USER MOD reduce.3.24.130724 H: found=0, std=0, add=1028, rem=0, adj=57 USER MOD reduce.3.24.130724 removed 1036 hydrogens (94 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 NoAdj-H: A 78 ASNHD21 : A 78 ASN ND2 : A 136 NAG C1 :(H bumps) USER MOD NoAdj-H: A 111 ASNHD21 : A 111 ASN ND2 : A 132 NAG C1 :(H bumps) USER MOD NoAdj-H: A 111 ASNHD22 : A 111 ASN ND2 : A 132 NAG C1 :(H bumps) USER MOD Set 1.1: A 137 NAG O6 : rot 102:sc= 0.194 USER MOD Set 1.2: A 139 BMA O2 : rot 146:sc= 0.088 USER MOD Set 2.1: A 132 NAG O3 : rot -30:sc= 0.522 USER MOD Set 2.2: A 133 NAG O6 : rot 30:sc= 0.96 USER MOD Set 3.1: A 114 GLN : amide:sc= -0.621 X(o=-0.6,f=-0.97) USER MOD Set 3.2: A 116 TYR OH : rot 33:sc= 0.0216 USER MOD Set 4.1: A 30 THR OG1 : rot 180:sc= -1.59 USER MOD Set 4.2: A 53 MET CE :methyl 176:sc= -7.15! (180deg=-7.47!) USER MOD Set 5.1: A 28 LYS NZ :NH3+ -163:sc= 0.509 (180deg=-0.104) USER MOD Set 5.2: A 75 ASN : amide:sc= 0.487 K(o=1,f=-11!) USER MOD Set 6.1: A 18 SER OG : rot 75:sc= 1.95 USER MOD Set 6.2: A 80 THR OG1 : rot 180:sc= 0.931 USER MOD Single : A 1 MET CE :methyl -152:sc= -0.294 (180deg=-1.68!) USER MOD Single : A 1AALA N :NH3+ -113:sc= 0.0595 (180deg=0) USER MOD Single : A 2 HIS : no HD1:sc= 0 X(o=0,f=-0.062) USER MOD Single : A 5 GLN : amide:sc= -2.97 K(o=-3,f=-7!) USER MOD Single : A 12 SER OG : rot 180:sc= -0.046 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot -139:sc= 1.19 USER MOD Single : A 25 SER OG : rot 180:sc= -0.978 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 GLN :FLIP amide:sc= -4.65! C(o=-5.5!,f=-4.7!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.0326 USER MOD Single : A 51 THR OG1 : rot -166:sc= 0.924 USER MOD Single : A 52 TYR OH : rot -22:sc= -1.43 USER MOD Single : A 54 MET CE :methyl 143:sc= -12.1! (180deg=-20.6!) USER MOD Single : A 56 ASN : amide:sc= -0.2 K(o=-0.2,f=-1.1) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.0188 USER MOD Single : A 64 SER OG : rot -77:sc= 1.14 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot -110:sc= -0.12 USER MOD Single : A 72 SER OG : rot 161:sc= 1.61 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= -0.449 X(o=-0.45,f=-0.45) USER MOD Single : A 82 GLN :FLIP amide:sc= -1.86! C(o=-3.6!,f=-1.9!) USER MOD Single : A 87 MET CE :methyl -156:sc= -0.0902 (180deg=-0.846) USER MOD Single : A 89 THR OG1 : rot 99:sc= 0.996 USER MOD Single : A 92 TYR OH : rot -26:sc= 0.0144 USER MOD Single : A 95 LYS NZ :NH3+ -156:sc= -0.0892 (180deg=-0.342) USER MOD Single : A 99 MET CE :methyl -145:sc= -0.241 (180deg=-1.34!) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 TYR OH : rot -73:sc= -3.47! USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot -39:sc= 0.05 USER MOD Single : A 123 CYS SG : rot -60:sc= -1.09 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= -0.533 X(o=-0.53,f=-0.25) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 NAG O3 : rot -170:sc= 0 USER MOD Single : A 134 FUL O2 : rot 150:sc= -0.574 USER MOD Single : A 134 FUL O3 : rot -92:sc= 0.0613 USER MOD Single : A 134 FUL O4 : rot 150:sc= 0.0703 USER MOD Single : A 135 BMA O2 : rot 156:sc= 0.0679 USER MOD Single : A 135 BMA O3 : rot 180:sc= 0.0747 USER MOD Single : A 135 BMA O4 : rot 160:sc= 0 USER MOD Single : A 135 BMA O6 : rot -28:sc= 0.0116 USER MOD Single : A 136 NAG O3 : rot -57:sc= 0.925 USER MOD Single : A 137 NAG O3 : rot -160:sc= -0.596 USER MOD Single : A 138 FUC O2 : rot 180:sc= 0 USER MOD Single : A 138 FUC O3 : rot -87:sc= 0.105 USER MOD Single : A 138 FUC O4 : rot 150:sc= 0.0891 USER MOD Single : A 139 BMA O3 : rot 180:sc= 0 USER MOD Single : A 139 BMA O4 : rot 160:sc= 0 USER MOD Single : A 139 BMA O6 : rot 180:sc= -0.0523 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1A -14.950 5.476 2.551 1.00 0.00 N ATOM 2 CA ALA A 1A -14.139 5.211 3.775 1.00 0.00 C ATOM 3 C ALA A 1A -12.901 4.384 3.420 1.00 0.00 C ATOM 4 O ALA A 1A -12.866 3.718 2.407 1.00 0.00 O ATOM 5 CB ALA A 1A -15.066 4.420 4.699 1.00 0.00 C ATOM 0 H1 ALA A 1A -14.926 6.492 2.332 1.00 0.00 H new ATOM 0 H2 ALA A 1A -14.556 4.940 1.751 1.00 0.00 H new ATOM 0 H3 ALA A 1A -15.933 5.180 2.715 1.00 0.00 H new ATOM 0 HA ALA A 1A -13.783 6.129 4.243 1.00 0.00 H new ATOM 0 HB1 ALA A 1A -14.542 4.185 5.625 1.00 0.00 H new ATOM 0 HB2 ALA A 1A -15.951 5.016 4.924 1.00 0.00 H new ATOM 0 HB3 ALA A 1A -15.367 3.495 4.207 1.00 0.00 H new ATOM 13 N MET A 1 -11.889 4.426 4.257 1.00 0.00 N ATOM 14 CA MET A 1 -10.628 3.649 4.002 1.00 0.00 C ATOM 15 C MET A 1 -10.014 4.026 2.647 1.00 0.00 C ATOM 16 O MET A 1 -10.572 3.758 1.601 1.00 0.00 O ATOM 17 CB MET A 1 -11.031 2.168 4.020 1.00 0.00 C ATOM 18 CG MET A 1 -11.535 1.793 5.415 1.00 0.00 C ATOM 19 SD MET A 1 -12.012 0.047 5.434 1.00 0.00 S ATOM 20 CE MET A 1 -13.372 0.171 4.246 1.00 0.00 C ATOM 0 H MET A 1 -11.882 4.973 5.118 1.00 0.00 H new ATOM 0 HA MET A 1 -9.873 3.867 4.757 1.00 0.00 H new ATOM 0 HB2 MET A 1 -11.809 1.983 3.279 1.00 0.00 H new ATOM 0 HB3 MET A 1 -10.178 1.545 3.750 1.00 0.00 H new ATOM 0 HG2 MET A 1 -10.757 1.977 6.156 1.00 0.00 H new ATOM 0 HG3 MET A 1 -12.387 2.417 5.686 1.00 0.00 H new ATOM 0 HE1 MET A 1 -14.108 -0.606 4.453 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.843 1.150 4.333 1.00 0.00 H new ATOM 0 HE3 MET A 1 -12.985 0.044 3.235 1.00 0.00 H new ATOM 30 N HIS A 2 -8.855 4.639 2.663 1.00 0.00 N ATOM 31 CA HIS A 2 -8.193 5.031 1.379 1.00 0.00 C ATOM 32 C HIS A 2 -7.199 3.959 0.924 1.00 0.00 C ATOM 33 O HIS A 2 -6.285 4.226 0.167 1.00 0.00 O ATOM 34 CB HIS A 2 -7.474 6.348 1.679 1.00 0.00 C ATOM 35 CG HIS A 2 -8.479 7.393 2.080 1.00 0.00 C ATOM 36 ND1 HIS A 2 -8.769 7.669 3.408 1.00 0.00 N ATOM 37 CD2 HIS A 2 -9.269 8.238 1.341 1.00 0.00 C ATOM 38 CE1 HIS A 2 -9.697 8.643 3.426 1.00 0.00 C ATOM 39 NE2 HIS A 2 -10.037 9.027 2.193 1.00 0.00 N ATOM 0 H HIS A 2 -8.340 4.884 3.508 1.00 0.00 H new ATOM 0 HA HIS A 2 -8.916 5.139 0.571 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -6.747 6.203 2.478 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -6.920 6.680 0.801 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -9.291 8.284 0.262 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -10.116 9.063 4.328 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -10.714 9.744 1.932 1.00 0.00 H new ATOM 47 N VAL A 3 -7.382 2.752 1.375 1.00 0.00 N ATOM 48 CA VAL A 3 -6.470 1.637 0.978 1.00 0.00 C ATOM 49 C VAL A 3 -7.251 0.316 0.987 1.00 0.00 C ATOM 50 O VAL A 3 -7.956 0.016 1.933 1.00 0.00 O ATOM 51 CB VAL A 3 -5.363 1.618 2.041 1.00 0.00 C ATOM 52 CG1 VAL A 3 -4.369 0.495 1.734 1.00 0.00 C ATOM 53 CG2 VAL A 3 -4.619 2.958 2.042 1.00 0.00 C ATOM 0 H VAL A 3 -8.133 2.483 2.010 1.00 0.00 H new ATOM 0 HA VAL A 3 -6.057 1.769 -0.022 1.00 0.00 H new ATOM 0 HB VAL A 3 -5.816 1.450 3.018 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -3.585 0.486 2.491 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -4.889 -0.463 1.739 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.924 0.661 0.753 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -3.835 2.938 2.799 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.173 3.128 1.062 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -5.319 3.763 2.266 1.00 0.00 H new ATOM 63 N ALA A 4 -7.133 -0.472 -0.054 1.00 0.00 N ATOM 64 CA ALA A 4 -7.875 -1.775 -0.094 1.00 0.00 C ATOM 65 C ALA A 4 -6.906 -2.943 0.083 1.00 0.00 C ATOM 66 O ALA A 4 -5.881 -3.016 -0.568 1.00 0.00 O ATOM 67 CB ALA A 4 -8.537 -1.833 -1.468 1.00 0.00 C ATOM 0 H ALA A 4 -6.559 -0.273 -0.874 1.00 0.00 H new ATOM 0 HA ALA A 4 -8.610 -1.845 0.708 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -9.097 -2.763 -1.563 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -9.216 -0.988 -1.581 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.772 -1.790 -2.243 1.00 0.00 H new ATOM 73 N GLN A 5 -7.221 -3.849 0.973 1.00 0.00 N ATOM 74 CA GLN A 5 -6.317 -5.013 1.216 1.00 0.00 C ATOM 75 C GLN A 5 -7.101 -6.340 1.183 1.00 0.00 C ATOM 76 O GLN A 5 -8.042 -6.503 1.935 1.00 0.00 O ATOM 77 CB GLN A 5 -5.775 -4.785 2.627 1.00 0.00 C ATOM 78 CG GLN A 5 -4.933 -3.509 2.669 1.00 0.00 C ATOM 79 CD GLN A 5 -4.942 -2.953 4.094 1.00 0.00 C ATOM 80 OE1 GLN A 5 -4.850 -3.698 5.048 1.00 0.00 O ATOM 81 NE2 GLN A 5 -5.061 -1.667 4.280 1.00 0.00 N ATOM 0 H GLN A 5 -8.067 -3.833 1.543 1.00 0.00 H new ATOM 0 HA GLN A 5 -5.538 -5.082 0.457 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -6.601 -4.708 3.334 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -5.171 -5.638 2.935 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -3.911 -3.722 2.354 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -5.333 -2.771 1.974 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -5.138 -1.041 3.479 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -5.077 -1.288 5.227 1.00 0.00 H new ATOM 90 N PRO A 6 -6.678 -7.270 0.348 1.00 0.00 N ATOM 91 CA PRO A 6 -7.358 -8.589 0.298 1.00 0.00 C ATOM 92 C PRO A 6 -7.003 -9.381 1.555 1.00 0.00 C ATOM 93 O PRO A 6 -5.878 -9.355 2.010 1.00 0.00 O ATOM 94 CB PRO A 6 -6.790 -9.247 -0.956 1.00 0.00 C ATOM 95 CG PRO A 6 -5.466 -8.589 -1.177 1.00 0.00 C ATOM 96 CD PRO A 6 -5.559 -7.196 -0.608 1.00 0.00 C ATOM 0 HA PRO A 6 -8.446 -8.526 0.262 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -6.678 -10.323 -0.820 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -7.450 -9.101 -1.811 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -4.671 -9.152 -0.688 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -5.226 -8.555 -2.240 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -4.632 -6.905 -0.114 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -5.750 -6.459 -1.388 1.00 0.00 H new ATOM 104 N ALA A 7 -7.948 -10.078 2.124 1.00 0.00 N ATOM 105 CA ALA A 7 -7.647 -10.862 3.357 1.00 0.00 C ATOM 106 C ALA A 7 -6.797 -12.071 3.008 1.00 0.00 C ATOM 107 O ALA A 7 -5.996 -12.517 3.811 1.00 0.00 O ATOM 108 CB ALA A 7 -9.004 -11.286 3.919 1.00 0.00 C ATOM 0 H ALA A 7 -8.910 -10.139 1.792 1.00 0.00 H new ATOM 0 HA ALA A 7 -7.085 -10.281 4.088 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -8.855 -11.868 4.829 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -9.596 -10.400 4.148 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -9.529 -11.893 3.182 1.00 0.00 H new ATOM 114 N VAL A 8 -6.946 -12.605 1.821 1.00 0.00 N ATOM 115 CA VAL A 8 -6.124 -13.770 1.456 1.00 0.00 C ATOM 116 C VAL A 8 -5.956 -13.850 -0.056 1.00 0.00 C ATOM 117 O VAL A 8 -6.704 -13.259 -0.813 1.00 0.00 O ATOM 118 CB VAL A 8 -6.881 -14.985 2.023 1.00 0.00 C ATOM 119 CG1 VAL A 8 -8.057 -15.460 1.134 1.00 0.00 C ATOM 120 CG2 VAL A 8 -5.906 -16.130 2.238 1.00 0.00 C ATOM 0 H VAL A 8 -7.596 -12.281 1.105 1.00 0.00 H new ATOM 0 HA VAL A 8 -5.113 -13.716 1.861 1.00 0.00 H new ATOM 0 HB VAL A 8 -7.322 -14.665 2.967 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -8.541 -16.319 1.599 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -8.780 -14.652 1.024 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -7.679 -15.744 0.152 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -6.439 -16.992 2.639 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -5.445 -16.399 1.287 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -5.133 -15.822 2.942 1.00 0.00 H new ATOM 130 N VAL A 9 -4.998 -14.601 -0.480 1.00 0.00 N ATOM 131 CA VAL A 9 -4.756 -14.777 -1.929 1.00 0.00 C ATOM 132 C VAL A 9 -4.406 -16.241 -2.208 1.00 0.00 C ATOM 133 O VAL A 9 -3.937 -16.953 -1.340 1.00 0.00 O ATOM 134 CB VAL A 9 -3.599 -13.822 -2.250 1.00 0.00 C ATOM 135 CG1 VAL A 9 -2.897 -14.203 -3.563 1.00 0.00 C ATOM 136 CG2 VAL A 9 -4.148 -12.404 -2.385 1.00 0.00 C ATOM 0 H VAL A 9 -4.357 -15.113 0.126 1.00 0.00 H new ATOM 0 HA VAL A 9 -5.622 -14.550 -2.551 1.00 0.00 H new ATOM 0 HB VAL A 9 -2.873 -13.887 -1.439 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -2.083 -13.504 -3.757 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -2.496 -15.213 -3.481 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -3.613 -14.162 -4.384 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -3.332 -11.718 -2.613 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -4.883 -12.374 -3.189 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -4.621 -12.106 -1.449 1.00 0.00 H new ATOM 146 N LEU A 10 -4.631 -16.684 -3.414 1.00 0.00 N ATOM 147 CA LEU A 10 -4.314 -18.099 -3.761 1.00 0.00 C ATOM 148 C LEU A 10 -3.183 -18.134 -4.794 1.00 0.00 C ATOM 149 O LEU A 10 -3.214 -17.424 -5.782 1.00 0.00 O ATOM 150 CB LEU A 10 -5.611 -18.666 -4.347 1.00 0.00 C ATOM 151 CG LEU A 10 -6.737 -18.582 -3.306 1.00 0.00 C ATOM 152 CD1 LEU A 10 -8.039 -19.097 -3.924 1.00 0.00 C ATOM 153 CD2 LEU A 10 -6.384 -19.427 -2.072 1.00 0.00 C ATOM 0 H LEU A 10 -5.021 -16.128 -4.175 1.00 0.00 H new ATOM 0 HA LEU A 10 -3.979 -18.679 -2.901 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -5.889 -18.110 -5.242 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -5.461 -19.702 -4.650 1.00 0.00 H new ATOM 0 HG LEU A 10 -6.861 -17.544 -2.999 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -8.840 -19.038 -3.187 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -8.297 -18.487 -4.790 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -7.909 -20.133 -4.236 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -7.190 -19.359 -1.342 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -6.251 -20.467 -2.369 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -5.460 -19.055 -1.628 1.00 0.00 H new ATOM 165 N ALA A 11 -2.185 -18.949 -4.567 1.00 0.00 N ATOM 166 CA ALA A 11 -1.042 -19.030 -5.525 1.00 0.00 C ATOM 167 C ALA A 11 -1.295 -20.132 -6.561 1.00 0.00 C ATOM 168 O ALA A 11 -2.410 -20.587 -6.730 1.00 0.00 O ATOM 169 CB ALA A 11 0.175 -19.361 -4.658 1.00 0.00 C ATOM 0 H ALA A 11 -2.112 -19.564 -3.756 1.00 0.00 H new ATOM 0 HA ALA A 11 -0.900 -18.105 -6.084 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.061 -19.438 -5.289 1.00 0.00 H new ATOM 0 HB2 ALA A 11 0.322 -18.572 -3.921 1.00 0.00 H new ATOM 0 HB3 ALA A 11 0.010 -20.309 -4.146 1.00 0.00 H new ATOM 175 N SER A 12 -0.271 -20.551 -7.262 1.00 0.00 N ATOM 176 CA SER A 12 -0.448 -21.617 -8.299 1.00 0.00 C ATOM 177 C SER A 12 0.574 -22.742 -8.095 1.00 0.00 C ATOM 178 O SER A 12 1.377 -22.702 -7.182 1.00 0.00 O ATOM 179 CB SER A 12 -0.210 -20.913 -9.633 1.00 0.00 C ATOM 180 OG SER A 12 -0.579 -21.782 -10.695 1.00 0.00 O ATOM 0 H SER A 12 0.682 -20.201 -7.162 1.00 0.00 H new ATOM 0 HA SER A 12 -1.435 -22.078 -8.248 1.00 0.00 H new ATOM 0 HB2 SER A 12 -0.793 -19.993 -9.681 1.00 0.00 H new ATOM 0 HB3 SER A 12 0.839 -20.631 -9.726 1.00 0.00 H new ATOM 0 HG SER A 12 -0.429 -21.332 -11.553 1.00 0.00 H new ATOM 186 N SER A 13 0.555 -23.741 -8.950 1.00 0.00 N ATOM 187 CA SER A 13 1.527 -24.874 -8.810 1.00 0.00 C ATOM 188 C SER A 13 2.957 -24.336 -8.916 1.00 0.00 C ATOM 189 O SER A 13 3.840 -24.739 -8.183 1.00 0.00 O ATOM 190 CB SER A 13 1.223 -25.814 -9.978 1.00 0.00 C ATOM 191 OG SER A 13 2.043 -26.971 -9.876 1.00 0.00 O ATOM 0 H SER A 13 -0.090 -23.820 -9.736 1.00 0.00 H new ATOM 0 HA SER A 13 1.437 -25.384 -7.851 1.00 0.00 H new ATOM 0 HB2 SER A 13 0.171 -26.098 -9.967 1.00 0.00 H new ATOM 0 HB3 SER A 13 1.406 -25.307 -10.925 1.00 0.00 H new ATOM 0 HG SER A 13 1.849 -27.576 -10.622 1.00 0.00 H new ATOM 197 N ARG A 14 3.173 -23.400 -9.802 1.00 0.00 N ATOM 198 CA ARG A 14 4.532 -22.789 -9.951 1.00 0.00 C ATOM 199 C ARG A 14 4.960 -22.153 -8.623 1.00 0.00 C ATOM 200 O ARG A 14 6.134 -21.959 -8.372 1.00 0.00 O ATOM 201 CB ARG A 14 4.374 -21.741 -11.056 1.00 0.00 C ATOM 202 CG ARG A 14 5.732 -21.108 -11.365 1.00 0.00 C ATOM 203 CD ARG A 14 6.610 -22.113 -12.119 1.00 0.00 C ATOM 204 NE ARG A 14 5.938 -22.316 -13.442 1.00 0.00 N ATOM 205 CZ ARG A 14 6.510 -23.022 -14.399 1.00 0.00 C ATOM 206 NH1 ARG A 14 7.689 -23.577 -14.235 1.00 0.00 N ATOM 207 NH2 ARG A 14 5.888 -23.173 -15.536 1.00 0.00 N ATOM 0 H ARG A 14 2.464 -23.029 -10.434 1.00 0.00 H new ATOM 0 HA ARG A 14 5.302 -23.517 -10.208 1.00 0.00 H new ATOM 0 HB2 ARG A 14 3.965 -22.204 -11.954 1.00 0.00 H new ATOM 0 HB3 ARG A 14 3.667 -20.973 -10.743 1.00 0.00 H new ATOM 0 HG2 ARG A 14 5.597 -20.207 -11.964 1.00 0.00 H new ATOM 0 HG3 ARG A 14 6.222 -20.805 -10.440 1.00 0.00 H new ATOM 0 HD2 ARG A 14 7.623 -21.731 -12.248 1.00 0.00 H new ATOM 0 HD3 ARG A 14 6.691 -23.052 -11.571 1.00 0.00 H new ATOM 0 HE ARG A 14 5.021 -21.901 -13.606 1.00 0.00 H new ATOM 0 HH11 ARG A 14 8.186 -23.467 -13.351 1.00 0.00 H new ATOM 0 HH12 ARG A 14 8.108 -24.118 -14.992 1.00 0.00 H new ATOM 0 HH21 ARG A 14 4.971 -22.748 -15.676 1.00 0.00 H new ATOM 0 HH22 ARG A 14 6.318 -23.716 -16.285 1.00 0.00 H new ATOM 221 N GLY A 15 4.015 -21.842 -7.767 1.00 0.00 N ATOM 222 CA GLY A 15 4.363 -21.235 -6.453 1.00 0.00 C ATOM 223 C GLY A 15 4.540 -19.734 -6.629 1.00 0.00 C ATOM 224 O GLY A 15 5.374 -19.120 -5.989 1.00 0.00 O ATOM 0 H GLY A 15 3.018 -21.985 -7.927 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.577 -21.438 -5.725 1.00 0.00 H new ATOM 0 HA3 GLY A 15 5.280 -21.679 -6.065 1.00 0.00 H new ATOM 228 N ILE A 16 3.763 -19.139 -7.497 1.00 0.00 N ATOM 229 CA ILE A 16 3.886 -17.681 -7.720 1.00 0.00 C ATOM 230 C ILE A 16 2.597 -17.009 -7.259 1.00 0.00 C ATOM 231 O ILE A 16 1.555 -17.159 -7.869 1.00 0.00 O ATOM 232 CB ILE A 16 4.082 -17.482 -9.230 1.00 0.00 C ATOM 233 CG1 ILE A 16 5.011 -18.544 -9.849 1.00 0.00 C ATOM 234 CG2 ILE A 16 4.679 -16.100 -9.470 1.00 0.00 C ATOM 235 CD1 ILE A 16 6.286 -18.732 -9.040 1.00 0.00 C ATOM 0 H ILE A 16 3.050 -19.606 -8.058 1.00 0.00 H new ATOM 0 HA ILE A 16 4.720 -17.249 -7.167 1.00 0.00 H new ATOM 0 HB ILE A 16 3.107 -17.581 -9.707 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.481 -19.494 -9.915 1.00 0.00 H new ATOM 0 HG13 ILE A 16 5.268 -18.251 -10.867 1.00 0.00 H new ATOM 0 HG21 ILE A 16 4.823 -15.947 -10.539 1.00 0.00 H new ATOM 0 HG22 ILE A 16 4.002 -15.339 -9.082 1.00 0.00 H new ATOM 0 HG23 ILE A 16 5.639 -16.025 -8.960 1.00 0.00 H new ATOM 0 HD11 ILE A 16 6.909 -19.490 -9.514 1.00 0.00 H new ATOM 0 HD12 ILE A 16 6.831 -17.789 -8.996 1.00 0.00 H new ATOM 0 HD13 ILE A 16 6.032 -19.052 -8.029 1.00 0.00 H new ATOM 247 N ALA A 17 2.662 -16.280 -6.185 1.00 0.00 N ATOM 248 CA ALA A 17 1.440 -15.598 -5.663 1.00 0.00 C ATOM 249 C ALA A 17 1.492 -14.106 -5.981 1.00 0.00 C ATOM 250 O ALA A 17 2.457 -13.432 -5.673 1.00 0.00 O ATOM 251 CB ALA A 17 1.466 -15.819 -4.150 1.00 0.00 C ATOM 0 H ALA A 17 3.510 -16.124 -5.641 1.00 0.00 H new ATOM 0 HA ALA A 17 0.530 -15.992 -6.115 1.00 0.00 H new ATOM 0 HB1 ALA A 17 0.595 -15.344 -3.698 1.00 0.00 H new ATOM 0 HB2 ALA A 17 1.447 -16.888 -3.938 1.00 0.00 H new ATOM 0 HB3 ALA A 17 2.374 -15.383 -3.734 1.00 0.00 H new ATOM 257 N SER A 18 0.459 -13.586 -6.592 1.00 0.00 N ATOM 258 CA SER A 18 0.444 -12.135 -6.929 1.00 0.00 C ATOM 259 C SER A 18 -0.821 -11.467 -6.397 1.00 0.00 C ATOM 260 O SER A 18 -1.925 -11.923 -6.627 1.00 0.00 O ATOM 261 CB SER A 18 0.475 -12.066 -8.454 1.00 0.00 C ATOM 262 OG SER A 18 0.539 -10.705 -8.855 1.00 0.00 O ATOM 0 H SER A 18 -0.374 -14.105 -6.871 1.00 0.00 H new ATOM 0 HA SER A 18 1.290 -11.615 -6.480 1.00 0.00 H new ATOM 0 HB2 SER A 18 1.337 -12.612 -8.838 1.00 0.00 H new ATOM 0 HB3 SER A 18 -0.414 -12.540 -8.870 1.00 0.00 H new ATOM 0 HG SER A 18 1.442 -10.359 -8.695 1.00 0.00 H new ATOM 268 N PHE A 19 -0.657 -10.374 -5.707 1.00 0.00 N ATOM 269 CA PHE A 19 -1.830 -9.631 -5.169 1.00 0.00 C ATOM 270 C PHE A 19 -1.613 -8.138 -5.366 1.00 0.00 C ATOM 271 O PHE A 19 -0.502 -7.688 -5.582 1.00 0.00 O ATOM 272 CB PHE A 19 -1.927 -9.995 -3.687 1.00 0.00 C ATOM 273 CG PHE A 19 -0.652 -9.634 -2.959 1.00 0.00 C ATOM 274 CD1 PHE A 19 0.444 -10.536 -2.969 1.00 0.00 C ATOM 275 CD2 PHE A 19 -0.554 -8.402 -2.253 1.00 0.00 C ATOM 276 CE1 PHE A 19 1.640 -10.210 -2.276 1.00 0.00 C ATOM 277 CE2 PHE A 19 0.643 -8.076 -1.556 1.00 0.00 C ATOM 278 CZ PHE A 19 1.740 -8.982 -1.570 1.00 0.00 C ATOM 0 H PHE A 19 0.249 -9.959 -5.490 1.00 0.00 H new ATOM 0 HA PHE A 19 -2.757 -9.892 -5.680 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.770 -9.472 -3.234 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.121 -11.063 -3.582 1.00 0.00 H new ATOM 0 HD1 PHE A 19 0.368 -11.471 -3.504 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.387 -7.715 -2.246 1.00 0.00 H new ATOM 0 HE1 PHE A 19 2.474 -10.896 -2.286 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.719 -7.143 -1.018 1.00 0.00 H new ATOM 0 HZ PHE A 19 2.650 -8.735 -1.043 1.00 0.00 H new ATOM 288 N VAL A 20 -2.667 -7.374 -5.328 1.00 0.00 N ATOM 289 CA VAL A 20 -2.525 -5.907 -5.552 1.00 0.00 C ATOM 290 C VAL A 20 -3.137 -5.106 -4.398 1.00 0.00 C ATOM 291 O VAL A 20 -4.307 -5.229 -4.091 1.00 0.00 O ATOM 292 CB VAL A 20 -3.277 -5.641 -6.858 1.00 0.00 C ATOM 293 CG1 VAL A 20 -3.206 -4.154 -7.209 1.00 0.00 C ATOM 294 CG2 VAL A 20 -2.645 -6.448 -7.997 1.00 0.00 C ATOM 0 H VAL A 20 -3.618 -7.699 -5.152 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.480 -5.602 -5.605 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.317 -5.939 -6.727 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -3.744 -3.974 -8.140 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -3.660 -3.569 -6.409 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -2.164 -3.858 -7.329 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -3.185 -6.254 -8.924 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.602 -6.154 -8.116 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.697 -7.511 -7.762 1.00 0.00 H new ATOM 304 N CYS A 21 -2.348 -4.265 -3.784 1.00 0.00 N ATOM 305 CA CYS A 21 -2.858 -3.414 -2.672 1.00 0.00 C ATOM 306 C CYS A 21 -3.012 -1.989 -3.202 1.00 0.00 C ATOM 307 O CYS A 21 -2.035 -1.326 -3.500 1.00 0.00 O ATOM 308 CB CYS A 21 -1.770 -3.490 -1.599 1.00 0.00 C ATOM 309 SG CYS A 21 -2.290 -2.593 -0.112 1.00 0.00 S ATOM 0 H CYS A 21 -1.362 -4.131 -4.009 1.00 0.00 H new ATOM 0 HA CYS A 21 -3.823 -3.730 -2.275 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -1.566 -4.532 -1.351 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -0.842 -3.066 -1.982 1.00 0.00 H new ATOM 314 N GLU A 22 -4.221 -1.521 -3.360 1.00 0.00 N ATOM 315 CA GLU A 22 -4.410 -0.151 -3.917 1.00 0.00 C ATOM 316 C GLU A 22 -4.266 0.919 -2.831 1.00 0.00 C ATOM 317 O GLU A 22 -4.587 0.699 -1.678 1.00 0.00 O ATOM 318 CB GLU A 22 -5.810 -0.162 -4.553 1.00 0.00 C ATOM 319 CG GLU A 22 -6.890 -0.053 -3.484 1.00 0.00 C ATOM 320 CD GLU A 22 -8.259 -0.340 -4.106 1.00 0.00 C ATOM 321 OE1 GLU A 22 -8.320 -1.164 -5.004 1.00 0.00 O ATOM 322 OE2 GLU A 22 -9.223 0.269 -3.673 1.00 0.00 O ATOM 0 H GLU A 22 -5.079 -2.023 -3.130 1.00 0.00 H new ATOM 0 HA GLU A 22 -3.649 0.100 -4.656 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.902 0.667 -5.255 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.948 -1.080 -5.124 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -6.690 -0.759 -2.678 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.881 0.944 -3.044 1.00 0.00 H new ATOM 329 N TYR A 23 -3.804 2.081 -3.209 1.00 0.00 N ATOM 330 CA TYR A 23 -3.652 3.181 -2.239 1.00 0.00 C ATOM 331 C TYR A 23 -4.275 4.440 -2.857 1.00 0.00 C ATOM 332 O TYR A 23 -4.527 4.488 -4.047 1.00 0.00 O ATOM 333 CB TYR A 23 -2.127 3.307 -1.995 1.00 0.00 C ATOM 334 CG TYR A 23 -1.427 4.053 -3.118 1.00 0.00 C ATOM 335 CD1 TYR A 23 -1.481 5.473 -3.159 1.00 0.00 C ATOM 336 CD2 TYR A 23 -0.702 3.341 -4.113 1.00 0.00 C ATOM 337 CE1 TYR A 23 -0.814 6.180 -4.194 1.00 0.00 C ATOM 338 CE2 TYR A 23 -0.037 4.050 -5.150 1.00 0.00 C ATOM 339 CZ TYR A 23 -0.093 5.470 -5.190 1.00 0.00 C ATOM 340 OH TYR A 23 0.558 6.159 -6.193 1.00 0.00 O ATOM 0 H TYR A 23 -3.524 2.308 -4.163 1.00 0.00 H new ATOM 0 HA TYR A 23 -4.154 3.017 -1.285 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -1.953 3.826 -1.052 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -1.693 2.312 -1.896 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -2.030 6.014 -2.402 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -0.657 2.262 -4.081 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -0.855 7.259 -4.224 1.00 0.00 H new ATOM 0 HE2 TYR A 23 0.511 3.510 -5.908 1.00 0.00 H new ATOM 0 HH TYR A 23 0.429 5.694 -7.046 1.00 0.00 H new ATOM 350 N ALA A 24 -4.538 5.438 -2.069 1.00 0.00 N ATOM 351 CA ALA A 24 -5.165 6.681 -2.618 1.00 0.00 C ATOM 352 C ALA A 24 -4.416 7.931 -2.151 1.00 0.00 C ATOM 353 O ALA A 24 -4.109 8.083 -0.983 1.00 0.00 O ATOM 354 CB ALA A 24 -6.593 6.676 -2.071 1.00 0.00 C ATOM 0 H ALA A 24 -4.349 5.454 -1.067 1.00 0.00 H new ATOM 0 HA ALA A 24 -5.138 6.699 -3.708 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -7.123 7.559 -2.429 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -7.110 5.779 -2.412 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -6.565 6.686 -0.981 1.00 0.00 H new ATOM 360 N SER A 25 -4.133 8.832 -3.059 1.00 0.00 N ATOM 361 CA SER A 25 -3.417 10.086 -2.683 1.00 0.00 C ATOM 362 C SER A 25 -4.003 11.293 -3.434 1.00 0.00 C ATOM 363 O SER A 25 -4.504 11.152 -4.531 1.00 0.00 O ATOM 364 CB SER A 25 -1.962 9.864 -3.082 1.00 0.00 C ATOM 365 OG SER A 25 -1.254 11.092 -2.979 1.00 0.00 O ATOM 0 H SER A 25 -4.369 8.751 -4.048 1.00 0.00 H new ATOM 0 HA SER A 25 -3.516 10.299 -1.619 1.00 0.00 H new ATOM 0 HB2 SER A 25 -1.506 9.113 -2.436 1.00 0.00 H new ATOM 0 HB3 SER A 25 -1.907 9.483 -4.102 1.00 0.00 H new ATOM 0 HG SER A 25 -0.318 10.952 -3.233 1.00 0.00 H new ATOM 371 N PRO A 26 -3.924 12.449 -2.811 1.00 0.00 N ATOM 372 CA PRO A 26 -4.456 13.693 -3.432 1.00 0.00 C ATOM 373 C PRO A 26 -3.611 14.138 -4.635 1.00 0.00 C ATOM 374 O PRO A 26 -3.998 15.034 -5.363 1.00 0.00 O ATOM 375 CB PRO A 26 -4.371 14.721 -2.305 1.00 0.00 C ATOM 376 CG PRO A 26 -3.293 14.214 -1.404 1.00 0.00 C ATOM 377 CD PRO A 26 -3.335 12.712 -1.488 1.00 0.00 C ATOM 0 HA PRO A 26 -5.465 13.560 -3.821 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -4.130 15.712 -2.691 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -5.320 14.807 -1.776 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -2.319 14.592 -1.714 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -3.454 14.550 -0.380 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -2.339 12.279 -1.401 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -3.940 12.284 -0.689 1.00 0.00 H new ATOM 385 N GLY A 27 -2.460 13.539 -4.850 1.00 0.00 N ATOM 386 CA GLY A 27 -1.606 13.958 -6.004 1.00 0.00 C ATOM 387 C GLY A 27 -0.850 12.755 -6.572 1.00 0.00 C ATOM 388 O GLY A 27 -1.004 11.638 -6.114 1.00 0.00 O ATOM 0 H GLY A 27 -2.080 12.784 -4.279 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.227 14.405 -6.780 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -0.898 14.722 -5.682 1.00 0.00 H new ATOM 392 N LYS A 28 -0.040 12.981 -7.577 1.00 0.00 N ATOM 393 CA LYS A 28 0.731 11.862 -8.199 1.00 0.00 C ATOM 394 C LYS A 28 2.235 12.141 -8.131 1.00 0.00 C ATOM 395 O LYS A 28 2.668 13.277 -8.153 1.00 0.00 O ATOM 396 CB LYS A 28 0.267 11.830 -9.656 1.00 0.00 C ATOM 397 CG LYS A 28 -1.219 11.477 -9.716 1.00 0.00 C ATOM 398 CD LYS A 28 -1.397 9.981 -9.459 1.00 0.00 C ATOM 399 CE LYS A 28 -2.873 9.608 -9.617 1.00 0.00 C ATOM 400 NZ LYS A 28 -2.915 8.130 -9.446 1.00 0.00 N ATOM 0 H LYS A 28 0.120 13.898 -7.995 1.00 0.00 H new ATOM 0 HA LYS A 28 0.561 10.915 -7.687 1.00 0.00 H new ATOM 0 HB2 LYS A 28 0.440 12.799 -10.124 1.00 0.00 H new ATOM 0 HB3 LYS A 28 0.848 11.097 -10.217 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -1.771 12.053 -8.973 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -1.627 11.741 -10.692 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -0.789 9.406 -10.158 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -1.053 9.730 -8.456 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -3.489 10.110 -8.871 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -3.253 9.904 -10.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -3.815 7.763 -9.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -2.124 7.698 -9.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -2.836 7.895 -8.436 1.00 0.00 H new ATOM 414 N ALA A 29 3.031 11.105 -8.055 1.00 0.00 N ATOM 415 CA ALA A 29 4.512 11.287 -7.992 1.00 0.00 C ATOM 416 C ALA A 29 5.209 10.104 -8.669 1.00 0.00 C ATOM 417 O ALA A 29 4.615 9.061 -8.868 1.00 0.00 O ATOM 418 CB ALA A 29 4.845 11.325 -6.502 1.00 0.00 C ATOM 0 H ALA A 29 2.716 10.135 -8.034 1.00 0.00 H new ATOM 0 HA ALA A 29 4.843 12.191 -8.503 1.00 0.00 H new ATOM 0 HB1 ALA A 29 5.919 11.457 -6.373 1.00 0.00 H new ATOM 0 HB2 ALA A 29 4.318 12.156 -6.033 1.00 0.00 H new ATOM 0 HB3 ALA A 29 4.536 10.389 -6.036 1.00 0.00 H new ATOM 424 N THR A 30 6.464 10.253 -9.015 1.00 0.00 N ATOM 425 CA THR A 30 7.192 9.130 -9.680 1.00 0.00 C ATOM 426 C THR A 30 7.655 8.115 -8.658 1.00 0.00 C ATOM 427 O THR A 30 7.556 6.922 -8.854 1.00 0.00 O ATOM 428 CB THR A 30 8.463 9.736 -10.274 1.00 0.00 C ATOM 429 OG1 THR A 30 9.240 10.310 -9.235 1.00 0.00 O ATOM 430 CG2 THR A 30 8.136 10.805 -11.284 1.00 0.00 C ATOM 0 H THR A 30 7.013 11.100 -8.866 1.00 0.00 H new ATOM 0 HA THR A 30 6.541 8.653 -10.412 1.00 0.00 H new ATOM 0 HB THR A 30 9.018 8.941 -10.773 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.057 10.698 -9.613 1.00 0.00 H new ATOM 0 HG21 THR A 30 9.060 11.218 -11.689 1.00 0.00 H new ATOM 0 HG22 THR A 30 7.546 10.373 -12.093 1.00 0.00 H new ATOM 0 HG23 THR A 30 7.565 11.599 -10.802 1.00 0.00 H new ATOM 438 N GLU A 31 8.224 8.591 -7.598 1.00 0.00 N ATOM 439 CA GLU A 31 8.798 7.663 -6.599 1.00 0.00 C ATOM 440 C GLU A 31 7.732 7.086 -5.678 1.00 0.00 C ATOM 441 O GLU A 31 7.176 7.766 -4.836 1.00 0.00 O ATOM 442 CB GLU A 31 9.780 8.513 -5.778 1.00 0.00 C ATOM 443 CG GLU A 31 10.785 9.246 -6.694 1.00 0.00 C ATOM 444 CD GLU A 31 12.181 8.604 -6.601 1.00 0.00 C ATOM 445 OE1 GLU A 31 12.341 7.646 -5.860 1.00 0.00 O ATOM 446 OE2 GLU A 31 13.071 9.088 -7.281 1.00 0.00 O ATOM 0 H GLU A 31 8.317 9.583 -7.379 1.00 0.00 H new ATOM 0 HA GLU A 31 9.274 6.814 -7.090 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.227 9.241 -5.185 1.00 0.00 H new ATOM 0 HB3 GLU A 31 10.320 7.875 -5.078 1.00 0.00 H new ATOM 0 HG2 GLU A 31 10.434 9.214 -7.725 1.00 0.00 H new ATOM 0 HG3 GLU A 31 10.844 10.297 -6.409 1.00 0.00 H new ATOM 453 N VAL A 32 7.496 5.813 -5.806 1.00 0.00 N ATOM 454 CA VAL A 32 6.524 5.132 -4.918 1.00 0.00 C ATOM 455 C VAL A 32 7.273 4.005 -4.214 1.00 0.00 C ATOM 456 O VAL A 32 7.452 2.927 -4.758 1.00 0.00 O ATOM 457 CB VAL A 32 5.424 4.592 -5.837 1.00 0.00 C ATOM 458 CG1 VAL A 32 4.416 3.779 -5.015 1.00 0.00 C ATOM 459 CG2 VAL A 32 4.702 5.766 -6.502 1.00 0.00 C ATOM 0 H VAL A 32 7.942 5.210 -6.497 1.00 0.00 H new ATOM 0 HA VAL A 32 6.084 5.781 -4.161 1.00 0.00 H new ATOM 0 HB VAL A 32 5.870 3.952 -6.598 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.635 3.397 -5.672 1.00 0.00 H new ATOM 0 HG12 VAL A 32 4.927 2.945 -4.535 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.969 4.417 -4.253 1.00 0.00 H new ATOM 0 HG21 VAL A 32 3.918 5.387 -7.157 1.00 0.00 H new ATOM 0 HG22 VAL A 32 4.259 6.402 -5.736 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.415 6.347 -7.087 1.00 0.00 H new ATOM 469 N ARG A 33 7.745 4.265 -3.022 1.00 0.00 N ATOM 470 CA ARG A 33 8.513 3.228 -2.278 1.00 0.00 C ATOM 471 C ARG A 33 7.555 2.189 -1.727 1.00 0.00 C ATOM 472 O ARG A 33 6.728 2.488 -0.884 1.00 0.00 O ATOM 473 CB ARG A 33 9.199 3.979 -1.135 1.00 0.00 C ATOM 474 CG ARG A 33 10.096 3.014 -0.357 1.00 0.00 C ATOM 475 CD ARG A 33 10.860 3.781 0.726 1.00 0.00 C ATOM 476 NE ARG A 33 11.664 2.741 1.444 1.00 0.00 N ATOM 477 CZ ARG A 33 12.688 3.069 2.208 1.00 0.00 C ATOM 478 NH1 ARG A 33 13.052 4.320 2.371 1.00 0.00 N ATOM 479 NH2 ARG A 33 13.355 2.127 2.815 1.00 0.00 N ATOM 0 H ARG A 33 7.630 5.153 -2.533 1.00 0.00 H new ATOM 0 HA ARG A 33 9.235 2.709 -2.909 1.00 0.00 H new ATOM 0 HB2 ARG A 33 9.791 4.804 -1.531 1.00 0.00 H new ATOM 0 HB3 ARG A 33 8.452 4.413 -0.471 1.00 0.00 H new ATOM 0 HG2 ARG A 33 9.493 2.228 0.097 1.00 0.00 H new ATOM 0 HG3 ARG A 33 10.797 2.527 -1.035 1.00 0.00 H new ATOM 0 HD2 ARG A 33 11.503 4.545 0.289 1.00 0.00 H new ATOM 0 HD3 ARG A 33 10.177 4.290 1.406 1.00 0.00 H new ATOM 0 HE ARG A 33 11.414 1.758 1.340 1.00 0.00 H new ATOM 0 HH11 ARG A 33 12.539 5.066 1.901 1.00 0.00 H new ATOM 0 HH12 ARG A 33 13.848 4.546 2.968 1.00 0.00 H new ATOM 0 HH21 ARG A 33 13.083 1.151 2.696 1.00 0.00 H new ATOM 0 HH22 ARG A 33 14.149 2.366 3.409 1.00 0.00 H new ATOM 493 N VAL A 34 7.655 0.970 -2.191 1.00 0.00 N ATOM 494 CA VAL A 34 6.743 -0.081 -1.684 1.00 0.00 C ATOM 495 C VAL A 34 7.526 -1.202 -1.009 1.00 0.00 C ATOM 496 O VAL A 34 8.570 -1.619 -1.476 1.00 0.00 O ATOM 497 CB VAL A 34 5.974 -0.604 -2.896 1.00 0.00 C ATOM 498 CG1 VAL A 34 5.108 0.517 -3.471 1.00 0.00 C ATOM 499 CG2 VAL A 34 6.951 -1.098 -3.969 1.00 0.00 C ATOM 0 H VAL A 34 8.327 0.664 -2.895 1.00 0.00 H new ATOM 0 HA VAL A 34 6.063 0.318 -0.931 1.00 0.00 H new ATOM 0 HB VAL A 34 5.341 -1.435 -2.584 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.559 0.145 -4.336 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.403 0.858 -2.713 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.744 1.348 -3.775 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.391 -1.468 -4.828 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.594 -0.275 -4.282 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.563 -1.902 -3.561 1.00 0.00 H new ATOM 509 N THR A 35 7.019 -1.681 0.093 1.00 0.00 N ATOM 510 CA THR A 35 7.705 -2.776 0.833 1.00 0.00 C ATOM 511 C THR A 35 6.721 -3.908 1.141 1.00 0.00 C ATOM 512 O THR A 35 5.564 -3.680 1.441 1.00 0.00 O ATOM 513 CB THR A 35 8.198 -2.132 2.138 1.00 0.00 C ATOM 514 OG1 THR A 35 9.063 -1.048 1.829 1.00 0.00 O ATOM 515 CG2 THR A 35 8.960 -3.169 2.974 1.00 0.00 C ATOM 0 H THR A 35 6.150 -1.357 0.516 1.00 0.00 H new ATOM 0 HA THR A 35 8.522 -3.209 0.255 1.00 0.00 H new ATOM 0 HB THR A 35 7.342 -1.770 2.708 1.00 0.00 H new ATOM 0 HG1 THR A 35 9.378 -0.634 2.659 1.00 0.00 H new ATOM 0 HG21 THR A 35 9.307 -2.707 3.898 1.00 0.00 H new ATOM 0 HG22 THR A 35 8.299 -4.002 3.211 1.00 0.00 H new ATOM 0 HG23 THR A 35 9.816 -3.535 2.407 1.00 0.00 H new ATOM 523 N VAL A 36 7.183 -5.125 1.091 1.00 0.00 N ATOM 524 CA VAL A 36 6.297 -6.276 1.414 1.00 0.00 C ATOM 525 C VAL A 36 6.840 -6.925 2.691 1.00 0.00 C ATOM 526 O VAL A 36 8.040 -7.004 2.861 1.00 0.00 O ATOM 527 CB VAL A 36 6.394 -7.217 0.206 1.00 0.00 C ATOM 528 CG1 VAL A 36 5.590 -8.491 0.479 1.00 0.00 C ATOM 529 CG2 VAL A 36 5.826 -6.514 -1.038 1.00 0.00 C ATOM 0 H VAL A 36 8.140 -5.373 0.839 1.00 0.00 H new ATOM 0 HA VAL A 36 5.256 -6.005 1.590 1.00 0.00 H new ATOM 0 HB VAL A 36 7.439 -7.477 0.035 1.00 0.00 H new ATOM 0 HG11 VAL A 36 5.661 -9.157 -0.381 1.00 0.00 H new ATOM 0 HG12 VAL A 36 5.990 -8.992 1.360 1.00 0.00 H new ATOM 0 HG13 VAL A 36 4.545 -8.232 0.652 1.00 0.00 H new ATOM 0 HG21 VAL A 36 5.895 -7.182 -1.897 1.00 0.00 H new ATOM 0 HG22 VAL A 36 4.782 -6.253 -0.864 1.00 0.00 H new ATOM 0 HG23 VAL A 36 6.398 -5.608 -1.237 1.00 0.00 H new ATOM 539 N LEU A 37 6.000 -7.346 3.619 1.00 0.00 N ATOM 540 CA LEU A 37 6.565 -7.942 4.876 1.00 0.00 C ATOM 541 C LEU A 37 5.919 -9.284 5.215 1.00 0.00 C ATOM 542 O LEU A 37 4.943 -9.696 4.622 1.00 0.00 O ATOM 543 CB LEU A 37 6.242 -6.948 5.999 1.00 0.00 C ATOM 544 CG LEU A 37 6.824 -5.567 5.698 1.00 0.00 C ATOM 545 CD1 LEU A 37 5.973 -4.502 6.398 1.00 0.00 C ATOM 546 CD2 LEU A 37 8.263 -5.495 6.221 1.00 0.00 C ATOM 0 H LEU A 37 4.982 -7.304 3.563 1.00 0.00 H new ATOM 0 HA LEU A 37 7.634 -8.118 4.752 1.00 0.00 H new ATOM 0 HB2 LEU A 37 5.162 -6.872 6.121 1.00 0.00 H new ATOM 0 HB3 LEU A 37 6.644 -7.317 6.942 1.00 0.00 H new ATOM 0 HG LEU A 37 6.821 -5.392 4.622 1.00 0.00 H new ATOM 0 HD11 LEU A 37 6.382 -3.514 6.188 1.00 0.00 H new ATOM 0 HD12 LEU A 37 4.948 -4.556 6.031 1.00 0.00 H new ATOM 0 HD13 LEU A 37 5.983 -4.678 7.474 1.00 0.00 H new ATOM 0 HD21 LEU A 37 8.679 -4.511 6.007 1.00 0.00 H new ATOM 0 HD22 LEU A 37 8.268 -5.665 7.298 1.00 0.00 H new ATOM 0 HD23 LEU A 37 8.867 -6.259 5.731 1.00 0.00 H new ATOM 558 N ARG A 38 6.461 -9.941 6.204 1.00 0.00 N ATOM 559 CA ARG A 38 5.900 -11.245 6.666 1.00 0.00 C ATOM 560 C ARG A 38 5.645 -11.168 8.171 1.00 0.00 C ATOM 561 O ARG A 38 6.547 -10.886 8.938 1.00 0.00 O ATOM 562 CB ARG A 38 6.975 -12.289 6.369 1.00 0.00 C ATOM 563 CG ARG A 38 7.099 -12.496 4.861 1.00 0.00 C ATOM 564 CD ARG A 38 8.243 -13.474 4.579 1.00 0.00 C ATOM 565 NE ARG A 38 8.359 -13.527 3.089 1.00 0.00 N ATOM 566 CZ ARG A 38 8.982 -14.519 2.483 1.00 0.00 C ATOM 567 NH1 ARG A 38 9.526 -15.506 3.159 1.00 0.00 N ATOM 568 NH2 ARG A 38 9.063 -14.520 1.181 1.00 0.00 N ATOM 0 H ARG A 38 7.282 -9.625 6.720 1.00 0.00 H new ATOM 0 HA ARG A 38 4.961 -11.492 6.171 1.00 0.00 H new ATOM 0 HB2 ARG A 38 7.931 -11.965 6.780 1.00 0.00 H new ATOM 0 HB3 ARG A 38 6.722 -13.232 6.854 1.00 0.00 H new ATOM 0 HG2 ARG A 38 6.164 -12.885 4.457 1.00 0.00 H new ATOM 0 HG3 ARG A 38 7.288 -11.544 4.366 1.00 0.00 H new ATOM 0 HD2 ARG A 38 9.173 -13.133 5.034 1.00 0.00 H new ATOM 0 HD3 ARG A 38 8.029 -14.460 4.992 1.00 0.00 H new ATOM 0 HE ARG A 38 7.948 -12.780 2.529 1.00 0.00 H new ATOM 0 HH11 ARG A 38 9.472 -15.517 4.178 1.00 0.00 H new ATOM 0 HH12 ARG A 38 10.002 -16.261 2.665 1.00 0.00 H new ATOM 0 HH21 ARG A 38 8.647 -13.759 0.644 1.00 0.00 H new ATOM 0 HH22 ARG A 38 9.542 -15.281 0.700 1.00 0.00 H new ATOM 582 N GLN A 39 4.435 -11.414 8.606 1.00 0.00 N ATOM 583 CA GLN A 39 4.148 -11.345 10.070 1.00 0.00 C ATOM 584 C GLN A 39 3.975 -12.744 10.659 1.00 0.00 C ATOM 585 O GLN A 39 3.260 -13.574 10.131 1.00 0.00 O ATOM 586 CB GLN A 39 2.857 -10.540 10.200 1.00 0.00 C ATOM 587 CG GLN A 39 3.138 -9.066 9.887 1.00 0.00 C ATOM 588 CD GLN A 39 1.829 -8.254 9.791 1.00 0.00 C ATOM 589 OE1 GLN A 39 0.687 -8.760 10.198 1.00 0.00 O flip ATOM 590 NE2 GLN A 39 1.850 -7.125 9.346 1.00 0.00 N flip ATOM 0 H GLN A 39 3.640 -11.658 8.016 1.00 0.00 H new ATOM 0 HA GLN A 39 4.969 -10.880 10.616 1.00 0.00 H new ATOM 0 HB2 GLN A 39 2.103 -10.930 9.517 1.00 0.00 H new ATOM 0 HB3 GLN A 39 2.455 -10.638 11.208 1.00 0.00 H new ATOM 0 HG2 GLN A 39 3.775 -8.642 10.663 1.00 0.00 H new ATOM 0 HG3 GLN A 39 3.686 -8.989 8.948 1.00 0.00 H new ATOM 0 HE21 GLN A 39 2.729 -6.719 9.026 1.00 0.00 H new ATOM 0 HE22 GLN A 39 0.988 -6.582 9.292 1.00 0.00 H new ATOM 599 N ALA A 40 4.633 -12.997 11.756 1.00 0.00 N ATOM 600 CA ALA A 40 4.534 -14.327 12.419 1.00 0.00 C ATOM 601 C ALA A 40 3.652 -14.216 13.665 1.00 0.00 C ATOM 602 O ALA A 40 3.039 -13.192 13.907 1.00 0.00 O ATOM 603 CB ALA A 40 5.973 -14.682 12.798 1.00 0.00 C ATOM 0 H ALA A 40 5.243 -12.329 12.227 1.00 0.00 H new ATOM 0 HA ALA A 40 4.087 -15.088 11.779 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.990 -15.652 13.294 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.587 -14.724 11.898 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.369 -13.923 13.472 1.00 0.00 H new ATOM 609 N ASP A 41 3.582 -15.257 14.454 1.00 0.00 N ATOM 610 CA ASP A 41 2.728 -15.211 15.681 1.00 0.00 C ATOM 611 C ASP A 41 3.194 -14.098 16.627 1.00 0.00 C ATOM 612 O ASP A 41 2.387 -13.368 17.173 1.00 0.00 O ATOM 613 CB ASP A 41 2.901 -16.575 16.342 1.00 0.00 C ATOM 614 CG ASP A 41 2.173 -17.647 15.524 1.00 0.00 C ATOM 615 OD1 ASP A 41 1.203 -17.311 14.864 1.00 0.00 O ATOM 616 OD2 ASP A 41 2.601 -18.789 15.573 1.00 0.00 O ATOM 0 H ASP A 41 4.078 -16.136 14.303 1.00 0.00 H new ATOM 0 HA ASP A 41 1.686 -15.001 15.439 1.00 0.00 H new ATOM 0 HB2 ASP A 41 3.960 -16.820 16.418 1.00 0.00 H new ATOM 0 HB3 ASP A 41 2.506 -16.549 17.358 1.00 0.00 H new ATOM 621 N SER A 42 4.482 -13.962 16.829 1.00 0.00 N ATOM 622 CA SER A 42 4.987 -12.894 17.749 1.00 0.00 C ATOM 623 C SER A 42 6.136 -12.089 17.117 1.00 0.00 C ATOM 624 O SER A 42 6.665 -11.184 17.735 1.00 0.00 O ATOM 625 CB SER A 42 5.484 -13.646 18.981 1.00 0.00 C ATOM 626 OG SER A 42 6.515 -14.546 18.598 1.00 0.00 O ATOM 0 H SER A 42 5.203 -14.541 16.399 1.00 0.00 H new ATOM 0 HA SER A 42 4.207 -12.169 17.981 1.00 0.00 H new ATOM 0 HB2 SER A 42 5.858 -12.942 19.725 1.00 0.00 H new ATOM 0 HB3 SER A 42 4.662 -14.192 19.444 1.00 0.00 H new ATOM 0 HG SER A 42 6.837 -15.029 19.387 1.00 0.00 H new ATOM 632 N GLN A 43 6.532 -12.403 15.904 1.00 0.00 N ATOM 633 CA GLN A 43 7.652 -11.643 15.264 1.00 0.00 C ATOM 634 C GLN A 43 7.333 -11.335 13.799 1.00 0.00 C ATOM 635 O GLN A 43 6.566 -12.029 13.164 1.00 0.00 O ATOM 636 CB GLN A 43 8.865 -12.566 15.365 1.00 0.00 C ATOM 637 CG GLN A 43 9.305 -12.664 16.825 1.00 0.00 C ATOM 638 CD GLN A 43 10.456 -13.665 16.947 1.00 0.00 C ATOM 639 OE1 GLN A 43 11.406 -13.610 16.191 1.00 0.00 O ATOM 640 NE2 GLN A 43 10.411 -14.583 17.873 1.00 0.00 N ATOM 0 H GLN A 43 6.130 -13.148 15.334 1.00 0.00 H new ATOM 0 HA GLN A 43 7.823 -10.684 15.752 1.00 0.00 H new ATOM 0 HB2 GLN A 43 8.616 -13.555 14.981 1.00 0.00 H new ATOM 0 HB3 GLN A 43 9.681 -12.182 14.752 1.00 0.00 H new ATOM 0 HG2 GLN A 43 9.621 -11.685 17.187 1.00 0.00 H new ATOM 0 HG3 GLN A 43 8.468 -12.979 17.448 1.00 0.00 H new ATOM 0 HE21 GLN A 43 9.614 -14.629 18.507 1.00 0.00 H new ATOM 0 HE22 GLN A 43 11.173 -15.255 17.963 1.00 0.00 H new ATOM 649 N VAL A 44 7.926 -10.298 13.263 1.00 0.00 N ATOM 650 CA VAL A 44 7.671 -9.934 11.834 1.00 0.00 C ATOM 651 C VAL A 44 9.003 -9.654 11.125 1.00 0.00 C ATOM 652 O VAL A 44 9.930 -9.135 11.719 1.00 0.00 O ATOM 653 CB VAL A 44 6.813 -8.663 11.886 1.00 0.00 C ATOM 654 CG1 VAL A 44 6.460 -8.226 10.462 1.00 0.00 C ATOM 655 CG2 VAL A 44 5.520 -8.933 12.665 1.00 0.00 C ATOM 0 H VAL A 44 8.577 -9.686 13.754 1.00 0.00 H new ATOM 0 HA VAL A 44 7.172 -10.733 11.286 1.00 0.00 H new ATOM 0 HB VAL A 44 7.377 -7.875 12.386 1.00 0.00 H new ATOM 0 HG11 VAL A 44 5.850 -7.323 10.499 1.00 0.00 H new ATOM 0 HG12 VAL A 44 7.375 -8.023 9.906 1.00 0.00 H new ATOM 0 HG13 VAL A 44 5.902 -9.020 9.965 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.918 -8.025 12.696 1.00 0.00 H new ATOM 0 HG22 VAL A 44 4.957 -9.725 12.172 1.00 0.00 H new ATOM 0 HG23 VAL A 44 5.765 -9.241 13.681 1.00 0.00 H new ATOM 665 N THR A 45 9.108 -9.998 9.863 1.00 0.00 N ATOM 666 CA THR A 45 10.389 -9.753 9.120 1.00 0.00 C ATOM 667 C THR A 45 10.126 -9.034 7.790 1.00 0.00 C ATOM 668 O THR A 45 9.045 -9.104 7.236 1.00 0.00 O ATOM 669 CB THR A 45 10.984 -11.143 8.864 1.00 0.00 C ATOM 670 OG1 THR A 45 10.115 -11.879 8.015 1.00 0.00 O ATOM 671 CG2 THR A 45 11.169 -11.887 10.189 1.00 0.00 C ATOM 0 H THR A 45 8.367 -10.436 9.316 1.00 0.00 H new ATOM 0 HA THR A 45 11.064 -9.116 9.691 1.00 0.00 H new ATOM 0 HB THR A 45 11.956 -11.035 8.383 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.495 -12.767 7.849 1.00 0.00 H new ATOM 0 HG21 THR A 45 11.592 -12.873 9.997 1.00 0.00 H new ATOM 0 HG22 THR A 45 11.843 -11.322 10.832 1.00 0.00 H new ATOM 0 HG23 THR A 45 10.203 -11.997 10.683 1.00 0.00 H new ATOM 679 N GLU A 46 11.116 -8.341 7.279 1.00 0.00 N ATOM 680 CA GLU A 46 10.948 -7.607 5.986 1.00 0.00 C ATOM 681 C GLU A 46 11.239 -8.516 4.793 1.00 0.00 C ATOM 682 O GLU A 46 11.888 -9.537 4.918 1.00 0.00 O ATOM 683 CB GLU A 46 11.952 -6.454 6.031 1.00 0.00 C ATOM 684 CG GLU A 46 11.554 -5.463 7.131 1.00 0.00 C ATOM 685 CD GLU A 46 12.272 -5.802 8.448 1.00 0.00 C ATOM 686 OE1 GLU A 46 13.030 -6.762 8.472 1.00 0.00 O ATOM 687 OE2 GLU A 46 12.048 -5.092 9.414 1.00 0.00 O ATOM 0 H GLU A 46 12.038 -8.252 7.705 1.00 0.00 H new ATOM 0 HA GLU A 46 9.924 -7.253 5.866 1.00 0.00 H new ATOM 0 HB2 GLU A 46 12.954 -6.839 6.221 1.00 0.00 H new ATOM 0 HB3 GLU A 46 11.982 -5.948 5.066 1.00 0.00 H new ATOM 0 HG2 GLU A 46 11.807 -4.448 6.823 1.00 0.00 H new ATOM 0 HG3 GLU A 46 10.475 -5.491 7.281 1.00 0.00 H new ATOM 694 N VAL A 47 10.753 -8.144 3.635 1.00 0.00 N ATOM 695 CA VAL A 47 10.985 -8.973 2.417 1.00 0.00 C ATOM 696 C VAL A 47 11.691 -8.138 1.332 1.00 0.00 C ATOM 697 O VAL A 47 12.890 -8.236 1.163 1.00 0.00 O ATOM 698 CB VAL A 47 9.583 -9.412 1.974 1.00 0.00 C ATOM 699 CG1 VAL A 47 9.668 -10.272 0.726 1.00 0.00 C ATOM 700 CG2 VAL A 47 8.925 -10.228 3.088 1.00 0.00 C ATOM 0 H VAL A 47 10.204 -7.298 3.482 1.00 0.00 H new ATOM 0 HA VAL A 47 11.631 -9.831 2.603 1.00 0.00 H new ATOM 0 HB VAL A 47 8.992 -8.521 1.761 1.00 0.00 H new ATOM 0 HG11 VAL A 47 8.666 -10.575 0.424 1.00 0.00 H new ATOM 0 HG12 VAL A 47 10.132 -9.701 -0.078 1.00 0.00 H new ATOM 0 HG13 VAL A 47 10.268 -11.158 0.935 1.00 0.00 H new ATOM 0 HG21 VAL A 47 7.929 -10.539 2.772 1.00 0.00 H new ATOM 0 HG22 VAL A 47 9.530 -11.109 3.300 1.00 0.00 H new ATOM 0 HG23 VAL A 47 8.846 -9.618 3.988 1.00 0.00 H new ATOM 710 N CYS A 48 10.969 -7.318 0.600 1.00 0.00 N ATOM 711 CA CYS A 48 11.620 -6.486 -0.466 1.00 0.00 C ATOM 712 C CYS A 48 11.177 -5.020 -0.361 1.00 0.00 C ATOM 713 O CYS A 48 10.133 -4.721 0.185 1.00 0.00 O ATOM 714 CB CYS A 48 11.152 -7.106 -1.784 1.00 0.00 C ATOM 715 SG CYS A 48 11.868 -8.762 -1.953 1.00 0.00 S ATOM 0 H CYS A 48 9.962 -7.190 0.694 1.00 0.00 H new ATOM 0 HA CYS A 48 12.706 -6.481 -0.379 1.00 0.00 H new ATOM 0 HB2 CYS A 48 10.064 -7.164 -1.806 1.00 0.00 H new ATOM 0 HB3 CYS A 48 11.455 -6.479 -2.622 1.00 0.00 H new ATOM 720 N ALA A 49 11.970 -4.104 -0.876 1.00 0.00 N ATOM 721 CA ALA A 49 11.596 -2.654 -0.797 1.00 0.00 C ATOM 722 C ALA A 49 12.356 -1.823 -1.847 1.00 0.00 C ATOM 723 O ALA A 49 13.572 -1.797 -1.868 1.00 0.00 O ATOM 724 CB ALA A 49 12.000 -2.231 0.617 1.00 0.00 C ATOM 0 H ALA A 49 12.855 -4.298 -1.345 1.00 0.00 H new ATOM 0 HA ALA A 49 10.536 -2.495 -0.996 1.00 0.00 H new ATOM 0 HB1 ALA A 49 11.761 -1.178 0.764 1.00 0.00 H new ATOM 0 HB2 ALA A 49 11.456 -2.831 1.346 1.00 0.00 H new ATOM 0 HB3 ALA A 49 13.071 -2.382 0.750 1.00 0.00 H new ATOM 730 N ALA A 50 11.641 -1.140 -2.714 1.00 0.00 N ATOM 731 CA ALA A 50 12.311 -0.300 -3.764 1.00 0.00 C ATOM 732 C ALA A 50 11.344 0.781 -4.276 1.00 0.00 C ATOM 733 O ALA A 50 10.161 0.537 -4.425 1.00 0.00 O ATOM 734 CB ALA A 50 12.668 -1.277 -4.896 1.00 0.00 C ATOM 0 H ALA A 50 10.621 -1.128 -2.740 1.00 0.00 H new ATOM 0 HA ALA A 50 13.191 0.214 -3.377 1.00 0.00 H new ATOM 0 HB1 ALA A 50 13.162 -0.735 -5.702 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.337 -2.048 -4.514 1.00 0.00 H new ATOM 0 HB3 ALA A 50 11.758 -1.742 -5.276 1.00 0.00 H new ATOM 740 N THR A 51 11.839 1.966 -4.564 1.00 0.00 N ATOM 741 CA THR A 51 10.941 3.048 -5.087 1.00 0.00 C ATOM 742 C THR A 51 10.961 3.007 -6.603 1.00 0.00 C ATOM 743 O THR A 51 12.003 3.165 -7.208 1.00 0.00 O ATOM 744 CB THR A 51 11.540 4.372 -4.608 1.00 0.00 C ATOM 745 OG1 THR A 51 12.014 4.227 -3.277 1.00 0.00 O ATOM 746 CG2 THR A 51 10.464 5.454 -4.644 1.00 0.00 C ATOM 0 H THR A 51 12.819 2.228 -4.460 1.00 0.00 H new ATOM 0 HA THR A 51 9.914 2.928 -4.741 1.00 0.00 H new ATOM 0 HB THR A 51 12.368 4.653 -5.260 1.00 0.00 H new ATOM 0 HG1 THR A 51 12.187 5.112 -2.893 1.00 0.00 H new ATOM 0 HG21 THR A 51 10.887 6.399 -4.303 1.00 0.00 H new ATOM 0 HG22 THR A 51 10.096 5.568 -5.664 1.00 0.00 H new ATOM 0 HG23 THR A 51 9.639 5.169 -3.991 1.00 0.00 H new ATOM 754 N TYR A 52 9.832 2.798 -7.226 1.00 0.00 N ATOM 755 CA TYR A 52 9.822 2.740 -8.717 1.00 0.00 C ATOM 756 C TYR A 52 9.127 3.945 -9.328 1.00 0.00 C ATOM 757 O TYR A 52 8.167 4.469 -8.789 1.00 0.00 O ATOM 758 CB TYR A 52 9.075 1.453 -9.083 1.00 0.00 C ATOM 759 CG TYR A 52 7.675 1.477 -8.521 1.00 0.00 C ATOM 760 CD1 TYR A 52 6.633 2.115 -9.244 1.00 0.00 C ATOM 761 CD2 TYR A 52 7.400 0.855 -7.276 1.00 0.00 C ATOM 762 CE1 TYR A 52 5.313 2.133 -8.719 1.00 0.00 C ATOM 763 CE2 TYR A 52 6.081 0.872 -6.752 1.00 0.00 C ATOM 764 CZ TYR A 52 5.038 1.511 -7.472 1.00 0.00 C ATOM 765 OH TYR A 52 3.756 1.528 -6.960 1.00 0.00 O ATOM 0 H TYR A 52 8.927 2.666 -6.774 1.00 0.00 H new ATOM 0 HA TYR A 52 10.840 2.749 -9.106 1.00 0.00 H new ATOM 0 HB2 TYR A 52 9.036 1.344 -10.167 1.00 0.00 H new ATOM 0 HB3 TYR A 52 9.615 0.589 -8.694 1.00 0.00 H new ATOM 0 HD1 TYR A 52 6.844 2.586 -10.193 1.00 0.00 H new ATOM 0 HD2 TYR A 52 8.193 0.369 -6.728 1.00 0.00 H new ATOM 0 HE1 TYR A 52 4.520 2.619 -9.267 1.00 0.00 H new ATOM 0 HE2 TYR A 52 5.871 0.398 -5.804 1.00 0.00 H new ATOM 0 HH TYR A 52 3.254 2.269 -7.359 1.00 0.00 H new ATOM 775 N MET A 53 9.596 4.362 -10.476 1.00 0.00 N ATOM 776 CA MET A 53 8.955 5.502 -11.170 1.00 0.00 C ATOM 777 C MET A 53 7.664 4.971 -11.794 1.00 0.00 C ATOM 778 O MET A 53 7.522 3.773 -11.971 1.00 0.00 O ATOM 779 CB MET A 53 9.930 5.930 -12.272 1.00 0.00 C ATOM 780 CG MET A 53 11.266 6.349 -11.661 1.00 0.00 C ATOM 781 SD MET A 53 11.392 5.685 -9.988 1.00 0.00 S ATOM 782 CE MET A 53 10.964 7.208 -9.113 1.00 0.00 C ATOM 0 H MET A 53 10.398 3.956 -10.958 1.00 0.00 H new ATOM 0 HA MET A 53 8.730 6.341 -10.511 1.00 0.00 H new ATOM 0 HB2 MET A 53 10.083 5.108 -12.971 1.00 0.00 H new ATOM 0 HB3 MET A 53 9.507 6.758 -12.841 1.00 0.00 H new ATOM 0 HG2 MET A 53 12.090 5.982 -12.273 1.00 0.00 H new ATOM 0 HG3 MET A 53 11.344 7.436 -11.640 1.00 0.00 H new ATOM 0 HE1 MET A 53 10.911 7.010 -8.042 1.00 0.00 H new ATOM 0 HE2 MET A 53 11.726 7.964 -9.305 1.00 0.00 H new ATOM 0 HE3 MET A 53 9.997 7.570 -9.464 1.00 0.00 H new ATOM 792 N MET A 54 6.728 5.814 -12.134 1.00 0.00 N ATOM 793 CA MET A 54 5.466 5.295 -12.747 1.00 0.00 C ATOM 794 C MET A 54 5.740 4.783 -14.163 1.00 0.00 C ATOM 795 O MET A 54 6.301 5.477 -14.990 1.00 0.00 O ATOM 796 CB MET A 54 4.505 6.483 -12.763 1.00 0.00 C ATOM 797 CG MET A 54 4.204 6.899 -11.323 1.00 0.00 C ATOM 798 SD MET A 54 3.634 5.457 -10.386 1.00 0.00 S ATOM 799 CE MET A 54 5.246 4.956 -9.729 1.00 0.00 C ATOM 0 H MET A 54 6.777 6.826 -12.017 1.00 0.00 H new ATOM 0 HA MET A 54 5.048 4.457 -12.189 1.00 0.00 H new ATOM 0 HB2 MET A 54 4.945 7.316 -13.311 1.00 0.00 H new ATOM 0 HB3 MET A 54 3.583 6.214 -13.278 1.00 0.00 H new ATOM 0 HG2 MET A 54 5.097 7.318 -10.860 1.00 0.00 H new ATOM 0 HG3 MET A 54 3.443 7.679 -11.310 1.00 0.00 H new ATOM 0 HE1 MET A 54 5.125 4.584 -8.712 1.00 0.00 H new ATOM 0 HE2 MET A 54 5.666 4.169 -10.355 1.00 0.00 H new ATOM 0 HE3 MET A 54 5.919 5.813 -9.724 1.00 0.00 H new ATOM 809 N GLY A 55 5.343 3.565 -14.442 1.00 0.00 N ATOM 810 CA GLY A 55 5.567 2.984 -15.797 1.00 0.00 C ATOM 811 C GLY A 55 6.933 2.287 -15.860 1.00 0.00 C ATOM 812 O GLY A 55 7.532 2.192 -16.916 1.00 0.00 O ATOM 0 H GLY A 55 4.870 2.947 -13.783 1.00 0.00 H new ATOM 0 HA2 GLY A 55 4.776 2.271 -16.029 1.00 0.00 H new ATOM 0 HA3 GLY A 55 5.518 3.771 -16.550 1.00 0.00 H new ATOM 816 N ASN A 56 7.432 1.796 -14.747 1.00 0.00 N ATOM 817 CA ASN A 56 8.761 1.103 -14.767 1.00 0.00 C ATOM 818 C ASN A 56 8.837 0.020 -13.684 1.00 0.00 C ATOM 819 O ASN A 56 7.936 -0.146 -12.884 1.00 0.00 O ATOM 820 CB ASN A 56 9.792 2.192 -14.489 1.00 0.00 C ATOM 821 CG ASN A 56 11.108 1.837 -15.184 1.00 0.00 C ATOM 822 OD1 ASN A 56 11.108 1.351 -16.298 1.00 0.00 O ATOM 823 ND2 ASN A 56 12.238 2.061 -14.571 1.00 0.00 N ATOM 0 H ASN A 56 6.980 1.845 -13.834 1.00 0.00 H new ATOM 0 HA ASN A 56 8.931 0.605 -15.722 1.00 0.00 H new ATOM 0 HB2 ASN A 56 9.427 3.154 -14.848 1.00 0.00 H new ATOM 0 HB3 ASN A 56 9.951 2.292 -13.415 1.00 0.00 H new ATOM 0 HD21 ASN A 56 13.120 1.828 -15.027 1.00 0.00 H new ATOM 0 HD22 ASN A 56 12.239 2.469 -13.636 1.00 0.00 H new ATOM 830 N GLU A 57 9.922 -0.711 -13.662 1.00 0.00 N ATOM 831 CA GLU A 57 10.103 -1.792 -12.643 1.00 0.00 C ATOM 832 C GLU A 57 11.543 -1.773 -12.113 1.00 0.00 C ATOM 833 O GLU A 57 12.452 -1.355 -12.804 1.00 0.00 O ATOM 834 CB GLU A 57 9.824 -3.098 -13.391 1.00 0.00 C ATOM 835 CG GLU A 57 8.364 -3.124 -13.858 1.00 0.00 C ATOM 836 CD GLU A 57 7.427 -3.128 -12.645 1.00 0.00 C ATOM 837 OE1 GLU A 57 7.833 -3.620 -11.604 1.00 0.00 O ATOM 838 OE2 GLU A 57 6.318 -2.638 -12.780 1.00 0.00 O ATOM 0 H GLU A 57 10.700 -0.605 -14.313 1.00 0.00 H new ATOM 0 HA GLU A 57 9.442 -1.669 -11.785 1.00 0.00 H new ATOM 0 HB2 GLU A 57 10.492 -3.187 -14.248 1.00 0.00 H new ATOM 0 HB3 GLU A 57 10.023 -3.950 -12.741 1.00 0.00 H new ATOM 0 HG2 GLU A 57 8.158 -2.256 -14.484 1.00 0.00 H new ATOM 0 HG3 GLU A 57 8.185 -4.008 -14.470 1.00 0.00 H new ATOM 845 N LEU A 58 11.759 -2.211 -10.892 1.00 0.00 N ATOM 846 CA LEU A 58 13.147 -2.200 -10.331 1.00 0.00 C ATOM 847 C LEU A 58 13.477 -3.491 -9.588 1.00 0.00 C ATOM 848 O LEU A 58 12.730 -4.450 -9.594 1.00 0.00 O ATOM 849 CB LEU A 58 13.172 -1.052 -9.335 1.00 0.00 C ATOM 850 CG LEU A 58 12.958 0.271 -10.050 1.00 0.00 C ATOM 851 CD1 LEU A 58 12.897 1.365 -8.997 1.00 0.00 C ATOM 852 CD2 LEU A 58 14.124 0.538 -11.002 1.00 0.00 C ATOM 0 H LEU A 58 11.039 -2.572 -10.266 1.00 0.00 H new ATOM 0 HA LEU A 58 13.875 -2.097 -11.136 1.00 0.00 H new ATOM 0 HB2 LEU A 58 12.396 -1.197 -8.583 1.00 0.00 H new ATOM 0 HB3 LEU A 58 14.127 -1.039 -8.809 1.00 0.00 H new ATOM 0 HG LEU A 58 12.035 0.246 -10.629 1.00 0.00 H new ATOM 0 HD11 LEU A 58 12.744 2.329 -9.482 1.00 0.00 H new ATOM 0 HD12 LEU A 58 12.071 1.167 -8.314 1.00 0.00 H new ATOM 0 HD13 LEU A 58 13.833 1.385 -8.438 1.00 0.00 H new ATOM 0 HD21 LEU A 58 13.966 1.488 -11.513 1.00 0.00 H new ATOM 0 HD22 LEU A 58 15.054 0.581 -10.435 1.00 0.00 H new ATOM 0 HD23 LEU A 58 14.184 -0.264 -11.738 1.00 0.00 H new ATOM 864 N THR A 59 14.606 -3.491 -8.930 1.00 0.00 N ATOM 865 CA THR A 59 15.047 -4.655 -8.149 1.00 0.00 C ATOM 866 C THR A 59 14.952 -4.305 -6.666 1.00 0.00 C ATOM 867 O THR A 59 14.907 -3.143 -6.305 1.00 0.00 O ATOM 868 CB THR A 59 16.499 -4.843 -8.569 1.00 0.00 C ATOM 869 OG1 THR A 59 17.225 -3.652 -8.299 1.00 0.00 O ATOM 870 CG2 THR A 59 16.577 -5.173 -10.062 1.00 0.00 C ATOM 0 H THR A 59 15.252 -2.702 -8.909 1.00 0.00 H new ATOM 0 HA THR A 59 14.455 -5.555 -8.314 1.00 0.00 H new ATOM 0 HB THR A 59 16.932 -5.669 -8.005 1.00 0.00 H new ATOM 0 HG1 THR A 59 18.160 -3.771 -8.567 1.00 0.00 H new ATOM 0 HG21 THR A 59 17.620 -5.305 -10.351 1.00 0.00 H new ATOM 0 HG22 THR A 59 16.026 -6.092 -10.261 1.00 0.00 H new ATOM 0 HG23 THR A 59 16.141 -4.357 -10.638 1.00 0.00 H new ATOM 878 N PHE A 60 14.908 -5.284 -5.808 1.00 0.00 N ATOM 879 CA PHE A 60 14.801 -4.990 -4.348 1.00 0.00 C ATOM 880 C PHE A 60 16.110 -5.384 -3.651 1.00 0.00 C ATOM 881 O PHE A 60 16.618 -6.473 -3.829 1.00 0.00 O ATOM 882 CB PHE A 60 13.592 -5.815 -3.890 1.00 0.00 C ATOM 883 CG PHE A 60 12.372 -5.321 -4.650 1.00 0.00 C ATOM 884 CD1 PHE A 60 11.599 -4.244 -4.140 1.00 0.00 C ATOM 885 CD2 PHE A 60 12.026 -5.909 -5.899 1.00 0.00 C ATOM 886 CE1 PHE A 60 10.479 -3.757 -4.872 1.00 0.00 C ATOM 887 CE2 PHE A 60 10.904 -5.424 -6.627 1.00 0.00 C ATOM 888 CZ PHE A 60 10.132 -4.349 -6.114 1.00 0.00 C ATOM 0 H PHE A 60 14.941 -6.274 -6.051 1.00 0.00 H new ATOM 0 HA PHE A 60 14.656 -3.936 -4.109 1.00 0.00 H new ATOM 0 HB2 PHE A 60 13.758 -6.875 -4.083 1.00 0.00 H new ATOM 0 HB3 PHE A 60 13.442 -5.707 -2.816 1.00 0.00 H new ATOM 0 HD1 PHE A 60 11.862 -3.793 -3.194 1.00 0.00 H new ATOM 0 HD2 PHE A 60 12.615 -6.723 -6.294 1.00 0.00 H new ATOM 0 HE1 PHE A 60 9.894 -2.937 -4.482 1.00 0.00 H new ATOM 0 HE2 PHE A 60 10.639 -5.875 -7.572 1.00 0.00 H new ATOM 0 HZ PHE A 60 9.281 -3.982 -6.669 1.00 0.00 H new ATOM 898 N LEU A 61 16.681 -4.474 -2.897 1.00 0.00 N ATOM 899 CA LEU A 61 17.995 -4.748 -2.224 1.00 0.00 C ATOM 900 C LEU A 61 17.922 -5.943 -1.269 1.00 0.00 C ATOM 901 O LEU A 61 18.807 -6.779 -1.256 1.00 0.00 O ATOM 902 CB LEU A 61 18.311 -3.470 -1.440 1.00 0.00 C ATOM 903 CG LEU A 61 18.652 -2.340 -2.415 1.00 0.00 C ATOM 904 CD1 LEU A 61 18.849 -1.038 -1.637 1.00 0.00 C ATOM 905 CD2 LEU A 61 19.942 -2.682 -3.164 1.00 0.00 C ATOM 0 H LEU A 61 16.293 -3.548 -2.717 1.00 0.00 H new ATOM 0 HA LEU A 61 18.760 -5.000 -2.958 1.00 0.00 H new ATOM 0 HB2 LEU A 61 17.456 -3.188 -0.825 1.00 0.00 H new ATOM 0 HB3 LEU A 61 19.147 -3.644 -0.763 1.00 0.00 H new ATOM 0 HG LEU A 61 17.837 -2.220 -3.129 1.00 0.00 H new ATOM 0 HD11 LEU A 61 19.092 -0.233 -2.331 1.00 0.00 H new ATOM 0 HD12 LEU A 61 17.932 -0.792 -1.102 1.00 0.00 H new ATOM 0 HD13 LEU A 61 19.664 -1.160 -0.923 1.00 0.00 H new ATOM 0 HD21 LEU A 61 20.184 -1.877 -3.858 1.00 0.00 H new ATOM 0 HD22 LEU A 61 20.756 -2.803 -2.450 1.00 0.00 H new ATOM 0 HD23 LEU A 61 19.806 -3.610 -3.719 1.00 0.00 H new ATOM 917 N ASP A 62 16.889 -6.037 -0.473 1.00 0.00 N ATOM 918 CA ASP A 62 16.785 -7.188 0.475 1.00 0.00 C ATOM 919 C ASP A 62 15.947 -8.298 -0.147 1.00 0.00 C ATOM 920 O ASP A 62 14.883 -8.058 -0.685 1.00 0.00 O ATOM 921 CB ASP A 62 16.132 -6.625 1.746 1.00 0.00 C ATOM 922 CG ASP A 62 14.723 -6.100 1.443 1.00 0.00 C ATOM 923 OD1 ASP A 62 14.528 -5.547 0.374 1.00 0.00 O ATOM 924 OD2 ASP A 62 13.863 -6.253 2.296 1.00 0.00 O ATOM 0 H ASP A 62 16.117 -5.372 -0.437 1.00 0.00 H new ATOM 0 HA ASP A 62 17.756 -7.626 0.705 1.00 0.00 H new ATOM 0 HB2 ASP A 62 16.080 -7.402 2.509 1.00 0.00 H new ATOM 0 HB3 ASP A 62 16.746 -5.821 2.151 1.00 0.00 H new ATOM 929 N ASP A 63 16.437 -9.519 -0.104 1.00 0.00 N ATOM 930 CA ASP A 63 15.692 -10.662 -0.722 1.00 0.00 C ATOM 931 C ASP A 63 15.360 -10.313 -2.174 1.00 0.00 C ATOM 932 O ASP A 63 14.212 -10.254 -2.558 1.00 0.00 O ATOM 933 CB ASP A 63 14.415 -10.829 0.104 1.00 0.00 C ATOM 934 CG ASP A 63 14.771 -11.230 1.540 1.00 0.00 C ATOM 935 OD1 ASP A 63 15.802 -11.858 1.725 1.00 0.00 O ATOM 936 OD2 ASP A 63 14.003 -10.905 2.430 1.00 0.00 O ATOM 0 H ASP A 63 17.323 -9.771 0.334 1.00 0.00 H new ATOM 0 HA ASP A 63 16.272 -11.585 -0.725 1.00 0.00 H new ATOM 0 HB2 ASP A 63 13.849 -9.897 0.107 1.00 0.00 H new ATOM 0 HB3 ASP A 63 13.776 -11.588 -0.347 1.00 0.00 H new ATOM 941 N SER A 64 16.376 -10.028 -2.949 1.00 0.00 N ATOM 942 CA SER A 64 16.180 -9.627 -4.385 1.00 0.00 C ATOM 943 C SER A 64 15.490 -10.732 -5.206 1.00 0.00 C ATOM 944 O SER A 64 16.054 -11.274 -6.139 1.00 0.00 O ATOM 945 CB SER A 64 17.591 -9.377 -4.921 1.00 0.00 C ATOM 946 OG SER A 64 18.209 -8.348 -4.160 1.00 0.00 O ATOM 0 H SER A 64 17.350 -10.055 -2.647 1.00 0.00 H new ATOM 0 HA SER A 64 15.535 -8.751 -4.461 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.181 -10.292 -4.864 1.00 0.00 H new ATOM 0 HB3 SER A 64 17.547 -9.091 -5.972 1.00 0.00 H new ATOM 0 HG SER A 64 17.855 -7.478 -4.439 1.00 0.00 H new ATOM 952 N ILE A 67 14.269 -11.046 -4.875 1.00 0.00 N ATOM 953 CA ILE A 67 13.504 -12.085 -5.622 1.00 0.00 C ATOM 954 C ILE A 67 12.036 -11.630 -5.761 1.00 0.00 C ATOM 955 O ILE A 67 11.157 -12.419 -6.055 1.00 0.00 O ATOM 956 CB ILE A 67 13.615 -13.355 -4.772 1.00 0.00 C ATOM 957 CG1 ILE A 67 15.092 -13.770 -4.702 1.00 0.00 C ATOM 958 CG2 ILE A 67 12.790 -14.482 -5.418 1.00 0.00 C ATOM 959 CD1 ILE A 67 15.243 -15.028 -3.853 1.00 0.00 C ATOM 0 H ILE A 67 13.758 -10.618 -4.103 1.00 0.00 H new ATOM 0 HA ILE A 67 13.885 -12.255 -6.629 1.00 0.00 H new ATOM 0 HB ILE A 67 13.233 -13.167 -3.768 1.00 0.00 H new ATOM 0 HG12 ILE A 67 15.475 -13.951 -5.706 1.00 0.00 H new ATOM 0 HG13 ILE A 67 15.685 -12.961 -4.276 1.00 0.00 H new ATOM 0 HG21 ILE A 67 12.870 -15.385 -4.812 1.00 0.00 H new ATOM 0 HG22 ILE A 67 11.745 -14.178 -5.480 1.00 0.00 H new ATOM 0 HG23 ILE A 67 13.170 -14.683 -6.420 1.00 0.00 H new ATOM 0 HD11 ILE A 67 16.294 -15.314 -3.810 1.00 0.00 H new ATOM 0 HD12 ILE A 67 14.878 -14.832 -2.845 1.00 0.00 H new ATOM 0 HD13 ILE A 67 14.665 -15.838 -4.297 1.00 0.00 H new ATOM 971 N CYS A 68 11.764 -10.359 -5.544 1.00 0.00 N ATOM 972 CA CYS A 68 10.363 -9.858 -5.651 1.00 0.00 C ATOM 973 C CYS A 68 10.167 -9.084 -6.954 1.00 0.00 C ATOM 974 O CYS A 68 10.928 -8.192 -7.280 1.00 0.00 O ATOM 975 CB CYS A 68 10.186 -8.919 -4.457 1.00 0.00 C ATOM 976 SG CYS A 68 10.449 -9.830 -2.916 1.00 0.00 S ATOM 0 H CYS A 68 12.457 -9.652 -5.298 1.00 0.00 H new ATOM 0 HA CYS A 68 9.640 -10.674 -5.651 1.00 0.00 H new ATOM 0 HB2 CYS A 68 10.892 -8.091 -4.526 1.00 0.00 H new ATOM 0 HB3 CYS A 68 9.186 -8.486 -4.468 1.00 0.00 H new ATOM 981 N THR A 69 9.140 -9.411 -7.687 1.00 0.00 N ATOM 982 CA THR A 69 8.856 -8.696 -8.963 1.00 0.00 C ATOM 983 C THR A 69 7.348 -8.483 -9.086 1.00 0.00 C ATOM 984 O THR A 69 6.573 -9.269 -8.578 1.00 0.00 O ATOM 985 CB THR A 69 9.385 -9.616 -10.072 1.00 0.00 C ATOM 986 OG1 THR A 69 9.163 -9.005 -11.335 1.00 0.00 O ATOM 987 CG2 THR A 69 8.672 -10.971 -10.022 1.00 0.00 C ATOM 0 H THR A 69 8.478 -10.151 -7.454 1.00 0.00 H new ATOM 0 HA THR A 69 9.328 -7.715 -9.019 1.00 0.00 H new ATOM 0 HB THR A 69 10.453 -9.776 -9.924 1.00 0.00 H new ATOM 0 HG1 THR A 69 9.501 -9.589 -12.045 1.00 0.00 H new ATOM 0 HG21 THR A 69 9.057 -11.614 -10.814 1.00 0.00 H new ATOM 0 HG22 THR A 69 8.850 -11.441 -9.055 1.00 0.00 H new ATOM 0 HG23 THR A 69 7.601 -10.824 -10.162 1.00 0.00 H new ATOM 995 N GLY A 70 6.924 -7.435 -9.740 1.00 0.00 N ATOM 996 CA GLY A 70 5.458 -7.193 -9.873 1.00 0.00 C ATOM 997 C GLY A 70 5.202 -5.952 -10.722 1.00 0.00 C ATOM 998 O GLY A 70 6.104 -5.385 -11.308 1.00 0.00 O ATOM 0 H GLY A 70 7.524 -6.741 -10.185 1.00 0.00 H new ATOM 0 HA2 GLY A 70 4.979 -8.059 -10.329 1.00 0.00 H new ATOM 0 HA3 GLY A 70 5.012 -7.065 -8.886 1.00 0.00 H new ATOM 1002 N THR A 71 3.968 -5.533 -10.786 1.00 0.00 N ATOM 1003 CA THR A 71 3.613 -4.330 -11.586 1.00 0.00 C ATOM 1004 C THR A 71 3.094 -3.230 -10.660 1.00 0.00 C ATOM 1005 O THR A 71 2.797 -3.470 -9.508 1.00 0.00 O ATOM 1006 CB THR A 71 2.512 -4.798 -12.529 1.00 0.00 C ATOM 1007 OG1 THR A 71 3.003 -5.849 -13.348 1.00 0.00 O ATOM 1008 CG2 THR A 71 2.043 -3.639 -13.409 1.00 0.00 C ATOM 0 H THR A 71 3.183 -5.979 -10.312 1.00 0.00 H new ATOM 0 HA THR A 71 4.465 -3.920 -12.128 1.00 0.00 H new ATOM 0 HB THR A 71 1.669 -5.158 -11.939 1.00 0.00 H new ATOM 0 HG1 THR A 71 3.092 -5.530 -14.270 1.00 0.00 H new ATOM 0 HG21 THR A 71 1.256 -3.986 -14.079 1.00 0.00 H new ATOM 0 HG22 THR A 71 1.657 -2.837 -12.780 1.00 0.00 H new ATOM 0 HG23 THR A 71 2.882 -3.266 -13.997 1.00 0.00 H new ATOM 1016 N SER A 72 2.980 -2.034 -11.163 1.00 0.00 N ATOM 1017 CA SER A 72 2.470 -0.907 -10.328 1.00 0.00 C ATOM 1018 C SER A 72 1.643 0.045 -11.198 1.00 0.00 C ATOM 1019 O SER A 72 1.870 0.168 -12.386 1.00 0.00 O ATOM 1020 CB SER A 72 3.715 -0.205 -9.794 1.00 0.00 C ATOM 1021 OG SER A 72 4.449 0.346 -10.880 1.00 0.00 O ATOM 0 H SER A 72 3.219 -1.785 -12.123 1.00 0.00 H new ATOM 0 HA SER A 72 1.826 -1.247 -9.517 1.00 0.00 H new ATOM 0 HB2 SER A 72 3.431 0.583 -9.096 1.00 0.00 H new ATOM 0 HB3 SER A 72 4.336 -0.911 -9.242 1.00 0.00 H new ATOM 0 HG SER A 72 5.058 1.037 -10.546 1.00 0.00 H new ATOM 1027 N SER A 73 0.688 0.712 -10.611 1.00 0.00 N ATOM 1028 CA SER A 73 -0.167 1.659 -11.385 1.00 0.00 C ATOM 1029 C SER A 73 -0.271 2.989 -10.639 1.00 0.00 C ATOM 1030 O SER A 73 0.360 3.186 -9.618 1.00 0.00 O ATOM 1031 CB SER A 73 -1.536 0.985 -11.477 1.00 0.00 C ATOM 1032 OG SER A 73 -1.400 -0.263 -12.145 1.00 0.00 O ATOM 0 H SER A 73 0.461 0.642 -9.619 1.00 0.00 H new ATOM 0 HA SER A 73 0.241 1.873 -12.373 1.00 0.00 H new ATOM 0 HB2 SER A 73 -1.948 0.834 -10.479 1.00 0.00 H new ATOM 0 HB3 SER A 73 -2.234 1.625 -12.016 1.00 0.00 H new ATOM 0 HG SER A 73 -2.276 -0.699 -12.205 1.00 0.00 H new ATOM 1038 N GLY A 74 -1.059 3.906 -11.143 1.00 0.00 N ATOM 1039 CA GLY A 74 -1.206 5.236 -10.472 1.00 0.00 C ATOM 1040 C GLY A 74 -1.577 5.053 -8.993 1.00 0.00 C ATOM 1041 O GLY A 74 -0.808 5.388 -8.113 1.00 0.00 O ATOM 0 H GLY A 74 -1.609 3.791 -11.994 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -0.274 5.796 -10.553 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.975 5.822 -10.976 1.00 0.00 H new ATOM 1045 N ASN A 75 -2.747 4.531 -8.716 1.00 0.00 N ATOM 1046 CA ASN A 75 -3.164 4.335 -7.292 1.00 0.00 C ATOM 1047 C ASN A 75 -3.240 2.845 -6.922 1.00 0.00 C ATOM 1048 O ASN A 75 -3.736 2.496 -5.867 1.00 0.00 O ATOM 1049 CB ASN A 75 -4.550 4.974 -7.202 1.00 0.00 C ATOM 1050 CG ASN A 75 -4.437 6.479 -7.449 1.00 0.00 C ATOM 1051 OD1 ASN A 75 -3.435 7.086 -7.128 1.00 0.00 O ATOM 1052 ND2 ASN A 75 -5.431 7.112 -8.010 1.00 0.00 N ATOM 0 H ASN A 75 -3.430 4.233 -9.412 1.00 0.00 H new ATOM 0 HA ASN A 75 -2.447 4.780 -6.602 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -5.218 4.524 -7.936 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -4.984 4.788 -6.220 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -5.366 8.116 -8.179 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -6.273 6.603 -8.280 1.00 0.00 H new ATOM 1059 N GLN A 76 -2.769 1.962 -7.773 1.00 0.00 N ATOM 1060 CA GLN A 76 -2.836 0.510 -7.462 1.00 0.00 C ATOM 1061 C GLN A 76 -1.466 -0.151 -7.670 1.00 0.00 C ATOM 1062 O GLN A 76 -0.855 0.019 -8.703 1.00 0.00 O ATOM 1063 CB GLN A 76 -3.859 -0.018 -8.463 1.00 0.00 C ATOM 1064 CG GLN A 76 -4.061 -1.498 -8.236 1.00 0.00 C ATOM 1065 CD GLN A 76 -5.157 -2.020 -9.166 1.00 0.00 C ATOM 1066 OE1 GLN A 76 -6.163 -2.529 -8.713 1.00 0.00 O ATOM 1067 NE2 GLN A 76 -5.005 -1.914 -10.458 1.00 0.00 N ATOM 0 H GLN A 76 -2.341 2.192 -8.670 1.00 0.00 H new ATOM 0 HA GLN A 76 -3.112 0.303 -6.428 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -4.805 0.512 -8.348 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.515 0.162 -9.481 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -3.130 -2.034 -8.420 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -4.335 -1.682 -7.197 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -4.161 -1.487 -10.839 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -5.731 -2.258 -11.087 1.00 0.00 H new ATOM 1076 N VAL A 77 -0.973 -0.898 -6.702 1.00 0.00 N ATOM 1077 CA VAL A 77 0.356 -1.545 -6.874 1.00 0.00 C ATOM 1078 C VAL A 77 0.218 -3.079 -6.894 1.00 0.00 C ATOM 1079 O VAL A 77 -0.474 -3.661 -6.080 1.00 0.00 O ATOM 1080 CB VAL A 77 1.197 -1.077 -5.672 1.00 0.00 C ATOM 1081 CG1 VAL A 77 1.148 0.454 -5.540 1.00 0.00 C ATOM 1082 CG2 VAL A 77 0.705 -1.723 -4.366 1.00 0.00 C ATOM 0 H VAL A 77 -1.436 -1.081 -5.812 1.00 0.00 H new ATOM 0 HA VAL A 77 0.823 -1.270 -7.819 1.00 0.00 H new ATOM 0 HB VAL A 77 2.226 -1.389 -5.849 1.00 0.00 H new ATOM 0 HG11 VAL A 77 1.748 0.765 -4.685 1.00 0.00 H new ATOM 0 HG12 VAL A 77 1.545 0.910 -6.447 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.116 0.774 -5.394 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.317 -1.374 -3.534 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -0.335 -1.446 -4.192 1.00 0.00 H new ATOM 0 HG23 VAL A 77 0.783 -2.807 -4.444 1.00 0.00 H new ATOM 1092 N ASN A 78 0.872 -3.730 -7.820 1.00 0.00 N ATOM 1093 CA ASN A 78 0.789 -5.219 -7.899 1.00 0.00 C ATOM 1094 C ASN A 78 2.131 -5.864 -7.516 1.00 0.00 C ATOM 1095 O ASN A 78 3.108 -5.750 -8.232 1.00 0.00 O ATOM 1096 CB ASN A 78 0.458 -5.517 -9.364 1.00 0.00 C ATOM 1097 CG ASN A 78 0.161 -7.010 -9.520 1.00 0.00 C ATOM 1098 OD1 ASN A 78 0.660 -7.831 -8.777 1.00 0.00 O ATOM 1099 ND2 ASN A 78 -0.647 -7.372 -10.483 1.00 0.00 N ATOM 0 H ASN A 78 1.462 -3.293 -8.528 1.00 0.00 H new ATOM 0 HA ASN A 78 0.043 -5.620 -7.213 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -0.402 -4.928 -9.682 1.00 0.00 H new ATOM 0 HB3 ASN A 78 1.293 -5.232 -10.003 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -1.056 -6.668 -11.097 1.00 0.00 H new ATOM 1105 N LEU A 79 2.174 -6.561 -6.405 1.00 0.00 N ATOM 1106 CA LEU A 79 3.441 -7.242 -5.984 1.00 0.00 C ATOM 1107 C LEU A 79 3.294 -8.757 -6.186 1.00 0.00 C ATOM 1108 O LEU A 79 2.322 -9.350 -5.754 1.00 0.00 O ATOM 1109 CB LEU A 79 3.615 -6.916 -4.493 1.00 0.00 C ATOM 1110 CG LEU A 79 3.836 -5.408 -4.295 1.00 0.00 C ATOM 1111 CD1 LEU A 79 3.909 -5.082 -2.798 1.00 0.00 C ATOM 1112 CD2 LEU A 79 5.144 -4.989 -4.984 1.00 0.00 C ATOM 0 H LEU A 79 1.385 -6.688 -5.771 1.00 0.00 H new ATOM 0 HA LEU A 79 4.302 -6.909 -6.564 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.733 -7.236 -3.939 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.463 -7.470 -4.090 1.00 0.00 H new ATOM 0 HG LEU A 79 3.003 -4.861 -4.735 1.00 0.00 H new ATOM 0 HD11 LEU A 79 4.066 -4.011 -2.666 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.976 -5.374 -2.316 1.00 0.00 H new ATOM 0 HD13 LEU A 79 4.737 -5.628 -2.347 1.00 0.00 H new ATOM 0 HD21 LEU A 79 5.302 -3.920 -4.845 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.978 -5.539 -4.548 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.081 -5.211 -6.049 1.00 0.00 H new ATOM 1124 N THR A 80 4.241 -9.388 -6.843 1.00 0.00 N ATOM 1125 CA THR A 80 4.138 -10.863 -7.074 1.00 0.00 C ATOM 1126 C THR A 80 5.373 -11.585 -6.531 1.00 0.00 C ATOM 1127 O THR A 80 6.493 -11.149 -6.723 1.00 0.00 O ATOM 1128 CB THR A 80 4.049 -11.024 -8.594 1.00 0.00 C ATOM 1129 OG1 THR A 80 2.959 -10.260 -9.087 1.00 0.00 O ATOM 1130 CG2 THR A 80 3.837 -12.497 -8.938 1.00 0.00 C ATOM 0 H THR A 80 5.076 -8.946 -7.227 1.00 0.00 H new ATOM 0 HA THR A 80 3.276 -11.294 -6.564 1.00 0.00 H new ATOM 0 HB THR A 80 4.974 -10.674 -9.052 1.00 0.00 H new ATOM 0 HG1 THR A 80 2.902 -10.362 -10.060 1.00 0.00 H new ATOM 0 HG21 THR A 80 3.774 -12.612 -10.020 1.00 0.00 H new ATOM 0 HG22 THR A 80 4.674 -13.083 -8.559 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.912 -12.848 -8.481 1.00 0.00 H new ATOM 1138 N ILE A 81 5.173 -12.695 -5.865 1.00 0.00 N ATOM 1139 CA ILE A 81 6.328 -13.464 -5.314 1.00 0.00 C ATOM 1140 C ILE A 81 6.602 -14.689 -6.185 1.00 0.00 C ATOM 1141 O ILE A 81 5.690 -15.394 -6.576 1.00 0.00 O ATOM 1142 CB ILE A 81 5.891 -13.916 -3.914 1.00 0.00 C ATOM 1143 CG1 ILE A 81 5.671 -12.693 -3.021 1.00 0.00 C ATOM 1144 CG2 ILE A 81 6.976 -14.814 -3.296 1.00 0.00 C ATOM 1145 CD1 ILE A 81 4.956 -13.122 -1.736 1.00 0.00 C ATOM 0 H ILE A 81 4.256 -13.102 -5.679 1.00 0.00 H new ATOM 0 HA ILE A 81 7.237 -12.863 -5.286 1.00 0.00 H new ATOM 0 HB ILE A 81 4.960 -14.477 -3.994 1.00 0.00 H new ATOM 0 HG12 ILE A 81 6.627 -12.228 -2.780 1.00 0.00 H new ATOM 0 HG13 ILE A 81 5.077 -11.946 -3.548 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.662 -15.133 -2.302 1.00 0.00 H new ATOM 0 HG22 ILE A 81 7.126 -15.690 -3.927 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.910 -14.257 -3.220 1.00 0.00 H new ATOM 0 HD11 ILE A 81 4.799 -12.252 -1.099 1.00 0.00 H new ATOM 0 HD12 ILE A 81 3.993 -13.567 -1.987 1.00 0.00 H new ATOM 0 HD13 ILE A 81 5.567 -13.853 -1.207 1.00 0.00 H new ATOM 1157 N GLN A 82 7.852 -14.963 -6.457 1.00 0.00 N ATOM 1158 CA GLN A 82 8.189 -16.164 -7.265 1.00 0.00 C ATOM 1159 C GLN A 82 9.082 -17.104 -6.458 1.00 0.00 C ATOM 1160 O GLN A 82 10.166 -16.746 -6.036 1.00 0.00 O ATOM 1161 CB GLN A 82 8.934 -15.658 -8.491 1.00 0.00 C ATOM 1162 CG GLN A 82 7.981 -14.858 -9.379 1.00 0.00 C ATOM 1163 CD GLN A 82 8.756 -14.267 -10.558 1.00 0.00 C ATOM 1164 OE1 GLN A 82 9.834 -13.568 -10.330 1.00 0.00 O flip ATOM 1165 NE2 GLN A 82 8.377 -14.445 -11.699 1.00 0.00 N flip ATOM 0 H GLN A 82 8.650 -14.405 -6.153 1.00 0.00 H new ATOM 0 HA GLN A 82 7.294 -16.719 -7.546 1.00 0.00 H new ATOM 0 HB2 GLN A 82 9.773 -15.033 -8.186 1.00 0.00 H new ATOM 0 HB3 GLN A 82 9.348 -16.498 -9.049 1.00 0.00 H new ATOM 0 HG2 GLN A 82 7.180 -15.501 -9.743 1.00 0.00 H new ATOM 0 HG3 GLN A 82 7.512 -14.061 -8.802 1.00 0.00 H new ATOM 0 HE21 GLN A 82 7.534 -14.991 -11.877 1.00 0.00 H new ATOM 0 HE22 GLN A 82 8.902 -14.048 -12.478 1.00 0.00 H new ATOM 1174 N GLY A 83 8.629 -18.303 -6.255 1.00 0.00 N ATOM 1175 CA GLY A 83 9.428 -19.304 -5.485 1.00 0.00 C ATOM 1176 C GLY A 83 8.791 -19.533 -4.114 1.00 0.00 C ATOM 1177 O GLY A 83 9.476 -19.654 -3.116 1.00 0.00 O ATOM 0 H GLY A 83 7.728 -18.643 -6.592 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.477 -20.244 -6.035 1.00 0.00 H new ATOM 0 HA3 GLY A 83 10.452 -18.951 -5.366 1.00 0.00 H new ATOM 1181 N LEU A 84 7.485 -19.590 -4.058 1.00 0.00 N ATOM 1182 CA LEU A 84 6.794 -19.807 -2.752 1.00 0.00 C ATOM 1183 C LEU A 84 6.798 -21.284 -2.356 1.00 0.00 C ATOM 1184 O LEU A 84 6.557 -22.161 -3.163 1.00 0.00 O ATOM 1185 CB LEU A 84 5.362 -19.326 -2.969 1.00 0.00 C ATOM 1186 CG LEU A 84 5.350 -17.804 -3.064 1.00 0.00 C ATOM 1187 CD1 LEU A 84 3.985 -17.338 -3.564 1.00 0.00 C ATOM 1188 CD2 LEU A 84 5.613 -17.213 -1.678 1.00 0.00 C ATOM 0 H LEU A 84 6.866 -19.495 -4.863 1.00 0.00 H new ATOM 0 HA LEU A 84 7.296 -19.270 -1.947 1.00 0.00 H new ATOM 0 HB2 LEU A 84 4.954 -19.762 -3.881 1.00 0.00 H new ATOM 0 HB3 LEU A 84 4.727 -19.655 -2.147 1.00 0.00 H new ATOM 0 HG LEU A 84 6.123 -17.473 -3.757 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.975 -16.250 -3.633 1.00 0.00 H new ATOM 0 HD12 LEU A 84 3.793 -17.765 -4.548 1.00 0.00 H new ATOM 0 HD13 LEU A 84 3.212 -17.665 -2.869 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.606 -16.125 -1.739 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.836 -17.543 -0.988 1.00 0.00 H new ATOM 0 HD23 LEU A 84 6.585 -17.550 -1.317 1.00 0.00 H new ATOM 1200 N ARG A 85 7.048 -21.548 -1.105 1.00 0.00 N ATOM 1201 CA ARG A 85 7.052 -22.949 -0.599 1.00 0.00 C ATOM 1202 C ARG A 85 5.942 -23.099 0.443 1.00 0.00 C ATOM 1203 O ARG A 85 5.281 -22.137 0.788 1.00 0.00 O ATOM 1204 CB ARG A 85 8.423 -23.138 0.049 1.00 0.00 C ATOM 1205 CG ARG A 85 9.512 -23.003 -1.016 1.00 0.00 C ATOM 1206 CD ARG A 85 10.830 -23.548 -0.466 1.00 0.00 C ATOM 1207 NE ARG A 85 11.837 -23.278 -1.537 1.00 0.00 N ATOM 1208 CZ ARG A 85 11.946 -24.059 -2.595 1.00 0.00 C ATOM 1209 NH1 ARG A 85 11.155 -25.092 -2.774 1.00 0.00 N ATOM 1210 NH2 ARG A 85 12.855 -23.792 -3.492 1.00 0.00 N ATOM 0 H ARG A 85 7.253 -20.840 -0.400 1.00 0.00 H new ATOM 0 HA ARG A 85 6.879 -23.686 -1.384 1.00 0.00 H new ATOM 0 HB2 ARG A 85 8.572 -22.396 0.833 1.00 0.00 H new ATOM 0 HB3 ARG A 85 8.482 -24.118 0.522 1.00 0.00 H new ATOM 0 HG2 ARG A 85 9.227 -23.549 -1.915 1.00 0.00 H new ATOM 0 HG3 ARG A 85 9.629 -21.958 -1.302 1.00 0.00 H new ATOM 0 HD2 ARG A 85 11.103 -23.054 0.466 1.00 0.00 H new ATOM 0 HD3 ARG A 85 10.758 -24.614 -0.252 1.00 0.00 H new ATOM 0 HE ARG A 85 12.454 -22.471 -1.448 1.00 0.00 H new ATOM 0 HH11 ARG A 85 10.434 -25.307 -2.086 1.00 0.00 H new ATOM 0 HH12 ARG A 85 11.262 -25.679 -3.601 1.00 0.00 H new ATOM 0 HH21 ARG A 85 13.471 -22.988 -3.371 1.00 0.00 H new ATOM 0 HH22 ARG A 85 12.950 -24.387 -4.315 1.00 0.00 H new ATOM 1224 N ALA A 86 5.733 -24.286 0.953 1.00 0.00 N ATOM 1225 CA ALA A 86 4.661 -24.479 1.982 1.00 0.00 C ATOM 1226 C ALA A 86 4.953 -23.600 3.203 1.00 0.00 C ATOM 1227 O ALA A 86 4.068 -22.981 3.763 1.00 0.00 O ATOM 1228 CB ALA A 86 4.724 -25.961 2.360 1.00 0.00 C ATOM 0 H ALA A 86 6.254 -25.127 0.705 1.00 0.00 H new ATOM 0 HA ALA A 86 3.674 -24.202 1.610 1.00 0.00 H new ATOM 0 HB1 ALA A 86 3.965 -26.177 3.112 1.00 0.00 H new ATOM 0 HB2 ALA A 86 4.542 -26.570 1.475 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.710 -26.192 2.763 1.00 0.00 H new ATOM 1234 N MET A 87 6.194 -23.543 3.608 1.00 0.00 N ATOM 1235 CA MET A 87 6.574 -22.707 4.787 1.00 0.00 C ATOM 1236 C MET A 87 6.305 -21.223 4.510 1.00 0.00 C ATOM 1237 O MET A 87 5.876 -20.488 5.379 1.00 0.00 O ATOM 1238 CB MET A 87 8.074 -22.947 4.977 1.00 0.00 C ATOM 1239 CG MET A 87 8.557 -22.211 6.228 1.00 0.00 C ATOM 1240 SD MET A 87 10.350 -22.401 6.385 1.00 0.00 S ATOM 1241 CE MET A 87 10.355 -24.154 6.832 1.00 0.00 C ATOM 0 H MET A 87 6.967 -24.043 3.170 1.00 0.00 H new ATOM 0 HA MET A 87 5.997 -22.971 5.673 1.00 0.00 H new ATOM 0 HB2 MET A 87 8.273 -24.015 5.071 1.00 0.00 H new ATOM 0 HB3 MET A 87 8.622 -22.597 4.102 1.00 0.00 H new ATOM 0 HG2 MET A 87 8.297 -21.154 6.165 1.00 0.00 H new ATOM 0 HG3 MET A 87 8.059 -22.609 7.112 1.00 0.00 H new ATOM 0 HE1 MET A 87 11.269 -24.387 7.379 1.00 0.00 H new ATOM 0 HE2 MET A 87 9.491 -24.372 7.459 1.00 0.00 H new ATOM 0 HE3 MET A 87 10.309 -24.760 5.927 1.00 0.00 H new ATOM 1251 N ASP A 88 6.572 -20.780 3.309 1.00 0.00 N ATOM 1252 CA ASP A 88 6.356 -19.338 2.964 1.00 0.00 C ATOM 1253 C ASP A 88 4.889 -18.939 3.146 1.00 0.00 C ATOM 1254 O ASP A 88 4.582 -17.778 3.343 1.00 0.00 O ATOM 1255 CB ASP A 88 6.763 -19.206 1.497 1.00 0.00 C ATOM 1256 CG ASP A 88 8.260 -19.503 1.346 1.00 0.00 C ATOM 1257 OD1 ASP A 88 8.993 -19.280 2.297 1.00 0.00 O ATOM 1258 OD2 ASP A 88 8.647 -19.950 0.279 1.00 0.00 O ATOM 0 H ASP A 88 6.932 -21.355 2.547 1.00 0.00 H new ATOM 0 HA ASP A 88 6.938 -18.684 3.613 1.00 0.00 H new ATOM 0 HB2 ASP A 88 6.182 -19.896 0.885 1.00 0.00 H new ATOM 0 HB3 ASP A 88 6.544 -18.200 1.138 1.00 0.00 H new ATOM 1263 N THR A 89 3.977 -19.884 3.084 1.00 0.00 N ATOM 1264 CA THR A 89 2.532 -19.556 3.254 1.00 0.00 C ATOM 1265 C THR A 89 2.322 -18.762 4.541 1.00 0.00 C ATOM 1266 O THR A 89 2.912 -19.055 5.564 1.00 0.00 O ATOM 1267 CB THR A 89 1.821 -20.891 3.329 1.00 0.00 C ATOM 1268 OG1 THR A 89 2.209 -21.701 2.228 1.00 0.00 O ATOM 1269 CG2 THR A 89 0.310 -20.670 3.298 1.00 0.00 C ATOM 0 H THR A 89 4.178 -20.871 2.922 1.00 0.00 H new ATOM 0 HA THR A 89 2.152 -18.945 2.436 1.00 0.00 H new ATOM 0 HB THR A 89 2.092 -21.393 4.258 1.00 0.00 H new ATOM 0 HG1 THR A 89 2.902 -22.332 2.514 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.200 -21.632 3.352 1.00 0.00 H new ATOM 0 HG22 THR A 89 0.015 -20.055 4.148 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.035 -20.165 2.372 1.00 0.00 H new ATOM 1277 N GLY A 90 1.504 -17.754 4.485 1.00 0.00 N ATOM 1278 CA GLY A 90 1.268 -16.918 5.703 1.00 0.00 C ATOM 1279 C GLY A 90 0.794 -15.521 5.299 1.00 0.00 C ATOM 1280 O GLY A 90 0.369 -15.303 4.183 1.00 0.00 O ATOM 0 H GLY A 90 0.987 -17.468 3.654 1.00 0.00 H new ATOM 0 HA2 GLY A 90 0.522 -17.393 6.341 1.00 0.00 H new ATOM 0 HA3 GLY A 90 2.186 -16.844 6.286 1.00 0.00 H new ATOM 1284 N LEU A 91 0.847 -14.580 6.213 1.00 0.00 N ATOM 1285 CA LEU A 91 0.373 -13.198 5.909 1.00 0.00 C ATOM 1286 C LEU A 91 1.474 -12.311 5.317 1.00 0.00 C ATOM 1287 O LEU A 91 2.519 -12.108 5.908 1.00 0.00 O ATOM 1288 CB LEU A 91 -0.076 -12.633 7.259 1.00 0.00 C ATOM 1289 CG LEU A 91 -0.682 -11.239 7.057 1.00 0.00 C ATOM 1290 CD1 LEU A 91 -2.118 -11.373 6.556 1.00 0.00 C ATOM 1291 CD2 LEU A 91 -0.673 -10.479 8.381 1.00 0.00 C ATOM 0 H LEU A 91 1.201 -14.714 7.160 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.420 -13.221 5.162 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.810 -13.297 7.717 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.772 -12.577 7.941 1.00 0.00 H new ATOM 0 HG LEU A 91 -0.091 -10.692 6.322 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -2.547 -10.381 6.413 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -2.124 -11.911 5.608 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -2.709 -11.922 7.289 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -1.104 -9.489 8.235 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.261 -11.026 9.118 1.00 0.00 H new ATOM 0 HD23 LEU A 91 0.353 -10.379 8.736 1.00 0.00 H new ATOM 1303 N TYR A 92 1.196 -11.724 4.181 1.00 0.00 N ATOM 1304 CA TYR A 92 2.156 -10.774 3.554 1.00 0.00 C ATOM 1305 C TYR A 92 1.593 -9.366 3.728 1.00 0.00 C ATOM 1306 O TYR A 92 0.411 -9.204 3.959 1.00 0.00 O ATOM 1307 CB TYR A 92 2.238 -11.162 2.077 1.00 0.00 C ATOM 1308 CG TYR A 92 3.218 -12.298 1.917 1.00 0.00 C ATOM 1309 CD1 TYR A 92 2.795 -13.643 2.094 1.00 0.00 C ATOM 1310 CD2 TYR A 92 4.571 -12.014 1.591 1.00 0.00 C ATOM 1311 CE1 TYR A 92 3.729 -14.704 1.944 1.00 0.00 C ATOM 1312 CE2 TYR A 92 5.505 -13.073 1.441 1.00 0.00 C ATOM 1313 CZ TYR A 92 5.084 -14.419 1.617 1.00 0.00 C ATOM 1314 OH TYR A 92 5.990 -15.450 1.472 1.00 0.00 O ATOM 0 H TYR A 92 0.333 -11.866 3.657 1.00 0.00 H new ATOM 0 HA TYR A 92 3.150 -10.806 4.000 1.00 0.00 H new ATOM 0 HB2 TYR A 92 1.255 -11.459 1.712 1.00 0.00 H new ATOM 0 HB3 TYR A 92 2.554 -10.306 1.481 1.00 0.00 H new ATOM 0 HD1 TYR A 92 1.766 -13.859 2.342 1.00 0.00 H new ATOM 0 HD2 TYR A 92 4.890 -10.991 1.457 1.00 0.00 H new ATOM 0 HE1 TYR A 92 3.410 -15.727 2.078 1.00 0.00 H new ATOM 0 HE2 TYR A 92 6.534 -12.856 1.194 1.00 0.00 H new ATOM 0 HH TYR A 92 5.697 -16.220 2.002 1.00 0.00 H new ATOM 1324 N ILE A 93 2.416 -8.354 3.662 1.00 0.00 N ATOM 1325 CA ILE A 93 1.902 -6.969 3.876 1.00 0.00 C ATOM 1326 C ILE A 93 2.217 -6.062 2.694 1.00 0.00 C ATOM 1327 O ILE A 93 3.303 -6.084 2.169 1.00 0.00 O ATOM 1328 CB ILE A 93 2.636 -6.473 5.129 1.00 0.00 C ATOM 1329 CG1 ILE A 93 2.135 -7.240 6.351 1.00 0.00 C ATOM 1330 CG2 ILE A 93 2.378 -4.969 5.352 1.00 0.00 C ATOM 1331 CD1 ILE A 93 2.995 -8.479 6.603 1.00 0.00 C ATOM 0 H ILE A 93 3.415 -8.424 3.471 1.00 0.00 H new ATOM 0 HA ILE A 93 0.817 -6.960 3.985 1.00 0.00 H new ATOM 0 HB ILE A 93 3.704 -6.637 4.988 1.00 0.00 H new ATOM 0 HG12 ILE A 93 2.157 -6.592 7.227 1.00 0.00 H new ATOM 0 HG13 ILE A 93 1.097 -7.537 6.200 1.00 0.00 H new ATOM 0 HG21 ILE A 93 2.907 -4.638 6.245 1.00 0.00 H new ATOM 0 HG22 ILE A 93 2.735 -4.407 4.489 1.00 0.00 H new ATOM 0 HG23 ILE A 93 1.309 -4.798 5.479 1.00 0.00 H new ATOM 0 HD11 ILE A 93 2.620 -9.010 7.478 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.951 -9.135 5.734 1.00 0.00 H new ATOM 0 HD13 ILE A 93 4.027 -8.176 6.777 1.00 0.00 H new ATOM 1343 N CYS A 94 1.290 -5.219 2.329 1.00 0.00 N ATOM 1344 CA CYS A 94 1.557 -4.250 1.241 1.00 0.00 C ATOM 1345 C CYS A 94 1.921 -2.922 1.905 1.00 0.00 C ATOM 1346 O CYS A 94 1.268 -2.483 2.834 1.00 0.00 O ATOM 1347 CB CYS A 94 0.264 -4.148 0.431 1.00 0.00 C ATOM 1348 SG CYS A 94 -0.959 -3.146 1.315 1.00 0.00 S ATOM 0 H CYS A 94 0.359 -5.163 2.741 1.00 0.00 H new ATOM 0 HA CYS A 94 2.373 -4.541 0.579 1.00 0.00 H new ATOM 0 HB2 CYS A 94 0.472 -3.704 -0.543 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -0.137 -5.145 0.248 1.00 0.00 H new ATOM 1353 N LYS A 95 2.962 -2.293 1.448 1.00 0.00 N ATOM 1354 CA LYS A 95 3.399 -1.008 2.041 1.00 0.00 C ATOM 1355 C LYS A 95 3.730 -0.085 0.901 1.00 0.00 C ATOM 1356 O LYS A 95 4.517 -0.425 0.051 1.00 0.00 O ATOM 1357 CB LYS A 95 4.658 -1.336 2.839 1.00 0.00 C ATOM 1358 CG LYS A 95 5.143 -0.086 3.585 1.00 0.00 C ATOM 1359 CD LYS A 95 5.246 -0.404 5.070 1.00 0.00 C ATOM 1360 CE LYS A 95 5.784 0.814 5.828 1.00 0.00 C ATOM 1361 NZ LYS A 95 5.886 0.374 7.249 1.00 0.00 N ATOM 0 H LYS A 95 3.538 -2.623 0.674 1.00 0.00 H new ATOM 0 HA LYS A 95 2.648 -0.539 2.677 1.00 0.00 H new ATOM 0 HB2 LYS A 95 4.451 -2.137 3.549 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.439 -1.697 2.170 1.00 0.00 H new ATOM 0 HG2 LYS A 95 6.112 0.230 3.200 1.00 0.00 H new ATOM 0 HG3 LYS A 95 4.451 0.741 3.424 1.00 0.00 H new ATOM 0 HD2 LYS A 95 4.267 -0.683 5.460 1.00 0.00 H new ATOM 0 HD3 LYS A 95 5.905 -1.259 5.223 1.00 0.00 H new ATOM 0 HE2 LYS A 95 6.755 1.122 5.440 1.00 0.00 H new ATOM 0 HE3 LYS A 95 5.115 1.668 5.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 5.846 1.205 7.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 5.097 -0.265 7.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 6.787 -0.125 7.394 1.00 0.00 H new ATOM 1375 N VAL A 96 3.108 1.035 0.850 1.00 0.00 N ATOM 1376 CA VAL A 96 3.346 1.979 -0.255 1.00 0.00 C ATOM 1377 C VAL A 96 3.566 3.375 0.318 1.00 0.00 C ATOM 1378 O VAL A 96 2.712 3.929 0.999 1.00 0.00 O ATOM 1379 CB VAL A 96 2.081 1.847 -1.103 1.00 0.00 C ATOM 1380 CG1 VAL A 96 0.826 1.957 -0.233 1.00 0.00 C ATOM 1381 CG2 VAL A 96 2.064 2.903 -2.214 1.00 0.00 C ATOM 0 H VAL A 96 2.427 1.348 1.542 1.00 0.00 H new ATOM 0 HA VAL A 96 4.234 1.781 -0.855 1.00 0.00 H new ATOM 0 HB VAL A 96 2.085 0.861 -1.567 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -0.061 1.860 -0.859 1.00 0.00 H new ATOM 0 HG12 VAL A 96 0.831 1.164 0.514 1.00 0.00 H new ATOM 0 HG13 VAL A 96 0.813 2.926 0.266 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.156 2.793 -2.807 1.00 0.00 H new ATOM 0 HG22 VAL A 96 2.089 3.898 -1.770 1.00 0.00 H new ATOM 0 HG23 VAL A 96 2.935 2.770 -2.856 1.00 0.00 H new ATOM 1391 N GLU A 97 4.734 3.925 0.080 1.00 0.00 N ATOM 1392 CA GLU A 97 5.054 5.267 0.636 1.00 0.00 C ATOM 1393 C GLU A 97 5.811 6.140 -0.360 1.00 0.00 C ATOM 1394 O GLU A 97 6.687 5.679 -1.065 1.00 0.00 O ATOM 1395 CB GLU A 97 5.973 4.980 1.829 1.00 0.00 C ATOM 1396 CG GLU A 97 5.228 4.162 2.906 1.00 0.00 C ATOM 1397 CD GLU A 97 3.900 4.835 3.280 1.00 0.00 C ATOM 1398 OE1 GLU A 97 3.846 6.052 3.258 1.00 0.00 O ATOM 1399 OE2 GLU A 97 2.957 4.116 3.558 1.00 0.00 O ATOM 0 H GLU A 97 5.475 3.498 -0.476 1.00 0.00 H new ATOM 0 HA GLU A 97 4.141 5.803 0.894 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.853 4.432 1.493 1.00 0.00 H new ATOM 0 HB3 GLU A 97 6.326 5.918 2.257 1.00 0.00 H new ATOM 0 HG2 GLU A 97 5.039 3.154 2.537 1.00 0.00 H new ATOM 0 HG3 GLU A 97 5.854 4.065 3.793 1.00 0.00 H new ATOM 1406 N LEU A 98 5.511 7.405 -0.362 1.00 0.00 N ATOM 1407 CA LEU A 98 6.238 8.363 -1.237 1.00 0.00 C ATOM 1408 C LEU A 98 7.399 8.851 -0.385 1.00 0.00 C ATOM 1409 O LEU A 98 7.299 9.878 0.269 1.00 0.00 O ATOM 1410 CB LEU A 98 5.233 9.507 -1.518 1.00 0.00 C ATOM 1411 CG LEU A 98 3.814 8.961 -1.792 1.00 0.00 C ATOM 1412 CD1 LEU A 98 2.949 10.062 -2.404 1.00 0.00 C ATOM 1413 CD2 LEU A 98 3.877 7.764 -2.748 1.00 0.00 C ATOM 0 H LEU A 98 4.781 7.823 0.215 1.00 0.00 H new ATOM 0 HA LEU A 98 6.603 7.958 -2.181 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.204 10.185 -0.665 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.572 10.088 -2.376 1.00 0.00 H new ATOM 0 HG LEU A 98 3.376 8.634 -0.849 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.949 9.674 -2.596 1.00 0.00 H new ATOM 0 HD12 LEU A 98 2.886 10.902 -1.712 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.395 10.396 -3.341 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.869 7.391 -2.931 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.326 8.075 -3.691 1.00 0.00 H new ATOM 0 HD23 LEU A 98 4.481 6.974 -2.302 1.00 0.00 H new ATOM 1425 N MET A 99 8.462 8.094 -0.319 1.00 0.00 N ATOM 1426 CA MET A 99 9.569 8.479 0.609 1.00 0.00 C ATOM 1427 C MET A 99 10.488 9.577 0.038 1.00 0.00 C ATOM 1428 O MET A 99 10.782 10.555 0.720 1.00 0.00 O ATOM 1429 CB MET A 99 10.355 7.192 0.829 1.00 0.00 C ATOM 1430 CG MET A 99 11.378 7.390 1.952 1.00 0.00 C ATOM 1431 SD MET A 99 11.312 5.969 3.071 1.00 0.00 S ATOM 1432 CE MET A 99 9.625 6.216 3.679 1.00 0.00 C ATOM 0 H MET A 99 8.612 7.240 -0.856 1.00 0.00 H new ATOM 0 HA MET A 99 9.166 8.902 1.529 1.00 0.00 H new ATOM 0 HB2 MET A 99 9.675 6.380 1.084 1.00 0.00 H new ATOM 0 HB3 MET A 99 10.864 6.905 -0.091 1.00 0.00 H new ATOM 0 HG2 MET A 99 12.379 7.493 1.534 1.00 0.00 H new ATOM 0 HG3 MET A 99 11.164 8.309 2.498 1.00 0.00 H new ATOM 0 HE1 MET A 99 9.568 5.919 4.726 1.00 0.00 H new ATOM 0 HE2 MET A 99 9.355 7.268 3.585 1.00 0.00 H new ATOM 0 HE3 MET A 99 8.934 5.610 3.092 1.00 0.00 H new ATOM 1442 N TYR A 100 10.944 9.429 -1.161 1.00 0.00 N ATOM 1443 CA TYR A 100 11.878 10.443 -1.773 1.00 0.00 C ATOM 1444 C TYR A 100 11.221 11.806 -2.131 1.00 0.00 C ATOM 1445 O TYR A 100 11.838 12.809 -1.914 1.00 0.00 O ATOM 1446 CB TYR A 100 12.393 9.765 -3.042 1.00 0.00 C ATOM 1447 CG TYR A 100 13.350 8.653 -2.682 1.00 0.00 C ATOM 1448 CD1 TYR A 100 12.859 7.344 -2.427 1.00 0.00 C ATOM 1449 CD2 TYR A 100 14.741 8.925 -2.605 1.00 0.00 C ATOM 1450 CE1 TYR A 100 13.764 6.306 -2.088 1.00 0.00 C ATOM 1451 CE2 TYR A 100 15.644 7.893 -2.265 1.00 0.00 C ATOM 1452 CZ TYR A 100 15.154 6.579 -2.010 1.00 0.00 C ATOM 1453 OH TYR A 100 16.038 5.571 -1.698 1.00 0.00 O ATOM 0 H TYR A 100 10.716 8.641 -1.767 1.00 0.00 H new ATOM 0 HA TYR A 100 12.653 10.706 -1.053 1.00 0.00 H new ATOM 0 HB2 TYR A 100 11.557 9.365 -3.615 1.00 0.00 H new ATOM 0 HB3 TYR A 100 12.894 10.496 -3.677 1.00 0.00 H new ATOM 0 HD1 TYR A 100 11.800 7.140 -2.491 1.00 0.00 H new ATOM 0 HD2 TYR A 100 15.109 9.920 -2.806 1.00 0.00 H new ATOM 0 HE1 TYR A 100 13.396 5.310 -1.890 1.00 0.00 H new ATOM 0 HE2 TYR A 100 16.702 8.099 -2.199 1.00 0.00 H new ATOM 0 HH TYR A 100 16.951 5.928 -1.687 1.00 0.00 H new ATOM 1463 N PRO A 101 10.037 11.803 -2.683 1.00 0.00 N ATOM 1464 CA PRO A 101 9.374 13.078 -3.133 1.00 0.00 C ATOM 1465 C PRO A 101 8.611 13.697 -1.955 1.00 0.00 C ATOM 1466 O PRO A 101 7.767 13.062 -1.417 1.00 0.00 O ATOM 1467 CB PRO A 101 8.386 12.587 -4.179 1.00 0.00 C ATOM 1468 CG PRO A 101 8.048 11.168 -3.802 1.00 0.00 C ATOM 1469 CD PRO A 101 9.181 10.619 -2.965 1.00 0.00 C ATOM 0 HA PRO A 101 10.069 13.831 -3.505 1.00 0.00 H new ATOM 0 HB2 PRO A 101 7.492 13.210 -4.193 1.00 0.00 H new ATOM 0 HB3 PRO A 101 8.821 12.632 -5.177 1.00 0.00 H new ATOM 0 HG2 PRO A 101 7.113 11.136 -3.244 1.00 0.00 H new ATOM 0 HG3 PRO A 101 7.907 10.561 -4.696 1.00 0.00 H new ATOM 0 HD2 PRO A 101 8.812 10.166 -2.044 1.00 0.00 H new ATOM 0 HD3 PRO A 101 9.734 9.847 -3.501 1.00 0.00 H new ATOM 1477 N PRO A 102 8.976 14.918 -1.568 1.00 0.00 N ATOM 1478 CA PRO A 102 8.311 15.626 -0.388 1.00 0.00 C ATOM 1479 C PRO A 102 6.930 16.369 -1.004 1.00 0.00 C ATOM 1480 O PRO A 102 7.030 16.661 -2.034 1.00 0.00 O ATOM 1481 CB PRO A 102 9.410 16.637 -0.014 1.00 0.00 C ATOM 1482 CG PRO A 102 10.193 16.935 -1.270 1.00 0.00 C ATOM 1483 CD PRO A 102 9.954 15.830 -2.259 1.00 0.00 C ATOM 0 HA PRO A 102 7.998 15.022 0.464 1.00 0.00 H new ATOM 0 HB2 PRO A 102 8.971 17.549 0.391 1.00 0.00 H new ATOM 0 HB3 PRO A 102 10.062 16.228 0.757 1.00 0.00 H new ATOM 0 HG2 PRO A 102 9.884 17.892 -1.690 1.00 0.00 H new ATOM 0 HG3 PRO A 102 11.256 17.016 -1.043 1.00 0.00 H new ATOM 0 HD2 PRO A 102 9.547 16.214 -3.194 1.00 0.00 H new ATOM 0 HD3 PRO A 102 10.879 15.309 -2.504 1.00 0.00 H new ATOM 1491 N PRO A 103 5.895 16.775 -0.116 1.00 0.00 N ATOM 1492 CA PRO A 103 6.378 16.058 1.144 1.00 0.00 C ATOM 1493 C PRO A 103 5.912 14.617 1.279 1.00 0.00 C ATOM 1494 O PRO A 103 5.162 14.185 0.498 1.00 0.00 O ATOM 1495 CB PRO A 103 5.999 17.002 2.380 1.00 0.00 C ATOM 1496 CG PRO A 103 4.919 17.752 1.794 1.00 0.00 C ATOM 1497 CD PRO A 103 4.559 16.940 0.570 1.00 0.00 C ATOM 0 HA PRO A 103 7.458 15.918 1.098 1.00 0.00 H new ATOM 0 HB2 PRO A 103 5.686 16.436 3.257 1.00 0.00 H new ATOM 0 HB3 PRO A 103 6.829 17.637 2.690 1.00 0.00 H new ATOM 0 HG2 PRO A 103 4.075 17.845 2.478 1.00 0.00 H new ATOM 0 HG3 PRO A 103 5.228 18.763 1.530 1.00 0.00 H new ATOM 0 HD2 PRO A 103 4.118 15.979 0.835 1.00 0.00 H new ATOM 0 HD3 PRO A 103 3.839 17.458 -0.063 1.00 0.00 H new ATOM 1505 N TYR A 104 6.314 13.845 2.236 1.00 0.00 N ATOM 1506 CA TYR A 104 5.797 12.408 2.316 1.00 0.00 C ATOM 1507 C TYR A 104 4.382 12.233 2.939 1.00 0.00 C ATOM 1508 O TYR A 104 4.108 12.702 4.021 1.00 0.00 O ATOM 1509 CB TYR A 104 6.842 11.837 3.235 1.00 0.00 C ATOM 1510 CG TYR A 104 6.666 10.404 3.493 1.00 0.00 C ATOM 1511 CD1 TYR A 104 5.955 9.580 2.561 1.00 0.00 C ATOM 1512 CD2 TYR A 104 7.149 9.887 4.696 1.00 0.00 C ATOM 1513 CE1 TYR A 104 5.762 8.220 2.847 1.00 0.00 C ATOM 1514 CE2 TYR A 104 6.972 8.511 4.979 1.00 0.00 C ATOM 1515 CZ TYR A 104 6.239 7.686 4.066 1.00 0.00 C ATOM 1516 OH TYR A 104 6.032 6.363 4.349 1.00 0.00 O ATOM 0 H TYR A 104 6.968 14.116 2.970 1.00 0.00 H new ATOM 0 HA TYR A 104 5.671 11.950 1.335 1.00 0.00 H new ATOM 0 HB2 TYR A 104 7.828 12.003 2.801 1.00 0.00 H new ATOM 0 HB3 TYR A 104 6.817 12.376 4.182 1.00 0.00 H new ATOM 0 HD1 TYR A 104 5.570 10.003 1.645 1.00 0.00 H new ATOM 0 HD2 TYR A 104 7.652 10.529 5.403 1.00 0.00 H new ATOM 0 HE1 TYR A 104 5.251 7.584 2.139 1.00 0.00 H new ATOM 0 HE2 TYR A 104 7.388 8.085 5.880 1.00 0.00 H new ATOM 0 HH TYR A 104 5.087 6.219 4.565 1.00 0.00 H new ATOM 1526 N TYR A 105 3.510 11.458 2.309 1.00 0.00 N ATOM 1527 CA TYR A 105 2.179 11.173 2.926 1.00 0.00 C ATOM 1528 C TYR A 105 1.518 9.973 2.296 1.00 0.00 C ATOM 1529 O TYR A 105 1.017 10.056 1.204 1.00 0.00 O ATOM 1530 CB TYR A 105 1.273 12.389 2.764 1.00 0.00 C ATOM 1531 CG TYR A 105 1.301 12.893 1.368 1.00 0.00 C ATOM 1532 CD1 TYR A 105 2.345 13.735 0.966 1.00 0.00 C ATOM 1533 CD2 TYR A 105 0.284 12.509 0.458 1.00 0.00 C ATOM 1534 CE1 TYR A 105 2.398 14.210 -0.365 1.00 0.00 C ATOM 1535 CE2 TYR A 105 0.326 12.978 -0.884 1.00 0.00 C ATOM 1536 CZ TYR A 105 1.394 13.833 -1.297 1.00 0.00 C ATOM 1537 OH TYR A 105 1.449 14.305 -2.589 1.00 0.00 O ATOM 0 H TYR A 105 3.671 11.019 1.402 1.00 0.00 H new ATOM 0 HA TYR A 105 2.339 10.956 3.982 1.00 0.00 H new ATOM 0 HB2 TYR A 105 0.252 12.125 3.038 1.00 0.00 H new ATOM 0 HB3 TYR A 105 1.592 13.178 3.445 1.00 0.00 H new ATOM 0 HD1 TYR A 105 3.110 14.022 1.672 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -0.519 11.863 0.782 1.00 0.00 H new ATOM 0 HE1 TYR A 105 3.203 14.860 -0.674 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -0.443 12.690 -1.585 1.00 0.00 H new ATOM 0 HH TYR A 105 0.690 13.953 -3.099 1.00 0.00 H new ATOM 1547 N LEU A 106 1.452 8.863 2.987 1.00 0.00 N ATOM 1548 CA LEU A 106 0.751 7.674 2.383 1.00 0.00 C ATOM 1549 C LEU A 106 0.277 6.683 3.466 1.00 0.00 C ATOM 1550 O LEU A 106 -0.118 7.094 4.546 1.00 0.00 O ATOM 1551 CB LEU A 106 1.774 7.053 1.418 1.00 0.00 C ATOM 1552 CG LEU A 106 1.117 6.788 0.055 1.00 0.00 C ATOM 1553 CD1 LEU A 106 0.662 8.108 -0.575 1.00 0.00 C ATOM 1554 CD2 LEU A 106 2.128 6.090 -0.868 1.00 0.00 C ATOM 0 H LEU A 106 1.840 8.723 3.920 1.00 0.00 H new ATOM 0 HA LEU A 106 -0.160 7.959 1.857 1.00 0.00 H new ATOM 0 HB2 LEU A 106 2.625 7.723 1.297 1.00 0.00 H new ATOM 0 HB3 LEU A 106 2.159 6.121 1.833 1.00 0.00 H new ATOM 0 HG LEU A 106 0.246 6.147 0.193 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.198 7.909 -1.541 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -0.060 8.595 0.081 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.524 8.761 -0.714 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.666 5.900 -1.837 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.001 6.729 -1.002 1.00 0.00 H new ATOM 0 HD23 LEU A 106 2.436 5.145 -0.421 1.00 0.00 H new ATOM 1566 N GLY A 108 0.260 5.392 3.191 1.00 0.00 N ATOM 1567 CA GLY A 108 -0.246 4.437 4.238 1.00 0.00 C ATOM 1568 C GLY A 108 0.224 2.996 3.982 1.00 0.00 C ATOM 1569 O GLY A 108 0.767 2.679 2.943 1.00 0.00 O ATOM 0 H GLY A 108 0.565 4.969 2.314 1.00 0.00 H new ATOM 0 HA2 GLY A 108 0.098 4.761 5.220 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -1.335 4.465 4.257 1.00 0.00 H new ATOM 1573 N ILE A 109 0.017 2.122 4.946 1.00 0.00 N ATOM 1574 CA ILE A 109 0.442 0.696 4.806 1.00 0.00 C ATOM 1575 C ILE A 109 -0.796 -0.218 4.851 1.00 0.00 C ATOM 1576 O ILE A 109 -1.829 0.156 5.368 1.00 0.00 O ATOM 1577 CB ILE A 109 1.341 0.425 6.030 1.00 0.00 C ATOM 1578 CG1 ILE A 109 2.660 1.179 5.892 1.00 0.00 C ATOM 1579 CG2 ILE A 109 1.644 -1.069 6.176 1.00 0.00 C ATOM 1580 CD1 ILE A 109 2.446 2.631 6.287 1.00 0.00 C ATOM 0 H ILE A 109 -0.435 2.345 5.833 1.00 0.00 H new ATOM 0 HA ILE A 109 0.961 0.507 3.866 1.00 0.00 H new ATOM 0 HB ILE A 109 0.803 0.768 6.914 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.421 0.725 6.527 1.00 0.00 H new ATOM 0 HG13 ILE A 109 3.023 1.118 4.866 1.00 0.00 H new ATOM 0 HG21 ILE A 109 2.279 -1.228 7.047 1.00 0.00 H new ATOM 0 HG22 ILE A 109 0.711 -1.619 6.302 1.00 0.00 H new ATOM 0 HG23 ILE A 109 2.157 -1.425 5.283 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.385 3.176 6.191 1.00 0.00 H new ATOM 0 HD12 ILE A 109 1.697 3.079 5.634 1.00 0.00 H new ATOM 0 HD13 ILE A 109 2.102 2.680 7.320 1.00 0.00 H new ATOM 1592 N GLY A 110 -0.682 -1.425 4.350 1.00 0.00 N ATOM 1593 CA GLY A 110 -1.839 -2.368 4.413 1.00 0.00 C ATOM 1594 C GLY A 110 -1.564 -3.377 5.528 1.00 0.00 C ATOM 1595 O GLY A 110 -0.432 -3.772 5.734 1.00 0.00 O ATOM 0 H GLY A 110 0.157 -1.794 3.903 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -2.763 -1.825 4.610 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -1.967 -2.879 3.459 1.00 0.00 H new ATOM 1599 N ASN A 111 -2.575 -3.793 6.254 1.00 0.00 N ATOM 1600 CA ASN A 111 -2.334 -4.769 7.358 1.00 0.00 C ATOM 1601 C ASN A 111 -1.729 -6.056 6.801 1.00 0.00 C ATOM 1602 O ASN A 111 -0.819 -6.618 7.384 1.00 0.00 O ATOM 1603 CB ASN A 111 -3.693 -5.030 8.016 1.00 0.00 C ATOM 1604 CG ASN A 111 -3.985 -3.934 9.041 1.00 0.00 C ATOM 1605 OD1 ASN A 111 -5.079 -3.410 9.111 1.00 0.00 O ATOM 1606 ND2 ASN A 111 -3.011 -3.584 9.840 1.00 0.00 N ATOM 0 H ASN A 111 -3.545 -3.502 6.130 1.00 0.00 H new ATOM 0 HA ASN A 111 -1.627 -4.379 8.090 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -4.477 -5.052 7.259 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -3.692 -6.006 8.502 1.00 0.00 H new ATOM 1612 N GLY A 112 -2.190 -6.505 5.658 1.00 0.00 N ATOM 1613 CA GLY A 112 -1.587 -7.730 5.060 1.00 0.00 C ATOM 1614 C GLY A 112 -2.629 -8.693 4.494 1.00 0.00 C ATOM 1615 O GLY A 112 -3.786 -8.697 4.868 1.00 0.00 O ATOM 0 H GLY A 112 -2.947 -6.081 5.122 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -0.900 -7.439 4.266 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -0.998 -8.246 5.818 1.00 0.00 H new ATOM 1619 N THR A 113 -2.177 -9.533 3.600 1.00 0.00 N ATOM 1620 CA THR A 113 -3.047 -10.563 2.969 1.00 0.00 C ATOM 1621 C THR A 113 -2.384 -11.921 3.166 1.00 0.00 C ATOM 1622 O THR A 113 -1.181 -12.039 3.008 1.00 0.00 O ATOM 1623 CB THR A 113 -3.037 -10.231 1.469 1.00 0.00 C ATOM 1624 OG1 THR A 113 -3.601 -8.946 1.258 1.00 0.00 O ATOM 1625 CG2 THR A 113 -3.824 -11.300 0.683 1.00 0.00 C ATOM 0 H THR A 113 -1.211 -9.546 3.273 1.00 0.00 H new ATOM 0 HA THR A 113 -4.055 -10.580 3.385 1.00 0.00 H new ATOM 0 HB THR A 113 -2.008 -10.227 1.111 1.00 0.00 H new ATOM 0 HG1 THR A 113 -4.368 -8.823 1.856 1.00 0.00 H new ATOM 0 HG21 THR A 113 -3.810 -11.054 -0.379 1.00 0.00 H new ATOM 0 HG22 THR A 113 -3.364 -12.276 0.836 1.00 0.00 H new ATOM 0 HG23 THR A 113 -4.855 -11.326 1.036 1.00 0.00 H new ATOM 1633 N GLN A 114 -3.133 -12.949 3.456 1.00 0.00 N ATOM 1634 CA GLN A 114 -2.479 -14.279 3.590 1.00 0.00 C ATOM 1635 C GLN A 114 -2.372 -14.899 2.205 1.00 0.00 C ATOM 1636 O GLN A 114 -3.260 -14.754 1.393 1.00 0.00 O ATOM 1637 CB GLN A 114 -3.352 -15.143 4.508 1.00 0.00 C ATOM 1638 CG GLN A 114 -2.628 -16.469 4.747 1.00 0.00 C ATOM 1639 CD GLN A 114 -3.031 -17.051 6.100 1.00 0.00 C ATOM 1640 OE1 GLN A 114 -4.096 -16.763 6.609 1.00 0.00 O ATOM 1641 NE2 GLN A 114 -2.212 -17.865 6.708 1.00 0.00 N ATOM 0 H GLN A 114 -4.142 -12.929 3.602 1.00 0.00 H new ATOM 0 HA GLN A 114 -1.480 -14.197 4.018 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -3.531 -14.632 5.454 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -4.326 -15.319 4.051 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -2.872 -17.174 3.952 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -1.550 -16.314 4.716 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -1.319 -18.105 6.278 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -2.465 -18.261 7.613 1.00 0.00 H new ATOM 1650 N ILE A 115 -1.300 -15.583 1.920 1.00 0.00 N ATOM 1651 CA ILE A 115 -1.178 -16.214 0.582 1.00 0.00 C ATOM 1652 C ILE A 115 -1.310 -17.733 0.763 1.00 0.00 C ATOM 1653 O ILE A 115 -0.649 -18.323 1.605 1.00 0.00 O ATOM 1654 CB ILE A 115 0.212 -15.826 0.048 1.00 0.00 C ATOM 1655 CG1 ILE A 115 0.246 -14.321 -0.240 1.00 0.00 C ATOM 1656 CG2 ILE A 115 0.505 -16.592 -1.248 1.00 0.00 C ATOM 1657 CD1 ILE A 115 1.655 -13.910 -0.677 1.00 0.00 C ATOM 0 H ILE A 115 -0.511 -15.730 2.550 1.00 0.00 H new ATOM 0 HA ILE A 115 -1.946 -15.888 -0.120 1.00 0.00 H new ATOM 0 HB ILE A 115 0.964 -16.077 0.796 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -0.474 -14.074 -1.021 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -0.046 -13.764 0.650 1.00 0.00 H new ATOM 0 HG21 ILE A 115 1.490 -16.313 -1.621 1.00 0.00 H new ATOM 0 HG22 ILE A 115 0.482 -17.664 -1.050 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -0.249 -16.345 -1.995 1.00 0.00 H new ATOM 0 HD11 ILE A 115 1.675 -12.839 -0.881 1.00 0.00 H new ATOM 0 HD12 ILE A 115 2.364 -14.141 0.118 1.00 0.00 H new ATOM 0 HD13 ILE A 115 1.930 -14.456 -1.579 1.00 0.00 H new ATOM 1669 N TYR A 116 -2.159 -18.359 -0.015 1.00 0.00 N ATOM 1670 CA TYR A 116 -2.354 -19.838 0.099 1.00 0.00 C ATOM 1671 C TYR A 116 -1.798 -20.545 -1.136 1.00 0.00 C ATOM 1672 O TYR A 116 -1.816 -20.005 -2.227 1.00 0.00 O ATOM 1673 CB TYR A 116 -3.877 -20.060 0.137 1.00 0.00 C ATOM 1674 CG TYR A 116 -4.519 -19.620 1.450 1.00 0.00 C ATOM 1675 CD1 TYR A 116 -3.762 -19.512 2.658 1.00 0.00 C ATOM 1676 CD2 TYR A 116 -5.919 -19.343 1.473 1.00 0.00 C ATOM 1677 CE1 TYR A 116 -4.407 -19.137 3.869 1.00 0.00 C ATOM 1678 CE2 TYR A 116 -6.553 -18.966 2.680 1.00 0.00 C ATOM 1679 CZ TYR A 116 -5.799 -18.867 3.880 1.00 0.00 C ATOM 1680 OH TYR A 116 -6.422 -18.502 5.057 1.00 0.00 O ATOM 0 H TYR A 116 -2.729 -17.905 -0.729 1.00 0.00 H new ATOM 0 HA TYR A 116 -1.846 -20.229 0.981 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -4.337 -19.513 -0.686 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -4.087 -21.117 -0.026 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -2.701 -19.715 2.651 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -6.497 -19.422 0.564 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -3.835 -19.058 4.782 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -7.612 -18.753 2.689 1.00 0.00 H new ATOM 0 HH TYR A 116 -5.799 -17.985 5.610 1.00 0.00 H new ATOM 1690 N VAL A 117 -1.343 -21.764 -0.982 1.00 0.00 N ATOM 1691 CA VAL A 117 -0.832 -22.519 -2.161 1.00 0.00 C ATOM 1692 C VAL A 117 -1.931 -23.457 -2.657 1.00 0.00 C ATOM 1693 O VAL A 117 -2.925 -23.679 -1.990 1.00 0.00 O ATOM 1694 CB VAL A 117 0.383 -23.318 -1.680 1.00 0.00 C ATOM 1695 CG1 VAL A 117 0.900 -24.201 -2.830 1.00 0.00 C ATOM 1696 CG2 VAL A 117 1.487 -22.352 -1.245 1.00 0.00 C ATOM 0 H VAL A 117 -1.304 -22.265 -0.094 1.00 0.00 H new ATOM 0 HA VAL A 117 -0.549 -21.858 -2.981 1.00 0.00 H new ATOM 0 HB VAL A 117 0.096 -23.947 -0.837 1.00 0.00 H new ATOM 0 HG11 VAL A 117 1.765 -24.771 -2.491 1.00 0.00 H new ATOM 0 HG12 VAL A 117 0.113 -24.887 -3.144 1.00 0.00 H new ATOM 0 HG13 VAL A 117 1.188 -23.571 -3.671 1.00 0.00 H new ATOM 0 HG21 VAL A 117 2.352 -22.919 -0.902 1.00 0.00 H new ATOM 0 HG22 VAL A 117 1.775 -21.725 -2.089 1.00 0.00 H new ATOM 0 HG23 VAL A 117 1.121 -21.723 -0.434 1.00 0.00 H new ATOM 1706 N ILE A 118 -1.760 -23.990 -3.830 1.00 0.00 N ATOM 1707 CA ILE A 118 -2.781 -24.899 -4.407 1.00 0.00 C ATOM 1708 C ILE A 118 -2.271 -26.345 -4.434 1.00 0.00 C ATOM 1709 O ILE A 118 -1.157 -26.613 -4.845 1.00 0.00 O ATOM 1710 CB ILE A 118 -2.953 -24.356 -5.823 1.00 0.00 C ATOM 1711 CG1 ILE A 118 -3.475 -22.912 -5.781 1.00 0.00 C ATOM 1712 CG2 ILE A 118 -3.927 -25.229 -6.621 1.00 0.00 C ATOM 1713 CD1 ILE A 118 -4.788 -22.856 -5.005 1.00 0.00 C ATOM 0 H ILE A 118 -0.944 -23.832 -4.421 1.00 0.00 H new ATOM 0 HA ILE A 118 -3.710 -24.925 -3.838 1.00 0.00 H new ATOM 0 HB ILE A 118 -1.979 -24.372 -6.313 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -2.737 -22.263 -5.310 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -3.626 -22.541 -6.795 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -4.036 -24.825 -7.628 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -3.541 -26.247 -6.678 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.898 -25.237 -6.126 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -5.152 -21.829 -4.979 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -5.527 -23.491 -5.494 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -4.624 -23.208 -3.987 1.00 0.00 H new ATOM 1725 N ASP A 119 -3.089 -27.274 -4.012 1.00 0.00 N ATOM 1726 CA ASP A 119 -2.677 -28.709 -4.023 1.00 0.00 C ATOM 1727 C ASP A 119 -3.784 -29.558 -4.674 1.00 0.00 C ATOM 1728 O ASP A 119 -4.823 -29.758 -4.077 1.00 0.00 O ATOM 1729 CB ASP A 119 -2.511 -29.085 -2.547 1.00 0.00 C ATOM 1730 CG ASP A 119 -1.987 -30.524 -2.420 1.00 0.00 C ATOM 1731 OD1 ASP A 119 -1.987 -31.236 -3.413 1.00 0.00 O ATOM 1732 OD2 ASP A 119 -1.592 -30.889 -1.325 1.00 0.00 O ATOM 0 H ASP A 119 -4.030 -27.099 -3.658 1.00 0.00 H new ATOM 0 HA ASP A 119 -1.761 -28.879 -4.589 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -1.819 -28.395 -2.064 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -3.467 -28.992 -2.031 1.00 0.00 H new ATOM 1737 N PRO A 120 -3.544 -30.027 -5.882 1.00 0.00 N ATOM 1738 CA PRO A 120 -4.565 -30.852 -6.579 1.00 0.00 C ATOM 1739 C PRO A 120 -4.712 -32.219 -5.909 1.00 0.00 C ATOM 1740 O PRO A 120 -3.739 -32.831 -5.509 1.00 0.00 O ATOM 1741 CB PRO A 120 -4.012 -30.990 -7.996 1.00 0.00 C ATOM 1742 CG PRO A 120 -2.537 -30.803 -7.853 1.00 0.00 C ATOM 1743 CD PRO A 120 -2.330 -29.857 -6.700 1.00 0.00 C ATOM 0 HA PRO A 120 -5.559 -30.405 -6.557 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.247 -31.967 -8.418 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -4.442 -30.242 -8.663 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -2.043 -31.756 -7.665 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -2.108 -30.396 -8.769 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -1.430 -30.104 -6.136 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.219 -28.828 -7.042 1.00 0.00 H new ATOM 1751 N GLU A 121 -5.923 -32.703 -5.793 1.00 0.00 N ATOM 1752 CA GLU A 121 -6.147 -34.036 -5.157 1.00 0.00 C ATOM 1753 C GLU A 121 -7.057 -34.899 -6.048 1.00 0.00 C ATOM 1754 O GLU A 121 -7.997 -34.392 -6.627 1.00 0.00 O ATOM 1755 CB GLU A 121 -6.834 -33.730 -3.826 1.00 0.00 C ATOM 1756 CG GLU A 121 -5.879 -32.933 -2.929 1.00 0.00 C ATOM 1757 CD GLU A 121 -6.582 -32.528 -1.623 1.00 0.00 C ATOM 1758 OE1 GLU A 121 -7.745 -32.863 -1.456 1.00 0.00 O ATOM 1759 OE2 GLU A 121 -5.939 -31.886 -0.809 1.00 0.00 O ATOM 0 H GLU A 121 -6.768 -32.230 -6.113 1.00 0.00 H new ATOM 0 HA GLU A 121 -5.219 -34.590 -5.017 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -7.748 -33.161 -3.998 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -7.124 -34.658 -3.333 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -4.997 -33.532 -2.704 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -5.534 -32.043 -3.455 1.00 0.00 H new ATOM 1766 N PRO A 122 -6.759 -36.179 -6.137 1.00 0.00 N ATOM 1767 CA PRO A 122 -7.590 -37.084 -6.974 1.00 0.00 C ATOM 1768 C PRO A 122 -8.984 -37.287 -6.359 1.00 0.00 C ATOM 1769 O PRO A 122 -9.875 -37.814 -6.999 1.00 0.00 O ATOM 1770 CB PRO A 122 -6.801 -38.392 -6.985 1.00 0.00 C ATOM 1771 CG PRO A 122 -5.977 -38.352 -5.740 1.00 0.00 C ATOM 1772 CD PRO A 122 -5.657 -36.905 -5.481 1.00 0.00 C ATOM 0 HA PRO A 122 -7.766 -36.687 -7.974 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -7.467 -39.255 -6.991 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -6.173 -38.467 -7.873 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -6.522 -38.784 -4.901 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -5.064 -38.935 -5.861 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -5.615 -36.689 -4.413 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -4.690 -36.628 -5.900 1.00 0.00 H new ATOM 1780 N CYS A 123 -9.179 -36.880 -5.126 1.00 0.00 N ATOM 1781 CA CYS A 123 -10.513 -37.056 -4.476 1.00 0.00 C ATOM 1782 C CYS A 123 -11.393 -35.815 -4.713 1.00 0.00 C ATOM 1783 O CYS A 123 -10.909 -34.703 -4.632 1.00 0.00 O ATOM 1784 CB CYS A 123 -10.208 -37.218 -2.987 1.00 0.00 C ATOM 1785 SG CYS A 123 -11.742 -37.560 -2.091 1.00 0.00 S ATOM 0 H CYS A 123 -8.470 -36.434 -4.544 1.00 0.00 H new ATOM 0 HA CYS A 123 -11.057 -37.910 -4.879 1.00 0.00 H new ATOM 0 HB2 CYS A 123 -9.498 -38.031 -2.837 1.00 0.00 H new ATOM 0 HB3 CYS A 123 -9.742 -36.312 -2.600 1.00 0.00 H new ATOM 0 HG CYS A 123 -12.569 -36.570 -2.252 1.00 0.00 H new ATOM 1791 N PRO A 124 -12.661 -36.033 -5.003 1.00 0.00 N ATOM 1792 CA PRO A 124 -13.583 -34.892 -5.241 1.00 0.00 C ATOM 1793 C PRO A 124 -13.843 -34.131 -3.939 1.00 0.00 C ATOM 1794 O PRO A 124 -13.575 -34.626 -2.860 1.00 0.00 O ATOM 1795 CB PRO A 124 -14.858 -35.556 -5.756 1.00 0.00 C ATOM 1796 CG PRO A 124 -14.812 -36.945 -5.211 1.00 0.00 C ATOM 1797 CD PRO A 124 -13.358 -37.326 -5.120 1.00 0.00 C ATOM 0 HA PRO A 124 -13.183 -34.159 -5.941 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -15.746 -35.026 -5.413 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -14.890 -35.559 -6.846 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -15.286 -36.992 -4.231 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -15.353 -37.634 -5.860 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -13.165 -37.964 -4.257 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -13.033 -37.877 -6.003 1.00 0.00 H new ATOM 1805 N ASP A 125 -14.363 -32.933 -4.033 1.00 0.00 N ATOM 1806 CA ASP A 125 -14.641 -32.133 -2.802 1.00 0.00 C ATOM 1807 C ASP A 125 -16.145 -32.120 -2.502 1.00 0.00 C ATOM 1808 O ASP A 125 -16.964 -32.336 -3.375 1.00 0.00 O ATOM 1809 CB ASP A 125 -14.133 -30.721 -3.123 1.00 0.00 C ATOM 1810 CG ASP A 125 -14.889 -30.131 -4.325 1.00 0.00 C ATOM 1811 OD1 ASP A 125 -15.702 -30.834 -4.907 1.00 0.00 O ATOM 1812 OD2 ASP A 125 -14.637 -28.980 -4.644 1.00 0.00 O ATOM 0 H ASP A 125 -14.607 -32.474 -4.911 1.00 0.00 H new ATOM 0 HA ASP A 125 -14.153 -32.547 -1.920 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -14.262 -30.076 -2.254 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -13.065 -30.754 -3.339 1.00 0.00 H new ATOM 1817 N SER A 126 -16.506 -31.868 -1.269 1.00 0.00 N ATOM 1818 CA SER A 126 -17.955 -31.839 -0.895 1.00 0.00 C ATOM 1819 C SER A 126 -18.656 -30.657 -1.571 1.00 0.00 C ATOM 1820 O SER A 126 -19.835 -30.713 -1.865 1.00 0.00 O ATOM 1821 CB SER A 126 -17.976 -31.675 0.625 1.00 0.00 C ATOM 1822 OG SER A 126 -17.404 -30.421 0.970 1.00 0.00 O ATOM 0 H SER A 126 -15.859 -31.681 -0.503 1.00 0.00 H new ATOM 0 HA SER A 126 -18.477 -32.742 -1.213 1.00 0.00 H new ATOM 0 HB2 SER A 126 -19.000 -31.735 0.995 1.00 0.00 H new ATOM 0 HB3 SER A 126 -17.419 -32.484 1.097 1.00 0.00 H new ATOM 0 HG SER A 126 -17.418 -30.312 1.944 1.00 0.00 H new ATOM 1828 N ASP A 127 -17.940 -29.589 -1.811 1.00 0.00 N ATOM 1829 CA ASP A 127 -18.563 -28.395 -2.465 1.00 0.00 C ATOM 1830 C ASP A 127 -19.009 -28.741 -3.888 1.00 0.00 C ATOM 1831 O ASP A 127 -18.280 -29.357 -4.643 1.00 0.00 O ATOM 1832 CB ASP A 127 -17.463 -27.330 -2.493 1.00 0.00 C ATOM 1833 CG ASP A 127 -18.030 -26.025 -3.056 1.00 0.00 C ATOM 1834 OD1 ASP A 127 -18.679 -25.313 -2.307 1.00 0.00 O ATOM 1835 OD2 ASP A 127 -17.805 -25.760 -4.225 1.00 0.00 O ATOM 0 H ASP A 127 -16.951 -29.490 -1.583 1.00 0.00 H new ATOM 0 HA ASP A 127 -19.447 -28.051 -1.929 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -17.075 -27.166 -1.488 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -16.628 -27.670 -3.106 1.00 0.00 H new ATOM 1840 N GLN A 128 -20.203 -28.348 -4.255 1.00 0.00 N ATOM 1841 CA GLN A 128 -20.708 -28.649 -5.628 1.00 0.00 C ATOM 1842 C GLN A 128 -21.259 -27.376 -6.279 1.00 0.00 C ATOM 1843 O GLN A 128 -21.632 -26.436 -5.605 1.00 0.00 O ATOM 1844 CB GLN A 128 -21.827 -29.672 -5.424 1.00 0.00 C ATOM 1845 CG GLN A 128 -21.247 -30.964 -4.840 1.00 0.00 C ATOM 1846 CD GLN A 128 -20.277 -31.596 -5.842 1.00 0.00 C ATOM 1847 OE1 GLN A 128 -19.086 -31.640 -5.607 1.00 0.00 O ATOM 1848 NE2 GLN A 128 -20.742 -32.089 -6.957 1.00 0.00 N ATOM 0 H GLN A 128 -20.851 -27.830 -3.661 1.00 0.00 H new ATOM 0 HA GLN A 128 -19.923 -29.028 -6.282 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -22.585 -29.267 -4.754 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -22.320 -29.880 -6.374 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -20.730 -30.751 -3.904 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -22.051 -31.662 -4.608 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -21.742 -32.052 -7.153 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -20.105 -32.512 -7.632 1.00 0.00 H new ATOM 1857 N GLU A 129 -21.309 -27.342 -7.590 1.00 0.00 N ATOM 1858 CA GLU A 129 -21.836 -26.134 -8.308 1.00 0.00 C ATOM 1859 C GLU A 129 -21.116 -24.853 -7.839 1.00 0.00 C ATOM 1860 O GLU A 129 -21.761 -23.879 -7.501 1.00 0.00 O ATOM 1861 CB GLU A 129 -23.327 -26.073 -7.961 1.00 0.00 C ATOM 1862 CG GLU A 129 -24.034 -27.308 -8.525 1.00 0.00 C ATOM 1863 CD GLU A 129 -25.504 -27.300 -8.096 1.00 0.00 C ATOM 1864 OE1 GLU A 129 -25.785 -26.810 -7.014 1.00 0.00 O ATOM 1865 OE2 GLU A 129 -26.324 -27.787 -8.856 1.00 0.00 O ATOM 0 H GLU A 129 -21.006 -28.103 -8.198 1.00 0.00 H new ATOM 0 HA GLU A 129 -21.671 -26.204 -9.383 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -23.458 -26.028 -6.880 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -23.770 -25.167 -8.374 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -23.962 -27.315 -9.613 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -23.545 -28.214 -8.167 1.00 0.00 H new ATOM 1872 N PRO A 130 -19.798 -24.885 -7.825 1.00 0.00 N ATOM 1873 CA PRO A 130 -19.025 -23.696 -7.384 1.00 0.00 C ATOM 1874 C PRO A 130 -19.143 -22.569 -8.415 1.00 0.00 C ATOM 1875 O PRO A 130 -19.298 -22.813 -9.597 1.00 0.00 O ATOM 1876 CB PRO A 130 -17.589 -24.209 -7.294 1.00 0.00 C ATOM 1877 CG PRO A 130 -17.540 -25.376 -8.226 1.00 0.00 C ATOM 1878 CD PRO A 130 -18.912 -25.995 -8.217 1.00 0.00 C ATOM 0 HA PRO A 130 -19.380 -23.281 -6.441 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -16.875 -23.439 -7.587 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -17.338 -24.506 -6.276 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -17.266 -25.057 -9.232 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -16.788 -26.097 -7.904 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -19.178 -26.392 -9.197 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -18.972 -26.823 -7.511 1.00 0.00 H new ATOM 1886 N LYS A 131 -19.070 -21.339 -7.972 1.00 0.00 N ATOM 1887 CA LYS A 131 -19.177 -20.189 -8.919 1.00 0.00 C ATOM 1888 C LYS A 131 -17.793 -19.817 -9.459 1.00 0.00 C ATOM 1889 O LYS A 131 -17.661 -19.281 -10.541 1.00 0.00 O ATOM 1890 CB LYS A 131 -19.754 -19.044 -8.087 1.00 0.00 C ATOM 1891 CG LYS A 131 -20.001 -17.831 -8.987 1.00 0.00 C ATOM 1892 CD LYS A 131 -21.200 -18.106 -9.897 1.00 0.00 C ATOM 1893 CE LYS A 131 -21.472 -16.878 -10.769 1.00 0.00 C ATOM 1894 NZ LYS A 131 -22.582 -17.286 -11.674 1.00 0.00 N ATOM 0 H LYS A 131 -18.941 -21.082 -6.993 1.00 0.00 H new ATOM 0 HA LYS A 131 -19.802 -20.421 -9.782 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -20.686 -19.357 -7.616 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -19.065 -18.780 -7.285 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -20.188 -16.946 -8.379 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -19.115 -17.624 -9.587 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -21.002 -18.974 -10.525 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -22.079 -18.341 -9.297 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -21.754 -16.018 -10.162 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -20.586 -16.592 -11.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -22.825 -16.495 -12.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -22.283 -18.103 -12.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -23.414 -17.546 -11.107 1.00 0.00 H new TER 1908 LYS A 131 HETATM 1909 C1 NAG A 132 -2.545 -4.491 10.875 1.00 0.00 C HETATM 1910 C2 NAG A 132 -1.067 -4.229 11.157 1.00 0.00 C HETATM 1911 C3 NAG A 132 -0.567 -5.150 12.262 1.00 0.00 C HETATM 1912 C4 NAG A 132 -1.467 -5.057 13.492 1.00 0.00 C HETATM 1913 C5 NAG A 132 -2.931 -5.254 13.101 1.00 0.00 C HETATM 1914 C6 NAG A 132 -3.873 -5.029 14.267 1.00 0.00 C HETATM 1915 C7 NAG A 132 0.716 -3.649 9.669 1.00 0.00 C HETATM 1916 C8 NAG A 132 0.504 -2.632 8.560 1.00 0.00 C HETATM 1917 N2 NAG A 132 -0.280 -4.448 9.958 1.00 0.00 N HETATM 1918 O3 NAG A 132 0.762 -4.792 12.612 1.00 0.00 O HETATM 1919 O4 NAG A 132 -1.084 -6.075 14.439 1.00 0.00 O HETATM 1920 O5 NAG A 132 -3.311 -4.324 12.068 1.00 0.00 O HETATM 1921 O6 NAG A 132 -4.492 -6.285 14.644 1.00 0.00 O HETATM 1922 O7 NAG A 132 1.772 -3.724 10.266 1.00 0.00 O HETATM 0 HO3 NAG A 132 1.216 -4.414 11.830 1.00 0.00 H new HETATM 0 HN2 NAG A 132 -0.503 -5.227 9.338 1.00 0.00 H new HETATM 0 H83 NAG A 132 0.274 -3.151 7.630 1.00 0.00 H new HETATM 0 H82 NAG A 132 -0.324 -1.974 8.823 1.00 0.00 H new HETATM 0 H81 NAG A 132 1.410 -2.040 8.431 1.00 0.00 H new HETATM 0 H62 NAG A 132 -3.327 -4.613 15.114 1.00 0.00 H new HETATM 0 H61 NAG A 132 -4.638 -4.303 13.994 1.00 0.00 H new HETATM 0 H5 NAG A 132 -3.012 -6.285 12.757 1.00 0.00 H new HETATM 0 H4 NAG A 132 -1.353 -4.069 13.938 1.00 0.00 H new HETATM 0 H3 NAG A 132 -0.587 -6.177 11.897 1.00 0.00 H new HETATM 0 H2 NAG A 132 -0.959 -3.192 11.476 1.00 0.00 H new HETATM 1935 C1 NAG A 133 -0.363 -5.671 15.555 1.00 0.00 C HETATM 1936 C2 NAG A 133 0.328 -6.884 16.174 1.00 0.00 C HETATM 1937 C3 NAG A 133 1.241 -6.459 17.321 1.00 0.00 C HETATM 1938 C4 NAG A 133 2.184 -5.351 16.868 1.00 0.00 C HETATM 1939 C5 NAG A 133 1.396 -4.212 16.232 1.00 0.00 C HETATM 1940 C6 NAG A 133 2.304 -3.134 15.676 1.00 0.00 C HETATM 1941 C7 NAG A 133 -1.421 -8.468 15.820 1.00 0.00 C HETATM 1942 C8 NAG A 133 -2.913 -8.182 15.866 1.00 0.00 C HETATM 1943 N2 NAG A 133 -0.663 -7.822 16.663 1.00 0.00 N HETATM 1944 O3 NAG A 133 1.997 -7.575 17.765 1.00 0.00 O HETATM 1945 O4 NAG A 133 2.927 -4.853 17.998 1.00 0.00 O HETATM 1946 O5 NAG A 133 0.607 -4.706 15.137 1.00 0.00 O HETATM 1947 O6 NAG A 133 2.654 -3.403 14.326 1.00 0.00 O HETATM 1948 O7 NAG A 133 -0.952 -9.265 15.033 1.00 0.00 O HETATM 0 HO6 NAG A 133 1.929 -3.901 13.893 1.00 0.00 H new HETATM 0 HO3 NAG A 133 2.463 -7.345 18.596 1.00 0.00 H new HETATM 0 HN2 NAG A 133 -0.768 -7.977 17.666 1.00 0.00 H new HETATM 0 H83 NAG A 133 -3.301 -8.430 16.854 1.00 0.00 H new HETATM 0 H82 NAG A 133 -3.087 -7.125 15.663 1.00 0.00 H new HETATM 0 H81 NAG A 133 -3.422 -8.785 15.114 1.00 0.00 H new HETATM 0 H62 NAG A 133 1.806 -2.167 15.739 1.00 0.00 H new HETATM 0 H61 NAG A 133 3.207 -3.067 16.282 1.00 0.00 H new HETATM 0 H5 NAG A 133 0.769 -3.792 17.019 1.00 0.00 H new HETATM 0 H4 NAG A 133 2.874 -5.758 16.129 1.00 0.00 H new HETATM 0 H3 NAG A 133 0.626 -6.084 18.139 1.00 0.00 H new HETATM 0 H2 NAG A 133 0.934 -7.363 15.405 1.00 0.00 H new HETATM 1962 C1 FUL A 134 -5.807 -6.154 15.202 1.00 0.00 C HETATM 1963 C2 FUL A 134 -6.470 -7.513 15.199 1.00 0.00 C HETATM 1964 O2 FUL A 134 -5.771 -8.419 16.041 1.00 0.00 O HETATM 1965 C3 FUL A 134 -7.909 -7.373 15.691 1.00 0.00 C HETATM 1966 O3 FUL A 134 -8.568 -8.626 15.589 1.00 0.00 O HETATM 1967 C4 FUL A 134 -8.651 -6.338 14.855 1.00 0.00 C HETATM 1968 O4 FUL A 134 -8.819 -6.832 13.535 1.00 0.00 O HETATM 1969 C5 FUL A 134 -7.872 -5.024 14.806 1.00 0.00 C HETATM 1970 C6 FUL A 134 -8.495 -4.026 13.854 1.00 0.00 C HETATM 1971 O5 FUL A 134 -6.520 -5.263 14.345 1.00 0.00 O HETATM 0 HO4 FUL A 134 -9.641 -6.463 13.150 1.00 0.00 H new HETATM 0 HO3 FUL A 134 -9.014 -8.691 14.719 1.00 0.00 H new HETATM 0 HO2 FUL A 134 -6.399 -9.077 16.407 1.00 0.00 H new HETATM 0 H63 FUL A 134 -8.514 -4.446 12.848 1.00 0.00 H new HETATM 0 H62 FUL A 134 -9.513 -3.804 14.174 1.00 0.00 H new HETATM 0 H61 FUL A 134 -7.907 -3.108 13.853 1.00 0.00 H new HETATM 0 H5 FUL A 134 -7.885 -4.620 15.818 1.00 0.00 H new HETATM 0 H4 FUL A 134 -9.623 -6.152 15.312 1.00 0.00 H new HETATM 0 H3 FUL A 134 -7.899 -7.047 16.731 1.00 0.00 H new HETATM 0 H2 FUL A 134 -6.457 -7.904 14.182 1.00 0.00 H new HETATM 1983 C1 BMA A 135 4.255 -5.244 18.079 1.00 0.00 C HETATM 1984 C2 BMA A 135 5.154 -4.120 17.576 1.00 0.00 C HETATM 1985 C3 BMA A 135 6.621 -4.493 17.757 1.00 0.00 C HETATM 1986 C4 BMA A 135 6.886 -4.907 19.200 1.00 0.00 C HETATM 1987 C5 BMA A 135 5.898 -5.986 19.638 1.00 0.00 C HETATM 1988 C6 BMA A 135 6.048 -6.340 21.105 1.00 0.00 C HETATM 1989 O2 BMA A 135 4.873 -2.926 18.292 1.00 0.00 O HETATM 1990 O3 BMA A 135 7.441 -3.383 17.421 1.00 0.00 O HETATM 1991 O4 BMA A 135 8.212 -5.402 19.316 1.00 0.00 O HETATM 1992 O5 BMA A 135 4.544 -5.536 19.448 1.00 0.00 O HETATM 1993 O6 BMA A 135 5.159 -7.383 21.475 1.00 0.00 O HETATM 0 HO6 BMA A 135 4.363 -7.353 20.904 1.00 0.00 H new HETATM 0 HO4 BMA A 135 8.494 -5.366 20.254 1.00 0.00 H new HETATM 0 HO3 BMA A 135 8.383 -3.625 17.540 1.00 0.00 H new HETATM 0 HO2 BMA A 135 5.658 -2.340 18.272 1.00 0.00 H new HETATM 0 H62 BMA A 135 7.075 -6.646 21.305 1.00 0.00 H new HETATM 0 H61 BMA A 135 5.853 -5.459 21.716 1.00 0.00 H new HETATM 0 H5 BMA A 135 6.115 -6.862 19.027 1.00 0.00 H new HETATM 0 H4 BMA A 135 6.760 -4.036 19.843 1.00 0.00 H new HETATM 0 H3 BMA A 135 6.855 -5.331 17.100 1.00 0.00 H new HETATM 0 H2 BMA A 135 4.959 -3.963 16.515 1.00 0.00 H new HETATM 2005 C1 NAG A 136 -0.209 -8.319 -11.492 1.00 0.00 C HETATM 2006 C2 NAG A 136 -1.263 -9.411 -11.655 1.00 0.00 C HETATM 2007 C3 NAG A 136 -0.848 -10.392 -12.745 1.00 0.00 C HETATM 2008 C4 NAG A 136 -0.531 -9.638 -14.029 1.00 0.00 C HETATM 2009 C5 NAG A 136 0.491 -8.530 -13.762 1.00 0.00 C HETATM 2010 C6 NAG A 136 0.762 -7.684 -14.991 1.00 0.00 C HETATM 2011 C7 NAG A 136 -2.594 -10.652 -10.110 1.00 0.00 C HETATM 2012 C8 NAG A 136 -3.398 -10.008 -8.992 1.00 0.00 C HETATM 2013 N2 NAG A 136 -1.440 -10.118 -10.402 1.00 0.00 N HETATM 2014 O3 NAG A 136 -1.900 -11.317 -12.981 1.00 0.00 O HETATM 2015 O4 NAG A 136 -0.039 -10.551 -15.031 1.00 0.00 O HETATM 2016 O5 NAG A 136 0.008 -7.645 -12.735 1.00 0.00 O HETATM 2017 O6 NAG A 136 -0.219 -6.631 -15.085 1.00 0.00 O HETATM 2018 O7 NAG A 136 -3.008 -11.625 -10.709 1.00 0.00 O HETATM 0 HO3 NAG A 136 -2.124 -11.777 -12.145 1.00 0.00 H new HETATM 0 HN2 NAG A 136 -0.661 -10.198 -9.748 1.00 0.00 H new HETATM 0 H83 NAG A 136 -2.823 -10.038 -8.067 1.00 0.00 H new HETATM 0 H82 NAG A 136 -3.616 -8.972 -9.251 1.00 0.00 H new HETATM 0 H81 NAG A 136 -4.333 -10.552 -8.856 1.00 0.00 H new HETATM 0 H62 NAG A 136 1.763 -7.257 -14.936 1.00 0.00 H new HETATM 0 H61 NAG A 136 0.729 -8.305 -15.886 1.00 0.00 H new HETATM 0 H5 NAG A 136 1.411 -9.031 -13.459 1.00 0.00 H new HETATM 0 H4 NAG A 136 -1.446 -9.175 -14.398 1.00 0.00 H new HETATM 0 H3 NAG A 136 0.042 -10.931 -12.420 1.00 0.00 H new HETATM 0 H2 NAG A 136 -2.205 -8.945 -11.942 1.00 0.00 H new HETATM 2031 C1 NAG A 137 1.249 -11.022 -14.858 1.00 0.00 C HETATM 2032 C2 NAG A 137 1.293 -12.529 -15.083 1.00 0.00 C HETATM 2033 C3 NAG A 137 2.732 -13.031 -14.983 1.00 0.00 C HETATM 2034 C4 NAG A 137 3.650 -12.219 -15.893 1.00 0.00 C HETATM 2035 C5 NAG A 137 3.473 -10.722 -15.647 1.00 0.00 C HETATM 2036 C6 NAG A 137 4.265 -9.881 -16.628 1.00 0.00 C HETATM 2037 C7 NAG A 137 0.087 -14.430 -14.290 1.00 0.00 C HETATM 2038 C8 NAG A 137 0.667 -15.498 -13.377 1.00 0.00 C HETATM 2039 N2 NAG A 137 0.472 -13.199 -14.092 1.00 0.00 N HETATM 2040 O3 NAG A 137 2.786 -14.400 -15.353 1.00 0.00 O HETATM 2041 O4 NAG A 137 5.021 -12.585 -15.650 1.00 0.00 O HETATM 2042 O5 NAG A 137 2.091 -10.356 -15.799 1.00 0.00 O HETATM 2043 O6 NAG A 137 5.478 -9.423 -16.050 1.00 0.00 O HETATM 2044 O7 NAG A 137 -0.704 -14.709 -15.170 1.00 0.00 O HETATM 0 HO6 NAG A 137 6.223 -9.970 -16.376 1.00 0.00 H new HETATM 0 HO3 NAG A 137 3.606 -14.803 -14.998 1.00 0.00 H new HETATM 0 HN2 NAG A 137 0.196 -12.708 -13.241 1.00 0.00 H new HETATM 0 H83 NAG A 137 1.752 -15.514 -13.479 1.00 0.00 H new HETATM 0 H82 NAG A 137 0.403 -15.275 -12.343 1.00 0.00 H new HETATM 0 H81 NAG A 137 0.262 -16.472 -13.653 1.00 0.00 H new HETATM 0 H62 NAG A 137 4.483 -10.468 -17.520 1.00 0.00 H new HETATM 0 H61 NAG A 137 3.666 -9.028 -16.946 1.00 0.00 H new HETATM 0 H5 NAG A 137 3.830 -10.533 -14.635 1.00 0.00 H new HETATM 0 H4 NAG A 137 3.387 -12.436 -16.928 1.00 0.00 H new HETATM 0 H3 NAG A 137 3.070 -12.915 -13.953 1.00 0.00 H new HETATM 0 H2 NAG A 137 0.907 -12.749 -16.078 1.00 0.00 H new HETATM 2058 C1 FUC A 138 -0.942 -6.691 -16.282 1.00 0.00 C HETATM 2059 C2 FUC A 138 -1.835 -5.467 -16.374 1.00 0.00 C HETATM 2060 C3 FUC A 138 -0.935 -4.241 -16.232 1.00 0.00 C HETATM 2061 C4 FUC A 138 0.181 -4.273 -17.290 1.00 0.00 C HETATM 2062 C5 FUC A 138 0.895 -5.634 -17.346 1.00 0.00 C HETATM 2063 C6 FUC A 138 1.776 -5.774 -18.572 1.00 0.00 C HETATM 2064 O2 FUC A 138 -2.808 -5.489 -15.340 1.00 0.00 O HETATM 2065 O3 FUC A 138 -1.710 -3.063 -16.398 1.00 0.00 O HETATM 2066 O4 FUC A 138 -0.382 -3.996 -18.564 1.00 0.00 O HETATM 2067 O5 FUC A 138 -0.081 -6.689 -17.401 1.00 0.00 O HETATM 0 HO4 FUC A 138 0.285 -3.551 -19.127 1.00 0.00 H new HETATM 0 HO3 FUC A 138 -1.756 -2.833 -17.350 1.00 0.00 H new HETATM 0 HO2 FUC A 138 -3.377 -4.694 -15.409 1.00 0.00 H new HETATM 0 H63 FUC A 138 1.167 -5.676 -19.471 1.00 0.00 H new HETATM 0 H62 FUC A 138 2.538 -4.995 -18.563 1.00 0.00 H new HETATM 0 H61 FUC A 138 2.257 -6.752 -18.564 1.00 0.00 H new HETATM 0 H5 FUC A 138 1.515 -5.699 -16.452 1.00 0.00 H new HETATM 0 H4 FUC A 138 0.920 -3.521 -17.014 1.00 0.00 H new HETATM 0 H3 FUC A 138 -0.483 -4.248 -15.240 1.00 0.00 H new HETATM 0 H2 FUC A 138 -2.366 -5.446 -17.326 1.00 0.00 H new HETATM 2079 C1 BMA A 139 5.577 -13.486 -16.543 1.00 0.00 C HETATM 2080 C2 BMA A 139 5.816 -12.798 -17.883 1.00 0.00 C HETATM 2081 C3 BMA A 139 6.516 -13.751 -18.845 1.00 0.00 C HETATM 2082 C4 BMA A 139 7.776 -14.321 -18.201 1.00 0.00 C HETATM 2083 C5 BMA A 139 7.458 -14.919 -16.832 1.00 0.00 C HETATM 2084 C6 BMA A 139 8.706 -15.376 -16.103 1.00 0.00 C HETATM 2085 O2 BMA A 139 6.616 -11.641 -17.691 1.00 0.00 O HETATM 2086 O3 BMA A 139 6.861 -13.059 -20.037 1.00 0.00 O HETATM 2087 O4 BMA A 139 8.326 -15.325 -19.041 1.00 0.00 O HETATM 2088 O5 BMA A 139 6.814 -13.942 -15.994 1.00 0.00 O HETATM 2089 O6 BMA A 139 9.692 -14.354 -16.081 1.00 0.00 O HETATM 0 HO6 BMA A 139 10.485 -14.675 -15.603 1.00 0.00 H new HETATM 0 HO4 BMA A 139 9.269 -15.463 -18.812 1.00 0.00 H new HETATM 0 HO3 BMA A 139 7.312 -13.673 -20.653 1.00 0.00 H new HETATM 0 HO2 BMA A 139 7.196 -11.511 -18.470 1.00 0.00 H new HETATM 0 H62 BMA A 139 8.450 -15.660 -15.082 1.00 0.00 H new HETATM 0 H61 BMA A 139 9.110 -16.264 -16.589 1.00 0.00 H new HETATM 0 H5 BMA A 139 6.808 -15.774 -17.018 1.00 0.00 H new HETATM 0 H4 BMA A 139 8.496 -13.514 -18.070 1.00 0.00 H new HETATM 0 H3 BMA A 139 5.839 -14.571 -19.083 1.00 0.00 H new HETATM 0 H2 BMA A 139 4.855 -12.508 -18.308 1.00 0.00 H new