 1.00 0.00 O ATOM 874 CB ASN B 54 -10.043 -3.584 0.191 1.00 0.00 C ATOM 875 CG ASN B 54 -11.250 -2.686 -0.003 1.00 0.00 C ATOM 876 OD1 ASN B 54 -11.972 -2.814 -0.988 1.00 0.00 O ATOM 877 ND2 ASN B 54 -11.472 -1.769 0.924 1.00 0.00 N ATOM 0 H ASN B 54 -8.140 -5.081 1.064 1.00 0.00 H new ATOM 0 HA ASN B 54 -9.673 -2.828 2.168 1.00 0.00 H new ATOM 0 HB2 ASN B 54 -9.190 -3.153 -0.334 1.00 0.00 H new ATOM 0 HB3 ASN B 54 -10.242 -4.553 -0.266 1.00 0.00 H new ATOM 0 HD21 ASN B 54 -12.267 -1.136 0.835 1.00 0.00 H new ATOM 0 HD22 ASN B 54 -10.848 -1.695 1.728 1.00 0.00 H new ATOM 884 N LYS B 55 -11.254 -4.242 3.413 1.00 0.00 N ATOM 885 CA LYS B 55 -12.258 -4.999 4.130 1.00 0.00 C ATOM 886 C LYS B 55 -13.426 -4.101 4.535 1.00 0.00 C ATOM 887 O LYS B 55 -13.412 -3.464 5.586 1.00 0.00 O ATOM 888 CB LYS B 55 -11.616 -5.677 5.351 1.00 0.00 C ATOM 889 CG LYS B 55 -10.566 -4.822 6.068 1.00 0.00 C ATOM 890 CD LYS B 55 -11.101 -4.189 7.347 1.00 0.00 C ATOM 891 CE LYS B 55 -11.510 -5.231 8.380 1.00 0.00 C ATOM 892 NZ LYS B 55 -10.364 -6.068 8.831 1.00 0.00 N ATOM 0 H LYS B 55 -11.023 -3.344 3.837 1.00 0.00 H new ATOM 0 HA LYS B 55 -12.659 -5.774 3.477 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -12.401 -5.939 6.061 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -11.151 -6.610 5.031 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -9.701 -5.440 6.307 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -10.221 -4.037 5.395 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -10.339 -3.537 7.774 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -11.959 -3.561 7.108 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -11.951 -4.730 9.242 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -12.281 -5.875 7.956 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -10.688 -6.738 9.557 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -9.979 -6.595 8.021 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -9.623 -5.457 9.230 1.00 0.00 H new ATOM 906 N ALA B 56 -14.437 -4.053 3.682 1.00 0.00 N ATOM 907 CA ALA B 56 -15.651 -3.299 3.968 1.00 0.00 C ATOM 908 C ALA B 56 -16.883 -4.154 3.688 1.00 0.00 C ATOM 909 O ALA B 56 -16.775 -5.172 3.000 1.00 0.00 O ATOM 910 CB ALA B 56 -15.690 -2.020 3.140 1.00 0.00 C ATOM 0 H ALA B 56 -14.442 -4.530 2.780 1.00 0.00 H new ATOM 0 HA ALA B 56 -15.651 -3.026 5.023 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -16.603 -1.468 3.365 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -14.824 -1.403 3.382 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -15.671 -2.272 2.080 1.00 0.00 H new ATOM 916 N PRO B 57 -18.063 -3.774 4.217 1.00 0.00 N ATOM 917 CA PRO B 57 -19.306 -4.524 4.007 1.00 0.00 C ATOM 918 C PRO B 57 -19.586 -4.751 2.529 1.00 0.00 C ATOM 919 O PRO B 57 -19.928 -5.854 2.101 1.00 0.00 O ATOM 920 CB PRO B 57 -20.387 -3.630 4.636 1.00 0.00 C ATOM 921 CG PRO B 57 -19.737 -2.303 4.830 1.00 0.00 C ATOM 922 CD PRO B 57 -18.289 -2.597 5.065 1.00 0.00 C ATOM 0 HA PRO B 57 -19.264 -5.519 4.449 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -21.258 -3.550 3.986 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -20.734 -4.040 5.584 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -19.871 -1.669 3.954 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -20.172 -1.773 5.677 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -17.653 -1.760 4.776 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -18.082 -2.807 6.114 1.00 0.00 H new ATOM 930 N ASN B 58 -19.419 -3.696 1.759 1.00 0.00 N ATOM 931 CA ASN B 58 -19.634 -3.741 0.325 1.00 0.00 C ATOM 932 C ASN B 58 -18.673 -2.798 -0.384 1.00 0.00 C ATOM 933 O ASN B 58 -19.055 -1.734 -0.864 1.00 0.00 O ATOM 934 CB ASN B 58 -21.087 -3.419 0.000 1.00 0.00 C ATOM 935 CG ASN B 58 -21.615 -2.289 0.838 1.00 0.00 C ATOM 936 OD1 ASN B 58 -21.728 -1.148 0.397 1.00 0.00 O ATOM 937 ND2 ASN B 58 -21.921 -2.618 2.075 1.00 0.00 N ATOM 0 H ASN B 58 -19.130 -2.782 2.108 1.00 0.00 H new ATOM 0 HA ASN B 58 -19.430 -4.749 -0.036 1.00 0.00 H new ATOM 0 HB2 ASN B 58 -21.173 -3.159 -1.055 1.00 0.00 H new ATOM 0 HB3 ASN B 58 -21.699 -4.306 0.161 1.00 0.00 H new ATOM 0 HD21 ASN B 58 -22.271 -1.909 2.719 1.00 0.00 H new ATOM 0 HD22 ASN B 58 -21.808 -3.582 2.389 1.00 0.00 H new ATOM 944 N SER B 59 -17.418 -3.216 -0.434 1.00 0.00 N ATOM 945 CA SER B 59 -16.339 -2.398 -0.963 1.00 0.00 C ATOM 946 C SER B 59 -16.488 -2.166 -2.463 1.00 0.00 C ATOM 947 O SER B 59 -16.660 -3.111 -3.237 1.00 0.00 O ATOM 948 CB SER B 59 -15.006 -3.090 -0.681 1.00 0.00 C ATOM 949 OG SER B 59 -14.987 -3.656 0.620 1.00 0.00 O ATOM 0 H SER B 59 -17.119 -4.135 -0.108 1.00 0.00 H new ATOM 0 HA SER B 59 -16.375 -1.425 -0.473 1.00 0.00 H new ATOM 0 HB2 SER B 59 -14.834 -3.870 -1.422 1.00 0.00 H new ATOM 0 HB3 SER B 59 -14.192 -2.372 -0.780 1.00 0.00 H new ATOM 0 HG SER B 59 -14.124 -4.094 0.774 1.00 0.00 H new ATOM 955 N LYS B 60 -16.431 -0.903 -2.857 1.00 0.00 N ATOM 956 CA LYS B 60 -16.443 -0.531 -4.260 1.00 0.00 C ATOM 957 C LYS B 60 -15.344 0.492 -4.549 1.00 0.00 C ATOM 958 O LYS B 60 -15.621 1.676 -4.741 1.00 0.00 O ATOM 959 CB LYS B 60 -17.807 0.043 -4.643 1.00 0.00 C ATOM 960 CG LYS B 60 -18.931 -0.982 -4.630 1.00 0.00 C ATOM 961 CD LYS B 60 -20.211 -0.422 -5.226 1.00 0.00 C ATOM 962 CE LYS B 60 -20.049 -0.113 -6.705 1.00 0.00 C ATOM 963 NZ LYS B 60 -21.334 0.284 -7.334 1.00 0.00 N ATOM 0 H LYS B 60 -16.375 -0.112 -2.215 1.00 0.00 H new ATOM 0 HA LYS B 60 -16.256 -1.424 -4.857 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -18.057 0.851 -3.955 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -17.739 0.482 -5.639 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -18.625 -1.865 -5.191 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -19.117 -1.304 -3.606 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -21.021 -1.139 -5.090 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -20.495 0.485 -4.693 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -19.321 0.689 -6.830 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -19.650 -0.989 -7.217 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -21.179 0.486 -8.342 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -22.022 -0.490 -7.238 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -21.703 1.135 -6.863 1.00 0.00 H new ATOM 977 N PRO B 61 -14.078 0.046 -4.574 1.00 0.00 N ATOM 978 CA PRO B 61 -12.930 0.930 -4.807 1.00 0.00 C ATOM 979 C PRO B 61 -12.848 1.428 -6.249 1.00 0.00 C ATOM 980 O PRO B 61 -13.475 0.864 -7.155 1.00 0.00 O ATOM 981 CB PRO B 61 -11.729 0.039 -4.483 1.00 0.00 C ATOM 982 CG PRO B 61 -12.207 -1.346 -4.749 1.00 0.00 C ATOM 983 CD PRO B 61 -13.664 -1.355 -4.376 1.00 0.00 C ATOM 0 HA PRO B 61 -12.989 1.835 -4.203 1.00 0.00 H new ATOM 0 HB2 PRO B 61 -10.870 0.289 -5.106 1.00 0.00 H new ATOM 0 HB3 PRO B 61 -11.415 0.158 -3.446 1.00 0.00 H new ATOM 0 HG2 PRO B 61 -12.070 -1.612 -5.797 1.00 0.00 H new ATOM 0 HG3 PRO B 61 -11.648 -2.073 -4.160 1.00 0.00 H new ATOM 0 HD2 PRO B 61 -14.236 -2.036 -5.007 1.00 0.00 H new ATOM 0 HD3 PRO B 61 -13.812 -1.676 -3.345 1.00 0.00 H new ATOM 991 N ASP B 62 -12.073 2.488 -6.451 1.00 0.00 N ATOM 992 CA ASP B 62 -11.862 3.044 -7.780 1.00 0.00 C ATOM 993 C ASP B 62 -10.719 2.325 -8.475 1.00 0.00 C ATOM 994 O ASP B 62 -10.939 1.490 -9.353 1.00 0.00 O ATOM 995 CB ASP B 62 -11.556 4.545 -7.711 1.00 0.00 C ATOM 996 CG ASP B 62 -12.753 5.378 -7.304 1.00 0.00 C ATOM 997 OD1 ASP B 62 -13.622 5.634 -8.162 1.00 0.00 O ATOM 998 OD2 ASP B 62 -12.828 5.790 -6.127 1.00 0.00 O ATOM 0 H ASP B 62 -11.579 2.980 -5.707 1.00 0.00 H new ATOM 0 HA ASP B 62 -12.781 2.903 -8.349 1.00 0.00 H new ATOM 0 HB2 ASP B 62 -10.746 4.712 -7.001 1.00 0.00 H new ATOM 0 HB3 ASP B 62 -11.201 4.882 -8.685 1.00 0.00 H new ATOM 1003 N ARG B 63 -9.499 2.647 -8.072 1.00 0.00 N ATOM 1004 CA ARG B 63 -8.313 2.045 -8.652 1.00 0.00 C ATOM 1005 C ARG B 63 -7.128 2.201 -7.710 1.00 0.00 C ATOM 1006 O ARG B 63 -7.276 2.689 -6.589 1.00 0.00 O ATOM 1007 CB ARG B 63 -8.010 2.702 -9.996 1.00 0.00 C ATOM 1008 CG ARG B 63 -7.873 4.210 -9.912 1.00 0.00 C ATOM 1009 CD ARG B 63 -7.863 4.836 -11.291 1.00 0.00 C ATOM 1010 NE ARG B 63 -6.670 4.467 -12.054 1.00 0.00 N ATOM 1011 CZ ARG B 63 -6.527 4.667 -13.364 1.00 0.00 C ATOM 1012 NH1 ARG B 63 -7.509 5.214 -14.069 1.00 0.00 N ATOM 1013 NH2 ARG B 63 -5.395 4.317 -13.968 1.00 0.00 N ATOM 0 H ARG B 63 -9.306 3.329 -7.338 1.00 0.00 H new ATOM 0 HA ARG B 63 -8.492 0.981 -8.807 1.00 0.00 H new ATOM 0 HB2 ARG B 63 -7.087 2.283 -10.397 1.00 0.00 H new ATOM 0 HB3 ARG B 63 -8.805 2.455 -10.700 1.00 0.00 H new ATOM 0 HG2 ARG B 63 -8.697 4.621 -9.329 1.00 0.00 H new ATOM 0 HG3 ARG B 63 -6.953 4.466 -9.387 1.00 0.00 H new ATOM 0 HD2 ARG B 63 -8.753 4.524 -11.837 1.00 0.00 H new ATOM 0 HD3 ARG B 63 -7.911 5.921 -11.197 1.00 0.00 H new ATOM 0 HE ARG B 63 -5.898 4.029 -11.551 1.00 0.00 H new ATOM 0 HH11 ARG B 63 -8.378 5.484 -13.609 1.00 0.00 H new ATOM 0 HH12 ARG B 63 -7.394 5.365 -15.071 1.00 0.00 H new ATOM 0 HH21 ARG B 63 -4.638 3.896 -13.429 1.00 0.00 H new ATOM 0 HH22 ARG B 63 -5.284 4.469 -14.970 1.00 0.00 H new ATOM 1027 N PHE B 64 -5.962 1.771 -8.166 1.00 0.00 N ATOM 1028 CA PHE B 64 -4.739 1.893 -7.390 1.00 0.00 C ATOM 1029 C PHE B 64 -3.654 2.568 -8.212 1.00 0.00 C ATOM 1030 O PHE B 64 -3.199 2.028 -9.222 1.00 0.00 O ATOM 1031 CB PHE B 64 -4.245 0.521 -6.927 1.00 0.00 C ATOM 1032 CG PHE B 64 -5.117 -0.118 -5.889 1.00 0.00 C ATOM 1033 CD1 PHE B 64 -4.982 0.231 -4.558 1.00 0.00 C ATOM 1034 CD2 PHE B 64 -6.057 -1.071 -6.240 1.00 0.00 C ATOM 1035 CE1 PHE B 64 -5.773 -0.356 -3.591 1.00 0.00 C ATOM 1036 CE2 PHE B 64 -6.853 -1.662 -5.278 1.00 0.00 C ATOM 1037 CZ PHE B 64 -6.710 -1.305 -3.951 1.00 0.00 C ATOM 0 H PHE B 64 -5.837 1.331 -9.078 1.00 0.00 H new ATOM 0 HA PHE B 64 -4.961 2.502 -6.514 1.00 0.00 H new ATOM 0 HB2 PHE B 64 -4.179 -0.141 -7.790 1.00 0.00 H new ATOM 0 HB3 PHE B 64 -3.236 0.625 -6.527 1.00 0.00 H new ATOM 0 HD1 PHE B 64 -4.249 0.971 -4.272 1.00 0.00 H new ATOM 0 HD2 PHE B 64 -6.169 -1.355 -7.276 1.00 0.00 H new ATOM 0 HE1 PHE B 64 -5.660 -0.074 -2.555 1.00 0.00 H new ATOM 0 HE2 PHE B 64 -7.586 -2.402 -5.563 1.00 0.00 H new ATOM 0 HZ PHE B 64 -7.330 -1.767 -3.197 1.00 0.00 H new ATOM 1047 N SER B 65 -3.255 3.752 -7.794 1.00 0.00 N ATOM 1048 CA SER B 65 -2.157 4.446 -8.438 1.00 0.00 C ATOM 1049 C SER B 65 -1.272 5.099 -7.384 1.00 0.00 C ATOM 1050 O SER B 65 -1.360 6.302 -7.132 1.00 0.00 O ATOM 1051 CB SER B 65 -2.697 5.490 -9.415 1.00 0.00 C ATOM 1052 OG SER B 65 -3.573 4.889 -10.361 1.00 0.00 O ATOM 0 H SER B 65 -3.674 4.254 -7.011 1.00 0.00 H new ATOM 0 HA SER B 65 -1.558 3.730 -9.000 1.00 0.00 H new ATOM 0 HB2 SER B 65 -3.226 6.269 -8.866 1.00 0.00 H new ATOM 0 HB3 SER B 65 -1.869 5.972 -9.934 1.00 0.00 H new ATOM 0 HG SER B 65 -3.909 5.574 -10.976 1.00 0.00 H new ATOM 1058 N PRO B 66 -0.397 4.300 -6.759 1.00 0.00 N ATOM 1059 CA PRO B 66 0.497 4.777 -5.712 1.00 0.00 C ATOM 1060 C PRO B 66 1.680 5.554 -6.271 1.00 0.00 C ATOM 1061 O PRO B 66 2.123 5.323 -7.398 1.00 0.00 O ATOM 1062 CB PRO B 66 0.967 3.491 -5.037 1.00 0.00 C ATOM 1063 CG PRO B 66 0.894 2.454 -6.103 1.00 0.00 C ATOM 1064 CD PRO B 66 -0.229 2.858 -7.017 1.00 0.00 C ATOM 0 HA PRO B 66 0.000 5.471 -5.034 1.00 0.00 H new ATOM 0 HB2 PRO B 66 1.982 3.594 -4.654 1.00 0.00 H new ATOM 0 HB3 PRO B 66 0.331 3.233 -4.190 1.00 0.00 H new ATOM 0 HG2 PRO B 66 1.835 2.392 -6.649 1.00 0.00 H new ATOM 0 HG3 PRO B 66 0.709 1.469 -5.674 1.00 0.00 H new ATOM 0 HD2 PRO B 66 0.017 2.665 -8.061 1.00 0.00 H new ATOM 0 HD3 PRO B 66 -1.142 2.304 -6.797 1.00 0.00 H new ATOM 1072 N SER B 67 2.181 6.487 -5.489 1.00 0.00 N ATOM 1073 CA SER B 67 3.303 7.307 -5.907 1.00 0.00 C ATOM 1074 C SER B 67 4.078 7.801 -4.694 1.00 0.00 C ATOM 1075 O SER B 67 3.493 8.101 -3.652 1.00 0.00 O ATOM 1076 CB SER B 67 2.821 8.495 -6.739 1.00 0.00 C ATOM 1077 OG SER B 67 1.994 8.071 -7.813 1.00 0.00 O ATOM 0 H SER B 67 1.828 6.699 -4.556 1.00 0.00 H new ATOM 0 HA SER B 67 3.963 6.696 -6.523 1.00 0.00 H new ATOM 0 HB2 SER B 67 2.269 9.187 -6.103 1.00 0.00 H new ATOM 0 HB3 SER B 67 3.680 9.039 -7.132 1.00 0.00 H new ATOM 0 HG SER B 67 1.699 8.852 -8.327 1.00 0.00 H new ATOM 1083 N TYR B 68 5.390 7.877 -4.837 1.00 0.00 N ATOM 1084 CA TYR B 68 6.249 8.330 -3.763 1.00 0.00 C ATOM 1085 C TYR B 68 6.723 9.746 -4.030 1.00 0.00 C ATOM 1086 O TYR B 68 7.471 10.002 -4.974 1.00 0.00 O ATOM 1087 CB TYR B 68 7.455 7.406 -3.603 1.00 0.00 C ATOM 1088 CG TYR B 68 8.435 7.878 -2.555 1.00 0.00 C ATOM 1089 CD1 TYR B 68 8.080 7.923 -1.212 1.00 0.00 C ATOM 1090 CD2 TYR B 68 9.711 8.291 -2.909 1.00 0.00 C ATOM 1091 CE1 TYR B 68 8.971 8.363 -0.256 1.00 0.00 C ATOM 1092 CE2 TYR B 68 10.606 8.732 -1.956 1.00 0.00 C ATOM 1093 CZ TYR B 68 10.231 8.767 -0.631 1.00 0.00 C ATOM 1094 OH TYR B 68 11.120 9.205 0.322 1.00 0.00 O ATOM 0 H TYR B 68 5.884 7.628 -5.694 1.00 0.00 H new ATOM 0 HA TYR B 68 5.671 8.312 -2.839 1.00 0.00 H new ATOM 0 HB2 TYR B 68 7.106 6.407 -3.341 1.00 0.00 H new ATOM 0 HB3 TYR B 68 7.970 7.323 -4.560 1.00 0.00 H new ATOM 0 HD1 TYR B 68 7.091 7.609 -0.913 1.00 0.00 H new ATOM 0 HD2 TYR B 68 10.009 8.267 -3.947 1.00 0.00 H new ATOM 0 HE1 TYR B 68 8.680 8.390 0.784 1.00 0.00 H new ATOM 0 HE2 TYR B 68 11.597 9.048 -2.248 1.00 0.00 H new ATOM 0 HH TYR B 68 11.965 9.452 -0.108 1.00 0.00 H new ATOM 1104 N ASN B 69 6.279 10.661 -3.201 1.00 0.00 N ATOM 1105 CA ASN B 69 6.703 12.041 -3.306 1.00 0.00 C ATOM 1106 C ASN B 69 7.863 12.315 -2.362 1.00 0.00 C ATOM 1107 O ASN B 69 7.684 12.365 -1.145 1.00 0.00 O ATOM 1108 CB ASN B 69 5.532 12.993 -3.037 1.00 0.00 C ATOM 1109 CG ASN B 69 4.587 12.500 -1.960 1.00 0.00 C ATOM 1110 OD1 ASN B 69 3.634 11.773 -2.239 1.00 0.00 O ATOM 1111 ND2 ASN B 69 4.827 12.910 -0.733 1.00 0.00 N ATOM 0 H ASN B 69 5.622 10.476 -2.443 1.00 0.00 H new ATOM 0 HA ASN B 69 7.048 12.219 -4.325 1.00 0.00 H new ATOM 0 HB2 ASN B 69 5.925 13.967 -2.746 1.00 0.00 H new ATOM 0 HB3 ASN B 69 4.973 13.138 -3.961 1.00 0.00 H new ATOM 0 HD21 ASN B 69 4.212 12.626 0.029 1.00 0.00 H new ATOM 0 HD22 ASN B 69 5.628 13.512 -0.544 1.00 0.00 H new ATOM 1118 N PHE B 70 9.056 12.489 -2.939 1.00 0.00 N ATOM 1119 CA PHE B 70 10.275 12.746 -2.167 1.00 0.00 C ATOM 1120 C PHE B 70 10.124 14.020 -1.359 1.00 0.00 C ATOM 1121 O PHE B 70 10.727 14.175 -0.298 1.00 0.00 O ATOM 1122 CB PHE B 70 11.491 12.894 -3.090 1.00 0.00 C ATOM 1123 CG PHE B 70 11.853 11.657 -3.860 1.00 0.00 C ATOM 1124 CD1 PHE B 70 11.243 11.377 -5.071 1.00 0.00 C ATOM 1125 CD2 PHE B 70 12.819 10.786 -3.381 1.00 0.00 C ATOM 1126 CE1 PHE B 70 11.588 10.248 -5.788 1.00 0.00 C ATOM 1127 CE2 PHE B 70 13.165 9.654 -4.094 1.00 0.00 C ATOM 1128 CZ PHE B 70 12.549 9.385 -5.300 1.00 0.00 C ATOM 0 H PHE B 70 9.203 12.456 -3.948 1.00 0.00 H new ATOM 0 HA PHE B 70 10.430 11.896 -1.502 1.00 0.00 H new ATOM 0 HB2 PHE B 70 11.297 13.701 -3.797 1.00 0.00 H new ATOM 0 HB3 PHE B 70 12.350 13.196 -2.490 1.00 0.00 H new ATOM 0 HD1 PHE B 70 10.490 12.048 -5.459 1.00 0.00 H new ATOM 0 HD2 PHE B 70 13.307 10.994 -2.440 1.00 0.00 H new ATOM 0 HE1 PHE B 70 11.105 10.040 -6.732 1.00 0.00 H new ATOM 0 HE2 PHE B 70 13.916 8.981 -3.708 1.00 0.00 H new ATOM 0 HZ PHE B 70 12.818 8.502 -5.860 1.00 0.00 H new ATOM 1138 N ALA B 71 9.305 14.922 -1.881 1.00 0.00 N ATOM 1139 CA ALA B 71 9.034 16.197 -1.243 1.00 0.00 C ATOM 1140 C ALA B 71 8.606 16.009 0.206 1.00 0.00 C ATOM 1141 O ALA B 71 9.062 16.722 1.096 1.00 0.00 O ATOM 1142 CB ALA B 71 7.953 16.930 -2.019 1.00 0.00 C ATOM 0 H ALA B 71 8.809 14.787 -2.762 1.00 0.00 H new ATOM 0 HA ALA B 71 9.950 16.788 -1.244 1.00 0.00 H new ATOM 0 HB1 ALA B 71 7.748 17.888 -1.541 1.00 0.00 H new ATOM 0 HB2 ALA B 71 8.291 17.099 -3.041 1.00 0.00 H new ATOM 0 HB3 ALA B 71 7.044 16.329 -2.032 1.00 0.00 H new ATOM 1148 N GLU B 72 7.724 15.046 0.436 1.00 0.00 N ATOM 1149 CA GLU B 72 7.218 14.788 1.775 1.00 0.00 C ATOM 1150 C GLU B 72 7.667 13.421 2.274 1.00 0.00 C ATOM 1151 O GLU B 72 7.267 12.992 3.351 1.00 0.00 O ATOM 1152 CB GLU B 72 5.694 14.846 1.786 1.00 0.00 C ATOM 1153 CG GLU B 72 5.114 15.895 0.853 1.00 0.00 C ATOM 1154 CD GLU B 72 3.601 15.930 0.878 1.00 0.00 C ATOM 1155 OE1 GLU B 72 2.968 15.123 0.165 1.00 0.00 O ATOM 1156 OE2 GLU B 72 3.036 16.775 1.600 1.00 0.00 O ATOM 0 H GLU B 72 7.346 14.433 -0.286 1.00 0.00 H new ATOM 0 HA GLU B 72 7.620 15.557 2.435 1.00 0.00 H new ATOM 0 HB2 GLU B 72 5.300 13.868 1.508 1.00 0.00 H new ATOM 0 HB3 GLU B 72 5.355 15.049 2.802 1.00 0.00 H new ATOM 0 HG2 GLU B 72 5.500 16.876 1.131 1.00 0.00 H new ATOM 0 HG3 GLU B 72 5.452 15.696 -0.164 1.00 0.00 H new ATOM 1163 N ASN B 73 8.483 12.744 1.453 1.00 0.00 N ATOM 1164 CA ASN B 73 8.936 11.361 1.694 1.00 0.00 C ATOM 1165 C ASN B 73 7.768 10.447 2.069 1.00 0.00 C ATOM 1166 O ASN B 73 7.863 9.607 2.970 1.00 0.00 O ATOM 1167 CB ASN B 73 10.076 11.274 2.737 1.00 0.00 C ATOM 1168 CG ASN B 73 9.751 11.907 4.076 1.00 0.00 C ATOM 1169 OD1 ASN B 73 10.092 13.065 4.329 1.00 0.00 O ATOM 1170 ND2 ASN B 73 9.088 11.161 4.940 1.00 0.00 N ATOM 0 H ASN B 73 8.853 13.144 0.591 1.00 0.00 H new ATOM 0 HA ASN B 73 9.353 11.007 0.751 1.00 0.00 H new ATOM 0 HB2 ASN B 73 10.327 10.225 2.896 1.00 0.00 H new ATOM 0 HB3 ASN B 73 10.964 11.755 2.327 1.00 0.00 H new ATOM 0 HD21 ASN B 73 8.840 11.538 5.855 1.00 0.00 H new ATOM 0 HD22 ASN B 73 8.824 10.207 4.693 1.00 0.00 H new ATOM 1177 N ILE B 74 6.672 10.598 1.340 1.00 0.00 N ATOM 1178 CA ILE B 74 5.465 9.838 1.610 1.00 0.00 C ATOM 1179 C ILE B 74 5.041 9.026 0.389 1.00 0.00 C ATOM 1180 O ILE B 74 5.117 9.503 -0.744 1.00 0.00 O ATOM 1181 CB ILE B 74 4.330 10.787 2.045 1.00 0.00 C ATOM 1182 CG1 ILE B 74 4.668 11.393 3.406 1.00 0.00 C ATOM 1183 CG2 ILE B 74 2.991 10.065 2.089 1.00 0.00 C ATOM 1184 CD1 ILE B 74 3.886 12.640 3.731 1.00 0.00 C ATOM 0 H ILE B 74 6.596 11.244 0.554 1.00 0.00 H new ATOM 0 HA ILE B 74 5.675 9.139 2.420 1.00 0.00 H new ATOM 0 HB ILE B 74 4.241 11.586 1.309 1.00 0.00 H new ATOM 0 HG12 ILE B 74 4.483 10.648 4.180 1.00 0.00 H new ATOM 0 HG13 ILE B 74 5.732 11.626 3.435 1.00 0.00 H new ATOM 0 HG21 ILE B 74 2.212 10.762 2.399 1.00 0.00 H new ATOM 0 HG22 ILE B 74 2.755 9.675 1.099 1.00 0.00 H new ATOM 0 HG23 ILE B 74 3.045 9.241 2.801 1.00 0.00 H new ATOM 0 HD11 ILE B 74 4.182 13.010 4.713 1.00 0.00 H new ATOM 0 HD12 ILE B 74 4.089 13.403 2.979 1.00 0.00 H new ATOM 0 HD13 ILE B 74 2.821 12.410 3.736 1.00 0.00 H new ATOM 1196 N LEU B 75 4.627 7.791 0.633 1.00 0.00 N ATOM 1197 CA LEU B 75 4.121 6.919 -0.409 1.00 0.00 C ATOM 1198 C LEU B 75 2.598 6.923 -0.352 1.00 0.00 C ATOM 1199 O LEU B 75 1.998 6.281 0.507 1.00 0.00 O ATOM 1200 CB LEU B 75 4.687 5.496 -0.220 1.00 0.00 C ATOM 1201 CG LEU B 75 4.362 4.456 -1.309 1.00 0.00 C ATOM 1202 CD1 LEU B 75 2.942 3.927 -1.173 1.00 0.00 C ATOM 1203 CD2 LEU B 75 4.577 5.042 -2.693 1.00 0.00 C ATOM 0 H LEU B 75 4.634 7.368 1.561 1.00 0.00 H new ATOM 0 HA LEU B 75 4.437 7.274 -1.390 1.00 0.00 H new ATOM 0 HB2 LEU B 75 5.771 5.572 -0.139 1.00 0.00 H new ATOM 0 HB3 LEU B 75 4.323 5.112 0.733 1.00 0.00 H new ATOM 0 HG LEU B 75 5.045 3.617 -1.173 1.00 0.00 H new ATOM 0 HD11 LEU B 75 2.749 3.196 -1.958 1.00 0.00 H new ATOM 0 HD12 LEU B 75 2.822 3.453 -0.199 1.00 0.00 H new ATOM 0 HD13 LEU B 75 2.236 4.752 -1.265 1.00 0.00 H new ATOM 0 HD21 LEU B 75 4.342 4.291 -3.447 1.00 0.00 H new ATOM 0 HD22 LEU B 75 3.927 5.907 -2.827 1.00 0.00 H new ATOM 0 HD23 LEU B 75 5.617 5.350 -2.800 1.00 0.00 H new ATOM 1215 N TYR B 76 1.974 7.662 -1.245 1.00 0.00 N ATOM 1216 CA TYR B 76 0.530 7.754 -1.249 1.00 0.00 C ATOM 1217 C TYR B 76 -0.050 6.645 -2.120 1.00 0.00 C ATOM 1218 O TYR B 76 0.499 6.321 -3.174 1.00 0.00 O ATOM 1219 CB TYR B 76 0.093 9.149 -1.727 1.00 0.00 C ATOM 1220 CG TYR B 76 -0.533 9.185 -3.099 1.00 0.00 C ATOM 1221 CD1 TYR B 76 0.247 9.317 -4.235 1.00 0.00 C ATOM 1222 CD2 TYR B 76 -1.907 9.088 -3.249 1.00 0.00 C ATOM 1223 CE1 TYR B 76 -0.325 9.350 -5.492 1.00 0.00 C ATOM 1224 CE2 TYR B 76 -2.489 9.120 -4.502 1.00 0.00 C ATOM 1225 CZ TYR B 76 -1.694 9.252 -5.620 1.00 0.00 C ATOM 1226 OH TYR B 76 -2.268 9.279 -6.871 1.00 0.00 O ATOM 0 H TYR B 76 2.440 8.204 -1.972 1.00 0.00 H new ATOM 0 HA TYR B 76 0.146 7.620 -0.238 1.00 0.00 H new ATOM 0 HB2 TYR B 76 -0.618 9.556 -1.009 1.00 0.00 H new ATOM 0 HB3 TYR B 76 0.962 9.807 -1.723 1.00 0.00 H new ATOM 0 HD1 TYR B 76 1.320 9.395 -4.137 1.00 0.00 H new ATOM 0 HD2 TYR B 76 -2.532 8.986 -2.374 1.00 0.00 H new ATOM 0 HE1 TYR B 76 0.297 9.452 -6.369 1.00 0.00 H new ATOM 0 HE2 TYR B 76 -3.561 9.042 -4.605 1.00 0.00 H new ATOM 0 HH TYR B 76 -2.145 8.410 -7.306 1.00 0.00 H new ATOM 1236 N ILE B 77 -1.140 6.047 -1.658 1.00 0.00 N ATOM 1237 CA ILE B 77 -1.771 4.953 -2.378 1.00 0.00 C ATOM 1238 C ILE B 77 -2.845 5.483 -3.319 1.00 0.00 C ATOM 1239 O ILE B 77 -2.846 5.182 -4.512 1.00 0.00 O ATOM 1240 CB ILE B 77 -2.407 3.933 -1.406 1.00 0.00 C ATOM 1241 CG1 ILE B 77 -1.339 3.281 -0.518 1.00 0.00 C ATOM 1242 CG2 ILE B 77 -3.183 2.876 -2.177 1.00 0.00 C ATOM 1243 CD1 ILE B 77 -0.313 2.469 -1.281 1.00 0.00 C ATOM 0 H ILE B 77 -1.605 6.303 -0.787 1.00 0.00 H new ATOM 0 HA ILE B 77 -0.994 4.451 -2.954 1.00 0.00 H new ATOM 0 HB ILE B 77 -3.102 4.468 -0.758 1.00 0.00 H new ATOM 0 HG12 ILE B 77 -0.825 4.060 0.045 1.00 0.00 H new ATOM 0 HG13 ILE B 77 -1.831 2.635 0.209 1.00 0.00 H new ATOM 0 HG21 ILE B 77 -3.624 2.166 -1.477 1.00 0.00 H new ATOM 0 HG22 ILE B 77 -3.973 3.354 -2.755 1.00 0.00 H new ATOM 0 HG23 ILE B 77 -2.508 2.349 -2.852 1.00 0.00 H new ATOM 0 HD11 ILE B 77 0.406 2.042 -0.582 1.00 0.00 H new ATOM 0 HD12 ILE B 77 -0.814 1.666 -1.822 1.00 0.00 H new ATOM 0 HD13 ILE B 77 0.208 3.114 -1.989 1.00 0.00 H new ATOM 1255 N ASN B 78 -3.757 6.266 -2.767 1.00 0.00 N ATOM 1256 CA ASN B 78 -4.842 6.852 -3.537 1.00 0.00 C ATOM 1257 C ASN B 78 -5.455 8.015 -2.766 1.00 0.00 C ATOM 1258 O ASN B 78 -4.869 8.490 -1.792 1.00 0.00 O ATOM 1259 CB ASN B 78 -5.905 5.796 -3.867 1.00 0.00 C ATOM 1260 CG ASN B 78 -6.325 4.974 -2.661 1.00 0.00 C ATOM 1261 OD1 ASN B 78 -6.283 5.442 -1.523 1.00 0.00 O ATOM 1262 ND2 ASN B 78 -6.737 3.740 -2.902 1.00 0.00 N ATOM 0 H ASN B 78 -3.767 6.513 -1.777 1.00 0.00 H new ATOM 0 HA ASN B 78 -4.442 7.229 -4.478 1.00 0.00 H new ATOM 0 HB2 ASN B 78 -6.782 6.291 -4.285 1.00 0.00 H new ATOM 0 HB3 ASN B 78 -5.518 5.128 -4.637 1.00 0.00 H new ATOM 0 HD21 ASN B 78 -7.034 3.142 -2.131 1.00 0.00 H new ATOM 0 HD22 ASN B 78 -6.758 3.387 -3.859 1.00 0.00 H new ATOM 1269 N GLY B 79 -6.623 8.471 -3.190 1.00 0.00 N ATOM 1270 CA GLY B 79 -7.291 9.553 -2.490 1.00 0.00 C ATOM 1271 C GLY B 79 -7.978 9.091 -1.217 1.00 0.00 C ATOM 1272 O GLY B 79 -8.592 9.891 -0.510 1.00 0.00 O ATOM 0 H GLY B 79 -7.122 8.113 -4.005 1.00 0.00 H new ATOM 0 HA2 GLY B 79 -6.563 10.326 -2.245 1.00 0.00 H new ATOM 0 HA3 GLY B 79 -8.028 10.008 -3.152 1.00 0.00 H new ATOM 1276 N LYS B 80 -7.868 7.803 -0.919 1.00 0.00 N ATOM 1277 CA LYS B 80 -8.506 7.237 0.258 1.00 0.00 C ATOM 1278 C LYS B 80 -7.538 7.267 1.425 1.00 0.00 C ATOM 1279 O LYS B 80 -7.911 7.594 2.553 1.00 0.00 O ATOM 1280 CB LYS B 80 -8.937 5.792 -0.007 1.00 0.00 C ATOM 1281 CG LYS B 80 -9.663 5.605 -1.326 1.00 0.00 C ATOM 1282 CD LYS B 80 -10.960 6.392 -1.363 1.00 0.00 C ATOM 1283 CE LYS B 80 -11.667 6.242 -2.699 1.00 0.00 C ATOM 1284 NZ LYS B 80 -12.925 7.034 -2.753 1.00 0.00 N ATOM 0 H LYS B 80 -7.342 7.131 -1.478 1.00 0.00 H new ATOM 0 HA LYS B 80 -9.389 7.830 0.495 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -8.056 5.151 0.007 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -9.585 5.461 0.805 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -9.019 5.924 -2.145 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -9.874 4.547 -1.480 1.00 0.00 H new ATOM 0 HD2 LYS B 80 -11.617 6.050 -0.563 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -10.752 7.446 -1.177 1.00 0.00 H new ATOM 0 HE2 LYS B 80 -11.001 6.563 -3.500 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -11.892 5.190 -2.874 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 -13.377 6.905 -3.681 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 -13.571 6.711 -2.005 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 -12.708 8.041 -2.611 1.00 0.00 H new ATOM 1298 N LEU B 81 -6.291 6.918 1.142 1.00 0.00 N ATOM 1299 CA LEU B 81 -5.261 6.879 2.165 1.00 0.00 C ATOM 1300 C LEU B 81 -3.862 6.971 1.568 1.00 0.00 C ATOM 1301 O LEU B 81 -3.631 6.621 0.405 1.00 0.00 O ATOM 1302 CB LEU B 81 -5.400 5.630 3.047 1.00 0.00 C ATOM 1303 CG LEU B 81 -5.784 4.327 2.335 1.00 0.00 C ATOM 1304 CD1 LEU B 81 -4.728 3.903 1.333 1.00 0.00 C ATOM 1305 CD2 LEU B 81 -6.001 3.234 3.357 1.00 0.00 C ATOM 0 H LEU B 81 -5.970 6.658 0.210 1.00 0.00 H new ATOM 0 HA LEU B 81 -5.404 7.757 2.795 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -4.453 5.470 3.563 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -6.149 5.834 3.812 1.00 0.00 H new ATOM 0 HG LEU B 81 -6.708 4.503 1.784 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -5.036 2.976 0.850 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -4.607 4.682 0.580 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -3.780 3.746 1.848 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -6.274 2.309 2.848 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -5.083 3.079 3.924 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -6.803 3.525 4.036 1.00 0.00 H new ATOM 1317 N SER B 82 -2.946 7.474 2.370 1.00 0.00 N ATOM 1318 CA SER B 82 -1.560 7.597 1.979 1.00 0.00 C ATOM 1319 C SER B 82 -0.668 7.080 3.108 1.00 0.00 C ATOM 1320 O SER B 82 -1.043 7.145 4.280 1.00 0.00 O ATOM 1321 CB SER B 82 -1.247 9.057 1.642 1.00 0.00 C ATOM 1322 OG SER B 82 0.129 9.255 1.395 1.00 0.00 O ATOM 0 H SER B 82 -3.144 7.809 3.313 1.00 0.00 H new ATOM 0 HA SER B 82 -1.367 6.998 1.089 1.00 0.00 H new ATOM 0 HB2 SER B 82 -1.821 9.359 0.766 1.00 0.00 H new ATOM 0 HB3 SER B 82 -1.564 9.696 2.466 1.00 0.00 H new ATOM 0 HG SER B 82 0.291 10.198 1.182 1.00 0.00 H new ATOM 1328 N ILE B 83 0.496 6.553 2.754 1.00 0.00 N ATOM 1329 CA ILE B 83 1.381 5.927 3.727 1.00 0.00 C ATOM 1330 C ILE B 83 2.687 6.713 3.864 1.00 0.00 C ATOM 1331 O ILE B 83 3.547 6.672 2.984 1.00 0.00 O ATOM 1332 CB ILE B 83 1.701 4.469 3.325 1.00 0.00 C ATOM 1333 CG1 ILE B 83 0.410 3.650 3.170 1.00 0.00 C ATOM 1334 CG2 ILE B 83 2.624 3.820 4.345 1.00 0.00 C ATOM 1335 CD1 ILE B 83 -0.434 3.572 4.428 1.00 0.00 C ATOM 0 H ILE B 83 0.850 6.547 1.798 1.00 0.00 H new ATOM 0 HA ILE B 83 0.863 5.927 4.686 1.00 0.00 H new ATOM 0 HB ILE B 83 2.212 4.488 2.362 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -0.189 4.086 2.371 1.00 0.00 H new ATOM 0 HG13 ILE B 83 0.670 2.639 2.858 1.00 0.00 H new ATOM 0 HG21 ILE B 83 2.836 2.794 4.043 1.00 0.00 H new ATOM 0 HG22 ILE B 83 3.556 4.382 4.402 1.00 0.00 H new ATOM 0 HG23 ILE B 83 2.142 3.818 5.323 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -1.326 2.976 4.232 1.00 0.00 H new ATOM 0 HD12 ILE B 83 0.145 3.107 5.226 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -0.728 4.577 4.731 1.00 0.00 H new ATOM 1347 N PRO B 84 2.850 7.450 4.971 1.00 0.00 N ATOM 1348 CA PRO B 84 4.056 8.233 5.219 1.00 0.00 C ATOM 1349 C PRO B 84 5.206 7.385 5.752 1.00 0.00 C ATOM 1350 O PRO B 84 5.020 6.542 6.634 1.00 0.00 O ATOM 1351 CB PRO B 84 3.606 9.245 6.267 1.00 0.00 C ATOM 1352 CG PRO B 84 2.508 8.565 7.015 1.00 0.00 C ATOM 1353 CD PRO B 84 1.867 7.587 6.060 1.00 0.00 C ATOM 0 HA PRO B 84 4.443 8.685 4.306 1.00 0.00 H new ATOM 0 HB2 PRO B 84 4.427 9.517 6.931 1.00 0.00 H new ATOM 0 HB3 PRO B 84 3.255 10.166 5.801 1.00 0.00 H new ATOM 0 HG2 PRO B 84 2.900 8.049 7.891 1.00 0.00 H new ATOM 0 HG3 PRO B 84 1.777 9.291 7.373 1.00 0.00 H new ATOM 0 HD2 PRO B 84 1.671 6.629 6.542 1.00 0.00 H new ATOM 0 HD3 PRO B 84 0.912 7.959 5.690 1.00 0.00 H new ATOM 1361 N LEU B 85 6.394 7.614 5.216 1.00 0.00 N ATOM 1362 CA LEU B 85 7.569 6.869 5.638 1.00 0.00 C ATOM 1363 C LEU B 85 8.385 7.693 6.620 1.00 0.00 C ATOM 1364 O LEU B 85 8.414 8.921 6.532 1.00 0.00 O ATOM 1365 CB LEU B 85 8.441 6.480 4.434 1.00 0.00 C ATOM 1366 CG LEU B 85 7.827 5.469 3.458 1.00 0.00 C ATOM 1367 CD1 LEU B 85 7.185 4.311 4.207 1.00 0.00 C ATOM 1368 CD2 LEU B 85 6.823 6.141 2.538 1.00 0.00 C ATOM 0 H LEU B 85 6.570 8.308 4.490 1.00 0.00 H new ATOM 0 HA LEU B 85 7.231 5.955 6.126 1.00 0.00 H new ATOM 0 HB2 LEU B 85 8.687 7.386 3.881 1.00 0.00 H new ATOM 0 HB3 LEU B 85 9.380 6.071 4.808 1.00 0.00 H new ATOM 0 HG LEU B 85 8.632 5.068 2.842 1.00 0.00 H new ATOM 0 HD11 LEU B 85 6.757 3.608 3.492 1.00 0.00 H new ATOM 0 HD12 LEU B 85 7.940 3.803 4.808 1.00 0.00 H new ATOM 0 HD13 LEU B 85 6.398 4.691 4.858 1.00 0.00 H new ATOM 0 HD21 LEU B 85 6.403 5.402 1.856 1.00 0.00 H new ATOM 0 HD22 LEU B 85 6.023 6.582 3.133 1.00 0.00 H new ATOM 0 HD23 LEU B 85 7.322 6.922 1.964 1.00 0.00 H new ATOM 1380 N PRO B 86 9.035 7.029 7.586 1.00 0.00 N ATOM 1381 CA PRO B 86 9.904 7.699 8.549 1.00 0.00 C ATOM 1382 C PRO B 86 11.088 8.369 7.866 1.00 0.00 C ATOM 1383 O PRO B 86 11.672 7.826 6.928 1.00 0.00 O ATOM 1384 CB PRO B 86 10.385 6.571 9.462 1.00 0.00 C ATOM 1385 CG PRO B 86 10.167 5.323 8.685 1.00 0.00 C ATOM 1386 CD PRO B 86 8.970 5.578 7.821 1.00 0.00 C ATOM 0 HA PRO B 86 9.383 8.492 9.085 1.00 0.00 H new ATOM 0 HB2 PRO B 86 11.436 6.695 9.721 1.00 0.00 H new ATOM 0 HB3 PRO B 86 9.826 6.556 10.397 1.00 0.00 H new ATOM 0 HG2 PRO B 86 11.041 5.083 8.080 1.00 0.00 H new ATOM 0 HG3 PRO B 86 9.996 4.475 9.348 1.00 0.00 H new ATOM 0 HD2 PRO B 86 9.018 5.016 6.889 1.00 0.00 H new ATOM 0 HD3 PRO B 86 8.044 5.291 8.319 1.00 0.00 H new ATOM 1394 N ARG B 87 11.451 9.539 8.362 1.00 0.00 N ATOM 1395 CA ARG B 87 12.492 10.346 7.741 1.00 0.00 C ATOM 1396 C ARG B 87 13.875 9.765 7.994 1.00 0.00 C ATOM 1397 O ARG B 87 14.861 10.236 7.426 1.00 0.00 O ATOM 1398 CB ARG B 87 12.445 11.795 8.244 1.00 0.00 C ATOM 1399 CG ARG B 87 11.330 12.638 7.640 1.00 0.00 C ATOM 1400 CD ARG B 87 9.954 12.217 8.133 1.00 0.00 C ATOM 1401 NE ARG B 87 8.889 12.993 7.500 1.00 0.00 N ATOM 1402 CZ ARG B 87 7.596 12.679 7.555 1.00 0.00 C ATOM 1403 NH1 ARG B 87 7.190 11.615 8.238 1.00 0.00 N ATOM 1404 NH2 ARG B 87 6.710 13.437 6.928 1.00 0.00 N ATOM 0 H ARG B 87 11.039 9.955 9.197 1.00 0.00 H new ATOM 0 HA ARG B 87 12.301 10.336 6.668 1.00 0.00 H new ATOM 0 HB2 ARG B 87 12.330 11.786 9.328 1.00 0.00 H new ATOM 0 HB3 ARG B 87 13.401 12.272 8.029 1.00 0.00 H new ATOM 0 HG2 ARG B 87 11.496 13.687 7.887 1.00 0.00 H new ATOM 0 HG3 ARG B 87 11.364 12.557 6.554 1.00 0.00 H new ATOM 0 HD2 ARG B 87 9.803 11.157 7.927 1.00 0.00 H new ATOM 0 HD3 ARG B 87 9.901 12.342 9.214 1.00 0.00 H new ATOM 0 HE ARG B 87 9.154 13.831 6.982 1.00 0.00 H new ATOM 0 HH11 ARG B 87 7.870 11.032 8.725 1.00 0.00 H new ATOM 0 HH12 ARG B 87 6.198 11.381 8.275 1.00 0.00 H new ATOM 0 HH21 ARG B 87 7.019 14.257 6.406 1.00 0.00 H new ATOM 0 HH22 ARG B 87 5.718 13.201 6.967 1.00 0.00 H new ATOM 1418 N ASP B 88 13.957 8.738 8.830 1.00 0.00 N ATOM 1419 CA ASP B 88 15.230 8.139 9.154 1.00 0.00 C ATOM 1420 C ASP B 88 15.569 7.024 8.171 1.00 0.00 C ATOM 1421 O ASP B 88 16.654 6.448 8.220 1.00 0.00 O ATOM 1422 CB ASP B 88 15.203 7.605 10.582 1.00 0.00 C ATOM 1423 CG ASP B 88 14.323 6.387 10.756 1.00 0.00 C ATOM 1424 OD1 ASP B 88 13.099 6.552 10.933 1.00 0.00 O ATOM 1425 OD2 ASP B 88 14.855 5.255 10.742 1.00 0.00 O ATOM 0 H ASP B 88 13.155 8.309 9.291 1.00 0.00 H new ATOM 0 HA ASP B 88 16.005 8.902 9.077 1.00 0.00 H new ATOM 0 HB2 ASP B 88 16.219 7.355 10.887 1.00 0.00 H new ATOM 0 HB3 ASP B 88 14.854 8.393 11.249 1.00 0.00 H new ATOM 1430 N ILE B 89 14.640 6.736 7.270 1.00 0.00 N ATOM 1431 CA ILE B 89 14.845 5.708 6.261 1.00 0.00 C ATOM 1432 C ILE B 89 14.938 6.337 4.876 1.00 0.00 C ATOM 1433 O ILE B 89 14.156 7.228 4.537 1.00 0.00 O ATOM 1434 CB ILE B 89 13.702 4.668 6.279 1.00 0.00 C ATOM 1435 CG1 ILE B 89 13.621 3.998 7.654 1.00 0.00 C ATOM 1436 CG2 ILE B 89 13.901 3.622 5.188 1.00 0.00 C ATOM 1437 CD1 ILE B 89 12.534 2.953 7.760 1.00 0.00 C ATOM 0 H ILE B 89 13.734 7.202 7.218 1.00 0.00 H new ATOM 0 HA ILE B 89 15.780 5.199 6.493 1.00 0.00 H new ATOM 0 HB ILE B 89 12.763 5.186 6.083 1.00 0.00 H new ATOM 0 HG12 ILE B 89 14.581 3.534 7.879 1.00 0.00 H new ATOM 0 HG13 ILE B 89 13.452 4.763 8.411 1.00 0.00 H new ATOM 0 HG21 ILE B 89 13.084 2.901 5.221 1.00 0.00 H new ATOM 0 HG22 ILE B 89 13.915 4.111 4.214 1.00 0.00 H new ATOM 0 HG23 ILE B 89 14.847 3.105 5.348 1.00 0.00 H new ATOM 0 HD11 ILE B 89 12.539 2.523 8.762 1.00 0.00 H new ATOM 0 HD12 ILE B 89 11.565 3.415 7.568 1.00 0.00 H new ATOM 0 HD13 ILE B 89 12.713 2.166 7.027 1.00 0.00 H new ATOM 1449 N VAL B 90 15.904 5.889 4.089 1.00 0.00 N ATOM 1450 CA VAL B 90 16.067 6.379 2.728 1.00 0.00 C ATOM 1451 C VAL B 90 15.202 5.563 1.766 1.00 0.00 C ATOM 1452 O VAL B 90 15.389 4.355 1.604 1.00 0.00 O ATOM 1453 CB VAL B 90 17.553 6.360 2.285 1.00 0.00 C ATOM 1454 CG1 VAL B 90 18.178 4.986 2.485 1.00 0.00 C ATOM 1455 CG2 VAL B 90 17.689 6.809 0.838 1.00 0.00 C ATOM 0 H VAL B 90 16.588 5.186 4.369 1.00 0.00 H new ATOM 0 HA VAL B 90 15.737 7.417 2.704 1.00 0.00 H new ATOM 0 HB VAL B 90 18.095 7.064 2.917 1.00 0.00 H new ATOM 0 HG11 VAL B 90 19.219 5.010 2.164 1.00 0.00 H new ATOM 0 HG12 VAL B 90 18.129 4.714 3.539 1.00 0.00 H new ATOM 0 HG13 VAL B 90 17.633 4.249 1.895 1.00 0.00 H new ATOM 0 HG21 VAL B 90 18.739 6.788 0.548 1.00 0.00 H new ATOM 0 HG22 VAL B 90 17.121 6.138 0.194 1.00 0.00 H new ATOM 0 HG23 VAL B 90 17.304 7.823 0.734 1.00 0.00 H new ATOM 1465 N VAL B 91 14.240 6.227 1.146 1.00 0.00 N ATOM 1466 CA VAL B 91 13.269 5.554 0.296 1.00 0.00 C ATOM 1467 C VAL B 91 13.293 6.116 -1.118 1.00 0.00 C ATOM 1468 O VAL B 91 13.315 7.327 -1.323 1.00 0.00 O ATOM 1469 CB VAL B 91 11.843 5.690 0.878 1.00 0.00 C ATOM 1470 CG1 VAL B 91 10.832 4.947 0.025 1.00 0.00 C ATOM 1471 CG2 VAL B 91 11.794 5.198 2.317 1.00 0.00 C ATOM 0 H VAL B 91 14.110 7.236 1.216 1.00 0.00 H new ATOM 0 HA VAL B 91 13.543 4.500 0.260 1.00 0.00 H new ATOM 0 HB VAL B 91 11.580 6.748 0.870 1.00 0.00 H new ATOM 0 HG11 VAL B 91 9.838 5.060 0.458 1.00 0.00 H new ATOM 0 HG12 VAL B 91 10.837 5.357 -0.985 1.00 0.00 H new ATOM 0 HG13 VAL B 91 11.094 3.890 -0.012 1.00 0.00 H new ATOM 0 HG21 VAL B 91 10.780 5.304 2.704 1.00 0.00 H new ATOM 0 HG22 VAL B 91 12.088 4.149 2.353 1.00 0.00 H new ATOM 0 HG23 VAL B 91 12.478 5.788 2.927 1.00 0.00 H new ATOM 1481 N ASN B 92 13.307 5.214 -2.085 1.00 0.00 N ATOM 1482 CA ASN B 92 13.286 5.573 -3.494 1.00 0.00 C ATOM 1483 C ASN B 92 12.408 4.595 -4.255 1.00 0.00 C ATOM 1484 O ASN B 92 12.178 3.476 -3.800 1.00 0.00 O ATOM 1485 CB ASN B 92 14.698 5.567 -4.087 1.00 0.00 C ATOM 1486 CG ASN B 92 15.690 4.770 -3.265 1.00 0.00 C ATOM 1487 OD1 ASN B 92 16.474 5.330 -2.498 1.00 0.00 O ATOM 1488 ND2 ASN B 92 15.621 3.458 -3.369 1.00 0.00 N ATOM 0 H ASN B 92 13.333 4.209 -1.915 1.00 0.00 H new ATOM 0 HA ASN B 92 12.882 6.581 -3.585 1.00 0.00 H new ATOM 0 HB2 ASN B 92 14.659 5.156 -5.096 1.00 0.00 H new ATOM 0 HB3 ASN B 92 15.052 6.594 -4.175 1.00 0.00 H new ATOM 0 HD21 ASN B 92 16.231 2.869 -2.802 1.00 0.00 H new ATOM 0 HD22 ASN B 92 14.958 3.032 -4.016 1.00 0.00 H new ATOM 1495 N ALA B 93 11.949 5.017 -5.429 1.00 0.00 N ATOM 1496 CA ALA B 93 11.014 4.237 -6.241 1.00 0.00 C ATOM 1497 C ALA B 93 11.629 2.927 -6.713 1.00 0.00 C ATOM 1498 O ALA B 93 10.921 2.019 -7.143 1.00 0.00 O ATOM 1499 CB ALA B 93 10.560 5.055 -7.438 1.00 0.00 C ATOM 0 H ALA B 93 12.213 5.909 -5.847 1.00 0.00 H new ATOM 0 HA ALA B 93 10.156 3.994 -5.615 1.00 0.00 H new ATOM 0 HB1 ALA B 93 9.864 4.468 -8.037 1.00 0.00 H new ATOM 0 HB2 ALA B 93 10.064 5.962 -7.092 1.00 0.00 H new ATOM 0 HB3 ALA B 93 11.425 5.323 -8.045 1.00 0.00 H new ATOM 1505 N ALA B 94 12.945 2.844 -6.635 1.00 0.00 N ATOM 1506 CA ALA B 94 13.662 1.639 -7.030 1.00 0.00 C ATOM 1507 C ALA B 94 13.708 0.632 -5.889 1.00 0.00 C ATOM 1508 O ALA B 94 14.033 -0.536 -6.089 1.00 0.00 O ATOM 1509 CB ALA B 94 15.070 1.992 -7.472 1.00 0.00 C ATOM 0 H ALA B 94 13.544 3.599 -6.300 1.00 0.00 H new ATOM 0 HA ALA B 94 13.129 1.183 -7.864 1.00 0.00 H new ATOM 0 HB1 ALA B 94 15.598 1.084 -7.765 1.00 0.00 H new ATOM 0 HB2 ALA B 94 15.025 2.675 -8.320 1.00 0.00 H new ATOM 0 HB3 ALA B 94 15.601 2.470 -6.649 1.00 0.00 H new ATOM 1515 N ASP B 95 13.380 1.092 -4.692 1.00 0.00 N ATOM 1516 CA ASP B 95 13.435 0.250 -3.505 1.00 0.00 C ATOM 1517 C ASP B 95 12.024 -0.063 -3.023 1.00 0.00 C ATOM 1518 O ASP B 95 11.790 -1.048 -2.328 1.00 0.00 O ATOM 1519 CB ASP B 95 14.233 0.964 -2.416 1.00 0.00 C ATOM 1520 CG ASP B 95 14.539 0.093 -1.223 1.00 0.00 C ATOM 1521 OD1 ASP B 95 14.961 -1.067 -1.416 1.00 0.00 O ATOM 1522 OD2 ASP B 95 14.414 0.588 -0.087 1.00 0.00 O ATOM 0 H ASP B 95 13.071 2.048 -4.515 1.00 0.00 H new ATOM 0 HA ASP B 95 13.929 -0.691 -3.745 1.00 0.00 H new ATOM 0 HB2 ASP B 95 15.169 1.326 -2.841 1.00 0.00 H new ATOM 0 HB3 ASP B 95 13.675 1.839 -2.083 1.00 0.00 H new ATOM 1527 N ILE B 96 11.094 0.793 -3.416 1.00 0.00 N ATOM 1528 CA ILE B 96 9.684 0.612 -3.121 1.00 0.00 C ATOM 1529 C ILE B 96 9.107 -0.534 -3.942 1.00 0.00 C ATOM 1530 O ILE B 96 9.100 -0.489 -5.174 1.00 0.00 O ATOM 1531 CB ILE B 96 8.918 1.909 -3.435 1.00 0.00 C ATOM 1532 CG1 ILE B 96 9.352 3.015 -2.484 1.00 0.00 C ATOM 1533 CG2 ILE B 96 7.414 1.698 -3.354 1.00 0.00 C ATOM 1534 CD1 ILE B 96 8.929 4.386 -2.941 1.00 0.00 C ATOM 0 H ILE B 96 11.299 1.637 -3.951 1.00 0.00 H new ATOM 0 HA ILE B 96 9.578 0.371 -2.063 1.00 0.00 H new ATOM 0 HB ILE B 96 9.156 2.204 -4.457 1.00 0.00 H new ATOM 0 HG12 ILE B 96 8.933 2.822 -1.496 1.00 0.00 H new ATOM 0 HG13 ILE B 96 10.437 2.992 -2.380 1.00 0.00 H new ATOM 0 HG21 ILE B 96 6.903 2.633 -3.581 1.00 0.00 H new ATOM 0 HG22 ILE B 96 7.114 0.936 -4.074 1.00 0.00 H new ATOM 0 HG23 ILE B 96 7.146 1.373 -2.349 1.00 0.00 H new ATOM 0 HD11 ILE B 96 9.268 5.130 -2.221 1.00 0.00 H new ATOM 0 HD12 ILE B 96 9.370 4.597 -3.915 1.00 0.00 H new ATOM 0 HD13 ILE B 96 7.842 4.425 -3.018 1.00 0.00 H new ATOM 1546 N LYS B 97 8.646 -1.564 -3.255 1.00 0.00 N ATOM 1547 CA LYS B 97 8.065 -2.724 -3.906 1.00 0.00 C ATOM 1548 C LYS B 97 6.572 -2.792 -3.598 1.00 0.00 C ATOM 1549 O LYS B 97 6.178 -3.141 -2.483 1.00 0.00 O ATOM 1550 CB LYS B 97 8.757 -4.002 -3.419 1.00 0.00 C ATOM 1551 CG LYS B 97 10.275 -3.896 -3.325 1.00 0.00 C ATOM 1552 CD LYS B 97 10.907 -3.537 -4.664 1.00 0.00 C ATOM 1553 CE LYS B 97 10.630 -4.596 -5.718 1.00 0.00 C ATOM 1554 NZ LYS B 97 11.192 -4.221 -7.040 1.00 0.00 N ATOM 0 H LYS B 97 8.664 -1.620 -2.237 1.00 0.00 H new ATOM 0 HA LYS B 97 8.206 -2.636 -4.983 1.00 0.00 H new ATOM 0 HB2 LYS B 97 8.361 -4.264 -2.438 1.00 0.00 H new ATOM 0 HB3 LYS B 97 8.503 -4.819 -4.094 1.00 0.00 H new ATOM 0 HG2 LYS B 97 10.540 -3.141 -2.585 1.00 0.00 H new ATOM 0 HG3 LYS B 97 10.683 -4.844 -2.974 1.00 0.00 H new ATOM 0 HD2 LYS B 97 10.520 -2.576 -5.003 1.00 0.00 H new ATOM 0 HD3 LYS B 97 11.984 -3.421 -4.539 1.00 0.00 H new ATOM 0 HE2 LYS B 97 11.057 -5.547 -5.398 1.00 0.00 H new ATOM 0 HE3 LYS B 97 9.554 -4.744 -5.810 1.00 0.00 H new ATOM 0 HZ1 LYS B 97 10.982 -4.969 -7.731 1.00 0.00 H new ATOM 0 HZ2 LYS B 97 10.766 -3.327 -7.357 1.00 0.00 H new ATOM 0 HZ3 LYS B 97 12.222 -4.104 -6.959 1.00 0.00 H new ATOM 1568 N ILE B 98 5.746 -2.436 -4.574 1.00 0.00 N ATOM 1569 CA ILE B 98 4.303 -2.409 -4.377 1.00 0.00 C ATOM 1570 C ILE B 98 3.614 -3.540 -5.136 1.00 0.00 C ATOM 1571 O ILE B 98 3.661 -3.605 -6.369 1.00 0.00 O ATOM 1572 CB ILE B 98 3.707 -1.058 -4.819 1.00 0.00 C ATOM 1573 CG1 ILE B 98 4.373 0.079 -4.049 1.00 0.00 C ATOM 1574 CG2 ILE B 98 2.203 -1.032 -4.603 1.00 0.00 C ATOM 1575 CD1 ILE B 98 3.822 1.441 -4.388 1.00 0.00 C ATOM 0 H ILE B 98 6.050 -2.162 -5.508 1.00 0.00 H new ATOM 0 HA ILE B 98 4.126 -2.545 -3.310 1.00 0.00 H new ATOM 0 HB ILE B 98 3.897 -0.927 -5.884 1.00 0.00 H new ATOM 0 HG12 ILE B 98 4.252 -0.097 -2.980 1.00 0.00 H new ATOM 0 HG13 ILE B 98 5.443 0.068 -4.254 1.00 0.00 H new ATOM 0 HG21 ILE B 98 1.806 -0.068 -4.922 1.00 0.00 H new ATOM 0 HG22 ILE B 98 1.738 -1.827 -5.186 1.00 0.00 H new ATOM 0 HG23 ILE B 98 1.985 -1.182 -3.546 1.00 0.00 H new ATOM 0 HD11 ILE B 98 4.342 2.200 -3.803 1.00 0.00 H new ATOM 0 HD12 ILE B 98 3.968 1.638 -5.450 1.00 0.00 H new ATOM 0 HD13 ILE B 98 2.757 1.471 -4.156 1.00 0.00 H new ATOM 1587 N PHE B 99 2.963 -4.419 -4.390 1.00 0.00 N ATOM 1588 CA PHE B 99 2.279 -5.560 -4.970 1.00 0.00 C ATOM 1589 C PHE B 99 0.844 -5.620 -4.485 1.00 0.00 C ATOM 1590 O PHE B 99 0.587 -5.695 -3.288 1.00 0.00 O ATOM 1591 CB PHE B 99 2.978 -6.869 -4.598 1.00 0.00 C ATOM 1592 CG PHE B 99 4.388 -6.986 -5.094 1.00 0.00 C ATOM 1593 CD1 PHE B 99 4.657 -7.527 -6.339 1.00 0.00 C ATOM 1594 CD2 PHE B 99 5.444 -6.564 -4.310 1.00 0.00 C ATOM 1595 CE1 PHE B 99 5.953 -7.638 -6.797 1.00 0.00 C ATOM 1596 CE2 PHE B 99 6.741 -6.673 -4.762 1.00 0.00 C ATOM 1597 CZ PHE B 99 6.997 -7.210 -6.006 1.00 0.00 C ATOM 0 H PHE B 99 2.895 -4.361 -3.374 1.00 0.00 H new ATOM 0 HA PHE B 99 2.300 -5.437 -6.053 1.00 0.00 H new ATOM 0 HB2 PHE B 99 2.979 -6.969 -3.513 1.00 0.00 H new ATOM 0 HB3 PHE B 99 2.397 -7.701 -4.995 1.00 0.00 H new ATOM 0 HD1 PHE B 99 3.841 -7.867 -6.960 1.00 0.00 H new ATOM 0 HD2 PHE B 99 5.251 -6.145 -3.334 1.00 0.00 H new ATOM 0 HE1 PHE B 99 6.149 -8.059 -7.772 1.00 0.00 H new ATOM 0 HE2 PHE B 99 7.558 -6.337 -4.141 1.00 0.00 H new ATOM 0 HZ PHE B 99 8.014 -7.295 -6.360 1.00 0.00 H new ATOM 1607 N HIS B 100 -0.089 -5.593 -5.408 1.00 0.00 N ATOM 1608 CA HIS B 100 -1.495 -5.709 -5.056 1.00 0.00 C ATOM 1609 C HIS B 100 -2.010 -7.093 -5.407 1.00 0.00 C ATOM 1610 O HIS B 100 -1.927 -7.522 -6.552 1.00 0.00 O ATOM 1611 CB HIS B 100 -2.351 -4.647 -5.761 1.00 0.00 C ATOM 1612 CG HIS B 100 -3.823 -4.825 -5.519 1.00 0.00 C ATOM 1613 ND1 HIS B 100 -4.671 -5.421 -6.431 1.00 0.00 N ATOM 1614 CD2 HIS B 100 -4.588 -4.518 -4.445 1.00 0.00 C ATOM 1615 CE1 HIS B 100 -5.886 -5.478 -5.926 1.00 0.00 C ATOM 1616 NE2 HIS B 100 -5.864 -4.936 -4.723 1.00 0.00 N ATOM 0 H HIS B 100 0.094 -5.492 -6.406 1.00 0.00 H new ATOM 0 HA HIS B 100 -1.576 -5.547 -3.981 1.00 0.00 H new ATOM 0 HB2 HIS B 100 -2.049 -3.658 -5.417 1.00 0.00 H new ATOM 0 HB3 HIS B 100 -2.157 -4.685 -6.833 1.00 0.00 H new ATOM 0 HD2 HIS B 100 -4.255 -4.034 -3.539 1.00 0.00 H new ATOM 0 HE1 HIS B 100 -6.754 -5.897 -6.414 1.00 0.00 H new ATOM 0 HE2 HIS B 100 -6.667 -4.843 -4.100 1.00 0.00 H new ATOM 1625 N ILE B 101 -2.540 -7.787 -4.424 1.00 0.00 N ATOM 1626 CA ILE B 101 -3.154 -9.074 -4.664 1.00 0.00 C ATOM 1627 C ILE B 101 -4.665 -8.917 -4.753 1.00 0.00 C ATOM 1628 O ILE B 101 -5.313 -8.447 -3.817 1.00 0.00 O ATOM 1629 CB ILE B 101 -2.800 -10.087 -3.566 1.00 0.00 C ATOM 1630 CG1 ILE B 101 -1.285 -10.263 -3.486 1.00 0.00 C ATOM 1631 CG2 ILE B 101 -3.477 -11.420 -3.842 1.00 0.00 C ATOM 1632 CD1 ILE B 101 -0.852 -11.288 -2.468 1.00 0.00 C ATOM 0 H ILE B 101 -2.558 -7.482 -3.451 1.00 0.00 H new ATOM 0 HA ILE B 101 -2.766 -9.457 -5.608 1.00 0.00 H new ATOM 0 HB ILE B 101 -3.159 -9.710 -2.608 1.00 0.00 H new ATOM 0 HG12 ILE B 101 -0.909 -10.555 -4.467 1.00 0.00 H new ATOM 0 HG13 ILE B 101 -0.828 -9.304 -3.242 1.00 0.00 H new ATOM 0 HG21 ILE B 101 -3.218 -12.129 -3.056 1.00 0.00 H new ATOM 0 HG22 ILE B 101 -4.558 -11.281 -3.864 1.00 0.00 H new ATOM 0 HG23 ILE B 101 -3.141 -11.806 -4.804 1.00 0.00 H new ATOM 0 HD11 ILE B 101 0.236 -11.361 -2.465 1.00 0.00 H new ATOM 0 HD12 ILE B 101 -1.198 -10.987 -1.479 1.00 0.00 H new ATOM 0 HD13 ILE B 101 -1.280 -12.257 -2.723 1.00 0.00 H new ATOM 1644 N ARG B 102 -5.211 -9.303 -5.891 1.00 0.00 N ATOM 1645 CA ARG B 102 -6.633 -9.144 -6.165 1.00 0.00 C ATOM 1646 C ARG B 102 -7.471 -10.178 -5.421 1.00 0.00 C ATOM 1647 O ARG B 102 -8.568 -9.875 -4.962 1.00 0.00 O ATOM 1648 CB ARG B 102 -6.891 -9.225 -7.672 1.00 0.00 C ATOM 1649 CG ARG B 102 -6.079 -10.305 -8.369 1.00 0.00 C ATOM 1650 CD ARG B 102 -6.323 -10.319 -9.866 1.00 0.00 C ATOM 1651 NE ARG B 102 -5.339 -11.144 -10.567 1.00 0.00 N ATOM 1652 CZ ARG B 102 -4.597 -10.709 -11.587 1.00 0.00 C ATOM 1653 NH1 ARG B 102 -4.743 -9.468 -12.040 1.00 0.00 N ATOM 1654 NH2 ARG B 102 -3.709 -11.515 -12.154 1.00 0.00 N ATOM 0 H ARG B 102 -4.686 -9.735 -6.651 1.00 0.00 H new ATOM 0 HA ARG B 102 -6.935 -8.161 -5.804 1.00 0.00 H new ATOM 0 HB2 ARG B 102 -7.951 -9.412 -7.842 1.00 0.00 H new ATOM 0 HB3 ARG B 102 -6.662 -8.260 -8.124 1.00 0.00 H new ATOM 0 HG2 ARG B 102 -5.019 -10.143 -8.176 1.00 0.00 H new ATOM 0 HG3 ARG B 102 -6.335 -11.278 -7.950 1.00 0.00 H new ATOM 0 HD2 ARG B 102 -7.325 -10.697 -10.068 1.00 0.00 H new ATOM 0 HD3 ARG B 102 -6.284 -9.300 -10.251 1.00 0.00 H new ATOM 0 HE ARG B 102 -5.213 -12.108 -10.258 1.00 0.00 H new ATOM 0 HH11 ARG B 102 -5.424 -8.844 -11.608 1.00 0.00 H new ATOM 0 HH12 ARG B 102 -4.174 -9.140 -12.820 1.00 0.00 H new ATOM 0 HH21 ARG B 102 -3.593 -12.468 -11.810 1.00 0.00 H new ATOM 0 HH22 ARG B 102 -3.142 -11.181 -12.934 1.00 0.00 H new ATOM 1668 N LYS B 103 -6.946 -11.390 -5.288 1.00 0.00 N ATOM 1669 CA LYS B 103 -7.665 -12.456 -4.600 1.00 0.00 C ATOM 1670 C LYS B 103 -7.691 -12.200 -3.097 1.00 0.00 C ATOM 1671 O LYS B 103 -8.712 -12.386 -2.439 1.00 0.00 O ATOM 1672 CB LYS B 103 -7.010 -13.808 -4.886 1.00 0.00 C ATOM 1673 CG LYS B 103 -7.778 -14.989 -4.312 1.00 0.00 C ATOM 1674 CD LYS B 103 -7.078 -16.305 -4.602 1.00 0.00 C ATOM 1675 CE LYS B 103 -5.787 -16.442 -3.814 1.00 0.00 C ATOM 1676 NZ LYS B 103 -5.054 -17.683 -4.166 1.00 0.00 N ATOM 0 H LYS B 103 -6.029 -11.659 -5.646 1.00 0.00 H new ATOM 0 HA LYS B 103 -8.690 -12.473 -4.970 1.00 0.00 H new ATOM 0 HB2 LYS B 103 -6.916 -13.936 -5.964 1.00 0.00 H new ATOM 0 HB3 LYS B 103 -6.000 -13.807 -4.475 1.00 0.00 H new ATOM 0 HG2 LYS B 103 -7.887 -14.864 -3.235 1.00 0.00 H new ATOM 0 HG3 LYS B 103 -8.783 -15.010 -4.734 1.00 0.00 H new ATOM 0 HD2 LYS B 103 -7.743 -17.133 -4.356 1.00 0.00 H new ATOM 0 HD3 LYS B 103 -6.862 -16.375 -5.668 1.00 0.00 H new ATOM 0 HE2 LYS B 103 -5.151 -15.578 -4.006 1.00 0.00 H new ATOM 0 HE3 LYS B 103 -6.011 -16.443 -2.747 1.00 0.00 H new ATOM 0 HZ1 LYS B 103 -4.638 -18.096 -3.307 1.00 0.00 H new ATOM 0 HZ2 LYS B 103 -5.712 -18.365 -4.595 1.00 0.00 H new ATOM 0 HZ3 LYS B 103 -4.297 -17.459 -4.843 1.00 0.00 H new ATOM 1690 N GLU B 104 -6.564 -11.749 -2.570 1.00 0.00 N ATOM 1691 CA GLU B 104 -6.430 -11.479 -1.146 1.00 0.00 C ATOM 1692 C GLU B 104 -7.024 -10.115 -0.805 1.00 0.00 C ATOM 1693 O GLU B 104 -7.189 -9.769 0.363 1.00 0.00 O ATOM 1694 CB GLU B 104 -4.950 -11.521 -0.746 1.00 0.00 C ATOM 1695 CG GLU B 104 -4.709 -11.544 0.752 1.00 0.00 C ATOM 1696 CD GLU B 104 -5.237 -12.802 1.394 1.00 0.00 C ATOM 1697 OE1 GLU B 104 -4.552 -13.840 1.308 1.00 0.00 O ATOM 1698 OE2 GLU B 104 -6.346 -12.768 1.963 1.00 0.00 O ATOM 0 H GLU B 104 -5.721 -11.561 -3.112 1.00 0.00 H new ATOM 0 HA GLU B 104 -6.973 -12.244 -0.591 1.00 0.00 H new ATOM 0 HB2 GLU B 104 -4.491 -12.404 -1.190 1.00 0.00 H new ATOM 0 HB3 GLU B 104 -4.446 -10.652 -1.170 1.00 0.00 H new ATOM 0 HG2 GLU B 104 -3.640 -11.459 0.948 1.00 0.00 H new ATOM 0 HG3 GLU B 104 -5.186 -10.677 1.209 1.00 0.00 H new ATOM 1705 N ARG B 105 -7.333 -9.344 -1.854 1.00 0.00 N ATOM 1706 CA ARG B 105 -7.873 -7.992 -1.706 1.00 0.00 C ATOM 1707 C ARG B 105 -6.903 -7.124 -0.911 1.00 0.00 C ATOM 1708 O ARG B 105 -7.309 -6.175 -0.238 1.00 0.00 O ATOM 1709 CB ARG B 105 -9.238 -8.022 -1.004 1.00 0.00 C ATOM 1710 CG ARG B 105 -10.264 -8.926 -1.671 1.00 0.00 C ATOM 1711 CD ARG B 105 -10.634 -8.433 -3.061 1.00 0.00 C ATOM 1712 NE ARG B 105 -11.234 -7.101 -3.032 1.00 0.00 N ATOM 1713 CZ ARG B 105 -11.555 -6.404 -4.121 1.00 0.00 C ATOM 1714 NH1 ARG B 105 -11.371 -6.928 -5.327 1.00 0.00 N ATOM 1715 NH2 ARG B 105 -12.083 -5.192 -4.002 1.00 0.00 N ATOM 0 H ARG B 105 -7.216 -9.640 -2.823 1.00 0.00 H new ATOM 0 HA ARG B 105 -8.004 -7.567 -2.701 1.00 0.00 H new ATOM 0 HB2 ARG B 105 -9.097 -8.350 0.026 1.00 0.00 H new ATOM 0 HB3 ARG B 105 -9.636 -7.008 -0.964 1.00 0.00 H new ATOM 0 HG2 ARG B 105 -9.866 -9.939 -1.739 1.00 0.00 H new ATOM 0 HG3 ARG B 105 -11.160 -8.976 -1.053 1.00 0.00 H new ATOM 0 HD2 ARG B 105 -9.742 -8.414 -3.688 1.00 0.00 H new ATOM 0 HD3 ARG B 105 -11.331 -9.134 -3.520 1.00 0.00 H new ATOM 0 HE ARG B 105 -11.418 -6.679 -2.122 1.00 0.00 H new ATOM 0 HH11 ARG B 105 -10.983 -7.867 -5.421 1.00 0.00 H new ATOM 0 HH12 ARG B 105 -11.618 -6.392 -6.159 1.00 0.00 H new ATOM 0 HH21 ARG B 105 -12.243 -4.794 -3.077 1.00 0.00 H new ATOM 0 HH22 ARG B 105 -12.329 -4.659 -4.836 1.00 0.00 H new ATOM 1729 N THR B 106 -5.617 -7.435 -1.018 1.00 0.00 N ATOM 1730 CA THR B 106 -4.624 -6.851 -0.138 1.00 0.00 C ATOM 1731 C THR B 106 -3.481 -6.217 -0.924 1.00 0.00 C ATOM 1732 O THR B 106 -3.039 -6.752 -1.941 1.00 0.00 O ATOM 1733 CB THR B 106 -4.071 -7.923 0.825 1.00 0.00 C ATOM 1734 OG1 THR B 106 -5.143 -8.487 1.592 1.00 0.00 O ATOM 1735 CG2 THR B 106 -3.033 -7.337 1.767 1.00 0.00 C ATOM 0 H THR B 106 -5.242 -8.088 -1.706 1.00 0.00 H new ATOM 0 HA THR B 106 -5.112 -6.064 0.437 1.00 0.00 H new ATOM 0 HB THR B 106 -3.594 -8.698 0.226 1.00 0.00 H new ATOM 0 HG1 THR B 106 -5.822 -8.851 0.987 1.00 0.00 H new ATOM 0 HG21 THR B 106 -2.663 -8.118 2.432 1.00 0.00 H new ATOM 0 HG22 THR B 106 -2.204 -6.931 1.188 1.00 0.00 H new ATOM 0 HG23 THR B 106 -3.486 -6.541 2.358 1.00 0.00 H new ATOM 1743 N LEU B 107 -3.028 -5.065 -0.458 1.00 0.00 N ATOM 1744 CA LEU B 107 -1.912 -4.372 -1.069 1.00 0.00 C ATOM 1745 C LEU B 107 -0.690 -4.466 -0.155 1.00 0.00 C ATOM 1746 O LEU B 107 -0.733 -4.038 1.000 1.00 0.00 O ATOM 1747 CB LEU B 107 -2.280 -2.905 -1.315 1.00 0.00 C ATOM 1748 CG LEU B 107 -1.841 -2.325 -2.661 1.00 0.00 C ATOM 1749 CD1 LEU B 107 -2.225 -0.860 -2.756 1.00 0.00 C ATOM 1750 CD2 LEU B 107 -0.346 -2.488 -2.862 1.00 0.00 C ATOM 0 H LEU B 107 -3.424 -4.587 0.352 1.00 0.00 H new ATOM 0 HA LEU B 107 -1.677 -4.837 -2.026 1.00 0.00 H new ATOM 0 HB2 LEU B 107 -3.362 -2.803 -1.232 1.00 0.00 H new ATOM 0 HB3 LEU B 107 -1.841 -2.302 -0.520 1.00 0.00 H new ATOM 0 HG LEU B 107 -2.354 -2.876 -3.449 1.00 0.00 H new ATOM 0 HD11 LEU B 107 -1.906 -0.462 -3.719 1.00 0.00 H new ATOM 0 HD12 LEU B 107 -3.306 -0.761 -2.663 1.00 0.00 H new ATOM 0 HD13 LEU B 107 -1.739 -0.304 -1.955 1.00 0.00 H new ATOM 0 HD21 LEU B 107 -0.061 -2.067 -3.826 1.00 0.00 H new ATOM 0 HD22 LEU B 107 0.187 -1.967 -2.067 1.00 0.00 H new ATOM 0 HD23 LEU B 107 -0.089 -3.547 -2.838 1.00 0.00 H new ATOM 1762 N TYR B 108 0.380 -5.046 -0.672 1.00 0.00 N ATOM 1763 CA TYR B 108 1.610 -5.228 0.087 1.00 0.00 C ATOM 1764 C TYR B 108 2.642 -4.176 -0.299 1.00 0.00 C ATOM 1765 O TYR B 108 2.969 -4.016 -1.478 1.00 0.00 O ATOM 1766 CB TYR B 108 2.188 -6.623 -0.161 1.00 0.00 C ATOM 1767 CG TYR B 108 1.278 -7.752 0.263 1.00 0.00 C ATOM 1768 CD1 TYR B 108 0.127 -8.044 -0.452 1.00 0.00 C ATOM 1769 CD2 TYR B 108 1.572 -8.527 1.378 1.00 0.00 C ATOM 1770 CE1 TYR B 108 -0.706 -9.070 -0.072 1.00 0.00 C ATOM 1771 CE2 TYR B 108 0.740 -9.560 1.765 1.00 0.00 C ATOM 1772 CZ TYR B 108 -0.399 -9.827 1.036 1.00 0.00 C ATOM 1773 OH TYR B 108 -1.231 -10.855 1.414 1.00 0.00 O ATOM 0 H TYR B 108 0.423 -5.404 -1.626 1.00 0.00 H new ATOM 0 HA TYR B 108 1.372 -5.119 1.145 1.00 0.00 H new ATOM 0 HB2 TYR B 108 2.410 -6.729 -1.223 1.00 0.00 H new ATOM 0 HB3 TYR B 108 3.134 -6.713 0.373 1.00 0.00 H new ATOM 0 HD1 TYR B 108 -0.120 -7.455 -1.323 1.00 0.00 H new ATOM 0 HD2 TYR B 108 2.464 -8.319 1.951 1.00 0.00 H new ATOM 0 HE1 TYR B 108 -1.599 -9.281 -0.641 1.00 0.00 H new ATOM 0 HE2 TYR B 108 0.981 -10.155 2.634 1.00 0.00 H new ATOM 0 HH TYR B 108 -1.309 -10.870 2.391 1.00 0.00 H new ATOM 1783 N ILE B 109 3.137 -3.460 0.696 1.00 0.00 N ATOM 1784 CA ILE B 109 4.174 -2.461 0.490 1.00 0.00 C ATOM 1785 C ILE B 109 5.464 -2.895 1.177 1.00 0.00 C ATOM 1786 O ILE B 109 5.498 -3.044 2.401 1.00 0.00 O ATOM 1787 CB ILE B 109 3.748 -1.089 1.061 1.00 0.00 C ATOM 1788 CG1 ILE B 109 2.396 -0.653 0.485 1.00 0.00 C ATOM 1789 CG2 ILE B 109 4.811 -0.033 0.788 1.00 0.00 C ATOM 1790 CD1 ILE B 109 2.393 -0.484 -1.017 1.00 0.00 C ATOM 0 H ILE B 109 2.834 -3.553 1.665 1.00 0.00 H new ATOM 0 HA ILE B 109 4.333 -2.367 -0.584 1.00 0.00 H new ATOM 0 HB ILE B 109 3.641 -1.194 2.141 1.00 0.00 H new ATOM 0 HG12 ILE B 109 1.641 -1.390 0.759 1.00 0.00 H new ATOM 0 HG13 ILE B 109 2.103 0.290 0.947 1.00 0.00 H new ATOM 0 HG21 ILE B 109 4.488 0.923 1.199 1.00 0.00 H new ATOM 0 HG22 ILE B 109 5.749 -0.331 1.256 1.00 0.00 H new ATOM 0 HG23 ILE B 109 4.958 0.066 -0.288 1.00 0.00 H new ATOM 0 HD11 ILE B 109 1.401 -0.175 -1.346 1.00 0.00 H new ATOM 0 HD12 ILE B 109 3.122 0.275 -1.299 1.00 0.00 H new ATOM 0 HD13 ILE B 109 2.653 -1.431 -1.490 1.00 0.00 H new ATOM 1802 N TYR B 110 6.510 -3.124 0.399 1.00 0.00 N ATOM 1803 CA TYR B 110 7.810 -3.456 0.955 1.00 0.00 C ATOM 1804 C TYR B 110 8.817 -2.381 0.583 1.00 0.00 C ATOM 1805 O TYR B 110 8.984 -2.061 -0.592 1.00 0.00 O ATOM 1806 CB TYR B 110 8.300 -4.811 0.439 1.00 0.00 C ATOM 1807 CG TYR B 110 7.376 -5.973 0.737 1.00 0.00 C ATOM 1808 CD1 TYR B 110 6.334 -6.299 -0.122 1.00 0.00 C ATOM 1809 CD2 TYR B 110 7.561 -6.759 1.867 1.00 0.00 C ATOM 1810 CE1 TYR B 110 5.505 -7.374 0.136 1.00 0.00 C ATOM 1811 CE2 TYR B 110 6.735 -7.833 2.134 1.00 0.00 C ATOM 1812 CZ TYR B 110 5.709 -8.136 1.266 1.00 0.00 C ATOM 1813 OH TYR B 110 4.893 -9.212 1.523 1.00 0.00 O ATOM 0 H TYR B 110 6.483 -3.086 -0.620 1.00 0.00 H new ATOM 0 HA TYR B 110 7.711 -3.513 2.039 1.00 0.00 H new ATOM 0 HB2 TYR B 110 8.441 -4.744 -0.640 1.00 0.00 H new ATOM 0 HB3 TYR B 110 9.276 -5.019 0.876 1.00 0.00 H new ATOM 0 HD1 TYR B 110 6.169 -5.702 -1.007 1.00 0.00 H new ATOM 0 HD2 TYR B 110 8.365 -6.526 2.549 1.00 0.00 H new ATOM 0 HE1 TYR B 110 4.702 -7.616 -0.544 1.00 0.00 H new ATOM 0 HE2 TYR B 110 6.893 -8.432 3.019 1.00 0.00 H new ATOM 0 HH TYR B 110 4.963 -9.457 2.469 1.00 0.00 H new ATOM 1823 N ILE B 111 9.462 -1.809 1.580 1.00 0.00 N ATOM 1824 CA ILE B 111 10.468 -0.787 1.350 1.00 0.00 C ATOM 1825 C ILE B 111 11.711 -1.103 2.165 1.00 0.00 C ATOM 1826 O ILE B 111 12.637 -1.729 1.617 1.00 0.00 O ATOM 1827 CB ILE B 111 9.954 0.627 1.710 1.00 0.00 C ATOM 1828 CG1 ILE B 111 8.692 0.955 0.905 1.00 0.00 C ATOM 1829 CG2 ILE B 111 11.039 1.666 1.449 1.00 0.00 C ATOM 1830 CD1 ILE B 111 8.079 2.295 1.246 1.00 0.00 C ATOM 1831 OXT ILE B 111 11.742 -0.769 3.366 1.00 0.00 O ATOM 0 H ILE B 111 9.308 -2.035 2.563 1.00 0.00 H new ATOM 0 HA ILE B 111 10.705 -0.790 0.286 1.00 0.00 H new ATOM 0 HB ILE B 111 9.703 0.648 2.770 1.00 0.00 H new ATOM 0 HG12 ILE B 111 8.936 0.938 -0.157 1.00 0.00 H new ATOM 0 HG13 ILE B 111 7.951 0.174 1.075 1.00 0.00 H new ATOM 0 HG21 ILE B 111 10.664 2.656 1.707 1.00 0.00 H new ATOM 0 HG22 ILE B 111 11.914 1.440 2.059 1.00 0.00 H new ATOM 0 HG23 ILE B 111 11.316 1.646 0.395 1.00 0.00 H new ATOM 0 HD11 ILE B 111 7.191 2.455 0.635 1.00 0.00 H new ATOM 0 HD12 ILE B 111 7.802 2.311 2.300 1.00 0.00 H new ATOM 0 HD13 ILE B 111 8.802 3.087 1.049 1.00 0.00 H new TER 1843 ILE B 111