USER MOD reduce.3.24.130724 H: found=0, std=0, add=834, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 832 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 63 HIS : no HD1:sc= -2.36 K(o=-4,f=-3.2) USER MOD Set 1.2: A 79 TYR OH : rot 179:sc= -1.6! USER MOD Set 2.1: A 70 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 55 THR OG1 : rot 166:sc= -6.43! USER MOD Set 3.2: A 57 GLN : amide:sc= -0.583 K(o=-7,f=-11!) USER MOD Set 4.1: A 32 ASN : amide:sc= 0 K(o=1.3,f=0.4) USER MOD Set 4.2: A 33 SER OG : rot 54:sc= 1.25 USER MOD Set 5.1: A 5 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 14 HIS : no HD1:sc= -12.4! C(o=-12!,f=-15!) USER MOD Single : A 1 VAL N :NH3+ -146:sc= -1.88! (180deg=-2.78!) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= -1.67! K(o=-1.7!,f=-0.043) USER MOD Single : A 8 SER OG : rot 180:sc= 0.174 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 ASN : amide:sc= -0.266 K(o=-0.27,f=-2.9!) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot -92:sc= -0.563 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.217 USER MOD Single : A 25 SER OG : rot -120:sc= 0.0253 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.189 USER MOD Single : A 29 TYR OH : rot 180:sc= -1.87! USER MOD Single : A 30 SER OG : rot -150:sc= -1.32! USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -101:sc= 0.0811 USER MOD Single : A 40 ASN : amide:sc= -0.023 X(o=-0.023,f=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 20:sc= 0.0274 USER MOD Single : A 51 SER OG : rot 17:sc= 0.105 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.0288 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -3.9! C(o=-3.9!,f=-8.9!) USER MOD Single : A 72 SER OG : rot -45:sc= 0.896 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= -0.0209 USER MOD Single : A 80 SER OG : rot 180:sc= -0.18 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -9.61! C(o=-9.6!,f=-11!) USER MOD Single : A 84 ASN : amide:sc= -2.31! C(o=-2.3!,f=-2.6!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= -1.3! USER MOD Single : A 94 LYS NZ :NH3+ -108:sc= 0 (180deg=-0.0385) USER MOD Single : A 96 SER OG : rot -46:sc= -1.23! USER MOD Single : A 98 SER OG : rot 25:sc= -0.852! USER MOD Single : A 99 SER OG : rot 180:sc= 0.0278 USER MOD Single : A 100 SER OG : rot 64:sc= 1.05 USER MOD Single : A 101 SER OG : rot 106:sc= 0.688 USER MOD Single : A 102 THR OG1 : rot 180:sc= -1.32! USER MOD Single : A 104 SER OG : rot 94:sc= -0.0472 USER MOD Single : A 107 ASN : amide:sc= -5.45! C(o=-5.4!,f=-12!) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.209 USER MOD Single : A 110 LYS NZ :NH3+ 159:sc= -0.809 (180deg=-1.86) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 -14.199 -12.944 -32.542 1.00 0.00 N ATOM 2 CA VAL A 1 -13.169 -13.734 -31.806 1.00 0.00 C ATOM 3 C VAL A 1 -12.328 -12.808 -30.923 1.00 0.00 C ATOM 4 O VAL A 1 -12.188 -11.633 -31.200 1.00 0.00 O ATOM 5 CB VAL A 1 -12.305 -14.373 -32.896 1.00 0.00 C ATOM 6 CG1 VAL A 1 -13.197 -15.160 -33.857 1.00 0.00 C ATOM 7 CG2 VAL A 1 -11.567 -13.279 -33.672 1.00 0.00 C ATOM 0 H1 VAL A 1 -15.061 -13.515 -32.652 1.00 0.00 H new ATOM 0 H2 VAL A 1 -14.422 -12.080 -32.007 1.00 0.00 H new ATOM 0 H3 VAL A 1 -13.833 -12.685 -33.480 1.00 0.00 H new ATOM 0 HA VAL A 1 -13.611 -14.483 -31.149 1.00 0.00 H new ATOM 0 HB VAL A 1 -11.581 -15.045 -32.436 1.00 0.00 H new ATOM 0 HG11 VAL A 1 -12.582 -15.615 -34.634 1.00 0.00 H new ATOM 0 HG12 VAL A 1 -13.724 -15.940 -33.308 1.00 0.00 H new ATOM 0 HG13 VAL A 1 -13.921 -14.486 -34.316 1.00 0.00 H new ATOM 0 HG21 VAL A 1 -10.952 -13.735 -34.448 1.00 0.00 H new ATOM 0 HG22 VAL A 1 -12.292 -12.607 -34.132 1.00 0.00 H new ATOM 0 HG23 VAL A 1 -10.931 -12.715 -32.990 1.00 0.00 H new ATOM 19 N LYS A 2 -11.769 -13.322 -29.863 1.00 0.00 N ATOM 20 CA LYS A 2 -10.942 -12.461 -28.971 1.00 0.00 C ATOM 21 C LYS A 2 -9.604 -13.137 -28.665 1.00 0.00 C ATOM 22 O LYS A 2 -9.418 -14.312 -28.914 1.00 0.00 O ATOM 23 CB LYS A 2 -11.766 -12.303 -27.693 1.00 0.00 C ATOM 24 CG LYS A 2 -11.795 -13.632 -26.937 1.00 0.00 C ATOM 25 CD LYS A 2 -13.241 -13.984 -26.582 1.00 0.00 C ATOM 26 CE LYS A 2 -13.424 -15.504 -26.627 1.00 0.00 C ATOM 27 NZ LYS A 2 -14.717 -15.763 -25.931 1.00 0.00 N ATOM 0 H LYS A 2 -11.848 -14.298 -29.576 1.00 0.00 H new ATOM 0 HA LYS A 2 -10.712 -11.500 -29.430 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -11.335 -11.524 -27.064 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -12.781 -11.990 -27.938 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -11.357 -14.421 -27.549 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -11.194 -13.561 -26.031 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -13.485 -13.607 -25.589 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -13.925 -13.504 -27.282 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -13.450 -15.867 -27.654 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -12.600 -16.015 -26.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -14.908 -16.785 -25.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -14.661 -15.414 -24.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -15.485 -15.271 -26.431 1.00 0.00 H new ATOM 41 N CYS A 3 -8.673 -12.401 -28.125 1.00 0.00 N ATOM 42 CA CYS A 3 -7.344 -12.989 -27.796 1.00 0.00 C ATOM 43 C CYS A 3 -6.908 -12.537 -26.399 1.00 0.00 C ATOM 44 O CYS A 3 -6.174 -11.583 -26.247 1.00 0.00 O ATOM 45 CB CYS A 3 -6.395 -12.439 -28.863 1.00 0.00 C ATOM 46 SG CYS A 3 -6.109 -13.701 -30.128 1.00 0.00 S ATOM 0 H CYS A 3 -8.776 -11.412 -27.896 1.00 0.00 H new ATOM 0 HA CYS A 3 -7.357 -14.079 -27.790 1.00 0.00 H new ATOM 0 HB2 CYS A 3 -6.821 -11.544 -29.317 1.00 0.00 H new ATOM 0 HB3 CYS A 3 -5.449 -12.146 -28.407 1.00 0.00 H new ATOM 51 N GLN A 4 -7.362 -13.206 -25.376 1.00 0.00 N ATOM 52 CA GLN A 4 -6.970 -12.796 -23.996 1.00 0.00 C ATOM 53 C GLN A 4 -5.451 -12.747 -23.872 1.00 0.00 C ATOM 54 O GLN A 4 -4.729 -13.163 -24.756 1.00 0.00 O ATOM 55 CB GLN A 4 -7.526 -13.864 -23.052 1.00 0.00 C ATOM 56 CG GLN A 4 -7.313 -15.261 -23.652 1.00 0.00 C ATOM 57 CD GLN A 4 -7.531 -16.344 -22.586 1.00 0.00 C ATOM 58 OE1 GLN A 4 -7.656 -17.507 -22.915 1.00 0.00 O ATOM 59 NE2 GLN A 4 -7.582 -16.023 -21.319 1.00 0.00 N ATOM 0 H GLN A 4 -7.983 -14.013 -25.433 1.00 0.00 H new ATOM 0 HA GLN A 4 -7.359 -11.806 -23.758 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -7.032 -13.797 -22.083 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -8.589 -13.691 -22.881 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -8.002 -15.416 -24.482 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -6.304 -15.339 -24.057 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -7.478 -15.049 -21.035 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -7.726 -16.747 -20.615 1.00 0.00 H new ATOM 68 N SER A 5 -4.962 -12.256 -22.771 1.00 0.00 N ATOM 69 CA SER A 5 -3.486 -12.199 -22.581 1.00 0.00 C ATOM 70 C SER A 5 -2.895 -13.587 -22.837 1.00 0.00 C ATOM 71 O SER A 5 -3.511 -14.587 -22.527 1.00 0.00 O ATOM 72 CB SER A 5 -3.288 -11.780 -21.125 1.00 0.00 C ATOM 73 OG SER A 5 -3.126 -12.941 -20.320 1.00 0.00 O ATOM 0 H SER A 5 -5.517 -11.892 -21.996 1.00 0.00 H new ATOM 0 HA SER A 5 -2.994 -11.504 -23.262 1.00 0.00 H new ATOM 0 HB2 SER A 5 -2.413 -11.136 -21.036 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.146 -11.202 -20.781 1.00 0.00 H new ATOM 0 HG SER A 5 -2.997 -12.676 -19.385 1.00 0.00 H new ATOM 79 N PRO A 6 -1.728 -13.605 -23.415 1.00 0.00 N ATOM 80 CA PRO A 6 -1.063 -14.892 -23.735 1.00 0.00 C ATOM 81 C PRO A 6 -0.553 -15.566 -22.462 1.00 0.00 C ATOM 82 O PRO A 6 -0.235 -14.907 -21.497 1.00 0.00 O ATOM 83 CB PRO A 6 0.100 -14.475 -24.625 1.00 0.00 C ATOM 84 CG PRO A 6 0.392 -13.064 -24.244 1.00 0.00 C ATOM 85 CD PRO A 6 -0.920 -12.450 -23.819 1.00 0.00 C ATOM 0 HA PRO A 6 -1.730 -15.611 -24.212 1.00 0.00 H new ATOM 0 HB2 PRO A 6 0.968 -15.114 -24.465 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -0.163 -14.552 -25.680 1.00 0.00 H new ATOM 0 HG2 PRO A 6 1.119 -13.025 -23.433 1.00 0.00 H new ATOM 0 HG3 PRO A 6 0.821 -12.517 -25.083 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -0.786 -11.748 -22.996 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -1.388 -11.900 -24.635 1.00 0.00 H new ATOM 93 N PRO A 7 -0.485 -16.865 -22.508 1.00 0.00 N ATOM 94 CA PRO A 7 0.003 -17.635 -21.343 1.00 0.00 C ATOM 95 C PRO A 7 1.524 -17.514 -21.245 1.00 0.00 C ATOM 96 O PRO A 7 2.171 -16.996 -22.133 1.00 0.00 O ATOM 97 CB PRO A 7 -0.412 -19.067 -21.664 1.00 0.00 C ATOM 98 CG PRO A 7 -0.515 -19.120 -23.157 1.00 0.00 C ATOM 99 CD PRO A 7 -0.850 -17.729 -23.635 1.00 0.00 C ATOM 0 HA PRO A 7 -0.398 -17.289 -20.390 1.00 0.00 H new ATOM 0 HB2 PRO A 7 0.323 -19.782 -21.294 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -1.364 -19.316 -21.194 1.00 0.00 H new ATOM 0 HG2 PRO A 7 0.423 -19.461 -23.595 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -1.285 -19.827 -23.464 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -0.289 -17.470 -24.533 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -1.908 -17.636 -23.882 1.00 0.00 H new ATOM 107 N SER A 8 2.104 -17.990 -20.181 1.00 0.00 N ATOM 108 CA SER A 8 3.586 -17.896 -20.049 1.00 0.00 C ATOM 109 C SER A 8 4.252 -18.821 -21.064 1.00 0.00 C ATOM 110 O SER A 8 3.593 -19.528 -21.800 1.00 0.00 O ATOM 111 CB SER A 8 3.892 -18.355 -18.625 1.00 0.00 C ATOM 112 OG SER A 8 2.857 -19.220 -18.178 1.00 0.00 O ATOM 0 H SER A 8 1.622 -18.437 -19.401 1.00 0.00 H new ATOM 0 HA SER A 8 3.957 -16.888 -20.235 1.00 0.00 H new ATOM 0 HB2 SER A 8 4.851 -18.871 -18.595 1.00 0.00 H new ATOM 0 HB3 SER A 8 3.973 -17.493 -17.962 1.00 0.00 H new ATOM 0 HG SER A 8 3.051 -19.518 -17.265 1.00 0.00 H new ATOM 118 N ILE A 9 5.553 -18.826 -21.111 1.00 0.00 N ATOM 119 CA ILE A 9 6.253 -19.714 -22.085 1.00 0.00 C ATOM 120 C ILE A 9 7.498 -20.328 -21.482 1.00 0.00 C ATOM 121 O ILE A 9 7.748 -20.250 -20.295 1.00 0.00 O ATOM 122 CB ILE A 9 6.647 -18.855 -23.289 1.00 0.00 C ATOM 123 CG1 ILE A 9 6.926 -17.402 -22.880 1.00 0.00 C ATOM 124 CG2 ILE A 9 5.526 -18.900 -24.312 1.00 0.00 C ATOM 125 CD1 ILE A 9 8.333 -17.018 -23.346 1.00 0.00 C ATOM 0 H ILE A 9 6.162 -18.258 -20.522 1.00 0.00 H new ATOM 0 HA ILE A 9 5.589 -20.529 -22.372 1.00 0.00 H new ATOM 0 HB ILE A 9 7.566 -19.256 -23.717 1.00 0.00 H new ATOM 0 HG12 ILE A 9 6.187 -16.736 -23.325 1.00 0.00 H new ATOM 0 HG13 ILE A 9 6.844 -17.292 -21.799 1.00 0.00 H new ATOM 0 HG21 ILE A 9 5.796 -18.291 -25.175 1.00 0.00 H new ATOM 0 HG22 ILE A 9 5.365 -19.930 -24.631 1.00 0.00 H new ATOM 0 HG23 ILE A 9 4.611 -18.511 -23.866 1.00 0.00 H new ATOM 0 HD11 ILE A 9 8.542 -15.987 -23.061 1.00 0.00 H new ATOM 0 HD12 ILE A 9 9.064 -17.679 -22.880 1.00 0.00 H new ATOM 0 HD13 ILE A 9 8.396 -17.114 -24.430 1.00 0.00 H new ATOM 137 N SER A 10 8.268 -20.957 -22.315 1.00 0.00 N ATOM 138 CA SER A 10 9.509 -21.618 -21.849 1.00 0.00 C ATOM 139 C SER A 10 10.201 -20.785 -20.765 1.00 0.00 C ATOM 140 O SER A 10 10.954 -19.876 -21.054 1.00 0.00 O ATOM 141 CB SER A 10 10.392 -21.728 -23.089 1.00 0.00 C ATOM 142 OG SER A 10 11.622 -22.346 -22.736 1.00 0.00 O ATOM 0 H SER A 10 8.087 -21.042 -23.315 1.00 0.00 H new ATOM 0 HA SER A 10 9.305 -22.592 -21.404 1.00 0.00 H new ATOM 0 HB2 SER A 10 9.887 -22.311 -23.859 1.00 0.00 H new ATOM 0 HB3 SER A 10 10.576 -20.739 -23.508 1.00 0.00 H new ATOM 0 HG SER A 10 12.191 -22.420 -23.531 1.00 0.00 H new ATOM 148 N ASN A 11 9.955 -21.092 -19.521 1.00 0.00 N ATOM 149 CA ASN A 11 10.602 -20.324 -18.418 1.00 0.00 C ATOM 150 C ASN A 11 10.589 -18.824 -18.732 1.00 0.00 C ATOM 151 O ASN A 11 11.433 -18.079 -18.277 1.00 0.00 O ATOM 152 CB ASN A 11 12.038 -20.850 -18.365 1.00 0.00 C ATOM 153 CG ASN A 11 12.416 -21.167 -16.917 1.00 0.00 C ATOM 154 OD1 ASN A 11 13.258 -20.510 -16.339 1.00 0.00 O ATOM 155 ND2 ASN A 11 11.827 -22.157 -16.303 1.00 0.00 N ATOM 0 H ASN A 11 9.333 -21.842 -19.220 1.00 0.00 H new ATOM 0 HA ASN A 11 10.084 -20.450 -17.467 1.00 0.00 H new ATOM 0 HB2 ASN A 11 12.131 -21.745 -18.980 1.00 0.00 H new ATOM 0 HB3 ASN A 11 12.723 -20.108 -18.776 1.00 0.00 H new ATOM 0 HD21 ASN A 11 12.074 -22.378 -15.338 1.00 0.00 H new ATOM 0 HD22 ASN A 11 11.120 -22.709 -16.788 1.00 0.00 H new ATOM 162 N GLY A 12 9.636 -18.374 -19.504 1.00 0.00 N ATOM 163 CA GLY A 12 9.574 -16.922 -19.840 1.00 0.00 C ATOM 164 C GLY A 12 8.181 -16.378 -19.508 1.00 0.00 C ATOM 165 O GLY A 12 7.341 -17.078 -18.979 1.00 0.00 O ATOM 0 H GLY A 12 8.900 -18.947 -19.915 1.00 0.00 H new ATOM 0 HA2 GLY A 12 10.332 -16.376 -19.279 1.00 0.00 H new ATOM 0 HA3 GLY A 12 9.791 -16.773 -20.898 1.00 0.00 H new ATOM 169 N ARG A 13 7.932 -15.132 -19.811 1.00 0.00 N ATOM 170 CA ARG A 13 6.594 -14.540 -19.509 1.00 0.00 C ATOM 171 C ARG A 13 6.118 -13.666 -20.671 1.00 0.00 C ATOM 172 O ARG A 13 6.806 -13.487 -21.656 1.00 0.00 O ATOM 173 CB ARG A 13 6.798 -13.690 -18.251 1.00 0.00 C ATOM 174 CG ARG A 13 8.132 -12.943 -18.337 1.00 0.00 C ATOM 175 CD ARG A 13 7.985 -11.557 -17.705 1.00 0.00 C ATOM 176 NE ARG A 13 7.882 -11.811 -16.241 1.00 0.00 N ATOM 177 CZ ARG A 13 7.969 -10.818 -15.398 1.00 0.00 C ATOM 178 NH1 ARG A 13 7.485 -9.648 -15.713 1.00 0.00 N ATOM 179 NH2 ARG A 13 8.542 -10.997 -14.239 1.00 0.00 N ATOM 0 H ARG A 13 8.596 -14.498 -20.255 1.00 0.00 H new ATOM 0 HA ARG A 13 5.837 -15.310 -19.361 1.00 0.00 H new ATOM 0 HB2 ARG A 13 5.979 -12.978 -18.146 1.00 0.00 H new ATOM 0 HB3 ARG A 13 6.784 -14.326 -17.366 1.00 0.00 H new ATOM 0 HG2 ARG A 13 8.910 -13.507 -17.823 1.00 0.00 H new ATOM 0 HG3 ARG A 13 8.441 -12.848 -19.378 1.00 0.00 H new ATOM 0 HD2 ARG A 13 8.842 -10.924 -17.937 1.00 0.00 H new ATOM 0 HD3 ARG A 13 7.099 -11.044 -18.080 1.00 0.00 H new ATOM 0 HE ARG A 13 7.743 -12.761 -15.897 1.00 0.00 H new ATOM 0 HH11 ARG A 13 7.038 -9.508 -16.619 1.00 0.00 H new ATOM 0 HH12 ARG A 13 7.554 -8.873 -15.053 1.00 0.00 H new ATOM 0 HH21 ARG A 13 8.921 -11.912 -13.993 1.00 0.00 H new ATOM 0 HH22 ARG A 13 8.611 -10.222 -13.579 1.00 0.00 H new ATOM 193 N HIS A 14 4.939 -13.125 -20.557 1.00 0.00 N ATOM 194 CA HIS A 14 4.396 -12.261 -21.645 1.00 0.00 C ATOM 195 C HIS A 14 3.878 -10.941 -21.064 1.00 0.00 C ATOM 196 O HIS A 14 3.166 -10.925 -20.079 1.00 0.00 O ATOM 197 CB HIS A 14 3.254 -13.071 -22.247 1.00 0.00 C ATOM 198 CG HIS A 14 2.080 -13.075 -21.311 1.00 0.00 C ATOM 199 ND1 HIS A 14 0.981 -12.267 -21.522 1.00 0.00 N ATOM 200 CD2 HIS A 14 1.796 -13.814 -20.190 1.00 0.00 C ATOM 201 CE1 HIS A 14 0.084 -12.542 -20.566 1.00 0.00 C ATOM 202 NE2 HIS A 14 0.530 -13.475 -19.719 1.00 0.00 N ATOM 0 H HIS A 14 4.323 -13.244 -19.753 1.00 0.00 H new ATOM 0 HA HIS A 14 5.150 -12.001 -22.388 1.00 0.00 H new ATOM 0 HB2 HIS A 14 2.963 -12.646 -23.208 1.00 0.00 H new ATOM 0 HB3 HIS A 14 3.582 -14.093 -22.437 1.00 0.00 H new ATOM 0 HD2 HIS A 14 2.453 -14.545 -19.742 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -0.883 -12.067 -20.489 1.00 0.00 H new ATOM 0 HE2 HIS A 14 0.048 -13.856 -18.905 1.00 0.00 H new ATOM 210 N ASN A 15 4.233 -9.835 -21.660 1.00 0.00 N ATOM 211 CA ASN A 15 3.759 -8.523 -21.130 1.00 0.00 C ATOM 212 C ASN A 15 3.720 -7.475 -22.245 1.00 0.00 C ATOM 213 O ASN A 15 4.608 -6.655 -22.371 1.00 0.00 O ATOM 214 CB ASN A 15 4.784 -8.134 -20.064 1.00 0.00 C ATOM 215 CG ASN A 15 4.064 -7.498 -18.873 1.00 0.00 C ATOM 216 OD1 ASN A 15 2.876 -7.684 -18.696 1.00 0.00 O ATOM 217 ND2 ASN A 15 4.738 -6.752 -18.042 1.00 0.00 N ATOM 0 H ASN A 15 4.828 -9.782 -22.487 1.00 0.00 H new ATOM 0 HA ASN A 15 2.749 -8.586 -20.725 1.00 0.00 H new ATOM 0 HB2 ASN A 15 5.339 -9.014 -19.739 1.00 0.00 H new ATOM 0 HB3 ASN A 15 5.510 -7.435 -20.480 1.00 0.00 H new ATOM 0 HD21 ASN A 15 4.268 -6.325 -17.244 1.00 0.00 H new ATOM 0 HD22 ASN A 15 5.735 -6.596 -18.190 1.00 0.00 H new ATOM 224 N GLY A 16 2.696 -7.491 -23.052 1.00 0.00 N ATOM 225 CA GLY A 16 2.600 -6.491 -24.153 1.00 0.00 C ATOM 226 C GLY A 16 2.113 -5.156 -23.586 1.00 0.00 C ATOM 227 O GLY A 16 2.764 -4.547 -22.761 1.00 0.00 O ATOM 0 H GLY A 16 1.922 -8.153 -22.997 1.00 0.00 H new ATOM 0 HA2 GLY A 16 3.572 -6.363 -24.629 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.913 -6.845 -24.921 1.00 0.00 H new ATOM 231 N TYR A 17 0.971 -4.697 -24.020 1.00 0.00 N ATOM 232 CA TYR A 17 0.446 -3.402 -23.500 1.00 0.00 C ATOM 233 C TYR A 17 -1.074 -3.474 -23.325 1.00 0.00 C ATOM 234 O TYR A 17 -1.763 -2.475 -23.384 1.00 0.00 O ATOM 235 CB TYR A 17 0.820 -2.367 -24.562 1.00 0.00 C ATOM 236 CG TYR A 17 1.750 -1.344 -23.955 1.00 0.00 C ATOM 237 CD1 TYR A 17 3.100 -1.656 -23.753 1.00 0.00 C ATOM 238 CD2 TYR A 17 1.260 -0.086 -23.588 1.00 0.00 C ATOM 239 CE1 TYR A 17 3.959 -0.709 -23.185 1.00 0.00 C ATOM 240 CE2 TYR A 17 2.119 0.862 -23.020 1.00 0.00 C ATOM 241 CZ TYR A 17 3.469 0.551 -22.818 1.00 0.00 C ATOM 242 OH TYR A 17 4.316 1.485 -22.257 1.00 0.00 O ATOM 0 H TYR A 17 0.380 -5.161 -24.710 1.00 0.00 H new ATOM 0 HA TYR A 17 0.862 -3.151 -22.524 1.00 0.00 H new ATOM 0 HB2 TYR A 17 1.301 -2.856 -25.409 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -0.077 -1.879 -24.943 1.00 0.00 H new ATOM 0 HD1 TYR A 17 3.478 -2.627 -24.036 1.00 0.00 H new ATOM 0 HD2 TYR A 17 0.218 0.154 -23.743 1.00 0.00 H new ATOM 0 HE1 TYR A 17 5.000 -0.949 -23.029 1.00 0.00 H new ATOM 0 HE2 TYR A 17 1.740 1.833 -22.738 1.00 0.00 H new ATOM 0 HH TYR A 17 3.816 2.305 -22.063 1.00 0.00 H new ATOM 252 N GLU A 18 -1.602 -4.647 -23.103 1.00 0.00 N ATOM 253 CA GLU A 18 -3.077 -4.780 -22.915 1.00 0.00 C ATOM 254 C GLU A 18 -3.403 -6.130 -22.274 1.00 0.00 C ATOM 255 O GLU A 18 -2.524 -6.914 -21.976 1.00 0.00 O ATOM 256 CB GLU A 18 -3.686 -4.687 -24.319 1.00 0.00 C ATOM 257 CG GLU A 18 -2.803 -5.425 -25.329 1.00 0.00 C ATOM 258 CD GLU A 18 -2.163 -4.412 -26.280 1.00 0.00 C ATOM 259 OE1 GLU A 18 -1.167 -3.820 -25.900 1.00 0.00 O ATOM 260 OE2 GLU A 18 -2.682 -4.245 -27.371 1.00 0.00 O ATOM 0 H GLU A 18 -1.077 -5.519 -23.044 1.00 0.00 H new ATOM 0 HA GLU A 18 -3.475 -4.007 -22.258 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.687 -5.117 -24.318 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.788 -3.642 -24.610 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.030 -5.990 -24.808 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -3.398 -6.144 -25.892 1.00 0.00 H new ATOM 267 N ASP A 19 -4.659 -6.408 -22.055 1.00 0.00 N ATOM 268 CA ASP A 19 -5.032 -7.708 -21.430 1.00 0.00 C ATOM 269 C ASP A 19 -6.215 -8.333 -22.171 1.00 0.00 C ATOM 270 O ASP A 19 -6.900 -9.193 -21.653 1.00 0.00 O ATOM 271 CB ASP A 19 -5.418 -7.361 -19.992 1.00 0.00 C ATOM 272 CG ASP A 19 -4.160 -7.319 -19.123 1.00 0.00 C ATOM 273 OD1 ASP A 19 -3.490 -6.300 -19.133 1.00 0.00 O ATOM 274 OD2 ASP A 19 -3.886 -8.309 -18.465 1.00 0.00 O ATOM 0 H ASP A 19 -5.441 -5.793 -22.281 1.00 0.00 H new ATOM 0 HA ASP A 19 -4.219 -8.433 -21.468 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -5.926 -6.397 -19.963 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -6.117 -8.101 -19.603 1.00 0.00 H new ATOM 279 N PHE A 20 -6.461 -7.910 -23.380 1.00 0.00 N ATOM 280 CA PHE A 20 -7.600 -8.484 -24.150 1.00 0.00 C ATOM 281 C PHE A 20 -7.310 -8.432 -25.651 1.00 0.00 C ATOM 282 O PHE A 20 -8.127 -7.991 -26.434 1.00 0.00 O ATOM 283 CB PHE A 20 -8.799 -7.600 -23.806 1.00 0.00 C ATOM 284 CG PHE A 20 -9.830 -8.419 -23.067 1.00 0.00 C ATOM 285 CD1 PHE A 20 -10.217 -9.670 -23.563 1.00 0.00 C ATOM 286 CD2 PHE A 20 -10.397 -7.927 -21.887 1.00 0.00 C ATOM 287 CE1 PHE A 20 -11.173 -10.429 -22.876 1.00 0.00 C ATOM 288 CE2 PHE A 20 -11.352 -8.685 -21.200 1.00 0.00 C ATOM 289 CZ PHE A 20 -11.741 -9.936 -21.695 1.00 0.00 C ATOM 0 H PHE A 20 -5.924 -7.193 -23.867 1.00 0.00 H new ATOM 0 HA PHE A 20 -7.778 -9.530 -23.899 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -8.480 -6.758 -23.192 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -9.232 -7.185 -24.716 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -9.779 -10.049 -24.474 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -10.098 -6.962 -21.506 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -11.472 -11.394 -23.257 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -11.789 -8.305 -20.288 1.00 0.00 H new ATOM 0 HZ PHE A 20 -12.479 -10.520 -21.166 1.00 0.00 H new ATOM 299 N TYR A 21 -6.157 -8.885 -26.064 1.00 0.00 N ATOM 300 CA TYR A 21 -5.836 -8.862 -27.518 1.00 0.00 C ATOM 301 C TYR A 21 -6.987 -9.495 -28.304 1.00 0.00 C ATOM 302 O TYR A 21 -7.849 -10.142 -27.742 1.00 0.00 O ATOM 303 CB TYR A 21 -4.553 -9.679 -27.660 1.00 0.00 C ATOM 304 CG TYR A 21 -3.371 -8.782 -27.392 1.00 0.00 C ATOM 305 CD1 TYR A 21 -3.200 -7.619 -28.146 1.00 0.00 C ATOM 306 CD2 TYR A 21 -2.449 -9.111 -26.392 1.00 0.00 C ATOM 307 CE1 TYR A 21 -2.106 -6.781 -27.906 1.00 0.00 C ATOM 308 CE2 TYR A 21 -1.353 -8.275 -26.152 1.00 0.00 C ATOM 309 CZ TYR A 21 -1.181 -7.110 -26.909 1.00 0.00 C ATOM 310 OH TYR A 21 -0.100 -6.286 -26.671 1.00 0.00 O ATOM 0 H TYR A 21 -5.428 -9.267 -25.461 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.702 -7.852 -27.906 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -4.559 -10.514 -26.960 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -4.485 -10.103 -28.662 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -3.914 -7.366 -28.916 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -2.583 -10.009 -25.807 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -1.976 -5.881 -28.489 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -0.639 -8.529 -25.382 1.00 0.00 H new ATOM 0 HH TYR A 21 0.661 -6.580 -27.214 1.00 0.00 H new ATOM 320 N THR A 22 -7.019 -9.311 -29.595 1.00 0.00 N ATOM 321 CA THR A 22 -8.130 -9.899 -30.402 1.00 0.00 C ATOM 322 C THR A 22 -7.585 -10.629 -31.624 1.00 0.00 C ATOM 323 O THR A 22 -7.637 -11.839 -31.715 1.00 0.00 O ATOM 324 CB THR A 22 -8.983 -8.703 -30.828 1.00 0.00 C ATOM 325 OG1 THR A 22 -8.133 -7.653 -31.269 1.00 0.00 O ATOM 326 CG2 THR A 22 -9.820 -8.220 -29.642 1.00 0.00 C ATOM 0 H THR A 22 -6.328 -8.781 -30.126 1.00 0.00 H new ATOM 0 HA THR A 22 -8.702 -10.632 -29.834 1.00 0.00 H new ATOM 0 HB THR A 22 -9.647 -9.001 -31.639 1.00 0.00 H new ATOM 0 HG1 THR A 22 -8.677 -6.886 -31.544 1.00 0.00 H new ATOM 0 HG21 THR A 22 -10.427 -7.368 -29.948 1.00 0.00 H new ATOM 0 HG22 THR A 22 -10.471 -9.026 -29.304 1.00 0.00 H new ATOM 0 HG23 THR A 22 -9.159 -7.921 -28.828 1.00 0.00 H new ATOM 334 N ASP A 23 -7.076 -9.903 -32.570 1.00 0.00 N ATOM 335 CA ASP A 23 -6.543 -10.551 -33.796 1.00 0.00 C ATOM 336 C ASP A 23 -5.573 -9.601 -34.500 1.00 0.00 C ATOM 337 O ASP A 23 -5.812 -8.414 -34.598 1.00 0.00 O ATOM 338 CB ASP A 23 -7.785 -10.815 -34.644 1.00 0.00 C ATOM 339 CG ASP A 23 -7.382 -11.028 -36.104 1.00 0.00 C ATOM 340 OD1 ASP A 23 -6.252 -11.429 -36.335 1.00 0.00 O ATOM 341 OD2 ASP A 23 -8.209 -10.787 -36.968 1.00 0.00 O ATOM 0 H ASP A 23 -7.005 -8.886 -32.550 1.00 0.00 H new ATOM 0 HA ASP A 23 -5.986 -11.467 -33.599 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -8.311 -11.694 -34.271 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -8.474 -9.974 -34.567 1.00 0.00 H new ATOM 346 N GLY A 24 -4.467 -10.109 -34.969 1.00 0.00 N ATOM 347 CA GLY A 24 -3.471 -9.228 -35.637 1.00 0.00 C ATOM 348 C GLY A 24 -2.669 -8.500 -34.558 1.00 0.00 C ATOM 349 O GLY A 24 -1.966 -7.546 -34.824 1.00 0.00 O ATOM 0 H GLY A 24 -4.211 -11.095 -34.918 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -2.807 -9.818 -36.270 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -3.974 -8.510 -36.285 1.00 0.00 H new ATOM 353 N SER A 25 -2.772 -8.954 -33.335 1.00 0.00 N ATOM 354 CA SER A 25 -2.022 -8.302 -32.223 1.00 0.00 C ATOM 355 C SER A 25 -0.723 -9.059 -31.961 1.00 0.00 C ATOM 356 O SER A 25 -0.492 -10.119 -32.508 1.00 0.00 O ATOM 357 CB SER A 25 -2.950 -8.398 -31.014 1.00 0.00 C ATOM 358 OG SER A 25 -4.282 -8.616 -31.459 1.00 0.00 O ATOM 0 H SER A 25 -3.346 -9.751 -33.059 1.00 0.00 H new ATOM 0 HA SER A 25 -1.753 -7.270 -32.449 1.00 0.00 H new ATOM 0 HB2 SER A 25 -2.634 -9.213 -30.363 1.00 0.00 H new ATOM 0 HB3 SER A 25 -2.896 -7.481 -30.426 1.00 0.00 H new ATOM 0 HG SER A 25 -4.854 -7.882 -31.151 1.00 0.00 H new ATOM 364 N VAL A 26 0.131 -8.529 -31.131 1.00 0.00 N ATOM 365 CA VAL A 26 1.411 -9.235 -30.850 1.00 0.00 C ATOM 366 C VAL A 26 1.856 -8.997 -29.411 1.00 0.00 C ATOM 367 O VAL A 26 1.498 -8.015 -28.792 1.00 0.00 O ATOM 368 CB VAL A 26 2.418 -8.634 -31.835 1.00 0.00 C ATOM 369 CG1 VAL A 26 3.840 -9.023 -31.427 1.00 0.00 C ATOM 370 CG2 VAL A 26 2.132 -9.161 -33.241 1.00 0.00 C ATOM 0 H VAL A 26 -0.000 -7.645 -30.639 1.00 0.00 H new ATOM 0 HA VAL A 26 1.317 -10.314 -30.968 1.00 0.00 H new ATOM 0 HB VAL A 26 2.325 -7.548 -31.824 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.551 -8.592 -32.132 1.00 0.00 H new ATOM 0 HG12 VAL A 26 4.047 -8.646 -30.426 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.936 -10.109 -31.432 1.00 0.00 H new ATOM 0 HG21 VAL A 26 2.848 -8.734 -33.943 1.00 0.00 H new ATOM 0 HG22 VAL A 26 2.222 -10.247 -33.248 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.122 -8.878 -33.537 1.00 0.00 H new ATOM 380 N VAL A 27 2.629 -9.898 -28.870 1.00 0.00 N ATOM 381 CA VAL A 27 3.085 -9.724 -27.463 1.00 0.00 C ATOM 382 C VAL A 27 4.573 -9.977 -27.323 1.00 0.00 C ATOM 383 O VAL A 27 5.049 -11.075 -27.525 1.00 0.00 O ATOM 384 CB VAL A 27 2.309 -10.760 -26.666 1.00 0.00 C ATOM 385 CG1 VAL A 27 2.974 -10.983 -25.303 1.00 0.00 C ATOM 386 CG2 VAL A 27 0.908 -10.239 -26.461 1.00 0.00 C ATOM 0 H VAL A 27 2.962 -10.741 -29.337 1.00 0.00 H new ATOM 0 HA VAL A 27 2.911 -8.705 -27.117 1.00 0.00 H new ATOM 0 HB VAL A 27 2.292 -11.708 -27.204 1.00 0.00 H new ATOM 0 HG11 VAL A 27 2.410 -11.727 -24.740 1.00 0.00 H new ATOM 0 HG12 VAL A 27 3.995 -11.336 -25.450 1.00 0.00 H new ATOM 0 HG13 VAL A 27 2.991 -10.045 -24.748 1.00 0.00 H new ATOM 0 HG21 VAL A 27 0.329 -10.966 -25.890 1.00 0.00 H new ATOM 0 HG22 VAL A 27 0.947 -9.296 -25.915 1.00 0.00 H new ATOM 0 HG23 VAL A 27 0.434 -10.078 -27.429 1.00 0.00 H new ATOM 396 N THR A 28 5.310 -8.986 -26.938 1.00 0.00 N ATOM 397 CA THR A 28 6.753 -9.216 -26.750 1.00 0.00 C ATOM 398 C THR A 28 6.937 -10.051 -25.490 1.00 0.00 C ATOM 399 O THR A 28 6.828 -9.562 -24.383 1.00 0.00 O ATOM 400 CB THR A 28 7.387 -7.832 -26.598 1.00 0.00 C ATOM 401 OG1 THR A 28 6.388 -6.832 -26.742 1.00 0.00 O ATOM 402 CG2 THR A 28 8.456 -7.646 -27.672 1.00 0.00 C ATOM 0 H THR A 28 4.981 -8.040 -26.748 1.00 0.00 H new ATOM 0 HA THR A 28 7.215 -9.749 -27.581 1.00 0.00 H new ATOM 0 HB THR A 28 7.842 -7.746 -25.611 1.00 0.00 H new ATOM 0 HG1 THR A 28 6.795 -5.946 -26.643 1.00 0.00 H new ATOM 0 HG21 THR A 28 8.910 -6.661 -27.567 1.00 0.00 H new ATOM 0 HG22 THR A 28 9.223 -8.413 -27.559 1.00 0.00 H new ATOM 0 HG23 THR A 28 8.000 -7.732 -28.658 1.00 0.00 H new ATOM 410 N TYR A 29 7.186 -11.315 -25.650 1.00 0.00 N ATOM 411 CA TYR A 29 7.342 -12.191 -24.461 1.00 0.00 C ATOM 412 C TYR A 29 8.621 -11.821 -23.703 1.00 0.00 C ATOM 413 O TYR A 29 9.401 -11.000 -24.145 1.00 0.00 O ATOM 414 CB TYR A 29 7.470 -13.608 -25.028 1.00 0.00 C ATOM 415 CG TYR A 29 6.120 -14.283 -25.139 1.00 0.00 C ATOM 416 CD1 TYR A 29 4.936 -13.600 -24.820 1.00 0.00 C ATOM 417 CD2 TYR A 29 6.061 -15.613 -25.570 1.00 0.00 C ATOM 418 CE1 TYR A 29 3.704 -14.252 -24.929 1.00 0.00 C ATOM 419 CE2 TYR A 29 4.830 -16.262 -25.681 1.00 0.00 C ATOM 420 CZ TYR A 29 3.650 -15.584 -25.360 1.00 0.00 C ATOM 421 OH TYR A 29 2.433 -16.227 -25.467 1.00 0.00 O ATOM 0 H TYR A 29 7.288 -11.781 -26.552 1.00 0.00 H new ATOM 0 HA TYR A 29 6.507 -12.095 -23.767 1.00 0.00 H new ATOM 0 HB2 TYR A 29 7.940 -13.567 -26.011 1.00 0.00 H new ATOM 0 HB3 TYR A 29 8.123 -14.200 -24.387 1.00 0.00 H new ATOM 0 HD1 TYR A 29 4.977 -12.572 -24.491 1.00 0.00 H new ATOM 0 HD2 TYR A 29 6.971 -16.139 -25.818 1.00 0.00 H new ATOM 0 HE1 TYR A 29 2.793 -13.728 -24.681 1.00 0.00 H new ATOM 0 HE2 TYR A 29 4.789 -17.288 -26.015 1.00 0.00 H new ATOM 0 HH TYR A 29 2.574 -17.145 -25.780 1.00 0.00 H new ATOM 431 N SER A 30 8.846 -12.426 -22.571 1.00 0.00 N ATOM 432 CA SER A 30 10.079 -12.119 -21.791 1.00 0.00 C ATOM 433 C SER A 30 10.710 -13.421 -21.295 1.00 0.00 C ATOM 434 O SER A 30 10.025 -14.388 -21.024 1.00 0.00 O ATOM 435 CB SER A 30 9.618 -11.260 -20.613 1.00 0.00 C ATOM 436 OG SER A 30 8.201 -11.139 -20.636 1.00 0.00 O ATOM 0 H SER A 30 8.229 -13.121 -22.151 1.00 0.00 H new ATOM 0 HA SER A 30 10.828 -11.601 -22.389 1.00 0.00 H new ATOM 0 HB2 SER A 30 9.939 -11.710 -19.674 1.00 0.00 H new ATOM 0 HB3 SER A 30 10.078 -10.273 -20.667 1.00 0.00 H new ATOM 0 HG SER A 30 7.940 -10.280 -20.243 1.00 0.00 H new ATOM 442 N CYS A 31 12.007 -13.459 -21.177 1.00 0.00 N ATOM 443 CA CYS A 31 12.672 -14.706 -20.703 1.00 0.00 C ATOM 444 C CYS A 31 13.425 -14.443 -19.398 1.00 0.00 C ATOM 445 O CYS A 31 13.932 -13.362 -19.170 1.00 0.00 O ATOM 446 CB CYS A 31 13.649 -15.080 -21.817 1.00 0.00 C ATOM 447 SG CYS A 31 12.755 -15.192 -23.386 1.00 0.00 S ATOM 0 H CYS A 31 12.635 -12.683 -21.387 1.00 0.00 H new ATOM 0 HA CYS A 31 11.957 -15.503 -20.501 1.00 0.00 H new ATOM 0 HB2 CYS A 31 14.440 -14.333 -21.889 1.00 0.00 H new ATOM 0 HB3 CYS A 31 14.129 -16.032 -21.590 1.00 0.00 H new ATOM 452 N ASN A 32 13.507 -15.422 -18.541 1.00 0.00 N ATOM 453 CA ASN A 32 14.232 -15.223 -17.254 1.00 0.00 C ATOM 454 C ASN A 32 15.551 -14.490 -17.506 1.00 0.00 C ATOM 455 O ASN A 32 16.142 -14.601 -18.562 1.00 0.00 O ATOM 456 CB ASN A 32 14.492 -16.631 -16.720 1.00 0.00 C ATOM 457 CG ASN A 32 14.412 -16.618 -15.193 1.00 0.00 C ATOM 458 OD1 ASN A 32 15.188 -15.952 -14.538 1.00 0.00 O ATOM 459 ND2 ASN A 32 13.499 -17.333 -14.595 1.00 0.00 N ATOM 0 H ASN A 32 13.105 -16.350 -18.675 1.00 0.00 H new ATOM 0 HA ASN A 32 13.662 -14.622 -16.545 1.00 0.00 H new ATOM 0 HB2 ASN A 32 13.759 -17.327 -17.128 1.00 0.00 H new ATOM 0 HB3 ASN A 32 15.474 -16.978 -17.041 1.00 0.00 H new ATOM 0 HD21 ASN A 32 13.437 -17.333 -13.577 1.00 0.00 H new ATOM 0 HD22 ASN A 32 12.847 -17.892 -15.146 1.00 0.00 H new ATOM 466 N SER A 33 16.017 -13.741 -16.546 1.00 0.00 N ATOM 467 CA SER A 33 17.296 -13.000 -16.735 1.00 0.00 C ATOM 468 C SER A 33 18.418 -13.967 -17.126 1.00 0.00 C ATOM 469 O SER A 33 18.997 -14.632 -16.290 1.00 0.00 O ATOM 470 CB SER A 33 17.584 -12.361 -15.377 1.00 0.00 C ATOM 471 OG SER A 33 17.830 -13.383 -14.420 1.00 0.00 O ATOM 0 H SER A 33 15.568 -13.610 -15.639 1.00 0.00 H new ATOM 0 HA SER A 33 17.231 -12.257 -17.530 1.00 0.00 H new ATOM 0 HB2 SER A 33 18.447 -11.699 -15.449 1.00 0.00 H new ATOM 0 HB3 SER A 33 16.738 -11.749 -15.063 1.00 0.00 H new ATOM 0 HG SER A 33 18.536 -13.977 -14.750 1.00 0.00 H new ATOM 477 N GLY A 34 18.730 -14.049 -18.392 1.00 0.00 N ATOM 478 CA GLY A 34 19.815 -14.970 -18.835 1.00 0.00 C ATOM 479 C GLY A 34 19.357 -15.751 -20.069 1.00 0.00 C ATOM 480 O GLY A 34 20.160 -16.279 -20.813 1.00 0.00 O ATOM 0 H GLY A 34 18.280 -13.518 -19.138 1.00 0.00 H new ATOM 0 HA2 GLY A 34 20.716 -14.402 -19.066 1.00 0.00 H new ATOM 0 HA3 GLY A 34 20.071 -15.660 -18.031 1.00 0.00 H new ATOM 484 N TYR A 35 18.074 -15.830 -20.292 1.00 0.00 N ATOM 485 CA TYR A 35 17.571 -16.580 -21.479 1.00 0.00 C ATOM 486 C TYR A 35 17.248 -15.612 -22.621 1.00 0.00 C ATOM 487 O TYR A 35 16.588 -14.609 -22.433 1.00 0.00 O ATOM 488 CB TYR A 35 16.305 -17.285 -20.993 1.00 0.00 C ATOM 489 CG TYR A 35 16.675 -18.620 -20.392 1.00 0.00 C ATOM 490 CD1 TYR A 35 17.026 -18.707 -19.039 1.00 0.00 C ATOM 491 CD2 TYR A 35 16.669 -19.770 -21.188 1.00 0.00 C ATOM 492 CE1 TYR A 35 17.371 -19.946 -18.484 1.00 0.00 C ATOM 493 CE2 TYR A 35 17.014 -21.009 -20.634 1.00 0.00 C ATOM 494 CZ TYR A 35 17.365 -21.096 -19.282 1.00 0.00 C ATOM 495 OH TYR A 35 17.705 -22.317 -18.735 1.00 0.00 O ATOM 0 H TYR A 35 17.353 -15.409 -19.706 1.00 0.00 H new ATOM 0 HA TYR A 35 18.307 -17.286 -21.865 1.00 0.00 H new ATOM 0 HB2 TYR A 35 15.794 -16.669 -20.253 1.00 0.00 H new ATOM 0 HB3 TYR A 35 15.613 -17.426 -21.823 1.00 0.00 H new ATOM 0 HD1 TYR A 35 17.031 -17.819 -18.424 1.00 0.00 H new ATOM 0 HD2 TYR A 35 16.398 -19.702 -22.231 1.00 0.00 H new ATOM 0 HE1 TYR A 35 17.642 -20.014 -17.441 1.00 0.00 H new ATOM 0 HE2 TYR A 35 17.009 -21.896 -21.249 1.00 0.00 H new ATOM 0 HH TYR A 35 17.649 -23.011 -19.424 1.00 0.00 H new ATOM 505 N SER A 36 17.717 -15.904 -23.803 1.00 0.00 N ATOM 506 CA SER A 36 17.448 -15.002 -24.962 1.00 0.00 C ATOM 507 C SER A 36 16.046 -15.229 -25.522 1.00 0.00 C ATOM 508 O SER A 36 15.557 -16.342 -25.572 1.00 0.00 O ATOM 509 CB SER A 36 18.486 -15.384 -26.009 1.00 0.00 C ATOM 510 OG SER A 36 18.952 -14.210 -26.660 1.00 0.00 O ATOM 0 H SER A 36 18.276 -16.730 -24.018 1.00 0.00 H new ATOM 0 HA SER A 36 17.507 -13.953 -24.671 1.00 0.00 H new ATOM 0 HB2 SER A 36 19.318 -15.907 -25.538 1.00 0.00 H new ATOM 0 HB3 SER A 36 18.050 -16.068 -26.737 1.00 0.00 H new ATOM 0 HG SER A 36 18.514 -14.124 -27.532 1.00 0.00 H new ATOM 516 N LEU A 37 15.406 -14.183 -25.968 1.00 0.00 N ATOM 517 CA LEU A 37 14.048 -14.339 -26.554 1.00 0.00 C ATOM 518 C LEU A 37 14.172 -14.540 -28.063 1.00 0.00 C ATOM 519 O LEU A 37 14.389 -13.603 -28.806 1.00 0.00 O ATOM 520 CB LEU A 37 13.313 -13.036 -26.249 1.00 0.00 C ATOM 521 CG LEU A 37 11.939 -13.071 -26.922 1.00 0.00 C ATOM 522 CD1 LEU A 37 10.846 -12.893 -25.867 1.00 0.00 C ATOM 523 CD2 LEU A 37 11.842 -11.942 -27.950 1.00 0.00 C ATOM 0 H LEU A 37 15.766 -13.229 -25.951 1.00 0.00 H new ATOM 0 HA LEU A 37 13.515 -15.197 -26.145 1.00 0.00 H new ATOM 0 HB2 LEU A 37 13.202 -12.909 -25.172 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.889 -12.185 -26.612 1.00 0.00 H new ATOM 0 HG LEU A 37 11.808 -14.030 -27.423 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.868 -12.918 -26.348 1.00 0.00 H new ATOM 0 HD12 LEU A 37 10.911 -13.699 -25.136 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.978 -11.935 -25.364 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.863 -11.969 -28.428 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.976 -10.983 -27.450 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.618 -12.070 -28.705 1.00 0.00 H new ATOM 535 N ILE A 38 14.043 -15.750 -28.527 1.00 0.00 N ATOM 536 CA ILE A 38 14.163 -15.991 -29.994 1.00 0.00 C ATOM 537 C ILE A 38 12.784 -15.888 -30.649 1.00 0.00 C ATOM 538 O ILE A 38 11.786 -16.291 -30.086 1.00 0.00 O ATOM 539 CB ILE A 38 14.742 -17.406 -30.178 1.00 0.00 C ATOM 540 CG1 ILE A 38 15.456 -17.897 -28.906 1.00 0.00 C ATOM 541 CG2 ILE A 38 15.751 -17.380 -31.319 1.00 0.00 C ATOM 542 CD1 ILE A 38 16.498 -16.864 -28.466 1.00 0.00 C ATOM 0 H ILE A 38 13.861 -16.578 -27.960 1.00 0.00 H new ATOM 0 HA ILE A 38 14.813 -15.251 -30.462 1.00 0.00 H new ATOM 0 HB ILE A 38 13.917 -18.084 -30.395 1.00 0.00 H new ATOM 0 HG12 ILE A 38 14.730 -18.057 -28.109 1.00 0.00 H new ATOM 0 HG13 ILE A 38 15.938 -18.856 -29.095 1.00 0.00 H new ATOM 0 HG21 ILE A 38 16.168 -18.377 -31.459 1.00 0.00 H new ATOM 0 HG22 ILE A 38 15.255 -17.062 -32.236 1.00 0.00 H new ATOM 0 HG23 ILE A 38 16.553 -16.682 -31.080 1.00 0.00 H new ATOM 0 HD11 ILE A 38 17.001 -17.216 -27.565 1.00 0.00 H new ATOM 0 HD12 ILE A 38 17.231 -16.726 -29.261 1.00 0.00 H new ATOM 0 HD13 ILE A 38 16.004 -15.915 -28.259 1.00 0.00 H new ATOM 554 N GLY A 39 12.722 -15.341 -31.831 1.00 0.00 N ATOM 555 CA GLY A 39 11.410 -15.197 -32.523 1.00 0.00 C ATOM 556 C GLY A 39 11.288 -13.771 -33.060 1.00 0.00 C ATOM 557 O GLY A 39 12.274 -13.081 -33.233 1.00 0.00 O ATOM 0 H GLY A 39 13.526 -14.986 -32.349 1.00 0.00 H new ATOM 0 HA2 GLY A 39 11.333 -15.915 -33.339 1.00 0.00 H new ATOM 0 HA3 GLY A 39 10.594 -15.411 -31.833 1.00 0.00 H new ATOM 561 N ASN A 40 10.095 -13.310 -33.319 1.00 0.00 N ATOM 562 CA ASN A 40 9.944 -11.919 -33.834 1.00 0.00 C ATOM 563 C ASN A 40 9.583 -10.983 -32.685 1.00 0.00 C ATOM 564 O ASN A 40 8.661 -10.197 -32.772 1.00 0.00 O ATOM 565 CB ASN A 40 8.822 -11.979 -34.871 1.00 0.00 C ATOM 566 CG ASN A 40 9.405 -11.755 -36.267 1.00 0.00 C ATOM 567 OD1 ASN A 40 9.348 -12.628 -37.110 1.00 0.00 O ATOM 568 ND2 ASN A 40 9.968 -10.612 -36.550 1.00 0.00 N ATOM 0 H ASN A 40 9.226 -13.830 -33.198 1.00 0.00 H new ATOM 0 HA ASN A 40 10.864 -11.540 -34.279 1.00 0.00 H new ATOM 0 HB2 ASN A 40 8.321 -12.946 -34.825 1.00 0.00 H new ATOM 0 HB3 ASN A 40 8.070 -11.220 -34.653 1.00 0.00 H new ATOM 0 HD21 ASN A 40 10.360 -10.452 -37.478 1.00 0.00 H new ATOM 0 HD22 ASN A 40 10.016 -9.878 -35.843 1.00 0.00 H new ATOM 575 N SER A 41 10.331 -11.075 -31.621 1.00 0.00 N ATOM 576 CA SER A 41 10.097 -10.212 -30.419 1.00 0.00 C ATOM 577 C SER A 41 8.627 -9.800 -30.307 1.00 0.00 C ATOM 578 O SER A 41 8.304 -8.629 -30.274 1.00 0.00 O ATOM 579 CB SER A 41 10.976 -8.985 -30.640 1.00 0.00 C ATOM 580 OG SER A 41 12.164 -9.117 -29.872 1.00 0.00 O ATOM 0 H SER A 41 11.112 -11.724 -31.528 1.00 0.00 H new ATOM 0 HA SER A 41 10.338 -10.738 -29.495 1.00 0.00 H new ATOM 0 HB2 SER A 41 11.221 -8.884 -31.697 1.00 0.00 H new ATOM 0 HB3 SER A 41 10.440 -8.082 -30.350 1.00 0.00 H new ATOM 0 HG SER A 41 12.733 -8.332 -30.012 1.00 0.00 H new ATOM 586 N GLY A 42 7.732 -10.745 -30.249 1.00 0.00 N ATOM 587 CA GLY A 42 6.292 -10.384 -30.141 1.00 0.00 C ATOM 588 C GLY A 42 5.425 -11.522 -30.681 1.00 0.00 C ATOM 589 O GLY A 42 5.475 -11.845 -31.851 1.00 0.00 O ATOM 0 H GLY A 42 7.933 -11.745 -30.271 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.036 -10.183 -29.101 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.095 -9.469 -30.700 1.00 0.00 H new ATOM 593 N VAL A 43 4.607 -12.118 -29.852 1.00 0.00 N ATOM 594 CA VAL A 43 3.728 -13.211 -30.364 1.00 0.00 C ATOM 595 C VAL A 43 2.797 -12.615 -31.411 1.00 0.00 C ATOM 596 O VAL A 43 2.854 -11.434 -31.684 1.00 0.00 O ATOM 597 CB VAL A 43 2.887 -13.715 -29.190 1.00 0.00 C ATOM 598 CG1 VAL A 43 2.449 -15.153 -29.472 1.00 0.00 C ATOM 599 CG2 VAL A 43 3.688 -13.692 -27.897 1.00 0.00 C ATOM 0 H VAL A 43 4.510 -11.900 -28.860 1.00 0.00 H new ATOM 0 HA VAL A 43 4.313 -14.023 -30.796 1.00 0.00 H new ATOM 0 HB VAL A 43 2.021 -13.062 -29.078 1.00 0.00 H new ATOM 0 HG11 VAL A 43 1.849 -15.520 -28.640 1.00 0.00 H new ATOM 0 HG12 VAL A 43 1.857 -15.180 -30.387 1.00 0.00 H new ATOM 0 HG13 VAL A 43 3.329 -15.785 -29.591 1.00 0.00 H new ATOM 0 HG21 VAL A 43 3.067 -14.055 -27.078 1.00 0.00 H new ATOM 0 HG22 VAL A 43 4.564 -14.333 -28.000 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.008 -12.672 -27.685 1.00 0.00 H new ATOM 609 N LEU A 44 1.924 -13.396 -31.978 1.00 0.00 N ATOM 610 CA LEU A 44 0.985 -12.822 -32.979 1.00 0.00 C ATOM 611 C LEU A 44 -0.383 -13.496 -32.878 1.00 0.00 C ATOM 612 O LEU A 44 -0.623 -14.528 -33.472 1.00 0.00 O ATOM 613 CB LEU A 44 1.615 -13.091 -34.347 1.00 0.00 C ATOM 614 CG LEU A 44 0.618 -12.710 -35.447 1.00 0.00 C ATOM 615 CD1 LEU A 44 0.845 -11.258 -35.870 1.00 0.00 C ATOM 616 CD2 LEU A 44 0.811 -13.629 -36.655 1.00 0.00 C ATOM 0 H LEU A 44 1.820 -14.394 -31.796 1.00 0.00 H new ATOM 0 HA LEU A 44 0.828 -11.756 -32.814 1.00 0.00 H new ATOM 0 HB2 LEU A 44 2.533 -12.514 -34.457 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.887 -14.143 -34.435 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.397 -12.820 -35.065 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.134 -10.991 -36.652 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.702 -10.602 -35.011 1.00 0.00 H new ATOM 0 HD13 LEU A 44 1.861 -11.144 -36.249 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.101 -13.357 -37.436 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.827 -13.522 -37.035 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.642 -14.663 -36.356 1.00 0.00 H new ATOM 628 N CYS A 45 -1.289 -12.908 -32.147 1.00 0.00 N ATOM 629 CA CYS A 45 -2.645 -13.511 -32.035 1.00 0.00 C ATOM 630 C CYS A 45 -3.469 -13.137 -33.265 1.00 0.00 C ATOM 631 O CYS A 45 -3.836 -11.993 -33.457 1.00 0.00 O ATOM 632 CB CYS A 45 -3.258 -12.917 -30.768 1.00 0.00 C ATOM 633 SG CYS A 45 -4.171 -14.209 -29.887 1.00 0.00 S ATOM 0 H CYS A 45 -1.150 -12.042 -31.626 1.00 0.00 H new ATOM 0 HA CYS A 45 -2.614 -14.599 -31.981 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -2.476 -12.507 -30.129 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -3.925 -12.094 -31.024 1.00 0.00 H new ATOM 638 N SER A 46 -3.746 -14.093 -34.106 1.00 0.00 N ATOM 639 CA SER A 46 -4.534 -13.798 -35.337 1.00 0.00 C ATOM 640 C SER A 46 -5.744 -14.733 -35.441 1.00 0.00 C ATOM 641 O SER A 46 -5.605 -15.919 -35.668 1.00 0.00 O ATOM 642 CB SER A 46 -3.565 -14.051 -36.491 1.00 0.00 C ATOM 643 OG SER A 46 -4.087 -13.469 -37.678 1.00 0.00 O ATOM 0 H SER A 46 -3.461 -15.066 -33.995 1.00 0.00 H new ATOM 0 HA SER A 46 -4.924 -12.780 -35.340 1.00 0.00 H new ATOM 0 HB2 SER A 46 -2.589 -13.624 -36.262 1.00 0.00 H new ATOM 0 HB3 SER A 46 -3.420 -15.122 -36.631 1.00 0.00 H new ATOM 0 HG SER A 46 -4.752 -12.789 -37.444 1.00 0.00 H new ATOM 649 N GLY A 47 -6.930 -14.210 -35.286 1.00 0.00 N ATOM 650 CA GLY A 47 -8.145 -15.071 -35.387 1.00 0.00 C ATOM 651 C GLY A 47 -8.489 -15.654 -34.015 1.00 0.00 C ATOM 652 O GLY A 47 -9.157 -16.663 -33.910 1.00 0.00 O ATOM 0 H GLY A 47 -7.111 -13.225 -35.094 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -8.984 -14.487 -35.764 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.972 -15.877 -36.100 1.00 0.00 H new ATOM 656 N GLY A 48 -8.044 -15.028 -32.962 1.00 0.00 N ATOM 657 CA GLY A 48 -8.356 -15.550 -31.602 1.00 0.00 C ATOM 658 C GLY A 48 -7.397 -16.690 -31.252 1.00 0.00 C ATOM 659 O GLY A 48 -7.666 -17.492 -30.380 1.00 0.00 O ATOM 0 H GLY A 48 -7.479 -14.179 -32.984 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.269 -14.750 -30.867 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -9.386 -15.905 -31.566 1.00 0.00 H new ATOM 663 N GLU A 49 -6.279 -16.771 -31.921 1.00 0.00 N ATOM 664 CA GLU A 49 -5.313 -17.865 -31.616 1.00 0.00 C ATOM 665 C GLU A 49 -3.875 -17.343 -31.674 1.00 0.00 C ATOM 666 O GLU A 49 -3.379 -16.976 -32.720 1.00 0.00 O ATOM 667 CB GLU A 49 -5.544 -18.915 -32.702 1.00 0.00 C ATOM 668 CG GLU A 49 -6.834 -19.680 -32.404 1.00 0.00 C ATOM 669 CD GLU A 49 -6.575 -21.183 -32.520 1.00 0.00 C ATOM 670 OE1 GLU A 49 -5.766 -21.562 -33.351 1.00 0.00 O ATOM 671 OE2 GLU A 49 -7.190 -21.929 -31.777 1.00 0.00 O ATOM 0 H GLU A 49 -5.994 -16.131 -32.662 1.00 0.00 H new ATOM 0 HA GLU A 49 -5.460 -18.272 -30.616 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.610 -18.435 -33.679 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.701 -19.604 -32.742 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -7.190 -19.438 -31.403 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -7.616 -19.380 -33.101 1.00 0.00 H new ATOM 678 N TRP A 50 -3.201 -17.316 -30.558 1.00 0.00 N ATOM 679 CA TRP A 50 -1.794 -16.825 -30.550 1.00 0.00 C ATOM 680 C TRP A 50 -0.925 -17.733 -31.423 1.00 0.00 C ATOM 681 O TRP A 50 -1.060 -18.940 -31.401 1.00 0.00 O ATOM 682 CB TRP A 50 -1.360 -16.895 -29.086 1.00 0.00 C ATOM 683 CG TRP A 50 -1.983 -15.763 -28.334 1.00 0.00 C ATOM 684 CD1 TRP A 50 -3.026 -15.876 -27.479 1.00 0.00 C ATOM 685 CD2 TRP A 50 -1.625 -14.353 -28.359 1.00 0.00 C ATOM 686 NE1 TRP A 50 -3.330 -14.623 -26.978 1.00 0.00 N ATOM 687 CE2 TRP A 50 -2.495 -13.651 -27.491 1.00 0.00 C ATOM 688 CE3 TRP A 50 -0.640 -13.621 -29.046 1.00 0.00 C ATOM 689 CZ2 TRP A 50 -2.391 -12.273 -27.311 1.00 0.00 C ATOM 690 CZ3 TRP A 50 -0.531 -12.234 -28.867 1.00 0.00 C ATOM 691 CH2 TRP A 50 -1.405 -11.561 -28.003 1.00 0.00 C ATOM 0 H TRP A 50 -3.563 -17.612 -29.652 1.00 0.00 H new ATOM 0 HA TRP A 50 -1.698 -15.815 -30.948 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -1.662 -17.847 -28.650 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -0.274 -16.842 -29.013 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -3.537 -16.794 -27.229 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -4.080 -14.440 -26.311 1.00 0.00 H new ATOM 0 HE3 TRP A 50 0.037 -14.130 -29.716 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -3.066 -11.759 -26.643 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 0.231 -11.682 -29.398 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -1.318 -10.493 -27.871 1.00 0.00 H new ATOM 702 N SER A 51 -0.043 -17.167 -32.202 1.00 0.00 N ATOM 703 CA SER A 51 0.812 -18.017 -33.078 1.00 0.00 C ATOM 704 C SER A 51 2.242 -17.473 -33.162 1.00 0.00 C ATOM 705 O SER A 51 2.544 -16.388 -32.697 1.00 0.00 O ATOM 706 CB SER A 51 0.144 -17.961 -34.450 1.00 0.00 C ATOM 707 OG SER A 51 -0.889 -18.935 -34.509 1.00 0.00 O ATOM 0 H SER A 51 0.121 -16.163 -32.270 1.00 0.00 H new ATOM 0 HA SER A 51 0.894 -19.033 -32.692 1.00 0.00 H new ATOM 0 HB2 SER A 51 -0.267 -16.967 -34.627 1.00 0.00 H new ATOM 0 HB3 SER A 51 0.879 -18.146 -35.233 1.00 0.00 H new ATOM 0 HG SER A 51 -1.121 -19.221 -33.601 1.00 0.00 H new ATOM 713 N ASP A 52 3.116 -18.233 -33.765 1.00 0.00 N ATOM 714 CA ASP A 52 4.539 -17.810 -33.916 1.00 0.00 C ATOM 715 C ASP A 52 5.037 -17.061 -32.681 1.00 0.00 C ATOM 716 O ASP A 52 5.328 -15.883 -32.737 1.00 0.00 O ATOM 717 CB ASP A 52 4.561 -16.901 -35.144 1.00 0.00 C ATOM 718 CG ASP A 52 5.512 -17.485 -36.190 1.00 0.00 C ATOM 719 OD1 ASP A 52 6.710 -17.443 -35.961 1.00 0.00 O ATOM 720 OD2 ASP A 52 5.027 -17.968 -37.200 1.00 0.00 O ATOM 0 H ASP A 52 2.900 -19.145 -34.167 1.00 0.00 H new ATOM 0 HA ASP A 52 5.198 -18.671 -34.030 1.00 0.00 H new ATOM 0 HB2 ASP A 52 3.558 -16.808 -35.560 1.00 0.00 H new ATOM 0 HB3 ASP A 52 4.883 -15.898 -34.863 1.00 0.00 H new ATOM 725 N PRO A 53 5.138 -17.791 -31.610 1.00 0.00 N ATOM 726 CA PRO A 53 5.630 -17.235 -30.338 1.00 0.00 C ATOM 727 C PRO A 53 7.150 -17.409 -30.255 1.00 0.00 C ATOM 728 O PRO A 53 7.684 -18.399 -30.715 1.00 0.00 O ATOM 729 CB PRO A 53 4.930 -18.100 -29.297 1.00 0.00 C ATOM 730 CG PRO A 53 4.623 -19.404 -29.989 1.00 0.00 C ATOM 731 CD PRO A 53 4.793 -19.202 -31.481 1.00 0.00 C ATOM 0 HA PRO A 53 5.430 -16.171 -30.211 1.00 0.00 H new ATOM 0 HB2 PRO A 53 5.568 -18.259 -28.427 1.00 0.00 H new ATOM 0 HB3 PRO A 53 4.018 -17.622 -28.940 1.00 0.00 H new ATOM 0 HG2 PRO A 53 5.291 -20.189 -29.634 1.00 0.00 H new ATOM 0 HG3 PRO A 53 3.606 -19.724 -29.763 1.00 0.00 H new ATOM 0 HD2 PRO A 53 5.577 -19.843 -31.884 1.00 0.00 H new ATOM 0 HD3 PRO A 53 3.878 -19.440 -32.023 1.00 0.00 H new ATOM 739 N PRO A 54 7.803 -16.440 -29.673 1.00 0.00 N ATOM 740 CA PRO A 54 9.278 -16.501 -29.538 1.00 0.00 C ATOM 741 C PRO A 54 9.672 -17.499 -28.445 1.00 0.00 C ATOM 742 O PRO A 54 8.834 -18.013 -27.730 1.00 0.00 O ATOM 743 CB PRO A 54 9.660 -15.074 -29.160 1.00 0.00 C ATOM 744 CG PRO A 54 8.436 -14.492 -28.524 1.00 0.00 C ATOM 745 CD PRO A 54 7.240 -15.217 -29.093 1.00 0.00 C ATOM 0 HA PRO A 54 9.784 -16.839 -30.442 1.00 0.00 H new ATOM 0 HB2 PRO A 54 10.504 -15.062 -28.471 1.00 0.00 H new ATOM 0 HB3 PRO A 54 9.957 -14.501 -30.038 1.00 0.00 H new ATOM 0 HG2 PRO A 54 8.475 -14.608 -27.441 1.00 0.00 H new ATOM 0 HG3 PRO A 54 8.369 -13.423 -28.728 1.00 0.00 H new ATOM 0 HD2 PRO A 54 6.507 -15.444 -28.319 1.00 0.00 H new ATOM 0 HD3 PRO A 54 6.732 -14.616 -29.847 1.00 0.00 H new ATOM 753 N THR A 55 10.937 -17.796 -28.324 1.00 0.00 N ATOM 754 CA THR A 55 11.374 -18.783 -27.294 1.00 0.00 C ATOM 755 C THR A 55 12.231 -18.126 -26.221 1.00 0.00 C ATOM 756 O THR A 55 12.680 -17.010 -26.359 1.00 0.00 O ATOM 757 CB THR A 55 12.222 -19.797 -28.060 1.00 0.00 C ATOM 758 OG1 THR A 55 13.124 -19.105 -28.901 1.00 0.00 O ATOM 759 CG2 THR A 55 11.319 -20.681 -28.911 1.00 0.00 C ATOM 0 H THR A 55 11.686 -17.399 -28.892 1.00 0.00 H new ATOM 0 HA THR A 55 10.517 -19.229 -26.789 1.00 0.00 H new ATOM 0 HB THR A 55 12.774 -20.417 -27.354 1.00 0.00 H new ATOM 0 HG1 THR A 55 13.815 -19.723 -29.218 1.00 0.00 H new ATOM 0 HG21 THR A 55 11.926 -21.403 -29.456 1.00 0.00 H new ATOM 0 HG22 THR A 55 10.616 -21.210 -28.267 1.00 0.00 H new ATOM 0 HG23 THR A 55 10.767 -20.063 -29.619 1.00 0.00 H new ATOM 767 N CYS A 56 12.484 -18.840 -25.164 1.00 0.00 N ATOM 768 CA CYS A 56 13.343 -18.303 -24.079 1.00 0.00 C ATOM 769 C CYS A 56 14.452 -19.305 -23.810 1.00 0.00 C ATOM 770 O CYS A 56 14.396 -20.090 -22.884 1.00 0.00 O ATOM 771 CB CYS A 56 12.423 -18.149 -22.869 1.00 0.00 C ATOM 772 SG CYS A 56 11.410 -16.664 -23.075 1.00 0.00 S ATOM 0 H CYS A 56 12.128 -19.783 -25.004 1.00 0.00 H new ATOM 0 HA CYS A 56 13.810 -17.349 -24.326 1.00 0.00 H new ATOM 0 HB2 CYS A 56 11.785 -19.027 -22.768 1.00 0.00 H new ATOM 0 HB3 CYS A 56 13.013 -18.077 -21.955 1.00 0.00 H new ATOM 777 N GLN A 57 15.451 -19.294 -24.640 1.00 0.00 N ATOM 778 CA GLN A 57 16.570 -20.257 -24.474 1.00 0.00 C ATOM 779 C GLN A 57 17.864 -19.509 -24.138 1.00 0.00 C ATOM 780 O GLN A 57 17.855 -18.320 -23.890 1.00 0.00 O ATOM 781 CB GLN A 57 16.711 -20.990 -25.822 1.00 0.00 C ATOM 782 CG GLN A 57 15.753 -20.419 -26.880 1.00 0.00 C ATOM 783 CD GLN A 57 15.780 -21.300 -28.130 1.00 0.00 C ATOM 784 OE1 GLN A 57 14.755 -21.555 -28.731 1.00 0.00 O ATOM 785 NE2 GLN A 57 16.919 -21.777 -28.553 1.00 0.00 N ATOM 0 H GLN A 57 15.542 -18.656 -25.431 1.00 0.00 H new ATOM 0 HA GLN A 57 16.376 -20.957 -23.661 1.00 0.00 H new ATOM 0 HB2 GLN A 57 17.738 -20.905 -26.177 1.00 0.00 H new ATOM 0 HB3 GLN A 57 16.508 -22.052 -25.682 1.00 0.00 H new ATOM 0 HG2 GLN A 57 14.740 -20.371 -26.479 1.00 0.00 H new ATOM 0 HG3 GLN A 57 16.044 -19.400 -27.135 1.00 0.00 H new ATOM 0 HE21 GLN A 57 17.780 -21.564 -28.049 1.00 0.00 H new ATOM 0 HE22 GLN A 57 16.948 -22.363 -29.387 1.00 0.00 H new ATOM 794 N ILE A 58 18.978 -20.191 -24.141 1.00 0.00 N ATOM 795 CA ILE A 58 20.273 -19.511 -23.838 1.00 0.00 C ATOM 796 C ILE A 58 21.076 -19.398 -25.133 1.00 0.00 C ATOM 797 O ILE A 58 21.492 -20.389 -25.699 1.00 0.00 O ATOM 798 CB ILE A 58 21.029 -20.392 -22.822 1.00 0.00 C ATOM 799 CG1 ILE A 58 20.133 -21.506 -22.261 1.00 0.00 C ATOM 800 CG2 ILE A 58 21.515 -19.522 -21.664 1.00 0.00 C ATOM 801 CD1 ILE A 58 20.223 -22.733 -23.170 1.00 0.00 C ATOM 0 H ILE A 58 19.048 -21.189 -24.340 1.00 0.00 H new ATOM 0 HA ILE A 58 20.117 -18.513 -23.428 1.00 0.00 H new ATOM 0 HB ILE A 58 21.870 -20.854 -23.339 1.00 0.00 H new ATOM 0 HG12 ILE A 58 20.445 -21.765 -21.249 1.00 0.00 H new ATOM 0 HG13 ILE A 58 19.101 -21.161 -22.197 1.00 0.00 H new ATOM 0 HG21 ILE A 58 22.050 -20.141 -20.944 1.00 0.00 H new ATOM 0 HG22 ILE A 58 22.183 -18.749 -22.045 1.00 0.00 H new ATOM 0 HG23 ILE A 58 20.660 -19.054 -21.176 1.00 0.00 H new ATOM 0 HD11 ILE A 58 19.588 -23.526 -22.775 1.00 0.00 H new ATOM 0 HD12 ILE A 58 19.890 -22.468 -24.173 1.00 0.00 H new ATOM 0 HD13 ILE A 58 21.255 -23.081 -23.210 1.00 0.00 H new ATOM 813 N VAL A 59 21.279 -18.209 -25.624 1.00 0.00 N ATOM 814 CA VAL A 59 22.032 -18.066 -26.900 1.00 0.00 C ATOM 815 C VAL A 59 23.505 -17.775 -26.652 1.00 0.00 C ATOM 816 O VAL A 59 23.947 -16.652 -26.703 1.00 0.00 O ATOM 817 CB VAL A 59 21.376 -16.900 -27.629 1.00 0.00 C ATOM 818 CG1 VAL A 59 19.868 -17.118 -27.656 1.00 0.00 C ATOM 819 CG2 VAL A 59 21.688 -15.588 -26.916 1.00 0.00 C ATOM 0 H VAL A 59 20.960 -17.337 -25.202 1.00 0.00 H new ATOM 0 HA VAL A 59 21.998 -18.988 -27.480 1.00 0.00 H new ATOM 0 HB VAL A 59 21.764 -16.847 -28.646 1.00 0.00 H new ATOM 0 HG11 VAL A 59 19.390 -16.288 -28.176 1.00 0.00 H new ATOM 0 HG12 VAL A 59 19.644 -18.049 -28.176 1.00 0.00 H new ATOM 0 HG13 VAL A 59 19.490 -17.173 -26.635 1.00 0.00 H new ATOM 0 HG21 VAL A 59 21.213 -14.763 -27.447 1.00 0.00 H new ATOM 0 HG22 VAL A 59 21.307 -15.629 -25.895 1.00 0.00 H new ATOM 0 HG23 VAL A 59 22.767 -15.433 -26.895 1.00 0.00 H new ATOM 829 N LYS A 60 24.285 -18.773 -26.415 1.00 0.00 N ATOM 830 CA LYS A 60 25.726 -18.507 -26.213 1.00 0.00 C ATOM 831 C LYS A 60 26.519 -19.272 -27.276 1.00 0.00 C ATOM 832 O LYS A 60 26.782 -20.451 -27.141 1.00 0.00 O ATOM 833 CB LYS A 60 26.048 -19.009 -24.807 1.00 0.00 C ATOM 834 CG LYS A 60 25.326 -18.141 -23.774 1.00 0.00 C ATOM 835 CD LYS A 60 26.241 -17.916 -22.570 1.00 0.00 C ATOM 836 CE LYS A 60 26.145 -19.118 -21.628 1.00 0.00 C ATOM 837 NZ LYS A 60 26.544 -18.595 -20.292 1.00 0.00 N ATOM 0 H LYS A 60 23.998 -19.750 -26.352 1.00 0.00 H new ATOM 0 HA LYS A 60 25.983 -17.452 -26.307 1.00 0.00 H new ATOM 0 HB2 LYS A 60 25.740 -20.049 -24.702 1.00 0.00 H new ATOM 0 HB3 LYS A 60 27.124 -18.976 -24.636 1.00 0.00 H new ATOM 0 HG2 LYS A 60 25.048 -17.185 -24.217 1.00 0.00 H new ATOM 0 HG3 LYS A 60 24.403 -18.626 -23.457 1.00 0.00 H new ATOM 0 HD2 LYS A 60 27.271 -17.781 -22.902 1.00 0.00 H new ATOM 0 HD3 LYS A 60 25.953 -17.005 -22.046 1.00 0.00 H new ATOM 0 HE2 LYS A 60 25.133 -19.523 -21.607 1.00 0.00 H new ATOM 0 HE3 LYS A 60 26.804 -19.924 -21.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 26.503 -19.363 -19.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 27.514 -18.223 -20.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 25.894 -17.834 -20.009 1.00 0.00 H new ATOM 851 N CYS A 61 26.869 -18.616 -28.347 1.00 0.00 N ATOM 852 CA CYS A 61 27.611 -19.314 -29.443 1.00 0.00 C ATOM 853 C CYS A 61 29.019 -19.707 -29.008 1.00 0.00 C ATOM 854 O CYS A 61 29.551 -19.195 -28.042 1.00 0.00 O ATOM 855 CB CYS A 61 27.692 -18.321 -30.610 1.00 0.00 C ATOM 856 SG CYS A 61 28.187 -16.694 -30.008 1.00 0.00 S ATOM 0 H CYS A 61 26.675 -17.629 -28.514 1.00 0.00 H new ATOM 0 HA CYS A 61 27.095 -20.234 -29.719 1.00 0.00 H new ATOM 0 HB2 CYS A 61 28.408 -18.676 -31.351 1.00 0.00 H new ATOM 0 HB3 CYS A 61 26.725 -18.254 -31.108 1.00 0.00 H new ATOM 861 N PRO A 62 29.571 -20.612 -29.766 1.00 0.00 N ATOM 862 CA PRO A 62 30.942 -21.114 -29.508 1.00 0.00 C ATOM 863 C PRO A 62 31.973 -20.030 -29.829 1.00 0.00 C ATOM 864 O PRO A 62 32.347 -19.237 -28.989 1.00 0.00 O ATOM 865 CB PRO A 62 31.076 -22.285 -30.484 1.00 0.00 C ATOM 866 CG PRO A 62 30.100 -21.992 -31.576 1.00 0.00 C ATOM 867 CD PRO A 62 28.961 -21.251 -30.939 1.00 0.00 C ATOM 0 HA PRO A 62 31.108 -21.401 -28.470 1.00 0.00 H new ATOM 0 HB2 PRO A 62 32.092 -22.361 -30.872 1.00 0.00 H new ATOM 0 HB3 PRO A 62 30.850 -23.233 -29.996 1.00 0.00 H new ATOM 0 HG2 PRO A 62 30.563 -21.393 -32.360 1.00 0.00 H new ATOM 0 HG3 PRO A 62 29.751 -22.913 -32.043 1.00 0.00 H new ATOM 0 HD2 PRO A 62 28.533 -20.514 -31.619 1.00 0.00 H new ATOM 0 HD3 PRO A 62 28.155 -21.926 -30.653 1.00 0.00 H new ATOM 875 N HIS A 63 32.428 -19.999 -31.048 1.00 0.00 N ATOM 876 CA HIS A 63 33.428 -18.986 -31.461 1.00 0.00 C ATOM 877 C HIS A 63 33.402 -18.876 -32.980 1.00 0.00 C ATOM 878 O HIS A 63 33.448 -19.874 -33.672 1.00 0.00 O ATOM 879 CB HIS A 63 34.768 -19.541 -30.997 1.00 0.00 C ATOM 880 CG HIS A 63 35.296 -18.718 -29.857 1.00 0.00 C ATOM 881 ND1 HIS A 63 36.293 -17.769 -30.025 1.00 0.00 N ATOM 882 CD2 HIS A 63 34.979 -18.698 -28.525 1.00 0.00 C ATOM 883 CE1 HIS A 63 36.537 -17.223 -28.819 1.00 0.00 C ATOM 884 NE2 HIS A 63 35.763 -17.753 -27.869 1.00 0.00 N ATOM 0 H HIS A 63 32.143 -20.644 -31.785 1.00 0.00 H new ATOM 0 HA HIS A 63 33.237 -17.998 -31.042 1.00 0.00 H new ATOM 0 HB2 HIS A 63 34.653 -20.579 -30.685 1.00 0.00 H new ATOM 0 HB3 HIS A 63 35.480 -19.534 -31.822 1.00 0.00 H new ATOM 0 HD2 HIS A 63 34.233 -19.321 -28.054 1.00 0.00 H new ATOM 0 HE1 HIS A 63 37.270 -16.450 -28.641 1.00 0.00 H new ATOM 0 HE2 HIS A 63 35.749 -17.517 -26.877 1.00 0.00 H new ATOM 892 N PRO A 64 33.318 -17.675 -33.454 1.00 0.00 N ATOM 893 CA PRO A 64 33.275 -17.459 -34.910 1.00 0.00 C ATOM 894 C PRO A 64 34.679 -17.608 -35.498 1.00 0.00 C ATOM 895 O PRO A 64 35.298 -16.652 -35.908 1.00 0.00 O ATOM 896 CB PRO A 64 32.765 -16.031 -35.038 1.00 0.00 C ATOM 897 CG PRO A 64 33.142 -15.355 -33.757 1.00 0.00 C ATOM 898 CD PRO A 64 33.262 -16.421 -32.698 1.00 0.00 C ATOM 0 HA PRO A 64 32.647 -18.172 -35.444 1.00 0.00 H new ATOM 0 HB2 PRO A 64 33.216 -15.529 -35.894 1.00 0.00 H new ATOM 0 HB3 PRO A 64 31.686 -16.012 -35.189 1.00 0.00 H new ATOM 0 HG2 PRO A 64 34.085 -14.819 -33.870 1.00 0.00 H new ATOM 0 HG3 PRO A 64 32.389 -14.619 -33.476 1.00 0.00 H new ATOM 0 HD2 PRO A 64 34.157 -16.281 -32.092 1.00 0.00 H new ATOM 0 HD3 PRO A 64 32.411 -16.404 -32.018 1.00 0.00 H new ATOM 906 N THR A 65 35.188 -18.805 -35.535 1.00 0.00 N ATOM 907 CA THR A 65 36.557 -19.016 -36.095 1.00 0.00 C ATOM 908 C THR A 65 36.453 -19.372 -37.573 1.00 0.00 C ATOM 909 O THR A 65 35.382 -19.392 -38.142 1.00 0.00 O ATOM 910 CB THR A 65 37.166 -20.198 -35.323 1.00 0.00 C ATOM 911 OG1 THR A 65 36.968 -21.391 -36.066 1.00 0.00 O ATOM 912 CG2 THR A 65 36.509 -20.344 -33.951 1.00 0.00 C ATOM 0 H THR A 65 34.719 -19.648 -35.203 1.00 0.00 H new ATOM 0 HA THR A 65 37.170 -18.120 -35.998 1.00 0.00 H new ATOM 0 HB THR A 65 38.231 -20.013 -35.182 1.00 0.00 H new ATOM 0 HG1 THR A 65 37.356 -22.148 -35.579 1.00 0.00 H new ATOM 0 HG21 THR A 65 36.955 -21.186 -33.422 1.00 0.00 H new ATOM 0 HG22 THR A 65 36.662 -19.431 -33.375 1.00 0.00 H new ATOM 0 HG23 THR A 65 35.440 -20.519 -34.076 1.00 0.00 H new ATOM 920 N ILE A 66 37.551 -19.672 -38.200 1.00 0.00 N ATOM 921 CA ILE A 66 37.489 -20.050 -39.635 1.00 0.00 C ATOM 922 C ILE A 66 38.897 -20.311 -40.185 1.00 0.00 C ATOM 923 O ILE A 66 39.891 -19.998 -39.561 1.00 0.00 O ATOM 924 CB ILE A 66 36.798 -18.874 -40.359 1.00 0.00 C ATOM 925 CG1 ILE A 66 37.274 -18.799 -41.812 1.00 0.00 C ATOM 926 CG2 ILE A 66 37.098 -17.549 -39.658 1.00 0.00 C ATOM 927 CD1 ILE A 66 36.526 -17.682 -42.535 1.00 0.00 C ATOM 0 H ILE A 66 38.483 -19.672 -37.785 1.00 0.00 H new ATOM 0 HA ILE A 66 36.930 -20.973 -39.786 1.00 0.00 H new ATOM 0 HB ILE A 66 35.722 -19.048 -40.334 1.00 0.00 H new ATOM 0 HG12 ILE A 66 38.348 -18.613 -41.845 1.00 0.00 H new ATOM 0 HG13 ILE A 66 37.100 -19.751 -42.313 1.00 0.00 H new ATOM 0 HG21 ILE A 66 36.600 -16.737 -40.187 1.00 0.00 H new ATOM 0 HG22 ILE A 66 36.734 -17.590 -38.631 1.00 0.00 H new ATOM 0 HG23 ILE A 66 38.174 -17.374 -39.655 1.00 0.00 H new ATOM 0 HD11 ILE A 66 36.864 -17.628 -43.570 1.00 0.00 H new ATOM 0 HD12 ILE A 66 35.456 -17.888 -42.513 1.00 0.00 H new ATOM 0 HD13 ILE A 66 36.723 -16.732 -42.039 1.00 0.00 H new ATOM 939 N SER A 67 38.977 -20.899 -41.348 1.00 0.00 N ATOM 940 CA SER A 67 40.306 -21.209 -41.954 1.00 0.00 C ATOM 941 C SER A 67 41.089 -19.928 -42.266 1.00 0.00 C ATOM 942 O SER A 67 41.242 -19.550 -43.411 1.00 0.00 O ATOM 943 CB SER A 67 39.979 -21.963 -43.243 1.00 0.00 C ATOM 944 OG SER A 67 39.844 -23.349 -42.956 1.00 0.00 O ATOM 0 H SER A 67 38.173 -21.180 -41.909 1.00 0.00 H new ATOM 0 HA SER A 67 40.933 -21.790 -41.277 1.00 0.00 H new ATOM 0 HB2 SER A 67 39.057 -21.579 -43.679 1.00 0.00 H new ATOM 0 HB3 SER A 67 40.768 -21.808 -43.979 1.00 0.00 H new ATOM 0 HG SER A 67 39.633 -23.835 -43.780 1.00 0.00 H new ATOM 950 N ASN A 68 41.599 -19.268 -41.254 1.00 0.00 N ATOM 951 CA ASN A 68 42.397 -18.015 -41.472 1.00 0.00 C ATOM 952 C ASN A 68 41.501 -16.818 -41.823 1.00 0.00 C ATOM 953 O ASN A 68 41.922 -15.681 -41.742 1.00 0.00 O ATOM 954 CB ASN A 68 43.340 -18.334 -42.635 1.00 0.00 C ATOM 955 CG ASN A 68 44.762 -17.907 -42.270 1.00 0.00 C ATOM 956 OD1 ASN A 68 45.315 -17.009 -42.875 1.00 0.00 O ATOM 957 ND2 ASN A 68 45.383 -18.518 -41.300 1.00 0.00 N ATOM 0 H ASN A 68 41.497 -19.544 -40.277 1.00 0.00 H new ATOM 0 HA ASN A 68 42.933 -17.732 -40.566 1.00 0.00 H new ATOM 0 HB2 ASN A 68 43.315 -19.401 -42.856 1.00 0.00 H new ATOM 0 HB3 ASN A 68 43.013 -17.814 -43.536 1.00 0.00 H new ATOM 0 HD21 ASN A 68 46.332 -18.243 -41.049 1.00 0.00 H new ATOM 0 HD22 ASN A 68 44.919 -19.271 -40.792 1.00 0.00 H new ATOM 964 N GLY A 69 40.278 -17.050 -42.215 1.00 0.00 N ATOM 965 CA GLY A 69 39.384 -15.911 -42.572 1.00 0.00 C ATOM 966 C GLY A 69 38.683 -15.371 -41.324 1.00 0.00 C ATOM 967 O GLY A 69 37.542 -14.966 -41.376 1.00 0.00 O ATOM 0 H GLY A 69 39.860 -17.976 -42.303 1.00 0.00 H new ATOM 0 HA2 GLY A 69 39.965 -15.118 -43.042 1.00 0.00 H new ATOM 0 HA3 GLY A 69 38.642 -16.237 -43.301 1.00 0.00 H new ATOM 971 N TYR A 70 39.360 -15.374 -40.207 1.00 0.00 N ATOM 972 CA TYR A 70 38.755 -14.868 -38.935 1.00 0.00 C ATOM 973 C TYR A 70 37.978 -13.581 -39.133 1.00 0.00 C ATOM 974 O TYR A 70 37.803 -13.085 -40.220 1.00 0.00 O ATOM 975 CB TYR A 70 39.930 -14.583 -38.002 1.00 0.00 C ATOM 976 CG TYR A 70 40.655 -13.330 -38.459 1.00 0.00 C ATOM 977 CD1 TYR A 70 41.219 -13.262 -39.743 1.00 0.00 C ATOM 978 CD2 TYR A 70 40.753 -12.229 -37.597 1.00 0.00 C ATOM 979 CE1 TYR A 70 41.879 -12.098 -40.157 1.00 0.00 C ATOM 980 CE2 TYR A 70 41.411 -11.067 -38.014 1.00 0.00 C ATOM 981 CZ TYR A 70 41.974 -11.001 -39.293 1.00 0.00 C ATOM 982 OH TYR A 70 42.620 -9.853 -39.702 1.00 0.00 O ATOM 0 H TYR A 70 40.319 -15.709 -40.118 1.00 0.00 H new ATOM 0 HA TYR A 70 38.055 -15.606 -38.544 1.00 0.00 H new ATOM 0 HB2 TYR A 70 39.573 -14.456 -36.980 1.00 0.00 H new ATOM 0 HB3 TYR A 70 40.616 -15.430 -37.996 1.00 0.00 H new ATOM 0 HD1 TYR A 70 41.144 -14.107 -40.411 1.00 0.00 H new ATOM 0 HD2 TYR A 70 40.320 -12.278 -36.609 1.00 0.00 H new ATOM 0 HE1 TYR A 70 42.315 -12.047 -41.144 1.00 0.00 H new ATOM 0 HE2 TYR A 70 41.484 -10.220 -37.348 1.00 0.00 H new ATOM 0 HH TYR A 70 42.594 -9.189 -38.982 1.00 0.00 H new ATOM 992 N LEU A 71 37.544 -13.027 -38.050 1.00 0.00 N ATOM 993 CA LEU A 71 36.792 -11.746 -38.123 1.00 0.00 C ATOM 994 C LEU A 71 37.598 -10.621 -37.474 1.00 0.00 C ATOM 995 O LEU A 71 38.523 -10.856 -36.724 1.00 0.00 O ATOM 996 CB LEU A 71 35.439 -11.984 -37.417 1.00 0.00 C ATOM 997 CG LEU A 71 35.594 -12.649 -36.039 1.00 0.00 C ATOM 998 CD1 LEU A 71 35.751 -14.151 -36.216 1.00 0.00 C ATOM 999 CD2 LEU A 71 36.801 -12.092 -35.276 1.00 0.00 C ATOM 0 H LEU A 71 37.675 -13.402 -37.110 1.00 0.00 H new ATOM 0 HA LEU A 71 36.618 -11.437 -39.154 1.00 0.00 H new ATOM 0 HB2 LEU A 71 34.923 -11.031 -37.299 1.00 0.00 H new ATOM 0 HB3 LEU A 71 34.810 -12.611 -38.049 1.00 0.00 H new ATOM 0 HG LEU A 71 34.699 -12.431 -35.456 1.00 0.00 H new ATOM 0 HD11 LEU A 71 35.861 -14.623 -35.240 1.00 0.00 H new ATOM 0 HD12 LEU A 71 34.870 -14.553 -36.716 1.00 0.00 H new ATOM 0 HD13 LEU A 71 36.635 -14.356 -36.820 1.00 0.00 H new ATOM 0 HD21 LEU A 71 36.878 -12.586 -34.307 1.00 0.00 H new ATOM 0 HD22 LEU A 71 37.710 -12.274 -35.850 1.00 0.00 H new ATOM 0 HD23 LEU A 71 36.674 -11.020 -35.128 1.00 0.00 H new ATOM 1011 N SER A 72 37.267 -9.400 -37.772 1.00 0.00 N ATOM 1012 CA SER A 72 38.026 -8.267 -37.182 1.00 0.00 C ATOM 1013 C SER A 72 37.093 -7.075 -36.958 1.00 0.00 C ATOM 1014 O SER A 72 37.524 -5.942 -36.879 1.00 0.00 O ATOM 1015 CB SER A 72 39.094 -7.927 -38.221 1.00 0.00 C ATOM 1016 OG SER A 72 39.893 -6.855 -37.739 1.00 0.00 O ATOM 0 H SER A 72 36.505 -9.137 -38.397 1.00 0.00 H new ATOM 0 HA SER A 72 38.464 -8.515 -36.215 1.00 0.00 H new ATOM 0 HB2 SER A 72 39.717 -8.800 -38.419 1.00 0.00 H new ATOM 0 HB3 SER A 72 38.625 -7.650 -39.165 1.00 0.00 H new ATOM 0 HG SER A 72 39.315 -6.161 -37.360 1.00 0.00 H new ATOM 1022 N SER A 73 35.814 -7.322 -36.867 1.00 0.00 N ATOM 1023 CA SER A 73 34.850 -6.204 -36.662 1.00 0.00 C ATOM 1024 C SER A 73 34.297 -6.215 -35.236 1.00 0.00 C ATOM 1025 O SER A 73 34.310 -5.214 -34.548 1.00 0.00 O ATOM 1026 CB SER A 73 33.732 -6.463 -37.668 1.00 0.00 C ATOM 1027 OG SER A 73 33.412 -5.251 -38.338 1.00 0.00 O ATOM 0 H SER A 73 35.395 -8.250 -36.926 1.00 0.00 H new ATOM 0 HA SER A 73 35.320 -5.231 -36.804 1.00 0.00 H new ATOM 0 HB2 SER A 73 34.044 -7.219 -38.389 1.00 0.00 H new ATOM 0 HB3 SER A 73 32.851 -6.853 -37.158 1.00 0.00 H new ATOM 0 HG SER A 73 32.695 -5.415 -38.986 1.00 0.00 H new ATOM 1033 N GLY A 74 33.803 -7.334 -34.791 1.00 0.00 N ATOM 1034 CA GLY A 74 33.240 -7.399 -33.413 1.00 0.00 C ATOM 1035 C GLY A 74 33.337 -8.827 -32.878 1.00 0.00 C ATOM 1036 O GLY A 74 32.427 -9.619 -33.024 1.00 0.00 O ATOM 0 H GLY A 74 33.764 -8.206 -35.319 1.00 0.00 H new ATOM 0 HA2 GLY A 74 33.782 -6.718 -32.757 1.00 0.00 H new ATOM 0 HA3 GLY A 74 32.200 -7.074 -33.420 1.00 0.00 H new ATOM 1040 N PHE A 75 34.431 -9.161 -32.253 1.00 0.00 N ATOM 1041 CA PHE A 75 34.586 -10.537 -31.701 1.00 0.00 C ATOM 1042 C PHE A 75 34.950 -10.472 -30.213 1.00 0.00 C ATOM 1043 O PHE A 75 35.988 -9.964 -29.838 1.00 0.00 O ATOM 1044 CB PHE A 75 35.721 -11.169 -32.518 1.00 0.00 C ATOM 1045 CG PHE A 75 36.382 -12.269 -31.715 1.00 0.00 C ATOM 1046 CD1 PHE A 75 37.410 -11.956 -30.819 1.00 0.00 C ATOM 1047 CD2 PHE A 75 35.958 -13.595 -31.858 1.00 0.00 C ATOM 1048 CE1 PHE A 75 38.014 -12.968 -30.063 1.00 0.00 C ATOM 1049 CE2 PHE A 75 36.564 -14.608 -31.105 1.00 0.00 C ATOM 1050 CZ PHE A 75 37.591 -14.293 -30.206 1.00 0.00 C ATOM 0 H PHE A 75 35.226 -8.540 -32.100 1.00 0.00 H new ATOM 0 HA PHE A 75 33.667 -11.120 -31.772 1.00 0.00 H new ATOM 0 HB2 PHE A 75 35.328 -11.573 -33.451 1.00 0.00 H new ATOM 0 HB3 PHE A 75 36.456 -10.409 -32.785 1.00 0.00 H new ATOM 0 HD1 PHE A 75 37.738 -10.933 -30.710 1.00 0.00 H new ATOM 0 HD2 PHE A 75 35.164 -13.837 -32.549 1.00 0.00 H new ATOM 0 HE1 PHE A 75 38.806 -12.725 -29.370 1.00 0.00 H new ATOM 0 HE2 PHE A 75 36.240 -15.632 -31.217 1.00 0.00 H new ATOM 0 HZ PHE A 75 38.056 -15.074 -29.623 1.00 0.00 H new ATOM 1060 N LYS A 76 34.107 -10.990 -29.365 1.00 0.00 N ATOM 1061 CA LYS A 76 34.406 -10.968 -27.906 1.00 0.00 C ATOM 1062 C LYS A 76 34.615 -12.397 -27.402 1.00 0.00 C ATOM 1063 O LYS A 76 34.018 -13.325 -27.901 1.00 0.00 O ATOM 1064 CB LYS A 76 33.166 -10.347 -27.264 1.00 0.00 C ATOM 1065 CG LYS A 76 33.353 -10.274 -25.749 1.00 0.00 C ATOM 1066 CD LYS A 76 32.007 -9.971 -25.089 1.00 0.00 C ATOM 1067 CE LYS A 76 32.219 -9.046 -23.889 1.00 0.00 C ATOM 1068 NZ LYS A 76 30.866 -8.893 -23.284 1.00 0.00 N ATOM 0 H LYS A 76 33.222 -11.429 -29.619 1.00 0.00 H new ATOM 0 HA LYS A 76 35.310 -10.408 -27.669 1.00 0.00 H new ATOM 0 HB2 LYS A 76 32.997 -9.349 -27.668 1.00 0.00 H new ATOM 0 HB3 LYS A 76 32.284 -10.941 -27.503 1.00 0.00 H new ATOM 0 HG2 LYS A 76 33.751 -11.217 -25.374 1.00 0.00 H new ATOM 0 HG3 LYS A 76 34.077 -9.499 -25.497 1.00 0.00 H new ATOM 0 HD2 LYS A 76 31.336 -9.502 -25.808 1.00 0.00 H new ATOM 0 HD3 LYS A 76 31.532 -10.898 -24.767 1.00 0.00 H new ATOM 0 HE2 LYS A 76 32.924 -9.476 -23.178 1.00 0.00 H new ATOM 0 HE3 LYS A 76 32.625 -8.083 -24.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 30.926 -8.271 -22.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 30.218 -8.476 -23.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 30.508 -9.825 -22.994 1.00 0.00 H new ATOM 1082 N ARG A 77 35.454 -12.588 -26.421 1.00 0.00 N ATOM 1083 CA ARG A 77 35.681 -13.970 -25.903 1.00 0.00 C ATOM 1084 C ARG A 77 34.346 -14.714 -25.802 1.00 0.00 C ATOM 1085 O ARG A 77 34.287 -15.924 -25.894 1.00 0.00 O ATOM 1086 CB ARG A 77 36.295 -13.780 -24.517 1.00 0.00 C ATOM 1087 CG ARG A 77 37.646 -14.489 -24.460 1.00 0.00 C ATOM 1088 CD ARG A 77 38.258 -14.316 -23.068 1.00 0.00 C ATOM 1089 NE ARG A 77 38.912 -12.978 -23.099 1.00 0.00 N ATOM 1090 CZ ARG A 77 40.201 -12.884 -23.276 1.00 0.00 C ATOM 1091 NH1 ARG A 77 41.010 -13.018 -22.262 1.00 0.00 N ATOM 1092 NH2 ARG A 77 40.681 -12.655 -24.468 1.00 0.00 N ATOM 0 H ARG A 77 35.989 -11.854 -25.958 1.00 0.00 H new ATOM 0 HA ARG A 77 36.328 -14.557 -26.555 1.00 0.00 H new ATOM 0 HB2 ARG A 77 36.420 -12.718 -24.305 1.00 0.00 H new ATOM 0 HB3 ARG A 77 35.629 -14.181 -23.754 1.00 0.00 H new ATOM 0 HG2 ARG A 77 37.522 -15.548 -24.685 1.00 0.00 H new ATOM 0 HG3 ARG A 77 38.315 -14.079 -25.216 1.00 0.00 H new ATOM 0 HD2 ARG A 77 37.494 -14.364 -22.292 1.00 0.00 H new ATOM 0 HD3 ARG A 77 38.980 -15.104 -22.854 1.00 0.00 H new ATOM 0 HE ARG A 77 38.351 -12.134 -22.982 1.00 0.00 H new ATOM 0 HH11 ARG A 77 40.635 -13.196 -21.330 1.00 0.00 H new ATOM 0 HH12 ARG A 77 42.018 -12.945 -22.401 1.00 0.00 H new ATOM 0 HH21 ARG A 77 40.048 -12.550 -25.261 1.00 0.00 H new ATOM 0 HH22 ARG A 77 41.689 -12.581 -24.606 1.00 0.00 H new ATOM 1106 N SER A 78 33.276 -13.991 -25.618 1.00 0.00 N ATOM 1107 CA SER A 78 31.936 -14.638 -25.513 1.00 0.00 C ATOM 1108 C SER A 78 30.879 -13.793 -26.237 1.00 0.00 C ATOM 1109 O SER A 78 30.955 -12.580 -26.268 1.00 0.00 O ATOM 1110 CB SER A 78 31.643 -14.690 -24.014 1.00 0.00 C ATOM 1111 OG SER A 78 32.687 -15.394 -23.355 1.00 0.00 O ATOM 0 H SER A 78 33.271 -12.974 -25.535 1.00 0.00 H new ATOM 0 HA SER A 78 31.917 -15.627 -25.970 1.00 0.00 H new ATOM 0 HB2 SER A 78 31.560 -13.680 -23.613 1.00 0.00 H new ATOM 0 HB3 SER A 78 30.687 -15.183 -23.836 1.00 0.00 H new ATOM 0 HG SER A 78 32.503 -15.428 -22.393 1.00 0.00 H new ATOM 1117 N TYR A 79 29.889 -14.425 -26.812 1.00 0.00 N ATOM 1118 CA TYR A 79 28.818 -13.661 -27.527 1.00 0.00 C ATOM 1119 C TYR A 79 27.467 -14.356 -27.322 1.00 0.00 C ATOM 1120 O TYR A 79 27.381 -15.381 -26.675 1.00 0.00 O ATOM 1121 CB TYR A 79 29.179 -13.648 -29.029 1.00 0.00 C ATOM 1122 CG TYR A 79 30.584 -14.165 -29.284 1.00 0.00 C ATOM 1123 CD1 TYR A 79 30.924 -15.490 -28.972 1.00 0.00 C ATOM 1124 CD2 TYR A 79 31.543 -13.313 -29.844 1.00 0.00 C ATOM 1125 CE1 TYR A 79 32.222 -15.954 -29.215 1.00 0.00 C ATOM 1126 CE2 TYR A 79 32.838 -13.779 -30.089 1.00 0.00 C ATOM 1127 CZ TYR A 79 33.178 -15.099 -29.773 1.00 0.00 C ATOM 1128 OH TYR A 79 34.456 -15.559 -30.012 1.00 0.00 O ATOM 0 H TYR A 79 29.774 -15.438 -26.818 1.00 0.00 H new ATOM 0 HA TYR A 79 28.746 -12.644 -27.142 1.00 0.00 H new ATOM 0 HB2 TYR A 79 28.463 -14.259 -29.579 1.00 0.00 H new ATOM 0 HB3 TYR A 79 29.092 -12.632 -29.413 1.00 0.00 H new ATOM 0 HD1 TYR A 79 30.185 -16.151 -28.545 1.00 0.00 H new ATOM 0 HD2 TYR A 79 31.282 -12.294 -30.087 1.00 0.00 H new ATOM 0 HE1 TYR A 79 32.485 -16.973 -28.972 1.00 0.00 H new ATOM 0 HE2 TYR A 79 33.576 -13.120 -30.522 1.00 0.00 H new ATOM 0 HH TYR A 79 34.990 -14.844 -30.417 1.00 0.00 H new ATOM 1138 N SER A 80 26.410 -13.809 -27.863 1.00 0.00 N ATOM 1139 CA SER A 80 25.072 -14.451 -27.688 1.00 0.00 C ATOM 1140 C SER A 80 24.034 -13.776 -28.596 1.00 0.00 C ATOM 1141 O SER A 80 24.008 -12.570 -28.697 1.00 0.00 O ATOM 1142 CB SER A 80 24.723 -14.222 -26.217 1.00 0.00 C ATOM 1143 OG SER A 80 25.512 -13.152 -25.709 1.00 0.00 O ATOM 0 H SER A 80 26.414 -12.951 -28.415 1.00 0.00 H new ATOM 0 HA SER A 80 25.081 -15.509 -27.951 1.00 0.00 H new ATOM 0 HB2 SER A 80 23.663 -13.988 -26.115 1.00 0.00 H new ATOM 0 HB3 SER A 80 24.906 -15.130 -25.642 1.00 0.00 H new ATOM 0 HG SER A 80 25.290 -13.001 -24.766 1.00 0.00 H new ATOM 1149 N TYR A 81 23.176 -14.552 -29.235 1.00 0.00 N ATOM 1150 CA TYR A 81 22.110 -13.987 -30.136 1.00 0.00 C ATOM 1151 C TYR A 81 22.505 -12.612 -30.704 1.00 0.00 C ATOM 1152 O TYR A 81 22.480 -11.619 -30.009 1.00 0.00 O ATOM 1153 CB TYR A 81 20.871 -13.885 -29.248 1.00 0.00 C ATOM 1154 CG TYR A 81 19.750 -13.222 -30.013 1.00 0.00 C ATOM 1155 CD1 TYR A 81 19.631 -13.425 -31.393 1.00 0.00 C ATOM 1156 CD2 TYR A 81 18.829 -12.408 -29.343 1.00 0.00 C ATOM 1157 CE1 TYR A 81 18.590 -12.814 -32.103 1.00 0.00 C ATOM 1158 CE2 TYR A 81 17.789 -11.796 -30.053 1.00 0.00 C ATOM 1159 CZ TYR A 81 17.670 -11.999 -31.433 1.00 0.00 C ATOM 1160 OH TYR A 81 16.644 -11.397 -32.133 1.00 0.00 O ATOM 0 H TYR A 81 23.172 -15.570 -29.167 1.00 0.00 H new ATOM 0 HA TYR A 81 21.944 -14.617 -31.010 1.00 0.00 H new ATOM 0 HB2 TYR A 81 20.563 -14.878 -28.921 1.00 0.00 H new ATOM 0 HB3 TYR A 81 21.101 -13.311 -28.351 1.00 0.00 H new ATOM 0 HD1 TYR A 81 20.342 -14.053 -31.910 1.00 0.00 H new ATOM 0 HD2 TYR A 81 18.921 -12.252 -28.278 1.00 0.00 H new ATOM 0 HE1 TYR A 81 18.497 -12.972 -33.167 1.00 0.00 H new ATOM 0 HE2 TYR A 81 17.079 -11.168 -29.536 1.00 0.00 H new ATOM 0 HH TYR A 81 16.095 -10.867 -31.518 1.00 0.00 H new ATOM 1170 N ASN A 82 22.869 -12.584 -31.971 1.00 0.00 N ATOM 1171 CA ASN A 82 23.299 -11.326 -32.683 1.00 0.00 C ATOM 1172 C ASN A 82 24.829 -11.226 -32.677 1.00 0.00 C ATOM 1173 O ASN A 82 25.514 -12.186 -32.967 1.00 0.00 O ATOM 1174 CB ASN A 82 22.681 -10.123 -31.969 1.00 0.00 C ATOM 1175 CG ASN A 82 21.179 -10.341 -31.782 1.00 0.00 C ATOM 1176 OD1 ASN A 82 20.611 -11.252 -32.349 1.00 0.00 O ATOM 1177 ND2 ASN A 82 20.508 -9.533 -31.008 1.00 0.00 N ATOM 0 H ASN A 82 22.886 -13.414 -32.563 1.00 0.00 H new ATOM 0 HA ASN A 82 22.960 -11.345 -33.719 1.00 0.00 H new ATOM 0 HB2 ASN A 82 23.159 -9.979 -31.000 1.00 0.00 H new ATOM 0 HB3 ASN A 82 22.856 -9.216 -32.548 1.00 0.00 H new ATOM 0 HD21 ASN A 82 19.505 -9.666 -30.879 1.00 0.00 H new ATOM 0 HD22 ASN A 82 20.986 -8.768 -30.532 1.00 0.00 H new ATOM 1184 N ASP A 83 25.378 -10.081 -32.379 1.00 0.00 N ATOM 1185 CA ASP A 83 26.863 -9.955 -32.398 1.00 0.00 C ATOM 1186 C ASP A 83 27.384 -10.441 -33.748 1.00 0.00 C ATOM 1187 O ASP A 83 28.030 -11.465 -33.850 1.00 0.00 O ATOM 1188 CB ASP A 83 27.368 -10.852 -31.266 1.00 0.00 C ATOM 1189 CG ASP A 83 26.535 -10.611 -30.006 1.00 0.00 C ATOM 1190 OD1 ASP A 83 26.296 -9.457 -29.689 1.00 0.00 O ATOM 1191 OD2 ASP A 83 26.153 -11.584 -29.378 1.00 0.00 O ATOM 0 H ASP A 83 24.869 -9.234 -32.125 1.00 0.00 H new ATOM 0 HA ASP A 83 27.201 -8.928 -32.261 1.00 0.00 H new ATOM 0 HB2 ASP A 83 27.303 -11.899 -31.562 1.00 0.00 H new ATOM 0 HB3 ASP A 83 28.419 -10.643 -31.064 1.00 0.00 H new ATOM 1196 N ASN A 84 27.081 -9.719 -34.790 1.00 0.00 N ATOM 1197 CA ASN A 84 27.525 -10.135 -36.150 1.00 0.00 C ATOM 1198 C ASN A 84 29.040 -9.988 -36.300 1.00 0.00 C ATOM 1199 O ASN A 84 29.570 -8.894 -36.306 1.00 0.00 O ATOM 1200 CB ASN A 84 26.793 -9.192 -37.108 1.00 0.00 C ATOM 1201 CG ASN A 84 27.365 -7.779 -36.981 1.00 0.00 C ATOM 1202 OD1 ASN A 84 28.261 -7.406 -37.712 1.00 0.00 O ATOM 1203 ND2 ASN A 84 26.881 -6.970 -36.078 1.00 0.00 N ATOM 0 H ASN A 84 26.542 -8.854 -34.758 1.00 0.00 H new ATOM 0 HA ASN A 84 27.299 -11.182 -36.350 1.00 0.00 H new ATOM 0 HB2 ASN A 84 26.899 -9.546 -38.133 1.00 0.00 H new ATOM 0 HB3 ASN A 84 25.727 -9.184 -36.882 1.00 0.00 H new ATOM 0 HD21 ASN A 84 27.255 -6.025 -35.986 1.00 0.00 H new ATOM 0 HD22 ASN A 84 26.129 -7.282 -35.464 1.00 0.00 H new ATOM 1210 N VAL A 85 29.744 -11.080 -36.437 1.00 0.00 N ATOM 1211 CA VAL A 85 31.221 -10.984 -36.602 1.00 0.00 C ATOM 1212 C VAL A 85 31.585 -10.981 -38.088 1.00 0.00 C ATOM 1213 O VAL A 85 31.346 -11.940 -38.796 1.00 0.00 O ATOM 1214 CB VAL A 85 31.810 -12.216 -35.928 1.00 0.00 C ATOM 1215 CG1 VAL A 85 31.544 -12.146 -34.423 1.00 0.00 C ATOM 1216 CG2 VAL A 85 31.176 -13.483 -36.507 1.00 0.00 C ATOM 0 H VAL A 85 29.363 -12.026 -36.442 1.00 0.00 H new ATOM 0 HA VAL A 85 31.608 -10.065 -36.161 1.00 0.00 H new ATOM 0 HB VAL A 85 32.885 -12.246 -36.107 1.00 0.00 H new ATOM 0 HG11 VAL A 85 31.965 -13.027 -33.938 1.00 0.00 H new ATOM 0 HG12 VAL A 85 32.008 -11.249 -34.013 1.00 0.00 H new ATOM 0 HG13 VAL A 85 30.469 -12.112 -34.245 1.00 0.00 H new ATOM 0 HG21 VAL A 85 31.603 -14.359 -36.019 1.00 0.00 H new ATOM 0 HG22 VAL A 85 30.100 -13.462 -36.337 1.00 0.00 H new ATOM 0 HG23 VAL A 85 31.373 -13.532 -37.578 1.00 0.00 H new ATOM 1226 N ASP A 86 32.178 -9.924 -38.562 1.00 0.00 N ATOM 1227 CA ASP A 86 32.574 -9.880 -40.001 1.00 0.00 C ATOM 1228 C ASP A 86 33.870 -10.667 -40.169 1.00 0.00 C ATOM 1229 O ASP A 86 34.799 -10.505 -39.407 1.00 0.00 O ATOM 1230 CB ASP A 86 32.789 -8.400 -40.319 1.00 0.00 C ATOM 1231 CG ASP A 86 31.990 -8.027 -41.569 1.00 0.00 C ATOM 1232 OD1 ASP A 86 30.777 -7.942 -41.469 1.00 0.00 O ATOM 1233 OD2 ASP A 86 32.604 -7.837 -42.606 1.00 0.00 O ATOM 0 H ASP A 86 32.406 -9.090 -38.021 1.00 0.00 H new ATOM 0 HA ASP A 86 31.828 -10.315 -40.666 1.00 0.00 H new ATOM 0 HB2 ASP A 86 32.473 -7.786 -39.476 1.00 0.00 H new ATOM 0 HB3 ASP A 86 33.849 -8.201 -40.479 1.00 0.00 H new ATOM 1238 N PHE A 87 33.938 -11.542 -41.133 1.00 0.00 N ATOM 1239 CA PHE A 87 35.177 -12.350 -41.290 1.00 0.00 C ATOM 1240 C PHE A 87 36.168 -11.703 -42.255 1.00 0.00 C ATOM 1241 O PHE A 87 35.916 -11.550 -43.434 1.00 0.00 O ATOM 1242 CB PHE A 87 34.703 -13.711 -41.787 1.00 0.00 C ATOM 1243 CG PHE A 87 34.140 -14.446 -40.601 1.00 0.00 C ATOM 1244 CD1 PHE A 87 34.999 -15.137 -39.742 1.00 0.00 C ATOM 1245 CD2 PHE A 87 32.768 -14.401 -40.335 1.00 0.00 C ATOM 1246 CE1 PHE A 87 34.488 -15.789 -38.620 1.00 0.00 C ATOM 1247 CE2 PHE A 87 32.257 -15.048 -39.206 1.00 0.00 C ATOM 1248 CZ PHE A 87 33.118 -15.743 -38.350 1.00 0.00 C ATOM 0 H PHE A 87 33.199 -11.731 -41.811 1.00 0.00 H new ATOM 0 HA PHE A 87 35.723 -12.432 -40.350 1.00 0.00 H new ATOM 0 HB2 PHE A 87 33.946 -13.595 -42.563 1.00 0.00 H new ATOM 0 HB3 PHE A 87 35.529 -14.268 -42.229 1.00 0.00 H new ATOM 0 HD1 PHE A 87 36.059 -15.166 -39.947 1.00 0.00 H new ATOM 0 HD2 PHE A 87 32.105 -13.868 -41.000 1.00 0.00 H new ATOM 0 HE1 PHE A 87 35.151 -16.329 -37.960 1.00 0.00 H new ATOM 0 HE2 PHE A 87 31.198 -15.011 -38.995 1.00 0.00 H new ATOM 0 HZ PHE A 87 32.723 -16.245 -37.479 1.00 0.00 H new ATOM 1258 N LYS A 88 37.307 -11.342 -41.737 1.00 0.00 N ATOM 1259 CA LYS A 88 38.371 -10.718 -42.562 1.00 0.00 C ATOM 1260 C LYS A 88 39.253 -11.810 -43.162 1.00 0.00 C ATOM 1261 O LYS A 88 40.179 -12.283 -42.533 1.00 0.00 O ATOM 1262 CB LYS A 88 39.174 -9.889 -41.565 1.00 0.00 C ATOM 1263 CG LYS A 88 39.602 -8.572 -42.216 1.00 0.00 C ATOM 1264 CD LYS A 88 41.040 -8.699 -42.726 1.00 0.00 C ATOM 1265 CE LYS A 88 41.779 -7.376 -42.509 1.00 0.00 C ATOM 1266 NZ LYS A 88 43.217 -7.752 -42.416 1.00 0.00 N ATOM 0 H LYS A 88 37.548 -11.457 -40.753 1.00 0.00 H new ATOM 0 HA LYS A 88 37.980 -10.121 -43.386 1.00 0.00 H new ATOM 0 HB2 LYS A 88 38.574 -9.689 -40.677 1.00 0.00 H new ATOM 0 HB3 LYS A 88 40.052 -10.446 -41.238 1.00 0.00 H new ATOM 0 HG2 LYS A 88 38.933 -8.327 -43.041 1.00 0.00 H new ATOM 0 HG3 LYS A 88 39.531 -7.758 -41.495 1.00 0.00 H new ATOM 0 HD2 LYS A 88 41.553 -9.505 -42.201 1.00 0.00 H new ATOM 0 HD3 LYS A 88 41.040 -8.958 -43.785 1.00 0.00 H new ATOM 0 HE2 LYS A 88 41.604 -6.685 -43.334 1.00 0.00 H new ATOM 0 HE3 LYS A 88 41.441 -6.879 -41.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 43.790 -6.897 -42.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 43.354 -8.405 -41.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 43.512 -8.217 -43.298 1.00 0.00 H new ATOM 1280 N CYS A 89 38.976 -12.226 -44.361 1.00 0.00 N ATOM 1281 CA CYS A 89 39.805 -13.298 -44.970 1.00 0.00 C ATOM 1282 C CYS A 89 41.291 -12.983 -44.805 1.00 0.00 C ATOM 1283 O CYS A 89 41.781 -11.981 -45.286 1.00 0.00 O ATOM 1284 CB CYS A 89 39.428 -13.321 -46.443 1.00 0.00 C ATOM 1285 SG CYS A 89 39.609 -15.010 -47.062 1.00 0.00 S ATOM 0 H CYS A 89 38.217 -11.874 -44.944 1.00 0.00 H new ATOM 0 HA CYS A 89 39.629 -14.262 -44.494 1.00 0.00 H new ATOM 0 HB2 CYS A 89 38.402 -12.978 -46.576 1.00 0.00 H new ATOM 0 HB3 CYS A 89 40.067 -12.641 -47.007 1.00 0.00 H new ATOM 1290 N LYS A 90 42.015 -13.833 -44.130 1.00 0.00 N ATOM 1291 CA LYS A 90 43.469 -13.576 -43.943 1.00 0.00 C ATOM 1292 C LYS A 90 44.155 -13.430 -45.308 1.00 0.00 C ATOM 1293 O LYS A 90 44.065 -14.303 -46.149 1.00 0.00 O ATOM 1294 CB LYS A 90 44.004 -14.807 -43.214 1.00 0.00 C ATOM 1295 CG LYS A 90 44.197 -14.477 -41.733 1.00 0.00 C ATOM 1296 CD LYS A 90 45.656 -14.089 -41.483 1.00 0.00 C ATOM 1297 CE LYS A 90 45.815 -13.599 -40.042 1.00 0.00 C ATOM 1298 NZ LYS A 90 45.857 -12.113 -40.144 1.00 0.00 N ATOM 0 H LYS A 90 41.664 -14.690 -43.702 1.00 0.00 H new ATOM 0 HA LYS A 90 43.656 -12.659 -43.385 1.00 0.00 H new ATOM 0 HB2 LYS A 90 43.309 -15.639 -43.325 1.00 0.00 H new ATOM 0 HB3 LYS A 90 44.950 -15.121 -43.654 1.00 0.00 H new ATOM 0 HG2 LYS A 90 43.537 -13.659 -41.443 1.00 0.00 H new ATOM 0 HG3 LYS A 90 43.928 -15.337 -41.120 1.00 0.00 H new ATOM 0 HD2 LYS A 90 46.307 -14.945 -41.661 1.00 0.00 H new ATOM 0 HD3 LYS A 90 45.960 -13.308 -42.180 1.00 0.00 H new ATOM 0 HE2 LYS A 90 44.984 -13.929 -39.419 1.00 0.00 H new ATOM 0 HE3 LYS A 90 46.727 -13.990 -39.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 45.965 -11.703 -39.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 46.662 -11.828 -40.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 44.973 -11.769 -40.571 1.00 0.00 H new ATOM 1312 N TYR A 91 44.843 -12.343 -45.533 1.00 0.00 N ATOM 1313 CA TYR A 91 45.541 -12.153 -46.842 1.00 0.00 C ATOM 1314 C TYR A 91 44.545 -12.112 -48.004 1.00 0.00 C ATOM 1315 O TYR A 91 43.344 -12.114 -47.817 1.00 0.00 O ATOM 1316 CB TYR A 91 46.474 -13.357 -46.976 1.00 0.00 C ATOM 1317 CG TYR A 91 47.871 -12.950 -46.575 1.00 0.00 C ATOM 1318 CD1 TYR A 91 48.642 -12.155 -47.432 1.00 0.00 C ATOM 1319 CD2 TYR A 91 48.393 -13.366 -45.345 1.00 0.00 C ATOM 1320 CE1 TYR A 91 49.937 -11.776 -47.057 1.00 0.00 C ATOM 1321 CE2 TYR A 91 49.688 -12.987 -44.971 1.00 0.00 C ATOM 1322 CZ TYR A 91 50.460 -12.193 -45.827 1.00 0.00 C ATOM 1323 OH TYR A 91 51.736 -11.819 -45.457 1.00 0.00 O ATOM 0 H TYR A 91 44.953 -11.577 -44.868 1.00 0.00 H new ATOM 0 HA TYR A 91 46.081 -11.207 -46.873 1.00 0.00 H new ATOM 0 HB2 TYR A 91 46.125 -14.174 -46.345 1.00 0.00 H new ATOM 0 HB3 TYR A 91 46.470 -13.723 -48.003 1.00 0.00 H new ATOM 0 HD1 TYR A 91 48.238 -11.834 -48.381 1.00 0.00 H new ATOM 0 HD2 TYR A 91 47.797 -13.979 -44.685 1.00 0.00 H new ATOM 0 HE1 TYR A 91 50.532 -11.162 -47.717 1.00 0.00 H new ATOM 0 HE2 TYR A 91 50.091 -13.307 -44.022 1.00 0.00 H new ATOM 0 HH TYR A 91 51.943 -12.192 -44.575 1.00 0.00 H new ATOM 1333 N GLY A 92 45.053 -12.061 -49.205 1.00 0.00 N ATOM 1334 CA GLY A 92 44.172 -12.001 -50.411 1.00 0.00 C ATOM 1335 C GLY A 92 43.460 -13.340 -50.622 1.00 0.00 C ATOM 1336 O GLY A 92 43.525 -13.930 -51.682 1.00 0.00 O ATOM 0 H GLY A 92 46.053 -12.058 -49.406 1.00 0.00 H new ATOM 0 HA2 GLY A 92 43.436 -11.206 -50.292 1.00 0.00 H new ATOM 0 HA3 GLY A 92 44.766 -11.756 -51.291 1.00 0.00 H new ATOM 1340 N TYR A 93 42.770 -13.813 -49.626 1.00 0.00 N ATOM 1341 CA TYR A 93 42.033 -15.104 -49.759 1.00 0.00 C ATOM 1342 C TYR A 93 40.533 -14.825 -49.871 1.00 0.00 C ATOM 1343 O TYR A 93 40.055 -13.784 -49.467 1.00 0.00 O ATOM 1344 CB TYR A 93 42.353 -15.860 -48.474 1.00 0.00 C ATOM 1345 CG TYR A 93 43.604 -16.683 -48.664 1.00 0.00 C ATOM 1346 CD1 TYR A 93 44.792 -16.066 -49.074 1.00 0.00 C ATOM 1347 CD2 TYR A 93 43.579 -18.062 -48.425 1.00 0.00 C ATOM 1348 CE1 TYR A 93 45.954 -16.828 -49.244 1.00 0.00 C ATOM 1349 CE2 TYR A 93 44.741 -18.824 -48.596 1.00 0.00 C ATOM 1350 CZ TYR A 93 45.928 -18.207 -49.006 1.00 0.00 C ATOM 1351 OH TYR A 93 47.073 -18.959 -49.174 1.00 0.00 O ATOM 0 H TYR A 93 42.682 -13.359 -48.717 1.00 0.00 H new ATOM 0 HA TYR A 93 42.318 -15.673 -50.644 1.00 0.00 H new ATOM 0 HB2 TYR A 93 42.490 -15.157 -47.652 1.00 0.00 H new ATOM 0 HB3 TYR A 93 41.518 -16.507 -48.204 1.00 0.00 H new ATOM 0 HD1 TYR A 93 44.812 -15.002 -49.259 1.00 0.00 H new ATOM 0 HD2 TYR A 93 42.663 -18.538 -48.109 1.00 0.00 H new ATOM 0 HE1 TYR A 93 46.871 -16.352 -49.559 1.00 0.00 H new ATOM 0 HE2 TYR A 93 44.721 -19.888 -48.411 1.00 0.00 H new ATOM 0 HH TYR A 93 46.881 -19.897 -48.966 1.00 0.00 H new ATOM 1361 N LYS A 94 39.785 -15.741 -50.417 1.00 0.00 N ATOM 1362 CA LYS A 94 38.317 -15.517 -50.548 1.00 0.00 C ATOM 1363 C LYS A 94 37.582 -16.254 -49.427 1.00 0.00 C ATOM 1364 O LYS A 94 37.946 -17.344 -49.048 1.00 0.00 O ATOM 1365 CB LYS A 94 37.948 -16.098 -51.915 1.00 0.00 C ATOM 1366 CG LYS A 94 38.011 -14.992 -52.971 1.00 0.00 C ATOM 1367 CD LYS A 94 37.908 -15.610 -54.367 1.00 0.00 C ATOM 1368 CE LYS A 94 39.308 -15.744 -54.970 1.00 0.00 C ATOM 1369 NZ LYS A 94 39.630 -14.390 -55.503 1.00 0.00 N ATOM 0 H LYS A 94 40.124 -16.633 -50.778 1.00 0.00 H new ATOM 0 HA LYS A 94 38.043 -14.465 -50.473 1.00 0.00 H new ATOM 0 HB2 LYS A 94 38.633 -16.905 -52.176 1.00 0.00 H new ATOM 0 HB3 LYS A 94 36.947 -16.528 -51.882 1.00 0.00 H new ATOM 0 HG2 LYS A 94 37.200 -14.281 -52.816 1.00 0.00 H new ATOM 0 HG3 LYS A 94 38.944 -14.437 -52.876 1.00 0.00 H new ATOM 0 HD2 LYS A 94 37.430 -16.588 -54.309 1.00 0.00 H new ATOM 0 HD3 LYS A 94 37.283 -14.987 -55.007 1.00 0.00 H new ATOM 0 HE2 LYS A 94 40.033 -16.055 -54.218 1.00 0.00 H new ATOM 0 HE3 LYS A 94 39.327 -16.494 -55.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 39.599 -14.410 -56.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 38.934 -13.703 -55.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 40.582 -14.111 -55.191 1.00 0.00 H new ATOM 1383 N LEU A 95 36.553 -15.674 -48.883 1.00 0.00 N ATOM 1384 CA LEU A 95 35.824 -16.370 -47.787 1.00 0.00 C ATOM 1385 C LEU A 95 34.753 -17.288 -48.371 1.00 0.00 C ATOM 1386 O LEU A 95 33.643 -16.872 -48.634 1.00 0.00 O ATOM 1387 CB LEU A 95 35.172 -15.260 -46.963 1.00 0.00 C ATOM 1388 CG LEU A 95 36.218 -14.585 -46.080 1.00 0.00 C ATOM 1389 CD1 LEU A 95 36.080 -13.068 -46.201 1.00 0.00 C ATOM 1390 CD2 LEU A 95 36.002 -15.001 -44.623 1.00 0.00 C ATOM 0 H LEU A 95 36.187 -14.759 -49.144 1.00 0.00 H new ATOM 0 HA LEU A 95 36.489 -16.987 -47.183 1.00 0.00 H new ATOM 0 HB2 LEU A 95 34.714 -14.525 -47.625 1.00 0.00 H new ATOM 0 HB3 LEU A 95 34.375 -15.674 -46.346 1.00 0.00 H new ATOM 0 HG LEU A 95 37.215 -14.888 -46.400 1.00 0.00 H new ATOM 0 HD11 LEU A 95 36.826 -12.583 -45.571 1.00 0.00 H new ATOM 0 HD12 LEU A 95 36.232 -12.770 -47.238 1.00 0.00 H new ATOM 0 HD13 LEU A 95 35.083 -12.767 -45.880 1.00 0.00 H new ATOM 0 HD21 LEU A 95 36.749 -14.519 -43.992 1.00 0.00 H new ATOM 0 HD22 LEU A 95 35.006 -14.697 -44.302 1.00 0.00 H new ATOM 0 HD23 LEU A 95 36.097 -16.083 -44.536 1.00 0.00 H new ATOM 1402 N SER A 96 35.070 -18.535 -48.566 1.00 0.00 N ATOM 1403 CA SER A 96 34.056 -19.467 -49.119 1.00 0.00 C ATOM 1404 C SER A 96 32.968 -19.707 -48.067 1.00 0.00 C ATOM 1405 O SER A 96 33.152 -20.465 -47.136 1.00 0.00 O ATOM 1406 CB SER A 96 34.821 -20.757 -49.425 1.00 0.00 C ATOM 1407 OG SER A 96 34.228 -21.839 -48.717 1.00 0.00 O ATOM 0 H SER A 96 35.982 -18.946 -48.367 1.00 0.00 H new ATOM 0 HA SER A 96 33.564 -19.081 -50.012 1.00 0.00 H new ATOM 0 HB2 SER A 96 34.804 -20.957 -50.496 1.00 0.00 H new ATOM 0 HB3 SER A 96 35.867 -20.649 -49.137 1.00 0.00 H new ATOM 0 HG SER A 96 34.065 -21.572 -47.788 1.00 0.00 H new ATOM 1413 N GLY A 97 31.842 -19.056 -48.200 1.00 0.00 N ATOM 1414 CA GLY A 97 30.752 -19.248 -47.200 1.00 0.00 C ATOM 1415 C GLY A 97 30.072 -17.908 -46.894 1.00 0.00 C ATOM 1416 O GLY A 97 29.188 -17.474 -47.605 1.00 0.00 O ATOM 0 H GLY A 97 31.631 -18.403 -48.954 1.00 0.00 H new ATOM 0 HA2 GLY A 97 30.018 -19.957 -47.583 1.00 0.00 H new ATOM 0 HA3 GLY A 97 31.160 -19.675 -46.284 1.00 0.00 H new ATOM 1420 N SER A 98 30.469 -17.255 -45.833 1.00 0.00 N ATOM 1421 CA SER A 98 29.834 -15.952 -45.473 1.00 0.00 C ATOM 1422 C SER A 98 30.834 -15.049 -44.743 1.00 0.00 C ATOM 1423 O SER A 98 31.293 -15.363 -43.664 1.00 0.00 O ATOM 1424 CB SER A 98 28.686 -16.330 -44.544 1.00 0.00 C ATOM 1425 OG SER A 98 27.540 -16.659 -45.320 1.00 0.00 O ATOM 0 H SER A 98 31.205 -17.567 -45.200 1.00 0.00 H new ATOM 0 HA SER A 98 29.497 -15.400 -46.350 1.00 0.00 H new ATOM 0 HB2 SER A 98 28.972 -17.177 -43.920 1.00 0.00 H new ATOM 0 HB3 SER A 98 28.459 -15.502 -43.873 1.00 0.00 H new ATOM 0 HG SER A 98 27.822 -16.952 -46.212 1.00 0.00 H new ATOM 1431 N SER A 99 31.169 -13.926 -45.321 1.00 0.00 N ATOM 1432 CA SER A 99 32.141 -13.001 -44.664 1.00 0.00 C ATOM 1433 C SER A 99 31.478 -12.211 -43.529 1.00 0.00 C ATOM 1434 O SER A 99 32.051 -11.281 -42.998 1.00 0.00 O ATOM 1435 CB SER A 99 32.593 -12.055 -45.775 1.00 0.00 C ATOM 1436 OG SER A 99 31.451 -11.464 -46.382 1.00 0.00 O ATOM 0 H SER A 99 30.811 -13.608 -46.222 1.00 0.00 H new ATOM 0 HA SER A 99 32.971 -13.545 -44.214 1.00 0.00 H new ATOM 0 HB2 SER A 99 33.244 -11.281 -45.367 1.00 0.00 H new ATOM 0 HB3 SER A 99 33.173 -12.600 -46.519 1.00 0.00 H new ATOM 0 HG SER A 99 31.737 -10.855 -47.094 1.00 0.00 H new ATOM 1442 N SER A 100 30.282 -12.566 -43.147 1.00 0.00 N ATOM 1443 CA SER A 100 29.610 -11.820 -42.044 1.00 0.00 C ATOM 1444 C SER A 100 28.583 -12.713 -41.341 1.00 0.00 C ATOM 1445 O SER A 100 27.475 -12.889 -41.807 1.00 0.00 O ATOM 1446 CB SER A 100 28.920 -10.641 -42.727 1.00 0.00 C ATOM 1447 OG SER A 100 27.823 -11.119 -43.495 1.00 0.00 O ATOM 0 H SER A 100 29.744 -13.334 -43.547 1.00 0.00 H new ATOM 0 HA SER A 100 30.315 -11.493 -41.280 1.00 0.00 H new ATOM 0 HB2 SER A 100 28.572 -9.926 -41.981 1.00 0.00 H new ATOM 0 HB3 SER A 100 29.626 -10.114 -43.369 1.00 0.00 H new ATOM 0 HG SER A 100 27.154 -11.516 -42.899 1.00 0.00 H new ATOM 1453 N SER A 101 28.945 -13.273 -40.218 1.00 0.00 N ATOM 1454 CA SER A 101 27.992 -14.151 -39.477 1.00 0.00 C ATOM 1455 C SER A 101 27.572 -13.484 -38.176 1.00 0.00 C ATOM 1456 O SER A 101 27.904 -12.344 -37.919 1.00 0.00 O ATOM 1457 CB SER A 101 28.760 -15.443 -39.203 1.00 0.00 C ATOM 1458 OG SER A 101 29.486 -15.814 -40.368 1.00 0.00 O ATOM 0 H SER A 101 29.860 -13.161 -39.781 1.00 0.00 H new ATOM 0 HA SER A 101 27.081 -14.342 -40.044 1.00 0.00 H new ATOM 0 HB2 SER A 101 29.442 -15.303 -38.364 1.00 0.00 H new ATOM 0 HB3 SER A 101 28.069 -16.238 -38.923 1.00 0.00 H new ATOM 0 HG SER A 101 30.439 -15.633 -40.231 1.00 0.00 H new ATOM 1464 N THR A 102 26.827 -14.173 -37.361 1.00 0.00 N ATOM 1465 CA THR A 102 26.374 -13.550 -36.094 1.00 0.00 C ATOM 1466 C THR A 102 26.049 -14.607 -35.034 1.00 0.00 C ATOM 1467 O THR A 102 25.535 -15.668 -35.328 1.00 0.00 O ATOM 1468 CB THR A 102 25.117 -12.779 -36.491 1.00 0.00 C ATOM 1469 OG1 THR A 102 25.351 -12.088 -37.710 1.00 0.00 O ATOM 1470 CG2 THR A 102 24.773 -11.780 -35.396 1.00 0.00 C ATOM 0 H THR A 102 26.515 -15.132 -37.517 1.00 0.00 H new ATOM 0 HA THR A 102 27.140 -12.914 -35.650 1.00 0.00 H new ATOM 0 HB THR A 102 24.288 -13.474 -36.623 1.00 0.00 H new ATOM 0 HG1 THR A 102 24.544 -11.594 -37.966 1.00 0.00 H new ATOM 0 HG21 THR A 102 23.876 -11.228 -35.676 1.00 0.00 H new ATOM 0 HG22 THR A 102 24.595 -12.312 -34.461 1.00 0.00 H new ATOM 0 HG23 THR A 102 25.602 -11.084 -35.265 1.00 0.00 H new ATOM 1478 N CYS A 103 26.339 -14.305 -33.797 1.00 0.00 N ATOM 1479 CA CYS A 103 26.047 -15.260 -32.691 1.00 0.00 C ATOM 1480 C CYS A 103 24.530 -15.448 -32.568 1.00 0.00 C ATOM 1481 O CYS A 103 23.872 -14.763 -31.817 1.00 0.00 O ATOM 1482 CB CYS A 103 26.611 -14.570 -31.448 1.00 0.00 C ATOM 1483 SG CYS A 103 26.456 -15.661 -30.017 1.00 0.00 S ATOM 0 H CYS A 103 26.770 -13.428 -33.504 1.00 0.00 H new ATOM 0 HA CYS A 103 26.480 -16.248 -32.845 1.00 0.00 H new ATOM 0 HB2 CYS A 103 27.658 -14.312 -31.608 1.00 0.00 H new ATOM 0 HB3 CYS A 103 26.077 -13.637 -31.265 1.00 0.00 H new ATOM 1488 N SER A 104 23.970 -16.351 -33.324 1.00 0.00 N ATOM 1489 CA SER A 104 22.489 -16.557 -33.284 1.00 0.00 C ATOM 1490 C SER A 104 21.996 -17.016 -31.920 1.00 0.00 C ATOM 1491 O SER A 104 22.764 -17.216 -31.001 1.00 0.00 O ATOM 1492 CB SER A 104 22.202 -17.620 -34.345 1.00 0.00 C ATOM 1493 OG SER A 104 23.337 -17.761 -35.190 1.00 0.00 O ATOM 0 H SER A 104 24.473 -16.959 -33.971 1.00 0.00 H new ATOM 0 HA SER A 104 21.967 -15.620 -33.476 1.00 0.00 H new ATOM 0 HB2 SER A 104 21.969 -18.572 -33.868 1.00 0.00 H new ATOM 0 HB3 SER A 104 21.329 -17.336 -34.933 1.00 0.00 H new ATOM 0 HG SER A 104 23.904 -18.488 -34.857 1.00 0.00 H new ATOM 1499 N PRO A 105 20.695 -17.133 -31.846 1.00 0.00 N ATOM 1500 CA PRO A 105 20.032 -17.532 -30.596 1.00 0.00 C ATOM 1501 C PRO A 105 20.087 -19.042 -30.383 1.00 0.00 C ATOM 1502 O PRO A 105 19.414 -19.583 -29.528 1.00 0.00 O ATOM 1503 CB PRO A 105 18.601 -17.061 -30.778 1.00 0.00 C ATOM 1504 CG PRO A 105 18.380 -17.000 -32.258 1.00 0.00 C ATOM 1505 CD PRO A 105 19.731 -16.900 -32.927 1.00 0.00 C ATOM 0 HA PRO A 105 20.514 -17.101 -29.718 1.00 0.00 H new ATOM 0 HB2 PRO A 105 17.899 -17.748 -30.305 1.00 0.00 H new ATOM 0 HB3 PRO A 105 18.449 -16.084 -30.319 1.00 0.00 H new ATOM 0 HG2 PRO A 105 17.849 -17.888 -32.601 1.00 0.00 H new ATOM 0 HG3 PRO A 105 17.762 -16.140 -32.516 1.00 0.00 H new ATOM 0 HD2 PRO A 105 19.837 -17.641 -33.720 1.00 0.00 H new ATOM 0 HD3 PRO A 105 19.876 -15.921 -33.384 1.00 0.00 H new ATOM 1513 N GLY A 106 20.882 -19.730 -31.138 1.00 0.00 N ATOM 1514 CA GLY A 106 20.969 -21.197 -30.950 1.00 0.00 C ATOM 1515 C GLY A 106 22.399 -21.557 -30.557 1.00 0.00 C ATOM 1516 O GLY A 106 22.820 -22.691 -30.665 1.00 0.00 O ATOM 0 H GLY A 106 21.474 -19.345 -31.874 1.00 0.00 H new ATOM 0 HA2 GLY A 106 20.272 -21.521 -30.177 1.00 0.00 H new ATOM 0 HA3 GLY A 106 20.688 -21.713 -31.868 1.00 0.00 H new ATOM 1520 N ASN A 107 23.148 -20.587 -30.105 1.00 0.00 N ATOM 1521 CA ASN A 107 24.560 -20.846 -29.702 1.00 0.00 C ATOM 1522 C ASN A 107 25.380 -21.255 -30.924 1.00 0.00 C ATOM 1523 O ASN A 107 25.830 -22.378 -31.032 1.00 0.00 O ATOM 1524 CB ASN A 107 24.501 -21.996 -28.690 1.00 0.00 C ATOM 1525 CG ASN A 107 23.424 -21.715 -27.638 1.00 0.00 C ATOM 1526 OD1 ASN A 107 22.318 -21.335 -27.966 1.00 0.00 O ATOM 1527 ND2 ASN A 107 23.702 -21.893 -26.376 1.00 0.00 N ATOM 0 H ASN A 107 22.840 -19.621 -29.997 1.00 0.00 H new ATOM 0 HA ASN A 107 25.030 -19.961 -29.272 1.00 0.00 H new ATOM 0 HB2 ASN A 107 24.283 -22.932 -29.204 1.00 0.00 H new ATOM 0 HB3 ASN A 107 25.471 -22.116 -28.206 1.00 0.00 H new ATOM 0 HD21 ASN A 107 22.991 -21.713 -25.667 1.00 0.00 H new ATOM 0 HD22 ASN A 107 24.630 -22.212 -26.098 1.00 0.00 H new ATOM 1534 N THR A 108 25.577 -20.357 -31.850 1.00 0.00 N ATOM 1535 CA THR A 108 26.367 -20.720 -33.058 1.00 0.00 C ATOM 1536 C THR A 108 26.727 -19.486 -33.883 1.00 0.00 C ATOM 1537 O THR A 108 26.500 -18.361 -33.481 1.00 0.00 O ATOM 1538 CB THR A 108 25.454 -21.645 -33.856 1.00 0.00 C ATOM 1539 OG1 THR A 108 24.113 -21.499 -33.405 1.00 0.00 O ATOM 1540 CG2 THR A 108 25.909 -23.084 -33.650 1.00 0.00 C ATOM 0 H THR A 108 25.229 -19.398 -31.823 1.00 0.00 H new ATOM 0 HA THR A 108 27.313 -21.191 -32.792 1.00 0.00 H new ATOM 0 HB THR A 108 25.503 -21.389 -34.914 1.00 0.00 H new ATOM 0 HG1 THR A 108 23.528 -22.093 -33.920 1.00 0.00 H new ATOM 0 HG21 THR A 108 25.263 -23.755 -34.216 1.00 0.00 H new ATOM 0 HG22 THR A 108 26.937 -23.193 -33.995 1.00 0.00 H new ATOM 0 HG23 THR A 108 25.853 -23.335 -32.591 1.00 0.00 H new ATOM 1548 N TRP A 109 27.294 -19.700 -35.037 1.00 0.00 N ATOM 1549 CA TRP A 109 27.687 -18.561 -35.908 1.00 0.00 C ATOM 1550 C TRP A 109 27.023 -18.693 -37.278 1.00 0.00 C ATOM 1551 O TRP A 109 27.506 -19.380 -38.155 1.00 0.00 O ATOM 1552 CB TRP A 109 29.207 -18.660 -35.999 1.00 0.00 C ATOM 1553 CG TRP A 109 29.776 -18.033 -34.770 1.00 0.00 C ATOM 1554 CD1 TRP A 109 30.534 -18.661 -33.835 1.00 0.00 C ATOM 1555 CD2 TRP A 109 29.623 -16.660 -34.320 1.00 0.00 C ATOM 1556 NE1 TRP A 109 30.847 -17.753 -32.839 1.00 0.00 N ATOM 1557 CE2 TRP A 109 30.311 -16.504 -33.097 1.00 0.00 C ATOM 1558 CE3 TRP A 109 28.958 -15.543 -34.857 1.00 0.00 C ATOM 1559 CZ2 TRP A 109 30.337 -15.281 -32.427 1.00 0.00 C ATOM 1560 CZ3 TRP A 109 28.986 -14.310 -34.189 1.00 0.00 C ATOM 1561 CH2 TRP A 109 29.672 -14.177 -32.976 1.00 0.00 C ATOM 0 H TRP A 109 27.503 -20.624 -35.416 1.00 0.00 H new ATOM 0 HA TRP A 109 27.373 -17.593 -35.517 1.00 0.00 H new ATOM 0 HB2 TRP A 109 29.519 -19.702 -36.076 1.00 0.00 H new ATOM 0 HB3 TRP A 109 29.571 -18.151 -36.892 1.00 0.00 H new ATOM 0 HD1 TRP A 109 30.841 -19.696 -33.864 1.00 0.00 H new ATOM 0 HE1 TRP A 109 31.405 -17.977 -32.015 1.00 0.00 H new ATOM 0 HE3 TRP A 109 28.422 -15.635 -35.790 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 30.867 -15.186 -31.491 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 28.475 -13.458 -34.613 1.00 0.00 H new ATOM 0 HH2 TRP A 109 29.689 -13.226 -32.465 1.00 0.00 H new ATOM 1572 N LYS A 110 25.906 -18.039 -37.459 1.00 0.00 N ATOM 1573 CA LYS A 110 25.190 -18.123 -38.763 1.00 0.00 C ATOM 1574 C LYS A 110 25.319 -16.796 -39.527 1.00 0.00 C ATOM 1575 O LYS A 110 25.346 -15.743 -38.923 1.00 0.00 O ATOM 1576 CB LYS A 110 23.730 -18.383 -38.391 1.00 0.00 C ATOM 1577 CG LYS A 110 23.569 -19.834 -37.934 1.00 0.00 C ATOM 1578 CD LYS A 110 22.826 -20.628 -39.011 1.00 0.00 C ATOM 1579 CE LYS A 110 21.322 -20.575 -38.737 1.00 0.00 C ATOM 1580 NZ LYS A 110 20.882 -19.244 -39.242 1.00 0.00 N ATOM 0 H LYS A 110 25.459 -17.449 -36.757 1.00 0.00 H new ATOM 0 HA LYS A 110 25.596 -18.902 -39.408 1.00 0.00 H new ATOM 0 HB2 LYS A 110 23.420 -17.704 -37.597 1.00 0.00 H new ATOM 0 HB3 LYS A 110 23.085 -18.187 -39.248 1.00 0.00 H new ATOM 0 HG2 LYS A 110 24.547 -20.279 -37.749 1.00 0.00 H new ATOM 0 HG3 LYS A 110 23.018 -19.872 -36.994 1.00 0.00 H new ATOM 0 HD2 LYS A 110 23.042 -20.215 -39.996 1.00 0.00 H new ATOM 0 HD3 LYS A 110 23.169 -21.663 -39.017 1.00 0.00 H new ATOM 0 HE2 LYS A 110 20.799 -21.383 -39.249 1.00 0.00 H new ATOM 0 HE3 LYS A 110 21.111 -20.682 -37.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 19.858 -19.262 -39.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 21.096 -18.515 -38.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 21.385 -19.024 -40.125 1.00 0.00 H new ATOM 1594 N PRO A 111 25.386 -16.882 -40.837 1.00 0.00 N ATOM 1595 CA PRO A 111 25.349 -18.192 -41.536 1.00 0.00 C ATOM 1596 C PRO A 111 26.669 -18.945 -41.337 1.00 0.00 C ATOM 1597 O PRO A 111 27.609 -18.428 -40.766 1.00 0.00 O ATOM 1598 CB PRO A 111 25.139 -17.816 -42.999 1.00 0.00 C ATOM 1599 CG PRO A 111 25.667 -16.424 -43.122 1.00 0.00 C ATOM 1600 CD PRO A 111 25.500 -15.763 -41.778 1.00 0.00 C ATOM 0 HA PRO A 111 24.569 -18.856 -41.162 1.00 0.00 H new ATOM 0 HB2 PRO A 111 25.670 -18.499 -43.662 1.00 0.00 H new ATOM 0 HB3 PRO A 111 24.085 -17.863 -43.271 1.00 0.00 H new ATOM 0 HG2 PRO A 111 26.716 -16.435 -43.417 1.00 0.00 H new ATOM 0 HG3 PRO A 111 25.125 -15.874 -43.891 1.00 0.00 H new ATOM 0 HD2 PRO A 111 26.352 -15.127 -41.539 1.00 0.00 H new ATOM 0 HD3 PRO A 111 24.613 -15.130 -41.753 1.00 0.00 H new ATOM 1608 N GLU A 112 26.729 -20.169 -41.785 1.00 0.00 N ATOM 1609 CA GLU A 112 27.969 -20.984 -41.612 1.00 0.00 C ATOM 1610 C GLU A 112 29.231 -20.128 -41.764 1.00 0.00 C ATOM 1611 O GLU A 112 29.383 -19.387 -42.714 1.00 0.00 O ATOM 1612 CB GLU A 112 27.909 -22.032 -42.723 1.00 0.00 C ATOM 1613 CG GLU A 112 26.995 -23.184 -42.297 1.00 0.00 C ATOM 1614 CD GLU A 112 27.839 -24.428 -42.017 1.00 0.00 C ATOM 1615 OE1 GLU A 112 28.286 -24.576 -40.891 1.00 0.00 O ATOM 1616 OE2 GLU A 112 28.025 -25.213 -42.933 1.00 0.00 O ATOM 0 H GLU A 112 25.967 -20.645 -42.268 1.00 0.00 H new ATOM 0 HA GLU A 112 28.017 -21.426 -40.617 1.00 0.00 H new ATOM 0 HB2 GLU A 112 27.536 -21.580 -43.642 1.00 0.00 H new ATOM 0 HB3 GLU A 112 28.910 -22.408 -42.935 1.00 0.00 H new ATOM 0 HG2 GLU A 112 26.432 -22.905 -41.406 1.00 0.00 H new ATOM 0 HG3 GLU A 112 26.267 -23.394 -43.081 1.00 0.00 H new ATOM 1623 N LEU A 113 30.145 -20.245 -40.836 1.00 0.00 N ATOM 1624 CA LEU A 113 31.412 -19.462 -40.924 1.00 0.00 C ATOM 1625 C LEU A 113 31.950 -19.510 -42.352 1.00 0.00 C ATOM 1626 O LEU A 113 31.666 -20.428 -43.096 1.00 0.00 O ATOM 1627 CB LEU A 113 32.369 -20.167 -39.959 1.00 0.00 C ATOM 1628 CG LEU A 113 32.616 -19.299 -38.714 1.00 0.00 C ATOM 1629 CD1 LEU A 113 31.342 -18.539 -38.322 1.00 0.00 C ATOM 1630 CD2 LEU A 113 33.033 -20.202 -37.552 1.00 0.00 C ATOM 0 H LEU A 113 30.068 -20.851 -40.019 1.00 0.00 H new ATOM 0 HA LEU A 113 31.279 -18.410 -40.670 1.00 0.00 H new ATOM 0 HB2 LEU A 113 31.951 -21.129 -39.662 1.00 0.00 H new ATOM 0 HB3 LEU A 113 33.315 -20.371 -40.460 1.00 0.00 H new ATOM 0 HG LEU A 113 33.402 -18.578 -38.939 1.00 0.00 H new ATOM 0 HD11 LEU A 113 31.538 -17.931 -37.439 1.00 0.00 H new ATOM 0 HD12 LEU A 113 31.035 -17.894 -39.146 1.00 0.00 H new ATOM 0 HD13 LEU A 113 30.546 -19.251 -38.103 1.00 0.00 H new ATOM 0 HD21 LEU A 113 33.210 -19.594 -36.665 1.00 0.00 H new ATOM 0 HD22 LEU A 113 32.240 -20.921 -37.347 1.00 0.00 H new ATOM 0 HD23 LEU A 113 33.947 -20.735 -37.815 1.00 0.00 H new ATOM 1642 N PRO A 114 32.703 -18.505 -42.689 1.00 0.00 N ATOM 1643 CA PRO A 114 33.282 -18.408 -44.041 1.00 0.00 C ATOM 1644 C PRO A 114 34.577 -19.219 -44.155 1.00 0.00 C ATOM 1645 O PRO A 114 35.097 -19.727 -43.182 1.00 0.00 O ATOM 1646 CB PRO A 114 33.552 -16.915 -44.193 1.00 0.00 C ATOM 1647 CG PRO A 114 33.686 -16.369 -42.801 1.00 0.00 C ATOM 1648 CD PRO A 114 33.080 -17.369 -41.844 1.00 0.00 C ATOM 0 HA PRO A 114 32.627 -18.808 -44.815 1.00 0.00 H new ATOM 0 HB2 PRO A 114 34.461 -16.741 -44.769 1.00 0.00 H new ATOM 0 HB3 PRO A 114 32.738 -16.425 -44.727 1.00 0.00 H new ATOM 0 HG2 PRO A 114 34.735 -16.198 -42.559 1.00 0.00 H new ATOM 0 HG3 PRO A 114 33.179 -15.408 -42.719 1.00 0.00 H new ATOM 0 HD2 PRO A 114 33.794 -17.666 -41.076 1.00 0.00 H new ATOM 0 HD3 PRO A 114 32.214 -16.952 -41.330 1.00 0.00 H new ATOM 1656 N LYS A 115 35.094 -19.348 -45.347 1.00 0.00 N ATOM 1657 CA LYS A 115 36.353 -20.122 -45.536 1.00 0.00 C ATOM 1658 C LYS A 115 37.357 -19.306 -46.349 1.00 0.00 C ATOM 1659 O LYS A 115 37.185 -19.094 -47.530 1.00 0.00 O ATOM 1660 CB LYS A 115 35.941 -21.377 -46.301 1.00 0.00 C ATOM 1661 CG LYS A 115 37.074 -22.403 -46.246 1.00 0.00 C ATOM 1662 CD LYS A 115 36.487 -23.800 -46.041 1.00 0.00 C ATOM 1663 CE LYS A 115 36.539 -24.573 -47.361 1.00 0.00 C ATOM 1664 NZ LYS A 115 35.507 -25.639 -47.225 1.00 0.00 N ATOM 0 H LYS A 115 34.698 -18.950 -46.199 1.00 0.00 H new ATOM 0 HA LYS A 115 36.832 -20.364 -44.587 1.00 0.00 H new ATOM 0 HB2 LYS A 115 35.034 -21.798 -45.868 1.00 0.00 H new ATOM 0 HB3 LYS A 115 35.713 -21.126 -47.337 1.00 0.00 H new ATOM 0 HG2 LYS A 115 37.652 -22.372 -47.169 1.00 0.00 H new ATOM 0 HG3 LYS A 115 37.759 -22.162 -45.433 1.00 0.00 H new ATOM 0 HD2 LYS A 115 37.048 -24.333 -45.273 1.00 0.00 H new ATOM 0 HD3 LYS A 115 35.457 -23.726 -45.691 1.00 0.00 H new ATOM 0 HE2 LYS A 115 36.324 -23.922 -48.208 1.00 0.00 H new ATOM 0 HE3 LYS A 115 37.528 -25.000 -47.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 35.483 -26.212 -48.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 35.741 -26.247 -46.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 34.575 -25.203 -47.073 1.00 0.00 H new ATOM 1678 N CYS A 116 38.409 -18.850 -45.728 1.00 0.00 N ATOM 1679 CA CYS A 116 39.421 -18.054 -46.478 1.00 0.00 C ATOM 1680 C CYS A 116 40.151 -18.965 -47.459 1.00 0.00 C ATOM 1681 O CYS A 116 40.935 -19.816 -47.087 1.00 0.00 O ATOM 1682 CB CYS A 116 40.361 -17.504 -45.401 1.00 0.00 C ATOM 1683 SG CYS A 116 40.996 -15.861 -45.852 1.00 0.00 S ATOM 0 H CYS A 116 38.612 -18.993 -44.739 1.00 0.00 H new ATOM 0 HA CYS A 116 38.988 -17.245 -47.067 1.00 0.00 H new ATOM 0 HB2 CYS A 116 39.831 -17.443 -44.450 1.00 0.00 H new ATOM 0 HB3 CYS A 116 41.195 -18.191 -45.258 1.00 0.00 H new ATOM 1688 N VAL A 117 39.874 -18.789 -48.717 1.00 0.00 N ATOM 1689 CA VAL A 117 40.512 -19.629 -49.763 1.00 0.00 C ATOM 1690 C VAL A 117 41.318 -18.766 -50.705 1.00 0.00 C ATOM 1691 O VAL A 117 41.466 -17.576 -50.510 1.00 0.00 O ATOM 1692 CB VAL A 117 39.365 -20.297 -50.527 1.00 0.00 C ATOM 1693 CG1 VAL A 117 39.047 -21.617 -49.864 1.00 0.00 C ATOM 1694 CG2 VAL A 117 38.111 -19.419 -50.511 1.00 0.00 C ATOM 0 H VAL A 117 39.223 -18.088 -49.070 1.00 0.00 H new ATOM 0 HA VAL A 117 41.188 -20.363 -49.325 1.00 0.00 H new ATOM 0 HB VAL A 117 39.671 -20.446 -51.562 1.00 0.00 H new ATOM 0 HG11 VAL A 117 38.231 -22.105 -50.397 1.00 0.00 H new ATOM 0 HG12 VAL A 117 39.929 -22.257 -49.886 1.00 0.00 H new ATOM 0 HG13 VAL A 117 38.751 -21.443 -48.830 1.00 0.00 H new ATOM 0 HG21 VAL A 117 37.312 -19.916 -51.060 1.00 0.00 H new ATOM 0 HG22 VAL A 117 37.795 -19.254 -49.481 1.00 0.00 H new ATOM 0 HG23 VAL A 117 38.332 -18.460 -50.981 1.00 0.00 H new ATOM 1704 N ARG A 118 41.840 -19.355 -51.730 1.00 0.00 N ATOM 1705 CA ARG A 118 42.633 -18.558 -52.684 1.00 0.00 C ATOM 1706 C ARG A 118 41.872 -18.400 -54.002 1.00 0.00 C ATOM 1707 O ARG A 118 42.484 -17.986 -54.971 1.00 0.00 O ATOM 1708 CB ARG A 118 43.930 -19.340 -52.891 1.00 0.00 C ATOM 1709 CG ARG A 118 44.786 -19.253 -51.625 1.00 0.00 C ATOM 1710 CD ARG A 118 46.228 -19.645 -51.955 1.00 0.00 C ATOM 1711 NE ARG A 118 46.290 -21.114 -51.715 1.00 0.00 N ATOM 1712 CZ ARG A 118 47.049 -21.867 -52.463 1.00 0.00 C ATOM 1713 NH1 ARG A 118 48.340 -21.679 -52.481 1.00 0.00 N ATOM 1714 NH2 ARG A 118 46.516 -22.808 -53.194 1.00 0.00 N ATOM 1715 OXT ARG A 118 40.688 -18.695 -54.017 1.00 0.00 O ATOM 0 H ARG A 118 41.753 -20.348 -51.948 1.00 0.00 H new ATOM 0 HA ARG A 118 42.831 -17.552 -52.313 1.00 0.00 H new ATOM 0 HB2 ARG A 118 43.706 -20.382 -53.121 1.00 0.00 H new ATOM 0 HB3 ARG A 118 44.479 -18.937 -53.742 1.00 0.00 H new ATOM 0 HG2 ARG A 118 44.756 -18.241 -51.222 1.00 0.00 H new ATOM 0 HG3 ARG A 118 44.385 -19.914 -50.856 1.00 0.00 H new ATOM 0 HD2 ARG A 118 46.477 -19.403 -52.988 1.00 0.00 H new ATOM 0 HD3 ARG A 118 46.937 -19.111 -51.323 1.00 0.00 H new ATOM 0 HE ARG A 118 45.739 -21.532 -50.965 1.00 0.00 H new ATOM 0 HH11 ARG A 118 48.756 -20.943 -51.910 1.00 0.00 H new ATOM 0 HH12 ARG A 118 48.933 -22.268 -53.066 1.00 0.00 H new ATOM 0 HH21 ARG A 118 45.507 -22.954 -53.180 1.00 0.00 H new ATOM 0 HH22 ARG A 118 47.109 -23.397 -53.779 1.00 0.00 H new