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= -2.95 K(o=-6.3,f=-4.4) USER MOD Set 1.2: A 79 TYR OH : rot -27:sc= -3.38! USER MOD Set 2.1: A 55 THR OG1 : rot 171:sc= -7.09! USER MOD Set 2.2: A 57 GLN : amide:sc= -0.649 K(o=-7.7,f=-11!) USER MOD Set 3.1: A 5 SER OG : rot 69:sc= -0.571 USER MOD Set 3.2: A 14 HIS : no HD1:sc= -13.1! C(o=-14!,f=-12!) USER MOD Single : A 1 VAL N :NH3+ -124:sc= -0.0115 (180deg=-0.288) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= 0.852 K(o=0.85,f=-1) USER MOD Single : A 8 SER OG : rot 180:sc= 0.03 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= -0.111 K(o=-0.11,f=-1.3!) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= -0.657 USER MOD Single : A 22 THR OG1 : rot 180:sc= -2.31! USER MOD Single : A 25 SER OG : rot 103:sc= 0.0338 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.159 USER MOD Single : A 29 TYR OH : rot 180:sc= -1.22 USER MOD Single : A 30 SER OG : rot 180:sc= 0.181 USER MOD Single : A 32 ASN : amide:sc= -0.0162 X(o=-0.016,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 60:sc= -5.23! USER MOD Single : A 40 ASN : amide:sc= -0.0328 X(o=-0.033,f=0) USER MOD Single : A 41 SER OG : rot 180:sc= -2.48! USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -0.627 X(o=-0.63,f=-1) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 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 -44:sc= 0.746! USER MOD Single : A 80 SER OG : rot 180:sc= -0.0106 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -4.71! C(o=-4.7!,f=-10!) USER MOD Single : A 84 ASN : amide:sc= -2.34! C(o=-2.3!,f=-4.9!) USER MOD Single : A 88 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.121) 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= 0 USER MOD Single : A 94 LYS NZ :NH3+ -108:sc= -2.26 (180deg=-5.42!) USER MOD Single : A 96 SER OG : rot -60:sc= 0.311! USER MOD Single : A 98 SER OG : rot 46:sc= -1.5! USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 2:sc= 0.758 USER MOD Single : A 101 SER OG : rot 131:sc= 0.537! USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.29 USER MOD Single : A 104 SER OG : rot 180:sc= -1.16 USER MOD Single : A 107 ASN : amide:sc= -2.55! C(o=-2.5!,f=-6.7!) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 -0.815 -14.155 -25.288 1.00 0.00 N ATOM 2 CA VAL A 1 -0.522 -14.085 -23.826 1.00 0.00 C ATOM 3 C VAL A 1 0.656 -13.139 -23.571 1.00 0.00 C ATOM 4 O VAL A 1 1.659 -13.185 -24.254 1.00 0.00 O ATOM 5 CB VAL A 1 -0.167 -15.518 -23.424 1.00 0.00 C ATOM 6 CG1 VAL A 1 1.253 -15.851 -23.889 1.00 0.00 C ATOM 7 CG2 VAL A 1 -0.247 -15.655 -21.901 1.00 0.00 C ATOM 0 H1 VAL A 1 -1.809 -13.899 -25.456 1.00 0.00 H new ATOM 0 H2 VAL A 1 -0.196 -13.493 -25.798 1.00 0.00 H new ATOM 0 H3 VAL A 1 -0.644 -15.122 -25.630 1.00 0.00 H new ATOM 0 HA VAL A 1 -1.364 -13.702 -23.250 1.00 0.00 H new ATOM 0 HB VAL A 1 -0.871 -16.206 -23.892 1.00 0.00 H new ATOM 0 HG11 VAL A 1 1.500 -16.872 -23.600 1.00 0.00 H new ATOM 0 HG12 VAL A 1 1.312 -15.756 -24.973 1.00 0.00 H new ATOM 0 HG13 VAL A 1 1.959 -15.162 -23.425 1.00 0.00 H new ATOM 0 HG21 VAL A 1 0.006 -16.676 -21.614 1.00 0.00 H new ATOM 0 HG22 VAL A 1 0.455 -14.963 -21.436 1.00 0.00 H new ATOM 0 HG23 VAL A 1 -1.259 -15.424 -21.568 1.00 0.00 H new ATOM 19 N LYS A 2 0.541 -12.281 -22.594 1.00 0.00 N ATOM 20 CA LYS A 2 1.655 -11.333 -22.300 1.00 0.00 C ATOM 21 C LYS A 2 1.857 -11.200 -20.790 1.00 0.00 C ATOM 22 O LYS A 2 1.141 -11.784 -20.001 1.00 0.00 O ATOM 23 CB LYS A 2 1.209 -10.000 -22.902 1.00 0.00 C ATOM 24 CG LYS A 2 -0.037 -9.497 -22.170 1.00 0.00 C ATOM 25 CD LYS A 2 -1.243 -9.553 -23.110 1.00 0.00 C ATOM 26 CE LYS A 2 -1.720 -8.129 -23.414 1.00 0.00 C ATOM 27 NZ LYS A 2 -1.952 -8.105 -24.885 1.00 0.00 N ATOM 0 H LYS A 2 -0.274 -12.195 -21.987 1.00 0.00 H new ATOM 0 HA LYS A 2 2.604 -11.672 -22.715 1.00 0.00 H new ATOM 0 HB2 LYS A 2 2.011 -9.267 -22.821 1.00 0.00 H new ATOM 0 HB3 LYS A 2 0.995 -10.123 -23.964 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -0.223 -10.108 -21.287 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.120 -8.475 -21.824 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -0.973 -10.063 -24.035 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -2.048 -10.128 -22.652 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -2.633 -7.893 -22.867 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -0.973 -7.392 -23.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -2.281 -7.160 -25.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -1.064 -8.326 -25.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.673 -8.812 -25.134 1.00 0.00 H new ATOM 41 N CYS A 3 2.834 -10.438 -20.386 1.00 0.00 N ATOM 42 CA CYS A 3 3.096 -10.268 -18.929 1.00 0.00 C ATOM 43 C CYS A 3 3.901 -8.997 -18.676 1.00 0.00 C ATOM 44 O CYS A 3 5.092 -8.959 -18.898 1.00 0.00 O ATOM 45 CB CYS A 3 3.929 -11.484 -18.544 1.00 0.00 C ATOM 46 SG CYS A 3 3.567 -11.970 -16.840 1.00 0.00 S ATOM 0 H CYS A 3 3.464 -9.924 -21.002 1.00 0.00 H new ATOM 0 HA CYS A 3 2.173 -10.187 -18.355 1.00 0.00 H new ATOM 0 HB2 CYS A 3 3.713 -12.311 -19.220 1.00 0.00 H new ATOM 0 HB3 CYS A 3 4.990 -11.256 -18.648 1.00 0.00 H new ATOM 51 N GLN A 4 3.282 -7.961 -18.198 1.00 0.00 N ATOM 52 CA GLN A 4 4.063 -6.726 -17.928 1.00 0.00 C ATOM 53 C GLN A 4 4.769 -6.860 -16.588 1.00 0.00 C ATOM 54 O GLN A 4 4.605 -7.834 -15.880 1.00 0.00 O ATOM 55 CB GLN A 4 3.054 -5.581 -17.883 1.00 0.00 C ATOM 56 CG GLN A 4 1.875 -5.962 -16.986 1.00 0.00 C ATOM 57 CD GLN A 4 1.539 -4.791 -16.061 1.00 0.00 C ATOM 58 OE1 GLN A 4 0.714 -3.961 -16.387 1.00 0.00 O ATOM 59 NE2 GLN A 4 2.149 -4.688 -14.911 1.00 0.00 N ATOM 0 H GLN A 4 2.286 -7.913 -17.985 1.00 0.00 H new ATOM 0 HA GLN A 4 4.820 -6.549 -18.692 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.533 -4.677 -17.505 1.00 0.00 H new ATOM 0 HB3 GLN A 4 2.699 -5.357 -18.889 1.00 0.00 H new ATOM 0 HG2 GLN A 4 1.008 -6.218 -17.596 1.00 0.00 H new ATOM 0 HG3 GLN A 4 2.123 -6.845 -16.397 1.00 0.00 H new ATOM 0 HE21 GLN A 4 2.842 -5.385 -14.637 1.00 0.00 H new ATOM 0 HE22 GLN A 4 1.933 -3.911 -14.287 1.00 0.00 H new ATOM 68 N SER A 5 5.551 -5.892 -16.232 1.00 0.00 N ATOM 69 CA SER A 5 6.268 -5.964 -14.930 1.00 0.00 C ATOM 70 C SER A 5 5.261 -6.196 -13.799 1.00 0.00 C ATOM 71 O SER A 5 4.138 -5.737 -13.866 1.00 0.00 O ATOM 72 CB SER A 5 6.954 -4.608 -14.784 1.00 0.00 C ATOM 73 OG SER A 5 8.305 -4.804 -14.389 1.00 0.00 O ATOM 0 H SER A 5 5.728 -5.052 -16.782 1.00 0.00 H new ATOM 0 HA SER A 5 6.987 -6.782 -14.887 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.915 -4.064 -15.728 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.431 -4.001 -14.045 1.00 0.00 H new ATOM 0 HG SER A 5 8.804 -5.216 -15.125 1.00 0.00 H new ATOM 79 N PRO A 6 5.695 -6.919 -12.801 1.00 0.00 N ATOM 80 CA PRO A 6 4.815 -7.236 -11.645 1.00 0.00 C ATOM 81 C PRO A 6 4.542 -5.993 -10.793 1.00 0.00 C ATOM 82 O PRO A 6 5.330 -5.073 -10.764 1.00 0.00 O ATOM 83 CB PRO A 6 5.629 -8.254 -10.855 1.00 0.00 C ATOM 84 CG PRO A 6 7.047 -7.976 -11.217 1.00 0.00 C ATOM 85 CD PRO A 6 7.032 -7.508 -12.651 1.00 0.00 C ATOM 0 HA PRO A 6 3.836 -7.605 -11.952 1.00 0.00 H new ATOM 0 HB2 PRO A 6 5.466 -8.144 -9.783 1.00 0.00 H new ATOM 0 HB3 PRO A 6 5.347 -9.274 -11.117 1.00 0.00 H new ATOM 0 HG2 PRO A 6 7.473 -7.215 -10.564 1.00 0.00 H new ATOM 0 HG3 PRO A 6 7.660 -8.871 -11.106 1.00 0.00 H new ATOM 0 HD2 PRO A 6 7.817 -6.777 -12.844 1.00 0.00 H new ATOM 0 HD3 PRO A 6 7.188 -8.334 -13.345 1.00 0.00 H new ATOM 93 N PRO A 7 3.427 -6.021 -10.115 1.00 0.00 N ATOM 94 CA PRO A 7 3.039 -4.893 -9.234 1.00 0.00 C ATOM 95 C PRO A 7 3.852 -4.929 -7.936 1.00 0.00 C ATOM 96 O PRO A 7 4.581 -5.866 -7.674 1.00 0.00 O ATOM 97 CB PRO A 7 1.563 -5.153 -8.952 1.00 0.00 C ATOM 98 CG PRO A 7 1.381 -6.628 -9.134 1.00 0.00 C ATOM 99 CD PRO A 7 2.431 -7.097 -10.110 1.00 0.00 C ATOM 0 HA PRO A 7 3.219 -3.916 -9.682 1.00 0.00 H new ATOM 0 HB2 PRO A 7 1.295 -4.845 -7.941 1.00 0.00 H new ATOM 0 HB3 PRO A 7 0.927 -4.591 -9.635 1.00 0.00 H new ATOM 0 HG2 PRO A 7 1.484 -7.147 -8.181 1.00 0.00 H new ATOM 0 HG3 PRO A 7 0.382 -6.848 -9.511 1.00 0.00 H new ATOM 0 HD2 PRO A 7 2.870 -8.044 -9.797 1.00 0.00 H new ATOM 0 HD3 PRO A 7 2.010 -7.254 -11.103 1.00 0.00 H new ATOM 107 N SER A 8 3.728 -3.920 -7.117 1.00 0.00 N ATOM 108 CA SER A 8 4.489 -3.903 -5.834 1.00 0.00 C ATOM 109 C SER A 8 3.935 -4.962 -4.884 1.00 0.00 C ATOM 110 O SER A 8 3.002 -5.671 -5.205 1.00 0.00 O ATOM 111 CB SER A 8 4.274 -2.505 -5.259 1.00 0.00 C ATOM 112 OG SER A 8 4.384 -1.547 -6.303 1.00 0.00 O ATOM 0 H SER A 8 3.133 -3.107 -7.280 1.00 0.00 H new ATOM 0 HA SER A 8 5.547 -4.123 -5.979 1.00 0.00 H new ATOM 0 HB2 SER A 8 3.292 -2.439 -4.791 1.00 0.00 H new ATOM 0 HB3 SER A 8 5.012 -2.301 -4.483 1.00 0.00 H new ATOM 0 HG SER A 8 4.245 -0.648 -5.938 1.00 0.00 H new ATOM 118 N ILE A 9 4.503 -5.080 -3.720 1.00 0.00 N ATOM 119 CA ILE A 9 4.003 -6.103 -2.756 1.00 0.00 C ATOM 120 C ILE A 9 4.102 -5.624 -1.321 1.00 0.00 C ATOM 121 O ILE A 9 4.356 -4.470 -1.037 1.00 0.00 O ATOM 122 CB ILE A 9 4.869 -7.351 -2.936 1.00 0.00 C ATOM 123 CG1 ILE A 9 6.291 -6.988 -3.388 1.00 0.00 C ATOM 124 CG2 ILE A 9 4.211 -8.255 -3.965 1.00 0.00 C ATOM 125 CD1 ILE A 9 7.294 -7.621 -2.425 1.00 0.00 C ATOM 0 H ILE A 9 5.288 -4.517 -3.392 1.00 0.00 H new ATOM 0 HA ILE A 9 2.951 -6.305 -2.955 1.00 0.00 H new ATOM 0 HB ILE A 9 4.951 -7.864 -1.978 1.00 0.00 H new ATOM 0 HG12 ILE A 9 6.466 -7.345 -4.403 1.00 0.00 H new ATOM 0 HG13 ILE A 9 6.416 -5.905 -3.405 1.00 0.00 H new ATOM 0 HG21 ILE A 9 4.818 -9.150 -4.104 1.00 0.00 H new ATOM 0 HG22 ILE A 9 3.218 -8.540 -3.617 1.00 0.00 H new ATOM 0 HG23 ILE A 9 4.124 -7.724 -4.913 1.00 0.00 H new ATOM 0 HD11 ILE A 9 8.307 -7.369 -2.738 1.00 0.00 H new ATOM 0 HD12 ILE A 9 7.120 -7.242 -1.418 1.00 0.00 H new ATOM 0 HD13 ILE A 9 7.171 -8.704 -2.432 1.00 0.00 H new ATOM 137 N SER A 10 3.875 -6.526 -0.418 1.00 0.00 N ATOM 138 CA SER A 10 3.916 -6.183 1.022 1.00 0.00 C ATOM 139 C SER A 10 5.154 -5.344 1.360 1.00 0.00 C ATOM 140 O SER A 10 6.256 -5.846 1.424 1.00 0.00 O ATOM 141 CB SER A 10 3.959 -7.525 1.751 1.00 0.00 C ATOM 142 OG SER A 10 3.760 -7.311 3.143 1.00 0.00 O ATOM 0 H SER A 10 3.659 -7.502 -0.620 1.00 0.00 H new ATOM 0 HA SER A 10 3.055 -5.583 1.315 1.00 0.00 H new ATOM 0 HB2 SER A 10 3.188 -8.189 1.360 1.00 0.00 H new ATOM 0 HB3 SER A 10 4.918 -8.014 1.580 1.00 0.00 H new ATOM 0 HG SER A 10 3.786 -8.171 3.613 1.00 0.00 H new ATOM 148 N ASN A 11 4.973 -4.071 1.588 1.00 0.00 N ATOM 149 CA ASN A 11 6.134 -3.196 1.936 1.00 0.00 C ATOM 150 C ASN A 11 7.354 -3.547 1.080 1.00 0.00 C ATOM 151 O ASN A 11 8.483 -3.331 1.476 1.00 0.00 O ATOM 152 CB ASN A 11 6.418 -3.487 3.409 1.00 0.00 C ATOM 153 CG ASN A 11 5.555 -2.576 4.283 1.00 0.00 C ATOM 154 OD1 ASN A 11 4.547 -3.000 4.813 1.00 0.00 O ATOM 155 ND2 ASN A 11 5.910 -1.333 4.459 1.00 0.00 N ATOM 0 H ASN A 11 4.071 -3.597 1.549 1.00 0.00 H new ATOM 0 HA ASN A 11 5.918 -2.143 1.756 1.00 0.00 H new ATOM 0 HB2 ASN A 11 6.204 -4.532 3.632 1.00 0.00 H new ATOM 0 HB3 ASN A 11 7.474 -3.324 3.626 1.00 0.00 H new ATOM 0 HD21 ASN A 11 5.342 -0.718 5.041 1.00 0.00 H new ATOM 0 HD22 ASN A 11 6.756 -0.976 4.014 1.00 0.00 H new ATOM 162 N GLY A 12 7.142 -4.082 -0.089 1.00 0.00 N ATOM 163 CA GLY A 12 8.296 -4.437 -0.962 1.00 0.00 C ATOM 164 C GLY A 12 7.948 -4.117 -2.415 1.00 0.00 C ATOM 165 O GLY A 12 6.818 -3.817 -2.743 1.00 0.00 O ATOM 0 H GLY A 12 6.222 -4.289 -0.478 1.00 0.00 H new ATOM 0 HA2 GLY A 12 9.182 -3.880 -0.657 1.00 0.00 H new ATOM 0 HA3 GLY A 12 8.533 -5.496 -0.858 1.00 0.00 H new ATOM 169 N ARG A 13 8.913 -4.175 -3.289 1.00 0.00 N ATOM 170 CA ARG A 13 8.642 -3.870 -4.723 1.00 0.00 C ATOM 171 C ARG A 13 9.285 -4.924 -5.620 1.00 0.00 C ATOM 172 O ARG A 13 9.888 -5.869 -5.157 1.00 0.00 O ATOM 173 CB ARG A 13 9.278 -2.500 -4.968 1.00 0.00 C ATOM 174 CG ARG A 13 10.655 -2.444 -4.303 1.00 0.00 C ATOM 175 CD ARG A 13 11.591 -1.574 -5.143 1.00 0.00 C ATOM 176 NE ARG A 13 12.603 -1.060 -4.180 1.00 0.00 N ATOM 177 CZ ARG A 13 13.395 -0.084 -4.528 1.00 0.00 C ATOM 178 NH1 ARG A 13 13.005 1.154 -4.392 1.00 0.00 N ATOM 179 NH2 ARG A 13 14.577 -0.346 -5.015 1.00 0.00 N ATOM 0 H ARG A 13 9.879 -4.421 -3.073 1.00 0.00 H new ATOM 0 HA ARG A 13 7.575 -3.870 -4.947 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.373 -2.319 -6.039 1.00 0.00 H new ATOM 0 HB3 ARG A 13 8.638 -1.714 -4.567 1.00 0.00 H new ATOM 0 HG2 ARG A 13 10.568 -2.036 -3.296 1.00 0.00 H new ATOM 0 HG3 ARG A 13 11.065 -3.449 -4.206 1.00 0.00 H new ATOM 0 HD2 ARG A 13 12.061 -2.153 -5.938 1.00 0.00 H new ATOM 0 HD3 ARG A 13 11.049 -0.757 -5.620 1.00 0.00 H new ATOM 0 HE ARG A 13 12.677 -1.471 -3.249 1.00 0.00 H new ATOM 0 HH11 ARG A 13 12.080 1.359 -4.013 1.00 0.00 H new ATOM 0 HH12 ARG A 13 13.625 1.917 -4.664 1.00 0.00 H new ATOM 0 HH21 ARG A 13 14.881 -1.314 -5.123 1.00 0.00 H new ATOM 0 HH22 ARG A 13 15.197 0.417 -5.287 1.00 0.00 H new ATOM 193 N HIS A 14 9.152 -4.765 -6.902 1.00 0.00 N ATOM 194 CA HIS A 14 9.747 -5.749 -7.850 1.00 0.00 C ATOM 195 C HIS A 14 10.752 -5.052 -8.769 1.00 0.00 C ATOM 196 O HIS A 14 10.683 -3.857 -8.984 1.00 0.00 O ATOM 197 CB HIS A 14 8.563 -6.276 -8.647 1.00 0.00 C ATOM 198 CG HIS A 14 8.072 -5.213 -9.582 1.00 0.00 C ATOM 199 ND1 HIS A 14 8.228 -5.321 -10.950 1.00 0.00 N ATOM 200 CD2 HIS A 14 7.382 -4.046 -9.372 1.00 0.00 C ATOM 201 CE1 HIS A 14 7.634 -4.263 -11.512 1.00 0.00 C ATOM 202 NE2 HIS A 14 7.104 -3.445 -10.596 1.00 0.00 N ATOM 0 H HIS A 14 8.653 -3.991 -7.341 1.00 0.00 H new ATOM 0 HA HIS A 14 10.288 -6.548 -7.343 1.00 0.00 H new ATOM 0 HB2 HIS A 14 8.856 -7.162 -9.210 1.00 0.00 H new ATOM 0 HB3 HIS A 14 7.763 -6.578 -7.971 1.00 0.00 H new ATOM 0 HD2 HIS A 14 7.098 -3.654 -8.406 1.00 0.00 H new ATOM 0 HE1 HIS A 14 7.588 -4.090 -12.577 1.00 0.00 H new ATOM 0 HE2 HIS A 14 6.605 -2.571 -10.759 1.00 0.00 H new ATOM 210 N ASN A 15 11.686 -5.782 -9.312 1.00 0.00 N ATOM 211 CA ASN A 15 12.689 -5.148 -10.212 1.00 0.00 C ATOM 212 C ASN A 15 13.588 -6.211 -10.850 1.00 0.00 C ATOM 213 O ASN A 15 14.799 -6.108 -10.825 1.00 0.00 O ATOM 214 CB ASN A 15 13.507 -4.228 -9.305 1.00 0.00 C ATOM 215 CG ASN A 15 13.955 -2.998 -10.098 1.00 0.00 C ATOM 216 OD1 ASN A 15 13.221 -2.493 -10.924 1.00 0.00 O ATOM 217 ND2 ASN A 15 15.137 -2.492 -9.879 1.00 0.00 N ATOM 0 H ASN A 15 11.798 -6.786 -9.172 1.00 0.00 H new ATOM 0 HA ASN A 15 12.218 -4.604 -11.031 1.00 0.00 H new ATOM 0 HB2 ASN A 15 12.910 -3.922 -8.445 1.00 0.00 H new ATOM 0 HB3 ASN A 15 14.376 -4.760 -8.917 1.00 0.00 H new ATOM 0 HD21 ASN A 15 15.445 -1.672 -10.401 1.00 0.00 H new ATOM 0 HD22 ASN A 15 15.753 -2.916 -9.185 1.00 0.00 H new ATOM 224 N GLY A 16 13.008 -7.227 -11.428 1.00 0.00 N ATOM 225 CA GLY A 16 13.838 -8.283 -12.071 1.00 0.00 C ATOM 226 C GLY A 16 14.792 -7.628 -13.069 1.00 0.00 C ATOM 227 O GLY A 16 15.958 -7.429 -12.789 1.00 0.00 O ATOM 0 H GLY A 16 12.000 -7.371 -11.483 1.00 0.00 H new ATOM 0 HA2 GLY A 16 14.401 -8.831 -11.316 1.00 0.00 H new ATOM 0 HA3 GLY A 16 13.200 -9.006 -12.579 1.00 0.00 H new ATOM 231 N TYR A 17 14.303 -7.281 -14.229 1.00 0.00 N ATOM 232 CA TYR A 17 15.178 -6.627 -15.245 1.00 0.00 C ATOM 233 C TYR A 17 14.413 -6.432 -16.556 1.00 0.00 C ATOM 234 O TYR A 17 14.968 -6.541 -17.631 1.00 0.00 O ATOM 235 CB TYR A 17 16.351 -7.586 -15.449 1.00 0.00 C ATOM 236 CG TYR A 17 17.637 -6.797 -15.468 1.00 0.00 C ATOM 237 CD1 TYR A 17 17.819 -5.779 -16.412 1.00 0.00 C ATOM 238 CD2 TYR A 17 18.645 -7.080 -14.539 1.00 0.00 C ATOM 239 CE1 TYR A 17 19.011 -5.045 -16.428 1.00 0.00 C ATOM 240 CE2 TYR A 17 19.837 -6.345 -14.556 1.00 0.00 C ATOM 241 CZ TYR A 17 20.020 -5.328 -15.500 1.00 0.00 C ATOM 242 OH TYR A 17 21.196 -4.605 -15.516 1.00 0.00 O ATOM 0 H TYR A 17 13.335 -7.422 -14.517 1.00 0.00 H new ATOM 0 HA TYR A 17 15.513 -5.642 -14.920 1.00 0.00 H new ATOM 0 HB2 TYR A 17 16.376 -8.326 -14.649 1.00 0.00 H new ATOM 0 HB3 TYR A 17 16.231 -8.133 -16.384 1.00 0.00 H new ATOM 0 HD1 TYR A 17 17.040 -5.560 -17.127 1.00 0.00 H new ATOM 0 HD2 TYR A 17 18.504 -7.864 -13.810 1.00 0.00 H new ATOM 0 HE1 TYR A 17 19.152 -4.260 -17.156 1.00 0.00 H new ATOM 0 HE2 TYR A 17 20.616 -6.563 -13.840 1.00 0.00 H new ATOM 0 HH TYR A 17 21.788 -4.928 -14.806 1.00 0.00 H new ATOM 252 N GLU A 18 13.143 -6.142 -16.477 1.00 0.00 N ATOM 253 CA GLU A 18 12.348 -5.940 -17.722 1.00 0.00 C ATOM 254 C GLU A 18 10.878 -5.690 -17.382 1.00 0.00 C ATOM 255 O GLU A 18 10.493 -5.648 -16.230 1.00 0.00 O ATOM 256 CB GLU A 18 12.495 -7.243 -18.509 1.00 0.00 C ATOM 257 CG GLU A 18 12.350 -8.437 -17.562 1.00 0.00 C ATOM 258 CD GLU A 18 13.686 -9.174 -17.462 1.00 0.00 C ATOM 259 OE1 GLU A 18 14.027 -9.871 -18.403 1.00 0.00 O ATOM 260 OE2 GLU A 18 14.345 -9.028 -16.446 1.00 0.00 O ATOM 0 H GLU A 18 12.622 -6.036 -15.606 1.00 0.00 H new ATOM 0 HA GLU A 18 12.695 -5.077 -18.290 1.00 0.00 H new ATOM 0 HB2 GLU A 18 11.738 -7.294 -19.292 1.00 0.00 H new ATOM 0 HB3 GLU A 18 13.467 -7.274 -19.002 1.00 0.00 H new ATOM 0 HG2 GLU A 18 12.036 -8.096 -16.575 1.00 0.00 H new ATOM 0 HG3 GLU A 18 11.576 -9.112 -17.927 1.00 0.00 H new ATOM 267 N ASP A 19 10.056 -5.528 -18.379 1.00 0.00 N ATOM 268 CA ASP A 19 8.608 -5.286 -18.123 1.00 0.00 C ATOM 269 C ASP A 19 7.776 -6.425 -18.714 1.00 0.00 C ATOM 270 O ASP A 19 6.857 -6.922 -18.094 1.00 0.00 O ATOM 271 CB ASP A 19 8.295 -3.967 -18.829 1.00 0.00 C ATOM 272 CG ASP A 19 6.779 -3.779 -18.910 1.00 0.00 C ATOM 273 OD1 ASP A 19 6.201 -3.351 -17.925 1.00 0.00 O ATOM 274 OD2 ASP A 19 6.222 -4.064 -19.957 1.00 0.00 O ATOM 0 H ASP A 19 10.324 -5.553 -19.363 1.00 0.00 H new ATOM 0 HA ASP A 19 8.376 -5.240 -17.059 1.00 0.00 H new ATOM 0 HB2 ASP A 19 8.747 -3.136 -18.287 1.00 0.00 H new ATOM 0 HB3 ASP A 19 8.726 -3.967 -19.830 1.00 0.00 H new ATOM 279 N PHE A 20 8.095 -6.845 -19.907 1.00 0.00 N ATOM 280 CA PHE A 20 7.325 -7.956 -20.534 1.00 0.00 C ATOM 281 C PHE A 20 7.877 -9.304 -20.060 1.00 0.00 C ATOM 282 O PHE A 20 9.068 -9.541 -20.088 1.00 0.00 O ATOM 283 CB PHE A 20 7.540 -7.793 -22.039 1.00 0.00 C ATOM 284 CG PHE A 20 6.507 -6.847 -22.600 1.00 0.00 C ATOM 285 CD1 PHE A 20 5.154 -7.209 -22.604 1.00 0.00 C ATOM 286 CD2 PHE A 20 6.901 -5.607 -23.116 1.00 0.00 C ATOM 287 CE1 PHE A 20 4.196 -6.331 -23.125 1.00 0.00 C ATOM 288 CE2 PHE A 20 5.943 -4.729 -23.637 1.00 0.00 C ATOM 289 CZ PHE A 20 4.590 -5.091 -23.641 1.00 0.00 C ATOM 0 H PHE A 20 8.854 -6.468 -20.474 1.00 0.00 H new ATOM 0 HA PHE A 20 6.268 -7.927 -20.270 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.542 -7.410 -22.234 1.00 0.00 H new ATOM 0 HB3 PHE A 20 7.467 -8.762 -22.534 1.00 0.00 H new ATOM 0 HD1 PHE A 20 4.850 -8.165 -22.205 1.00 0.00 H new ATOM 0 HD2 PHE A 20 7.944 -5.327 -23.112 1.00 0.00 H new ATOM 0 HE1 PHE A 20 3.153 -6.611 -23.129 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.247 -3.773 -24.036 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.851 -4.413 -24.042 1.00 0.00 H new ATOM 299 N TYR A 21 7.022 -10.180 -19.614 1.00 0.00 N ATOM 300 CA TYR A 21 7.494 -11.508 -19.124 1.00 0.00 C ATOM 301 C TYR A 21 6.653 -12.641 -19.721 1.00 0.00 C ATOM 302 O TYR A 21 6.941 -13.807 -19.534 1.00 0.00 O ATOM 303 CB TYR A 21 7.300 -11.447 -17.617 1.00 0.00 C ATOM 304 CG TYR A 21 8.621 -11.114 -16.959 1.00 0.00 C ATOM 305 CD1 TYR A 21 9.795 -11.744 -17.389 1.00 0.00 C ATOM 306 CD2 TYR A 21 8.673 -10.172 -15.924 1.00 0.00 C ATOM 307 CE1 TYR A 21 11.019 -11.435 -16.784 1.00 0.00 C ATOM 308 CE2 TYR A 21 9.897 -9.863 -15.319 1.00 0.00 C ATOM 309 CZ TYR A 21 11.070 -10.494 -15.749 1.00 0.00 C ATOM 310 OH TYR A 21 12.276 -10.186 -15.152 1.00 0.00 O ATOM 0 H TYR A 21 6.013 -10.035 -19.567 1.00 0.00 H new ATOM 0 HA TYR A 21 8.527 -11.706 -19.408 1.00 0.00 H new ATOM 0 HB2 TYR A 21 6.554 -10.693 -17.364 1.00 0.00 H new ATOM 0 HB3 TYR A 21 6.926 -12.402 -17.247 1.00 0.00 H new ATOM 0 HD1 TYR A 21 9.756 -12.469 -18.188 1.00 0.00 H new ATOM 0 HD2 TYR A 21 7.768 -9.684 -15.592 1.00 0.00 H new ATOM 0 HE1 TYR A 21 11.924 -11.923 -17.116 1.00 0.00 H new ATOM 0 HE2 TYR A 21 9.936 -9.137 -14.520 1.00 0.00 H new ATOM 0 HH TYR A 21 12.133 -9.514 -14.453 1.00 0.00 H new ATOM 320 N THR A 22 5.620 -12.302 -20.434 1.00 0.00 N ATOM 321 CA THR A 22 4.745 -13.337 -21.054 1.00 0.00 C ATOM 322 C THR A 22 4.396 -14.456 -20.065 1.00 0.00 C ATOM 323 O THR A 22 3.463 -14.345 -19.295 1.00 0.00 O ATOM 324 CB THR A 22 5.546 -13.882 -22.240 1.00 0.00 C ATOM 325 OG1 THR A 22 6.792 -14.384 -21.780 1.00 0.00 O ATOM 326 CG2 THR A 22 5.786 -12.759 -23.251 1.00 0.00 C ATOM 0 H THR A 22 5.339 -11.339 -20.618 1.00 0.00 H new ATOM 0 HA THR A 22 3.790 -12.914 -21.364 1.00 0.00 H new ATOM 0 HB THR A 22 4.987 -14.687 -22.718 1.00 0.00 H new ATOM 0 HG1 THR A 22 7.304 -14.734 -22.539 1.00 0.00 H new ATOM 0 HG21 THR A 22 6.356 -13.146 -24.096 1.00 0.00 H new ATOM 0 HG22 THR A 22 4.828 -12.377 -23.604 1.00 0.00 H new ATOM 0 HG23 THR A 22 6.345 -11.954 -22.774 1.00 0.00 H new ATOM 334 N ASP A 23 5.108 -15.545 -20.098 1.00 0.00 N ATOM 335 CA ASP A 23 4.776 -16.669 -19.175 1.00 0.00 C ATOM 336 C ASP A 23 6.033 -17.467 -18.822 1.00 0.00 C ATOM 337 O ASP A 23 6.968 -17.546 -19.593 1.00 0.00 O ATOM 338 CB ASP A 23 3.799 -17.529 -19.974 1.00 0.00 C ATOM 339 CG ASP A 23 3.693 -18.916 -19.336 1.00 0.00 C ATOM 340 OD1 ASP A 23 4.656 -19.660 -19.424 1.00 0.00 O ATOM 341 OD2 ASP A 23 2.653 -19.210 -18.771 1.00 0.00 O ATOM 0 H ASP A 23 5.901 -15.708 -20.719 1.00 0.00 H new ATOM 0 HA ASP A 23 4.356 -16.325 -18.229 1.00 0.00 H new ATOM 0 HB2 ASP A 23 2.818 -17.054 -20.000 1.00 0.00 H new ATOM 0 HB3 ASP A 23 4.138 -17.618 -21.006 1.00 0.00 H new ATOM 346 N GLY A 24 6.060 -18.058 -17.660 1.00 0.00 N ATOM 347 CA GLY A 24 7.254 -18.850 -17.254 1.00 0.00 C ATOM 348 C GLY A 24 8.343 -17.896 -16.772 1.00 0.00 C ATOM 349 O GLY A 24 9.497 -18.257 -16.654 1.00 0.00 O ATOM 0 H GLY A 24 5.306 -18.027 -16.974 1.00 0.00 H new ATOM 0 HA2 GLY A 24 6.990 -19.550 -16.462 1.00 0.00 H new ATOM 0 HA3 GLY A 24 7.617 -19.442 -18.094 1.00 0.00 H new ATOM 353 N SER A 25 7.981 -16.675 -16.497 1.00 0.00 N ATOM 354 CA SER A 25 8.985 -15.686 -16.023 1.00 0.00 C ATOM 355 C SER A 25 8.953 -15.588 -14.501 1.00 0.00 C ATOM 356 O SER A 25 8.099 -16.156 -13.849 1.00 0.00 O ATOM 357 CB SER A 25 8.553 -14.364 -16.648 1.00 0.00 C ATOM 358 OG SER A 25 8.895 -14.363 -18.027 1.00 0.00 O ATOM 0 H SER A 25 7.029 -16.319 -16.581 1.00 0.00 H new ATOM 0 HA SER A 25 10.002 -15.962 -16.302 1.00 0.00 H new ATOM 0 HB2 SER A 25 7.479 -14.226 -16.528 1.00 0.00 H new ATOM 0 HB3 SER A 25 9.040 -13.532 -16.140 1.00 0.00 H new ATOM 0 HG SER A 25 8.091 -14.527 -18.563 1.00 0.00 H new ATOM 364 N VAL A 26 9.875 -14.869 -13.930 1.00 0.00 N ATOM 365 CA VAL A 26 9.893 -14.733 -12.451 1.00 0.00 C ATOM 366 C VAL A 26 10.516 -13.399 -12.056 1.00 0.00 C ATOM 367 O VAL A 26 11.333 -12.849 -12.769 1.00 0.00 O ATOM 368 CB VAL A 26 10.747 -15.904 -11.958 1.00 0.00 C ATOM 369 CG1 VAL A 26 11.152 -15.681 -10.499 1.00 0.00 C ATOM 370 CG2 VAL A 26 9.943 -17.198 -12.064 1.00 0.00 C ATOM 0 H VAL A 26 10.616 -14.370 -14.423 1.00 0.00 H new ATOM 0 HA VAL A 26 8.893 -14.753 -12.017 1.00 0.00 H new ATOM 0 HB VAL A 26 11.644 -15.973 -12.573 1.00 0.00 H new ATOM 0 HG11 VAL A 26 11.759 -16.519 -10.158 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.728 -14.759 -10.418 1.00 0.00 H new ATOM 0 HG13 VAL A 26 10.258 -15.605 -9.881 1.00 0.00 H new ATOM 0 HG21 VAL A 26 10.550 -18.033 -11.713 1.00 0.00 H new ATOM 0 HG22 VAL A 26 9.045 -17.120 -11.451 1.00 0.00 H new ATOM 0 HG23 VAL A 26 9.660 -17.366 -13.103 1.00 0.00 H new ATOM 380 N VAL A 27 10.133 -12.865 -10.932 1.00 0.00 N ATOM 381 CA VAL A 27 10.706 -11.558 -10.511 1.00 0.00 C ATOM 382 C VAL A 27 11.110 -11.571 -9.051 1.00 0.00 C ATOM 383 O VAL A 27 10.292 -11.737 -8.170 1.00 0.00 O ATOM 384 CB VAL A 27 9.588 -10.549 -10.724 1.00 0.00 C ATOM 385 CG1 VAL A 27 9.916 -9.243 -9.996 1.00 0.00 C ATOM 386 CG2 VAL A 27 9.465 -10.281 -12.206 1.00 0.00 C ATOM 0 H VAL A 27 9.453 -13.273 -10.290 1.00 0.00 H new ATOM 0 HA VAL A 27 11.605 -11.322 -11.081 1.00 0.00 H new ATOM 0 HB VAL A 27 8.652 -10.945 -10.330 1.00 0.00 H new ATOM 0 HG11 VAL A 27 9.110 -8.526 -10.154 1.00 0.00 H new ATOM 0 HG12 VAL A 27 10.024 -9.438 -8.929 1.00 0.00 H new ATOM 0 HG13 VAL A 27 10.848 -8.833 -10.386 1.00 0.00 H new ATOM 0 HG21 VAL A 27 8.667 -9.559 -12.380 1.00 0.00 H new ATOM 0 HG22 VAL A 27 10.406 -9.880 -12.583 1.00 0.00 H new ATOM 0 HG23 VAL A 27 9.233 -11.210 -12.726 1.00 0.00 H new ATOM 396 N THR A 28 12.355 -11.350 -8.777 1.00 0.00 N ATOM 397 CA THR A 28 12.764 -11.307 -7.363 1.00 0.00 C ATOM 398 C THR A 28 12.226 -10.011 -6.770 1.00 0.00 C ATOM 399 O THR A 28 12.736 -8.938 -7.026 1.00 0.00 O ATOM 400 CB THR A 28 14.292 -11.334 -7.362 1.00 0.00 C ATOM 401 OG1 THR A 28 14.768 -11.472 -8.694 1.00 0.00 O ATOM 402 CG2 THR A 28 14.773 -12.516 -6.522 1.00 0.00 C ATOM 0 H THR A 28 13.096 -11.199 -9.461 1.00 0.00 H new ATOM 0 HA THR A 28 12.382 -12.140 -6.772 1.00 0.00 H new ATOM 0 HB THR A 28 14.673 -10.405 -6.939 1.00 0.00 H new ATOM 0 HG1 THR A 28 15.748 -11.487 -8.691 1.00 0.00 H new ATOM 0 HG21 THR A 28 15.863 -12.540 -6.518 1.00 0.00 H new ATOM 0 HG22 THR A 28 14.409 -12.409 -5.500 1.00 0.00 H new ATOM 0 HG23 THR A 28 14.391 -13.444 -6.948 1.00 0.00 H new ATOM 410 N TYR A 29 11.177 -10.096 -6.008 1.00 0.00 N ATOM 411 CA TYR A 29 10.583 -8.859 -5.436 1.00 0.00 C ATOM 412 C TYR A 29 11.542 -8.238 -4.418 1.00 0.00 C ATOM 413 O TYR A 29 11.907 -8.856 -3.439 1.00 0.00 O ATOM 414 CB TYR A 29 9.309 -9.321 -4.721 1.00 0.00 C ATOM 415 CG TYR A 29 8.114 -9.338 -5.655 1.00 0.00 C ATOM 416 CD1 TYR A 29 8.195 -8.825 -6.961 1.00 0.00 C ATOM 417 CD2 TYR A 29 6.905 -9.877 -5.195 1.00 0.00 C ATOM 418 CE1 TYR A 29 7.070 -8.853 -7.792 1.00 0.00 C ATOM 419 CE2 TYR A 29 5.784 -9.905 -6.029 1.00 0.00 C ATOM 420 CZ TYR A 29 5.865 -9.393 -7.327 1.00 0.00 C ATOM 421 OH TYR A 29 4.758 -9.420 -8.150 1.00 0.00 O ATOM 0 H TYR A 29 10.705 -10.965 -5.756 1.00 0.00 H new ATOM 0 HA TYR A 29 10.383 -8.111 -6.204 1.00 0.00 H new ATOM 0 HB2 TYR A 29 9.464 -10.319 -4.311 1.00 0.00 H new ATOM 0 HB3 TYR A 29 9.104 -8.659 -3.880 1.00 0.00 H new ATOM 0 HD1 TYR A 29 9.124 -8.410 -7.322 1.00 0.00 H new ATOM 0 HD2 TYR A 29 6.839 -10.272 -4.192 1.00 0.00 H new ATOM 0 HE1 TYR A 29 7.131 -8.457 -8.795 1.00 0.00 H new ATOM 0 HE2 TYR A 29 4.855 -10.322 -5.670 1.00 0.00 H new ATOM 0 HH TYR A 29 4.006 -9.829 -7.673 1.00 0.00 H new ATOM 431 N SER A 30 11.943 -7.018 -4.634 1.00 0.00 N ATOM 432 CA SER A 30 12.865 -6.360 -3.668 1.00 0.00 C ATOM 433 C SER A 30 12.091 -5.961 -2.409 1.00 0.00 C ATOM 434 O SER A 30 10.908 -5.686 -2.460 1.00 0.00 O ATOM 435 CB SER A 30 13.395 -5.119 -4.391 1.00 0.00 C ATOM 436 OG SER A 30 12.895 -5.093 -5.722 1.00 0.00 O ATOM 0 H SER A 30 11.673 -6.448 -5.436 1.00 0.00 H new ATOM 0 HA SER A 30 13.677 -7.016 -3.356 1.00 0.00 H new ATOM 0 HB2 SER A 30 13.090 -4.218 -3.859 1.00 0.00 H new ATOM 0 HB3 SER A 30 14.485 -5.129 -4.401 1.00 0.00 H new ATOM 0 HG SER A 30 13.234 -4.297 -6.183 1.00 0.00 H new ATOM 442 N CYS A 31 12.742 -5.934 -1.280 1.00 0.00 N ATOM 443 CA CYS A 31 12.035 -5.559 -0.023 1.00 0.00 C ATOM 444 C CYS A 31 12.652 -4.292 0.576 1.00 0.00 C ATOM 445 O CYS A 31 13.775 -3.937 0.280 1.00 0.00 O ATOM 446 CB CYS A 31 12.243 -6.749 0.913 1.00 0.00 C ATOM 447 SG CYS A 31 11.649 -8.255 0.107 1.00 0.00 S ATOM 0 H CYS A 31 13.732 -6.155 -1.173 1.00 0.00 H new ATOM 0 HA CYS A 31 10.979 -5.348 -0.190 1.00 0.00 H new ATOM 0 HB2 CYS A 31 13.299 -6.849 1.163 1.00 0.00 H new ATOM 0 HB3 CYS A 31 11.708 -6.588 1.849 1.00 0.00 H new ATOM 452 N ASN A 32 11.926 -3.608 1.416 1.00 0.00 N ATOM 453 CA ASN A 32 12.469 -2.364 2.033 1.00 0.00 C ATOM 454 C ASN A 32 13.818 -2.649 2.701 1.00 0.00 C ATOM 455 O ASN A 32 13.981 -3.629 3.401 1.00 0.00 O ATOM 456 CB ASN A 32 11.429 -1.956 3.076 1.00 0.00 C ATOM 457 CG ASN A 32 11.556 -0.460 3.364 1.00 0.00 C ATOM 458 OD1 ASN A 32 11.931 -0.068 4.452 1.00 0.00 O ATOM 459 ND2 ASN A 32 11.259 0.399 2.428 1.00 0.00 N ATOM 0 H ASN A 32 10.979 -3.856 1.703 1.00 0.00 H new ATOM 0 HA ASN A 32 12.640 -1.578 1.298 1.00 0.00 H new ATOM 0 HB2 ASN A 32 10.426 -2.184 2.714 1.00 0.00 H new ATOM 0 HB3 ASN A 32 11.574 -2.527 3.993 1.00 0.00 H new ATOM 0 HD21 ASN A 32 11.341 1.399 2.609 1.00 0.00 H new ATOM 0 HD22 ASN A 32 10.944 0.070 1.515 1.00 0.00 H new ATOM 466 N SER A 33 14.786 -1.798 2.491 1.00 0.00 N ATOM 467 CA SER A 33 16.123 -2.020 3.113 1.00 0.00 C ATOM 468 C SER A 33 15.965 -2.434 4.579 1.00 0.00 C ATOM 469 O SER A 33 15.705 -1.618 5.441 1.00 0.00 O ATOM 470 CB SER A 33 16.834 -0.670 3.010 1.00 0.00 C ATOM 471 OG SER A 33 17.919 -0.780 2.097 1.00 0.00 O ATOM 0 H SER A 33 14.709 -0.959 1.916 1.00 0.00 H new ATOM 0 HA SER A 33 16.682 -2.815 2.619 1.00 0.00 H new ATOM 0 HB2 SER A 33 16.136 0.097 2.673 1.00 0.00 H new ATOM 0 HB3 SER A 33 17.198 -0.362 3.990 1.00 0.00 H new ATOM 0 HG SER A 33 18.376 0.084 2.027 1.00 0.00 H new ATOM 477 N GLY A 34 16.121 -3.698 4.868 1.00 0.00 N ATOM 478 CA GLY A 34 15.981 -4.165 6.278 1.00 0.00 C ATOM 479 C GLY A 34 14.832 -5.170 6.375 1.00 0.00 C ATOM 480 O GLY A 34 14.661 -5.836 7.377 1.00 0.00 O ATOM 0 H GLY A 34 16.339 -4.427 4.189 1.00 0.00 H new ATOM 0 HA2 GLY A 34 16.910 -4.626 6.613 1.00 0.00 H new ATOM 0 HA3 GLY A 34 15.792 -3.316 6.935 1.00 0.00 H new ATOM 484 N TYR A 35 14.043 -5.286 5.343 1.00 0.00 N ATOM 485 CA TYR A 35 12.905 -6.251 5.378 1.00 0.00 C ATOM 486 C TYR A 35 13.331 -7.588 4.765 1.00 0.00 C ATOM 487 O TYR A 35 14.033 -7.630 3.775 1.00 0.00 O ATOM 488 CB TYR A 35 11.807 -5.596 4.538 1.00 0.00 C ATOM 489 CG TYR A 35 10.948 -4.710 5.414 1.00 0.00 C ATOM 490 CD1 TYR A 35 11.426 -4.263 6.653 1.00 0.00 C ATOM 491 CD2 TYR A 35 9.670 -4.333 4.982 1.00 0.00 C ATOM 492 CE1 TYR A 35 10.628 -3.442 7.458 1.00 0.00 C ATOM 493 CE2 TYR A 35 8.872 -3.511 5.787 1.00 0.00 C ATOM 494 CZ TYR A 35 9.351 -3.065 7.025 1.00 0.00 C ATOM 495 OH TYR A 35 8.564 -2.255 7.818 1.00 0.00 O ATOM 0 H TYR A 35 14.136 -4.755 4.477 1.00 0.00 H new ATOM 0 HA TYR A 35 12.568 -6.461 6.393 1.00 0.00 H new ATOM 0 HB2 TYR A 35 12.253 -5.007 3.736 1.00 0.00 H new ATOM 0 HB3 TYR A 35 11.192 -6.362 4.066 1.00 0.00 H new ATOM 0 HD1 TYR A 35 12.411 -4.552 6.987 1.00 0.00 H new ATOM 0 HD2 TYR A 35 9.300 -4.677 4.027 1.00 0.00 H new ATOM 0 HE1 TYR A 35 10.997 -3.099 8.413 1.00 0.00 H new ATOM 0 HE2 TYR A 35 7.887 -3.221 5.453 1.00 0.00 H new ATOM 0 HH TYR A 35 7.709 -2.088 7.369 1.00 0.00 H new ATOM 505 N SER A 36 12.916 -8.681 5.346 1.00 0.00 N ATOM 506 CA SER A 36 13.306 -10.008 4.791 1.00 0.00 C ATOM 507 C SER A 36 12.360 -10.428 3.671 1.00 0.00 C ATOM 508 O SER A 36 11.166 -10.214 3.736 1.00 0.00 O ATOM 509 CB SER A 36 13.198 -10.989 5.955 1.00 0.00 C ATOM 510 OG SER A 36 14.228 -11.958 5.835 1.00 0.00 O ATOM 0 H SER A 36 12.326 -8.712 6.178 1.00 0.00 H new ATOM 0 HA SER A 36 14.310 -9.979 4.369 1.00 0.00 H new ATOM 0 HB2 SER A 36 13.287 -10.460 6.904 1.00 0.00 H new ATOM 0 HB3 SER A 36 12.222 -11.474 5.950 1.00 0.00 H new ATOM 0 HG SER A 36 15.101 -11.512 5.856 1.00 0.00 H new ATOM 516 N LEU A 37 12.886 -11.044 2.650 1.00 0.00 N ATOM 517 CA LEU A 37 12.020 -11.501 1.533 1.00 0.00 C ATOM 518 C LEU A 37 11.593 -12.946 1.786 1.00 0.00 C ATOM 519 O LEU A 37 12.313 -13.879 1.489 1.00 0.00 O ATOM 520 CB LEU A 37 12.890 -11.407 0.280 1.00 0.00 C ATOM 521 CG LEU A 37 12.115 -11.964 -0.914 1.00 0.00 C ATOM 522 CD1 LEU A 37 11.442 -10.817 -1.665 1.00 0.00 C ATOM 523 CD2 LEU A 37 13.079 -12.689 -1.853 1.00 0.00 C ATOM 0 H LEU A 37 13.879 -11.250 2.542 1.00 0.00 H new ATOM 0 HA LEU A 37 11.114 -10.903 1.432 1.00 0.00 H new ATOM 0 HB2 LEU A 37 13.171 -10.370 0.095 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.814 -11.967 0.422 1.00 0.00 H new ATOM 0 HG LEU A 37 11.356 -12.662 -0.560 1.00 0.00 H new ATOM 0 HD11 LEU A 37 10.889 -11.214 -2.516 1.00 0.00 H new ATOM 0 HD12 LEU A 37 10.755 -10.298 -0.997 1.00 0.00 H new ATOM 0 HD13 LEU A 37 12.201 -10.119 -2.019 1.00 0.00 H new ATOM 0 HD21 LEU A 37 12.527 -13.087 -2.705 1.00 0.00 H new ATOM 0 HD22 LEU A 37 13.837 -11.990 -2.206 1.00 0.00 H new ATOM 0 HD23 LEU A 37 13.561 -13.508 -1.319 1.00 0.00 H new ATOM 535 N ILE A 38 10.427 -13.136 2.329 1.00 0.00 N ATOM 536 CA ILE A 38 9.954 -14.526 2.598 1.00 0.00 C ATOM 537 C ILE A 38 9.228 -15.053 1.363 1.00 0.00 C ATOM 538 O ILE A 38 8.741 -14.294 0.555 1.00 0.00 O ATOM 539 CB ILE A 38 8.977 -14.462 3.790 1.00 0.00 C ATOM 540 CG1 ILE A 38 9.123 -13.154 4.589 1.00 0.00 C ATOM 541 CG2 ILE A 38 9.257 -15.633 4.724 1.00 0.00 C ATOM 542 CD1 ILE A 38 10.576 -12.978 5.033 1.00 0.00 C ATOM 0 H ILE A 38 9.780 -12.395 2.599 1.00 0.00 H new ATOM 0 HA ILE A 38 10.789 -15.188 2.826 1.00 0.00 H new ATOM 0 HB ILE A 38 7.964 -14.506 3.391 1.00 0.00 H new ATOM 0 HG12 ILE A 38 8.815 -12.307 3.976 1.00 0.00 H new ATOM 0 HG13 ILE A 38 8.467 -13.173 5.459 1.00 0.00 H new ATOM 0 HG21 ILE A 38 8.571 -15.596 5.570 1.00 0.00 H new ATOM 0 HG22 ILE A 38 9.118 -16.570 4.185 1.00 0.00 H new ATOM 0 HG23 ILE A 38 10.283 -15.572 5.086 1.00 0.00 H new ATOM 0 HD11 ILE A 38 10.674 -12.051 5.598 1.00 0.00 H new ATOM 0 HD12 ILE A 38 10.869 -13.819 5.662 1.00 0.00 H new ATOM 0 HD13 ILE A 38 11.222 -12.939 4.156 1.00 0.00 H new ATOM 554 N GLY A 39 9.143 -16.341 1.206 1.00 0.00 N ATOM 555 CA GLY A 39 8.435 -16.887 0.017 1.00 0.00 C ATOM 556 C GLY A 39 9.423 -17.095 -1.129 1.00 0.00 C ATOM 557 O GLY A 39 10.595 -16.794 -1.017 1.00 0.00 O ATOM 0 H GLY A 39 9.530 -17.036 1.844 1.00 0.00 H new ATOM 0 HA2 GLY A 39 7.956 -17.832 0.271 1.00 0.00 H new ATOM 0 HA3 GLY A 39 7.645 -16.202 -0.292 1.00 0.00 H new ATOM 561 N ASN A 40 8.957 -17.605 -2.235 1.00 0.00 N ATOM 562 CA ASN A 40 9.866 -17.828 -3.393 1.00 0.00 C ATOM 563 C ASN A 40 10.578 -16.525 -3.752 1.00 0.00 C ATOM 564 O ASN A 40 9.952 -15.515 -3.999 1.00 0.00 O ATOM 565 CB ASN A 40 8.950 -18.273 -4.533 1.00 0.00 C ATOM 566 CG ASN A 40 9.116 -19.776 -4.759 1.00 0.00 C ATOM 567 OD1 ASN A 40 9.249 -20.223 -5.881 1.00 0.00 O ATOM 568 ND2 ASN A 40 9.117 -20.579 -3.731 1.00 0.00 N ATOM 0 H ASN A 40 7.986 -17.877 -2.387 1.00 0.00 H new ATOM 0 HA ASN A 40 10.639 -18.567 -3.182 1.00 0.00 H new ATOM 0 HB2 ASN A 40 7.912 -18.043 -4.292 1.00 0.00 H new ATOM 0 HB3 ASN A 40 9.194 -17.728 -5.445 1.00 0.00 H new ATOM 0 HD21 ASN A 40 9.230 -21.583 -3.869 1.00 0.00 H new ATOM 0 HD22 ASN A 40 9.005 -20.202 -2.790 1.00 0.00 H new ATOM 575 N SER A 41 11.882 -16.537 -3.785 1.00 0.00 N ATOM 576 CA SER A 41 12.629 -15.294 -4.130 1.00 0.00 C ATOM 577 C SER A 41 12.479 -14.992 -5.621 1.00 0.00 C ATOM 578 O SER A 41 13.450 -14.850 -6.337 1.00 0.00 O ATOM 579 CB SER A 41 14.088 -15.596 -3.787 1.00 0.00 C ATOM 580 OG SER A 41 14.620 -14.525 -3.018 1.00 0.00 O ATOM 0 H SER A 41 12.462 -17.352 -3.588 1.00 0.00 H new ATOM 0 HA SER A 41 12.259 -14.424 -3.588 1.00 0.00 H new ATOM 0 HB2 SER A 41 14.157 -16.529 -3.228 1.00 0.00 H new ATOM 0 HB3 SER A 41 14.669 -15.727 -4.700 1.00 0.00 H new ATOM 0 HG SER A 41 15.555 -14.716 -2.795 1.00 0.00 H new ATOM 586 N GLY A 42 11.267 -14.896 -6.095 1.00 0.00 N ATOM 587 CA GLY A 42 11.056 -14.607 -7.540 1.00 0.00 C ATOM 588 C GLY A 42 9.634 -14.991 -7.950 1.00 0.00 C ATOM 589 O GLY A 42 9.358 -16.138 -8.238 1.00 0.00 O ATOM 0 H GLY A 42 10.415 -15.005 -5.544 1.00 0.00 H new ATOM 0 HA2 GLY A 42 11.226 -13.548 -7.736 1.00 0.00 H new ATOM 0 HA3 GLY A 42 11.778 -15.162 -8.139 1.00 0.00 H new ATOM 593 N VAL A 43 8.729 -14.043 -7.981 1.00 0.00 N ATOM 594 CA VAL A 43 7.324 -14.381 -8.394 1.00 0.00 C ATOM 595 C VAL A 43 7.388 -15.264 -9.636 1.00 0.00 C ATOM 596 O VAL A 43 8.441 -15.461 -10.205 1.00 0.00 O ATOM 597 CB VAL A 43 6.574 -13.083 -8.770 1.00 0.00 C ATOM 598 CG1 VAL A 43 5.212 -13.067 -8.076 1.00 0.00 C ATOM 599 CG2 VAL A 43 7.349 -11.827 -8.375 1.00 0.00 C ATOM 0 H VAL A 43 8.894 -13.065 -7.743 1.00 0.00 H new ATOM 0 HA VAL A 43 6.811 -14.888 -7.577 1.00 0.00 H new ATOM 0 HB VAL A 43 6.459 -13.075 -9.854 1.00 0.00 H new ATOM 0 HG11 VAL A 43 4.680 -12.153 -8.339 1.00 0.00 H new ATOM 0 HG12 VAL A 43 4.630 -13.931 -8.397 1.00 0.00 H new ATOM 0 HG13 VAL A 43 5.353 -13.106 -6.996 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.779 -10.943 -8.661 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.509 -11.822 -7.297 1.00 0.00 H new ATOM 0 HG23 VAL A 43 8.312 -11.818 -8.885 1.00 0.00 H new ATOM 609 N LEU A 44 6.279 -15.775 -10.084 1.00 0.00 N ATOM 610 CA LEU A 44 6.311 -16.620 -11.311 1.00 0.00 C ATOM 611 C LEU A 44 5.184 -16.217 -12.265 1.00 0.00 C ATOM 612 O LEU A 44 4.036 -16.563 -12.065 1.00 0.00 O ATOM 613 CB LEU A 44 6.118 -18.057 -10.826 1.00 0.00 C ATOM 614 CG LEU A 44 5.916 -18.976 -12.034 1.00 0.00 C ATOM 615 CD1 LEU A 44 7.272 -19.432 -12.572 1.00 0.00 C ATOM 616 CD2 LEU A 44 5.096 -20.199 -11.614 1.00 0.00 C ATOM 0 H LEU A 44 5.360 -15.648 -9.661 1.00 0.00 H new ATOM 0 HA LEU A 44 7.246 -16.504 -11.858 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.986 -18.379 -10.251 1.00 0.00 H new ATOM 0 HB3 LEU A 44 5.256 -18.116 -10.161 1.00 0.00 H new ATOM 0 HG LEU A 44 5.385 -18.431 -12.814 1.00 0.00 H new ATOM 0 HD11 LEU A 44 7.121 -20.086 -13.431 1.00 0.00 H new ATOM 0 HD12 LEU A 44 7.854 -18.562 -12.875 1.00 0.00 H new ATOM 0 HD13 LEU A 44 7.809 -19.974 -11.793 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.952 -20.853 -12.474 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.626 -20.741 -10.830 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.125 -19.875 -11.238 1.00 0.00 H new ATOM 628 N CYS A 45 5.506 -15.502 -13.308 1.00 0.00 N ATOM 629 CA CYS A 45 4.455 -15.096 -14.281 1.00 0.00 C ATOM 630 C CYS A 45 4.103 -16.285 -15.176 1.00 0.00 C ATOM 631 O CYS A 45 4.917 -16.757 -15.946 1.00 0.00 O ATOM 632 CB CYS A 45 5.082 -13.959 -15.101 1.00 0.00 C ATOM 633 SG CYS A 45 4.290 -13.851 -16.731 1.00 0.00 S ATOM 0 H CYS A 45 6.449 -15.182 -13.527 1.00 0.00 H new ATOM 0 HA CYS A 45 3.534 -14.773 -13.796 1.00 0.00 H new ATOM 0 HB2 CYS A 45 4.969 -13.013 -14.571 1.00 0.00 H new ATOM 0 HB3 CYS A 45 6.152 -14.133 -15.219 1.00 0.00 H new ATOM 638 N SER A 46 2.899 -16.767 -15.093 1.00 0.00 N ATOM 639 CA SER A 46 2.512 -17.917 -15.956 1.00 0.00 C ATOM 640 C SER A 46 1.159 -17.647 -16.620 1.00 0.00 C ATOM 641 O SER A 46 0.118 -17.777 -16.008 1.00 0.00 O ATOM 642 CB SER A 46 2.418 -19.115 -15.015 1.00 0.00 C ATOM 643 OG SER A 46 3.257 -20.156 -15.497 1.00 0.00 O ATOM 0 H SER A 46 2.169 -16.420 -14.471 1.00 0.00 H new ATOM 0 HA SER A 46 3.232 -18.089 -16.757 1.00 0.00 H new ATOM 0 HB2 SER A 46 2.719 -18.826 -14.008 1.00 0.00 H new ATOM 0 HB3 SER A 46 1.387 -19.463 -14.952 1.00 0.00 H new ATOM 0 HG SER A 46 3.201 -20.927 -14.894 1.00 0.00 H new ATOM 649 N GLY A 47 1.170 -17.268 -17.868 1.00 0.00 N ATOM 650 CA GLY A 47 -0.110 -16.983 -18.575 1.00 0.00 C ATOM 651 C GLY A 47 -0.621 -15.606 -18.153 1.00 0.00 C ATOM 652 O GLY A 47 -1.799 -15.410 -17.929 1.00 0.00 O ATOM 0 H GLY A 47 2.012 -17.143 -18.430 1.00 0.00 H new ATOM 0 HA2 GLY A 47 0.042 -17.013 -19.654 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.849 -17.747 -18.336 1.00 0.00 H new ATOM 656 N GLY A 48 0.260 -14.650 -18.039 1.00 0.00 N ATOM 657 CA GLY A 48 -0.171 -13.284 -17.628 1.00 0.00 C ATOM 658 C GLY A 48 -0.724 -13.335 -16.204 1.00 0.00 C ATOM 659 O GLY A 48 -1.601 -12.577 -15.840 1.00 0.00 O ATOM 0 H GLY A 48 1.260 -14.756 -18.213 1.00 0.00 H new ATOM 0 HA2 GLY A 48 0.671 -12.594 -17.679 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -0.932 -12.909 -18.313 1.00 0.00 H new ATOM 663 N GLU A 49 -0.221 -14.227 -15.395 1.00 0.00 N ATOM 664 CA GLU A 49 -0.721 -14.329 -13.994 1.00 0.00 C ATOM 665 C GLU A 49 0.446 -14.478 -13.017 1.00 0.00 C ATOM 666 O GLU A 49 1.009 -15.545 -12.865 1.00 0.00 O ATOM 667 CB GLU A 49 -1.587 -15.587 -13.974 1.00 0.00 C ATOM 668 CG GLU A 49 -2.579 -15.505 -12.813 1.00 0.00 C ATOM 669 CD GLU A 49 -3.951 -15.086 -13.343 1.00 0.00 C ATOM 670 OE1 GLU A 49 -4.103 -13.926 -13.687 1.00 0.00 O ATOM 671 OE2 GLU A 49 -4.827 -15.934 -13.397 1.00 0.00 O ATOM 0 H GLU A 49 0.514 -14.889 -15.643 1.00 0.00 H new ATOM 0 HA GLU A 49 -1.275 -13.440 -13.694 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -2.123 -15.687 -14.918 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -0.959 -16.472 -13.868 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -2.650 -16.471 -12.313 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -2.229 -14.787 -12.072 1.00 0.00 H new ATOM 678 N TRP A 50 0.809 -13.423 -12.344 1.00 0.00 N ATOM 679 CA TRP A 50 1.932 -13.517 -11.371 1.00 0.00 C ATOM 680 C TRP A 50 1.468 -14.275 -10.125 1.00 0.00 C ATOM 681 O TRP A 50 0.503 -13.903 -9.487 1.00 0.00 O ATOM 682 CB TRP A 50 2.276 -12.068 -11.023 1.00 0.00 C ATOM 683 CG TRP A 50 3.008 -11.436 -12.164 1.00 0.00 C ATOM 684 CD1 TRP A 50 2.489 -10.515 -13.009 1.00 0.00 C ATOM 685 CD2 TRP A 50 4.380 -11.657 -12.594 1.00 0.00 C ATOM 686 NE1 TRP A 50 3.457 -10.158 -13.930 1.00 0.00 N ATOM 687 CE2 TRP A 50 4.640 -10.835 -13.715 1.00 0.00 C ATOM 688 CE3 TRP A 50 5.413 -12.484 -12.122 1.00 0.00 C ATOM 689 CZ2 TRP A 50 5.884 -10.833 -14.347 1.00 0.00 C ATOM 690 CZ3 TRP A 50 6.666 -12.486 -12.754 1.00 0.00 C ATOM 691 CH2 TRP A 50 6.901 -11.663 -13.863 1.00 0.00 C ATOM 0 H TRP A 50 0.378 -12.502 -12.425 1.00 0.00 H new ATOM 0 HA TRP A 50 2.794 -14.050 -11.773 1.00 0.00 H new ATOM 0 HB2 TRP A 50 1.365 -11.509 -10.809 1.00 0.00 H new ATOM 0 HB3 TRP A 50 2.889 -12.036 -10.122 1.00 0.00 H new ATOM 0 HD1 TRP A 50 1.483 -10.123 -12.970 1.00 0.00 H new ATOM 0 HE1 TRP A 50 3.314 -9.478 -14.677 1.00 0.00 H new ATOM 0 HE3 TRP A 50 5.242 -13.122 -11.268 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 6.060 -10.197 -15.202 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 7.453 -13.126 -12.383 1.00 0.00 H new ATOM 0 HH2 TRP A 50 7.868 -11.669 -14.345 1.00 0.00 H new ATOM 702 N SER A 51 2.134 -15.343 -9.778 1.00 0.00 N ATOM 703 CA SER A 51 1.703 -16.120 -8.580 1.00 0.00 C ATOM 704 C SER A 51 2.878 -16.376 -7.626 1.00 0.00 C ATOM 705 O SER A 51 3.984 -15.915 -7.836 1.00 0.00 O ATOM 706 CB SER A 51 1.176 -17.438 -9.140 1.00 0.00 C ATOM 707 OG SER A 51 -0.101 -17.221 -9.729 1.00 0.00 O ATOM 0 H SER A 51 2.951 -15.709 -10.267 1.00 0.00 H new ATOM 0 HA SER A 51 0.954 -15.581 -8.000 1.00 0.00 H new ATOM 0 HB2 SER A 51 1.869 -17.834 -9.882 1.00 0.00 H new ATOM 0 HB3 SER A 51 1.101 -18.180 -8.345 1.00 0.00 H new ATOM 0 HG SER A 51 -0.442 -18.065 -10.091 1.00 0.00 H new ATOM 713 N ASP A 52 2.626 -17.113 -6.577 1.00 0.00 N ATOM 714 CA ASP A 52 3.689 -17.428 -5.574 1.00 0.00 C ATOM 715 C ASP A 52 4.615 -16.229 -5.354 1.00 0.00 C ATOM 716 O ASP A 52 5.791 -16.279 -5.657 1.00 0.00 O ATOM 717 CB ASP A 52 4.461 -18.620 -6.148 1.00 0.00 C ATOM 718 CG ASP A 52 4.881 -18.326 -7.589 1.00 0.00 C ATOM 719 OD1 ASP A 52 5.780 -17.522 -7.771 1.00 0.00 O ATOM 720 OD2 ASP A 52 4.297 -18.911 -8.487 1.00 0.00 O ATOM 0 H ASP A 52 1.713 -17.517 -6.368 1.00 0.00 H new ATOM 0 HA ASP A 52 3.259 -17.661 -4.600 1.00 0.00 H new ATOM 0 HB2 ASP A 52 5.341 -18.822 -5.538 1.00 0.00 H new ATOM 0 HB3 ASP A 52 3.840 -19.515 -6.117 1.00 0.00 H new ATOM 725 N PRO A 53 4.040 -15.197 -4.809 1.00 0.00 N ATOM 726 CA PRO A 53 4.784 -13.961 -4.501 1.00 0.00 C ATOM 727 C PRO A 53 5.341 -14.025 -3.073 1.00 0.00 C ATOM 728 O PRO A 53 4.626 -14.357 -2.148 1.00 0.00 O ATOM 729 CB PRO A 53 3.708 -12.887 -4.608 1.00 0.00 C ATOM 730 CG PRO A 53 2.400 -13.589 -4.343 1.00 0.00 C ATOM 731 CD PRO A 53 2.635 -15.082 -4.437 1.00 0.00 C ATOM 0 HA PRO A 53 5.637 -13.785 -5.157 1.00 0.00 H new ATOM 0 HB2 PRO A 53 3.878 -12.090 -3.884 1.00 0.00 H new ATOM 0 HB3 PRO A 53 3.712 -12.427 -5.596 1.00 0.00 H new ATOM 0 HG2 PRO A 53 2.021 -13.326 -3.356 1.00 0.00 H new ATOM 0 HG3 PRO A 53 1.648 -13.277 -5.067 1.00 0.00 H new ATOM 0 HD2 PRO A 53 2.432 -15.578 -3.488 1.00 0.00 H new ATOM 0 HD3 PRO A 53 1.986 -15.542 -5.182 1.00 0.00 H new ATOM 739 N PRO A 54 6.601 -13.707 -2.935 1.00 0.00 N ATOM 740 CA PRO A 54 7.243 -13.734 -1.599 1.00 0.00 C ATOM 741 C PRO A 54 6.818 -12.507 -0.782 1.00 0.00 C ATOM 742 O PRO A 54 6.156 -11.619 -1.282 1.00 0.00 O ATOM 743 CB PRO A 54 8.734 -13.698 -1.920 1.00 0.00 C ATOM 744 CG PRO A 54 8.833 -13.038 -3.261 1.00 0.00 C ATOM 745 CD PRO A 54 7.535 -13.300 -3.991 1.00 0.00 C ATOM 0 HA PRO A 54 6.967 -14.603 -1.001 1.00 0.00 H new ATOM 0 HB2 PRO A 54 9.286 -13.139 -1.164 1.00 0.00 H new ATOM 0 HB3 PRO A 54 9.156 -14.703 -1.944 1.00 0.00 H new ATOM 0 HG2 PRO A 54 9.001 -11.967 -3.150 1.00 0.00 H new ATOM 0 HG3 PRO A 54 9.677 -13.437 -3.824 1.00 0.00 H new ATOM 0 HD2 PRO A 54 7.184 -12.408 -4.511 1.00 0.00 H new ATOM 0 HD3 PRO A 54 7.652 -14.081 -4.742 1.00 0.00 H new ATOM 753 N THR A 55 7.180 -12.454 0.473 1.00 0.00 N ATOM 754 CA THR A 55 6.781 -11.287 1.315 1.00 0.00 C ATOM 755 C THR A 55 7.997 -10.472 1.744 1.00 0.00 C ATOM 756 O THR A 55 9.041 -11.008 2.060 1.00 0.00 O ATOM 757 CB THR A 55 6.125 -11.889 2.557 1.00 0.00 C ATOM 758 OG1 THR A 55 7.001 -12.837 3.132 1.00 0.00 O ATOM 759 CG2 THR A 55 4.817 -12.572 2.175 1.00 0.00 C ATOM 0 H THR A 55 7.733 -13.166 0.950 1.00 0.00 H new ATOM 0 HA THR A 55 6.120 -10.619 0.763 1.00 0.00 H new ATOM 0 HB THR A 55 5.916 -11.096 3.275 1.00 0.00 H new ATOM 0 HG1 THR A 55 6.652 -13.119 4.003 1.00 0.00 H new ATOM 0 HG21 THR A 55 4.356 -12.999 3.066 1.00 0.00 H new ATOM 0 HG22 THR A 55 4.141 -11.841 1.731 1.00 0.00 H new ATOM 0 HG23 THR A 55 5.018 -13.365 1.455 1.00 0.00 H new ATOM 767 N CYS A 56 7.851 -9.181 1.798 1.00 0.00 N ATOM 768 CA CYS A 56 8.973 -8.323 2.255 1.00 0.00 C ATOM 769 C CYS A 56 8.629 -7.803 3.642 1.00 0.00 C ATOM 770 O CYS A 56 8.179 -6.688 3.817 1.00 0.00 O ATOM 771 CB CYS A 56 9.064 -7.190 1.233 1.00 0.00 C ATOM 772 SG CYS A 56 9.721 -7.842 -0.322 1.00 0.00 S ATOM 0 H CYS A 56 6.999 -8.681 1.544 1.00 0.00 H new ATOM 0 HA CYS A 56 9.927 -8.846 2.322 1.00 0.00 H new ATOM 0 HB2 CYS A 56 8.080 -6.751 1.070 1.00 0.00 H new ATOM 0 HB3 CYS A 56 9.709 -6.396 1.609 1.00 0.00 H new ATOM 777 N GLN A 57 8.812 -8.632 4.626 1.00 0.00 N ATOM 778 CA GLN A 57 8.471 -8.236 6.018 1.00 0.00 C ATOM 779 C GLN A 57 9.731 -8.148 6.874 1.00 0.00 C ATOM 780 O GLN A 57 10.829 -8.024 6.374 1.00 0.00 O ATOM 781 CB GLN A 57 7.541 -9.336 6.566 1.00 0.00 C ATOM 782 CG GLN A 57 7.410 -10.516 5.590 1.00 0.00 C ATOM 783 CD GLN A 57 6.520 -11.594 6.211 1.00 0.00 C ATOM 784 OE1 GLN A 57 5.545 -12.010 5.617 1.00 0.00 O ATOM 785 NE2 GLN A 57 6.815 -12.066 7.392 1.00 0.00 N ATOM 0 H GLN A 57 9.186 -9.576 4.526 1.00 0.00 H new ATOM 0 HA GLN A 57 7.992 -7.257 6.039 1.00 0.00 H new ATOM 0 HB2 GLN A 57 7.927 -9.695 7.520 1.00 0.00 H new ATOM 0 HB3 GLN A 57 6.555 -8.914 6.760 1.00 0.00 H new ATOM 0 HG2 GLN A 57 6.983 -10.176 4.646 1.00 0.00 H new ATOM 0 HG3 GLN A 57 8.394 -10.927 5.365 1.00 0.00 H new ATOM 0 HE21 GLN A 57 7.633 -11.717 7.891 1.00 0.00 H new ATOM 0 HE22 GLN A 57 6.227 -12.784 7.816 1.00 0.00 H new ATOM 794 N ILE A 58 9.576 -8.223 8.166 1.00 0.00 N ATOM 795 CA ILE A 58 10.756 -8.158 9.065 1.00 0.00 C ATOM 796 C ILE A 58 10.954 -9.535 9.694 1.00 0.00 C ATOM 797 O ILE A 58 10.003 -10.230 9.991 1.00 0.00 O ATOM 798 CB ILE A 58 10.434 -7.105 10.139 1.00 0.00 C ATOM 799 CG1 ILE A 58 9.315 -6.162 9.673 1.00 0.00 C ATOM 800 CG2 ILE A 58 11.686 -6.277 10.406 1.00 0.00 C ATOM 801 CD1 ILE A 58 7.963 -6.703 10.139 1.00 0.00 C ATOM 0 H ILE A 58 8.678 -8.327 8.638 1.00 0.00 H new ATOM 0 HA ILE A 58 11.670 -7.885 8.537 1.00 0.00 H new ATOM 0 HB ILE A 58 10.105 -7.621 11.041 1.00 0.00 H new ATOM 0 HG12 ILE A 58 9.477 -5.162 10.076 1.00 0.00 H new ATOM 0 HG13 ILE A 58 9.328 -6.074 8.587 1.00 0.00 H new ATOM 0 HG21 ILE A 58 11.470 -5.526 11.166 1.00 0.00 H new ATOM 0 HG22 ILE A 58 12.486 -6.929 10.757 1.00 0.00 H new ATOM 0 HG23 ILE A 58 11.998 -5.783 9.486 1.00 0.00 H new ATOM 0 HD11 ILE A 58 7.169 -6.033 9.808 1.00 0.00 H new ATOM 0 HD12 ILE A 58 7.802 -7.694 9.715 1.00 0.00 H new ATOM 0 HD13 ILE A 58 7.953 -6.768 11.227 1.00 0.00 H new ATOM 813 N VAL A 59 12.171 -9.953 9.876 1.00 0.00 N ATOM 814 CA VAL A 59 12.399 -11.305 10.459 1.00 0.00 C ATOM 815 C VAL A 59 13.438 -11.254 11.553 1.00 0.00 C ATOM 816 O VAL A 59 14.315 -12.086 11.631 1.00 0.00 O ATOM 817 CB VAL A 59 12.919 -12.134 9.299 1.00 0.00 C ATOM 818 CG1 VAL A 59 11.911 -12.098 8.154 1.00 0.00 C ATOM 819 CG2 VAL A 59 14.245 -11.539 8.840 1.00 0.00 C ATOM 0 H VAL A 59 13.013 -9.424 9.649 1.00 0.00 H new ATOM 0 HA VAL A 59 11.492 -11.713 10.904 1.00 0.00 H new ATOM 0 HB VAL A 59 13.063 -13.169 9.609 1.00 0.00 H new ATOM 0 HG11 VAL A 59 12.285 -12.694 7.321 1.00 0.00 H new ATOM 0 HG12 VAL A 59 10.959 -12.507 8.494 1.00 0.00 H new ATOM 0 HG13 VAL A 59 11.768 -11.068 7.828 1.00 0.00 H new ATOM 0 HG21 VAL A 59 14.636 -12.121 8.006 1.00 0.00 H new ATOM 0 HG22 VAL A 59 14.090 -10.508 8.522 1.00 0.00 H new ATOM 0 HG23 VAL A 59 14.958 -11.561 9.664 1.00 0.00 H new ATOM 829 N LYS A 60 13.340 -10.302 12.405 1.00 0.00 N ATOM 830 CA LYS A 60 14.336 -10.218 13.504 1.00 0.00 C ATOM 831 C LYS A 60 13.940 -11.187 14.623 1.00 0.00 C ATOM 832 O LYS A 60 13.037 -10.929 15.394 1.00 0.00 O ATOM 833 CB LYS A 60 14.285 -8.768 13.989 1.00 0.00 C ATOM 834 CG LYS A 60 14.792 -7.841 12.882 1.00 0.00 C ATOM 835 CD LYS A 60 14.025 -6.518 12.933 1.00 0.00 C ATOM 836 CE LYS A 60 15.009 -5.364 13.134 1.00 0.00 C ATOM 837 NZ LYS A 60 14.960 -4.591 11.862 1.00 0.00 N ATOM 0 H LYS A 60 12.623 -9.576 12.400 1.00 0.00 H new ATOM 0 HA LYS A 60 15.342 -10.489 13.183 1.00 0.00 H new ATOM 0 HB2 LYS A 60 13.264 -8.501 14.263 1.00 0.00 H new ATOM 0 HB3 LYS A 60 14.896 -8.651 14.884 1.00 0.00 H new ATOM 0 HG2 LYS A 60 15.860 -7.660 13.006 1.00 0.00 H new ATOM 0 HG3 LYS A 60 14.659 -8.313 11.909 1.00 0.00 H new ATOM 0 HD2 LYS A 60 13.464 -6.375 12.009 1.00 0.00 H new ATOM 0 HD3 LYS A 60 13.300 -6.537 13.746 1.00 0.00 H new ATOM 0 HE2 LYS A 60 14.723 -4.744 13.984 1.00 0.00 H new ATOM 0 HE3 LYS A 60 16.015 -5.733 13.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 15.610 -3.781 11.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 15.244 -5.205 11.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 13.992 -4.247 11.702 1.00 0.00 H new ATOM 851 N CYS A 61 14.597 -12.310 14.699 1.00 0.00 N ATOM 852 CA CYS A 61 14.254 -13.317 15.745 1.00 0.00 C ATOM 853 C CYS A 61 14.718 -12.860 17.130 1.00 0.00 C ATOM 854 O CYS A 61 15.521 -11.957 17.256 1.00 0.00 O ATOM 855 CB CYS A 61 14.992 -14.579 15.305 1.00 0.00 C ATOM 856 SG CYS A 61 14.543 -14.948 13.591 1.00 0.00 S ATOM 0 H CYS A 61 15.362 -12.576 14.079 1.00 0.00 H new ATOM 0 HA CYS A 61 13.179 -13.472 15.834 1.00 0.00 H new ATOM 0 HB2 CYS A 61 16.069 -14.436 15.391 1.00 0.00 H new ATOM 0 HB3 CYS A 61 14.729 -15.415 15.953 1.00 0.00 H new ATOM 861 N PRO A 62 14.178 -13.510 18.127 1.00 0.00 N ATOM 862 CA PRO A 62 14.514 -13.186 19.538 1.00 0.00 C ATOM 863 C PRO A 62 15.953 -13.598 19.859 1.00 0.00 C ATOM 864 O PRO A 62 16.882 -12.833 19.701 1.00 0.00 O ATOM 865 CB PRO A 62 13.520 -14.028 20.339 1.00 0.00 C ATOM 866 CG PRO A 62 13.148 -15.153 19.431 1.00 0.00 C ATOM 867 CD PRO A 62 13.208 -14.608 18.032 1.00 0.00 C ATOM 0 HA PRO A 62 14.448 -12.121 19.760 1.00 0.00 H new ATOM 0 HB2 PRO A 62 13.968 -14.397 21.261 1.00 0.00 H new ATOM 0 HB3 PRO A 62 12.645 -13.443 20.622 1.00 0.00 H new ATOM 0 HG2 PRO A 62 13.834 -15.992 19.551 1.00 0.00 H new ATOM 0 HG3 PRO A 62 12.149 -15.523 19.661 1.00 0.00 H new ATOM 0 HD2 PRO A 62 13.531 -15.367 17.320 1.00 0.00 H new ATOM 0 HD3 PRO A 62 12.233 -14.253 17.698 1.00 0.00 H new ATOM 875 N HIS A 63 16.134 -14.806 20.309 1.00 0.00 N ATOM 876 CA HIS A 63 17.496 -15.299 20.644 1.00 0.00 C ATOM 877 C HIS A 63 17.467 -16.817 20.645 1.00 0.00 C ATOM 878 O HIS A 63 16.567 -17.415 21.200 1.00 0.00 O ATOM 879 CB HIS A 63 17.783 -14.773 22.045 1.00 0.00 C ATOM 880 CG HIS A 63 19.051 -13.965 22.024 1.00 0.00 C ATOM 881 ND1 HIS A 63 20.068 -14.157 22.947 1.00 0.00 N ATOM 882 CD2 HIS A 63 19.484 -12.967 21.190 1.00 0.00 C ATOM 883 CE1 HIS A 63 21.054 -13.291 22.648 1.00 0.00 C ATOM 884 NE2 HIS A 63 20.749 -12.541 21.585 1.00 0.00 N ATOM 0 H HIS A 63 15.385 -15.482 20.461 1.00 0.00 H new ATOM 0 HA HIS A 63 18.257 -14.970 19.936 1.00 0.00 H new ATOM 0 HB2 HIS A 63 16.952 -14.158 22.392 1.00 0.00 H new ATOM 0 HB3 HIS A 63 17.879 -15.603 22.745 1.00 0.00 H new ATOM 0 HD2 HIS A 63 18.928 -12.571 20.353 1.00 0.00 H new ATOM 0 HE1 HIS A 63 21.979 -13.212 23.200 1.00 0.00 H new ATOM 0 HE2 HIS A 63 21.320 -11.813 21.156 1.00 0.00 H new ATOM 892 N PRO A 64 18.434 -17.403 20.012 1.00 0.00 N ATOM 893 CA PRO A 64 18.472 -18.868 19.942 1.00 0.00 C ATOM 894 C PRO A 64 18.985 -19.432 21.263 1.00 0.00 C ATOM 895 O PRO A 64 20.042 -20.023 21.332 1.00 0.00 O ATOM 896 CB PRO A 64 19.448 -19.147 18.817 1.00 0.00 C ATOM 897 CG PRO A 64 20.347 -17.950 18.773 1.00 0.00 C ATOM 898 CD PRO A 64 19.566 -16.779 19.318 1.00 0.00 C ATOM 0 HA PRO A 64 17.497 -19.322 19.767 1.00 0.00 H new ATOM 0 HB2 PRO A 64 20.015 -20.059 19.004 1.00 0.00 H new ATOM 0 HB3 PRO A 64 18.928 -19.284 17.869 1.00 0.00 H new ATOM 0 HG2 PRO A 64 21.245 -18.122 19.367 1.00 0.00 H new ATOM 0 HG3 PRO A 64 20.673 -17.752 17.752 1.00 0.00 H new ATOM 0 HD2 PRO A 64 20.170 -16.178 19.998 1.00 0.00 H new ATOM 0 HD3 PRO A 64 19.230 -16.117 18.520 1.00 0.00 H new ATOM 906 N THR A 65 18.241 -19.256 22.311 1.00 0.00 N ATOM 907 CA THR A 65 18.681 -19.792 23.629 1.00 0.00 C ATOM 908 C THR A 65 18.200 -21.230 23.754 1.00 0.00 C ATOM 909 O THR A 65 17.630 -21.781 22.834 1.00 0.00 O ATOM 910 CB THR A 65 18.012 -18.924 24.704 1.00 0.00 C ATOM 911 OG1 THR A 65 16.788 -19.527 25.097 1.00 0.00 O ATOM 912 CG2 THR A 65 17.735 -17.523 24.163 1.00 0.00 C ATOM 0 H THR A 65 17.347 -18.765 22.317 1.00 0.00 H new ATOM 0 HA THR A 65 19.766 -19.771 23.735 1.00 0.00 H new ATOM 0 HB THR A 65 18.681 -18.844 25.561 1.00 0.00 H new ATOM 0 HG1 THR A 65 16.358 -18.977 25.785 1.00 0.00 H new ATOM 0 HG21 THR A 65 17.261 -16.921 24.938 1.00 0.00 H new ATOM 0 HG22 THR A 65 18.674 -17.056 23.864 1.00 0.00 H new ATOM 0 HG23 THR A 65 17.073 -17.591 23.300 1.00 0.00 H new ATOM 920 N ILE A 66 18.407 -21.845 24.878 1.00 0.00 N ATOM 921 CA ILE A 66 17.934 -23.244 25.024 1.00 0.00 C ATOM 922 C ILE A 66 18.280 -23.792 26.416 1.00 0.00 C ATOM 923 O ILE A 66 19.019 -23.190 27.171 1.00 0.00 O ATOM 924 CB ILE A 66 18.632 -24.042 23.898 1.00 0.00 C ATOM 925 CG1 ILE A 66 18.890 -25.483 24.351 1.00 0.00 C ATOM 926 CG2 ILE A 66 19.965 -23.396 23.514 1.00 0.00 C ATOM 927 CD1 ILE A 66 19.597 -26.244 23.233 1.00 0.00 C ATOM 0 H ILE A 66 18.876 -21.448 25.692 1.00 0.00 H new ATOM 0 HA ILE A 66 16.850 -23.320 24.937 1.00 0.00 H new ATOM 0 HB ILE A 66 17.972 -24.040 23.031 1.00 0.00 H new ATOM 0 HG12 ILE A 66 19.501 -25.489 25.253 1.00 0.00 H new ATOM 0 HG13 ILE A 66 17.948 -25.972 24.601 1.00 0.00 H new ATOM 0 HG21 ILE A 66 20.435 -23.977 22.720 1.00 0.00 H new ATOM 0 HG22 ILE A 66 19.789 -22.379 23.164 1.00 0.00 H new ATOM 0 HG23 ILE A 66 20.622 -23.372 24.384 1.00 0.00 H new ATOM 0 HD11 ILE A 66 19.782 -27.270 23.552 1.00 0.00 H new ATOM 0 HD12 ILE A 66 18.969 -26.249 22.342 1.00 0.00 H new ATOM 0 HD13 ILE A 66 20.546 -25.758 23.005 1.00 0.00 H new ATOM 939 N SER A 67 17.735 -24.930 26.758 1.00 0.00 N ATOM 940 CA SER A 67 18.006 -25.531 28.097 1.00 0.00 C ATOM 941 C SER A 67 19.453 -26.025 28.192 1.00 0.00 C ATOM 942 O SER A 67 19.758 -27.156 27.870 1.00 0.00 O ATOM 943 CB SER A 67 17.029 -26.705 28.203 1.00 0.00 C ATOM 944 OG SER A 67 16.832 -27.046 29.572 1.00 0.00 O ATOM 0 H SER A 67 17.109 -25.473 26.163 1.00 0.00 H new ATOM 0 HA SER A 67 17.875 -24.809 28.903 1.00 0.00 H new ATOM 0 HB2 SER A 67 16.077 -26.440 27.744 1.00 0.00 H new ATOM 0 HB3 SER A 67 17.418 -27.564 27.657 1.00 0.00 H new ATOM 0 HG SER A 67 16.205 -27.797 29.635 1.00 0.00 H new ATOM 950 N ASN A 68 20.342 -25.186 28.645 1.00 0.00 N ATOM 951 CA ASN A 68 21.768 -25.603 28.781 1.00 0.00 C ATOM 952 C ASN A 68 22.283 -26.222 27.478 1.00 0.00 C ATOM 953 O ASN A 68 23.090 -27.128 27.490 1.00 0.00 O ATOM 954 CB ASN A 68 21.765 -26.643 29.901 1.00 0.00 C ATOM 955 CG ASN A 68 21.984 -25.946 31.244 1.00 0.00 C ATOM 956 OD1 ASN A 68 22.915 -26.260 31.959 1.00 0.00 O ATOM 957 ND2 ASN A 68 21.161 -25.006 31.620 1.00 0.00 N ATOM 0 H ASN A 68 20.143 -24.226 28.928 1.00 0.00 H new ATOM 0 HA ASN A 68 22.420 -24.758 29.000 1.00 0.00 H new ATOM 0 HB2 ASN A 68 20.818 -27.182 29.909 1.00 0.00 H new ATOM 0 HB3 ASN A 68 22.549 -27.380 29.729 1.00 0.00 H new ATOM 0 HD21 ASN A 68 21.299 -24.535 32.514 1.00 0.00 H new ATOM 0 HD22 ASN A 68 20.379 -24.742 31.020 1.00 0.00 H new ATOM 964 N GLY A 69 21.833 -25.738 26.355 1.00 0.00 N ATOM 965 CA GLY A 69 22.314 -26.302 25.062 1.00 0.00 C ATOM 966 C GLY A 69 22.546 -25.163 24.071 1.00 0.00 C ATOM 967 O GLY A 69 22.392 -25.326 22.878 1.00 0.00 O ATOM 0 H GLY A 69 21.156 -24.979 26.275 1.00 0.00 H new ATOM 0 HA2 GLY A 69 23.238 -26.859 25.216 1.00 0.00 H new ATOM 0 HA3 GLY A 69 21.581 -27.003 24.663 1.00 0.00 H new ATOM 971 N TYR A 70 22.896 -24.009 24.570 1.00 0.00 N ATOM 972 CA TYR A 70 23.131 -22.825 23.689 1.00 0.00 C ATOM 973 C TYR A 70 23.921 -23.169 22.441 1.00 0.00 C ATOM 974 O TYR A 70 24.255 -24.299 22.170 1.00 0.00 O ATOM 975 CB TYR A 70 23.940 -21.837 24.525 1.00 0.00 C ATOM 976 CG TYR A 70 25.359 -22.343 24.694 1.00 0.00 C ATOM 977 CD1 TYR A 70 25.610 -23.529 25.400 1.00 0.00 C ATOM 978 CD2 TYR A 70 26.428 -21.623 24.144 1.00 0.00 C ATOM 979 CE1 TYR A 70 26.922 -23.989 25.555 1.00 0.00 C ATOM 980 CE2 TYR A 70 27.740 -22.085 24.299 1.00 0.00 C ATOM 981 CZ TYR A 70 27.987 -23.268 25.004 1.00 0.00 C ATOM 982 OH TYR A 70 29.281 -23.723 25.157 1.00 0.00 O ATOM 0 H TYR A 70 23.032 -23.832 25.565 1.00 0.00 H new ATOM 0 HA TYR A 70 22.174 -22.427 23.352 1.00 0.00 H new ATOM 0 HB2 TYR A 70 23.948 -20.860 24.042 1.00 0.00 H new ATOM 0 HB3 TYR A 70 23.473 -21.706 25.501 1.00 0.00 H new ATOM 0 HD1 TYR A 70 24.789 -24.088 25.825 1.00 0.00 H new ATOM 0 HD2 TYR A 70 26.239 -20.710 23.599 1.00 0.00 H new ATOM 0 HE1 TYR A 70 27.113 -24.901 26.100 1.00 0.00 H new ATOM 0 HE2 TYR A 70 28.562 -21.528 23.874 1.00 0.00 H new ATOM 0 HH TYR A 70 29.899 -23.106 24.713 1.00 0.00 H new ATOM 992 N LEU A 71 24.240 -22.160 21.698 1.00 0.00 N ATOM 993 CA LEU A 71 25.033 -22.369 20.457 1.00 0.00 C ATOM 994 C LEU A 71 26.412 -21.721 20.600 1.00 0.00 C ATOM 995 O LEU A 71 26.618 -20.846 21.417 1.00 0.00 O ATOM 996 CB LEU A 71 24.212 -21.755 19.297 1.00 0.00 C ATOM 997 CG LEU A 71 23.690 -20.342 19.610 1.00 0.00 C ATOM 998 CD1 LEU A 71 22.442 -20.434 20.481 1.00 0.00 C ATOM 999 CD2 LEU A 71 24.755 -19.499 20.316 1.00 0.00 C ATOM 0 H LEU A 71 23.987 -21.191 21.893 1.00 0.00 H new ATOM 0 HA LEU A 71 25.212 -23.426 20.261 1.00 0.00 H new ATOM 0 HB2 LEU A 71 24.832 -21.717 18.401 1.00 0.00 H new ATOM 0 HB3 LEU A 71 23.367 -22.407 19.073 1.00 0.00 H new ATOM 0 HG LEU A 71 23.444 -19.855 18.667 1.00 0.00 H new ATOM 0 HD11 LEU A 71 22.076 -19.431 20.700 1.00 0.00 H new ATOM 0 HD12 LEU A 71 21.670 -20.994 19.953 1.00 0.00 H new ATOM 0 HD13 LEU A 71 22.686 -20.943 21.414 1.00 0.00 H new ATOM 0 HD21 LEU A 71 24.355 -18.506 20.523 1.00 0.00 H new ATOM 0 HD22 LEU A 71 25.037 -19.979 21.253 1.00 0.00 H new ATOM 0 HD23 LEU A 71 25.632 -19.410 19.675 1.00 0.00 H new ATOM 1011 N SER A 72 27.366 -22.161 19.831 1.00 0.00 N ATOM 1012 CA SER A 72 28.732 -21.579 19.943 1.00 0.00 C ATOM 1013 C SER A 72 29.346 -21.408 18.552 1.00 0.00 C ATOM 1014 O SER A 72 30.547 -21.300 18.401 1.00 0.00 O ATOM 1015 CB SER A 72 29.530 -22.599 20.753 1.00 0.00 C ATOM 1016 OG SER A 72 30.205 -21.935 21.813 1.00 0.00 O ATOM 0 H SER A 72 27.261 -22.896 19.132 1.00 0.00 H new ATOM 0 HA SER A 72 28.725 -20.596 20.414 1.00 0.00 H new ATOM 0 HB2 SER A 72 28.864 -23.363 21.153 1.00 0.00 H new ATOM 0 HB3 SER A 72 30.249 -23.107 20.111 1.00 0.00 H new ATOM 0 HG SER A 72 30.716 -22.588 22.335 1.00 0.00 H new ATOM 1022 N SER A 73 28.532 -21.396 17.532 1.00 0.00 N ATOM 1023 CA SER A 73 29.071 -21.247 16.150 1.00 0.00 C ATOM 1024 C SER A 73 28.941 -19.801 15.668 1.00 0.00 C ATOM 1025 O SER A 73 29.864 -19.017 15.770 1.00 0.00 O ATOM 1026 CB SER A 73 28.215 -22.179 15.295 1.00 0.00 C ATOM 1027 OG SER A 73 28.570 -22.019 13.928 1.00 0.00 O ATOM 0 H SER A 73 27.518 -21.483 17.596 1.00 0.00 H new ATOM 0 HA SER A 73 30.131 -21.494 16.095 1.00 0.00 H new ATOM 0 HB2 SER A 73 28.365 -23.214 15.603 1.00 0.00 H new ATOM 0 HB3 SER A 73 27.158 -21.954 15.437 1.00 0.00 H new ATOM 0 HG SER A 73 28.024 -22.617 13.376 1.00 0.00 H new ATOM 1033 N GLY A 74 27.808 -19.444 15.132 1.00 0.00 N ATOM 1034 CA GLY A 74 27.625 -18.052 14.631 1.00 0.00 C ATOM 1035 C GLY A 74 26.882 -17.215 15.669 1.00 0.00 C ATOM 1036 O GLY A 74 27.479 -16.531 16.478 1.00 0.00 O ATOM 0 H GLY A 74 27.000 -20.056 15.019 1.00 0.00 H new ATOM 0 HA2 GLY A 74 28.595 -17.603 14.417 1.00 0.00 H new ATOM 0 HA3 GLY A 74 27.067 -18.064 13.695 1.00 0.00 H new ATOM 1040 N PHE A 75 25.582 -17.254 15.642 1.00 0.00 N ATOM 1041 CA PHE A 75 24.787 -16.456 16.615 1.00 0.00 C ATOM 1042 C PHE A 75 25.149 -14.972 16.503 1.00 0.00 C ATOM 1043 O PHE A 75 26.204 -14.544 16.928 1.00 0.00 O ATOM 1044 CB PHE A 75 25.162 -16.998 17.998 1.00 0.00 C ATOM 1045 CG PHE A 75 24.676 -16.034 19.056 1.00 0.00 C ATOM 1046 CD1 PHE A 75 25.472 -14.943 19.426 1.00 0.00 C ATOM 1047 CD2 PHE A 75 23.424 -16.221 19.654 1.00 0.00 C ATOM 1048 CE1 PHE A 75 25.016 -14.039 20.391 1.00 0.00 C ATOM 1049 CE2 PHE A 75 22.970 -15.319 20.623 1.00 0.00 C ATOM 1050 CZ PHE A 75 23.765 -14.226 20.990 1.00 0.00 C ATOM 0 H PHE A 75 25.032 -17.807 14.985 1.00 0.00 H new ATOM 0 HA PHE A 75 23.716 -16.539 16.429 1.00 0.00 H new ATOM 0 HB2 PHE A 75 24.715 -17.980 18.151 1.00 0.00 H new ATOM 0 HB3 PHE A 75 26.242 -17.124 18.072 1.00 0.00 H new ATOM 0 HD1 PHE A 75 26.439 -14.799 18.966 1.00 0.00 H new ATOM 0 HD2 PHE A 75 22.809 -17.061 19.368 1.00 0.00 H new ATOM 0 HE1 PHE A 75 25.629 -13.196 20.674 1.00 0.00 H new ATOM 0 HE2 PHE A 75 22.006 -15.466 21.088 1.00 0.00 H new ATOM 0 HZ PHE A 75 23.413 -13.528 21.735 1.00 0.00 H new ATOM 1060 N LYS A 76 24.276 -14.183 15.941 1.00 0.00 N ATOM 1061 CA LYS A 76 24.557 -12.724 15.813 1.00 0.00 C ATOM 1062 C LYS A 76 23.549 -11.948 16.664 1.00 0.00 C ATOM 1063 O LYS A 76 22.358 -12.097 16.498 1.00 0.00 O ATOM 1064 CB LYS A 76 24.381 -12.411 14.322 1.00 0.00 C ATOM 1065 CG LYS A 76 24.096 -10.917 14.127 1.00 0.00 C ATOM 1066 CD LYS A 76 25.148 -10.088 14.869 1.00 0.00 C ATOM 1067 CE LYS A 76 26.072 -9.412 13.854 1.00 0.00 C ATOM 1068 NZ LYS A 76 27.422 -9.444 14.484 1.00 0.00 N ATOM 0 H LYS A 76 23.378 -14.486 15.564 1.00 0.00 H new ATOM 0 HA LYS A 76 25.554 -12.447 16.155 1.00 0.00 H new ATOM 0 HB2 LYS A 76 25.281 -12.692 13.775 1.00 0.00 H new ATOM 0 HB3 LYS A 76 23.562 -13.002 13.913 1.00 0.00 H new ATOM 0 HG2 LYS A 76 24.108 -10.671 13.065 1.00 0.00 H new ATOM 0 HG3 LYS A 76 23.100 -10.676 14.499 1.00 0.00 H new ATOM 0 HD2 LYS A 76 24.662 -9.337 15.491 1.00 0.00 H new ATOM 0 HD3 LYS A 76 25.727 -10.727 15.535 1.00 0.00 H new ATOM 0 HE2 LYS A 76 26.068 -9.942 12.902 1.00 0.00 H new ATOM 0 HE3 LYS A 76 25.755 -8.389 13.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 28.113 -8.998 13.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 27.397 -8.926 15.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 27.700 -10.431 14.659 1.00 0.00 H new ATOM 1082 N ARG A 77 24.027 -11.140 17.581 1.00 0.00 N ATOM 1083 CA ARG A 77 23.111 -10.357 18.473 1.00 0.00 C ATOM 1084 C ARG A 77 21.782 -10.058 17.776 1.00 0.00 C ATOM 1085 O ARG A 77 20.726 -10.125 18.373 1.00 0.00 O ATOM 1086 CB ARG A 77 23.863 -9.060 18.769 1.00 0.00 C ATOM 1087 CG ARG A 77 24.034 -8.910 20.281 1.00 0.00 C ATOM 1088 CD ARG A 77 24.519 -7.495 20.607 1.00 0.00 C ATOM 1089 NE ARG A 77 25.762 -7.686 21.407 1.00 0.00 N ATOM 1090 CZ ARG A 77 25.761 -8.490 22.437 1.00 0.00 C ATOM 1091 NH1 ARG A 77 25.236 -8.102 23.567 1.00 0.00 N ATOM 1092 NH2 ARG A 77 26.284 -9.681 22.333 1.00 0.00 N ATOM 0 H ARG A 77 25.021 -10.988 17.751 1.00 0.00 H new ATOM 0 HA ARG A 77 22.863 -10.909 19.379 1.00 0.00 H new ATOM 0 HB2 ARG A 77 24.837 -9.071 18.280 1.00 0.00 H new ATOM 0 HB3 ARG A 77 23.315 -8.208 18.367 1.00 0.00 H new ATOM 0 HG2 ARG A 77 23.088 -9.106 20.785 1.00 0.00 H new ATOM 0 HG3 ARG A 77 24.750 -9.644 20.651 1.00 0.00 H new ATOM 0 HD2 ARG A 77 24.718 -6.927 19.698 1.00 0.00 H new ATOM 0 HD3 ARG A 77 23.768 -6.941 21.171 1.00 0.00 H new ATOM 0 HE ARG A 77 26.615 -7.188 21.150 1.00 0.00 H new ATOM 0 HH11 ARG A 77 24.826 -7.171 23.646 1.00 0.00 H new ATOM 0 HH12 ARG A 77 25.235 -8.730 24.371 1.00 0.00 H new ATOM 0 HH21 ARG A 77 26.693 -9.983 21.449 1.00 0.00 H new ATOM 0 HH22 ARG A 77 26.284 -10.310 23.136 1.00 0.00 H new ATOM 1106 N SER A 78 21.828 -9.746 16.515 1.00 0.00 N ATOM 1107 CA SER A 78 20.571 -9.460 15.768 1.00 0.00 C ATOM 1108 C SER A 78 20.466 -10.392 14.555 1.00 0.00 C ATOM 1109 O SER A 78 21.162 -10.228 13.573 1.00 0.00 O ATOM 1110 CB SER A 78 20.694 -8.000 15.328 1.00 0.00 C ATOM 1111 OG SER A 78 20.932 -7.946 13.927 1.00 0.00 O ATOM 0 H SER A 78 22.684 -9.676 15.965 1.00 0.00 H new ATOM 0 HA SER A 78 19.677 -9.621 16.371 1.00 0.00 H new ATOM 0 HB2 SER A 78 19.782 -7.457 15.574 1.00 0.00 H new ATOM 0 HB3 SER A 78 21.509 -7.514 15.865 1.00 0.00 H new ATOM 0 HG SER A 78 21.603 -8.617 13.683 1.00 0.00 H new ATOM 1117 N TYR A 79 19.610 -11.376 14.619 1.00 0.00 N ATOM 1118 CA TYR A 79 19.475 -12.322 13.467 1.00 0.00 C ATOM 1119 C TYR A 79 18.384 -11.828 12.514 1.00 0.00 C ATOM 1120 O TYR A 79 17.709 -10.855 12.785 1.00 0.00 O ATOM 1121 CB TYR A 79 19.071 -13.677 14.066 1.00 0.00 C ATOM 1122 CG TYR A 79 19.600 -13.820 15.474 1.00 0.00 C ATOM 1123 CD1 TYR A 79 20.916 -14.247 15.690 1.00 0.00 C ATOM 1124 CD2 TYR A 79 18.769 -13.531 16.562 1.00 0.00 C ATOM 1125 CE1 TYR A 79 21.398 -14.385 16.998 1.00 0.00 C ATOM 1126 CE2 TYR A 79 19.252 -13.666 17.866 1.00 0.00 C ATOM 1127 CZ TYR A 79 20.564 -14.094 18.084 1.00 0.00 C ATOM 1128 OH TYR A 79 21.037 -14.227 19.371 1.00 0.00 O ATOM 0 H TYR A 79 19.000 -11.568 15.414 1.00 0.00 H new ATOM 0 HA TYR A 79 20.405 -12.398 12.903 1.00 0.00 H new ATOM 0 HB2 TYR A 79 17.985 -13.769 14.070 1.00 0.00 H new ATOM 0 HB3 TYR A 79 19.457 -14.484 13.444 1.00 0.00 H new ATOM 0 HD1 TYR A 79 21.558 -14.469 14.850 1.00 0.00 H new ATOM 0 HD2 TYR A 79 17.754 -13.203 16.394 1.00 0.00 H new ATOM 0 HE1 TYR A 79 22.412 -14.716 17.168 1.00 0.00 H new ATOM 0 HE2 TYR A 79 18.611 -13.440 18.705 1.00 0.00 H new ATOM 0 HH TYR A 79 21.748 -14.901 19.390 1.00 0.00 H new ATOM 1138 N SER A 80 18.201 -12.489 11.402 1.00 0.00 N ATOM 1139 CA SER A 80 17.146 -12.042 10.450 1.00 0.00 C ATOM 1140 C SER A 80 16.929 -13.083 9.331 1.00 0.00 C ATOM 1141 O SER A 80 17.737 -13.219 8.435 1.00 0.00 O ATOM 1142 CB SER A 80 17.679 -10.736 9.867 1.00 0.00 C ATOM 1143 OG SER A 80 16.685 -9.728 9.991 1.00 0.00 O ATOM 0 H SER A 80 18.731 -13.311 11.114 1.00 0.00 H new ATOM 0 HA SER A 80 16.181 -11.917 10.942 1.00 0.00 H new ATOM 0 HB2 SER A 80 18.587 -10.434 10.390 1.00 0.00 H new ATOM 0 HB3 SER A 80 17.945 -10.874 8.819 1.00 0.00 H new ATOM 0 HG SER A 80 17.024 -8.887 9.619 1.00 0.00 H new ATOM 1149 N TYR A 81 15.832 -13.800 9.368 1.00 0.00 N ATOM 1150 CA TYR A 81 15.542 -14.815 8.302 1.00 0.00 C ATOM 1151 C TYR A 81 16.767 -15.701 8.007 1.00 0.00 C ATOM 1152 O TYR A 81 16.834 -16.365 6.992 1.00 0.00 O ATOM 1153 CB TYR A 81 15.132 -13.979 7.086 1.00 0.00 C ATOM 1154 CG TYR A 81 15.356 -14.741 5.800 1.00 0.00 C ATOM 1155 CD1 TYR A 81 14.480 -15.770 5.436 1.00 0.00 C ATOM 1156 CD2 TYR A 81 16.438 -14.417 4.971 1.00 0.00 C ATOM 1157 CE1 TYR A 81 14.684 -16.475 4.245 1.00 0.00 C ATOM 1158 CE2 TYR A 81 16.643 -15.124 3.779 1.00 0.00 C ATOM 1159 CZ TYR A 81 15.765 -16.153 3.416 1.00 0.00 C ATOM 1160 OH TYR A 81 15.965 -16.849 2.241 1.00 0.00 O ATOM 0 H TYR A 81 15.120 -13.727 10.094 1.00 0.00 H new ATOM 0 HA TYR A 81 14.762 -15.516 8.600 1.00 0.00 H new ATOM 0 HB2 TYR A 81 14.081 -13.702 7.169 1.00 0.00 H new ATOM 0 HB3 TYR A 81 15.706 -13.052 7.068 1.00 0.00 H new ATOM 0 HD1 TYR A 81 13.646 -16.020 6.075 1.00 0.00 H new ATOM 0 HD2 TYR A 81 17.114 -13.622 5.251 1.00 0.00 H new ATOM 0 HE1 TYR A 81 14.007 -17.268 3.965 1.00 0.00 H new ATOM 0 HE2 TYR A 81 17.478 -14.876 3.140 1.00 0.00 H new ATOM 0 HH TYR A 81 16.758 -16.499 1.784 1.00 0.00 H new ATOM 1170 N ASN A 82 17.726 -15.753 8.889 1.00 0.00 N ATOM 1171 CA ASN A 82 18.904 -16.629 8.628 1.00 0.00 C ATOM 1172 C ASN A 82 19.818 -16.692 9.854 1.00 0.00 C ATOM 1173 O ASN A 82 19.373 -16.978 10.948 1.00 0.00 O ATOM 1174 CB ASN A 82 19.612 -15.998 7.431 1.00 0.00 C ATOM 1175 CG ASN A 82 19.855 -14.512 7.699 1.00 0.00 C ATOM 1176 OD1 ASN A 82 19.858 -14.079 8.834 1.00 0.00 O ATOM 1177 ND2 ASN A 82 20.066 -13.705 6.693 1.00 0.00 N ATOM 0 H ASN A 82 17.747 -15.235 9.768 1.00 0.00 H new ATOM 0 HA ASN A 82 18.613 -17.659 8.422 1.00 0.00 H new ATOM 0 HB2 ASN A 82 20.560 -16.504 7.249 1.00 0.00 H new ATOM 0 HB3 ASN A 82 19.007 -16.121 6.532 1.00 0.00 H new ATOM 0 HD21 ASN A 82 20.233 -12.713 6.861 1.00 0.00 H new ATOM 0 HD22 ASN A 82 20.064 -14.067 5.739 1.00 0.00 H new ATOM 1184 N ASP A 83 21.091 -16.456 9.690 1.00 0.00 N ATOM 1185 CA ASP A 83 22.002 -16.538 10.858 1.00 0.00 C ATOM 1186 C ASP A 83 21.807 -17.889 11.541 1.00 0.00 C ATOM 1187 O ASP A 83 21.226 -17.985 12.604 1.00 0.00 O ATOM 1188 CB ASP A 83 21.586 -15.391 11.779 1.00 0.00 C ATOM 1189 CG ASP A 83 22.472 -14.173 11.508 1.00 0.00 C ATOM 1190 OD1 ASP A 83 23.425 -14.313 10.759 1.00 0.00 O ATOM 1191 OD2 ASP A 83 22.182 -13.122 12.054 1.00 0.00 O ATOM 0 H ASP A 83 21.534 -16.212 8.804 1.00 0.00 H new ATOM 0 HA ASP A 83 23.054 -16.455 10.585 1.00 0.00 H new ATOM 0 HB2 ASP A 83 20.539 -15.137 11.612 1.00 0.00 H new ATOM 0 HB3 ASP A 83 21.677 -15.696 12.821 1.00 0.00 H new ATOM 1196 N ASN A 84 22.276 -18.937 10.925 1.00 0.00 N ATOM 1197 CA ASN A 84 22.105 -20.288 11.521 1.00 0.00 C ATOM 1198 C ASN A 84 22.951 -20.416 12.789 1.00 0.00 C ATOM 1199 O ASN A 84 24.082 -19.973 12.838 1.00 0.00 O ATOM 1200 CB ASN A 84 22.601 -21.256 10.448 1.00 0.00 C ATOM 1201 CG ASN A 84 24.119 -21.126 10.311 1.00 0.00 C ATOM 1202 OD1 ASN A 84 24.855 -21.489 11.207 1.00 0.00 O ATOM 1203 ND2 ASN A 84 24.621 -20.617 9.219 1.00 0.00 N ATOM 0 H ASN A 84 22.771 -18.915 10.033 1.00 0.00 H new ATOM 0 HA ASN A 84 21.072 -20.487 11.806 1.00 0.00 H new ATOM 0 HB2 ASN A 84 22.335 -22.279 10.714 1.00 0.00 H new ATOM 0 HB3 ASN A 84 22.119 -21.039 9.495 1.00 0.00 H new ATOM 0 HD21 ASN A 84 25.632 -20.524 9.117 1.00 0.00 H new ATOM 0 HD22 ASN A 84 24.003 -20.312 8.467 1.00 0.00 H new ATOM 1210 N VAL A 85 22.416 -21.018 13.816 1.00 0.00 N ATOM 1211 CA VAL A 85 23.199 -21.170 15.073 1.00 0.00 C ATOM 1212 C VAL A 85 23.277 -22.639 15.488 1.00 0.00 C ATOM 1213 O VAL A 85 22.276 -23.274 15.756 1.00 0.00 O ATOM 1214 CB VAL A 85 22.450 -20.362 16.125 1.00 0.00 C ATOM 1215 CG1 VAL A 85 22.700 -18.874 15.883 1.00 0.00 C ATOM 1216 CG2 VAL A 85 20.949 -20.652 16.037 1.00 0.00 C ATOM 0 H VAL A 85 21.474 -21.409 13.838 1.00 0.00 H new ATOM 0 HA VAL A 85 24.224 -20.822 14.948 1.00 0.00 H new ATOM 0 HB VAL A 85 22.806 -20.640 17.117 1.00 0.00 H new ATOM 0 HG11 VAL A 85 22.167 -18.289 16.632 1.00 0.00 H new ATOM 0 HG12 VAL A 85 23.768 -18.668 15.954 1.00 0.00 H new ATOM 0 HG13 VAL A 85 22.344 -18.602 14.889 1.00 0.00 H new ATOM 0 HG21 VAL A 85 20.421 -20.070 16.793 1.00 0.00 H new ATOM 0 HG22 VAL A 85 20.583 -20.379 15.047 1.00 0.00 H new ATOM 0 HG23 VAL A 85 20.773 -21.714 16.208 1.00 0.00 H new ATOM 1226 N ASP A 86 24.462 -23.175 15.567 1.00 0.00 N ATOM 1227 CA ASP A 86 24.609 -24.597 15.992 1.00 0.00 C ATOM 1228 C ASP A 86 24.539 -24.653 17.519 1.00 0.00 C ATOM 1229 O ASP A 86 25.160 -23.864 18.201 1.00 0.00 O ATOM 1230 CB ASP A 86 25.988 -25.030 15.494 1.00 0.00 C ATOM 1231 CG ASP A 86 25.998 -26.542 15.266 1.00 0.00 C ATOM 1232 OD1 ASP A 86 25.543 -27.256 16.145 1.00 0.00 O ATOM 1233 OD2 ASP A 86 26.462 -26.960 14.218 1.00 0.00 O ATOM 0 H ASP A 86 25.335 -22.692 15.356 1.00 0.00 H new ATOM 0 HA ASP A 86 23.831 -25.248 15.594 1.00 0.00 H new ATOM 0 HB2 ASP A 86 26.231 -24.510 14.567 1.00 0.00 H new ATOM 0 HB3 ASP A 86 26.751 -24.757 16.222 1.00 0.00 H new ATOM 1238 N PHE A 87 23.765 -25.545 18.063 1.00 0.00 N ATOM 1239 CA PHE A 87 23.637 -25.598 19.544 1.00 0.00 C ATOM 1240 C PHE A 87 24.636 -26.557 20.181 1.00 0.00 C ATOM 1241 O PHE A 87 24.667 -27.740 19.906 1.00 0.00 O ATOM 1242 CB PHE A 87 22.197 -26.023 19.792 1.00 0.00 C ATOM 1243 CG PHE A 87 21.327 -24.834 19.496 1.00 0.00 C ATOM 1244 CD1 PHE A 87 21.071 -23.898 20.501 1.00 0.00 C ATOM 1245 CD2 PHE A 87 20.810 -24.643 18.210 1.00 0.00 C ATOM 1246 CE1 PHE A 87 20.300 -22.770 20.223 1.00 0.00 C ATOM 1247 CE2 PHE A 87 20.031 -23.516 17.934 1.00 0.00 C ATOM 1248 CZ PHE A 87 19.779 -22.578 18.942 1.00 0.00 C ATOM 0 H PHE A 87 23.218 -26.237 17.551 1.00 0.00 H new ATOM 0 HA PHE A 87 23.863 -24.635 20.002 1.00 0.00 H new ATOM 0 HB2 PHE A 87 21.929 -26.865 19.154 1.00 0.00 H new ATOM 0 HB3 PHE A 87 22.064 -26.350 20.823 1.00 0.00 H new ATOM 0 HD1 PHE A 87 21.470 -24.048 21.493 1.00 0.00 H new ATOM 0 HD2 PHE A 87 21.012 -25.365 17.432 1.00 0.00 H new ATOM 0 HE1 PHE A 87 20.106 -22.044 20.999 1.00 0.00 H new ATOM 0 HE2 PHE A 87 19.624 -23.369 16.944 1.00 0.00 H new ATOM 0 HZ PHE A 87 19.181 -21.705 18.729 1.00 0.00 H new ATOM 1258 N LYS A 88 25.449 -26.022 21.046 1.00 0.00 N ATOM 1259 CA LYS A 88 26.471 -26.828 21.756 1.00 0.00 C ATOM 1260 C LYS A 88 25.906 -27.322 23.088 1.00 0.00 C ATOM 1261 O LYS A 88 26.017 -26.655 24.097 1.00 0.00 O ATOM 1262 CB LYS A 88 27.603 -25.837 22.009 1.00 0.00 C ATOM 1263 CG LYS A 88 28.945 -26.485 21.665 1.00 0.00 C ATOM 1264 CD LYS A 88 29.388 -26.030 20.274 1.00 0.00 C ATOM 1265 CE LYS A 88 30.826 -25.508 20.339 1.00 0.00 C ATOM 1266 NZ LYS A 88 31.672 -26.717 20.563 1.00 0.00 N ATOM 0 H LYS A 88 25.445 -25.033 21.295 1.00 0.00 H new ATOM 0 HA LYS A 88 26.790 -27.705 21.193 1.00 0.00 H new ATOM 0 HB2 LYS A 88 27.456 -24.941 21.406 1.00 0.00 H new ATOM 0 HB3 LYS A 88 27.597 -25.523 23.053 1.00 0.00 H new ATOM 0 HG2 LYS A 88 29.695 -26.209 22.406 1.00 0.00 H new ATOM 0 HG3 LYS A 88 28.855 -27.571 21.693 1.00 0.00 H new ATOM 0 HD2 LYS A 88 29.323 -26.860 19.571 1.00 0.00 H new ATOM 0 HD3 LYS A 88 28.723 -25.248 19.907 1.00 0.00 H new ATOM 0 HE2 LYS A 88 31.102 -25.000 19.415 1.00 0.00 H new ATOM 0 HE3 LYS A 88 30.947 -24.787 21.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 32.671 -26.477 20.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 31.551 -27.049 21.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 31.385 -27.469 19.904 1.00 0.00 H new ATOM 1280 N CYS A 89 25.302 -28.476 23.106 1.00 0.00 N ATOM 1281 CA CYS A 89 24.739 -28.985 24.387 1.00 0.00 C ATOM 1282 C CYS A 89 25.743 -28.762 25.518 1.00 0.00 C ATOM 1283 O CYS A 89 26.909 -29.081 25.391 1.00 0.00 O ATOM 1284 CB CYS A 89 24.505 -30.475 24.160 1.00 0.00 C ATOM 1285 SG CYS A 89 22.881 -30.923 24.814 1.00 0.00 S ATOM 0 H CYS A 89 25.174 -29.084 22.297 1.00 0.00 H new ATOM 0 HA CYS A 89 23.818 -28.474 24.668 1.00 0.00 H new ATOM 0 HB2 CYS A 89 24.559 -30.707 23.096 1.00 0.00 H new ATOM 0 HB3 CYS A 89 25.283 -31.058 24.653 1.00 0.00 H new ATOM 1290 N LYS A 90 25.300 -28.205 26.614 1.00 0.00 N ATOM 1291 CA LYS A 90 26.232 -27.946 27.756 1.00 0.00 C ATOM 1292 C LYS A 90 27.244 -29.089 27.901 1.00 0.00 C ATOM 1293 O LYS A 90 28.415 -28.935 27.618 1.00 0.00 O ATOM 1294 CB LYS A 90 25.340 -27.870 28.996 1.00 0.00 C ATOM 1295 CG LYS A 90 25.275 -26.424 29.494 1.00 0.00 C ATOM 1296 CD LYS A 90 26.440 -26.159 30.451 1.00 0.00 C ATOM 1297 CE LYS A 90 27.519 -25.351 29.728 1.00 0.00 C ATOM 1298 NZ LYS A 90 27.524 -24.023 30.404 1.00 0.00 N ATOM 0 H LYS A 90 24.334 -27.917 26.770 1.00 0.00 H new ATOM 0 HA LYS A 90 26.807 -27.032 27.606 1.00 0.00 H new ATOM 0 HB2 LYS A 90 24.339 -28.229 28.758 1.00 0.00 H new ATOM 0 HB3 LYS A 90 25.733 -28.518 29.779 1.00 0.00 H new ATOM 0 HG2 LYS A 90 25.320 -25.736 28.650 1.00 0.00 H new ATOM 0 HG3 LYS A 90 24.327 -26.245 30.001 1.00 0.00 H new ATOM 0 HD2 LYS A 90 26.088 -25.614 31.327 1.00 0.00 H new ATOM 0 HD3 LYS A 90 26.854 -27.102 30.807 1.00 0.00 H new ATOM 0 HE2 LYS A 90 28.492 -25.836 29.803 1.00 0.00 H new ATOM 0 HE3 LYS A 90 27.293 -25.253 28.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 28.240 -23.412 29.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 26.587 -23.582 30.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 27.749 -24.147 31.412 1.00 0.00 H new ATOM 1312 N TYR A 91 26.798 -30.234 28.339 1.00 0.00 N ATOM 1313 CA TYR A 91 27.733 -31.389 28.504 1.00 0.00 C ATOM 1314 C TYR A 91 26.959 -32.648 28.912 1.00 0.00 C ATOM 1315 O TYR A 91 25.983 -32.580 29.630 1.00 0.00 O ATOM 1316 CB TYR A 91 28.688 -30.968 29.621 1.00 0.00 C ATOM 1317 CG TYR A 91 29.848 -31.933 29.684 1.00 0.00 C ATOM 1318 CD1 TYR A 91 30.841 -31.897 28.698 1.00 0.00 C ATOM 1319 CD2 TYR A 91 29.931 -32.862 30.728 1.00 0.00 C ATOM 1320 CE1 TYR A 91 31.918 -32.790 28.756 1.00 0.00 C ATOM 1321 CE2 TYR A 91 31.008 -33.756 30.786 1.00 0.00 C ATOM 1322 CZ TYR A 91 32.002 -33.720 29.800 1.00 0.00 C ATOM 1323 OH TYR A 91 33.064 -34.600 29.859 1.00 0.00 O ATOM 0 H TYR A 91 25.828 -30.422 28.590 1.00 0.00 H new ATOM 0 HA TYR A 91 28.260 -31.625 27.580 1.00 0.00 H new ATOM 0 HB2 TYR A 91 29.052 -29.957 29.440 1.00 0.00 H new ATOM 0 HB3 TYR A 91 28.163 -30.952 30.576 1.00 0.00 H new ATOM 0 HD1 TYR A 91 30.776 -31.180 27.893 1.00 0.00 H new ATOM 0 HD2 TYR A 91 29.165 -32.889 31.489 1.00 0.00 H new ATOM 0 HE1 TYR A 91 32.684 -32.762 27.995 1.00 0.00 H new ATOM 0 HE2 TYR A 91 31.072 -34.473 31.591 1.00 0.00 H new ATOM 0 HH TYR A 91 32.969 -35.175 30.646 1.00 0.00 H new ATOM 1333 N GLY A 92 27.389 -33.798 28.462 1.00 0.00 N ATOM 1334 CA GLY A 92 26.674 -35.055 28.829 1.00 0.00 C ATOM 1335 C GLY A 92 25.169 -34.849 28.652 1.00 0.00 C ATOM 1336 O GLY A 92 24.373 -35.259 29.472 1.00 0.00 O ATOM 0 H GLY A 92 28.202 -33.920 27.858 1.00 0.00 H new ATOM 0 HA2 GLY A 92 27.016 -35.878 28.202 1.00 0.00 H new ATOM 0 HA3 GLY A 92 26.897 -35.326 29.861 1.00 0.00 H new ATOM 1340 N TYR A 93 24.780 -34.207 27.586 1.00 0.00 N ATOM 1341 CA TYR A 93 23.330 -33.954 27.343 1.00 0.00 C ATOM 1342 C TYR A 93 23.034 -34.015 25.843 1.00 0.00 C ATOM 1343 O TYR A 93 23.879 -33.719 25.022 1.00 0.00 O ATOM 1344 CB TYR A 93 23.095 -32.542 27.877 1.00 0.00 C ATOM 1345 CG TYR A 93 23.107 -32.544 29.389 1.00 0.00 C ATOM 1346 CD1 TYR A 93 22.520 -33.596 30.104 1.00 0.00 C ATOM 1347 CD2 TYR A 93 23.710 -31.483 30.077 1.00 0.00 C ATOM 1348 CE1 TYR A 93 22.538 -33.586 31.504 1.00 0.00 C ATOM 1349 CE2 TYR A 93 23.728 -31.474 31.476 1.00 0.00 C ATOM 1350 CZ TYR A 93 23.142 -32.524 32.190 1.00 0.00 C ATOM 1351 OH TYR A 93 23.160 -32.515 33.570 1.00 0.00 O ATOM 0 H TYR A 93 25.407 -33.844 26.868 1.00 0.00 H new ATOM 0 HA TYR A 93 22.687 -34.690 27.825 1.00 0.00 H new ATOM 0 HB2 TYR A 93 23.867 -31.871 27.501 1.00 0.00 H new ATOM 0 HB3 TYR A 93 22.139 -32.163 27.515 1.00 0.00 H new ATOM 0 HD1 TYR A 93 22.054 -34.414 29.576 1.00 0.00 H new ATOM 0 HD2 TYR A 93 24.162 -30.671 29.527 1.00 0.00 H new ATOM 0 HE1 TYR A 93 22.086 -34.397 32.055 1.00 0.00 H new ATOM 0 HE2 TYR A 93 24.195 -30.656 32.005 1.00 0.00 H new ATOM 0 HH TYR A 93 23.618 -31.708 33.886 1.00 0.00 H new ATOM 1361 N LYS A 94 21.842 -34.397 25.480 1.00 0.00 N ATOM 1362 CA LYS A 94 21.492 -34.476 24.032 1.00 0.00 C ATOM 1363 C LYS A 94 20.546 -33.333 23.662 1.00 0.00 C ATOM 1364 O LYS A 94 19.648 -32.998 24.402 1.00 0.00 O ATOM 1365 CB LYS A 94 20.795 -35.827 23.867 1.00 0.00 C ATOM 1366 CG LYS A 94 21.837 -36.902 23.559 1.00 0.00 C ATOM 1367 CD LYS A 94 21.130 -38.189 23.134 1.00 0.00 C ATOM 1368 CE LYS A 94 20.567 -38.894 24.370 1.00 0.00 C ATOM 1369 NZ LYS A 94 19.291 -38.186 24.676 1.00 0.00 N ATOM 0 H LYS A 94 21.094 -34.658 26.122 1.00 0.00 H new ATOM 0 HA LYS A 94 22.366 -34.390 23.386 1.00 0.00 H new ATOM 0 HB2 LYS A 94 20.252 -36.082 24.777 1.00 0.00 H new ATOM 0 HB3 LYS A 94 20.062 -35.774 23.062 1.00 0.00 H new ATOM 0 HG2 LYS A 94 22.503 -36.561 22.766 1.00 0.00 H new ATOM 0 HG3 LYS A 94 22.455 -37.087 24.437 1.00 0.00 H new ATOM 0 HD2 LYS A 94 20.326 -37.961 22.435 1.00 0.00 H new ATOM 0 HD3 LYS A 94 21.828 -38.845 22.614 1.00 0.00 H new ATOM 0 HE2 LYS A 94 20.393 -39.952 24.175 1.00 0.00 H new ATOM 0 HE3 LYS A 94 21.261 -38.834 25.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 19.411 -37.610 25.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 19.036 -37.570 23.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 18.535 -38.884 24.830 1.00 0.00 H new ATOM 1383 N LEU A 95 20.742 -32.726 22.527 1.00 0.00 N ATOM 1384 CA LEU A 95 19.850 -31.601 22.133 1.00 0.00 C ATOM 1385 C LEU A 95 18.518 -32.128 21.600 1.00 0.00 C ATOM 1386 O LEU A 95 18.408 -32.530 20.458 1.00 0.00 O ATOM 1387 CB LEU A 95 20.604 -30.859 21.030 1.00 0.00 C ATOM 1388 CG LEU A 95 21.692 -29.986 21.651 1.00 0.00 C ATOM 1389 CD1 LEU A 95 23.063 -30.437 21.146 1.00 0.00 C ATOM 1390 CD2 LEU A 95 21.465 -28.531 21.248 1.00 0.00 C ATOM 0 H LEU A 95 21.476 -32.958 21.858 1.00 0.00 H new ATOM 0 HA LEU A 95 19.618 -30.955 22.980 1.00 0.00 H new ATOM 0 HB2 LEU A 95 21.048 -31.572 20.336 1.00 0.00 H new ATOM 0 HB3 LEU A 95 19.913 -30.243 20.455 1.00 0.00 H new ATOM 0 HG LEU A 95 21.654 -30.080 22.736 1.00 0.00 H new ATOM 0 HD11 LEU A 95 23.838 -29.813 21.590 1.00 0.00 H new ATOM 0 HD12 LEU A 95 23.230 -31.477 21.426 1.00 0.00 H new ATOM 0 HD13 LEU A 95 23.100 -30.343 20.061 1.00 0.00 H new ATOM 0 HD21 LEU A 95 22.241 -27.906 21.690 1.00 0.00 H new ATOM 0 HD22 LEU A 95 21.504 -28.444 20.162 1.00 0.00 H new ATOM 0 HD23 LEU A 95 20.488 -28.203 21.603 1.00 0.00 H new ATOM 1402 N SER A 96 17.503 -32.115 22.416 1.00 0.00 N ATOM 1403 CA SER A 96 16.174 -32.599 21.955 1.00 0.00 C ATOM 1404 C SER A 96 15.502 -31.514 21.109 1.00 0.00 C ATOM 1405 O SER A 96 15.036 -30.516 21.622 1.00 0.00 O ATOM 1406 CB SER A 96 15.381 -32.853 23.235 1.00 0.00 C ATOM 1407 OG SER A 96 14.032 -32.453 23.038 1.00 0.00 O ATOM 0 H SER A 96 17.536 -31.790 23.382 1.00 0.00 H new ATOM 0 HA SER A 96 16.241 -33.496 21.339 1.00 0.00 H new ATOM 0 HB2 SER A 96 15.424 -33.909 23.500 1.00 0.00 H new ATOM 0 HB3 SER A 96 15.820 -32.298 24.064 1.00 0.00 H new ATOM 0 HG SER A 96 14.003 -31.499 22.815 1.00 0.00 H new ATOM 1413 N GLY A 97 15.456 -31.695 19.818 1.00 0.00 N ATOM 1414 CA GLY A 97 14.821 -30.666 18.946 1.00 0.00 C ATOM 1415 C GLY A 97 15.661 -30.471 17.682 1.00 0.00 C ATOM 1416 O GLY A 97 15.441 -31.112 16.674 1.00 0.00 O ATOM 0 H GLY A 97 15.830 -32.509 19.330 1.00 0.00 H new ATOM 0 HA2 GLY A 97 13.811 -30.975 18.679 1.00 0.00 H new ATOM 0 HA3 GLY A 97 14.733 -29.723 19.485 1.00 0.00 H new ATOM 1420 N SER A 98 16.619 -29.586 17.727 1.00 0.00 N ATOM 1421 CA SER A 98 17.469 -29.342 16.525 1.00 0.00 C ATOM 1422 C SER A 98 18.808 -28.715 16.931 1.00 0.00 C ATOM 1423 O SER A 98 18.863 -27.593 17.395 1.00 0.00 O ATOM 1424 CB SER A 98 16.658 -28.367 15.678 1.00 0.00 C ATOM 1425 OG SER A 98 16.176 -29.036 14.521 1.00 0.00 O ATOM 0 H SER A 98 16.851 -29.021 18.544 1.00 0.00 H new ATOM 0 HA SER A 98 17.706 -30.262 15.990 1.00 0.00 H new ATOM 0 HB2 SER A 98 15.824 -27.972 16.257 1.00 0.00 H new ATOM 0 HB3 SER A 98 17.276 -27.517 15.389 1.00 0.00 H new ATOM 0 HG SER A 98 15.803 -29.905 14.777 1.00 0.00 H new ATOM 1431 N SER A 99 19.887 -29.430 16.761 1.00 0.00 N ATOM 1432 CA SER A 99 21.222 -28.878 17.141 1.00 0.00 C ATOM 1433 C SER A 99 21.580 -27.674 16.267 1.00 0.00 C ATOM 1434 O SER A 99 22.386 -26.852 16.638 1.00 0.00 O ATOM 1435 CB SER A 99 22.205 -30.024 16.906 1.00 0.00 C ATOM 1436 OG SER A 99 22.176 -30.394 15.534 1.00 0.00 O ATOM 0 H SER A 99 19.903 -30.374 16.375 1.00 0.00 H new ATOM 0 HA SER A 99 21.239 -28.527 18.173 1.00 0.00 H new ATOM 0 HB2 SER A 99 23.212 -29.719 17.191 1.00 0.00 H new ATOM 0 HB3 SER A 99 21.942 -30.878 17.530 1.00 0.00 H new ATOM 0 HG SER A 99 22.807 -31.128 15.380 1.00 0.00 H new ATOM 1442 N SER A 100 20.992 -27.557 15.112 1.00 0.00 N ATOM 1443 CA SER A 100 21.316 -26.392 14.239 1.00 0.00 C ATOM 1444 C SER A 100 20.031 -25.655 13.857 1.00 0.00 C ATOM 1445 O SER A 100 19.093 -26.243 13.356 1.00 0.00 O ATOM 1446 CB SER A 100 21.985 -26.993 13.007 1.00 0.00 C ATOM 1447 OG SER A 100 21.001 -27.620 12.195 1.00 0.00 O ATOM 0 H SER A 100 20.306 -28.211 14.734 1.00 0.00 H new ATOM 0 HA SER A 100 21.963 -25.667 14.733 1.00 0.00 H new ATOM 0 HB2 SER A 100 22.497 -26.215 12.441 1.00 0.00 H new ATOM 0 HB3 SER A 100 22.741 -27.719 13.307 1.00 0.00 H new ATOM 0 HG SER A 100 20.116 -27.489 12.594 1.00 0.00 H new ATOM 1453 N SER A 101 19.977 -24.375 14.097 1.00 0.00 N ATOM 1454 CA SER A 101 18.747 -23.603 13.756 1.00 0.00 C ATOM 1455 C SER A 101 19.114 -22.296 13.066 1.00 0.00 C ATOM 1456 O SER A 101 20.268 -21.933 12.974 1.00 0.00 O ATOM 1457 CB SER A 101 18.071 -23.327 15.096 1.00 0.00 C ATOM 1458 OG SER A 101 18.082 -24.512 15.880 1.00 0.00 O ATOM 0 H SER A 101 20.731 -23.829 14.514 1.00 0.00 H new ATOM 0 HA SER A 101 18.096 -24.148 13.073 1.00 0.00 H new ATOM 0 HB2 SER A 101 18.591 -22.525 15.620 1.00 0.00 H new ATOM 0 HB3 SER A 101 17.046 -22.992 14.937 1.00 0.00 H new ATOM 0 HG SER A 101 18.413 -24.306 16.779 1.00 0.00 H new ATOM 1464 N THR A 102 18.136 -21.587 12.577 1.00 0.00 N ATOM 1465 CA THR A 102 18.426 -20.304 11.888 1.00 0.00 C ATOM 1466 C THR A 102 17.279 -19.313 12.098 1.00 0.00 C ATOM 1467 O THR A 102 16.118 -19.673 12.073 1.00 0.00 O ATOM 1468 CB THR A 102 18.555 -20.675 10.411 1.00 0.00 C ATOM 1469 OG1 THR A 102 19.019 -22.014 10.300 1.00 0.00 O ATOM 1470 CG2 THR A 102 19.546 -19.731 9.731 1.00 0.00 C ATOM 0 H THR A 102 17.150 -21.842 12.626 1.00 0.00 H new ATOM 0 HA THR A 102 19.327 -19.823 12.270 1.00 0.00 H new ATOM 0 HB THR A 102 17.583 -20.586 9.927 1.00 0.00 H new ATOM 0 HG1 THR A 102 19.101 -22.254 9.353 1.00 0.00 H new ATOM 0 HG21 THR A 102 19.637 -19.996 8.678 1.00 0.00 H new ATOM 0 HG22 THR A 102 19.189 -18.705 9.817 1.00 0.00 H new ATOM 0 HG23 THR A 102 20.520 -19.817 10.213 1.00 0.00 H new ATOM 1478 N CYS A 103 17.600 -18.065 12.301 1.00 0.00 N ATOM 1479 CA CYS A 103 16.537 -17.042 12.504 1.00 0.00 C ATOM 1480 C CYS A 103 15.634 -16.994 11.269 1.00 0.00 C ATOM 1481 O CYS A 103 15.880 -16.250 10.351 1.00 0.00 O ATOM 1482 CB CYS A 103 17.297 -15.724 12.662 1.00 0.00 C ATOM 1483 SG CYS A 103 16.141 -14.342 12.521 1.00 0.00 S ATOM 0 H CYS A 103 18.555 -17.709 12.335 1.00 0.00 H new ATOM 0 HA CYS A 103 15.901 -17.253 13.364 1.00 0.00 H new ATOM 0 HB2 CYS A 103 17.799 -15.695 13.629 1.00 0.00 H new ATOM 0 HB3 CYS A 103 18.071 -15.644 11.899 1.00 0.00 H new ATOM 1488 N SER A 104 14.606 -17.793 11.229 1.00 0.00 N ATOM 1489 CA SER A 104 13.712 -17.797 10.029 1.00 0.00 C ATOM 1490 C SER A 104 13.052 -16.442 9.812 1.00 0.00 C ATOM 1491 O SER A 104 13.193 -15.536 10.610 1.00 0.00 O ATOM 1492 CB SER A 104 12.665 -18.873 10.307 1.00 0.00 C ATOM 1493 OG SER A 104 12.701 -19.842 9.268 1.00 0.00 O ATOM 0 H SER A 104 14.343 -18.443 11.970 1.00 0.00 H new ATOM 0 HA SER A 104 14.276 -18.000 9.119 1.00 0.00 H new ATOM 0 HB2 SER A 104 12.860 -19.347 11.269 1.00 0.00 H new ATOM 0 HB3 SER A 104 11.673 -18.425 10.368 1.00 0.00 H new ATOM 0 HG SER A 104 12.031 -20.535 9.444 1.00 0.00 H new ATOM 1499 N PRO A 105 12.371 -16.351 8.699 1.00 0.00 N ATOM 1500 CA PRO A 105 11.698 -15.094 8.312 1.00 0.00 C ATOM 1501 C PRO A 105 10.421 -14.855 9.124 1.00 0.00 C ATOM 1502 O PRO A 105 9.613 -14.014 8.784 1.00 0.00 O ATOM 1503 CB PRO A 105 11.369 -15.299 6.840 1.00 0.00 C ATOM 1504 CG PRO A 105 11.288 -16.780 6.658 1.00 0.00 C ATOM 1505 CD PRO A 105 12.174 -17.412 7.703 1.00 0.00 C ATOM 0 HA PRO A 105 12.324 -14.221 8.496 1.00 0.00 H new ATOM 0 HB2 PRO A 105 10.427 -14.818 6.577 1.00 0.00 H new ATOM 0 HB3 PRO A 105 12.138 -14.865 6.201 1.00 0.00 H new ATOM 0 HG2 PRO A 105 10.260 -17.124 6.767 1.00 0.00 H new ATOM 0 HG3 PRO A 105 11.614 -17.062 5.657 1.00 0.00 H new ATOM 0 HD2 PRO A 105 11.704 -18.291 8.145 1.00 0.00 H new ATOM 0 HD3 PRO A 105 13.122 -17.739 7.276 1.00 0.00 H new ATOM 1513 N GLY A 106 10.225 -15.572 10.192 1.00 0.00 N ATOM 1514 CA GLY A 106 9.000 -15.352 11.002 1.00 0.00 C ATOM 1515 C GLY A 106 9.396 -14.759 12.354 1.00 0.00 C ATOM 1516 O GLY A 106 8.680 -14.871 13.329 1.00 0.00 O ATOM 0 H GLY A 106 10.855 -16.296 10.537 1.00 0.00 H new ATOM 0 HA2 GLY A 106 8.320 -14.679 10.480 1.00 0.00 H new ATOM 0 HA3 GLY A 106 8.469 -16.293 11.145 1.00 0.00 H new ATOM 1520 N ASN A 107 10.541 -14.133 12.409 1.00 0.00 N ATOM 1521 CA ASN A 107 11.019 -13.517 13.682 1.00 0.00 C ATOM 1522 C ASN A 107 11.174 -14.579 14.769 1.00 0.00 C ATOM 1523 O ASN A 107 10.714 -14.411 15.881 1.00 0.00 O ATOM 1524 CB ASN A 107 9.945 -12.497 14.072 1.00 0.00 C ATOM 1525 CG ASN A 107 10.161 -11.204 13.285 1.00 0.00 C ATOM 1526 OD1 ASN A 107 11.136 -10.509 13.490 1.00 0.00 O ATOM 1527 ND2 ASN A 107 9.285 -10.849 12.386 1.00 0.00 N ATOM 0 H ASN A 107 11.173 -14.021 11.617 1.00 0.00 H new ATOM 0 HA ASN A 107 11.995 -13.048 13.562 1.00 0.00 H new ATOM 0 HB2 ASN A 107 8.953 -12.900 13.865 1.00 0.00 H new ATOM 0 HB3 ASN A 107 9.991 -12.296 15.142 1.00 0.00 H new ATOM 0 HD21 ASN A 107 9.419 -9.988 11.855 1.00 0.00 H new ATOM 0 HD22 ASN A 107 8.466 -11.432 12.214 1.00 0.00 H new ATOM 1534 N THR A 108 11.823 -15.671 14.467 1.00 0.00 N ATOM 1535 CA THR A 108 12.000 -16.726 15.503 1.00 0.00 C ATOM 1536 C THR A 108 13.141 -17.677 15.141 1.00 0.00 C ATOM 1537 O THR A 108 13.802 -17.526 14.134 1.00 0.00 O ATOM 1538 CB THR A 108 10.670 -17.467 15.543 1.00 0.00 C ATOM 1539 OG1 THR A 108 10.010 -17.328 14.293 1.00 0.00 O ATOM 1540 CG2 THR A 108 9.811 -16.868 16.649 1.00 0.00 C ATOM 0 H THR A 108 12.234 -15.876 13.557 1.00 0.00 H new ATOM 0 HA THR A 108 12.263 -16.299 16.471 1.00 0.00 H new ATOM 0 HB THR A 108 10.838 -18.526 15.738 1.00 0.00 H new ATOM 0 HG1 THR A 108 9.155 -17.806 14.320 1.00 0.00 H new ATOM 0 HG21 THR A 108 8.855 -17.389 16.689 1.00 0.00 H new ATOM 0 HG22 THR A 108 10.323 -16.974 17.605 1.00 0.00 H new ATOM 0 HG23 THR A 108 9.640 -15.811 16.445 1.00 0.00 H new ATOM 1548 N TRP A 109 13.378 -18.651 15.975 1.00 0.00 N ATOM 1549 CA TRP A 109 14.480 -19.617 15.714 1.00 0.00 C ATOM 1550 C TRP A 109 13.926 -20.953 15.214 1.00 0.00 C ATOM 1551 O TRP A 109 13.484 -21.785 15.981 1.00 0.00 O ATOM 1552 CB TRP A 109 15.171 -19.767 17.066 1.00 0.00 C ATOM 1553 CG TRP A 109 16.163 -18.659 17.201 1.00 0.00 C ATOM 1554 CD1 TRP A 109 16.111 -17.655 18.112 1.00 0.00 C ATOM 1555 CD2 TRP A 109 17.349 -18.421 16.397 1.00 0.00 C ATOM 1556 NE1 TRP A 109 17.185 -16.813 17.903 1.00 0.00 N ATOM 1557 CE2 TRP A 109 17.982 -17.248 16.863 1.00 0.00 C ATOM 1558 CE3 TRP A 109 17.933 -19.105 15.318 1.00 0.00 C ATOM 1559 CZ2 TRP A 109 19.153 -16.770 16.279 1.00 0.00 C ATOM 1560 CZ3 TRP A 109 19.113 -18.628 14.729 1.00 0.00 C ATOM 1561 CH2 TRP A 109 19.724 -17.463 15.209 1.00 0.00 C ATOM 0 H TRP A 109 12.851 -18.820 16.832 1.00 0.00 H new ATOM 0 HA TRP A 109 15.166 -19.277 14.938 1.00 0.00 H new ATOM 0 HB2 TRP A 109 14.441 -19.726 17.874 1.00 0.00 H new ATOM 0 HB3 TRP A 109 15.668 -20.735 17.135 1.00 0.00 H new ATOM 0 HD1 TRP A 109 15.355 -17.534 18.874 1.00 0.00 H new ATOM 0 HE1 TRP A 109 17.367 -15.972 18.450 1.00 0.00 H new ATOM 0 HE3 TRP A 109 17.470 -20.004 14.939 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 19.617 -15.869 16.652 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 19.553 -19.162 13.900 1.00 0.00 H new ATOM 0 HH2 TRP A 109 20.634 -17.101 14.753 1.00 0.00 H new ATOM 1572 N LYS A 110 13.954 -21.160 13.924 1.00 0.00 N ATOM 1573 CA LYS A 110 13.439 -22.439 13.356 1.00 0.00 C ATOM 1574 C LYS A 110 14.611 -23.271 12.815 1.00 0.00 C ATOM 1575 O LYS A 110 15.530 -22.724 12.238 1.00 0.00 O ATOM 1576 CB LYS A 110 12.509 -22.019 12.216 1.00 0.00 C ATOM 1577 CG LYS A 110 11.414 -21.097 12.760 1.00 0.00 C ATOM 1578 CD LYS A 110 10.043 -21.612 12.318 1.00 0.00 C ATOM 1579 CE LYS A 110 9.127 -20.426 12.011 1.00 0.00 C ATOM 1580 NZ LYS A 110 7.775 -21.023 11.823 1.00 0.00 N ATOM 0 H LYS A 110 14.313 -20.496 13.238 1.00 0.00 H new ATOM 0 HA LYS A 110 12.922 -23.049 14.096 1.00 0.00 H new ATOM 0 HB2 LYS A 110 13.077 -21.507 11.440 1.00 0.00 H new ATOM 0 HB3 LYS A 110 12.061 -22.900 11.755 1.00 0.00 H new ATOM 0 HG2 LYS A 110 11.465 -21.057 13.848 1.00 0.00 H new ATOM 0 HG3 LYS A 110 11.566 -20.081 12.396 1.00 0.00 H new ATOM 0 HD2 LYS A 110 10.147 -22.243 11.435 1.00 0.00 H new ATOM 0 HD3 LYS A 110 9.605 -22.230 13.102 1.00 0.00 H new ATOM 0 HE2 LYS A 110 9.130 -19.703 12.827 1.00 0.00 H new ATOM 0 HE3 LYS A 110 9.453 -19.897 11.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 7.090 -20.270 11.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 7.802 -21.702 11.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 7.488 -21.514 12.694 1.00 0.00 H new ATOM 1594 N PRO A 111 14.555 -24.568 13.012 1.00 0.00 N ATOM 1595 CA PRO A 111 13.417 -25.212 13.725 1.00 0.00 C ATOM 1596 C PRO A 111 13.450 -24.883 15.220 1.00 0.00 C ATOM 1597 O PRO A 111 14.414 -24.347 15.729 1.00 0.00 O ATOM 1598 CB PRO A 111 13.647 -26.703 13.493 1.00 0.00 C ATOM 1599 CG PRO A 111 15.113 -26.829 13.242 1.00 0.00 C ATOM 1600 CD PRO A 111 15.556 -25.550 12.585 1.00 0.00 C ATOM 0 HA PRO A 111 12.446 -24.870 13.367 1.00 0.00 H new ATOM 0 HB2 PRO A 111 13.342 -27.290 14.360 1.00 0.00 H new ATOM 0 HB3 PRO A 111 13.068 -27.065 12.644 1.00 0.00 H new ATOM 0 HG2 PRO A 111 15.652 -26.990 14.176 1.00 0.00 H new ATOM 0 HG3 PRO A 111 15.323 -27.685 12.601 1.00 0.00 H new ATOM 0 HD2 PRO A 111 16.558 -25.263 12.904 1.00 0.00 H new ATOM 0 HD3 PRO A 111 15.583 -25.647 11.500 1.00 0.00 H new ATOM 1608 N GLU A 112 12.393 -25.192 15.920 1.00 0.00 N ATOM 1609 CA GLU A 112 12.337 -24.893 17.381 1.00 0.00 C ATOM 1610 C GLU A 112 13.690 -25.152 18.049 1.00 0.00 C ATOM 1611 O GLU A 112 14.289 -26.196 17.885 1.00 0.00 O ATOM 1612 CB GLU A 112 11.281 -25.846 17.939 1.00 0.00 C ATOM 1613 CG GLU A 112 11.175 -25.658 19.455 1.00 0.00 C ATOM 1614 CD GLU A 112 9.703 -25.657 19.870 1.00 0.00 C ATOM 1615 OE1 GLU A 112 8.858 -25.692 18.990 1.00 0.00 O ATOM 1616 OE2 GLU A 112 9.444 -25.622 21.062 1.00 0.00 O ATOM 0 H GLU A 112 11.560 -25.642 15.541 1.00 0.00 H new ATOM 0 HA GLU A 112 12.095 -23.847 17.568 1.00 0.00 H new ATOM 0 HB2 GLU A 112 10.317 -25.653 17.469 1.00 0.00 H new ATOM 0 HB3 GLU A 112 11.547 -26.877 17.707 1.00 0.00 H new ATOM 0 HG2 GLU A 112 11.708 -26.458 19.969 1.00 0.00 H new ATOM 0 HG3 GLU A 112 11.647 -24.721 19.749 1.00 0.00 H new ATOM 1623 N LEU A 113 14.163 -24.209 18.815 1.00 0.00 N ATOM 1624 CA LEU A 113 15.466 -24.392 19.516 1.00 0.00 C ATOM 1625 C LEU A 113 15.560 -25.803 20.089 1.00 0.00 C ATOM 1626 O LEU A 113 14.571 -26.382 20.493 1.00 0.00 O ATOM 1627 CB LEU A 113 15.441 -23.357 20.640 1.00 0.00 C ATOM 1628 CG LEU A 113 16.443 -22.222 20.368 1.00 0.00 C ATOM 1629 CD1 LEU A 113 16.571 -21.953 18.862 1.00 0.00 C ATOM 1630 CD2 LEU A 113 15.948 -20.954 21.062 1.00 0.00 C ATOM 0 H LEU A 113 13.702 -23.316 18.987 1.00 0.00 H new ATOM 0 HA LEU A 113 16.322 -24.263 18.854 1.00 0.00 H new ATOM 0 HB2 LEU A 113 14.437 -22.945 20.737 1.00 0.00 H new ATOM 0 HB3 LEU A 113 15.681 -23.839 21.588 1.00 0.00 H new ATOM 0 HG LEU A 113 17.420 -22.515 20.751 1.00 0.00 H new ATOM 0 HD11 LEU A 113 17.285 -21.146 18.696 1.00 0.00 H new ATOM 0 HD12 LEU A 113 16.919 -22.855 18.360 1.00 0.00 H new ATOM 0 HD13 LEU A 113 15.599 -21.666 18.460 1.00 0.00 H new ATOM 0 HD21 LEU A 113 16.650 -20.141 20.877 1.00 0.00 H new ATOM 0 HD22 LEU A 113 14.968 -20.684 20.670 1.00 0.00 H new ATOM 0 HD23 LEU A 113 15.873 -21.132 22.135 1.00 0.00 H new ATOM 1642 N PRO A 114 16.759 -26.303 20.101 1.00 0.00 N ATOM 1643 CA PRO A 114 17.014 -27.663 20.626 1.00 0.00 C ATOM 1644 C PRO A 114 16.932 -27.676 22.152 1.00 0.00 C ATOM 1645 O PRO A 114 16.809 -26.647 22.786 1.00 0.00 O ATOM 1646 CB PRO A 114 18.432 -27.965 20.150 1.00 0.00 C ATOM 1647 CG PRO A 114 19.078 -26.631 19.943 1.00 0.00 C ATOM 1648 CD PRO A 114 17.982 -25.647 19.629 1.00 0.00 C ATOM 0 HA PRO A 114 16.287 -28.399 20.283 1.00 0.00 H new ATOM 0 HB2 PRO A 114 18.976 -28.554 20.888 1.00 0.00 H new ATOM 0 HB3 PRO A 114 18.421 -28.543 19.226 1.00 0.00 H new ATOM 0 HG2 PRO A 114 19.624 -26.326 20.835 1.00 0.00 H new ATOM 0 HG3 PRO A 114 19.800 -26.676 19.127 1.00 0.00 H new ATOM 0 HD2 PRO A 114 18.144 -24.696 20.136 1.00 0.00 H new ATOM 0 HD3 PRO A 114 17.932 -25.434 18.561 1.00 0.00 H new ATOM 1656 N LYS A 115 17.007 -28.834 22.749 1.00 0.00 N ATOM 1657 CA LYS A 115 16.941 -28.907 24.236 1.00 0.00 C ATOM 1658 C LYS A 115 18.014 -29.851 24.775 1.00 0.00 C ATOM 1659 O LYS A 115 17.950 -31.045 24.589 1.00 0.00 O ATOM 1660 CB LYS A 115 15.546 -29.443 24.559 1.00 0.00 C ATOM 1661 CG LYS A 115 15.338 -29.423 26.075 1.00 0.00 C ATOM 1662 CD LYS A 115 13.842 -29.420 26.390 1.00 0.00 C ATOM 1663 CE LYS A 115 13.297 -27.994 26.270 1.00 0.00 C ATOM 1664 NZ LYS A 115 11.909 -28.055 26.814 1.00 0.00 N ATOM 0 H LYS A 115 17.111 -29.730 22.273 1.00 0.00 H new ATOM 0 HA LYS A 115 17.116 -27.934 24.695 1.00 0.00 H new ATOM 0 HB2 LYS A 115 14.787 -28.835 24.068 1.00 0.00 H new ATOM 0 HB3 LYS A 115 15.436 -30.458 24.178 1.00 0.00 H new ATOM 0 HG2 LYS A 115 15.813 -30.293 26.528 1.00 0.00 H new ATOM 0 HG3 LYS A 115 15.812 -28.541 26.505 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.314 -30.081 25.703 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.671 -29.803 27.396 1.00 0.00 H new ATOM 0 HE2 LYS A 115 13.910 -27.290 26.834 1.00 0.00 H new ATOM 0 HE3 LYS A 115 13.298 -27.658 25.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 11.474 -27.112 26.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 11.346 -28.726 26.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 11.938 -28.370 27.805 1.00 0.00 H new ATOM 1678 N CYS A 116 18.992 -29.322 25.457 1.00 0.00 N ATOM 1679 CA CYS A 116 20.059 -30.192 26.027 1.00 0.00 C ATOM 1680 C CYS A 116 19.445 -31.083 27.102 1.00 0.00 C ATOM 1681 O CYS A 116 19.213 -30.667 28.220 1.00 0.00 O ATOM 1682 CB CYS A 116 21.079 -29.214 26.619 1.00 0.00 C ATOM 1683 SG CYS A 116 22.755 -29.911 26.562 1.00 0.00 S ATOM 0 H CYS A 116 19.099 -28.325 25.644 1.00 0.00 H new ATOM 0 HA CYS A 116 20.527 -30.851 25.295 1.00 0.00 H new ATOM 0 HB2 CYS A 116 21.052 -28.275 26.065 1.00 0.00 H new ATOM 0 HB3 CYS A 116 20.812 -28.984 27.650 1.00 0.00 H new ATOM 1688 N VAL A 117 19.166 -32.307 26.758 1.00 0.00 N ATOM 1689 CA VAL A 117 18.546 -33.240 27.740 1.00 0.00 C ATOM 1690 C VAL A 117 19.522 -34.320 28.145 1.00 0.00 C ATOM 1691 O VAL A 117 20.661 -34.342 27.727 1.00 0.00 O ATOM 1692 CB VAL A 117 17.342 -33.874 27.040 1.00 0.00 C ATOM 1693 CG1 VAL A 117 16.129 -33.008 27.295 1.00 0.00 C ATOM 1694 CG2 VAL A 117 17.572 -33.983 25.529 1.00 0.00 C ATOM 0 H VAL A 117 19.341 -32.704 25.835 1.00 0.00 H new ATOM 0 HA VAL A 117 18.253 -32.705 28.643 1.00 0.00 H new ATOM 0 HB VAL A 117 17.194 -34.879 27.435 1.00 0.00 H new ATOM 0 HG11 VAL A 117 15.260 -33.445 26.803 1.00 0.00 H new ATOM 0 HG12 VAL A 117 15.945 -32.946 28.368 1.00 0.00 H new ATOM 0 HG13 VAL A 117 16.306 -32.008 26.898 1.00 0.00 H new ATOM 0 HG21 VAL A 117 16.699 -34.437 25.060 1.00 0.00 H new ATOM 0 HG22 VAL A 117 17.731 -32.988 25.113 1.00 0.00 H new ATOM 0 HG23 VAL A 117 18.449 -34.601 25.338 1.00 0.00 H new ATOM 1704 N ARG A 118 19.079 -35.222 28.963 1.00 0.00 N ATOM 1705 CA ARG A 118 19.979 -36.306 29.400 1.00 0.00 C ATOM 1706 C ARG A 118 19.419 -37.669 28.981 1.00 0.00 C ATOM 1707 O ARG A 118 20.210 -38.573 28.767 1.00 0.00 O ATOM 1708 CB ARG A 118 20.039 -36.188 30.923 1.00 0.00 C ATOM 1709 CG ARG A 118 18.626 -35.974 31.474 1.00 0.00 C ATOM 1710 CD ARG A 118 18.661 -36.015 33.003 1.00 0.00 C ATOM 1711 NE ARG A 118 17.593 -36.980 33.385 1.00 0.00 N ATOM 1712 CZ ARG A 118 17.873 -37.992 34.159 1.00 0.00 C ATOM 1713 NH1 ARG A 118 18.238 -37.785 35.395 1.00 0.00 N ATOM 1714 NH2 ARG A 118 17.789 -39.210 33.698 1.00 0.00 N ATOM 1715 OXT ARG A 118 18.208 -37.785 28.881 1.00 0.00 O ATOM 0 H ARG A 118 18.134 -35.254 29.346 1.00 0.00 H new ATOM 0 HA ARG A 118 20.968 -36.224 28.949 1.00 0.00 H new ATOM 0 HB2 ARG A 118 20.475 -37.090 31.352 1.00 0.00 H new ATOM 0 HB3 ARG A 118 20.682 -35.356 31.209 1.00 0.00 H new ATOM 0 HG2 ARG A 118 18.233 -35.015 31.135 1.00 0.00 H new ATOM 0 HG3 ARG A 118 17.956 -36.745 31.094 1.00 0.00 H new ATOM 0 HD2 ARG A 118 19.636 -36.340 33.367 1.00 0.00 H new ATOM 0 HD3 ARG A 118 18.474 -35.029 33.429 1.00 0.00 H new ATOM 0 HE ARG A 118 16.642 -36.850 33.041 1.00 0.00 H new ATOM 0 HH11 ARG A 118 18.304 -36.833 35.755 1.00 0.00 H new ATOM 0 HH12 ARG A 118 18.457 -38.575 36.001 1.00 0.00 H new ATOM 0 HH21 ARG A 118 17.504 -39.371 32.732 1.00 0.00 H new ATOM 0 HH22 ARG A 118 18.008 -40.001 34.304 1.00 0.00 H new TER 1729 ARG A 118