USER MOD reduce.3.24.130724 H: found=0, std=0, add=834, rem=0, adj=40 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 70 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 72 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 63 HIS : no HE2:sc= -4.1! C(o=-9!,f=-5.1!) USER MOD Set 2.2: A 79 TYR OH : rot 172:sc= -4.86! USER MOD Set 3.1: A 55 THR OG1 : rot -177:sc= -6.8! USER MOD Set 3.2: A 57 GLN : amide:sc= -1.64 K(o=-8.4,f=-7.3) USER MOD Set 4.1: A 5 SER OG : rot 180:sc= -0.685 USER MOD Set 4.2: A 14 HIS : no HD1:sc= -13.5! C(o=-14!,f=-15!) USER MOD Single : A 1 VAL N :NH3+ 159:sc= -1.04 (180deg=-2.36!) USER MOD Single : A 2 LYS NZ :NH3+ 153:sc= -0.287 (180deg=-1.89!) USER MOD Single : A 4 GLN : amide:sc= 0.262 X(o=0.26,f=-0.1) USER MOD Single : A 8 SER OG : rot -86:sc= 0.17 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 X(o=0,f=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 30:sc= 0 USER MOD Single : A 22 THR OG1 : rot -2:sc= -1.85! USER MOD Single : A 25 SER OG : rot 174:sc= 0.467 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.169 USER MOD Single : A 29 TYR OH : rot 180:sc= -1.97! USER MOD Single : A 30 SER OG : rot -100:sc= -0.237! USER MOD Single : A 32 ASN : amide:sc= -0.694 X(o=-0.69,f=-0.69) 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 -67:sc= -5.01! USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 SER OG : rot 180:sc= -0.47 USER MOD Single : A 46 SER OG : rot 66:sc= 1.14 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= -0.689 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -0.0293 K(o=-0.029,f=-2!) USER MOD Single : A 73 SER OG : rot -160:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= -0.529! USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -3.77! C(o=-3.8!,f=-5.2!) USER MOD Single : A 84 ASN : amide:sc= -0.683 K(o=-0.68,f=-6.8!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ -124:sc= 0 (180deg=-0.0324) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= -0.0236 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot -47:sc= -0.105 USER MOD Single : A 98 SER OG : rot 45:sc= 0.223 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 39:sc= 0.668! USER MOD Single : A 101 SER OG : rot 105:sc= 0.173 USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.0308 USER MOD Single : A 104 SER OG : rot 180:sc= -0.714 USER MOD Single : A 107 ASN : amide:sc= -3.94! C(o=-3.9!,f=-8.2!) USER MOD Single : A 108 THR OG1 : rot 180:sc= -1.18! 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 -27.449 -3.368 -5.020 1.00 0.00 N ATOM 2 CA VAL A 1 -27.043 -3.868 -6.365 1.00 0.00 C ATOM 3 C VAL A 1 -25.826 -3.090 -6.872 1.00 0.00 C ATOM 4 O VAL A 1 -25.547 -1.994 -6.427 1.00 0.00 O ATOM 5 CB VAL A 1 -28.254 -3.618 -7.264 1.00 0.00 C ATOM 6 CG1 VAL A 1 -29.335 -4.656 -6.960 1.00 0.00 C ATOM 7 CG2 VAL A 1 -28.806 -2.215 -6.999 1.00 0.00 C ATOM 0 H1 VAL A 1 -28.440 -3.625 -4.839 1.00 0.00 H new ATOM 0 H2 VAL A 1 -26.842 -3.796 -4.293 1.00 0.00 H new ATOM 0 H3 VAL A 1 -27.349 -2.333 -4.989 1.00 0.00 H new ATOM 0 HA VAL A 1 -26.761 -4.921 -6.347 1.00 0.00 H new ATOM 0 HB VAL A 1 -27.954 -3.699 -8.309 1.00 0.00 H new ATOM 0 HG11 VAL A 1 -30.199 -4.479 -7.600 1.00 0.00 H new ATOM 0 HG12 VAL A 1 -28.943 -5.656 -7.148 1.00 0.00 H new ATOM 0 HG13 VAL A 1 -29.635 -4.574 -5.915 1.00 0.00 H new ATOM 0 HG21 VAL A 1 -29.669 -2.037 -7.640 1.00 0.00 H new ATOM 0 HG22 VAL A 1 -29.107 -2.134 -5.954 1.00 0.00 H new ATOM 0 HG23 VAL A 1 -28.036 -1.474 -7.214 1.00 0.00 H new ATOM 19 N LYS A 2 -25.097 -3.649 -7.799 1.00 0.00 N ATOM 20 CA LYS A 2 -23.898 -2.941 -8.332 1.00 0.00 C ATOM 21 C LYS A 2 -24.013 -2.769 -9.848 1.00 0.00 C ATOM 22 O LYS A 2 -24.956 -3.223 -10.467 1.00 0.00 O ATOM 23 CB LYS A 2 -22.716 -3.843 -7.976 1.00 0.00 C ATOM 24 CG LYS A 2 -22.066 -3.339 -6.686 1.00 0.00 C ATOM 25 CD LYS A 2 -22.852 -3.861 -5.483 1.00 0.00 C ATOM 26 CE LYS A 2 -22.648 -5.373 -5.357 1.00 0.00 C ATOM 27 NZ LYS A 2 -21.178 -5.547 -5.199 1.00 0.00 N ATOM 0 H LYS A 2 -25.279 -4.564 -8.210 1.00 0.00 H new ATOM 0 HA LYS A 2 -23.787 -1.941 -7.912 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -23.054 -4.871 -7.849 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -21.988 -3.845 -8.787 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -21.031 -3.676 -6.632 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -22.047 -2.249 -6.677 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -22.519 -3.361 -4.573 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -23.912 -3.635 -5.602 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -23.188 -5.775 -4.500 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -23.016 -5.897 -6.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -20.987 -6.422 -4.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -20.732 -5.605 -6.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -20.786 -4.736 -4.679 1.00 0.00 H new ATOM 41 N CYS A 3 -23.063 -2.108 -10.448 1.00 0.00 N ATOM 42 CA CYS A 3 -23.116 -1.894 -11.924 1.00 0.00 C ATOM 43 C CYS A 3 -21.749 -2.129 -12.555 1.00 0.00 C ATOM 44 O CYS A 3 -20.923 -1.243 -12.606 1.00 0.00 O ATOM 45 CB CYS A 3 -23.508 -0.432 -12.097 1.00 0.00 C ATOM 46 SG CYS A 3 -24.366 -0.220 -13.673 1.00 0.00 S ATOM 0 H CYS A 3 -22.250 -1.706 -9.981 1.00 0.00 H new ATOM 0 HA CYS A 3 -23.816 -2.580 -12.402 1.00 0.00 H new ATOM 0 HB2 CYS A 3 -24.151 -0.117 -11.275 1.00 0.00 H new ATOM 0 HB3 CYS A 3 -22.620 0.200 -12.066 1.00 0.00 H new ATOM 51 N GLN A 4 -21.503 -3.299 -13.057 1.00 0.00 N ATOM 52 CA GLN A 4 -20.184 -3.539 -13.699 1.00 0.00 C ATOM 53 C GLN A 4 -20.157 -2.840 -15.050 1.00 0.00 C ATOM 54 O GLN A 4 -21.136 -2.265 -15.483 1.00 0.00 O ATOM 55 CB GLN A 4 -20.062 -5.053 -13.880 1.00 0.00 C ATOM 56 CG GLN A 4 -21.359 -5.613 -14.470 1.00 0.00 C ATOM 57 CD GLN A 4 -21.030 -6.564 -15.621 1.00 0.00 C ATOM 58 OE1 GLN A 4 -21.400 -7.721 -15.593 1.00 0.00 O ATOM 59 NE2 GLN A 4 -20.347 -6.123 -16.642 1.00 0.00 N ATOM 0 H GLN A 4 -22.145 -4.091 -13.053 1.00 0.00 H new ATOM 0 HA GLN A 4 -19.359 -3.154 -13.099 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -19.224 -5.283 -14.538 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -19.854 -5.527 -12.921 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -21.923 -6.139 -13.700 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -21.990 -4.799 -14.827 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -20.036 -5.152 -16.666 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -20.124 -6.749 -17.416 1.00 0.00 H new ATOM 68 N SER A 5 -19.053 -2.884 -15.722 1.00 0.00 N ATOM 69 CA SER A 5 -18.983 -2.217 -17.052 1.00 0.00 C ATOM 70 C SER A 5 -20.219 -2.594 -17.872 1.00 0.00 C ATOM 71 O SER A 5 -20.725 -3.693 -17.759 1.00 0.00 O ATOM 72 CB SER A 5 -17.711 -2.758 -17.703 1.00 0.00 C ATOM 73 OG SER A 5 -18.054 -3.798 -18.610 1.00 0.00 O ATOM 0 H SER A 5 -18.197 -3.348 -15.417 1.00 0.00 H new ATOM 0 HA SER A 5 -18.960 -1.130 -16.980 1.00 0.00 H new ATOM 0 HB2 SER A 5 -17.189 -1.958 -18.229 1.00 0.00 H new ATOM 0 HB3 SER A 5 -17.030 -3.135 -16.940 1.00 0.00 H new ATOM 0 HG SER A 5 -17.240 -4.147 -19.031 1.00 0.00 H new ATOM 79 N PRO A 6 -20.676 -1.662 -18.661 1.00 0.00 N ATOM 80 CA PRO A 6 -21.880 -1.897 -19.494 1.00 0.00 C ATOM 81 C PRO A 6 -21.573 -2.877 -20.627 1.00 0.00 C ATOM 82 O PRO A 6 -20.449 -2.988 -21.064 1.00 0.00 O ATOM 83 CB PRO A 6 -22.200 -0.514 -20.051 1.00 0.00 C ATOM 84 CG PRO A 6 -20.901 0.220 -20.031 1.00 0.00 C ATOM 85 CD PRO A 6 -20.123 -0.316 -18.855 1.00 0.00 C ATOM 0 HA PRO A 6 -22.706 -2.334 -18.934 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -22.601 -0.579 -21.062 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -22.949 -0.007 -19.443 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -20.354 0.065 -20.961 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -21.064 1.293 -19.932 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -19.053 -0.348 -19.063 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -20.257 0.304 -17.969 1.00 0.00 H new ATOM 93 N PRO A 7 -22.595 -3.551 -21.071 1.00 0.00 N ATOM 94 CA PRO A 7 -22.437 -4.525 -22.174 1.00 0.00 C ATOM 95 C PRO A 7 -22.275 -3.782 -23.502 1.00 0.00 C ATOM 96 O PRO A 7 -22.439 -2.580 -23.573 1.00 0.00 O ATOM 97 CB PRO A 7 -23.743 -5.314 -22.147 1.00 0.00 C ATOM 98 CG PRO A 7 -24.740 -4.396 -21.511 1.00 0.00 C ATOM 99 CD PRO A 7 -23.978 -3.472 -20.592 1.00 0.00 C ATOM 0 HA PRO A 7 -21.561 -5.165 -22.067 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -24.053 -5.597 -23.153 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -23.635 -6.236 -21.575 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -25.276 -3.826 -22.270 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -25.484 -4.964 -20.953 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -24.360 -2.453 -20.645 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -24.058 -3.789 -19.552 1.00 0.00 H new ATOM 107 N SER A 8 -21.958 -4.482 -24.554 1.00 0.00 N ATOM 108 CA SER A 8 -21.796 -3.802 -25.871 1.00 0.00 C ATOM 109 C SER A 8 -23.155 -3.325 -26.376 1.00 0.00 C ATOM 110 O SER A 8 -24.175 -3.559 -25.758 1.00 0.00 O ATOM 111 CB SER A 8 -21.215 -4.859 -26.809 1.00 0.00 C ATOM 112 OG SER A 8 -21.254 -6.132 -26.174 1.00 0.00 O ATOM 0 H SER A 8 -21.804 -5.490 -24.561 1.00 0.00 H new ATOM 0 HA SER A 8 -21.148 -2.928 -25.807 1.00 0.00 H new ATOM 0 HB2 SER A 8 -21.784 -4.887 -27.739 1.00 0.00 H new ATOM 0 HB3 SER A 8 -20.188 -4.603 -27.071 1.00 0.00 H new ATOM 0 HG SER A 8 -20.450 -6.249 -25.626 1.00 0.00 H new ATOM 118 N ILE A 9 -23.181 -2.657 -27.492 1.00 0.00 N ATOM 119 CA ILE A 9 -24.484 -2.168 -28.027 1.00 0.00 C ATOM 120 C ILE A 9 -24.539 -2.264 -29.536 1.00 0.00 C ATOM 121 O ILE A 9 -23.695 -2.858 -30.178 1.00 0.00 O ATOM 122 CB ILE A 9 -24.629 -0.704 -27.607 1.00 0.00 C ATOM 123 CG1 ILE A 9 -23.264 -0.009 -27.509 1.00 0.00 C ATOM 124 CG2 ILE A 9 -25.340 -0.651 -26.266 1.00 0.00 C ATOM 125 CD1 ILE A 9 -23.274 1.233 -28.402 1.00 0.00 C ATOM 0 H ILE A 9 -22.363 -2.428 -28.056 1.00 0.00 H new ATOM 0 HA ILE A 9 -25.292 -2.783 -27.631 1.00 0.00 H new ATOM 0 HB ILE A 9 -25.210 -0.176 -28.363 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -23.057 0.271 -26.476 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -22.471 -0.690 -27.819 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -25.451 0.387 -25.954 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -26.325 -1.109 -26.358 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -24.756 -1.193 -25.523 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -22.308 1.734 -28.339 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -23.463 0.938 -29.434 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -24.058 1.914 -28.070 1.00 0.00 H new ATOM 137 N SER A 10 -25.554 -1.687 -30.094 1.00 0.00 N ATOM 138 CA SER A 10 -25.729 -1.730 -31.562 1.00 0.00 C ATOM 139 C SER A 10 -24.387 -1.534 -32.273 1.00 0.00 C ATOM 140 O SER A 10 -23.966 -0.423 -32.529 1.00 0.00 O ATOM 141 CB SER A 10 -26.685 -0.583 -31.884 1.00 0.00 C ATOM 142 OG SER A 10 -27.104 -0.686 -33.238 1.00 0.00 O ATOM 0 H SER A 10 -26.281 -1.180 -29.589 1.00 0.00 H new ATOM 0 HA SER A 10 -26.119 -2.691 -31.898 1.00 0.00 H new ATOM 0 HB2 SER A 10 -27.549 -0.618 -31.220 1.00 0.00 H new ATOM 0 HB3 SER A 10 -26.192 0.374 -31.716 1.00 0.00 H new ATOM 0 HG SER A 10 -27.719 0.048 -33.447 1.00 0.00 H new ATOM 148 N ASN A 11 -23.715 -2.606 -32.599 1.00 0.00 N ATOM 149 CA ASN A 11 -22.404 -2.483 -33.298 1.00 0.00 C ATOM 150 C ASN A 11 -21.576 -1.354 -32.677 1.00 0.00 C ATOM 151 O ASN A 11 -20.979 -0.556 -33.372 1.00 0.00 O ATOM 152 CB ASN A 11 -22.761 -2.150 -34.747 1.00 0.00 C ATOM 153 CG ASN A 11 -22.580 -3.394 -35.619 1.00 0.00 C ATOM 154 OD1 ASN A 11 -21.469 -3.798 -35.899 1.00 0.00 O ATOM 155 ND2 ASN A 11 -23.634 -4.022 -36.064 1.00 0.00 N ATOM 0 H ASN A 11 -24.018 -3.562 -32.411 1.00 0.00 H new ATOM 0 HA ASN A 11 -21.808 -3.392 -33.222 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -23.791 -1.798 -34.807 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -22.127 -1.342 -35.112 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -23.525 -4.852 -36.647 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -24.567 -3.683 -35.829 1.00 0.00 H new ATOM 162 N GLY A 12 -21.537 -1.281 -31.374 1.00 0.00 N ATOM 163 CA GLY A 12 -20.748 -0.202 -30.712 1.00 0.00 C ATOM 164 C GLY A 12 -20.046 -0.765 -29.475 1.00 0.00 C ATOM 165 O GLY A 12 -20.198 -1.920 -29.132 1.00 0.00 O ATOM 0 H GLY A 12 -22.016 -1.920 -30.740 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -20.013 0.203 -31.407 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -21.405 0.620 -30.427 1.00 0.00 H new ATOM 169 N ARG A 13 -19.278 0.045 -28.799 1.00 0.00 N ATOM 170 CA ARG A 13 -18.566 -0.443 -27.583 1.00 0.00 C ATOM 171 C ARG A 13 -18.891 0.435 -26.385 1.00 0.00 C ATOM 172 O ARG A 13 -19.791 1.252 -26.410 1.00 0.00 O ATOM 173 CB ARG A 13 -17.078 -0.348 -27.916 1.00 0.00 C ATOM 174 CG ARG A 13 -16.466 -1.751 -27.925 1.00 0.00 C ATOM 175 CD ARG A 13 -14.956 -1.652 -27.695 1.00 0.00 C ATOM 176 NE ARG A 13 -14.433 -3.019 -27.969 1.00 0.00 N ATOM 177 CZ ARG A 13 -14.715 -3.612 -29.097 1.00 0.00 C ATOM 178 NH1 ARG A 13 -14.747 -2.922 -30.205 1.00 0.00 N ATOM 179 NH2 ARG A 13 -14.964 -4.892 -29.117 1.00 0.00 N ATOM 0 H ARG A 13 -19.113 1.023 -29.036 1.00 0.00 H new ATOM 0 HA ARG A 13 -18.863 -1.459 -27.325 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -16.942 0.126 -28.888 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -16.569 0.277 -27.182 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -16.923 -2.364 -27.148 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -16.668 -2.241 -28.877 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -14.503 -0.916 -28.359 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -14.732 -1.341 -26.675 1.00 0.00 H new ATOM 0 HE ARG A 13 -13.854 -3.492 -27.275 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -14.552 -1.921 -30.188 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -14.967 -3.384 -31.087 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -14.938 -5.430 -28.251 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -15.184 -5.355 -29.999 1.00 0.00 H new ATOM 193 N HIS A 14 -18.157 0.257 -25.336 1.00 0.00 N ATOM 194 CA HIS A 14 -18.390 1.058 -24.103 1.00 0.00 C ATOM 195 C HIS A 14 -17.111 1.107 -23.262 1.00 0.00 C ATOM 196 O HIS A 14 -16.558 0.087 -22.899 1.00 0.00 O ATOM 197 CB HIS A 14 -19.504 0.315 -23.366 1.00 0.00 C ATOM 198 CG HIS A 14 -18.936 -0.879 -22.653 1.00 0.00 C ATOM 199 ND1 HIS A 14 -18.493 -0.805 -21.346 1.00 0.00 N ATOM 200 CD2 HIS A 14 -18.757 -2.184 -23.038 1.00 0.00 C ATOM 201 CE1 HIS A 14 -18.084 -2.028 -20.985 1.00 0.00 C ATOM 202 NE2 HIS A 14 -18.217 -2.911 -21.981 1.00 0.00 N ATOM 0 H HIS A 14 -17.394 -0.417 -25.273 1.00 0.00 H new ATOM 0 HA HIS A 14 -18.664 2.092 -24.315 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -19.986 0.981 -22.651 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -20.271 -0.003 -24.073 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -18.998 -2.585 -24.011 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -17.694 -2.272 -20.008 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -17.975 -3.902 -21.969 1.00 0.00 H new ATOM 210 N ASN A 15 -16.634 2.279 -22.953 1.00 0.00 N ATOM 211 CA ASN A 15 -15.389 2.376 -22.141 1.00 0.00 C ATOM 212 C ASN A 15 -15.426 3.617 -21.249 1.00 0.00 C ATOM 213 O ASN A 15 -15.660 4.718 -21.705 1.00 0.00 O ATOM 214 CB ASN A 15 -14.259 2.484 -23.164 1.00 0.00 C ATOM 215 CG ASN A 15 -13.476 1.170 -23.196 1.00 0.00 C ATOM 216 OD1 ASN A 15 -13.717 0.327 -24.037 1.00 0.00 O ATOM 217 ND2 ASN A 15 -12.541 0.960 -22.311 1.00 0.00 N ATOM 0 H ASN A 15 -17.049 3.170 -23.225 1.00 0.00 H new ATOM 0 HA ASN A 15 -15.263 1.519 -21.479 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -14.667 2.701 -24.151 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -13.596 3.309 -22.904 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -12.012 0.088 -22.325 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -12.339 1.668 -21.605 1.00 0.00 H new ATOM 224 N GLY A 16 -15.189 3.443 -19.978 1.00 0.00 N ATOM 225 CA GLY A 16 -15.202 4.607 -19.049 1.00 0.00 C ATOM 226 C GLY A 16 -13.870 4.673 -18.303 1.00 0.00 C ATOM 227 O GLY A 16 -12.826 4.874 -18.891 1.00 0.00 O ATOM 0 H GLY A 16 -14.987 2.543 -19.542 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -15.366 5.530 -19.606 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -16.025 4.512 -18.340 1.00 0.00 H new ATOM 231 N TYR A 17 -13.897 4.502 -17.011 1.00 0.00 N ATOM 232 CA TYR A 17 -12.631 4.552 -16.227 1.00 0.00 C ATOM 233 C TYR A 17 -12.866 4.008 -14.815 1.00 0.00 C ATOM 234 O TYR A 17 -12.315 4.496 -13.848 1.00 0.00 O ATOM 235 CB TYR A 17 -12.249 6.032 -16.184 1.00 0.00 C ATOM 236 CG TYR A 17 -13.366 6.828 -15.552 1.00 0.00 C ATOM 237 CD1 TYR A 17 -14.433 7.282 -16.337 1.00 0.00 C ATOM 238 CD2 TYR A 17 -13.334 7.115 -14.182 1.00 0.00 C ATOM 239 CE1 TYR A 17 -15.467 8.024 -15.753 1.00 0.00 C ATOM 240 CE2 TYR A 17 -14.368 7.856 -13.598 1.00 0.00 C ATOM 241 CZ TYR A 17 -15.434 8.310 -14.383 1.00 0.00 C ATOM 242 OH TYR A 17 -16.452 9.041 -13.806 1.00 0.00 O ATOM 0 H TYR A 17 -14.740 4.330 -16.464 1.00 0.00 H new ATOM 0 HA TYR A 17 -11.842 3.945 -16.671 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -11.329 6.164 -15.615 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -12.055 6.397 -17.193 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -14.458 7.060 -17.394 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -12.512 6.765 -13.576 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -16.289 8.375 -16.359 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -14.343 8.077 -12.541 1.00 0.00 H new ATOM 0 HH TYR A 17 -16.275 9.149 -12.848 1.00 0.00 H new ATOM 252 N GLU A 18 -13.682 2.996 -14.692 1.00 0.00 N ATOM 253 CA GLU A 18 -13.956 2.413 -13.347 1.00 0.00 C ATOM 254 C GLU A 18 -14.270 0.920 -13.475 1.00 0.00 C ATOM 255 O GLU A 18 -13.871 0.271 -14.421 1.00 0.00 O ATOM 256 CB GLU A 18 -15.179 3.168 -12.828 1.00 0.00 C ATOM 257 CG GLU A 18 -16.364 2.923 -13.765 1.00 0.00 C ATOM 258 CD GLU A 18 -17.239 1.804 -13.199 1.00 0.00 C ATOM 259 OE1 GLU A 18 -17.539 1.854 -12.017 1.00 0.00 O ATOM 260 OE2 GLU A 18 -17.595 0.917 -13.956 1.00 0.00 O ATOM 0 H GLU A 18 -14.171 2.547 -15.466 1.00 0.00 H new ATOM 0 HA GLU A 18 -13.102 2.507 -12.676 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -15.424 2.835 -11.819 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -14.963 4.235 -12.768 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -16.949 3.836 -13.875 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -16.006 2.652 -14.758 1.00 0.00 H new ATOM 267 N ASP A 19 -14.985 0.374 -12.530 1.00 0.00 N ATOM 268 CA ASP A 19 -15.329 -1.075 -12.597 1.00 0.00 C ATOM 269 C ASP A 19 -16.765 -1.296 -12.120 1.00 0.00 C ATOM 270 O ASP A 19 -17.516 -2.050 -12.707 1.00 0.00 O ATOM 271 CB ASP A 19 -14.339 -1.761 -11.656 1.00 0.00 C ATOM 272 CG ASP A 19 -13.107 -2.203 -12.446 1.00 0.00 C ATOM 273 OD1 ASP A 19 -13.224 -2.355 -13.650 1.00 0.00 O ATOM 274 OD2 ASP A 19 -12.068 -2.383 -11.832 1.00 0.00 O ATOM 0 H ASP A 19 -15.346 0.868 -11.714 1.00 0.00 H new ATOM 0 HA ASP A 19 -15.266 -1.470 -13.611 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -14.047 -1.078 -10.858 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -14.809 -2.623 -11.182 1.00 0.00 H new ATOM 279 N PHE A 20 -17.155 -0.639 -11.063 1.00 0.00 N ATOM 280 CA PHE A 20 -18.547 -0.806 -10.555 1.00 0.00 C ATOM 281 C PHE A 20 -19.268 0.544 -10.585 1.00 0.00 C ATOM 282 O PHE A 20 -19.068 1.385 -9.733 1.00 0.00 O ATOM 283 CB PHE A 20 -18.396 -1.301 -9.116 1.00 0.00 C ATOM 284 CG PHE A 20 -17.939 -2.740 -9.124 1.00 0.00 C ATOM 285 CD1 PHE A 20 -18.573 -3.669 -9.957 1.00 0.00 C ATOM 286 CD2 PHE A 20 -16.883 -3.145 -8.299 1.00 0.00 C ATOM 287 CE1 PHE A 20 -18.151 -5.004 -9.965 1.00 0.00 C ATOM 288 CE2 PHE A 20 -16.460 -4.479 -8.308 1.00 0.00 C ATOM 289 CZ PHE A 20 -17.095 -5.409 -9.141 1.00 0.00 C ATOM 0 H PHE A 20 -16.572 0.005 -10.529 1.00 0.00 H new ATOM 0 HA PHE A 20 -19.130 -1.502 -11.158 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -17.675 -0.682 -8.581 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -19.346 -1.213 -8.588 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -19.388 -3.356 -10.593 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -16.395 -2.428 -7.656 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -18.641 -5.721 -10.607 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -15.644 -4.791 -7.673 1.00 0.00 H new ATOM 0 HZ PHE A 20 -16.770 -6.439 -9.147 1.00 0.00 H new ATOM 299 N TYR A 21 -20.090 0.759 -11.572 1.00 0.00 N ATOM 300 CA TYR A 21 -20.816 2.055 -11.680 1.00 0.00 C ATOM 301 C TYR A 21 -21.998 2.117 -10.705 1.00 0.00 C ATOM 302 O TYR A 21 -22.591 3.156 -10.499 1.00 0.00 O ATOM 303 CB TYR A 21 -21.303 2.099 -13.118 1.00 0.00 C ATOM 304 CG TYR A 21 -20.342 2.939 -13.923 1.00 0.00 C ATOM 305 CD1 TYR A 21 -19.915 4.171 -13.421 1.00 0.00 C ATOM 306 CD2 TYR A 21 -19.876 2.491 -15.162 1.00 0.00 C ATOM 307 CE1 TYR A 21 -19.026 4.960 -14.156 1.00 0.00 C ATOM 308 CE2 TYR A 21 -18.985 3.279 -15.900 1.00 0.00 C ATOM 309 CZ TYR A 21 -18.560 4.515 -15.398 1.00 0.00 C ATOM 310 OH TYR A 21 -17.683 5.292 -16.126 1.00 0.00 O ATOM 0 H TYR A 21 -20.292 0.089 -12.314 1.00 0.00 H new ATOM 0 HA TYR A 21 -20.177 2.902 -11.428 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -21.361 1.091 -13.529 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -22.307 2.521 -13.165 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -20.273 4.515 -12.462 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -20.203 1.538 -15.550 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -18.699 5.912 -13.766 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -18.625 2.933 -16.858 1.00 0.00 H new ATOM 0 HH TYR A 21 -17.133 5.824 -15.514 1.00 0.00 H new ATOM 320 N THR A 22 -22.342 1.016 -10.108 1.00 0.00 N ATOM 321 CA THR A 22 -23.483 1.003 -9.146 1.00 0.00 C ATOM 322 C THR A 22 -24.707 1.737 -9.710 1.00 0.00 C ATOM 323 O THR A 22 -25.509 1.165 -10.420 1.00 0.00 O ATOM 324 CB THR A 22 -22.964 1.703 -7.887 1.00 0.00 C ATOM 325 OG1 THR A 22 -22.687 3.065 -8.179 1.00 0.00 O ATOM 326 CG2 THR A 22 -21.688 1.014 -7.403 1.00 0.00 C ATOM 0 H THR A 22 -21.882 0.116 -10.243 1.00 0.00 H new ATOM 0 HA THR A 22 -23.813 -0.015 -8.941 1.00 0.00 H new ATOM 0 HB THR A 22 -23.722 1.647 -7.106 1.00 0.00 H new ATOM 0 HG1 THR A 22 -22.864 3.239 -9.127 1.00 0.00 H new ATOM 0 HG21 THR A 22 -21.322 1.515 -6.507 1.00 0.00 H new ATOM 0 HG22 THR A 22 -21.903 -0.030 -7.173 1.00 0.00 H new ATOM 0 HG23 THR A 22 -20.929 1.065 -8.183 1.00 0.00 H new ATOM 334 N ASP A 23 -24.879 2.987 -9.379 1.00 0.00 N ATOM 335 CA ASP A 23 -26.075 3.722 -9.883 1.00 0.00 C ATOM 336 C ASP A 23 -25.793 5.222 -9.983 1.00 0.00 C ATOM 337 O ASP A 23 -25.052 5.782 -9.199 1.00 0.00 O ATOM 338 CB ASP A 23 -27.154 3.450 -8.837 1.00 0.00 C ATOM 339 CG ASP A 23 -28.336 4.394 -9.064 1.00 0.00 C ATOM 340 OD1 ASP A 23 -28.186 5.575 -8.799 1.00 0.00 O ATOM 341 OD2 ASP A 23 -29.372 3.919 -9.499 1.00 0.00 O ATOM 0 H ASP A 23 -24.250 3.528 -8.786 1.00 0.00 H new ATOM 0 HA ASP A 23 -26.367 3.399 -10.882 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -27.485 2.414 -8.902 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -26.748 3.593 -7.835 1.00 0.00 H new ATOM 346 N GLY A 24 -26.384 5.877 -10.945 1.00 0.00 N ATOM 347 CA GLY A 24 -26.160 7.341 -11.103 1.00 0.00 C ATOM 348 C GLY A 24 -24.859 7.573 -11.867 1.00 0.00 C ATOM 349 O GLY A 24 -24.238 8.611 -11.758 1.00 0.00 O ATOM 0 H GLY A 24 -27.014 5.459 -11.630 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -26.995 7.793 -11.639 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -26.112 7.821 -10.125 1.00 0.00 H new ATOM 353 N SER A 25 -24.440 6.609 -12.637 1.00 0.00 N ATOM 354 CA SER A 25 -23.175 6.769 -13.407 1.00 0.00 C ATOM 355 C SER A 25 -23.461 6.727 -14.905 1.00 0.00 C ATOM 356 O SER A 25 -24.557 6.416 -15.328 1.00 0.00 O ATOM 357 CB SER A 25 -22.307 5.594 -12.982 1.00 0.00 C ATOM 358 OG SER A 25 -22.774 5.095 -11.737 1.00 0.00 O ATOM 0 H SER A 25 -24.918 5.717 -12.767 1.00 0.00 H new ATOM 0 HA SER A 25 -22.685 7.723 -13.212 1.00 0.00 H new ATOM 0 HB2 SER A 25 -22.341 4.809 -13.738 1.00 0.00 H new ATOM 0 HB3 SER A 25 -21.267 5.908 -12.895 1.00 0.00 H new ATOM 0 HG SER A 25 -22.283 4.279 -11.506 1.00 0.00 H new ATOM 364 N VAL A 26 -22.493 7.054 -15.713 1.00 0.00 N ATOM 365 CA VAL A 26 -22.736 7.047 -17.179 1.00 0.00 C ATOM 366 C VAL A 26 -21.541 6.469 -17.929 1.00 0.00 C ATOM 367 O VAL A 26 -20.427 6.469 -17.446 1.00 0.00 O ATOM 368 CB VAL A 26 -22.947 8.522 -17.532 1.00 0.00 C ATOM 369 CG1 VAL A 26 -22.803 8.734 -19.040 1.00 0.00 C ATOM 370 CG2 VAL A 26 -24.345 8.952 -17.085 1.00 0.00 C ATOM 0 H VAL A 26 -21.552 7.323 -15.424 1.00 0.00 H new ATOM 0 HA VAL A 26 -23.588 6.427 -17.457 1.00 0.00 H new ATOM 0 HB VAL A 26 -22.194 9.122 -17.021 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -22.956 9.787 -19.276 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -21.804 8.433 -19.356 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -23.546 8.134 -19.564 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -24.500 10.002 -17.334 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -25.093 8.344 -17.594 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -24.440 8.817 -16.008 1.00 0.00 H new ATOM 380 N VAL A 27 -21.776 5.966 -19.108 1.00 0.00 N ATOM 381 CA VAL A 27 -20.660 5.373 -19.897 1.00 0.00 C ATOM 382 C VAL A 27 -20.685 5.864 -21.329 1.00 0.00 C ATOM 383 O VAL A 27 -21.659 5.703 -22.035 1.00 0.00 O ATOM 384 CB VAL A 27 -20.913 3.874 -19.861 1.00 0.00 C ATOM 385 CG1 VAL A 27 -20.098 3.171 -20.951 1.00 0.00 C ATOM 386 CG2 VAL A 27 -20.485 3.353 -18.513 1.00 0.00 C ATOM 0 H VAL A 27 -22.690 5.940 -19.559 1.00 0.00 H new ATOM 0 HA VAL A 27 -19.688 5.648 -19.488 1.00 0.00 H new ATOM 0 HB VAL A 27 -21.972 3.679 -20.032 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -20.289 2.099 -20.913 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -20.388 3.557 -21.928 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -19.036 3.356 -20.788 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -20.659 2.278 -18.467 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -19.424 3.556 -18.364 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -21.062 3.848 -17.732 1.00 0.00 H new ATOM 396 N THR A 28 -19.614 6.431 -21.785 1.00 0.00 N ATOM 397 CA THR A 28 -19.605 6.884 -23.187 1.00 0.00 C ATOM 398 C THR A 28 -19.492 5.663 -24.086 1.00 0.00 C ATOM 399 O THR A 28 -18.432 5.093 -24.256 1.00 0.00 O ATOM 400 CB THR A 28 -18.389 7.799 -23.331 1.00 0.00 C ATOM 401 OG1 THR A 28 -17.771 7.975 -22.063 1.00 0.00 O ATOM 402 CG2 THR A 28 -18.842 9.153 -23.872 1.00 0.00 C ATOM 0 H THR A 28 -18.758 6.598 -21.256 1.00 0.00 H new ATOM 0 HA THR A 28 -20.511 7.421 -23.466 1.00 0.00 H new ATOM 0 HB THR A 28 -17.673 7.350 -24.019 1.00 0.00 H new ATOM 0 HG1 THR A 28 -16.991 8.560 -22.158 1.00 0.00 H new ATOM 0 HG21 THR A 28 -17.979 9.810 -23.977 1.00 0.00 H new ATOM 0 HG22 THR A 28 -19.314 9.017 -24.845 1.00 0.00 H new ATOM 0 HG23 THR A 28 -19.557 9.600 -23.181 1.00 0.00 H new ATOM 410 N TYR A 29 -20.587 5.242 -24.642 1.00 0.00 N ATOM 411 CA TYR A 29 -20.558 4.038 -25.508 1.00 0.00 C ATOM 412 C TYR A 29 -19.788 4.334 -26.796 1.00 0.00 C ATOM 413 O TYR A 29 -20.068 5.292 -27.489 1.00 0.00 O ATOM 414 CB TYR A 29 -22.026 3.753 -25.836 1.00 0.00 C ATOM 415 CG TYR A 29 -22.611 2.768 -24.851 1.00 0.00 C ATOM 416 CD1 TYR A 29 -21.930 2.452 -23.669 1.00 0.00 C ATOM 417 CD2 TYR A 29 -23.845 2.173 -25.126 1.00 0.00 C ATOM 418 CE1 TYR A 29 -22.483 1.540 -22.765 1.00 0.00 C ATOM 419 CE2 TYR A 29 -24.400 1.262 -24.223 1.00 0.00 C ATOM 420 CZ TYR A 29 -23.719 0.944 -23.041 1.00 0.00 C ATOM 421 OH TYR A 29 -24.266 0.043 -22.150 1.00 0.00 O ATOM 0 H TYR A 29 -21.502 5.680 -24.534 1.00 0.00 H new ATOM 0 HA TYR A 29 -20.069 3.194 -25.021 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -22.596 4.682 -25.812 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -22.107 3.355 -26.848 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -20.977 2.913 -23.456 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -24.371 2.417 -26.037 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -21.957 1.296 -21.854 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -25.354 0.803 -24.437 1.00 0.00 H new ATOM 0 HH TYR A 29 -25.127 -0.275 -22.494 1.00 0.00 H new ATOM 431 N SER A 30 -18.827 3.521 -27.131 1.00 0.00 N ATOM 432 CA SER A 30 -18.059 3.764 -28.383 1.00 0.00 C ATOM 433 C SER A 30 -18.856 3.252 -29.584 1.00 0.00 C ATOM 434 O SER A 30 -20.012 2.897 -29.466 1.00 0.00 O ATOM 435 CB SER A 30 -16.761 2.976 -28.217 1.00 0.00 C ATOM 436 OG SER A 30 -16.106 2.882 -29.474 1.00 0.00 O ATOM 0 H SER A 30 -18.541 2.702 -26.595 1.00 0.00 H new ATOM 0 HA SER A 30 -17.864 4.822 -28.555 1.00 0.00 H new ATOM 0 HB2 SER A 30 -16.113 3.469 -27.492 1.00 0.00 H new ATOM 0 HB3 SER A 30 -16.974 1.980 -27.829 1.00 0.00 H new ATOM 0 HG SER A 30 -16.282 2.003 -29.870 1.00 0.00 H new ATOM 442 N CYS A 31 -18.253 3.211 -30.738 1.00 0.00 N ATOM 443 CA CYS A 31 -18.988 2.721 -31.940 1.00 0.00 C ATOM 444 C CYS A 31 -18.012 2.085 -32.932 1.00 0.00 C ATOM 445 O CYS A 31 -16.821 2.319 -32.882 1.00 0.00 O ATOM 446 CB CYS A 31 -19.632 3.968 -32.546 1.00 0.00 C ATOM 447 SG CYS A 31 -21.006 4.508 -31.499 1.00 0.00 S ATOM 0 H CYS A 31 -17.287 3.494 -30.903 1.00 0.00 H new ATOM 0 HA CYS A 31 -19.728 1.961 -31.691 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -18.894 4.765 -32.635 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -19.991 3.752 -33.552 1.00 0.00 H new ATOM 452 N ASN A 32 -18.506 1.283 -33.835 1.00 0.00 N ATOM 453 CA ASN A 32 -17.601 0.637 -34.827 1.00 0.00 C ATOM 454 C ASN A 32 -16.669 1.682 -35.446 1.00 0.00 C ATOM 455 O ASN A 32 -16.830 2.869 -35.244 1.00 0.00 O ATOM 456 CB ASN A 32 -18.529 0.050 -35.890 1.00 0.00 C ATOM 457 CG ASN A 32 -17.714 -0.810 -36.858 1.00 0.00 C ATOM 458 OD1 ASN A 32 -17.663 -0.533 -38.040 1.00 0.00 O ATOM 459 ND2 ASN A 32 -17.069 -1.849 -36.403 1.00 0.00 N ATOM 0 H ASN A 32 -19.494 1.048 -33.929 1.00 0.00 H new ATOM 0 HA ASN A 32 -16.969 -0.127 -34.374 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -19.306 -0.551 -35.418 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -19.031 0.851 -36.432 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -16.522 -2.429 -37.040 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -17.112 -2.082 -35.411 1.00 0.00 H new ATOM 466 N SER A 33 -15.696 1.250 -36.200 1.00 0.00 N ATOM 467 CA SER A 33 -14.756 2.218 -36.831 1.00 0.00 C ATOM 468 C SER A 33 -15.445 2.945 -37.989 1.00 0.00 C ATOM 469 O SER A 33 -15.683 2.377 -39.037 1.00 0.00 O ATOM 470 CB SER A 33 -13.599 1.365 -37.347 1.00 0.00 C ATOM 471 OG SER A 33 -12.392 2.114 -37.274 1.00 0.00 O ATOM 0 H SER A 33 -15.511 0.268 -36.406 1.00 0.00 H new ATOM 0 HA SER A 33 -14.419 2.983 -36.132 1.00 0.00 H new ATOM 0 HB2 SER A 33 -13.511 0.454 -36.755 1.00 0.00 H new ATOM 0 HB3 SER A 33 -13.789 1.059 -38.376 1.00 0.00 H new ATOM 0 HG SER A 33 -11.648 1.568 -37.603 1.00 0.00 H new ATOM 477 N GLY A 34 -15.767 4.196 -37.809 1.00 0.00 N ATOM 478 CA GLY A 34 -16.440 4.957 -38.899 1.00 0.00 C ATOM 479 C GLY A 34 -17.940 5.041 -38.615 1.00 0.00 C ATOM 480 O GLY A 34 -18.720 5.431 -39.461 1.00 0.00 O ATOM 0 H GLY A 34 -15.593 4.724 -36.954 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -16.017 5.959 -38.972 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -16.268 4.468 -39.858 1.00 0.00 H new ATOM 484 N TYR A 35 -18.351 4.677 -37.431 1.00 0.00 N ATOM 485 CA TYR A 35 -19.803 4.737 -37.097 1.00 0.00 C ATOM 486 C TYR A 35 -20.080 5.905 -36.145 1.00 0.00 C ATOM 487 O TYR A 35 -19.442 6.051 -35.121 1.00 0.00 O ATOM 488 CB TYR A 35 -20.109 3.401 -36.417 1.00 0.00 C ATOM 489 CG TYR A 35 -20.549 2.394 -37.454 1.00 0.00 C ATOM 490 CD1 TYR A 35 -20.144 2.534 -38.787 1.00 0.00 C ATOM 491 CD2 TYR A 35 -21.363 1.319 -37.080 1.00 0.00 C ATOM 492 CE1 TYR A 35 -20.554 1.599 -39.745 1.00 0.00 C ATOM 493 CE2 TYR A 35 -21.773 0.384 -38.038 1.00 0.00 C ATOM 494 CZ TYR A 35 -21.368 0.524 -39.371 1.00 0.00 C ATOM 495 OH TYR A 35 -21.773 -0.397 -40.315 1.00 0.00 O ATOM 0 H TYR A 35 -17.746 4.341 -36.682 1.00 0.00 H new ATOM 0 HA TYR A 35 -20.424 4.895 -37.979 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -19.225 3.037 -35.894 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -20.891 3.533 -35.669 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -19.515 3.363 -39.076 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -21.675 1.211 -36.052 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -20.242 1.707 -40.773 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -22.402 -0.445 -37.749 1.00 0.00 H new ATOM 0 HH TYR A 35 -22.332 -1.079 -39.888 1.00 0.00 H new ATOM 505 N SER A 36 -21.028 6.738 -36.478 1.00 0.00 N ATOM 506 CA SER A 36 -21.350 7.898 -35.601 1.00 0.00 C ATOM 507 C SER A 36 -22.104 7.442 -34.353 1.00 0.00 C ATOM 508 O SER A 36 -22.985 6.606 -34.417 1.00 0.00 O ATOM 509 CB SER A 36 -22.246 8.800 -36.444 1.00 0.00 C ATOM 510 OG SER A 36 -21.992 10.153 -36.101 1.00 0.00 O ATOM 0 H SER A 36 -21.595 6.664 -37.323 1.00 0.00 H new ATOM 0 HA SER A 36 -20.447 8.406 -35.262 1.00 0.00 H new ATOM 0 HB2 SER A 36 -22.053 8.638 -37.504 1.00 0.00 H new ATOM 0 HB3 SER A 36 -23.294 8.558 -36.270 1.00 0.00 H new ATOM 0 HG SER A 36 -22.291 10.319 -35.183 1.00 0.00 H new ATOM 516 N LEU A 37 -21.776 7.999 -33.221 1.00 0.00 N ATOM 517 CA LEU A 37 -22.489 7.612 -31.974 1.00 0.00 C ATOM 518 C LEU A 37 -23.685 8.541 -31.763 1.00 0.00 C ATOM 519 O LEU A 37 -23.537 9.680 -31.368 1.00 0.00 O ATOM 520 CB LEU A 37 -21.471 7.786 -30.847 1.00 0.00 C ATOM 521 CG LEU A 37 -22.163 7.541 -29.506 1.00 0.00 C ATOM 522 CD1 LEU A 37 -21.929 6.094 -29.069 1.00 0.00 C ATOM 523 CD2 LEU A 37 -21.590 8.494 -28.454 1.00 0.00 C ATOM 0 H LEU A 37 -21.047 8.703 -33.106 1.00 0.00 H new ATOM 0 HA LEU A 37 -22.867 6.590 -32.013 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -20.644 7.088 -30.976 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -21.048 8.790 -30.874 1.00 0.00 H new ATOM 0 HG LEU A 37 -23.233 7.719 -29.611 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -22.422 5.918 -28.113 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -22.339 5.417 -29.818 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -20.859 5.914 -28.964 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -22.083 8.319 -27.498 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -20.520 8.318 -28.348 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -21.758 9.525 -28.766 1.00 0.00 H new ATOM 535 N ILE A 38 -24.869 8.064 -32.024 1.00 0.00 N ATOM 536 CA ILE A 38 -26.074 8.925 -31.837 1.00 0.00 C ATOM 537 C ILE A 38 -26.708 8.622 -30.479 1.00 0.00 C ATOM 538 O ILE A 38 -26.560 7.542 -29.944 1.00 0.00 O ATOM 539 CB ILE A 38 -27.059 8.584 -32.975 1.00 0.00 C ATOM 540 CG1 ILE A 38 -26.374 7.800 -34.109 1.00 0.00 C ATOM 541 CG2 ILE A 38 -27.621 9.878 -33.554 1.00 0.00 C ATOM 542 CD1 ILE A 38 -25.199 8.610 -34.664 1.00 0.00 C ATOM 0 H ILE A 38 -25.057 7.119 -32.358 1.00 0.00 H new ATOM 0 HA ILE A 38 -25.813 9.983 -31.864 1.00 0.00 H new ATOM 0 HB ILE A 38 -27.851 7.963 -32.555 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -26.021 6.838 -33.737 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -27.091 7.591 -34.903 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -28.318 9.644 -34.359 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -28.142 10.430 -32.772 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -26.805 10.486 -33.946 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -24.718 8.050 -35.466 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -25.564 9.561 -35.053 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -24.478 8.796 -33.868 1.00 0.00 H new ATOM 554 N GLY A 39 -27.408 9.564 -29.913 1.00 0.00 N ATOM 555 CA GLY A 39 -28.042 9.317 -28.589 1.00 0.00 C ATOM 556 C GLY A 39 -27.119 9.823 -27.482 1.00 0.00 C ATOM 557 O GLY A 39 -26.977 9.204 -26.447 1.00 0.00 O ATOM 0 H GLY A 39 -27.568 10.491 -30.308 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -29.005 9.824 -28.535 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -28.235 8.252 -28.459 1.00 0.00 H new ATOM 561 N ASN A 40 -26.488 10.944 -27.694 1.00 0.00 N ATOM 562 CA ASN A 40 -25.568 11.493 -26.656 1.00 0.00 C ATOM 563 C ASN A 40 -24.333 10.601 -26.523 1.00 0.00 C ATOM 564 O ASN A 40 -24.242 9.553 -27.132 1.00 0.00 O ATOM 565 CB ASN A 40 -26.378 11.491 -25.359 1.00 0.00 C ATOM 566 CG ASN A 40 -26.250 12.853 -24.674 1.00 0.00 C ATOM 567 OD1 ASN A 40 -25.356 13.064 -23.878 1.00 0.00 O ATOM 568 ND2 ASN A 40 -27.112 13.794 -24.950 1.00 0.00 N ATOM 0 H ASN A 40 -26.569 11.505 -28.542 1.00 0.00 H new ATOM 0 HA ASN A 40 -25.213 12.492 -26.907 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -27.425 11.277 -25.572 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -26.020 10.704 -24.696 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -27.035 14.705 -24.498 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -27.863 13.618 -25.618 1.00 0.00 H new ATOM 575 N SER A 41 -23.382 11.009 -25.732 1.00 0.00 N ATOM 576 CA SER A 41 -22.151 10.186 -25.562 1.00 0.00 C ATOM 577 C SER A 41 -21.984 9.776 -24.097 1.00 0.00 C ATOM 578 O SER A 41 -21.114 10.263 -23.402 1.00 0.00 O ATOM 579 CB SER A 41 -21.004 11.097 -25.999 1.00 0.00 C ATOM 580 OG SER A 41 -20.038 10.331 -26.705 1.00 0.00 O ATOM 0 H SER A 41 -23.403 11.876 -25.195 1.00 0.00 H new ATOM 0 HA SER A 41 -22.186 9.266 -26.145 1.00 0.00 H new ATOM 0 HB2 SER A 41 -21.383 11.899 -26.633 1.00 0.00 H new ATOM 0 HB3 SER A 41 -20.546 11.567 -25.129 1.00 0.00 H new ATOM 0 HG SER A 41 -19.302 10.913 -26.988 1.00 0.00 H new ATOM 586 N GLY A 42 -22.809 8.883 -23.620 1.00 0.00 N ATOM 587 CA GLY A 42 -22.686 8.446 -22.200 1.00 0.00 C ATOM 588 C GLY A 42 -23.967 7.737 -21.753 1.00 0.00 C ATOM 589 O GLY A 42 -25.037 8.313 -21.742 1.00 0.00 O ATOM 0 H GLY A 42 -23.559 8.439 -24.150 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -21.833 7.776 -22.091 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -22.497 9.309 -21.561 1.00 0.00 H new ATOM 593 N VAL A 43 -23.865 6.492 -21.366 1.00 0.00 N ATOM 594 CA VAL A 43 -25.073 5.751 -20.900 1.00 0.00 C ATOM 595 C VAL A 43 -25.412 6.217 -19.490 1.00 0.00 C ATOM 596 O VAL A 43 -24.776 7.104 -18.965 1.00 0.00 O ATOM 597 CB VAL A 43 -24.689 4.267 -20.868 1.00 0.00 C ATOM 598 CG1 VAL A 43 -25.953 3.418 -21.010 1.00 0.00 C ATOM 599 CG2 VAL A 43 -23.737 3.929 -22.015 1.00 0.00 C ATOM 0 H VAL A 43 -22.997 5.957 -21.353 1.00 0.00 H new ATOM 0 HA VAL A 43 -25.931 5.920 -21.550 1.00 0.00 H new ATOM 0 HB VAL A 43 -24.191 4.057 -19.921 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -25.686 2.361 -20.988 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -26.633 3.638 -20.187 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -26.442 3.649 -21.956 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -23.478 2.871 -21.973 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -24.222 4.146 -22.967 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -22.831 4.528 -21.925 1.00 0.00 H new ATOM 609 N LEU A 44 -26.384 5.621 -18.862 1.00 0.00 N ATOM 610 CA LEU A 44 -26.721 6.039 -17.474 1.00 0.00 C ATOM 611 C LEU A 44 -27.143 4.829 -16.647 1.00 0.00 C ATOM 612 O LEU A 44 -28.259 4.356 -16.744 1.00 0.00 O ATOM 613 CB LEU A 44 -27.880 7.033 -17.611 1.00 0.00 C ATOM 614 CG LEU A 44 -28.550 7.247 -16.245 1.00 0.00 C ATOM 615 CD1 LEU A 44 -28.034 8.539 -15.611 1.00 0.00 C ATOM 616 CD2 LEU A 44 -30.066 7.344 -16.434 1.00 0.00 C ATOM 0 H LEU A 44 -26.956 4.868 -19.245 1.00 0.00 H new ATOM 0 HA LEU A 44 -25.868 6.489 -16.966 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -27.512 7.983 -17.998 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -28.609 6.658 -18.329 1.00 0.00 H new ATOM 0 HG LEU A 44 -28.313 6.407 -15.592 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -28.513 8.686 -14.643 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -26.954 8.472 -15.476 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -28.267 9.382 -16.262 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -30.544 7.496 -15.466 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -30.298 8.184 -17.089 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -30.437 6.422 -16.881 1.00 0.00 H new ATOM 628 N CYS A 45 -26.270 4.337 -15.818 1.00 0.00 N ATOM 629 CA CYS A 45 -26.642 3.174 -14.971 1.00 0.00 C ATOM 630 C CYS A 45 -27.372 3.668 -13.726 1.00 0.00 C ATOM 631 O CYS A 45 -26.867 4.491 -12.985 1.00 0.00 O ATOM 632 CB CYS A 45 -25.331 2.502 -14.577 1.00 0.00 C ATOM 633 SG CYS A 45 -25.672 1.269 -13.299 1.00 0.00 S ATOM 0 H CYS A 45 -25.320 4.687 -15.690 1.00 0.00 H new ATOM 0 HA CYS A 45 -27.299 2.481 -15.496 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -24.873 2.029 -15.446 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -24.623 3.243 -14.207 1.00 0.00 H new ATOM 638 N SER A 46 -28.552 3.175 -13.487 1.00 0.00 N ATOM 639 CA SER A 46 -29.307 3.623 -12.285 1.00 0.00 C ATOM 640 C SER A 46 -29.863 2.414 -11.526 1.00 0.00 C ATOM 641 O SER A 46 -31.022 2.071 -11.650 1.00 0.00 O ATOM 642 CB SER A 46 -30.445 4.484 -12.831 1.00 0.00 C ATOM 643 OG SER A 46 -31.361 3.657 -13.538 1.00 0.00 O ATOM 0 H SER A 46 -29.026 2.484 -14.068 1.00 0.00 H new ATOM 0 HA SER A 46 -28.679 4.174 -11.585 1.00 0.00 H new ATOM 0 HB2 SER A 46 -30.954 4.995 -12.014 1.00 0.00 H new ATOM 0 HB3 SER A 46 -30.049 5.255 -13.492 1.00 0.00 H new ATOM 0 HG SER A 46 -31.792 3.038 -12.913 1.00 0.00 H new ATOM 649 N GLY A 47 -29.046 1.767 -10.741 1.00 0.00 N ATOM 650 CA GLY A 47 -29.530 0.583 -9.975 1.00 0.00 C ATOM 651 C GLY A 47 -29.263 -0.692 -10.775 1.00 0.00 C ATOM 652 O GLY A 47 -30.120 -1.543 -10.911 1.00 0.00 O ATOM 0 H GLY A 47 -28.065 2.006 -10.597 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -29.026 0.531 -9.010 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -30.597 0.680 -9.772 1.00 0.00 H new ATOM 656 N GLY A 48 -28.079 -0.834 -11.305 1.00 0.00 N ATOM 657 CA GLY A 48 -27.757 -2.056 -12.094 1.00 0.00 C ATOM 658 C GLY A 48 -28.682 -2.141 -13.309 1.00 0.00 C ATOM 659 O GLY A 48 -28.907 -3.202 -13.856 1.00 0.00 O ATOM 0 H GLY A 48 -27.321 -0.156 -11.226 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -26.717 -2.028 -12.418 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -27.874 -2.944 -11.472 1.00 0.00 H new ATOM 663 N GLU A 49 -29.219 -1.032 -13.738 1.00 0.00 N ATOM 664 CA GLU A 49 -30.128 -1.056 -14.920 1.00 0.00 C ATOM 665 C GLU A 49 -29.656 -0.057 -15.974 1.00 0.00 C ATOM 666 O GLU A 49 -30.297 0.942 -16.233 1.00 0.00 O ATOM 667 CB GLU A 49 -31.498 -0.657 -14.377 1.00 0.00 C ATOM 668 CG GLU A 49 -31.920 -1.652 -13.298 1.00 0.00 C ATOM 669 CD GLU A 49 -33.361 -2.097 -13.549 1.00 0.00 C ATOM 670 OE1 GLU A 49 -33.752 -2.147 -14.704 1.00 0.00 O ATOM 671 OE2 GLU A 49 -34.050 -2.382 -12.583 1.00 0.00 O ATOM 0 H GLU A 49 -29.069 -0.112 -13.323 1.00 0.00 H new ATOM 0 HA GLU A 49 -30.150 -2.034 -15.401 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -31.459 0.351 -13.964 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -32.232 -0.643 -15.183 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -31.255 -2.516 -13.305 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -31.836 -1.193 -12.313 1.00 0.00 H new ATOM 678 N TRP A 50 -28.542 -0.328 -16.589 1.00 0.00 N ATOM 679 CA TRP A 50 -28.025 0.596 -17.637 1.00 0.00 C ATOM 680 C TRP A 50 -29.176 1.038 -18.547 1.00 0.00 C ATOM 681 O TRP A 50 -29.997 0.238 -18.952 1.00 0.00 O ATOM 682 CB TRP A 50 -27.007 -0.236 -18.420 1.00 0.00 C ATOM 683 CG TRP A 50 -25.717 -0.293 -17.664 1.00 0.00 C ATOM 684 CD1 TRP A 50 -25.227 -1.389 -17.037 1.00 0.00 C ATOM 685 CD2 TRP A 50 -24.746 0.770 -17.449 1.00 0.00 C ATOM 686 NE1 TRP A 50 -24.018 -1.064 -16.451 1.00 0.00 N ATOM 687 CE2 TRP A 50 -23.679 0.254 -16.676 1.00 0.00 C ATOM 688 CE3 TRP A 50 -24.691 2.119 -17.844 1.00 0.00 C ATOM 689 CZ2 TRP A 50 -22.592 1.047 -16.309 1.00 0.00 C ATOM 690 CZ3 TRP A 50 -23.599 2.921 -17.478 1.00 0.00 C ATOM 691 CH2 TRP A 50 -22.553 2.387 -16.711 1.00 0.00 C ATOM 0 H TRP A 50 -27.965 -1.150 -16.412 1.00 0.00 H new ATOM 0 HA TRP A 50 -27.578 1.500 -17.222 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -27.391 -1.243 -18.580 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -26.844 0.203 -19.404 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -25.703 -2.358 -17.001 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -23.446 -1.719 -15.917 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -25.493 2.540 -18.432 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -21.788 0.631 -15.720 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -23.564 3.955 -17.789 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -21.717 3.010 -16.430 1.00 0.00 H new ATOM 702 N SER A 51 -29.254 2.302 -18.868 1.00 0.00 N ATOM 703 CA SER A 51 -30.367 2.772 -19.745 1.00 0.00 C ATOM 704 C SER A 51 -29.911 3.929 -20.642 1.00 0.00 C ATOM 705 O SER A 51 -28.843 4.485 -20.471 1.00 0.00 O ATOM 706 CB SER A 51 -31.453 3.245 -18.781 1.00 0.00 C ATOM 707 OG SER A 51 -32.658 3.464 -19.502 1.00 0.00 O ATOM 0 H SER A 51 -28.601 3.025 -18.564 1.00 0.00 H new ATOM 0 HA SER A 51 -30.716 1.983 -20.412 1.00 0.00 H new ATOM 0 HB2 SER A 51 -31.613 2.500 -18.001 1.00 0.00 H new ATOM 0 HB3 SER A 51 -31.140 4.164 -18.285 1.00 0.00 H new ATOM 0 HG SER A 51 -33.358 3.766 -18.886 1.00 0.00 H new ATOM 713 N ASP A 52 -30.729 4.292 -21.595 1.00 0.00 N ATOM 714 CA ASP A 52 -30.381 5.410 -22.521 1.00 0.00 C ATOM 715 C ASP A 52 -29.087 5.110 -23.280 1.00 0.00 C ATOM 716 O ASP A 52 -28.093 5.790 -23.122 1.00 0.00 O ATOM 717 CB ASP A 52 -30.217 6.638 -21.625 1.00 0.00 C ATOM 718 CG ASP A 52 -31.149 7.751 -22.108 1.00 0.00 C ATOM 719 OD1 ASP A 52 -30.847 8.350 -23.127 1.00 0.00 O ATOM 720 OD2 ASP A 52 -32.151 7.985 -21.451 1.00 0.00 O ATOM 0 H ASP A 52 -31.634 3.856 -21.773 1.00 0.00 H new ATOM 0 HA ASP A 52 -31.149 5.561 -23.279 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -30.447 6.380 -20.591 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -29.183 6.981 -21.646 1.00 0.00 H new ATOM 725 N PRO A 53 -29.162 4.095 -24.091 1.00 0.00 N ATOM 726 CA PRO A 53 -28.014 3.671 -24.913 1.00 0.00 C ATOM 727 C PRO A 53 -28.049 4.370 -26.276 1.00 0.00 C ATOM 728 O PRO A 53 -29.049 4.333 -26.964 1.00 0.00 O ATOM 729 CB PRO A 53 -28.254 2.177 -25.079 1.00 0.00 C ATOM 730 CG PRO A 53 -29.740 1.982 -24.916 1.00 0.00 C ATOM 731 CD PRO A 53 -30.321 3.242 -24.310 1.00 0.00 C ATOM 0 HA PRO A 53 -27.048 3.910 -24.469 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -27.919 1.833 -26.058 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -27.700 1.606 -24.334 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -30.204 1.776 -25.881 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -29.942 1.124 -24.275 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -31.041 3.712 -24.980 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -30.844 3.032 -23.377 1.00 0.00 H new ATOM 739 N PRO A 54 -26.952 4.979 -26.622 1.00 0.00 N ATOM 740 CA PRO A 54 -26.856 5.688 -27.919 1.00 0.00 C ATOM 741 C PRO A 54 -26.664 4.681 -29.056 1.00 0.00 C ATOM 742 O PRO A 54 -26.499 3.498 -28.829 1.00 0.00 O ATOM 743 CB PRO A 54 -25.625 6.570 -27.751 1.00 0.00 C ATOM 744 CG PRO A 54 -24.787 5.882 -26.714 1.00 0.00 C ATOM 745 CD PRO A 54 -25.712 5.067 -25.846 1.00 0.00 C ATOM 0 HA PRO A 54 -27.749 6.261 -28.169 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -25.083 6.672 -28.691 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -25.901 7.575 -27.431 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -24.043 5.241 -27.187 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -24.244 6.613 -26.114 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -25.299 4.079 -25.642 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -25.879 5.547 -24.882 1.00 0.00 H new ATOM 753 N THR A 55 -26.698 5.137 -30.278 1.00 0.00 N ATOM 754 CA THR A 55 -26.531 4.201 -31.427 1.00 0.00 C ATOM 755 C THR A 55 -25.166 4.369 -32.083 1.00 0.00 C ATOM 756 O THR A 55 -24.488 5.359 -31.899 1.00 0.00 O ATOM 757 CB THR A 55 -27.612 4.608 -32.427 1.00 0.00 C ATOM 758 OG1 THR A 55 -27.566 6.010 -32.609 1.00 0.00 O ATOM 759 CG2 THR A 55 -28.985 4.213 -31.895 1.00 0.00 C ATOM 0 H THR A 55 -26.834 6.116 -30.531 1.00 0.00 H new ATOM 0 HA THR A 55 -26.610 3.164 -31.102 1.00 0.00 H new ATOM 0 HB THR A 55 -27.438 4.102 -33.377 1.00 0.00 H new ATOM 0 HG1 THR A 55 -28.286 6.285 -33.214 1.00 0.00 H new ATOM 0 HG21 THR A 55 -29.751 4.506 -32.613 1.00 0.00 H new ATOM 0 HG22 THR A 55 -29.021 3.134 -31.746 1.00 0.00 H new ATOM 0 HG23 THR A 55 -29.166 4.716 -30.945 1.00 0.00 H new ATOM 767 N CYS A 56 -24.785 3.416 -32.882 1.00 0.00 N ATOM 768 CA CYS A 56 -23.491 3.508 -33.604 1.00 0.00 C ATOM 769 C CYS A 56 -23.758 3.258 -35.079 1.00 0.00 C ATOM 770 O CYS A 56 -23.503 2.194 -35.607 1.00 0.00 O ATOM 771 CB CYS A 56 -22.599 2.419 -33.006 1.00 0.00 C ATOM 772 SG CYS A 56 -22.162 2.863 -31.305 1.00 0.00 S ATOM 0 H CYS A 56 -25.321 2.568 -33.067 1.00 0.00 H new ATOM 0 HA CYS A 56 -23.010 4.481 -33.507 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -23.117 1.460 -33.021 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -21.697 2.303 -33.606 1.00 0.00 H new ATOM 777 N GLN A 57 -24.297 4.238 -35.736 1.00 0.00 N ATOM 778 CA GLN A 57 -24.622 4.085 -37.178 1.00 0.00 C ATOM 779 C GLN A 57 -23.717 4.978 -38.018 1.00 0.00 C ATOM 780 O GLN A 57 -22.667 5.396 -37.583 1.00 0.00 O ATOM 781 CB GLN A 57 -26.089 4.523 -37.345 1.00 0.00 C ATOM 782 CG GLN A 57 -26.640 5.193 -36.081 1.00 0.00 C ATOM 783 CD GLN A 57 -28.115 5.538 -36.296 1.00 0.00 C ATOM 784 OE1 GLN A 57 -28.470 6.140 -37.290 1.00 0.00 O ATOM 785 NE2 GLN A 57 -28.995 5.178 -35.404 1.00 0.00 N ATOM 0 H GLN A 57 -24.529 5.147 -35.335 1.00 0.00 H new ATOM 0 HA GLN A 57 -24.474 3.056 -37.506 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -26.167 5.214 -38.184 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -26.700 3.654 -37.590 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -26.531 4.527 -35.225 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -26.072 6.096 -35.857 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -28.698 4.673 -34.569 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -29.981 5.402 -35.541 1.00 0.00 H new ATOM 794 N ILE A 58 -24.123 5.288 -39.215 1.00 0.00 N ATOM 795 CA ILE A 58 -23.294 6.175 -40.070 1.00 0.00 C ATOM 796 C ILE A 58 -24.025 7.504 -40.231 1.00 0.00 C ATOM 797 O ILE A 58 -25.239 7.555 -40.233 1.00 0.00 O ATOM 798 CB ILE A 58 -23.136 5.470 -41.426 1.00 0.00 C ATOM 799 CG1 ILE A 58 -23.483 3.981 -41.315 1.00 0.00 C ATOM 800 CG2 ILE A 58 -21.684 5.601 -41.879 1.00 0.00 C ATOM 801 CD1 ILE A 58 -23.180 3.295 -42.645 1.00 0.00 C ATOM 0 H ILE A 58 -24.993 4.965 -39.638 1.00 0.00 H new ATOM 0 HA ILE A 58 -22.313 6.369 -39.637 1.00 0.00 H new ATOM 0 HB ILE A 58 -23.813 5.935 -42.143 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -22.906 3.519 -40.514 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -24.536 3.859 -41.060 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -21.557 5.105 -42.841 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -21.428 6.656 -41.978 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -21.029 5.136 -41.142 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -23.425 2.235 -42.572 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -23.777 3.752 -43.434 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -22.121 3.407 -42.880 1.00 0.00 H new ATOM 813 N VAL A 59 -23.310 8.581 -40.339 1.00 0.00 N ATOM 814 CA VAL A 59 -23.994 9.896 -40.466 1.00 0.00 C ATOM 815 C VAL A 59 -23.406 10.712 -41.589 1.00 0.00 C ATOM 816 O VAL A 59 -23.105 11.876 -41.431 1.00 0.00 O ATOM 817 CB VAL A 59 -23.731 10.596 -39.149 1.00 0.00 C ATOM 818 CG1 VAL A 59 -24.322 9.771 -38.006 1.00 0.00 C ATOM 819 CG2 VAL A 59 -22.221 10.731 -38.980 1.00 0.00 C ATOM 0 H VAL A 59 -22.290 8.612 -40.345 1.00 0.00 H new ATOM 0 HA VAL A 59 -25.055 9.772 -40.684 1.00 0.00 H new ATOM 0 HB VAL A 59 -24.195 11.582 -39.137 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -24.133 10.275 -37.058 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -25.397 9.664 -38.152 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -23.858 8.785 -37.992 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -22.004 11.233 -38.037 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -21.765 9.741 -38.977 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -21.813 11.316 -39.805 1.00 0.00 H new ATOM 829 N LYS A 60 -23.264 10.134 -42.723 1.00 0.00 N ATOM 830 CA LYS A 60 -22.714 10.923 -43.846 1.00 0.00 C ATOM 831 C LYS A 60 -23.698 12.037 -44.160 1.00 0.00 C ATOM 832 O LYS A 60 -24.608 12.288 -43.401 1.00 0.00 O ATOM 833 CB LYS A 60 -22.572 9.946 -45.014 1.00 0.00 C ATOM 834 CG LYS A 60 -21.832 8.693 -44.540 1.00 0.00 C ATOM 835 CD LYS A 60 -21.086 8.058 -45.717 1.00 0.00 C ATOM 836 CE LYS A 60 -21.311 6.543 -45.708 1.00 0.00 C ATOM 837 NZ LYS A 60 -20.041 5.963 -45.187 1.00 0.00 N ATOM 0 H LYS A 60 -23.498 9.163 -42.930 1.00 0.00 H new ATOM 0 HA LYS A 60 -21.749 11.380 -43.626 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -23.555 9.677 -45.400 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -22.027 10.416 -45.832 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -21.129 8.952 -43.748 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -22.539 7.979 -44.117 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -21.439 8.483 -46.657 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -20.021 8.278 -45.648 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -22.156 6.274 -45.074 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -21.532 6.172 -46.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -20.121 4.927 -45.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -19.255 6.229 -45.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -19.859 6.328 -44.230 1.00 0.00 H new ATOM 851 N CYS A 61 -23.523 12.727 -45.240 1.00 0.00 N ATOM 852 CA CYS A 61 -24.475 13.838 -45.533 1.00 0.00 C ATOM 853 C CYS A 61 -24.768 14.002 -47.020 1.00 0.00 C ATOM 854 O CYS A 61 -24.121 13.420 -47.867 1.00 0.00 O ATOM 855 CB CYS A 61 -23.780 15.092 -45.031 1.00 0.00 C ATOM 856 SG CYS A 61 -24.847 15.928 -43.841 1.00 0.00 S ATOM 0 H CYS A 61 -22.781 12.582 -45.925 1.00 0.00 H new ATOM 0 HA CYS A 61 -25.435 13.638 -45.056 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -22.829 14.833 -44.565 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -23.556 15.756 -45.866 1.00 0.00 H new ATOM 861 N PRO A 62 -25.740 14.840 -47.263 1.00 0.00 N ATOM 862 CA PRO A 62 -26.164 15.179 -48.626 1.00 0.00 C ATOM 863 C PRO A 62 -25.408 16.421 -49.091 1.00 0.00 C ATOM 864 O PRO A 62 -24.553 16.359 -49.952 1.00 0.00 O ATOM 865 CB PRO A 62 -27.647 15.493 -48.452 1.00 0.00 C ATOM 866 CG PRO A 62 -27.814 15.905 -47.015 1.00 0.00 C ATOM 867 CD PRO A 62 -26.545 15.554 -46.275 1.00 0.00 C ATOM 0 HA PRO A 62 -25.977 14.395 -49.360 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -27.959 16.291 -49.126 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -28.261 14.622 -48.683 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -28.011 16.975 -46.946 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -28.668 15.394 -46.570 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -26.034 16.447 -45.915 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -26.751 14.932 -45.404 1.00 0.00 H new ATOM 875 N HIS A 63 -25.728 17.552 -48.508 1.00 0.00 N ATOM 876 CA HIS A 63 -25.054 18.833 -48.878 1.00 0.00 C ATOM 877 C HIS A 63 -25.921 20.021 -48.462 1.00 0.00 C ATOM 878 O HIS A 63 -27.089 20.078 -48.795 1.00 0.00 O ATOM 879 CB HIS A 63 -24.955 18.825 -50.391 1.00 0.00 C ATOM 880 CG HIS A 63 -23.528 18.659 -50.823 1.00 0.00 C ATOM 881 ND1 HIS A 63 -23.180 18.465 -52.150 1.00 0.00 N ATOM 882 CD2 HIS A 63 -22.351 18.669 -50.124 1.00 0.00 C ATOM 883 CE1 HIS A 63 -21.841 18.368 -52.207 1.00 0.00 C ATOM 884 NE2 HIS A 63 -21.284 18.485 -50.999 1.00 0.00 N ATOM 0 H HIS A 63 -26.438 17.641 -47.781 1.00 0.00 H new ATOM 0 HA HIS A 63 -24.083 18.920 -48.391 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -25.561 18.015 -50.797 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -25.357 19.755 -50.793 1.00 0.00 H new ATOM 0 HD1 HIS A 63 -23.823 18.406 -52.940 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -22.263 18.800 -49.056 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -21.283 18.214 -53.119 1.00 0.00 H new ATOM 892 N PRO A 64 -25.320 20.944 -47.773 1.00 0.00 N ATOM 893 CA PRO A 64 -26.048 22.152 -47.343 1.00 0.00 C ATOM 894 C PRO A 64 -26.019 23.194 -48.474 1.00 0.00 C ATOM 895 O PRO A 64 -25.079 23.946 -48.614 1.00 0.00 O ATOM 896 CB PRO A 64 -25.251 22.621 -46.136 1.00 0.00 C ATOM 897 CG PRO A 64 -23.860 22.092 -46.335 1.00 0.00 C ATOM 898 CD PRO A 64 -23.928 20.953 -47.323 1.00 0.00 C ATOM 0 HA PRO A 64 -27.099 21.983 -47.107 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -25.250 23.709 -46.067 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -25.685 22.243 -45.210 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -23.203 22.879 -46.706 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -23.444 21.750 -45.388 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -23.242 21.108 -48.156 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -23.655 20.006 -46.857 1.00 0.00 H new ATOM 906 N THR A 65 -27.032 23.221 -49.297 1.00 0.00 N ATOM 907 CA THR A 65 -27.057 24.192 -50.441 1.00 0.00 C ATOM 908 C THR A 65 -28.136 25.243 -50.223 1.00 0.00 C ATOM 909 O THR A 65 -27.956 26.420 -50.467 1.00 0.00 O ATOM 910 CB THR A 65 -27.439 23.346 -51.656 1.00 0.00 C ATOM 911 OG1 THR A 65 -28.851 23.185 -51.686 1.00 0.00 O ATOM 912 CG2 THR A 65 -26.776 21.974 -51.573 1.00 0.00 C ATOM 0 H THR A 65 -27.848 22.613 -49.230 1.00 0.00 H new ATOM 0 HA THR A 65 -26.103 24.708 -50.553 1.00 0.00 H new ATOM 0 HB THR A 65 -27.101 23.848 -52.562 1.00 0.00 H new ATOM 0 HG1 THR A 65 -29.102 22.645 -52.464 1.00 0.00 H new ATOM 0 HG21 THR A 65 -27.056 21.381 -52.444 1.00 0.00 H new ATOM 0 HG22 THR A 65 -25.693 22.094 -51.549 1.00 0.00 H new ATOM 0 HG23 THR A 65 -27.105 21.465 -50.667 1.00 0.00 H new ATOM 920 N ILE A 66 -29.265 24.789 -49.786 1.00 0.00 N ATOM 921 CA ILE A 66 -30.440 25.675 -49.544 1.00 0.00 C ATOM 922 C ILE A 66 -30.745 26.499 -50.803 1.00 0.00 C ATOM 923 O ILE A 66 -29.992 26.502 -51.756 1.00 0.00 O ATOM 924 CB ILE A 66 -30.135 26.574 -48.305 1.00 0.00 C ATOM 925 CG1 ILE A 66 -30.448 28.048 -48.624 1.00 0.00 C ATOM 926 CG2 ILE A 66 -28.681 26.462 -47.857 1.00 0.00 C ATOM 927 CD1 ILE A 66 -29.928 28.957 -47.507 1.00 0.00 C ATOM 0 H ILE A 66 -29.435 23.805 -49.577 1.00 0.00 H new ATOM 0 HA ILE A 66 -31.332 25.086 -49.330 1.00 0.00 H new ATOM 0 HB ILE A 66 -30.771 26.221 -47.493 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -29.989 28.327 -49.572 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -31.524 28.181 -48.739 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -28.516 27.105 -46.992 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -28.462 25.429 -47.588 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -28.025 26.772 -48.670 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -30.157 29.995 -47.747 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -30.408 28.688 -46.566 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -28.849 28.836 -47.412 1.00 0.00 H new ATOM 939 N SER A 67 -31.858 27.183 -50.811 1.00 0.00 N ATOM 940 CA SER A 67 -32.236 27.993 -52.006 1.00 0.00 C ATOM 941 C SER A 67 -31.297 29.189 -52.188 1.00 0.00 C ATOM 942 O SER A 67 -31.427 30.202 -51.531 1.00 0.00 O ATOM 943 CB SER A 67 -33.660 28.472 -51.728 1.00 0.00 C ATOM 944 OG SER A 67 -34.479 28.184 -52.854 1.00 0.00 O ATOM 0 H SER A 67 -32.524 27.216 -50.039 1.00 0.00 H new ATOM 0 HA SER A 67 -32.166 27.408 -52.923 1.00 0.00 H new ATOM 0 HB2 SER A 67 -34.055 27.979 -50.840 1.00 0.00 H new ATOM 0 HB3 SER A 67 -33.663 29.543 -51.526 1.00 0.00 H new ATOM 0 HG SER A 67 -35.394 28.488 -52.679 1.00 0.00 H new ATOM 950 N ASN A 68 -30.369 29.081 -53.097 1.00 0.00 N ATOM 951 CA ASN A 68 -29.427 30.210 -53.360 1.00 0.00 C ATOM 952 C ASN A 68 -28.944 30.859 -52.059 1.00 0.00 C ATOM 953 O ASN A 68 -29.014 32.061 -51.897 1.00 0.00 O ATOM 954 CB ASN A 68 -30.248 31.210 -54.174 1.00 0.00 C ATOM 955 CG ASN A 68 -30.498 30.645 -55.574 1.00 0.00 C ATOM 956 OD1 ASN A 68 -30.067 29.553 -55.886 1.00 0.00 O ATOM 957 ND2 ASN A 68 -31.182 31.346 -56.436 1.00 0.00 N ATOM 0 H ASN A 68 -30.220 28.254 -53.675 1.00 0.00 H new ATOM 0 HA ASN A 68 -28.530 29.871 -53.878 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -31.197 31.409 -53.676 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -29.719 32.160 -54.243 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -31.355 30.977 -57.371 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -31.544 32.263 -56.175 1.00 0.00 H new ATOM 964 N GLY A 69 -28.444 30.086 -51.135 1.00 0.00 N ATOM 965 CA GLY A 69 -27.951 30.689 -49.861 1.00 0.00 C ATOM 966 C GLY A 69 -26.576 30.115 -49.522 1.00 0.00 C ATOM 967 O GLY A 69 -25.702 30.803 -49.037 1.00 0.00 O ATOM 0 H GLY A 69 -28.355 29.072 -51.204 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -27.890 31.773 -49.959 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -28.652 30.481 -49.053 1.00 0.00 H new ATOM 971 N TYR A 70 -26.401 28.851 -49.773 1.00 0.00 N ATOM 972 CA TYR A 70 -25.108 28.160 -49.480 1.00 0.00 C ATOM 973 C TYR A 70 -24.471 28.636 -48.188 1.00 0.00 C ATOM 974 O TYR A 70 -25.042 29.360 -47.397 1.00 0.00 O ATOM 975 CB TYR A 70 -24.181 28.405 -50.681 1.00 0.00 C ATOM 976 CG TYR A 70 -23.308 29.628 -50.488 1.00 0.00 C ATOM 977 CD1 TYR A 70 -23.821 30.903 -50.745 1.00 0.00 C ATOM 978 CD2 TYR A 70 -21.977 29.481 -50.076 1.00 0.00 C ATOM 979 CE1 TYR A 70 -23.008 32.032 -50.590 1.00 0.00 C ATOM 980 CE2 TYR A 70 -21.164 30.610 -49.918 1.00 0.00 C ATOM 981 CZ TYR A 70 -21.680 31.885 -50.176 1.00 0.00 C ATOM 982 OH TYR A 70 -20.879 32.998 -50.023 1.00 0.00 O ATOM 0 H TYR A 70 -27.116 28.248 -50.180 1.00 0.00 H new ATOM 0 HA TYR A 70 -25.288 27.095 -49.337 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -23.549 27.530 -50.835 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -24.781 28.527 -51.583 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -24.847 31.017 -51.064 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -21.578 28.497 -49.880 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -23.406 33.016 -50.790 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -20.139 30.497 -49.597 1.00 0.00 H new ATOM 0 HH TYR A 70 -19.986 32.721 -49.729 1.00 0.00 H new ATOM 992 N LEU A 71 -23.281 28.196 -47.982 1.00 0.00 N ATOM 993 CA LEU A 71 -22.544 28.562 -46.743 1.00 0.00 C ATOM 994 C LEU A 71 -21.072 28.860 -47.055 1.00 0.00 C ATOM 995 O LEU A 71 -20.548 28.473 -48.079 1.00 0.00 O ATOM 996 CB LEU A 71 -22.714 27.358 -45.780 1.00 0.00 C ATOM 997 CG LEU A 71 -22.377 26.001 -46.431 1.00 0.00 C ATOM 998 CD1 LEU A 71 -23.601 25.450 -47.150 1.00 0.00 C ATOM 999 CD2 LEU A 71 -21.220 26.118 -47.420 1.00 0.00 C ATOM 0 H LEU A 71 -22.770 27.588 -48.623 1.00 0.00 H new ATOM 0 HA LEU A 71 -22.934 29.472 -46.286 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -22.073 27.505 -44.910 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -23.742 27.334 -45.418 1.00 0.00 H new ATOM 0 HG LEU A 71 -22.075 25.322 -45.634 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -23.354 24.492 -47.607 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -24.412 25.313 -46.435 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -23.914 26.151 -47.924 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -21.014 25.141 -47.856 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -21.487 26.819 -48.211 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -20.332 26.478 -46.900 1.00 0.00 H new ATOM 1011 N SER A 72 -20.403 29.566 -46.191 1.00 0.00 N ATOM 1012 CA SER A 72 -18.977 29.893 -46.462 1.00 0.00 C ATOM 1013 C SER A 72 -18.141 29.702 -45.192 1.00 0.00 C ATOM 1014 O SER A 72 -17.132 30.351 -44.998 1.00 0.00 O ATOM 1015 CB SER A 72 -18.982 31.362 -46.879 1.00 0.00 C ATOM 1016 OG SER A 72 -18.011 31.563 -47.897 1.00 0.00 O ATOM 0 H SER A 72 -20.778 29.929 -45.314 1.00 0.00 H new ATOM 0 HA SER A 72 -18.544 29.251 -47.229 1.00 0.00 H new ATOM 0 HB2 SER A 72 -19.970 31.646 -47.241 1.00 0.00 H new ATOM 0 HB3 SER A 72 -18.763 31.997 -46.020 1.00 0.00 H new ATOM 0 HG SER A 72 -18.012 32.505 -48.169 1.00 0.00 H new ATOM 1022 N SER A 73 -18.561 28.827 -44.318 1.00 0.00 N ATOM 1023 CA SER A 73 -17.796 28.612 -43.055 1.00 0.00 C ATOM 1024 C SER A 73 -16.986 27.314 -43.115 1.00 0.00 C ATOM 1025 O SER A 73 -15.790 27.328 -43.331 1.00 0.00 O ATOM 1026 CB SER A 73 -18.860 28.526 -41.961 1.00 0.00 C ATOM 1027 OG SER A 73 -18.645 29.565 -41.014 1.00 0.00 O ATOM 0 H SER A 73 -19.398 28.253 -44.423 1.00 0.00 H new ATOM 0 HA SER A 73 -17.079 29.413 -42.876 1.00 0.00 H new ATOM 0 HB2 SER A 73 -19.855 28.616 -42.397 1.00 0.00 H new ATOM 0 HB3 SER A 73 -18.814 27.554 -41.469 1.00 0.00 H new ATOM 0 HG SER A 73 -19.096 29.340 -40.173 1.00 0.00 H new ATOM 1033 N GLY A 74 -17.624 26.194 -42.913 1.00 0.00 N ATOM 1034 CA GLY A 74 -16.886 24.900 -42.944 1.00 0.00 C ATOM 1035 C GLY A 74 -17.674 23.868 -43.749 1.00 0.00 C ATOM 1036 O GLY A 74 -18.379 23.043 -43.203 1.00 0.00 O ATOM 0 H GLY A 74 -18.624 26.119 -42.728 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -15.901 25.044 -43.388 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -16.728 24.538 -41.928 1.00 0.00 H new ATOM 1040 N PHE A 75 -17.551 23.907 -45.043 1.00 0.00 N ATOM 1041 CA PHE A 75 -18.283 22.927 -45.897 1.00 0.00 C ATOM 1042 C PHE A 75 -17.296 21.923 -46.504 1.00 0.00 C ATOM 1043 O PHE A 75 -16.095 22.085 -46.416 1.00 0.00 O ATOM 1044 CB PHE A 75 -18.950 23.780 -46.983 1.00 0.00 C ATOM 1045 CG PHE A 75 -19.163 22.967 -48.244 1.00 0.00 C ATOM 1046 CD1 PHE A 75 -18.080 22.677 -49.084 1.00 0.00 C ATOM 1047 CD2 PHE A 75 -20.444 22.505 -48.572 1.00 0.00 C ATOM 1048 CE1 PHE A 75 -18.277 21.924 -50.248 1.00 0.00 C ATOM 1049 CE2 PHE A 75 -20.640 21.753 -49.737 1.00 0.00 C ATOM 1050 CZ PHE A 75 -19.557 21.462 -50.575 1.00 0.00 C ATOM 0 H PHE A 75 -16.974 24.577 -45.551 1.00 0.00 H new ATOM 0 HA PHE A 75 -19.015 22.342 -45.340 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -19.907 24.157 -46.621 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -18.329 24.648 -47.204 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -17.092 23.035 -48.834 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -21.280 22.729 -47.927 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -17.441 21.700 -50.894 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -21.628 21.397 -49.989 1.00 0.00 H new ATOM 0 HZ PHE A 75 -19.709 20.882 -51.473 1.00 0.00 H new ATOM 1060 N LYS A 76 -17.798 20.891 -47.124 1.00 0.00 N ATOM 1061 CA LYS A 76 -16.897 19.879 -47.743 1.00 0.00 C ATOM 1062 C LYS A 76 -17.714 18.898 -48.586 1.00 0.00 C ATOM 1063 O LYS A 76 -18.926 18.892 -48.546 1.00 0.00 O ATOM 1064 CB LYS A 76 -16.239 19.158 -46.569 1.00 0.00 C ATOM 1065 CG LYS A 76 -15.318 18.063 -47.105 1.00 0.00 C ATOM 1066 CD LYS A 76 -14.419 17.551 -45.981 1.00 0.00 C ATOM 1067 CE LYS A 76 -12.996 18.076 -46.190 1.00 0.00 C ATOM 1068 NZ LYS A 76 -12.186 17.452 -45.105 1.00 0.00 N ATOM 0 H LYS A 76 -18.795 20.705 -47.229 1.00 0.00 H new ATOM 0 HA LYS A 76 -16.158 20.332 -48.404 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -15.670 19.865 -45.965 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -17.000 18.725 -45.920 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -15.910 17.243 -47.512 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -14.710 18.453 -47.921 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -14.802 17.881 -45.015 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -14.418 16.461 -45.969 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -12.615 17.801 -47.174 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -12.965 19.164 -46.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -11.198 17.766 -45.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -12.566 17.737 -44.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -12.228 16.417 -45.192 1.00 0.00 H new ATOM 1082 N ARG A 77 -17.064 18.069 -49.354 1.00 0.00 N ATOM 1083 CA ARG A 77 -17.815 17.098 -50.199 1.00 0.00 C ATOM 1084 C ARG A 77 -18.659 16.165 -49.324 1.00 0.00 C ATOM 1085 O ARG A 77 -19.762 15.799 -49.675 1.00 0.00 O ATOM 1086 CB ARG A 77 -16.740 16.307 -50.945 1.00 0.00 C ATOM 1087 CG ARG A 77 -16.417 17.002 -52.270 1.00 0.00 C ATOM 1088 CD ARG A 77 -15.490 16.113 -53.102 1.00 0.00 C ATOM 1089 NE ARG A 77 -14.216 16.056 -52.332 1.00 0.00 N ATOM 1090 CZ ARG A 77 -13.666 14.904 -52.064 1.00 0.00 C ATOM 1091 NH1 ARG A 77 -13.265 14.131 -53.036 1.00 0.00 N ATOM 1092 NH2 ARG A 77 -13.515 14.527 -50.823 1.00 0.00 N ATOM 0 H ARG A 77 -16.048 18.021 -49.433 1.00 0.00 H new ATOM 0 HA ARG A 77 -18.504 17.596 -50.881 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -15.841 16.231 -50.334 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -17.086 15.290 -51.131 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -17.336 17.203 -52.821 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -15.942 17.965 -52.081 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -15.914 15.118 -53.237 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -15.332 16.530 -54.097 1.00 0.00 H new ATOM 0 HE ARG A 77 -13.774 16.918 -52.014 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -13.382 14.428 -54.005 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -12.835 13.230 -52.827 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -13.827 15.133 -50.064 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -13.085 13.626 -50.612 1.00 0.00 H new ATOM 1106 N SER A 78 -18.147 15.779 -48.189 1.00 0.00 N ATOM 1107 CA SER A 78 -18.919 14.869 -47.293 1.00 0.00 C ATOM 1108 C SER A 78 -18.863 15.373 -45.846 1.00 0.00 C ATOM 1109 O SER A 78 -17.984 16.125 -45.474 1.00 0.00 O ATOM 1110 CB SER A 78 -18.227 13.513 -47.414 1.00 0.00 C ATOM 1111 OG SER A 78 -18.507 12.953 -48.690 1.00 0.00 O ATOM 0 H SER A 78 -17.228 16.053 -47.842 1.00 0.00 H new ATOM 0 HA SER A 78 -19.972 14.816 -47.569 1.00 0.00 H new ATOM 0 HB2 SER A 78 -17.151 13.628 -47.283 1.00 0.00 H new ATOM 0 HB3 SER A 78 -18.574 12.844 -46.627 1.00 0.00 H new ATOM 0 HG SER A 78 -18.062 12.083 -48.770 1.00 0.00 H new ATOM 1117 N TYR A 79 -19.796 14.961 -45.028 1.00 0.00 N ATOM 1118 CA TYR A 79 -19.797 15.414 -43.604 1.00 0.00 C ATOM 1119 C TYR A 79 -20.029 14.216 -42.670 1.00 0.00 C ATOM 1120 O TYR A 79 -19.597 13.114 -42.948 1.00 0.00 O ATOM 1121 CB TYR A 79 -20.951 16.416 -43.502 1.00 0.00 C ATOM 1122 CG TYR A 79 -20.943 17.341 -44.703 1.00 0.00 C ATOM 1123 CD1 TYR A 79 -21.388 16.888 -45.957 1.00 0.00 C ATOM 1124 CD2 TYR A 79 -20.487 18.658 -44.562 1.00 0.00 C ATOM 1125 CE1 TYR A 79 -21.375 17.753 -47.055 1.00 0.00 C ATOM 1126 CE2 TYR A 79 -20.477 19.519 -45.662 1.00 0.00 C ATOM 1127 CZ TYR A 79 -20.919 19.069 -46.907 1.00 0.00 C ATOM 1128 OH TYR A 79 -20.910 19.924 -47.986 1.00 0.00 O ATOM 0 H TYR A 79 -20.557 14.331 -45.283 1.00 0.00 H new ATOM 0 HA TYR A 79 -18.848 15.864 -43.312 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -21.901 15.885 -43.448 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -20.859 16.997 -42.585 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -21.739 15.873 -46.072 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -20.142 19.009 -43.600 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -21.717 17.406 -48.019 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -20.127 20.534 -45.549 1.00 0.00 H new ATOM 0 HH TYR A 79 -20.686 20.829 -47.684 1.00 0.00 H new ATOM 1138 N SER A 80 -20.700 14.416 -41.563 1.00 0.00 N ATOM 1139 CA SER A 80 -20.940 13.274 -40.628 1.00 0.00 C ATOM 1140 C SER A 80 -22.123 13.574 -39.683 1.00 0.00 C ATOM 1141 O SER A 80 -23.197 13.920 -40.116 1.00 0.00 O ATOM 1142 CB SER A 80 -19.637 13.137 -39.840 1.00 0.00 C ATOM 1143 OG SER A 80 -19.608 14.113 -38.807 1.00 0.00 O ATOM 0 H SER A 80 -21.089 15.312 -41.268 1.00 0.00 H new ATOM 0 HA SER A 80 -21.200 12.358 -41.158 1.00 0.00 H new ATOM 0 HB2 SER A 80 -19.560 12.137 -39.413 1.00 0.00 H new ATOM 0 HB3 SER A 80 -18.782 13.267 -40.503 1.00 0.00 H new ATOM 0 HG SER A 80 -18.775 14.027 -38.299 1.00 0.00 H new ATOM 1149 N TYR A 81 -21.946 13.423 -38.394 1.00 0.00 N ATOM 1150 CA TYR A 81 -23.071 13.688 -37.448 1.00 0.00 C ATOM 1151 C TYR A 81 -23.011 15.138 -36.926 1.00 0.00 C ATOM 1152 O TYR A 81 -23.669 15.486 -35.965 1.00 0.00 O ATOM 1153 CB TYR A 81 -22.856 12.651 -36.328 1.00 0.00 C ATOM 1154 CG TYR A 81 -22.856 13.299 -34.959 1.00 0.00 C ATOM 1155 CD1 TYR A 81 -21.801 14.140 -34.587 1.00 0.00 C ATOM 1156 CD2 TYR A 81 -23.909 13.058 -34.068 1.00 0.00 C ATOM 1157 CE1 TYR A 81 -21.798 14.741 -33.324 1.00 0.00 C ATOM 1158 CE2 TYR A 81 -23.906 13.660 -32.804 1.00 0.00 C ATOM 1159 CZ TYR A 81 -22.850 14.502 -32.432 1.00 0.00 C ATOM 1160 OH TYR A 81 -22.845 15.095 -31.186 1.00 0.00 O ATOM 0 H TYR A 81 -21.073 13.128 -37.957 1.00 0.00 H new ATOM 0 HA TYR A 81 -24.056 13.593 -37.905 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -23.642 11.897 -36.374 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -21.909 12.135 -36.487 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -20.989 14.325 -35.275 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -24.723 12.408 -34.356 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -20.984 15.390 -33.037 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -24.718 13.475 -32.116 1.00 0.00 H new ATOM 0 HH TYR A 81 -23.648 14.826 -30.692 1.00 0.00 H new ATOM 1170 N ASN A 82 -22.234 15.987 -37.547 1.00 0.00 N ATOM 1171 CA ASN A 82 -22.149 17.398 -37.068 1.00 0.00 C ATOM 1172 C ASN A 82 -21.595 18.310 -38.166 1.00 0.00 C ATOM 1173 O ASN A 82 -22.297 18.665 -39.092 1.00 0.00 O ATOM 1174 CB ASN A 82 -21.205 17.344 -35.866 1.00 0.00 C ATOM 1175 CG ASN A 82 -21.083 18.737 -35.246 1.00 0.00 C ATOM 1176 OD1 ASN A 82 -22.067 19.325 -34.843 1.00 0.00 O ATOM 1177 ND2 ASN A 82 -19.906 19.294 -35.151 1.00 0.00 N ATOM 0 H ASN A 82 -21.658 15.766 -38.360 1.00 0.00 H new ATOM 0 HA ASN A 82 -23.124 17.805 -36.801 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -21.582 16.638 -35.126 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -20.224 16.986 -36.177 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -19.813 20.222 -34.739 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -19.080 18.801 -35.489 1.00 0.00 H new ATOM 1184 N ASP A 83 -20.354 18.712 -38.072 1.00 0.00 N ATOM 1185 CA ASP A 83 -19.799 19.618 -39.115 1.00 0.00 C ATOM 1186 C ASP A 83 -20.811 20.728 -39.392 1.00 0.00 C ATOM 1187 O ASP A 83 -21.559 20.676 -40.348 1.00 0.00 O ATOM 1188 CB ASP A 83 -19.598 18.738 -40.349 1.00 0.00 C ATOM 1189 CG ASP A 83 -18.201 18.115 -40.308 1.00 0.00 C ATOM 1190 OD1 ASP A 83 -18.007 17.194 -39.532 1.00 0.00 O ATOM 1191 OD2 ASP A 83 -17.348 18.570 -41.052 1.00 0.00 O ATOM 0 H ASP A 83 -19.708 18.454 -37.326 1.00 0.00 H new ATOM 0 HA ASP A 83 -18.863 20.091 -38.817 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -20.356 17.956 -40.378 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -19.717 19.331 -41.256 1.00 0.00 H new ATOM 1196 N ASN A 84 -20.858 21.719 -38.545 1.00 0.00 N ATOM 1197 CA ASN A 84 -21.842 22.817 -38.743 1.00 0.00 C ATOM 1198 C ASN A 84 -21.477 23.662 -39.967 1.00 0.00 C ATOM 1199 O ASN A 84 -20.322 23.802 -40.317 1.00 0.00 O ATOM 1200 CB ASN A 84 -21.768 23.655 -37.466 1.00 0.00 C ATOM 1201 CG ASN A 84 -20.385 24.298 -37.350 1.00 0.00 C ATOM 1202 OD1 ASN A 84 -19.407 23.755 -37.825 1.00 0.00 O ATOM 1203 ND2 ASN A 84 -20.262 25.442 -36.735 1.00 0.00 N ATOM 0 H ASN A 84 -20.258 21.815 -37.726 1.00 0.00 H new ATOM 0 HA ASN A 84 -22.847 22.434 -38.922 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -22.538 24.426 -37.481 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -21.962 23.027 -36.596 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -19.345 25.881 -36.653 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -21.083 25.898 -36.336 1.00 0.00 H new ATOM 1210 N VAL A 85 -22.458 24.231 -40.614 1.00 0.00 N ATOM 1211 CA VAL A 85 -22.179 25.075 -41.809 1.00 0.00 C ATOM 1212 C VAL A 85 -22.967 26.385 -41.722 1.00 0.00 C ATOM 1213 O VAL A 85 -24.182 26.390 -41.702 1.00 0.00 O ATOM 1214 CB VAL A 85 -22.640 24.257 -43.013 1.00 0.00 C ATOM 1215 CG1 VAL A 85 -21.714 23.053 -43.197 1.00 0.00 C ATOM 1216 CG2 VAL A 85 -24.073 23.766 -42.797 1.00 0.00 C ATOM 0 H VAL A 85 -23.443 24.147 -40.365 1.00 0.00 H new ATOM 0 HA VAL A 85 -21.123 25.335 -41.883 1.00 0.00 H new ATOM 0 HB VAL A 85 -22.608 24.886 -43.903 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -22.043 22.469 -44.056 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -20.694 23.400 -43.363 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -21.744 22.431 -42.303 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -24.392 23.184 -43.661 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -24.113 23.142 -41.904 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -24.736 24.622 -42.671 1.00 0.00 H new ATOM 1226 N ASP A 86 -22.287 27.495 -41.685 1.00 0.00 N ATOM 1227 CA ASP A 86 -23.003 28.805 -41.617 1.00 0.00 C ATOM 1228 C ASP A 86 -23.424 29.204 -43.029 1.00 0.00 C ATOM 1229 O ASP A 86 -22.628 29.197 -43.945 1.00 0.00 O ATOM 1230 CB ASP A 86 -21.989 29.797 -41.050 1.00 0.00 C ATOM 1231 CG ASP A 86 -22.725 30.888 -40.269 1.00 0.00 C ATOM 1232 OD1 ASP A 86 -23.808 30.611 -39.780 1.00 0.00 O ATOM 1233 OD2 ASP A 86 -22.193 31.982 -40.174 1.00 0.00 O ATOM 0 H ASP A 86 -21.269 27.556 -41.699 1.00 0.00 H new ATOM 0 HA ASP A 86 -23.899 28.770 -40.998 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -21.284 29.281 -40.398 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -21.408 30.242 -41.858 1.00 0.00 H new ATOM 1238 N PHE A 87 -24.671 29.509 -43.228 1.00 0.00 N ATOM 1239 CA PHE A 87 -25.127 29.846 -44.603 1.00 0.00 C ATOM 1240 C PHE A 87 -24.891 31.305 -44.977 1.00 0.00 C ATOM 1241 O PHE A 87 -25.127 32.219 -44.212 1.00 0.00 O ATOM 1242 CB PHE A 87 -26.605 29.487 -44.612 1.00 0.00 C ATOM 1243 CG PHE A 87 -26.674 27.995 -44.733 1.00 0.00 C ATOM 1244 CD1 PHE A 87 -26.561 27.401 -45.990 1.00 0.00 C ATOM 1245 CD2 PHE A 87 -26.793 27.202 -43.589 1.00 0.00 C ATOM 1246 CE1 PHE A 87 -26.566 26.015 -46.108 1.00 0.00 C ATOM 1247 CE2 PHE A 87 -26.809 25.811 -43.709 1.00 0.00 C ATOM 1248 CZ PHE A 87 -26.692 25.221 -44.972 1.00 0.00 C ATOM 0 H PHE A 87 -25.391 29.540 -42.506 1.00 0.00 H new ATOM 0 HA PHE A 87 -24.559 29.295 -45.353 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -27.093 29.826 -43.698 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -27.117 29.969 -45.445 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -26.470 28.017 -46.872 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -26.872 27.663 -42.616 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -26.472 25.555 -47.081 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -26.911 25.193 -42.830 1.00 0.00 H new ATOM 0 HZ PHE A 87 -26.699 24.145 -45.066 1.00 0.00 H new ATOM 1258 N LYS A 88 -24.423 31.503 -46.179 1.00 0.00 N ATOM 1259 CA LYS A 88 -24.146 32.870 -46.690 1.00 0.00 C ATOM 1260 C LYS A 88 -25.140 33.200 -47.804 1.00 0.00 C ATOM 1261 O LYS A 88 -24.864 32.992 -48.968 1.00 0.00 O ATOM 1262 CB LYS A 88 -22.734 32.775 -47.259 1.00 0.00 C ATOM 1263 CG LYS A 88 -21.916 33.993 -46.823 1.00 0.00 C ATOM 1264 CD LYS A 88 -21.199 33.687 -45.506 1.00 0.00 C ATOM 1265 CE LYS A 88 -21.510 34.787 -44.489 1.00 0.00 C ATOM 1266 NZ LYS A 88 -20.269 34.924 -43.677 1.00 0.00 N ATOM 0 H LYS A 88 -24.217 30.755 -46.841 1.00 0.00 H new ATOM 0 HA LYS A 88 -24.236 33.643 -45.926 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -22.253 31.860 -46.913 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -22.773 32.722 -48.347 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -21.189 34.250 -47.593 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -22.569 34.857 -46.701 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -21.520 32.719 -45.121 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -20.124 33.623 -45.671 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -21.762 35.724 -44.986 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -22.362 34.518 -43.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -20.405 35.661 -42.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -20.058 34.019 -43.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -19.476 35.187 -44.296 1.00 0.00 H new ATOM 1280 N CYS A 89 -26.296 33.689 -47.455 1.00 0.00 N ATOM 1281 CA CYS A 89 -27.321 34.013 -48.490 1.00 0.00 C ATOM 1282 C CYS A 89 -26.671 34.585 -49.753 1.00 0.00 C ATOM 1283 O CYS A 89 -25.866 35.494 -49.696 1.00 0.00 O ATOM 1284 CB CYS A 89 -28.225 35.053 -47.835 1.00 0.00 C ATOM 1285 SG CYS A 89 -29.950 34.616 -48.149 1.00 0.00 S ATOM 0 H CYS A 89 -26.578 33.880 -46.494 1.00 0.00 H new ATOM 0 HA CYS A 89 -27.870 33.126 -48.806 1.00 0.00 H new ATOM 0 HB2 CYS A 89 -28.036 35.093 -46.762 1.00 0.00 H new ATOM 0 HB3 CYS A 89 -28.009 36.044 -48.234 1.00 0.00 H new ATOM 1290 N LYS A 90 -27.017 34.051 -50.893 1.00 0.00 N ATOM 1291 CA LYS A 90 -26.426 34.550 -52.168 1.00 0.00 C ATOM 1292 C LYS A 90 -26.336 36.078 -52.161 1.00 0.00 C ATOM 1293 O LYS A 90 -25.334 36.648 -51.778 1.00 0.00 O ATOM 1294 CB LYS A 90 -27.389 34.084 -53.257 1.00 0.00 C ATOM 1295 CG LYS A 90 -26.837 32.826 -53.925 1.00 0.00 C ATOM 1296 CD LYS A 90 -26.564 33.115 -55.402 1.00 0.00 C ATOM 1297 CE LYS A 90 -25.186 32.572 -55.780 1.00 0.00 C ATOM 1298 NZ LYS A 90 -25.375 31.100 -55.894 1.00 0.00 N ATOM 0 H LYS A 90 -27.686 33.288 -50.997 1.00 0.00 H new ATOM 0 HA LYS A 90 -25.414 34.175 -52.321 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -28.369 33.879 -52.826 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -27.525 34.872 -53.998 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -25.919 32.510 -53.429 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -27.550 32.007 -53.829 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -27.332 32.653 -56.022 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -26.608 34.188 -55.588 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -24.836 33.000 -56.720 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -24.442 32.818 -55.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -24.707 30.614 -55.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -26.349 30.853 -55.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -25.202 30.803 -56.875 1.00 0.00 H new ATOM 1312 N TYR A 91 -27.372 36.746 -52.592 1.00 0.00 N ATOM 1313 CA TYR A 91 -27.337 38.238 -52.620 1.00 0.00 C ATOM 1314 C TYR A 91 -28.753 38.812 -52.490 1.00 0.00 C ATOM 1315 O TYR A 91 -29.710 38.252 -52.987 1.00 0.00 O ATOM 1316 CB TYR A 91 -26.741 38.585 -53.985 1.00 0.00 C ATOM 1317 CG TYR A 91 -26.050 39.926 -53.913 1.00 0.00 C ATOM 1318 CD1 TYR A 91 -26.805 41.104 -53.893 1.00 0.00 C ATOM 1319 CD2 TYR A 91 -24.653 39.989 -53.869 1.00 0.00 C ATOM 1320 CE1 TYR A 91 -26.162 42.347 -53.829 1.00 0.00 C ATOM 1321 CE2 TYR A 91 -24.010 41.230 -53.805 1.00 0.00 C ATOM 1322 CZ TYR A 91 -24.764 42.409 -53.785 1.00 0.00 C ATOM 1323 OH TYR A 91 -24.129 43.633 -53.722 1.00 0.00 O ATOM 0 H TYR A 91 -28.239 36.325 -52.925 1.00 0.00 H new ATOM 0 HA TYR A 91 -26.756 38.654 -51.797 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -26.031 37.815 -54.289 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -27.527 38.610 -54.740 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -27.883 41.055 -53.927 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -24.071 39.079 -53.884 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -26.744 43.257 -53.814 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -22.932 41.278 -53.771 1.00 0.00 H new ATOM 0 HH TYR A 91 -23.159 43.497 -53.697 1.00 0.00 H new ATOM 1333 N GLY A 92 -28.889 39.928 -51.825 1.00 0.00 N ATOM 1334 CA GLY A 92 -30.236 40.546 -51.661 1.00 0.00 C ATOM 1335 C GLY A 92 -31.243 39.478 -51.235 1.00 0.00 C ATOM 1336 O GLY A 92 -32.272 39.298 -51.855 1.00 0.00 O ATOM 0 H GLY A 92 -28.123 40.439 -51.387 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -30.195 41.339 -50.915 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -30.553 41.006 -52.597 1.00 0.00 H new ATOM 1340 N TYR A 93 -30.954 38.765 -50.182 1.00 0.00 N ATOM 1341 CA TYR A 93 -31.894 37.705 -49.720 1.00 0.00 C ATOM 1342 C TYR A 93 -31.771 37.510 -48.208 1.00 0.00 C ATOM 1343 O TYR A 93 -30.852 37.997 -47.581 1.00 0.00 O ATOM 1344 CB TYR A 93 -31.453 36.442 -50.456 1.00 0.00 C ATOM 1345 CG TYR A 93 -31.946 36.478 -51.883 1.00 0.00 C ATOM 1346 CD1 TYR A 93 -33.247 36.908 -52.167 1.00 0.00 C ATOM 1347 CD2 TYR A 93 -31.101 36.072 -52.922 1.00 0.00 C ATOM 1348 CE1 TYR A 93 -33.702 36.933 -53.490 1.00 0.00 C ATOM 1349 CE2 TYR A 93 -31.556 36.098 -54.245 1.00 0.00 C ATOM 1350 CZ TYR A 93 -32.857 36.527 -54.529 1.00 0.00 C ATOM 1351 OH TYR A 93 -33.306 36.550 -55.834 1.00 0.00 O ATOM 0 H TYR A 93 -30.108 38.870 -49.622 1.00 0.00 H new ATOM 0 HA TYR A 93 -32.934 37.958 -49.924 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -30.366 36.362 -50.440 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -31.845 35.560 -49.949 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -33.900 37.220 -51.365 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -30.097 35.739 -52.703 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -34.706 37.266 -53.709 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -30.903 35.787 -55.047 1.00 0.00 H new ATOM 0 HH TYR A 93 -32.594 36.238 -56.431 1.00 0.00 H new ATOM 1361 N LYS A 94 -32.691 36.796 -47.620 1.00 0.00 N ATOM 1362 CA LYS A 94 -32.631 36.561 -46.150 1.00 0.00 C ATOM 1363 C LYS A 94 -32.844 35.074 -45.853 1.00 0.00 C ATOM 1364 O LYS A 94 -33.915 34.538 -46.058 1.00 0.00 O ATOM 1365 CB LYS A 94 -33.771 37.397 -45.566 1.00 0.00 C ATOM 1366 CG LYS A 94 -33.697 37.366 -44.038 1.00 0.00 C ATOM 1367 CD LYS A 94 -34.784 38.269 -43.453 1.00 0.00 C ATOM 1368 CE LYS A 94 -35.991 37.419 -43.050 1.00 0.00 C ATOM 1369 NZ LYS A 94 -37.149 38.033 -43.758 1.00 0.00 N ATOM 0 H LYS A 94 -33.483 36.364 -48.095 1.00 0.00 H new ATOM 0 HA LYS A 94 -31.668 36.839 -45.722 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -33.702 38.425 -45.923 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -34.732 37.006 -45.902 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -33.826 36.345 -43.678 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -32.714 37.700 -43.705 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -34.398 38.806 -42.586 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -35.082 39.019 -44.186 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -35.856 36.378 -43.343 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -36.138 37.429 -41.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -38.015 37.504 -43.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -37.257 39.022 -43.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -36.984 38.003 -44.784 1.00 0.00 H new ATOM 1383 N LEU A 95 -31.831 34.403 -45.377 1.00 0.00 N ATOM 1384 CA LEU A 95 -31.976 32.949 -45.073 1.00 0.00 C ATOM 1385 C LEU A 95 -33.255 32.698 -44.271 1.00 0.00 C ATOM 1386 O LEU A 95 -33.354 33.052 -43.113 1.00 0.00 O ATOM 1387 CB LEU A 95 -30.746 32.590 -44.238 1.00 0.00 C ATOM 1388 CG LEU A 95 -29.500 32.601 -45.122 1.00 0.00 C ATOM 1389 CD1 LEU A 95 -28.301 33.095 -44.311 1.00 0.00 C ATOM 1390 CD2 LEU A 95 -29.223 31.184 -45.627 1.00 0.00 C ATOM 0 H LEU A 95 -30.910 34.797 -45.185 1.00 0.00 H new ATOM 0 HA LEU A 95 -32.045 32.347 -45.979 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -30.630 33.302 -43.421 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -30.875 31.606 -43.788 1.00 0.00 H new ATOM 0 HG LEU A 95 -29.663 33.266 -45.970 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -27.413 33.102 -44.943 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -28.497 34.104 -43.949 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -28.137 32.431 -43.462 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -28.334 31.190 -46.258 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -29.061 30.520 -44.778 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -30.076 30.831 -46.206 1.00 0.00 H new ATOM 1402 N SER A 96 -34.231 32.081 -44.879 1.00 0.00 N ATOM 1403 CA SER A 96 -35.501 31.797 -44.154 1.00 0.00 C ATOM 1404 C SER A 96 -35.420 30.425 -43.480 1.00 0.00 C ATOM 1405 O SER A 96 -35.611 29.403 -44.109 1.00 0.00 O ATOM 1406 CB SER A 96 -36.586 31.810 -45.235 1.00 0.00 C ATOM 1407 OG SER A 96 -37.286 30.573 -45.223 1.00 0.00 O ATOM 0 H SER A 96 -34.203 31.761 -45.847 1.00 0.00 H new ATOM 0 HA SER A 96 -35.707 32.525 -43.369 1.00 0.00 H new ATOM 0 HB2 SER A 96 -37.279 32.633 -45.059 1.00 0.00 H new ATOM 0 HB3 SER A 96 -36.136 31.975 -46.214 1.00 0.00 H new ATOM 0 HG SER A 96 -36.643 29.834 -45.194 1.00 0.00 H new ATOM 1413 N GLY A 97 -35.134 30.390 -42.207 1.00 0.00 N ATOM 1414 CA GLY A 97 -35.042 29.079 -41.506 1.00 0.00 C ATOM 1415 C GLY A 97 -33.888 29.099 -40.502 1.00 0.00 C ATOM 1416 O GLY A 97 -34.092 29.208 -39.309 1.00 0.00 O ATOM 0 H GLY A 97 -34.961 31.209 -41.625 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -35.979 28.867 -40.991 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -34.889 28.280 -42.231 1.00 0.00 H new ATOM 1420 N SER A 98 -32.679 28.982 -40.976 1.00 0.00 N ATOM 1421 CA SER A 98 -31.510 28.980 -40.047 1.00 0.00 C ATOM 1422 C SER A 98 -30.209 29.246 -40.816 1.00 0.00 C ATOM 1423 O SER A 98 -29.816 28.479 -41.672 1.00 0.00 O ATOM 1424 CB SER A 98 -31.503 27.578 -39.449 1.00 0.00 C ATOM 1425 OG SER A 98 -32.241 27.583 -38.234 1.00 0.00 O ATOM 0 H SER A 98 -32.448 28.888 -41.965 1.00 0.00 H new ATOM 0 HA SER A 98 -31.582 29.756 -39.285 1.00 0.00 H new ATOM 0 HB2 SER A 98 -31.941 26.868 -40.151 1.00 0.00 H new ATOM 0 HB3 SER A 98 -30.479 27.254 -39.265 1.00 0.00 H new ATOM 0 HG SER A 98 -33.077 28.078 -38.361 1.00 0.00 H new ATOM 1431 N SER A 99 -29.539 30.327 -40.514 1.00 0.00 N ATOM 1432 CA SER A 99 -28.264 30.648 -41.227 1.00 0.00 C ATOM 1433 C SER A 99 -27.113 29.779 -40.710 1.00 0.00 C ATOM 1434 O SER A 99 -25.972 29.962 -41.086 1.00 0.00 O ATOM 1435 CB SER A 99 -28.002 32.121 -40.918 1.00 0.00 C ATOM 1436 OG SER A 99 -27.344 32.227 -39.663 1.00 0.00 O ATOM 0 H SER A 99 -29.819 31.003 -39.804 1.00 0.00 H new ATOM 0 HA SER A 99 -28.338 30.456 -42.297 1.00 0.00 H new ATOM 0 HB2 SER A 99 -27.389 32.566 -41.702 1.00 0.00 H new ATOM 0 HB3 SER A 99 -28.942 32.673 -40.897 1.00 0.00 H new ATOM 0 HG SER A 99 -27.173 33.171 -39.462 1.00 0.00 H new ATOM 1442 N SER A 100 -27.398 28.835 -39.859 1.00 0.00 N ATOM 1443 CA SER A 100 -26.317 27.955 -39.332 1.00 0.00 C ATOM 1444 C SER A 100 -26.873 26.554 -39.068 1.00 0.00 C ATOM 1445 O SER A 100 -27.699 26.359 -38.199 1.00 0.00 O ATOM 1446 CB SER A 100 -25.868 28.610 -38.027 1.00 0.00 C ATOM 1447 OG SER A 100 -26.878 28.435 -37.043 1.00 0.00 O ATOM 0 H SER A 100 -28.333 28.634 -39.505 1.00 0.00 H new ATOM 0 HA SER A 100 -25.489 27.847 -40.033 1.00 0.00 H new ATOM 0 HB2 SER A 100 -24.932 28.167 -37.687 1.00 0.00 H new ATOM 0 HB3 SER A 100 -25.679 29.672 -38.186 1.00 0.00 H new ATOM 0 HG SER A 100 -27.265 27.539 -37.127 1.00 0.00 H new ATOM 1453 N SER A 101 -26.433 25.579 -39.814 1.00 0.00 N ATOM 1454 CA SER A 101 -26.949 24.192 -39.606 1.00 0.00 C ATOM 1455 C SER A 101 -25.799 23.206 -39.446 1.00 0.00 C ATOM 1456 O SER A 101 -24.654 23.522 -39.690 1.00 0.00 O ATOM 1457 CB SER A 101 -27.747 23.869 -40.868 1.00 0.00 C ATOM 1458 OG SER A 101 -28.649 24.933 -41.140 1.00 0.00 O ATOM 0 H SER A 101 -25.741 25.679 -40.557 1.00 0.00 H new ATOM 0 HA SER A 101 -27.555 24.119 -38.703 1.00 0.00 H new ATOM 0 HB2 SER A 101 -27.072 23.725 -41.712 1.00 0.00 H new ATOM 0 HB3 SER A 101 -28.296 22.937 -40.736 1.00 0.00 H new ATOM 0 HG SER A 101 -28.316 25.459 -41.897 1.00 0.00 H new ATOM 1464 N THR A 102 -26.102 22.007 -39.039 1.00 0.00 N ATOM 1465 CA THR A 102 -25.034 20.994 -38.864 1.00 0.00 C ATOM 1466 C THR A 102 -25.476 19.650 -39.432 1.00 0.00 C ATOM 1467 O THR A 102 -26.639 19.296 -39.399 1.00 0.00 O ATOM 1468 CB THR A 102 -24.812 20.901 -37.357 1.00 0.00 C ATOM 1469 OG1 THR A 102 -25.094 22.158 -36.758 1.00 0.00 O ATOM 1470 CG2 THR A 102 -23.358 20.522 -37.093 1.00 0.00 C ATOM 0 H THR A 102 -27.045 21.687 -38.820 1.00 0.00 H new ATOM 0 HA THR A 102 -24.119 21.268 -39.390 1.00 0.00 H new ATOM 0 HB THR A 102 -25.472 20.145 -36.931 1.00 0.00 H new ATOM 0 HG1 THR A 102 -24.953 22.098 -35.790 1.00 0.00 H new ATOM 0 HG21 THR A 102 -23.189 20.453 -36.018 1.00 0.00 H new ATOM 0 HG22 THR A 102 -23.143 19.559 -37.557 1.00 0.00 H new ATOM 0 HG23 THR A 102 -22.701 21.283 -37.515 1.00 0.00 H new ATOM 1478 N CYS A 103 -24.551 18.904 -39.961 1.00 0.00 N ATOM 1479 CA CYS A 103 -24.897 17.583 -40.544 1.00 0.00 C ATOM 1480 C CYS A 103 -25.124 16.554 -39.437 1.00 0.00 C ATOM 1481 O CYS A 103 -24.234 15.813 -39.072 1.00 0.00 O ATOM 1482 CB CYS A 103 -23.684 17.201 -41.382 1.00 0.00 C ATOM 1483 SG CYS A 103 -23.952 15.562 -42.081 1.00 0.00 S ATOM 0 H CYS A 103 -23.564 19.155 -40.015 1.00 0.00 H new ATOM 0 HA CYS A 103 -25.813 17.619 -41.133 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -23.531 17.930 -42.178 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -22.784 17.206 -40.767 1.00 0.00 H new ATOM 1488 N SER A 104 -26.309 16.501 -38.902 1.00 0.00 N ATOM 1489 CA SER A 104 -26.594 15.518 -37.819 1.00 0.00 C ATOM 1490 C SER A 104 -26.502 14.093 -38.360 1.00 0.00 C ATOM 1491 O SER A 104 -26.204 13.881 -39.518 1.00 0.00 O ATOM 1492 CB SER A 104 -28.019 15.830 -37.363 1.00 0.00 C ATOM 1493 OG SER A 104 -28.014 16.131 -35.974 1.00 0.00 O ATOM 0 H SER A 104 -27.094 17.096 -39.167 1.00 0.00 H new ATOM 0 HA SER A 104 -25.880 15.591 -36.998 1.00 0.00 H new ATOM 0 HB2 SER A 104 -28.417 16.673 -37.928 1.00 0.00 H new ATOM 0 HB3 SER A 104 -28.670 14.978 -37.560 1.00 0.00 H new ATOM 0 HG SER A 104 -28.927 16.333 -35.680 1.00 0.00 H new ATOM 1499 N PRO A 105 -26.754 13.162 -37.487 1.00 0.00 N ATOM 1500 CA PRO A 105 -26.692 11.736 -37.860 1.00 0.00 C ATOM 1501 C PRO A 105 -27.926 11.329 -38.660 1.00 0.00 C ATOM 1502 O PRO A 105 -29.048 11.609 -38.285 1.00 0.00 O ATOM 1503 CB PRO A 105 -26.640 11.017 -36.520 1.00 0.00 C ATOM 1504 CG PRO A 105 -27.274 11.956 -35.541 1.00 0.00 C ATOM 1505 CD PRO A 105 -27.118 13.354 -36.081 1.00 0.00 C ATOM 0 HA PRO A 105 -25.839 11.499 -38.496 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -27.178 10.070 -36.561 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -25.613 10.788 -36.236 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -28.328 11.713 -35.406 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -26.799 11.868 -34.564 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -28.043 13.923 -35.984 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -26.347 13.904 -35.542 1.00 0.00 H new ATOM 1513 N GLY A 106 -27.724 10.669 -39.764 1.00 0.00 N ATOM 1514 CA GLY A 106 -28.876 10.241 -40.595 1.00 0.00 C ATOM 1515 C GLY A 106 -28.735 10.831 -42.002 1.00 0.00 C ATOM 1516 O GLY A 106 -29.446 10.454 -42.912 1.00 0.00 O ATOM 0 H GLY A 106 -26.807 10.408 -40.126 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -28.917 9.153 -40.647 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -29.810 10.573 -40.141 1.00 0.00 H new ATOM 1520 N ASN A 107 -27.815 11.754 -42.173 1.00 0.00 N ATOM 1521 CA ASN A 107 -27.578 12.401 -43.509 1.00 0.00 C ATOM 1522 C ASN A 107 -28.567 13.537 -43.748 1.00 0.00 C ATOM 1523 O ASN A 107 -29.655 13.335 -44.249 1.00 0.00 O ATOM 1524 CB ASN A 107 -27.749 11.309 -44.572 1.00 0.00 C ATOM 1525 CG ASN A 107 -27.085 10.015 -44.099 1.00 0.00 C ATOM 1526 OD1 ASN A 107 -26.401 10.001 -43.095 1.00 0.00 O ATOM 1527 ND2 ASN A 107 -27.260 8.918 -44.784 1.00 0.00 N ATOM 0 H ASN A 107 -27.206 12.093 -41.428 1.00 0.00 H new ATOM 0 HA ASN A 107 -26.579 12.834 -43.551 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -28.808 11.136 -44.762 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -27.305 11.633 -45.513 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -26.823 8.049 -44.476 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -27.834 8.929 -45.627 1.00 0.00 H new ATOM 1534 N THR A 108 -28.187 14.737 -43.400 1.00 0.00 N ATOM 1535 CA THR A 108 -29.095 15.897 -43.615 1.00 0.00 C ATOM 1536 C THR A 108 -28.433 17.194 -43.155 1.00 0.00 C ATOM 1537 O THR A 108 -27.227 17.280 -43.032 1.00 0.00 O ATOM 1538 CB THR A 108 -30.334 15.609 -42.773 1.00 0.00 C ATOM 1539 OG1 THR A 108 -30.101 14.481 -41.938 1.00 0.00 O ATOM 1540 CG2 THR A 108 -31.503 15.329 -43.708 1.00 0.00 C ATOM 0 H THR A 108 -27.287 14.963 -42.976 1.00 0.00 H new ATOM 0 HA THR A 108 -29.339 16.022 -44.670 1.00 0.00 H new ATOM 0 HB THR A 108 -30.561 16.468 -42.142 1.00 0.00 H new ATOM 0 HG1 THR A 108 -30.900 14.302 -41.399 1.00 0.00 H new ATOM 0 HG21 THR A 108 -32.397 15.121 -43.120 1.00 0.00 H new ATOM 0 HG22 THR A 108 -31.679 16.199 -44.341 1.00 0.00 H new ATOM 0 HG23 THR A 108 -31.271 14.467 -44.333 1.00 0.00 H new ATOM 1548 N TRP A 109 -29.217 18.205 -42.906 1.00 0.00 N ATOM 1549 CA TRP A 109 -28.641 19.501 -42.461 1.00 0.00 C ATOM 1550 C TRP A 109 -29.618 20.234 -41.535 1.00 0.00 C ATOM 1551 O TRP A 109 -30.416 21.040 -41.971 1.00 0.00 O ATOM 1552 CB TRP A 109 -28.420 20.285 -43.750 1.00 0.00 C ATOM 1553 CG TRP A 109 -27.073 19.946 -44.300 1.00 0.00 C ATOM 1554 CD1 TRP A 109 -26.831 19.384 -45.513 1.00 0.00 C ATOM 1555 CD2 TRP A 109 -25.777 20.141 -43.672 1.00 0.00 C ATOM 1556 NE1 TRP A 109 -25.465 19.221 -45.658 1.00 0.00 N ATOM 1557 CE2 TRP A 109 -24.773 19.676 -44.550 1.00 0.00 C ATOM 1558 CE3 TRP A 109 -25.381 20.674 -42.432 1.00 0.00 C ATOM 1559 CZ2 TRP A 109 -23.421 19.738 -44.210 1.00 0.00 C ATOM 1560 CZ3 TRP A 109 -24.023 20.739 -42.087 1.00 0.00 C ATOM 1561 CH2 TRP A 109 -23.044 20.273 -42.972 1.00 0.00 C ATOM 0 H TRP A 109 -30.233 18.188 -42.992 1.00 0.00 H new ATOM 0 HA TRP A 109 -27.719 19.375 -41.894 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -29.195 20.042 -44.476 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -28.489 21.355 -43.556 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -27.580 19.110 -46.242 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -25.022 18.815 -46.482 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -26.128 21.036 -41.741 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -22.670 19.376 -44.897 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -23.731 21.151 -41.132 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -22.000 20.326 -42.701 1.00 0.00 H new ATOM 1572 N LYS A 110 -29.553 19.963 -40.258 1.00 0.00 N ATOM 1573 CA LYS A 110 -30.470 20.647 -39.297 1.00 0.00 C ATOM 1574 C LYS A 110 -29.768 21.870 -38.690 1.00 0.00 C ATOM 1575 O LYS A 110 -28.557 21.907 -38.629 1.00 0.00 O ATOM 1576 CB LYS A 110 -30.754 19.606 -38.214 1.00 0.00 C ATOM 1577 CG LYS A 110 -31.594 18.471 -38.802 1.00 0.00 C ATOM 1578 CD LYS A 110 -32.674 18.063 -37.798 1.00 0.00 C ATOM 1579 CE LYS A 110 -34.053 18.415 -38.359 1.00 0.00 C ATOM 1580 NZ LYS A 110 -34.913 17.244 -38.028 1.00 0.00 N ATOM 0 H LYS A 110 -28.904 19.297 -39.838 1.00 0.00 H new ATOM 0 HA LYS A 110 -31.385 21.001 -39.773 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -29.817 19.212 -37.819 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -31.282 20.069 -37.380 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -32.054 18.791 -39.737 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -30.958 17.617 -39.036 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -32.614 16.993 -37.598 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -32.515 18.574 -36.849 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -34.441 19.329 -37.909 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -34.011 18.582 -39.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -35.877 17.410 -38.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -34.523 16.390 -38.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -34.940 17.114 -36.997 1.00 0.00 H new ATOM 1594 N PRO A 111 -30.540 22.838 -38.255 1.00 0.00 N ATOM 1595 CA PRO A 111 -32.025 22.768 -38.343 1.00 0.00 C ATOM 1596 C PRO A 111 -32.483 22.923 -39.791 1.00 0.00 C ATOM 1597 O PRO A 111 -31.680 23.024 -40.696 1.00 0.00 O ATOM 1598 CB PRO A 111 -32.488 23.959 -37.506 1.00 0.00 C ATOM 1599 CG PRO A 111 -31.344 24.916 -37.540 1.00 0.00 C ATOM 1600 CD PRO A 111 -30.090 24.092 -37.639 1.00 0.00 C ATOM 0 HA PRO A 111 -32.428 21.818 -37.993 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -33.391 24.407 -37.921 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -32.722 23.658 -36.485 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -31.431 25.592 -38.391 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -31.330 25.534 -36.642 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -29.333 24.587 -38.248 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -29.647 23.919 -36.658 1.00 0.00 H new ATOM 1608 N GLU A 112 -33.769 22.931 -40.009 1.00 0.00 N ATOM 1609 CA GLU A 112 -34.298 23.073 -41.397 1.00 0.00 C ATOM 1610 C GLU A 112 -33.432 24.048 -42.196 1.00 0.00 C ATOM 1611 O GLU A 112 -33.404 25.231 -41.921 1.00 0.00 O ATOM 1612 CB GLU A 112 -35.711 23.630 -41.228 1.00 0.00 C ATOM 1613 CG GLU A 112 -36.666 22.898 -42.174 1.00 0.00 C ATOM 1614 CD GLU A 112 -37.790 23.845 -42.600 1.00 0.00 C ATOM 1615 OE1 GLU A 112 -38.051 24.789 -41.872 1.00 0.00 O ATOM 1616 OE2 GLU A 112 -38.369 23.611 -43.648 1.00 0.00 O ATOM 0 H GLU A 112 -34.480 22.845 -39.283 1.00 0.00 H new ATOM 0 HA GLU A 112 -34.294 22.127 -41.938 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -36.040 23.508 -40.196 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -35.720 24.699 -41.441 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -36.124 22.542 -43.050 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -37.083 22.021 -41.679 1.00 0.00 H new ATOM 1623 N LEU A 113 -32.720 23.554 -43.175 1.00 0.00 N ATOM 1624 CA LEU A 113 -31.845 24.442 -43.996 1.00 0.00 C ATOM 1625 C LEU A 113 -32.521 25.796 -44.224 1.00 0.00 C ATOM 1626 O LEU A 113 -33.719 25.868 -44.419 1.00 0.00 O ATOM 1627 CB LEU A 113 -31.672 23.703 -45.323 1.00 0.00 C ATOM 1628 CG LEU A 113 -30.201 23.740 -45.746 1.00 0.00 C ATOM 1629 CD1 LEU A 113 -29.339 23.100 -44.659 1.00 0.00 C ATOM 1630 CD2 LEU A 113 -30.025 22.964 -47.055 1.00 0.00 C ATOM 0 H LEU A 113 -32.707 22.570 -43.442 1.00 0.00 H new ATOM 0 HA LEU A 113 -30.891 24.644 -43.509 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -32.005 22.670 -45.221 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -32.293 24.164 -46.091 1.00 0.00 H new ATOM 0 HG LEU A 113 -29.894 24.776 -45.891 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -28.292 23.127 -44.962 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -29.461 23.651 -43.726 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -29.648 22.065 -44.512 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -28.978 22.991 -47.356 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -30.334 21.929 -46.909 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -30.638 23.419 -47.833 1.00 0.00 H new ATOM 1642 N PRO A 114 -31.723 26.825 -44.192 1.00 0.00 N ATOM 1643 CA PRO A 114 -32.242 28.199 -44.400 1.00 0.00 C ATOM 1644 C PRO A 114 -32.675 28.393 -45.855 1.00 0.00 C ATOM 1645 O PRO A 114 -32.286 27.647 -46.731 1.00 0.00 O ATOM 1646 CB PRO A 114 -31.045 29.088 -44.064 1.00 0.00 C ATOM 1647 CG PRO A 114 -29.846 28.219 -44.277 1.00 0.00 C ATOM 1648 CD PRO A 114 -30.274 26.810 -43.965 1.00 0.00 C ATOM 0 HA PRO A 114 -33.118 28.423 -43.791 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -31.014 29.968 -44.707 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -31.095 29.446 -43.036 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -29.489 28.297 -45.304 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -29.025 28.527 -43.630 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -29.775 26.088 -44.612 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -30.033 26.537 -42.938 1.00 0.00 H new ATOM 1656 N LYS A 115 -33.473 29.391 -46.119 1.00 0.00 N ATOM 1657 CA LYS A 115 -33.922 29.632 -47.520 1.00 0.00 C ATOM 1658 C LYS A 115 -33.595 31.061 -47.948 1.00 0.00 C ATOM 1659 O LYS A 115 -34.299 31.989 -47.621 1.00 0.00 O ATOM 1660 CB LYS A 115 -35.434 29.415 -47.501 1.00 0.00 C ATOM 1661 CG LYS A 115 -35.955 29.385 -48.939 1.00 0.00 C ATOM 1662 CD LYS A 115 -36.831 28.148 -49.141 1.00 0.00 C ATOM 1663 CE LYS A 115 -38.201 28.573 -49.671 1.00 0.00 C ATOM 1664 NZ LYS A 115 -38.295 27.960 -51.025 1.00 0.00 N ATOM 0 H LYS A 115 -33.833 30.049 -45.427 1.00 0.00 H new ATOM 0 HA LYS A 115 -33.423 28.968 -48.226 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -35.673 28.480 -46.995 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -35.921 30.213 -46.941 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -36.529 30.288 -49.147 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -35.120 29.370 -49.639 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -36.355 27.463 -49.842 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -36.944 27.612 -48.199 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -39.002 28.221 -49.021 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -38.286 29.659 -49.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -39.209 28.206 -51.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -37.523 28.319 -51.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -38.218 26.926 -50.944 1.00 0.00 H new ATOM 1678 N CYS A 116 -32.537 31.248 -48.685 1.00 0.00 N ATOM 1679 CA CYS A 116 -32.188 32.624 -49.132 1.00 0.00 C ATOM 1680 C CYS A 116 -33.373 33.225 -49.886 1.00 0.00 C ATOM 1681 O CYS A 116 -33.520 33.054 -51.080 1.00 0.00 O ATOM 1682 CB CYS A 116 -30.974 32.441 -50.046 1.00 0.00 C ATOM 1683 SG CYS A 116 -29.948 33.938 -50.055 1.00 0.00 S ATOM 0 H CYS A 116 -31.902 30.513 -48.996 1.00 0.00 H new ATOM 0 HA CYS A 116 -31.962 33.302 -48.309 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -30.382 31.590 -49.707 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -31.306 32.215 -51.059 1.00 0.00 H new ATOM 1688 N VAL A 117 -34.226 33.917 -49.185 1.00 0.00 N ATOM 1689 CA VAL A 117 -35.419 34.525 -49.841 1.00 0.00 C ATOM 1690 C VAL A 117 -35.307 36.031 -49.876 1.00 0.00 C ATOM 1691 O VAL A 117 -34.364 36.610 -49.381 1.00 0.00 O ATOM 1692 CB VAL A 117 -36.605 34.136 -48.970 1.00 0.00 C ATOM 1693 CG1 VAL A 117 -36.955 32.694 -49.245 1.00 0.00 C ATOM 1694 CG2 VAL A 117 -36.249 34.299 -47.490 1.00 0.00 C ATOM 0 H VAL A 117 -34.149 34.089 -48.183 1.00 0.00 H new ATOM 0 HA VAL A 117 -35.518 34.178 -50.870 1.00 0.00 H new ATOM 0 HB VAL A 117 -37.453 34.781 -49.201 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -37.804 32.401 -48.627 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -37.214 32.577 -50.297 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -36.100 32.061 -49.010 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -37.105 34.018 -46.877 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -35.402 33.657 -47.247 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -35.986 35.338 -47.291 1.00 0.00 H new ATOM 1704 N ARG A 118 -36.281 36.675 -50.441 1.00 0.00 N ATOM 1705 CA ARG A 118 -36.234 38.148 -50.484 1.00 0.00 C ATOM 1706 C ARG A 118 -37.525 38.736 -49.909 1.00 0.00 C ATOM 1707 O ARG A 118 -37.761 39.915 -50.117 1.00 0.00 O ATOM 1708 CB ARG A 118 -36.079 38.521 -51.961 1.00 0.00 C ATOM 1709 CG ARG A 118 -36.968 37.618 -52.821 1.00 0.00 C ATOM 1710 CD ARG A 118 -37.307 38.333 -54.131 1.00 0.00 C ATOM 1711 NE ARG A 118 -36.552 37.592 -55.179 1.00 0.00 N ATOM 1712 CZ ARG A 118 -35.831 38.247 -56.047 1.00 0.00 C ATOM 1713 NH1 ARG A 118 -35.166 39.307 -55.676 1.00 0.00 N ATOM 1714 NH2 ARG A 118 -35.774 37.842 -57.286 1.00 0.00 N ATOM 1715 OXT ARG A 118 -38.256 37.996 -49.271 1.00 0.00 O ATOM 0 H ARG A 118 -37.101 36.246 -50.871 1.00 0.00 H new ATOM 0 HA ARG A 118 -35.411 38.543 -49.889 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -36.352 39.565 -52.112 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -35.037 38.416 -52.264 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -36.457 36.678 -53.029 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -37.883 37.371 -52.282 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -38.379 38.311 -54.327 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -37.010 39.381 -54.097 1.00 0.00 H new ATOM 0 HE ARG A 118 -36.598 36.574 -55.218 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -35.210 39.623 -54.707 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -34.602 39.819 -56.355 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -36.293 37.013 -57.576 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -35.210 38.354 -57.965 1.00 0.00 H new TER 1729 ARG A 118