USER MOD reduce.3.24.130724 H: found=0, std=0, add=1584, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1581 hydrogens (12 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 134 ASN : amide:sc= -0.869 X(o=-1.6,f=-1.3!) USER MOD Set 1.2: A 145 ASN : amide:sc= -0.772 X(o=-1.6,f=-1.6) USER MOD Set 2.1: A 109 LYS NZ :NH3+ -179:sc= 1.23 (180deg=0) USER MOD Set 2.2: A 154 THR OG1 : rot 179:sc= 0.965 USER MOD Set 3.1: A 23 ASN : amide:sc= -0.035 X(o=-1.4,f=-1.3) USER MOD Set 3.2: A 64 HIS : no HD1:sc= -1.37 X(o=-1.4,f=-1.6) USER MOD Set 4.1: A 1 MET CE :methyl 158:sc= 0 (180deg=0) USER MOD Set 4.2: A 48 ASN : amide:sc= 0.386 K(o=1.5,f=-3.7!) USER MOD Set 4.3: A 98 GLN : amide:sc= 1.16 K(o=1.5,f=-6.3!) USER MOD Single : A 1 MET N :NH3+ -154:sc= 0.0103 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0.0252 USER MOD Single : A 6 GLN : amide:sc= -2.53 K(o=-2.5,f=-0.57) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 165:sc= 1.27 (180deg=1.11) USER MOD Single : A 12 ASN : amide:sc= 0.124 K(o=0.12,f=-4.2!) USER MOD Single : A 13 HIS : no HD1:sc= -0.0522 X(o=-0.052,f=0) USER MOD Single : A 16 SER OG : rot 86:sc= 1.24 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= 0.0669 X(o=0.067,f=-0.24) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 177:sc= -0.547 USER MOD Single : A 32 LYS NZ :NH3+ 147:sc= -0.137 (180deg=-0.432) USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 167:sc= 0.818 (180deg=0.401) USER MOD Single : A 46 MET CE :methyl -154:sc= -0.758! (180deg=-2.22!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 145:sc= -0.406 (180deg=-0.571) USER MOD Single : A 63 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0335) USER MOD Single : A 68 ASN : amide:sc= -0.0259 K(o=-0.026,f=-1.9) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 175:sc= 0.743 (180deg=0.604) USER MOD Single : A 86 CYS SG : rot 2:sc= 0.00283 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 43:sc= 0.149 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.0557 USER MOD Single : A 111 TYR OH : rot 54:sc= -2.39! USER MOD Single : A 115 HIS : no HE2:sc= -6.22! C(o=-6.2!,f=-5.1!) USER MOD Single : A 117 THR OG1 : rot 36:sc= 1.25 USER MOD Single : A 121 SER OG : rot 180:sc= 0.0387 USER MOD Single : A 122 TYR OH : rot 26:sc= 0.09 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 ASN : amide:sc= 0.379 X(o=0.38,f=-0.085!) USER MOD Single : A 139 GLN : amide:sc= -0.14 X(o=-0.14,f=0) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 GLN : amide:sc= -0.448 X(o=-0.45,f=0) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ 174:sc= 1.24 (180deg=1.2) USER MOD Single : A 155 THR OG1 : rot 132:sc= 0.0806 USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ -154:sc= 1.21 (180deg=0.832) USER MOD Single : A 166 THR OG1 : rot 25:sc= 0.3 USER MOD Single : A 167 TYR OH : rot 67:sc= 1.24 USER MOD Single : A 171 LYS NZ :NH3+ 144:sc= 1.26 (180deg=0.304) USER MOD Single : A 172 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0545) USER MOD Single : A 201 DGT O3' : rot -59:sc= 0.0105 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.536 -16.959 7.000 1.00 1.61 N ATOM 2 CA MET A 1 -10.834 -16.276 6.811 1.00 0.85 C ATOM 3 C MET A 1 -11.282 -16.381 5.356 1.00 0.76 C ATOM 4 O MET A 1 -11.985 -17.319 4.986 1.00 0.95 O ATOM 5 CB MET A 1 -10.736 -14.806 7.238 1.00 1.35 C ATOM 6 CG MET A 1 -12.077 -14.089 7.254 1.00 2.03 C ATOM 7 SD MET A 1 -11.976 -12.446 7.980 1.00 2.69 S ATOM 8 CE MET A 1 -13.701 -11.966 7.950 1.00 3.45 C ATOM 0 H1 MET A 1 -9.448 -17.270 7.988 1.00 1.61 H new ATOM 0 H2 MET A 1 -9.484 -17.785 6.371 1.00 1.61 H new ATOM 0 H3 MET A 1 -8.762 -16.302 6.774 1.00 1.61 H new ATOM 0 HA MET A 1 -11.578 -16.767 7.439 1.00 0.85 H new ATOM 0 HB2 MET A 1 -10.293 -14.753 8.232 1.00 1.35 H new ATOM 0 HB3 MET A 1 -10.061 -14.283 6.560 1.00 1.35 H new ATOM 0 HG2 MET A 1 -12.454 -14.009 6.234 1.00 2.03 H new ATOM 0 HG3 MET A 1 -12.797 -14.686 7.814 1.00 2.03 H new ATOM 0 HE1 MET A 1 -13.874 -11.183 8.688 1.00 3.45 H new ATOM 0 HE2 MET A 1 -13.958 -11.593 6.959 1.00 3.45 H new ATOM 0 HE3 MET A 1 -14.323 -12.830 8.185 1.00 3.45 H new ATOM 20 N LEU A 2 -10.864 -15.431 4.529 1.00 0.61 N ATOM 21 CA LEU A 2 -11.228 -15.432 3.127 1.00 0.57 C ATOM 22 C LEU A 2 -10.138 -16.094 2.288 1.00 0.52 C ATOM 23 O LEU A 2 -9.066 -16.423 2.794 1.00 0.60 O ATOM 24 CB LEU A 2 -11.484 -14.002 2.654 1.00 0.59 C ATOM 25 CG LEU A 2 -10.391 -12.985 2.990 1.00 0.64 C ATOM 26 CD1 LEU A 2 -9.745 -12.452 1.724 1.00 1.05 C ATOM 27 CD2 LEU A 2 -10.974 -11.847 3.811 1.00 0.96 C ATOM 0 H LEU A 2 -10.271 -14.650 4.811 1.00 0.61 H new ATOM 0 HA LEU A 2 -12.144 -16.010 3.002 1.00 0.57 H new ATOM 0 HB2 LEU A 2 -11.621 -14.016 1.573 1.00 0.59 H new ATOM 0 HB3 LEU A 2 -12.422 -13.657 3.090 1.00 0.59 H new ATOM 0 HG LEU A 2 -9.621 -13.484 3.578 1.00 0.64 H new ATOM 0 HD11 LEU A 2 -8.971 -11.731 1.986 1.00 1.05 H new ATOM 0 HD12 LEU A 2 -9.299 -13.277 1.168 1.00 1.05 H new ATOM 0 HD13 LEU A 2 -10.500 -11.965 1.107 1.00 1.05 H new ATOM 0 HD21 LEU A 2 -10.189 -11.128 4.045 1.00 0.96 H new ATOM 0 HD22 LEU A 2 -11.760 -11.352 3.241 1.00 0.96 H new ATOM 0 HD23 LEU A 2 -11.392 -12.243 4.737 1.00 0.96 H new ATOM 39 N THR A 3 -10.419 -16.293 1.016 1.00 0.46 N ATOM 40 CA THR A 3 -9.472 -16.919 0.107 1.00 0.42 C ATOM 41 C THR A 3 -8.910 -15.893 -0.872 1.00 0.39 C ATOM 42 O THR A 3 -9.326 -14.732 -0.866 1.00 0.40 O ATOM 43 CB THR A 3 -10.158 -18.055 -0.671 1.00 0.44 C ATOM 44 OG1 THR A 3 -11.562 -17.782 -0.769 1.00 0.51 O ATOM 45 CG2 THR A 3 -9.941 -19.394 0.017 1.00 0.52 C ATOM 0 H THR A 3 -11.304 -16.028 0.583 1.00 0.46 H new ATOM 0 HA THR A 3 -8.651 -17.330 0.695 1.00 0.42 H new ATOM 0 HB THR A 3 -9.720 -18.109 -1.668 1.00 0.44 H new ATOM 0 HG1 THR A 3 -12.002 -18.503 -1.266 1.00 0.51 H new ATOM 0 HG21 THR A 3 -10.436 -20.180 -0.553 1.00 0.52 H new ATOM 0 HG22 THR A 3 -8.873 -19.605 0.074 1.00 0.52 H new ATOM 0 HG23 THR A 3 -10.358 -19.358 1.023 1.00 0.52 H new ATOM 53 N LEU A 4 -7.959 -16.315 -1.701 1.00 0.39 N ATOM 54 CA LEU A 4 -7.345 -15.430 -2.693 1.00 0.40 C ATOM 55 C LEU A 4 -8.398 -14.805 -3.605 1.00 0.39 C ATOM 56 O LEU A 4 -8.292 -13.633 -3.972 1.00 0.41 O ATOM 57 CB LEU A 4 -6.323 -16.209 -3.528 1.00 0.43 C ATOM 58 CG LEU A 4 -5.378 -15.351 -4.376 1.00 0.63 C ATOM 59 CD1 LEU A 4 -4.504 -14.481 -3.489 1.00 1.14 C ATOM 60 CD2 LEU A 4 -4.521 -16.231 -5.270 1.00 1.69 C ATOM 0 H LEU A 4 -7.594 -17.268 -1.707 1.00 0.39 H new ATOM 0 HA LEU A 4 -6.839 -14.625 -2.161 1.00 0.40 H new ATOM 0 HB2 LEU A 4 -5.724 -16.825 -2.857 1.00 0.43 H new ATOM 0 HB3 LEU A 4 -6.861 -16.889 -4.189 1.00 0.43 H new ATOM 0 HG LEU A 4 -5.980 -14.699 -5.008 1.00 0.63 H new ATOM 0 HD11 LEU A 4 -3.840 -13.879 -4.110 1.00 1.14 H new ATOM 0 HD12 LEU A 4 -5.134 -13.824 -2.889 1.00 1.14 H new ATOM 0 HD13 LEU A 4 -3.910 -15.114 -2.830 1.00 1.14 H new ATOM 0 HD21 LEU A 4 -3.856 -15.606 -5.866 1.00 1.69 H new ATOM 0 HD22 LEU A 4 -3.929 -16.908 -4.654 1.00 1.69 H new ATOM 0 HD23 LEU A 4 -5.163 -16.811 -5.932 1.00 1.69 H new ATOM 72 N ILE A 5 -9.419 -15.591 -3.952 1.00 0.40 N ATOM 73 CA ILE A 5 -10.495 -15.117 -4.812 1.00 0.42 C ATOM 74 C ILE A 5 -11.254 -13.976 -4.142 1.00 0.40 C ATOM 75 O ILE A 5 -11.549 -12.958 -4.766 1.00 0.40 O ATOM 76 CB ILE A 5 -11.478 -16.260 -5.177 1.00 0.48 C ATOM 77 CG1 ILE A 5 -12.645 -15.734 -6.015 1.00 1.32 C ATOM 78 CG2 ILE A 5 -11.998 -16.958 -3.928 1.00 1.22 C ATOM 79 CD1 ILE A 5 -12.214 -14.919 -7.210 1.00 1.94 C ATOM 0 H ILE A 5 -9.520 -16.559 -3.648 1.00 0.40 H new ATOM 0 HA ILE A 5 -10.040 -14.753 -5.733 1.00 0.42 H new ATOM 0 HB ILE A 5 -10.927 -16.988 -5.772 1.00 0.48 H new ATOM 0 HG12 ILE A 5 -13.244 -16.578 -6.358 1.00 1.32 H new ATOM 0 HG13 ILE A 5 -13.289 -15.123 -5.382 1.00 1.32 H new ATOM 0 HG21 ILE A 5 -12.685 -17.754 -4.215 1.00 1.22 H new ATOM 0 HG22 ILE A 5 -11.161 -17.383 -3.374 1.00 1.22 H new ATOM 0 HG23 ILE A 5 -12.521 -16.237 -3.299 1.00 1.22 H new ATOM 0 HD11 ILE A 5 -13.094 -14.580 -7.756 1.00 1.94 H new ATOM 0 HD12 ILE A 5 -11.641 -14.055 -6.874 1.00 1.94 H new ATOM 0 HD13 ILE A 5 -11.595 -15.532 -7.865 1.00 1.94 H new ATOM 91 N GLN A 6 -11.548 -14.150 -2.865 1.00 0.38 N ATOM 92 CA GLN A 6 -12.271 -13.149 -2.094 1.00 0.38 C ATOM 93 C GLN A 6 -11.557 -11.806 -2.124 1.00 0.36 C ATOM 94 O GLN A 6 -12.175 -10.784 -2.426 1.00 0.37 O ATOM 95 CB GLN A 6 -12.432 -13.621 -0.653 1.00 0.40 C ATOM 96 CG GLN A 6 -13.590 -12.972 0.079 1.00 0.77 C ATOM 97 CD GLN A 6 -14.907 -13.165 -0.644 1.00 0.81 C ATOM 98 OE1 GLN A 6 -15.601 -14.161 -0.446 1.00 1.38 O ATOM 99 NE2 GLN A 6 -15.256 -12.213 -1.492 1.00 0.99 N ATOM 0 H GLN A 6 -11.295 -14.983 -2.334 1.00 0.38 H new ATOM 0 HA GLN A 6 -13.254 -13.018 -2.546 1.00 0.38 H new ATOM 0 HB2 GLN A 6 -12.572 -14.702 -0.648 1.00 0.40 H new ATOM 0 HB3 GLN A 6 -11.510 -13.416 -0.109 1.00 0.40 H new ATOM 0 HG2 GLN A 6 -13.664 -13.392 1.082 1.00 0.77 H new ATOM 0 HG3 GLN A 6 -13.393 -11.906 0.193 1.00 0.77 H new ATOM 0 HE21 GLN A 6 -14.651 -11.403 -1.627 1.00 0.99 H new ATOM 0 HE22 GLN A 6 -16.130 -12.288 -2.012 1.00 0.99 H new ATOM 108 N GLY A 7 -10.266 -11.815 -1.794 1.00 0.35 N ATOM 109 CA GLY A 7 -9.484 -10.595 -1.828 1.00 0.34 C ATOM 110 C GLY A 7 -9.575 -9.915 -3.180 1.00 0.33 C ATOM 111 O GLY A 7 -9.795 -8.703 -3.272 1.00 0.33 O ATOM 0 H GLY A 7 -9.751 -12.646 -1.504 1.00 0.35 H new ATOM 0 HA2 GLY A 7 -9.836 -9.914 -1.053 1.00 0.34 H new ATOM 0 HA3 GLY A 7 -8.442 -10.823 -1.603 1.00 0.34 H new ATOM 115 N LYS A 8 -9.461 -10.716 -4.227 1.00 0.35 N ATOM 116 CA LYS A 8 -9.531 -10.223 -5.592 1.00 0.38 C ATOM 117 C LYS A 8 -10.905 -9.622 -5.884 1.00 0.38 C ATOM 118 O LYS A 8 -11.007 -8.548 -6.481 1.00 0.38 O ATOM 119 CB LYS A 8 -9.216 -11.362 -6.571 1.00 0.44 C ATOM 120 CG LYS A 8 -9.543 -11.051 -8.022 1.00 0.76 C ATOM 121 CD LYS A 8 -8.796 -9.821 -8.522 1.00 0.74 C ATOM 122 CE LYS A 8 -8.821 -9.734 -10.039 1.00 1.24 C ATOM 123 NZ LYS A 8 -8.129 -8.519 -10.531 1.00 1.81 N ATOM 0 H LYS A 8 -9.318 -11.723 -4.155 1.00 0.35 H new ATOM 0 HA LYS A 8 -8.790 -9.434 -5.719 1.00 0.38 H new ATOM 0 HB2 LYS A 8 -8.157 -11.608 -6.495 1.00 0.44 H new ATOM 0 HB3 LYS A 8 -9.772 -12.249 -6.268 1.00 0.44 H new ATOM 0 HG2 LYS A 8 -9.287 -11.909 -8.644 1.00 0.76 H new ATOM 0 HG3 LYS A 8 -10.616 -10.891 -8.126 1.00 0.76 H new ATOM 0 HD2 LYS A 8 -9.245 -8.923 -8.097 1.00 0.74 H new ATOM 0 HD3 LYS A 8 -7.763 -9.855 -8.175 1.00 0.74 H new ATOM 0 HE2 LYS A 8 -8.346 -10.619 -10.462 1.00 1.24 H new ATOM 0 HE3 LYS A 8 -9.854 -9.730 -10.386 1.00 1.24 H new ATOM 0 HZ1 LYS A 8 -8.167 -8.495 -11.570 1.00 1.81 H new ATOM 0 HZ2 LYS A 8 -8.597 -7.673 -10.148 1.00 1.81 H new ATOM 0 HZ3 LYS A 8 -7.136 -8.535 -10.221 1.00 1.81 H new ATOM 137 N LYS A 9 -11.954 -10.300 -5.432 1.00 0.41 N ATOM 138 CA LYS A 9 -13.317 -9.836 -5.657 1.00 0.46 C ATOM 139 C LYS A 9 -13.575 -8.539 -4.905 1.00 0.43 C ATOM 140 O LYS A 9 -14.102 -7.581 -5.473 1.00 0.44 O ATOM 141 CB LYS A 9 -14.343 -10.891 -5.228 1.00 0.53 C ATOM 142 CG LYS A 9 -15.789 -10.426 -5.376 1.00 0.74 C ATOM 143 CD LYS A 9 -16.762 -11.354 -4.665 1.00 0.87 C ATOM 144 CE LYS A 9 -18.138 -10.718 -4.518 1.00 1.29 C ATOM 145 NZ LYS A 9 -19.177 -11.705 -4.113 1.00 1.69 N ATOM 0 H LYS A 9 -11.886 -11.172 -4.908 1.00 0.41 H new ATOM 0 HA LYS A 9 -13.428 -9.659 -6.727 1.00 0.46 H new ATOM 0 HB2 LYS A 9 -14.196 -11.793 -5.823 1.00 0.53 H new ATOM 0 HB3 LYS A 9 -14.161 -11.162 -4.188 1.00 0.53 H new ATOM 0 HG2 LYS A 9 -15.889 -9.418 -4.973 1.00 0.74 H new ATOM 0 HG3 LYS A 9 -16.046 -10.373 -6.434 1.00 0.74 H new ATOM 0 HD2 LYS A 9 -16.849 -12.287 -5.222 1.00 0.87 H new ATOM 0 HD3 LYS A 9 -16.370 -11.607 -3.680 1.00 0.87 H new ATOM 0 HE2 LYS A 9 -18.090 -9.920 -3.777 1.00 1.29 H new ATOM 0 HE3 LYS A 9 -18.426 -10.258 -5.463 1.00 1.29 H new ATOM 0 HZ1 LYS A 9 -20.024 -11.201 -3.781 1.00 1.69 H new ATOM 0 HZ2 LYS A 9 -19.426 -12.301 -4.928 1.00 1.69 H new ATOM 0 HZ3 LYS A 9 -18.808 -12.303 -3.346 1.00 1.69 H new ATOM 159 N ILE A 10 -13.193 -8.502 -3.630 1.00 0.41 N ATOM 160 CA ILE A 10 -13.415 -7.310 -2.828 1.00 0.42 C ATOM 161 C ILE A 10 -12.626 -6.133 -3.379 1.00 0.35 C ATOM 162 O ILE A 10 -13.173 -5.053 -3.521 1.00 0.38 O ATOM 163 CB ILE A 10 -13.101 -7.501 -1.316 1.00 0.46 C ATOM 164 CG1 ILE A 10 -11.597 -7.546 -1.043 1.00 0.45 C ATOM 165 CG2 ILE A 10 -13.759 -8.760 -0.782 1.00 0.57 C ATOM 166 CD1 ILE A 10 -11.248 -7.399 0.423 1.00 0.58 C ATOM 0 H ILE A 10 -12.736 -9.271 -3.140 1.00 0.41 H new ATOM 0 HA ILE A 10 -14.483 -7.104 -2.898 1.00 0.42 H new ATOM 0 HB ILE A 10 -13.511 -6.635 -0.797 1.00 0.46 H new ATOM 0 HG12 ILE A 10 -11.196 -8.490 -1.411 1.00 0.45 H new ATOM 0 HG13 ILE A 10 -11.109 -6.751 -1.607 1.00 0.45 H new ATOM 0 HG21 ILE A 10 -13.525 -8.872 0.277 1.00 0.57 H new ATOM 0 HG22 ILE A 10 -14.839 -8.688 -0.909 1.00 0.57 H new ATOM 0 HG23 ILE A 10 -13.386 -9.626 -1.329 1.00 0.57 H new ATOM 0 HD11 ILE A 10 -10.166 -7.440 0.545 1.00 0.58 H new ATOM 0 HD12 ILE A 10 -11.619 -6.443 0.791 1.00 0.58 H new ATOM 0 HD13 ILE A 10 -11.708 -8.209 0.989 1.00 0.58 H new ATOM 178 N VAL A 11 -11.361 -6.351 -3.734 1.00 0.31 N ATOM 179 CA VAL A 11 -10.529 -5.272 -4.265 1.00 0.30 C ATOM 180 C VAL A 11 -11.093 -4.741 -5.572 1.00 0.29 C ATOM 181 O VAL A 11 -11.303 -3.540 -5.723 1.00 0.30 O ATOM 182 CB VAL A 11 -9.070 -5.726 -4.490 1.00 0.35 C ATOM 183 CG1 VAL A 11 -8.305 -4.720 -5.336 1.00 0.39 C ATOM 184 CG2 VAL A 11 -8.373 -5.937 -3.164 1.00 0.41 C ATOM 0 H VAL A 11 -10.893 -7.255 -3.665 1.00 0.31 H new ATOM 0 HA VAL A 11 -10.534 -4.479 -3.518 1.00 0.30 H new ATOM 0 HB VAL A 11 -9.092 -6.672 -5.030 1.00 0.35 H new ATOM 0 HG11 VAL A 11 -7.281 -5.067 -5.477 1.00 0.39 H new ATOM 0 HG12 VAL A 11 -8.790 -4.617 -6.307 1.00 0.39 H new ATOM 0 HG13 VAL A 11 -8.294 -3.754 -4.831 1.00 0.39 H new ATOM 0 HG21 VAL A 11 -7.346 -6.257 -3.340 1.00 0.41 H new ATOM 0 HG22 VAL A 11 -8.371 -5.003 -2.601 1.00 0.41 H new ATOM 0 HG23 VAL A 11 -8.899 -6.703 -2.594 1.00 0.41 H new ATOM 194 N ASN A 12 -11.326 -5.644 -6.509 1.00 0.32 N ATOM 195 CA ASN A 12 -11.869 -5.293 -7.816 1.00 0.37 C ATOM 196 C ASN A 12 -13.123 -4.423 -7.685 1.00 0.36 C ATOM 197 O ASN A 12 -13.230 -3.357 -8.308 1.00 0.38 O ATOM 198 CB ASN A 12 -12.177 -6.572 -8.591 1.00 0.44 C ATOM 199 CG ASN A 12 -12.606 -6.311 -10.019 1.00 0.59 C ATOM 200 OD1 ASN A 12 -12.236 -5.303 -10.624 1.00 1.02 O ATOM 201 ND2 ASN A 12 -13.376 -7.233 -10.573 1.00 1.32 N ATOM 0 H ASN A 12 -11.145 -6.641 -6.388 1.00 0.32 H new ATOM 0 HA ASN A 12 -11.127 -4.708 -8.359 1.00 0.37 H new ATOM 0 HB2 ASN A 12 -11.293 -7.210 -8.594 1.00 0.44 H new ATOM 0 HB3 ASN A 12 -12.965 -7.121 -8.076 1.00 0.44 H new ATOM 0 HD21 ASN A 12 -13.687 -7.125 -11.538 1.00 1.32 H new ATOM 0 HD22 ASN A 12 -13.659 -8.052 -10.035 1.00 1.32 H new ATOM 208 N HIS A 13 -14.043 -4.861 -6.842 1.00 0.35 N ATOM 209 CA HIS A 13 -15.285 -4.133 -6.616 1.00 0.38 C ATOM 210 C HIS A 13 -15.013 -2.837 -5.854 1.00 0.33 C ATOM 211 O HIS A 13 -15.470 -1.759 -6.245 1.00 0.35 O ATOM 212 CB HIS A 13 -16.280 -5.000 -5.842 1.00 0.44 C ATOM 213 CG HIS A 13 -16.900 -6.104 -6.650 1.00 0.64 C ATOM 214 ND1 HIS A 13 -18.146 -6.601 -6.347 1.00 1.05 N ATOM 215 CD2 HIS A 13 -16.406 -6.775 -7.722 1.00 1.07 C ATOM 216 CE1 HIS A 13 -18.379 -7.557 -7.232 1.00 1.21 C ATOM 217 NE2 HIS A 13 -17.354 -7.699 -8.083 1.00 1.22 N ATOM 0 H HIS A 13 -13.955 -5.720 -6.300 1.00 0.35 H new ATOM 0 HA HIS A 13 -15.718 -3.884 -7.585 1.00 0.38 H new ATOM 0 HB2 HIS A 13 -15.771 -5.437 -4.983 1.00 0.44 H new ATOM 0 HB3 HIS A 13 -17.073 -4.362 -5.452 1.00 0.44 H new ATOM 0 HD2 HIS A 13 -15.451 -6.613 -8.199 1.00 1.07 H new ATOM 0 HE1 HIS A 13 -19.282 -8.148 -7.264 1.00 1.21 H new ATOM 0 HE2 HIS A 13 -17.291 -8.366 -8.852 1.00 1.22 H new ATOM 225 N LEU A 14 -14.229 -2.954 -4.789 1.00 0.30 N ATOM 226 CA LEU A 14 -13.881 -1.821 -3.936 1.00 0.31 C ATOM 227 C LEU A 14 -13.248 -0.692 -4.738 1.00 0.31 C ATOM 228 O LEU A 14 -13.643 0.460 -4.613 1.00 0.34 O ATOM 229 CB LEU A 14 -12.911 -2.269 -2.833 1.00 0.35 C ATOM 230 CG LEU A 14 -13.543 -2.785 -1.527 1.00 0.49 C ATOM 231 CD1 LEU A 14 -13.166 -1.884 -0.369 1.00 0.89 C ATOM 232 CD2 LEU A 14 -15.057 -2.900 -1.636 1.00 0.54 C ATOM 0 H LEU A 14 -13.815 -3.838 -4.491 1.00 0.30 H new ATOM 0 HA LEU A 14 -14.803 -1.449 -3.489 1.00 0.31 H new ATOM 0 HB2 LEU A 14 -12.275 -3.056 -3.238 1.00 0.35 H new ATOM 0 HB3 LEU A 14 -12.262 -1.428 -2.588 1.00 0.35 H new ATOM 0 HG LEU A 14 -13.150 -3.785 -1.345 1.00 0.49 H new ATOM 0 HD11 LEU A 14 -13.620 -2.261 0.548 1.00 0.89 H new ATOM 0 HD12 LEU A 14 -12.082 -1.869 -0.258 1.00 0.89 H new ATOM 0 HD13 LEU A 14 -13.525 -0.873 -0.563 1.00 0.89 H new ATOM 0 HD21 LEU A 14 -15.463 -3.267 -0.693 1.00 0.54 H new ATOM 0 HD22 LEU A 14 -15.481 -1.921 -1.857 1.00 0.54 H new ATOM 0 HD23 LEU A 14 -15.312 -3.595 -2.436 1.00 0.54 H new ATOM 244 N ARG A 15 -12.295 -1.040 -5.589 1.00 0.32 N ATOM 245 CA ARG A 15 -11.596 -0.053 -6.396 1.00 0.37 C ATOM 246 C ARG A 15 -12.542 0.600 -7.404 1.00 0.38 C ATOM 247 O ARG A 15 -12.550 1.813 -7.559 1.00 0.45 O ATOM 248 CB ARG A 15 -10.384 -0.688 -7.103 1.00 0.43 C ATOM 249 CG ARG A 15 -10.747 -1.640 -8.233 1.00 1.21 C ATOM 250 CD ARG A 15 -9.562 -2.470 -8.697 1.00 1.96 C ATOM 251 NE ARG A 15 -9.917 -3.323 -9.837 1.00 2.47 N ATOM 252 CZ ARG A 15 -9.036 -3.981 -10.587 1.00 3.14 C ATOM 253 NH1 ARG A 15 -7.738 -3.915 -10.323 1.00 3.59 N ATOM 254 NH2 ARG A 15 -9.460 -4.709 -11.606 1.00 3.77 N ATOM 0 H ARG A 15 -11.988 -2.001 -5.738 1.00 0.32 H new ATOM 0 HA ARG A 15 -11.228 0.729 -5.732 1.00 0.37 H new ATOM 0 HB2 ARG A 15 -9.753 0.107 -7.501 1.00 0.43 H new ATOM 0 HB3 ARG A 15 -9.790 -1.228 -6.366 1.00 0.43 H new ATOM 0 HG2 ARG A 15 -11.545 -2.305 -7.902 1.00 1.21 H new ATOM 0 HG3 ARG A 15 -11.138 -1.068 -9.075 1.00 1.21 H new ATOM 0 HD2 ARG A 15 -8.741 -1.810 -8.977 1.00 1.96 H new ATOM 0 HD3 ARG A 15 -9.206 -3.090 -7.874 1.00 1.96 H new ATOM 0 HE ARG A 15 -10.905 -3.418 -10.070 1.00 2.47 H new ATOM 0 HH11 ARG A 15 -7.405 -3.355 -9.538 1.00 3.59 H new ATOM 0 HH12 ARG A 15 -7.073 -4.424 -10.905 1.00 3.59 H new ATOM 0 HH21 ARG A 15 -10.457 -4.764 -11.814 1.00 3.77 H new ATOM 0 HH22 ARG A 15 -8.790 -5.216 -12.185 1.00 3.77 H new ATOM 268 N SER A 16 -13.347 -0.214 -8.078 1.00 0.36 N ATOM 269 CA SER A 16 -14.297 0.290 -9.068 1.00 0.41 C ATOM 270 C SER A 16 -15.473 1.039 -8.426 1.00 0.38 C ATOM 271 O SER A 16 -16.266 1.678 -9.122 1.00 0.41 O ATOM 272 CB SER A 16 -14.825 -0.878 -9.898 1.00 0.47 C ATOM 273 OG SER A 16 -13.760 -1.664 -10.407 1.00 1.10 O ATOM 0 H SER A 16 -13.362 -1.227 -7.958 1.00 0.36 H new ATOM 0 HA SER A 16 -13.768 1.002 -9.701 1.00 0.41 H new ATOM 0 HB2 SER A 16 -15.478 -1.498 -9.284 1.00 0.47 H new ATOM 0 HB3 SER A 16 -15.428 -0.499 -10.723 1.00 0.47 H new ATOM 0 HG SER A 16 -13.492 -2.326 -9.736 1.00 1.10 H new ATOM 279 N ARG A 17 -15.582 0.954 -7.114 1.00 0.34 N ATOM 280 CA ARG A 17 -16.682 1.590 -6.393 1.00 0.34 C ATOM 281 C ARG A 17 -16.221 2.613 -5.346 1.00 0.30 C ATOM 282 O ARG A 17 -17.051 3.116 -4.582 1.00 0.32 O ATOM 283 CB ARG A 17 -17.567 0.527 -5.750 1.00 0.40 C ATOM 284 CG ARG A 17 -18.386 -0.262 -6.769 1.00 0.60 C ATOM 285 CD ARG A 17 -18.729 -1.654 -6.271 1.00 1.17 C ATOM 286 NE ARG A 17 -19.926 -1.671 -5.435 1.00 1.61 N ATOM 287 CZ ARG A 17 -20.752 -2.717 -5.345 1.00 2.24 C ATOM 288 NH1 ARG A 17 -20.525 -3.816 -6.067 1.00 2.71 N ATOM 289 NH2 ARG A 17 -21.812 -2.655 -4.546 1.00 2.95 N ATOM 0 H ARG A 17 -14.924 0.451 -6.519 1.00 0.34 H new ATOM 0 HA ARG A 17 -17.254 2.153 -7.131 1.00 0.34 H new ATOM 0 HB2 ARG A 17 -16.943 -0.162 -5.181 1.00 0.40 H new ATOM 0 HB3 ARG A 17 -18.243 1.005 -5.040 1.00 0.40 H new ATOM 0 HG2 ARG A 17 -19.305 0.280 -6.992 1.00 0.60 H new ATOM 0 HG3 ARG A 17 -17.827 -0.339 -7.702 1.00 0.60 H new ATOM 0 HD2 ARG A 17 -18.877 -2.315 -7.125 1.00 1.17 H new ATOM 0 HD3 ARG A 17 -17.888 -2.050 -5.703 1.00 1.17 H new ATOM 0 HE ARG A 17 -20.144 -0.837 -4.889 1.00 1.61 H new ATOM 0 HH11 ARG A 17 -19.719 -3.859 -6.690 1.00 2.71 H new ATOM 0 HH12 ARG A 17 -21.158 -4.613 -5.996 1.00 2.71 H new ATOM 0 HH21 ARG A 17 -21.993 -1.810 -4.004 1.00 2.95 H new ATOM 0 HH22 ARG A 17 -22.445 -3.452 -4.475 1.00 2.95 H new ATOM 303 N LEU A 18 -14.923 2.939 -5.304 1.00 0.27 N ATOM 304 CA LEU A 18 -14.435 3.849 -4.279 1.00 0.26 C ATOM 305 C LEU A 18 -14.687 5.298 -4.661 1.00 0.24 C ATOM 306 O LEU A 18 -14.606 5.666 -5.831 1.00 0.25 O ATOM 307 CB LEU A 18 -12.944 3.647 -4.036 1.00 0.30 C ATOM 308 CG LEU A 18 -12.564 2.661 -2.934 1.00 0.40 C ATOM 309 CD1 LEU A 18 -11.067 2.406 -2.970 1.00 0.63 C ATOM 310 CD2 LEU A 18 -12.985 3.189 -1.568 1.00 0.49 C ATOM 0 H LEU A 18 -14.215 2.594 -5.952 1.00 0.27 H new ATOM 0 HA LEU A 18 -14.983 3.624 -3.364 1.00 0.26 H new ATOM 0 HB2 LEU A 18 -12.488 3.311 -4.967 1.00 0.30 H new ATOM 0 HB3 LEU A 18 -12.503 4.614 -3.796 1.00 0.30 H new ATOM 0 HG LEU A 18 -13.089 1.721 -3.106 1.00 0.40 H new ATOM 0 HD11 LEU A 18 -10.799 1.702 -2.182 1.00 0.63 H new ATOM 0 HD12 LEU A 18 -10.792 1.989 -3.939 1.00 0.63 H new ATOM 0 HD13 LEU A 18 -10.534 3.344 -2.815 1.00 0.63 H new ATOM 0 HD21 LEU A 18 -12.704 2.470 -0.798 1.00 0.49 H new ATOM 0 HD22 LEU A 18 -12.487 4.140 -1.376 1.00 0.49 H new ATOM 0 HD23 LEU A 18 -14.065 3.335 -1.552 1.00 0.49 H new ATOM 322 N ALA A 19 -15.022 6.107 -3.671 1.00 0.25 N ATOM 323 CA ALA A 19 -15.246 7.529 -3.870 1.00 0.27 C ATOM 324 C ALA A 19 -15.027 8.268 -2.557 1.00 0.29 C ATOM 325 O ALA A 19 -15.459 7.807 -1.505 1.00 0.45 O ATOM 326 CB ALA A 19 -16.652 7.791 -4.387 1.00 0.32 C ATOM 0 H ALA A 19 -15.146 5.797 -2.707 1.00 0.25 H new ATOM 0 HA ALA A 19 -14.538 7.892 -4.615 1.00 0.27 H new ATOM 0 HB1 ALA A 19 -16.794 8.863 -4.528 1.00 0.32 H new ATOM 0 HB2 ALA A 19 -16.791 7.279 -5.339 1.00 0.32 H new ATOM 0 HB3 ALA A 19 -17.380 7.420 -3.666 1.00 0.32 H new ATOM 332 N PHE A 20 -14.334 9.388 -2.599 1.00 0.28 N ATOM 333 CA PHE A 20 -14.099 10.167 -1.399 1.00 0.29 C ATOM 334 C PHE A 20 -14.555 11.601 -1.605 1.00 0.33 C ATOM 335 O PHE A 20 -14.704 12.054 -2.738 1.00 0.35 O ATOM 336 CB PHE A 20 -12.618 10.110 -0.998 1.00 0.31 C ATOM 337 CG PHE A 20 -11.698 10.958 -1.835 1.00 0.32 C ATOM 338 CD1 PHE A 20 -11.123 10.448 -2.982 1.00 1.22 C ATOM 339 CD2 PHE A 20 -11.400 12.258 -1.468 1.00 1.20 C ATOM 340 CE1 PHE A 20 -10.266 11.213 -3.747 1.00 1.25 C ATOM 341 CE2 PHE A 20 -10.548 13.029 -2.228 1.00 1.21 C ATOM 342 CZ PHE A 20 -9.977 12.507 -3.368 1.00 0.41 C ATOM 0 H PHE A 20 -13.925 9.779 -3.448 1.00 0.28 H new ATOM 0 HA PHE A 20 -14.682 9.738 -0.584 1.00 0.29 H new ATOM 0 HB2 PHE A 20 -12.527 10.421 0.043 1.00 0.31 H new ATOM 0 HB3 PHE A 20 -12.282 9.074 -1.052 1.00 0.31 H new ATOM 0 HD1 PHE A 20 -11.347 9.436 -3.285 1.00 1.22 H new ATOM 0 HD2 PHE A 20 -11.841 12.674 -0.574 1.00 1.20 H new ATOM 0 HE1 PHE A 20 -9.823 10.799 -4.641 1.00 1.25 H new ATOM 0 HE2 PHE A 20 -10.328 14.043 -1.930 1.00 1.21 H new ATOM 0 HZ PHE A 20 -9.306 13.109 -3.963 1.00 0.41 H new ATOM 352 N GLU A 21 -14.802 12.305 -0.516 1.00 0.37 N ATOM 353 CA GLU A 21 -15.228 13.684 -0.598 1.00 0.43 C ATOM 354 C GLU A 21 -14.107 14.601 -0.149 1.00 0.46 C ATOM 355 O GLU A 21 -13.569 14.460 0.970 1.00 0.44 O ATOM 356 CB GLU A 21 -16.481 13.924 0.239 1.00 0.48 C ATOM 357 CG GLU A 21 -17.356 15.052 -0.272 1.00 1.11 C ATOM 358 CD GLU A 21 -18.473 15.391 0.689 1.00 1.40 C ATOM 359 OE1 GLU A 21 -19.553 14.777 0.597 1.00 1.92 O ATOM 360 OE2 GLU A 21 -18.275 16.276 1.546 1.00 1.89 O ATOM 0 H GLU A 21 -14.714 11.943 0.433 1.00 0.37 H new ATOM 0 HA GLU A 21 -15.473 13.905 -1.637 1.00 0.43 H new ATOM 0 HB2 GLU A 21 -17.068 13.006 0.267 1.00 0.48 H new ATOM 0 HB3 GLU A 21 -16.184 14.144 1.264 1.00 0.48 H new ATOM 0 HG2 GLU A 21 -16.743 15.937 -0.440 1.00 1.11 H new ATOM 0 HG3 GLU A 21 -17.781 14.771 -1.236 1.00 1.11 H new ATOM 367 N TYR A 22 -13.798 15.541 -1.040 1.00 0.52 N ATOM 368 CA TYR A 22 -12.752 16.530 -0.845 1.00 0.59 C ATOM 369 C TYR A 22 -13.368 17.917 -0.947 1.00 0.65 C ATOM 370 O TYR A 22 -13.924 18.275 -1.984 1.00 0.65 O ATOM 371 CB TYR A 22 -11.638 16.330 -1.895 1.00 0.60 C ATOM 372 CG TYR A 22 -11.086 17.602 -2.520 1.00 0.74 C ATOM 373 CD1 TYR A 22 -10.082 18.335 -1.893 1.00 1.38 C ATOM 374 CD2 TYR A 22 -11.562 18.062 -3.749 1.00 1.53 C ATOM 375 CE1 TYR A 22 -9.576 19.487 -2.464 1.00 1.48 C ATOM 376 CE2 TYR A 22 -11.056 19.213 -4.322 1.00 1.69 C ATOM 377 CZ TYR A 22 -10.066 19.921 -3.675 1.00 1.16 C ATOM 378 OH TYR A 22 -9.564 21.071 -4.245 1.00 1.40 O ATOM 0 H TYR A 22 -14.280 15.634 -1.934 1.00 0.52 H new ATOM 0 HA TYR A 22 -12.301 16.416 0.141 1.00 0.59 H new ATOM 0 HB2 TYR A 22 -10.815 15.790 -1.427 1.00 0.60 H new ATOM 0 HB3 TYR A 22 -12.024 15.694 -2.691 1.00 0.60 H new ATOM 0 HD1 TYR A 22 -9.692 17.997 -0.944 1.00 1.38 H new ATOM 0 HD2 TYR A 22 -12.337 17.510 -4.260 1.00 1.53 H new ATOM 0 HE1 TYR A 22 -8.799 20.045 -1.962 1.00 1.48 H new ATOM 0 HE2 TYR A 22 -11.435 19.557 -5.273 1.00 1.69 H new ATOM 0 HH TYR A 22 -10.016 21.237 -5.099 1.00 1.40 H new ATOM 388 N ASN A 23 -13.305 18.680 0.137 1.00 0.72 N ATOM 389 CA ASN A 23 -13.865 20.035 0.175 1.00 0.80 C ATOM 390 C ASN A 23 -15.341 20.048 -0.238 1.00 0.78 C ATOM 391 O ASN A 23 -15.835 21.036 -0.785 1.00 0.83 O ATOM 392 CB ASN A 23 -13.068 20.962 -0.744 1.00 0.87 C ATOM 393 CG ASN A 23 -12.700 22.263 -0.065 1.00 1.09 C ATOM 394 OD1 ASN A 23 -13.469 23.225 -0.072 1.00 1.72 O ATOM 395 ND2 ASN A 23 -11.512 22.304 0.513 1.00 1.37 N ATOM 0 H ASN A 23 -12.869 18.385 1.011 1.00 0.72 H new ATOM 0 HA ASN A 23 -13.796 20.390 1.203 1.00 0.80 H new ATOM 0 HB2 ASN A 23 -12.160 20.455 -1.070 1.00 0.87 H new ATOM 0 HB3 ASN A 23 -13.653 21.174 -1.639 1.00 0.87 H new ATOM 0 HD21 ASN A 23 -11.200 23.157 0.978 1.00 1.37 H new ATOM 0 HD22 ASN A 23 -10.907 21.483 0.495 1.00 1.37 H new ATOM 402 N GLY A 24 -16.045 18.954 0.036 1.00 0.73 N ATOM 403 CA GLY A 24 -17.451 18.864 -0.319 1.00 0.73 C ATOM 404 C GLY A 24 -17.669 18.325 -1.721 1.00 0.68 C ATOM 405 O GLY A 24 -18.804 18.057 -2.119 1.00 0.70 O ATOM 0 H GLY A 24 -15.667 18.127 0.498 1.00 0.73 H new ATOM 0 HA2 GLY A 24 -17.961 18.220 0.397 1.00 0.73 H new ATOM 0 HA3 GLY A 24 -17.905 19.852 -0.239 1.00 0.73 H new ATOM 409 N GLN A 25 -16.586 18.173 -2.472 1.00 0.64 N ATOM 410 CA GLN A 25 -16.665 17.668 -3.835 1.00 0.60 C ATOM 411 C GLN A 25 -16.437 16.163 -3.849 1.00 0.54 C ATOM 412 O GLN A 25 -15.500 15.664 -3.225 1.00 0.53 O ATOM 413 CB GLN A 25 -15.627 18.357 -4.736 1.00 0.63 C ATOM 414 CG GLN A 25 -15.393 19.824 -4.399 1.00 0.76 C ATOM 415 CD GLN A 25 -16.665 20.647 -4.430 1.00 1.16 C ATOM 416 OE1 GLN A 25 -17.561 20.405 -5.239 1.00 1.91 O ATOM 417 NE2 GLN A 25 -16.759 21.617 -3.539 1.00 1.56 N ATOM 0 H GLN A 25 -15.641 18.393 -2.159 1.00 0.64 H new ATOM 0 HA GLN A 25 -17.660 17.887 -4.221 1.00 0.60 H new ATOM 0 HB2 GLN A 25 -14.681 17.821 -4.659 1.00 0.63 H new ATOM 0 HB3 GLN A 25 -15.953 18.280 -5.773 1.00 0.63 H new ATOM 0 HG2 GLN A 25 -14.943 19.897 -3.409 1.00 0.76 H new ATOM 0 HG3 GLN A 25 -14.677 20.244 -5.106 1.00 0.76 H new ATOM 0 HE21 GLN A 25 -15.994 21.785 -2.886 1.00 1.56 H new ATOM 0 HE22 GLN A 25 -17.597 22.198 -3.504 1.00 1.56 H new ATOM 426 N LEU A 26 -17.295 15.443 -4.552 1.00 0.50 N ATOM 427 CA LEU A 26 -17.178 13.995 -4.640 1.00 0.46 C ATOM 428 C LEU A 26 -16.128 13.593 -5.665 1.00 0.43 C ATOM 429 O LEU A 26 -16.197 13.983 -6.831 1.00 0.47 O ATOM 430 CB LEU A 26 -18.521 13.366 -5.006 1.00 0.49 C ATOM 431 CG LEU A 26 -19.276 12.692 -3.851 1.00 0.54 C ATOM 432 CD1 LEU A 26 -20.344 11.762 -4.394 1.00 0.59 C ATOM 433 CD2 LEU A 26 -18.320 11.927 -2.945 1.00 0.61 C ATOM 0 H LEU A 26 -18.080 15.836 -5.070 1.00 0.50 H new ATOM 0 HA LEU A 26 -16.869 13.629 -3.661 1.00 0.46 H new ATOM 0 HB2 LEU A 26 -19.160 14.140 -5.431 1.00 0.49 H new ATOM 0 HB3 LEU A 26 -18.354 12.625 -5.788 1.00 0.49 H new ATOM 0 HG LEU A 26 -19.754 13.471 -3.257 1.00 0.54 H new ATOM 0 HD11 LEU A 26 -20.872 11.291 -3.565 1.00 0.59 H new ATOM 0 HD12 LEU A 26 -21.051 12.332 -4.997 1.00 0.59 H new ATOM 0 HD13 LEU A 26 -19.878 10.994 -5.011 1.00 0.59 H new ATOM 0 HD21 LEU A 26 -18.881 11.460 -2.136 1.00 0.61 H new ATOM 0 HD22 LEU A 26 -17.808 11.158 -3.523 1.00 0.61 H new ATOM 0 HD23 LEU A 26 -17.586 12.615 -2.527 1.00 0.61 H new ATOM 445 N ILE A 27 -15.159 12.813 -5.218 1.00 0.39 N ATOM 446 CA ILE A 27 -14.081 12.342 -6.078 1.00 0.39 C ATOM 447 C ILE A 27 -14.014 10.821 -6.057 1.00 0.36 C ATOM 448 O ILE A 27 -13.610 10.221 -5.060 1.00 0.42 O ATOM 449 CB ILE A 27 -12.700 12.892 -5.637 1.00 0.41 C ATOM 450 CG1 ILE A 27 -12.777 14.375 -5.226 1.00 0.46 C ATOM 451 CG2 ILE A 27 -11.678 12.699 -6.745 1.00 0.48 C ATOM 452 CD1 ILE A 27 -13.059 15.328 -6.372 1.00 0.78 C ATOM 0 H ILE A 27 -15.095 12.488 -4.253 1.00 0.39 H new ATOM 0 HA ILE A 27 -14.301 12.705 -7.082 1.00 0.39 H new ATOM 0 HB ILE A 27 -12.385 12.327 -4.760 1.00 0.41 H new ATOM 0 HG12 ILE A 27 -13.556 14.491 -4.473 1.00 0.46 H new ATOM 0 HG13 ILE A 27 -11.835 14.659 -4.757 1.00 0.46 H new ATOM 0 HG21 ILE A 27 -10.713 13.090 -6.422 1.00 0.48 H new ATOM 0 HG22 ILE A 27 -11.582 11.637 -6.971 1.00 0.48 H new ATOM 0 HG23 ILE A 27 -12.005 13.232 -7.638 1.00 0.48 H new ATOM 0 HD11 ILE A 27 -13.097 16.350 -5.995 1.00 0.78 H new ATOM 0 HD12 ILE A 27 -12.268 15.245 -7.117 1.00 0.78 H new ATOM 0 HD13 ILE A 27 -14.016 15.075 -6.829 1.00 0.78 H new ATOM 464 N LYS A 28 -14.418 10.204 -7.150 1.00 0.31 N ATOM 465 CA LYS A 28 -14.394 8.758 -7.276 1.00 0.30 C ATOM 466 C LYS A 28 -12.950 8.279 -7.416 1.00 0.30 C ATOM 467 O LYS A 28 -12.147 8.904 -8.116 1.00 0.35 O ATOM 468 CB LYS A 28 -15.213 8.344 -8.476 1.00 0.32 C ATOM 469 CG LYS A 28 -16.233 7.253 -8.191 1.00 0.66 C ATOM 470 CD LYS A 28 -16.925 6.781 -9.465 1.00 1.05 C ATOM 471 CE LYS A 28 -17.831 7.854 -10.048 1.00 1.84 C ATOM 472 NZ LYS A 28 -17.341 8.339 -11.370 1.00 2.41 N ATOM 0 H LYS A 28 -14.772 10.689 -7.975 1.00 0.31 H new ATOM 0 HA LYS A 28 -14.825 8.302 -6.385 1.00 0.30 H new ATOM 0 HB2 LYS A 28 -15.733 9.219 -8.865 1.00 0.32 H new ATOM 0 HB3 LYS A 28 -14.539 7.999 -9.260 1.00 0.32 H new ATOM 0 HG2 LYS A 28 -15.738 6.408 -7.711 1.00 0.66 H new ATOM 0 HG3 LYS A 28 -16.978 7.626 -7.489 1.00 0.66 H new ATOM 0 HD2 LYS A 28 -16.174 6.499 -10.203 1.00 1.05 H new ATOM 0 HD3 LYS A 28 -17.512 5.888 -9.250 1.00 1.05 H new ATOM 0 HE2 LYS A 28 -18.840 7.456 -10.159 1.00 1.84 H new ATOM 0 HE3 LYS A 28 -17.893 8.692 -9.354 1.00 1.84 H new ATOM 0 HZ1 LYS A 28 -17.986 9.069 -11.733 1.00 2.41 H new ATOM 0 HZ2 LYS A 28 -16.389 8.742 -11.261 1.00 2.41 H new ATOM 0 HZ3 LYS A 28 -17.306 7.544 -12.040 1.00 2.41 H new ATOM 486 N ILE A 29 -12.616 7.176 -6.764 1.00 0.28 N ATOM 487 CA ILE A 29 -11.252 6.660 -6.807 1.00 0.31 C ATOM 488 C ILE A 29 -11.179 5.182 -7.184 1.00 0.29 C ATOM 489 O ILE A 29 -11.818 4.322 -6.567 1.00 0.31 O ATOM 490 CB ILE A 29 -10.511 6.861 -5.467 1.00 0.34 C ATOM 491 CG1 ILE A 29 -11.501 7.148 -4.332 1.00 0.31 C ATOM 492 CG2 ILE A 29 -9.501 7.988 -5.603 1.00 0.43 C ATOM 493 CD1 ILE A 29 -10.898 7.013 -2.945 1.00 0.36 C ATOM 0 H ILE A 29 -13.263 6.623 -6.202 1.00 0.28 H new ATOM 0 HA ILE A 29 -10.763 7.242 -7.588 1.00 0.31 H new ATOM 0 HB ILE A 29 -9.981 5.942 -5.217 1.00 0.34 H new ATOM 0 HG12 ILE A 29 -11.893 8.158 -4.451 1.00 0.31 H new ATOM 0 HG13 ILE A 29 -12.347 6.466 -4.419 1.00 0.31 H new ATOM 0 HG21 ILE A 29 -8.981 8.126 -4.655 1.00 0.43 H new ATOM 0 HG22 ILE A 29 -8.779 7.738 -6.380 1.00 0.43 H new ATOM 0 HG23 ILE A 29 -10.018 8.909 -5.871 1.00 0.43 H new ATOM 0 HD11 ILE A 29 -11.658 7.231 -2.195 1.00 0.36 H new ATOM 0 HD12 ILE A 29 -10.531 5.996 -2.805 1.00 0.36 H new ATOM 0 HD13 ILE A 29 -10.071 7.715 -2.838 1.00 0.36 H new ATOM 505 N LEU A 30 -10.465 4.923 -8.264 1.00 0.30 N ATOM 506 CA LEU A 30 -10.232 3.565 -8.745 1.00 0.31 C ATOM 507 C LEU A 30 -8.807 3.145 -8.460 1.00 0.29 C ATOM 508 O LEU A 30 -8.027 3.924 -7.909 1.00 0.28 O ATOM 509 CB LEU A 30 -10.539 3.391 -10.228 1.00 0.36 C ATOM 510 CG LEU A 30 -11.798 2.558 -10.488 1.00 1.41 C ATOM 511 CD1 LEU A 30 -12.955 3.449 -10.900 1.00 1.97 C ATOM 512 CD2 LEU A 30 -11.537 1.483 -11.535 1.00 2.00 C ATOM 0 H LEU A 30 -10.028 5.646 -8.836 1.00 0.30 H new ATOM 0 HA LEU A 30 -10.925 2.922 -8.202 1.00 0.31 H new ATOM 0 HB2 LEU A 30 -10.660 4.373 -10.685 1.00 0.36 H new ATOM 0 HB3 LEU A 30 -9.688 2.915 -10.715 1.00 0.36 H new ATOM 0 HG LEU A 30 -12.070 2.057 -9.559 1.00 1.41 H new ATOM 0 HD11 LEU A 30 -13.839 2.837 -11.080 1.00 1.97 H new ATOM 0 HD12 LEU A 30 -13.164 4.164 -10.105 1.00 1.97 H new ATOM 0 HD13 LEU A 30 -12.694 3.986 -11.812 1.00 1.97 H new ATOM 0 HD21 LEU A 30 -12.448 0.907 -11.700 1.00 2.00 H new ATOM 0 HD22 LEU A 30 -11.230 1.952 -12.470 1.00 2.00 H new ATOM 0 HD23 LEU A 30 -10.746 0.819 -11.186 1.00 2.00 H new ATOM 524 N SER A 31 -8.477 1.916 -8.853 1.00 0.31 N ATOM 525 CA SER A 31 -7.137 1.352 -8.698 1.00 0.33 C ATOM 526 C SER A 31 -6.046 2.274 -9.263 1.00 0.33 C ATOM 527 O SER A 31 -4.858 2.067 -9.014 1.00 0.36 O ATOM 528 CB SER A 31 -7.095 0.008 -9.419 1.00 0.41 C ATOM 529 OG SER A 31 -8.185 -0.096 -10.324 1.00 1.16 O ATOM 0 H SER A 31 -9.139 1.277 -9.293 1.00 0.31 H new ATOM 0 HA SER A 31 -6.936 1.234 -7.633 1.00 0.33 H new ATOM 0 HB2 SER A 31 -6.153 -0.094 -9.959 1.00 0.41 H new ATOM 0 HB3 SER A 31 -7.136 -0.804 -8.693 1.00 0.41 H new ATOM 0 HG SER A 31 -8.121 -0.940 -10.817 1.00 1.16 H new ATOM 535 N LYS A 32 -6.454 3.275 -10.046 1.00 0.34 N ATOM 536 CA LYS A 32 -5.520 4.240 -10.618 1.00 0.38 C ATOM 537 C LYS A 32 -4.768 4.959 -9.509 1.00 0.36 C ATOM 538 O LYS A 32 -3.648 5.434 -9.686 1.00 0.40 O ATOM 539 CB LYS A 32 -6.299 5.306 -11.390 1.00 0.45 C ATOM 540 CG LYS A 32 -7.311 4.769 -12.381 1.00 1.10 C ATOM 541 CD LYS A 32 -8.192 5.883 -12.934 1.00 1.55 C ATOM 542 CE LYS A 32 -7.366 7.013 -13.545 1.00 1.94 C ATOM 543 NZ LYS A 32 -6.305 6.505 -14.456 1.00 2.47 N ATOM 0 H LYS A 32 -7.429 3.436 -10.298 1.00 0.34 H new ATOM 0 HA LYS A 32 -4.829 3.703 -11.268 1.00 0.38 H new ATOM 0 HB2 LYS A 32 -6.817 5.945 -10.675 1.00 0.45 H new ATOM 0 HB3 LYS A 32 -5.589 5.937 -11.925 1.00 0.45 H new ATOM 0 HG2 LYS A 32 -6.792 4.273 -13.201 1.00 1.10 H new ATOM 0 HG3 LYS A 32 -7.934 4.017 -11.896 1.00 1.10 H new ATOM 0 HD2 LYS A 32 -8.863 5.474 -13.690 1.00 1.55 H new ATOM 0 HD3 LYS A 32 -8.817 6.282 -12.135 1.00 1.55 H new ATOM 0 HE2 LYS A 32 -8.024 7.685 -14.096 1.00 1.94 H new ATOM 0 HE3 LYS A 32 -6.908 7.598 -12.748 1.00 1.94 H new ATOM 0 HZ1 LYS A 32 -6.157 7.185 -15.229 1.00 2.47 H new ATOM 0 HZ2 LYS A 32 -5.419 6.386 -13.925 1.00 2.47 H new ATOM 0 HZ3 LYS A 32 -6.597 5.589 -14.852 1.00 2.47 H new ATOM 557 N ASN A 33 -5.427 5.035 -8.375 1.00 0.31 N ATOM 558 CA ASN A 33 -4.901 5.698 -7.203 1.00 0.33 C ATOM 559 C ASN A 33 -4.627 4.698 -6.093 1.00 0.30 C ATOM 560 O ASN A 33 -3.690 4.846 -5.315 1.00 0.38 O ATOM 561 CB ASN A 33 -5.935 6.733 -6.758 1.00 0.36 C ATOM 562 CG ASN A 33 -5.948 7.952 -7.652 1.00 0.75 C ATOM 563 OD1 ASN A 33 -5.051 8.793 -7.606 1.00 1.28 O ATOM 564 ND2 ASN A 33 -6.981 8.058 -8.474 1.00 1.12 N ATOM 0 H ASN A 33 -6.355 4.633 -8.239 1.00 0.31 H new ATOM 0 HA ASN A 33 -3.953 6.183 -7.436 1.00 0.33 H new ATOM 0 HB2 ASN A 33 -6.925 6.277 -6.755 1.00 0.36 H new ATOM 0 HB3 ASN A 33 -5.722 7.039 -5.734 1.00 0.36 H new ATOM 0 HD21 ASN A 33 -7.054 8.860 -9.101 1.00 1.12 H new ATOM 0 HD22 ASN A 33 -7.703 7.338 -8.481 1.00 1.12 H new ATOM 571 N ILE A 34 -5.452 3.669 -6.040 1.00 0.33 N ATOM 572 CA ILE A 34 -5.341 2.647 -5.016 1.00 0.33 C ATOM 573 C ILE A 34 -4.737 1.360 -5.573 1.00 0.29 C ATOM 574 O ILE A 34 -5.289 0.748 -6.486 1.00 0.30 O ATOM 575 CB ILE A 34 -6.729 2.355 -4.402 1.00 0.35 C ATOM 576 CG1 ILE A 34 -7.163 3.502 -3.488 1.00 0.53 C ATOM 577 CG2 ILE A 34 -6.717 1.051 -3.637 1.00 0.58 C ATOM 578 CD1 ILE A 34 -7.861 4.635 -4.207 1.00 0.59 C ATOM 0 H ILE A 34 -6.214 3.518 -6.701 1.00 0.33 H new ATOM 0 HA ILE A 34 -4.674 3.024 -4.241 1.00 0.33 H new ATOM 0 HB ILE A 34 -7.447 2.267 -5.217 1.00 0.35 H new ATOM 0 HG12 ILE A 34 -7.829 3.108 -2.720 1.00 0.53 H new ATOM 0 HG13 ILE A 34 -6.285 3.897 -2.977 1.00 0.53 H new ATOM 0 HG21 ILE A 34 -7.705 0.868 -3.215 1.00 0.58 H new ATOM 0 HG22 ILE A 34 -6.454 0.236 -4.311 1.00 0.58 H new ATOM 0 HG23 ILE A 34 -5.983 1.108 -2.833 1.00 0.58 H new ATOM 0 HD11 ILE A 34 -8.136 5.407 -3.489 1.00 0.59 H new ATOM 0 HD12 ILE A 34 -7.191 5.058 -4.956 1.00 0.59 H new ATOM 0 HD13 ILE A 34 -8.759 4.257 -4.695 1.00 0.59 H new ATOM 590 N VAL A 35 -3.613 0.947 -5.011 1.00 0.27 N ATOM 591 CA VAL A 35 -2.945 -0.266 -5.441 1.00 0.26 C ATOM 592 C VAL A 35 -3.046 -1.328 -4.352 1.00 0.25 C ATOM 593 O VAL A 35 -2.616 -1.112 -3.215 1.00 0.26 O ATOM 594 CB VAL A 35 -1.459 -0.008 -5.791 1.00 0.30 C ATOM 595 CG1 VAL A 35 -0.710 -1.316 -6.017 1.00 0.45 C ATOM 596 CG2 VAL A 35 -1.355 0.880 -7.021 1.00 0.51 C ATOM 0 H VAL A 35 -3.143 1.439 -4.251 1.00 0.27 H new ATOM 0 HA VAL A 35 -3.443 -0.619 -6.344 1.00 0.26 H new ATOM 0 HB VAL A 35 -0.997 0.502 -4.946 1.00 0.30 H new ATOM 0 HG11 VAL A 35 0.331 -1.102 -6.261 1.00 0.45 H new ATOM 0 HG12 VAL A 35 -0.753 -1.921 -5.112 1.00 0.45 H new ATOM 0 HG13 VAL A 35 -1.171 -1.862 -6.840 1.00 0.45 H new ATOM 0 HG21 VAL A 35 -0.305 1.054 -7.257 1.00 0.51 H new ATOM 0 HG22 VAL A 35 -1.840 0.390 -7.865 1.00 0.51 H new ATOM 0 HG23 VAL A 35 -1.845 1.833 -6.824 1.00 0.51 H new ATOM 606 N ALA A 36 -3.627 -2.468 -4.704 1.00 0.25 N ATOM 607 CA ALA A 36 -3.808 -3.565 -3.765 1.00 0.25 C ATOM 608 C ALA A 36 -2.492 -4.274 -3.482 1.00 0.24 C ATOM 609 O ALA A 36 -1.743 -4.605 -4.399 1.00 0.27 O ATOM 610 CB ALA A 36 -4.838 -4.546 -4.300 1.00 0.30 C ATOM 0 H ALA A 36 -3.983 -2.656 -5.641 1.00 0.25 H new ATOM 0 HA ALA A 36 -4.169 -3.150 -2.824 1.00 0.25 H new ATOM 0 HB1 ALA A 36 -4.966 -5.363 -3.590 1.00 0.30 H new ATOM 0 HB2 ALA A 36 -5.790 -4.034 -4.439 1.00 0.30 H new ATOM 0 HB3 ALA A 36 -4.498 -4.946 -5.255 1.00 0.30 H new ATOM 616 N VAL A 37 -2.230 -4.501 -2.208 1.00 0.23 N ATOM 617 CA VAL A 37 -1.012 -5.166 -1.772 1.00 0.24 C ATOM 618 C VAL A 37 -1.301 -6.094 -0.600 1.00 0.25 C ATOM 619 O VAL A 37 -2.252 -5.885 0.168 1.00 0.25 O ATOM 620 CB VAL A 37 0.088 -4.162 -1.363 1.00 0.27 C ATOM 621 CG1 VAL A 37 0.841 -3.658 -2.584 1.00 0.29 C ATOM 622 CG2 VAL A 37 -0.514 -3.000 -0.585 1.00 0.30 C ATOM 0 H VAL A 37 -2.853 -4.231 -1.447 1.00 0.23 H new ATOM 0 HA VAL A 37 -0.648 -5.742 -2.622 1.00 0.24 H new ATOM 0 HB VAL A 37 0.798 -4.678 -0.717 1.00 0.27 H new ATOM 0 HG11 VAL A 37 1.611 -2.952 -2.271 1.00 0.29 H new ATOM 0 HG12 VAL A 37 1.307 -4.499 -3.097 1.00 0.29 H new ATOM 0 HG13 VAL A 37 0.146 -3.161 -3.260 1.00 0.29 H new ATOM 0 HG21 VAL A 37 0.275 -2.302 -0.305 1.00 0.30 H new ATOM 0 HG22 VAL A 37 -1.248 -2.487 -1.207 1.00 0.30 H new ATOM 0 HG23 VAL A 37 -1.001 -3.378 0.314 1.00 0.30 H new ATOM 632 N GLY A 38 -0.542 -7.169 -0.527 1.00 0.27 N ATOM 633 CA GLY A 38 -0.721 -8.109 0.549 1.00 0.30 C ATOM 634 C GLY A 38 -0.355 -9.511 0.142 1.00 0.32 C ATOM 635 O GLY A 38 0.360 -9.730 -0.847 1.00 0.32 O ATOM 0 H GLY A 38 0.194 -7.407 -1.192 1.00 0.27 H new ATOM 0 HA2 GLY A 38 -0.109 -7.807 1.399 1.00 0.30 H new ATOM 0 HA3 GLY A 38 -1.759 -8.087 0.880 1.00 0.30 H new ATOM 639 N SER A 39 -0.878 -10.474 0.884 1.00 0.38 N ATOM 640 CA SER A 39 -0.670 -11.867 0.564 1.00 0.43 C ATOM 641 C SER A 39 -1.365 -12.155 -0.763 1.00 0.43 C ATOM 642 O SER A 39 -1.011 -13.094 -1.478 1.00 0.44 O ATOM 643 CB SER A 39 -1.203 -12.745 1.689 1.00 0.57 C ATOM 644 OG SER A 39 -0.590 -12.403 2.921 1.00 1.40 O ATOM 0 H SER A 39 -1.450 -10.311 1.713 1.00 0.38 H new ATOM 0 HA SER A 39 0.392 -12.090 0.463 1.00 0.43 H new ATOM 0 HB2 SER A 39 -2.284 -12.627 1.769 1.00 0.57 H new ATOM 0 HB3 SER A 39 -1.013 -13.794 1.461 1.00 0.57 H new ATOM 0 HG SER A 39 -0.945 -12.975 3.633 1.00 1.40 H new ATOM 650 N LEU A 40 -2.363 -11.317 -1.079 1.00 0.45 N ATOM 651 CA LEU A 40 -3.093 -11.402 -2.333 1.00 0.51 C ATOM 652 C LEU A 40 -2.112 -11.215 -3.484 1.00 0.47 C ATOM 653 O LEU A 40 -2.217 -11.866 -4.521 1.00 0.52 O ATOM 654 CB LEU A 40 -4.201 -10.328 -2.349 1.00 0.63 C ATOM 655 CG LEU A 40 -4.368 -9.510 -3.638 1.00 0.97 C ATOM 656 CD1 LEU A 40 -5.844 -9.315 -3.954 1.00 1.24 C ATOM 657 CD2 LEU A 40 -3.684 -8.153 -3.506 1.00 2.02 C ATOM 0 H LEU A 40 -2.680 -10.565 -0.467 1.00 0.45 H new ATOM 0 HA LEU A 40 -3.569 -12.377 -2.441 1.00 0.51 H new ATOM 0 HB2 LEU A 40 -5.150 -10.819 -2.135 1.00 0.63 H new ATOM 0 HB3 LEU A 40 -4.010 -9.634 -1.531 1.00 0.63 H new ATOM 0 HG LEU A 40 -3.899 -10.061 -4.454 1.00 0.97 H new ATOM 0 HD11 LEU A 40 -5.946 -8.733 -4.870 1.00 1.24 H new ATOM 0 HD12 LEU A 40 -6.319 -10.287 -4.086 1.00 1.24 H new ATOM 0 HD13 LEU A 40 -6.325 -8.785 -3.132 1.00 1.24 H new ATOM 0 HD21 LEU A 40 -3.814 -7.589 -4.430 1.00 2.02 H new ATOM 0 HD22 LEU A 40 -4.128 -7.601 -2.678 1.00 2.02 H new ATOM 0 HD23 LEU A 40 -2.621 -8.299 -3.316 1.00 2.02 H new ATOM 669 N ARG A 41 -1.140 -10.329 -3.273 1.00 0.43 N ATOM 670 CA ARG A 41 -0.112 -10.072 -4.266 1.00 0.47 C ATOM 671 C ARG A 41 0.910 -11.210 -4.254 1.00 0.47 C ATOM 672 O ARG A 41 1.460 -11.575 -5.291 1.00 0.54 O ATOM 673 CB ARG A 41 0.586 -8.729 -4.004 1.00 0.50 C ATOM 674 CG ARG A 41 1.484 -8.285 -5.152 1.00 0.92 C ATOM 675 CD ARG A 41 2.343 -7.091 -4.774 1.00 1.30 C ATOM 676 NE ARG A 41 3.771 -7.372 -4.949 1.00 1.82 N ATOM 677 CZ ARG A 41 4.599 -6.644 -5.705 1.00 2.29 C ATOM 678 NH1 ARG A 41 4.160 -5.568 -6.345 1.00 2.67 N ATOM 679 NH2 ARG A 41 5.872 -6.998 -5.822 1.00 2.98 N ATOM 0 H ARG A 41 -1.047 -9.779 -2.419 1.00 0.43 H new ATOM 0 HA ARG A 41 -0.584 -10.019 -5.247 1.00 0.47 H new ATOM 0 HB2 ARG A 41 -0.169 -7.963 -3.825 1.00 0.50 H new ATOM 0 HB3 ARG A 41 1.182 -8.808 -3.095 1.00 0.50 H new ATOM 0 HG2 ARG A 41 2.126 -9.113 -5.451 1.00 0.92 H new ATOM 0 HG3 ARG A 41 0.869 -8.030 -6.015 1.00 0.92 H new ATOM 0 HD2 ARG A 41 2.063 -6.233 -5.386 1.00 1.30 H new ATOM 0 HD3 ARG A 41 2.150 -6.818 -3.736 1.00 1.30 H new ATOM 0 HE ARG A 41 4.160 -8.179 -4.460 1.00 1.82 H new ATOM 0 HH11 ARG A 41 3.182 -5.289 -6.263 1.00 2.67 H new ATOM 0 HH12 ARG A 41 4.800 -5.020 -6.919 1.00 2.67 H new ATOM 0 HH21 ARG A 41 6.218 -7.825 -5.335 1.00 2.98 H new ATOM 0 HH22 ARG A 41 6.505 -6.443 -6.399 1.00 2.98 H new ATOM 693 N ARG A 42 1.170 -11.761 -3.067 1.00 0.43 N ATOM 694 CA ARG A 42 2.121 -12.868 -2.919 1.00 0.48 C ATOM 695 C ARG A 42 1.528 -14.211 -3.362 1.00 0.47 C ATOM 696 O ARG A 42 2.240 -15.222 -3.388 1.00 0.52 O ATOM 697 CB ARG A 42 2.584 -12.968 -1.468 1.00 0.52 C ATOM 698 CG ARG A 42 4.043 -12.585 -1.266 1.00 1.06 C ATOM 699 CD ARG A 42 4.559 -13.060 0.081 1.00 1.93 C ATOM 700 NE ARG A 42 4.688 -14.518 0.133 1.00 2.68 N ATOM 701 CZ ARG A 42 3.782 -15.330 0.686 1.00 3.60 C ATOM 702 NH1 ARG A 42 2.730 -14.827 1.322 1.00 3.96 N ATOM 703 NH2 ARG A 42 3.939 -16.645 0.626 1.00 4.52 N ATOM 0 H ARG A 42 0.737 -11.460 -2.194 1.00 0.43 H new ATOM 0 HA ARG A 42 2.969 -12.652 -3.569 1.00 0.48 H new ATOM 0 HB2 ARG A 42 1.959 -12.323 -0.851 1.00 0.52 H new ATOM 0 HB3 ARG A 42 2.433 -13.989 -1.117 1.00 0.52 H new ATOM 0 HG2 ARG A 42 4.648 -13.018 -2.062 1.00 1.06 H new ATOM 0 HG3 ARG A 42 4.150 -11.503 -1.337 1.00 1.06 H new ATOM 0 HD2 ARG A 42 5.528 -12.602 0.280 1.00 1.93 H new ATOM 0 HD3 ARG A 42 3.881 -12.727 0.867 1.00 1.93 H new ATOM 0 HE ARG A 42 5.521 -14.940 -0.278 1.00 2.68 H new ATOM 0 HH11 ARG A 42 2.611 -13.816 1.390 1.00 3.96 H new ATOM 0 HH12 ARG A 42 2.042 -15.451 1.742 1.00 3.96 H new ATOM 0 HH21 ARG A 42 4.754 -17.040 0.157 1.00 4.52 H new ATOM 0 HH22 ARG A 42 3.245 -17.261 1.049 1.00 4.52 H new ATOM 717 N GLU A 43 0.226 -14.216 -3.670 1.00 0.46 N ATOM 718 CA GLU A 43 -0.475 -15.417 -4.155 1.00 0.50 C ATOM 719 C GLU A 43 -0.691 -16.453 -3.032 1.00 0.47 C ATOM 720 O GLU A 43 -0.374 -17.636 -3.186 1.00 0.52 O ATOM 721 CB GLU A 43 0.297 -16.027 -5.338 1.00 0.59 C ATOM 722 CG GLU A 43 0.529 -15.040 -6.476 1.00 0.67 C ATOM 723 CD GLU A 43 1.688 -15.425 -7.380 1.00 0.95 C ATOM 724 OE1 GLU A 43 2.184 -16.571 -7.272 1.00 1.53 O ATOM 725 OE2 GLU A 43 2.105 -14.580 -8.203 1.00 1.60 O ATOM 0 H GLU A 43 -0.372 -13.393 -3.592 1.00 0.46 H new ATOM 0 HA GLU A 43 -1.466 -15.118 -4.496 1.00 0.50 H new ATOM 0 HB2 GLU A 43 1.260 -16.396 -4.984 1.00 0.59 H new ATOM 0 HB3 GLU A 43 -0.254 -16.887 -5.718 1.00 0.59 H new ATOM 0 HG2 GLU A 43 -0.379 -14.966 -7.074 1.00 0.67 H new ATOM 0 HG3 GLU A 43 0.717 -14.051 -6.057 1.00 0.67 H new ATOM 732 N GLU A 44 -1.257 -16.000 -1.912 1.00 0.43 N ATOM 733 CA GLU A 44 -1.519 -16.867 -0.759 1.00 0.43 C ATOM 734 C GLU A 44 -2.821 -17.656 -0.890 1.00 0.43 C ATOM 735 O GLU A 44 -3.776 -17.219 -1.536 1.00 0.52 O ATOM 736 CB GLU A 44 -1.551 -16.066 0.535 1.00 0.48 C ATOM 737 CG GLU A 44 -0.295 -16.221 1.377 1.00 1.24 C ATOM 738 CD GLU A 44 0.302 -17.619 1.305 1.00 1.94 C ATOM 739 OE1 GLU A 44 -0.463 -18.612 1.314 1.00 2.57 O ATOM 740 OE2 GLU A 44 1.544 -17.738 1.236 1.00 2.47 O ATOM 0 H GLU A 44 -1.545 -15.031 -1.778 1.00 0.43 H new ATOM 0 HA GLU A 44 -0.695 -17.580 -0.733 1.00 0.43 H new ATOM 0 HB2 GLU A 44 -1.691 -15.012 0.297 1.00 0.48 H new ATOM 0 HB3 GLU A 44 -2.414 -16.377 1.124 1.00 0.48 H new ATOM 0 HG2 GLU A 44 0.449 -15.497 1.046 1.00 1.24 H new ATOM 0 HG3 GLU A 44 -0.529 -15.985 2.415 1.00 1.24 H new ATOM 747 N LYS A 45 -2.837 -18.819 -0.244 1.00 0.46 N ATOM 748 CA LYS A 45 -3.979 -19.731 -0.261 1.00 0.50 C ATOM 749 C LYS A 45 -5.160 -19.165 0.525 1.00 0.49 C ATOM 750 O LYS A 45 -6.309 -19.255 0.087 1.00 0.56 O ATOM 751 CB LYS A 45 -3.604 -21.109 0.322 1.00 0.59 C ATOM 752 CG LYS A 45 -2.105 -21.396 0.427 1.00 1.14 C ATOM 753 CD LYS A 45 -1.486 -21.742 -0.914 1.00 1.28 C ATOM 754 CE LYS A 45 -0.536 -20.652 -1.399 1.00 1.42 C ATOM 755 NZ LYS A 45 0.565 -20.396 -0.434 1.00 2.10 N ATOM 0 H LYS A 45 -2.051 -19.158 0.311 1.00 0.46 H new ATOM 0 HA LYS A 45 -4.269 -19.848 -1.305 1.00 0.50 H new ATOM 0 HB2 LYS A 45 -4.043 -21.195 1.316 1.00 0.59 H new ATOM 0 HB3 LYS A 45 -4.061 -21.882 -0.296 1.00 0.59 H new ATOM 0 HG2 LYS A 45 -1.600 -20.525 0.843 1.00 1.14 H new ATOM 0 HG3 LYS A 45 -1.944 -22.220 1.122 1.00 1.14 H new ATOM 0 HD2 LYS A 45 -0.945 -22.685 -0.832 1.00 1.28 H new ATOM 0 HD3 LYS A 45 -2.275 -21.890 -1.651 1.00 1.28 H new ATOM 0 HE2 LYS A 45 -0.113 -20.942 -2.361 1.00 1.42 H new ATOM 0 HE3 LYS A 45 -1.096 -19.731 -1.562 1.00 1.42 H new ATOM 0 HZ1 LYS A 45 1.300 -19.818 -0.891 1.00 2.10 H new ATOM 0 HZ2 LYS A 45 0.191 -19.889 0.393 1.00 2.10 H new ATOM 0 HZ3 LYS A 45 0.976 -21.301 -0.129 1.00 2.10 H new ATOM 769 N MET A 46 -4.868 -18.578 1.681 1.00 0.46 N ATOM 770 CA MET A 46 -5.903 -18.013 2.533 1.00 0.48 C ATOM 771 C MET A 46 -5.473 -16.665 3.096 1.00 0.46 C ATOM 772 O MET A 46 -4.321 -16.483 3.490 1.00 0.67 O ATOM 773 CB MET A 46 -6.236 -18.976 3.673 1.00 0.60 C ATOM 774 CG MET A 46 -7.507 -18.603 4.427 1.00 0.67 C ATOM 775 SD MET A 46 -8.239 -19.995 5.314 1.00 1.15 S ATOM 776 CE MET A 46 -8.175 -21.281 4.060 1.00 2.00 C ATOM 0 H MET A 46 -3.921 -18.482 2.048 1.00 0.46 H new ATOM 0 HA MET A 46 -6.794 -17.860 1.925 1.00 0.48 H new ATOM 0 HB2 MET A 46 -6.344 -19.983 3.269 1.00 0.60 H new ATOM 0 HB3 MET A 46 -5.401 -19.001 4.373 1.00 0.60 H new ATOM 0 HG2 MET A 46 -7.281 -17.806 5.136 1.00 0.67 H new ATOM 0 HG3 MET A 46 -8.237 -18.205 3.722 1.00 0.67 H new ATOM 0 HE1 MET A 46 -8.959 -22.014 4.250 1.00 2.00 H new ATOM 0 HE2 MET A 46 -8.325 -20.837 3.076 1.00 2.00 H new ATOM 0 HE3 MET A 46 -7.203 -21.773 4.092 1.00 2.00 H new ATOM 786 N LEU A 47 -6.407 -15.725 3.127 1.00 0.49 N ATOM 787 CA LEU A 47 -6.127 -14.388 3.633 1.00 0.56 C ATOM 788 C LEU A 47 -7.125 -13.958 4.706 1.00 0.55 C ATOM 789 O LEU A 47 -8.176 -14.583 4.893 1.00 0.59 O ATOM 790 CB LEU A 47 -6.138 -13.385 2.475 1.00 0.82 C ATOM 791 CG LEU A 47 -4.828 -12.622 2.267 1.00 0.43 C ATOM 792 CD1 LEU A 47 -4.845 -11.841 0.967 1.00 1.09 C ATOM 793 CD2 LEU A 47 -4.586 -11.682 3.420 1.00 1.09 C ATOM 0 H LEU A 47 -7.366 -15.863 2.808 1.00 0.49 H new ATOM 0 HA LEU A 47 -5.141 -14.409 4.096 1.00 0.56 H new ATOM 0 HB2 LEU A 47 -6.381 -13.918 1.555 1.00 0.82 H new ATOM 0 HB3 LEU A 47 -6.937 -12.664 2.646 1.00 0.82 H new ATOM 0 HG LEU A 47 -4.021 -13.353 2.217 1.00 0.43 H new ATOM 0 HD11 LEU A 47 -3.900 -11.310 0.849 1.00 1.09 H new ATOM 0 HD12 LEU A 47 -4.982 -12.528 0.132 1.00 1.09 H new ATOM 0 HD13 LEU A 47 -5.665 -11.123 0.985 1.00 1.09 H new ATOM 0 HD21 LEU A 47 -3.651 -11.144 3.261 1.00 1.09 H new ATOM 0 HD22 LEU A 47 -5.408 -10.969 3.487 1.00 1.09 H new ATOM 0 HD23 LEU A 47 -4.524 -12.252 4.347 1.00 1.09 H new ATOM 805 N ASN A 48 -6.768 -12.900 5.426 1.00 0.61 N ATOM 806 CA ASN A 48 -7.616 -12.349 6.475 1.00 0.64 C ATOM 807 C ASN A 48 -8.097 -10.955 6.093 1.00 0.52 C ATOM 808 O ASN A 48 -9.284 -10.647 6.173 1.00 0.54 O ATOM 809 CB ASN A 48 -6.856 -12.280 7.806 1.00 0.77 C ATOM 810 CG ASN A 48 -7.734 -11.820 8.955 1.00 1.47 C ATOM 811 OD1 ASN A 48 -7.881 -10.621 9.206 1.00 2.03 O ATOM 812 ND2 ASN A 48 -8.318 -12.767 9.673 1.00 2.14 N ATOM 0 H ASN A 48 -5.887 -12.403 5.299 1.00 0.61 H new ATOM 0 HA ASN A 48 -8.477 -13.007 6.592 1.00 0.64 H new ATOM 0 HB2 ASN A 48 -6.446 -13.263 8.038 1.00 0.77 H new ATOM 0 HB3 ASN A 48 -6.011 -11.599 7.703 1.00 0.77 H new ATOM 0 HD21 ASN A 48 -8.912 -12.515 10.463 1.00 2.14 H new ATOM 0 HD22 ASN A 48 -8.174 -13.749 9.436 1.00 2.14 H new ATOM 819 N ASP A 49 -7.162 -10.119 5.673 1.00 0.49 N ATOM 820 CA ASP A 49 -7.470 -8.750 5.283 1.00 0.39 C ATOM 821 C ASP A 49 -6.713 -8.381 4.026 1.00 0.34 C ATOM 822 O ASP A 49 -5.641 -8.922 3.767 1.00 0.42 O ATOM 823 CB ASP A 49 -7.105 -7.768 6.413 1.00 0.43 C ATOM 824 CG ASP A 49 -5.628 -7.366 6.446 1.00 0.52 C ATOM 825 OD1 ASP A 49 -4.728 -8.255 6.353 1.00 1.02 O ATOM 826 OD2 ASP A 49 -5.342 -6.163 6.613 1.00 1.05 O ATOM 0 H ASP A 49 -6.176 -10.366 5.593 1.00 0.49 H new ATOM 0 HA ASP A 49 -8.541 -8.684 5.091 1.00 0.39 H new ATOM 0 HB2 ASP A 49 -7.712 -6.869 6.307 1.00 0.43 H new ATOM 0 HB3 ASP A 49 -7.368 -8.219 7.370 1.00 0.43 H new ATOM 831 N VAL A 50 -7.262 -7.481 3.236 1.00 0.28 N ATOM 832 CA VAL A 50 -6.564 -7.054 2.035 1.00 0.27 C ATOM 833 C VAL A 50 -6.080 -5.653 2.244 1.00 0.24 C ATOM 834 O VAL A 50 -6.796 -4.815 2.799 1.00 0.26 O ATOM 835 CB VAL A 50 -7.407 -7.130 0.755 1.00 0.36 C ATOM 836 CG1 VAL A 50 -6.589 -6.649 -0.438 1.00 0.88 C ATOM 837 CG2 VAL A 50 -7.890 -8.546 0.529 1.00 0.90 C ATOM 0 H VAL A 50 -8.167 -7.038 3.395 1.00 0.28 H new ATOM 0 HA VAL A 50 -5.737 -7.748 1.881 1.00 0.27 H new ATOM 0 HB VAL A 50 -8.277 -6.483 0.866 1.00 0.36 H new ATOM 0 HG11 VAL A 50 -7.195 -6.707 -1.342 1.00 0.88 H new ATOM 0 HG12 VAL A 50 -6.279 -5.617 -0.274 1.00 0.88 H new ATOM 0 HG13 VAL A 50 -5.707 -7.279 -0.552 1.00 0.88 H new ATOM 0 HG21 VAL A 50 -8.487 -8.586 -0.382 1.00 0.90 H new ATOM 0 HG22 VAL A 50 -7.032 -9.212 0.431 1.00 0.90 H new ATOM 0 HG23 VAL A 50 -8.499 -8.862 1.376 1.00 0.90 H new ATOM 847 N ASP A 51 -4.865 -5.398 1.828 1.00 0.24 N ATOM 848 CA ASP A 51 -4.274 -4.118 2.029 1.00 0.24 C ATOM 849 C ASP A 51 -4.202 -3.341 0.729 1.00 0.24 C ATOM 850 O ASP A 51 -4.034 -3.916 -0.346 1.00 0.26 O ATOM 851 CB ASP A 51 -2.922 -4.388 2.645 1.00 0.27 C ATOM 852 CG ASP A 51 -3.060 -5.140 3.952 1.00 0.31 C ATOM 853 OD1 ASP A 51 -3.279 -6.383 3.967 1.00 0.40 O ATOM 854 OD2 ASP A 51 -2.936 -4.498 4.995 1.00 0.38 O ATOM 0 H ASP A 51 -4.270 -6.071 1.346 1.00 0.24 H new ATOM 0 HA ASP A 51 -4.865 -3.485 2.691 1.00 0.24 H new ATOM 0 HB2 ASP A 51 -2.312 -4.967 1.951 1.00 0.27 H new ATOM 0 HB3 ASP A 51 -2.402 -3.445 2.817 1.00 0.27 H new ATOM 859 N LEU A 52 -4.375 -2.032 0.817 1.00 0.26 N ATOM 860 CA LEU A 52 -4.384 -1.200 -0.370 1.00 0.31 C ATOM 861 C LEU A 52 -3.739 0.160 -0.121 1.00 0.25 C ATOM 862 O LEU A 52 -4.162 0.925 0.754 1.00 0.32 O ATOM 863 CB LEU A 52 -5.825 -1.010 -0.851 1.00 0.41 C ATOM 864 CG LEU A 52 -6.564 -2.290 -1.274 1.00 0.64 C ATOM 865 CD1 LEU A 52 -7.235 -2.953 -0.084 1.00 1.28 C ATOM 866 CD2 LEU A 52 -7.591 -1.989 -2.350 1.00 1.07 C ATOM 0 H LEU A 52 -4.510 -1.527 1.693 1.00 0.26 H new ATOM 0 HA LEU A 52 -3.797 -1.706 -1.136 1.00 0.31 H new ATOM 0 HB2 LEU A 52 -6.394 -0.531 -0.054 1.00 0.41 H new ATOM 0 HB3 LEU A 52 -5.818 -0.321 -1.696 1.00 0.41 H new ATOM 0 HG LEU A 52 -5.824 -2.980 -1.680 1.00 0.64 H new ATOM 0 HD11 LEU A 52 -7.750 -3.856 -0.413 1.00 1.28 H new ATOM 0 HD12 LEU A 52 -6.482 -3.215 0.659 1.00 1.28 H new ATOM 0 HD13 LEU A 52 -7.956 -2.265 0.357 1.00 1.28 H new ATOM 0 HD21 LEU A 52 -8.101 -2.909 -2.634 1.00 1.07 H new ATOM 0 HD22 LEU A 52 -8.319 -1.273 -1.968 1.00 1.07 H new ATOM 0 HD23 LEU A 52 -7.091 -1.568 -3.222 1.00 1.07 H new ATOM 878 N LEU A 53 -2.691 0.442 -0.873 1.00 0.27 N ATOM 879 CA LEU A 53 -1.998 1.715 -0.775 1.00 0.31 C ATOM 880 C LEU A 53 -2.648 2.733 -1.695 1.00 0.26 C ATOM 881 O LEU A 53 -2.917 2.449 -2.859 1.00 0.26 O ATOM 882 CB LEU A 53 -0.529 1.563 -1.164 1.00 0.48 C ATOM 883 CG LEU A 53 0.311 0.696 -0.232 1.00 0.79 C ATOM 884 CD1 LEU A 53 1.494 0.128 -0.984 1.00 1.59 C ATOM 885 CD2 LEU A 53 0.786 1.502 0.961 1.00 1.06 C ATOM 0 H LEU A 53 -2.298 -0.198 -1.563 1.00 0.27 H new ATOM 0 HA LEU A 53 -2.061 2.055 0.259 1.00 0.31 H new ATOM 0 HB2 LEU A 53 -0.479 1.141 -2.168 1.00 0.48 H new ATOM 0 HB3 LEU A 53 -0.080 2.555 -1.212 1.00 0.48 H new ATOM 0 HG LEU A 53 -0.306 -0.125 0.132 1.00 0.79 H new ATOM 0 HD11 LEU A 53 2.089 -0.490 -0.312 1.00 1.59 H new ATOM 0 HD12 LEU A 53 1.138 -0.479 -1.816 1.00 1.59 H new ATOM 0 HD13 LEU A 53 2.108 0.944 -1.366 1.00 1.59 H new ATOM 0 HD21 LEU A 53 1.384 0.867 1.615 1.00 1.06 H new ATOM 0 HD22 LEU A 53 1.392 2.340 0.616 1.00 1.06 H new ATOM 0 HD23 LEU A 53 -0.076 1.880 1.511 1.00 1.06 H new ATOM 897 N ILE A 54 -2.900 3.910 -1.167 1.00 0.26 N ATOM 898 CA ILE A 54 -3.498 4.980 -1.943 1.00 0.25 C ATOM 899 C ILE A 54 -2.418 5.990 -2.300 1.00 0.25 C ATOM 900 O ILE A 54 -1.920 6.706 -1.430 1.00 0.27 O ATOM 901 CB ILE A 54 -4.624 5.691 -1.167 1.00 0.29 C ATOM 902 CG1 ILE A 54 -5.515 4.666 -0.448 1.00 0.52 C ATOM 903 CG2 ILE A 54 -5.448 6.566 -2.106 1.00 0.41 C ATOM 904 CD1 ILE A 54 -6.614 5.290 0.388 1.00 0.58 C ATOM 0 H ILE A 54 -2.699 4.154 -0.197 1.00 0.26 H new ATOM 0 HA ILE A 54 -3.936 4.546 -2.842 1.00 0.25 H new ATOM 0 HB ILE A 54 -4.172 6.334 -0.412 1.00 0.29 H new ATOM 0 HG12 ILE A 54 -5.966 4.007 -1.190 1.00 0.52 H new ATOM 0 HG13 ILE A 54 -4.892 4.044 0.194 1.00 0.52 H new ATOM 0 HG21 ILE A 54 -6.239 7.061 -1.542 1.00 0.41 H new ATOM 0 HG22 ILE A 54 -4.803 7.317 -2.563 1.00 0.41 H new ATOM 0 HG23 ILE A 54 -5.892 5.946 -2.885 1.00 0.41 H new ATOM 0 HD11 ILE A 54 -7.200 4.504 0.864 1.00 0.58 H new ATOM 0 HD12 ILE A 54 -6.171 5.927 1.154 1.00 0.58 H new ATOM 0 HD13 ILE A 54 -7.262 5.889 -0.252 1.00 0.58 H new ATOM 916 N ILE A 55 -2.048 6.030 -3.565 1.00 0.25 N ATOM 917 CA ILE A 55 -1.013 6.937 -4.032 1.00 0.26 C ATOM 918 C ILE A 55 -1.628 8.204 -4.593 1.00 0.25 C ATOM 919 O ILE A 55 -2.343 8.170 -5.594 1.00 0.29 O ATOM 920 CB ILE A 55 -0.135 6.287 -5.120 1.00 0.30 C ATOM 921 CG1 ILE A 55 0.313 4.893 -4.687 1.00 0.35 C ATOM 922 CG2 ILE A 55 1.068 7.162 -5.424 1.00 0.48 C ATOM 923 CD1 ILE A 55 -0.565 3.796 -5.241 1.00 0.44 C ATOM 0 H ILE A 55 -2.451 5.441 -4.294 1.00 0.25 H new ATOM 0 HA ILE A 55 -0.388 7.176 -3.172 1.00 0.26 H new ATOM 0 HB ILE A 55 -0.729 6.189 -6.028 1.00 0.30 H new ATOM 0 HG12 ILE A 55 1.340 4.729 -5.013 1.00 0.35 H new ATOM 0 HG13 ILE A 55 0.312 4.838 -3.598 1.00 0.35 H new ATOM 0 HG21 ILE A 55 1.677 6.688 -6.194 1.00 0.48 H new ATOM 0 HG22 ILE A 55 0.729 8.136 -5.777 1.00 0.48 H new ATOM 0 HG23 ILE A 55 1.662 7.291 -4.519 1.00 0.48 H new ATOM 0 HD11 ILE A 55 -0.197 2.828 -4.899 1.00 0.44 H new ATOM 0 HD12 ILE A 55 -1.588 3.939 -4.894 1.00 0.44 H new ATOM 0 HD13 ILE A 55 -0.544 3.828 -6.330 1.00 0.44 H new ATOM 935 N VAL A 56 -1.346 9.318 -3.947 1.00 0.24 N ATOM 936 CA VAL A 56 -1.885 10.594 -4.373 1.00 0.26 C ATOM 937 C VAL A 56 -0.776 11.547 -4.813 1.00 0.27 C ATOM 938 O VAL A 56 0.232 11.710 -4.122 1.00 0.25 O ATOM 939 CB VAL A 56 -2.710 11.250 -3.249 1.00 0.28 C ATOM 940 CG1 VAL A 56 -3.653 12.296 -3.817 1.00 0.34 C ATOM 941 CG2 VAL A 56 -3.484 10.202 -2.459 1.00 0.33 C ATOM 0 H VAL A 56 -0.746 9.365 -3.124 1.00 0.24 H new ATOM 0 HA VAL A 56 -2.537 10.398 -5.224 1.00 0.26 H new ATOM 0 HB VAL A 56 -2.018 11.745 -2.567 1.00 0.28 H new ATOM 0 HG11 VAL A 56 -4.226 12.747 -3.007 1.00 0.34 H new ATOM 0 HG12 VAL A 56 -3.076 13.068 -4.327 1.00 0.34 H new ATOM 0 HG13 VAL A 56 -4.335 11.825 -4.525 1.00 0.34 H new ATOM 0 HG21 VAL A 56 -4.058 10.691 -1.672 1.00 0.33 H new ATOM 0 HG22 VAL A 56 -4.162 9.671 -3.127 1.00 0.33 H new ATOM 0 HG23 VAL A 56 -2.786 9.494 -2.013 1.00 0.33 H new ATOM 951 N PRO A 57 -0.942 12.171 -5.992 1.00 0.31 N ATOM 952 CA PRO A 57 0.033 13.130 -6.533 1.00 0.34 C ATOM 953 C PRO A 57 0.069 14.448 -5.753 1.00 0.34 C ATOM 954 O PRO A 57 0.948 15.284 -5.969 1.00 0.37 O ATOM 955 CB PRO A 57 -0.465 13.374 -7.960 1.00 0.39 C ATOM 956 CG PRO A 57 -1.914 13.053 -7.928 1.00 0.41 C ATOM 957 CD PRO A 57 -2.074 11.953 -6.915 1.00 0.37 C ATOM 0 HA PRO A 57 1.050 12.742 -6.475 1.00 0.34 H new ATOM 0 HB2 PRO A 57 -0.297 14.407 -8.264 1.00 0.39 H new ATOM 0 HB3 PRO A 57 0.062 12.742 -8.674 1.00 0.39 H new ATOM 0 HG2 PRO A 57 -2.501 13.928 -7.649 1.00 0.41 H new ATOM 0 HG3 PRO A 57 -2.264 12.733 -8.909 1.00 0.41 H new ATOM 0 HD2 PRO A 57 -3.032 12.018 -6.399 1.00 0.37 H new ATOM 0 HD3 PRO A 57 -2.029 10.968 -7.380 1.00 0.37 H new ATOM 965 N GLU A 58 -0.877 14.632 -4.841 1.00 0.33 N ATOM 966 CA GLU A 58 -0.940 15.853 -4.046 1.00 0.36 C ATOM 967 C GLU A 58 -1.144 15.547 -2.580 1.00 0.35 C ATOM 968 O GLU A 58 -1.956 14.692 -2.225 1.00 0.34 O ATOM 969 CB GLU A 58 -2.077 16.764 -4.494 1.00 0.40 C ATOM 970 CG GLU A 58 -1.623 17.938 -5.345 1.00 0.64 C ATOM 971 CD GLU A 58 -1.044 19.048 -4.499 1.00 1.32 C ATOM 972 OE1 GLU A 58 -0.337 18.734 -3.521 1.00 2.00 O ATOM 973 OE2 GLU A 58 -1.312 20.233 -4.784 1.00 1.99 O ATOM 0 H GLU A 58 -1.610 13.954 -4.633 1.00 0.33 H new ATOM 0 HA GLU A 58 0.015 16.357 -4.195 1.00 0.36 H new ATOM 0 HB2 GLU A 58 -2.800 16.176 -5.059 1.00 0.40 H new ATOM 0 HB3 GLU A 58 -2.594 17.144 -3.613 1.00 0.40 H new ATOM 0 HG2 GLU A 58 -0.876 17.600 -6.063 1.00 0.64 H new ATOM 0 HG3 GLU A 58 -2.467 18.320 -5.919 1.00 0.64 H new ATOM 980 N LYS A 59 -0.418 16.256 -1.737 1.00 0.36 N ATOM 981 CA LYS A 59 -0.546 16.085 -0.299 1.00 0.37 C ATOM 982 C LYS A 59 -1.910 16.582 0.136 1.00 0.37 C ATOM 983 O LYS A 59 -2.512 16.062 1.075 1.00 0.37 O ATOM 984 CB LYS A 59 0.546 16.836 0.465 1.00 0.42 C ATOM 985 CG LYS A 59 0.498 16.574 1.963 1.00 1.10 C ATOM 986 CD LYS A 59 1.833 16.829 2.640 1.00 1.46 C ATOM 987 CE LYS A 59 1.808 16.354 4.085 1.00 2.16 C ATOM 988 NZ LYS A 59 3.108 16.561 4.766 1.00 2.64 N ATOM 0 H LYS A 59 0.267 16.956 -2.021 1.00 0.36 H new ATOM 0 HA LYS A 59 -0.435 15.025 -0.070 1.00 0.37 H new ATOM 0 HB2 LYS A 59 1.522 16.541 0.080 1.00 0.42 H new ATOM 0 HB3 LYS A 59 0.441 17.906 0.283 1.00 0.42 H new ATOM 0 HG2 LYS A 59 -0.263 17.210 2.416 1.00 1.10 H new ATOM 0 HG3 LYS A 59 0.196 15.541 2.139 1.00 1.10 H new ATOM 0 HD2 LYS A 59 2.625 16.313 2.097 1.00 1.46 H new ATOM 0 HD3 LYS A 59 2.065 17.894 2.607 1.00 1.46 H new ATOM 0 HE2 LYS A 59 1.027 16.887 4.627 1.00 2.16 H new ATOM 0 HE3 LYS A 59 1.550 15.295 4.113 1.00 2.16 H new ATOM 0 HZ1 LYS A 59 3.044 16.223 5.747 1.00 2.64 H new ATOM 0 HZ2 LYS A 59 3.850 16.032 4.265 1.00 2.64 H new ATOM 0 HZ3 LYS A 59 3.344 17.574 4.764 1.00 2.64 H new ATOM 1002 N LYS A 60 -2.396 17.586 -0.584 1.00 0.40 N ATOM 1003 CA LYS A 60 -3.690 18.175 -0.298 1.00 0.42 C ATOM 1004 C LYS A 60 -4.777 17.151 -0.559 1.00 0.40 C ATOM 1005 O LYS A 60 -5.528 16.795 0.347 1.00 0.41 O ATOM 1006 CB LYS A 60 -3.912 19.421 -1.152 1.00 0.48 C ATOM 1007 CG LYS A 60 -3.452 20.711 -0.486 1.00 0.69 C ATOM 1008 CD LYS A 60 -1.995 20.647 -0.046 1.00 0.79 C ATOM 1009 CE LYS A 60 -1.035 20.564 -1.226 1.00 0.94 C ATOM 1010 NZ LYS A 60 -1.450 21.425 -2.370 1.00 1.50 N ATOM 0 H LYS A 60 -1.907 18.008 -1.373 1.00 0.40 H new ATOM 0 HA LYS A 60 -3.724 18.474 0.750 1.00 0.42 H new ATOM 0 HB2 LYS A 60 -3.382 19.302 -2.097 1.00 0.48 H new ATOM 0 HB3 LYS A 60 -4.973 19.503 -1.389 1.00 0.48 H new ATOM 0 HG2 LYS A 60 -3.584 21.542 -1.179 1.00 0.69 H new ATOM 0 HG3 LYS A 60 -4.082 20.915 0.380 1.00 0.69 H new ATOM 0 HD2 LYS A 60 -1.759 21.529 0.549 1.00 0.79 H new ATOM 0 HD3 LYS A 60 -1.851 19.780 0.598 1.00 0.79 H new ATOM 0 HE2 LYS A 60 -0.038 20.858 -0.899 1.00 0.94 H new ATOM 0 HE3 LYS A 60 -0.968 19.529 -1.562 1.00 0.94 H new ATOM 0 HZ1 LYS A 60 -0.605 21.810 -2.839 1.00 1.50 H new ATOM 0 HZ2 LYS A 60 -1.997 20.859 -3.050 1.00 1.50 H new ATOM 0 HZ3 LYS A 60 -2.038 22.208 -2.020 1.00 1.50 H new ATOM 1024 N LEU A 61 -4.851 16.667 -1.800 1.00 0.40 N ATOM 1025 CA LEU A 61 -5.835 15.669 -2.164 1.00 0.40 C ATOM 1026 C LEU A 61 -5.765 14.464 -1.238 1.00 0.37 C ATOM 1027 O LEU A 61 -6.793 13.916 -0.861 1.00 0.42 O ATOM 1028 CB LEU A 61 -5.633 15.229 -3.610 1.00 0.42 C ATOM 1029 CG LEU A 61 -5.863 16.317 -4.665 1.00 0.45 C ATOM 1030 CD1 LEU A 61 -5.687 15.748 -6.058 1.00 0.57 C ATOM 1031 CD2 LEU A 61 -7.249 16.931 -4.508 1.00 0.52 C ATOM 0 H LEU A 61 -4.238 16.955 -2.563 1.00 0.40 H new ATOM 0 HA LEU A 61 -6.822 16.119 -2.063 1.00 0.40 H new ATOM 0 HB2 LEU A 61 -4.617 14.850 -3.718 1.00 0.42 H new ATOM 0 HB3 LEU A 61 -6.307 14.398 -3.817 1.00 0.42 H new ATOM 0 HG LEU A 61 -5.122 17.103 -4.517 1.00 0.45 H new ATOM 0 HD11 LEU A 61 -5.854 16.533 -6.795 1.00 0.57 H new ATOM 0 HD12 LEU A 61 -4.675 15.357 -6.166 1.00 0.57 H new ATOM 0 HD13 LEU A 61 -6.405 14.944 -6.216 1.00 0.57 H new ATOM 0 HD21 LEU A 61 -7.394 17.701 -5.266 1.00 0.52 H new ATOM 0 HD22 LEU A 61 -8.006 16.156 -4.629 1.00 0.52 H new ATOM 0 HD23 LEU A 61 -7.340 17.375 -3.517 1.00 0.52 H new ATOM 1043 N LEU A 62 -4.554 14.077 -0.849 1.00 0.32 N ATOM 1044 CA LEU A 62 -4.348 12.937 0.036 1.00 0.31 C ATOM 1045 C LEU A 62 -4.977 13.188 1.399 1.00 0.34 C ATOM 1046 O LEU A 62 -5.726 12.359 1.919 1.00 0.36 O ATOM 1047 CB LEU A 62 -2.846 12.677 0.183 1.00 0.31 C ATOM 1048 CG LEU A 62 -2.411 11.899 1.424 1.00 0.40 C ATOM 1049 CD1 LEU A 62 -1.540 10.722 1.023 1.00 0.65 C ATOM 1050 CD2 LEU A 62 -1.660 12.805 2.389 1.00 0.58 C ATOM 0 H LEU A 62 -3.693 14.542 -1.137 1.00 0.32 H new ATOM 0 HA LEU A 62 -4.829 12.060 -0.398 1.00 0.31 H new ATOM 0 HB2 LEU A 62 -2.505 12.133 -0.698 1.00 0.31 H new ATOM 0 HB3 LEU A 62 -2.331 13.638 0.184 1.00 0.31 H new ATOM 0 HG LEU A 62 -3.302 11.524 1.928 1.00 0.40 H new ATOM 0 HD11 LEU A 62 -1.235 10.174 1.915 1.00 0.65 H new ATOM 0 HD12 LEU A 62 -2.103 10.060 0.365 1.00 0.65 H new ATOM 0 HD13 LEU A 62 -0.655 11.086 0.501 1.00 0.65 H new ATOM 0 HD21 LEU A 62 -1.359 12.232 3.266 1.00 0.58 H new ATOM 0 HD22 LEU A 62 -0.775 13.207 1.896 1.00 0.58 H new ATOM 0 HD23 LEU A 62 -2.308 13.626 2.697 1.00 0.58 H new ATOM 1062 N LYS A 63 -4.678 14.347 1.963 1.00 0.37 N ATOM 1063 CA LYS A 63 -5.202 14.727 3.265 1.00 0.43 C ATOM 1064 C LYS A 63 -6.716 14.894 3.212 1.00 0.46 C ATOM 1065 O LYS A 63 -7.388 14.817 4.236 1.00 0.52 O ATOM 1066 CB LYS A 63 -4.549 16.030 3.736 1.00 0.47 C ATOM 1067 CG LYS A 63 -4.828 16.366 5.190 1.00 1.14 C ATOM 1068 CD LYS A 63 -4.364 17.766 5.537 1.00 1.36 C ATOM 1069 CE LYS A 63 -4.737 18.142 6.962 1.00 1.86 C ATOM 1070 NZ LYS A 63 -6.194 18.400 7.107 1.00 2.13 N ATOM 0 H LYS A 63 -4.070 15.046 1.536 1.00 0.37 H new ATOM 0 HA LYS A 63 -4.967 13.932 3.973 1.00 0.43 H new ATOM 0 HB2 LYS A 63 -3.471 15.959 3.590 1.00 0.47 H new ATOM 0 HB3 LYS A 63 -4.902 16.849 3.110 1.00 0.47 H new ATOM 0 HG2 LYS A 63 -5.896 16.277 5.386 1.00 1.14 H new ATOM 0 HG3 LYS A 63 -4.324 15.645 5.834 1.00 1.14 H new ATOM 0 HD2 LYS A 63 -3.283 17.833 5.414 1.00 1.36 H new ATOM 0 HD3 LYS A 63 -4.809 18.480 4.843 1.00 1.36 H new ATOM 0 HE2 LYS A 63 -4.442 17.339 7.638 1.00 1.86 H new ATOM 0 HE3 LYS A 63 -4.180 19.030 7.260 1.00 1.86 H new ATOM 0 HZ1 LYS A 63 -6.388 18.767 8.061 1.00 2.13 H new ATOM 0 HZ2 LYS A 63 -6.495 19.100 6.399 1.00 2.13 H new ATOM 0 HZ3 LYS A 63 -6.719 17.514 6.963 1.00 2.13 H new ATOM 1084 N HIS A 64 -7.247 15.120 2.016 1.00 0.45 N ATOM 1085 CA HIS A 64 -8.682 15.306 1.845 1.00 0.51 C ATOM 1086 C HIS A 64 -9.405 13.997 1.535 1.00 0.38 C ATOM 1087 O HIS A 64 -10.628 13.981 1.421 1.00 0.37 O ATOM 1088 CB HIS A 64 -8.967 16.351 0.773 1.00 0.69 C ATOM 1089 CG HIS A 64 -8.777 17.753 1.263 1.00 0.96 C ATOM 1090 ND1 HIS A 64 -9.809 18.660 1.282 1.00 1.60 N ATOM 1091 CD2 HIS A 64 -7.661 18.345 1.747 1.00 0.76 C ATOM 1092 CE1 HIS A 64 -9.297 19.775 1.774 1.00 1.71 C ATOM 1093 NE2 HIS A 64 -7.998 19.631 2.069 1.00 1.18 N ATOM 0 H HIS A 64 -6.707 15.179 1.153 1.00 0.45 H new ATOM 0 HA HIS A 64 -9.073 15.667 2.796 1.00 0.51 H new ATOM 0 HB2 HIS A 64 -8.311 16.177 -0.080 1.00 0.69 H new ATOM 0 HB3 HIS A 64 -9.991 16.231 0.418 1.00 0.69 H new ATOM 0 HD2 HIS A 64 -6.688 17.889 1.858 1.00 0.76 H new ATOM 0 HE1 HIS A 64 -9.856 20.688 1.920 1.00 1.71 H new ATOM 0 HE2 HIS A 64 -7.380 20.343 2.458 1.00 1.18 H new ATOM 1101 N VAL A 65 -8.661 12.905 1.409 1.00 0.36 N ATOM 1102 CA VAL A 65 -9.276 11.603 1.156 1.00 0.35 C ATOM 1103 C VAL A 65 -9.852 11.061 2.464 1.00 0.37 C ATOM 1104 O VAL A 65 -10.841 10.329 2.479 1.00 0.43 O ATOM 1105 CB VAL A 65 -8.271 10.578 0.568 1.00 0.41 C ATOM 1106 CG1 VAL A 65 -8.936 9.230 0.328 1.00 1.04 C ATOM 1107 CG2 VAL A 65 -7.664 11.092 -0.726 1.00 1.09 C ATOM 0 H VAL A 65 -7.643 12.891 1.476 1.00 0.36 H new ATOM 0 HA VAL A 65 -10.064 11.745 0.416 1.00 0.35 H new ATOM 0 HB VAL A 65 -7.475 10.446 1.301 1.00 0.41 H new ATOM 0 HG11 VAL A 65 -8.207 8.533 -0.084 1.00 1.04 H new ATOM 0 HG12 VAL A 65 -9.318 8.840 1.271 1.00 1.04 H new ATOM 0 HG13 VAL A 65 -9.760 9.351 -0.375 1.00 1.04 H new ATOM 0 HG21 VAL A 65 -6.963 10.355 -1.117 1.00 1.09 H new ATOM 0 HG22 VAL A 65 -8.455 11.264 -1.456 1.00 1.09 H new ATOM 0 HG23 VAL A 65 -7.138 12.027 -0.535 1.00 1.09 H new ATOM 1117 N LEU A 66 -9.223 11.462 3.565 1.00 0.41 N ATOM 1118 CA LEU A 66 -9.631 11.034 4.898 1.00 0.52 C ATOM 1119 C LEU A 66 -10.984 11.631 5.334 1.00 0.51 C ATOM 1120 O LEU A 66 -11.834 10.891 5.832 1.00 0.56 O ATOM 1121 CB LEU A 66 -8.542 11.375 5.925 1.00 0.67 C ATOM 1122 CG LEU A 66 -7.142 10.834 5.601 1.00 0.86 C ATOM 1123 CD1 LEU A 66 -6.161 11.219 6.696 1.00 1.65 C ATOM 1124 CD2 LEU A 66 -7.178 9.324 5.422 1.00 0.83 C ATOM 0 H LEU A 66 -8.419 12.090 3.558 1.00 0.41 H new ATOM 0 HA LEU A 66 -9.765 9.953 4.853 1.00 0.52 H new ATOM 0 HB2 LEU A 66 -8.482 12.459 6.020 1.00 0.67 H new ATOM 0 HB3 LEU A 66 -8.848 10.987 6.897 1.00 0.67 H new ATOM 0 HG LEU A 66 -6.808 11.280 4.664 1.00 0.86 H new ATOM 0 HD11 LEU A 66 -5.173 10.829 6.453 1.00 1.65 H new ATOM 0 HD12 LEU A 66 -6.113 12.305 6.776 1.00 1.65 H new ATOM 0 HD13 LEU A 66 -6.493 10.800 7.646 1.00 1.65 H new ATOM 0 HD21 LEU A 66 -6.176 8.961 5.193 1.00 0.83 H new ATOM 0 HD22 LEU A 66 -7.532 8.857 6.341 1.00 0.83 H new ATOM 0 HD23 LEU A 66 -7.852 9.071 4.603 1.00 0.83 H new ATOM 1136 N PRO A 67 -11.199 12.975 5.198 1.00 0.50 N ATOM 1137 CA PRO A 67 -12.460 13.631 5.581 1.00 0.53 C ATOM 1138 C PRO A 67 -13.701 12.810 5.248 1.00 0.46 C ATOM 1139 O PRO A 67 -14.474 12.460 6.142 1.00 0.54 O ATOM 1140 CB PRO A 67 -12.428 14.921 4.770 1.00 0.58 C ATOM 1141 CG PRO A 67 -10.988 15.278 4.715 1.00 0.68 C ATOM 1142 CD PRO A 67 -10.226 13.974 4.701 1.00 0.55 C ATOM 0 HA PRO A 67 -12.528 13.778 6.659 1.00 0.53 H new ATOM 0 HB2 PRO A 67 -12.841 14.775 3.772 1.00 0.58 H new ATOM 0 HB3 PRO A 67 -13.015 15.706 5.246 1.00 0.58 H new ATOM 0 HG2 PRO A 67 -10.767 15.866 3.824 1.00 0.68 H new ATOM 0 HG3 PRO A 67 -10.705 15.884 5.576 1.00 0.68 H new ATOM 0 HD2 PRO A 67 -9.880 13.727 3.698 1.00 0.55 H new ATOM 0 HD3 PRO A 67 -9.344 14.022 5.340 1.00 0.55 H new ATOM 1150 N ASN A 68 -13.912 12.499 3.978 1.00 0.38 N ATOM 1151 CA ASN A 68 -15.066 11.691 3.626 1.00 0.43 C ATOM 1152 C ASN A 68 -14.705 10.626 2.612 1.00 0.40 C ATOM 1153 O ASN A 68 -14.073 10.904 1.605 1.00 0.35 O ATOM 1154 CB ASN A 68 -16.209 12.551 3.102 1.00 0.53 C ATOM 1155 CG ASN A 68 -17.569 12.049 3.550 1.00 0.99 C ATOM 1156 OD1 ASN A 68 -17.739 10.870 3.869 1.00 1.73 O ATOM 1157 ND2 ASN A 68 -18.551 12.937 3.564 1.00 1.40 N ATOM 0 H ASN A 68 -13.320 12.783 3.198 1.00 0.38 H new ATOM 0 HA ASN A 68 -15.401 11.197 4.538 1.00 0.43 H new ATOM 0 HB2 ASN A 68 -16.074 13.577 3.444 1.00 0.53 H new ATOM 0 HB3 ASN A 68 -16.174 12.571 2.013 1.00 0.53 H new ATOM 0 HD21 ASN A 68 -19.490 12.655 3.846 1.00 1.40 H new ATOM 0 HD22 ASN A 68 -18.369 13.903 3.293 1.00 1.40 H new ATOM 1164 N ILE A 69 -15.113 9.407 2.901 1.00 0.46 N ATOM 1165 CA ILE A 69 -14.870 8.271 2.027 1.00 0.48 C ATOM 1166 C ILE A 69 -16.124 7.409 1.982 1.00 0.58 C ATOM 1167 O ILE A 69 -16.726 7.120 3.020 1.00 0.79 O ATOM 1168 CB ILE A 69 -13.652 7.430 2.484 1.00 0.56 C ATOM 1169 CG1 ILE A 69 -13.463 6.224 1.557 1.00 0.60 C ATOM 1170 CG2 ILE A 69 -13.809 6.979 3.934 1.00 0.70 C ATOM 1171 CD1 ILE A 69 -12.123 5.534 1.721 1.00 0.71 C ATOM 0 H ILE A 69 -15.625 9.173 3.752 1.00 0.46 H new ATOM 0 HA ILE A 69 -14.635 8.647 1.031 1.00 0.48 H new ATOM 0 HB ILE A 69 -12.762 8.057 2.426 1.00 0.56 H new ATOM 0 HG12 ILE A 69 -14.258 5.503 1.746 1.00 0.60 H new ATOM 0 HG13 ILE A 69 -13.569 6.552 0.523 1.00 0.60 H new ATOM 0 HG21 ILE A 69 -12.940 6.391 4.228 1.00 0.70 H new ATOM 0 HG22 ILE A 69 -13.891 7.853 4.580 1.00 0.70 H new ATOM 0 HG23 ILE A 69 -14.708 6.371 4.031 1.00 0.70 H new ATOM 0 HD11 ILE A 69 -12.061 4.691 1.033 1.00 0.71 H new ATOM 0 HD12 ILE A 69 -11.321 6.240 1.503 1.00 0.71 H new ATOM 0 HD13 ILE A 69 -12.022 5.175 2.745 1.00 0.71 H new ATOM 1183 N ARG A 70 -16.549 7.040 0.789 1.00 0.48 N ATOM 1184 CA ARG A 70 -17.740 6.229 0.626 1.00 0.61 C ATOM 1185 C ARG A 70 -17.542 5.180 -0.454 1.00 0.41 C ATOM 1186 O ARG A 70 -16.618 5.268 -1.265 1.00 0.34 O ATOM 1187 CB ARG A 70 -18.946 7.105 0.278 1.00 0.82 C ATOM 1188 CG ARG A 70 -19.485 7.905 1.456 1.00 1.23 C ATOM 1189 CD ARG A 70 -20.977 8.174 1.317 1.00 1.41 C ATOM 1190 NE ARG A 70 -21.714 6.962 0.955 1.00 1.74 N ATOM 1191 CZ ARG A 70 -22.220 6.100 1.833 1.00 2.19 C ATOM 1192 NH1 ARG A 70 -22.132 6.334 3.138 1.00 2.55 N ATOM 1193 NH2 ARG A 70 -22.836 5.006 1.403 1.00 2.92 N ATOM 0 H ARG A 70 -16.085 7.290 -0.084 1.00 0.48 H new ATOM 0 HA ARG A 70 -17.928 5.724 1.573 1.00 0.61 H new ATOM 0 HB2 ARG A 70 -18.665 7.794 -0.519 1.00 0.82 H new ATOM 0 HB3 ARG A 70 -19.742 6.472 -0.114 1.00 0.82 H new ATOM 0 HG2 ARG A 70 -19.298 7.361 2.382 1.00 1.23 H new ATOM 0 HG3 ARG A 70 -18.950 8.852 1.529 1.00 1.23 H new ATOM 0 HD2 ARG A 70 -21.365 8.569 2.256 1.00 1.41 H new ATOM 0 HD3 ARG A 70 -21.140 8.939 0.558 1.00 1.41 H new ATOM 0 HE ARG A 70 -21.849 6.765 -0.037 1.00 1.74 H new ATOM 0 HH11 ARG A 70 -21.673 7.181 3.475 1.00 2.55 H new ATOM 0 HH12 ARG A 70 -22.523 5.667 3.803 1.00 2.55 H new ATOM 0 HH21 ARG A 70 -22.920 4.828 0.402 1.00 2.92 H new ATOM 0 HH22 ARG A 70 -23.225 4.343 2.073 1.00 2.92 H new ATOM 1207 N ILE A 71 -18.406 4.180 -0.437 1.00 0.62 N ATOM 1208 CA ILE A 71 -18.366 3.111 -1.416 1.00 0.48 C ATOM 1209 C ILE A 71 -19.748 2.956 -2.028 1.00 0.45 C ATOM 1210 O ILE A 71 -20.752 2.967 -1.313 1.00 0.58 O ATOM 1211 CB ILE A 71 -17.919 1.768 -0.802 1.00 0.56 C ATOM 1212 CG1 ILE A 71 -16.679 1.961 0.069 1.00 0.96 C ATOM 1213 CG2 ILE A 71 -17.635 0.758 -1.911 1.00 0.76 C ATOM 1214 CD1 ILE A 71 -16.265 0.717 0.831 1.00 1.09 C ATOM 0 H ILE A 71 -19.151 4.087 0.253 1.00 0.62 H new ATOM 0 HA ILE A 71 -17.632 3.378 -2.176 1.00 0.48 H new ATOM 0 HB ILE A 71 -18.723 1.387 -0.172 1.00 0.56 H new ATOM 0 HG12 ILE A 71 -15.850 2.282 -0.562 1.00 0.96 H new ATOM 0 HG13 ILE A 71 -16.868 2.765 0.780 1.00 0.96 H new ATOM 0 HG21 ILE A 71 -17.320 -0.188 -1.470 1.00 0.76 H new ATOM 0 HG22 ILE A 71 -18.539 0.601 -2.500 1.00 0.76 H new ATOM 0 HG23 ILE A 71 -16.843 1.139 -2.556 1.00 0.76 H new ATOM 0 HD11 ILE A 71 -15.378 0.933 1.426 1.00 1.09 H new ATOM 0 HD12 ILE A 71 -17.077 0.407 1.489 1.00 1.09 H new ATOM 0 HD13 ILE A 71 -16.043 -0.084 0.126 1.00 1.09 H new ATOM 1226 N LYS A 72 -19.791 2.830 -3.342 1.00 0.38 N ATOM 1227 CA LYS A 72 -21.054 2.700 -4.064 1.00 0.47 C ATOM 1228 C LYS A 72 -21.841 1.452 -3.658 1.00 0.43 C ATOM 1229 O LYS A 72 -21.443 0.324 -3.974 1.00 0.49 O ATOM 1230 CB LYS A 72 -20.802 2.662 -5.572 1.00 0.64 C ATOM 1231 CG LYS A 72 -20.462 4.014 -6.181 1.00 0.87 C ATOM 1232 CD LYS A 72 -20.488 3.960 -7.699 1.00 1.57 C ATOM 1233 CE LYS A 72 -21.803 3.390 -8.213 1.00 1.96 C ATOM 1234 NZ LYS A 72 -22.178 3.953 -9.534 1.00 2.63 N ATOM 0 H LYS A 72 -18.963 2.814 -3.938 1.00 0.38 H new ATOM 0 HA LYS A 72 -21.652 3.572 -3.801 1.00 0.47 H new ATOM 0 HB2 LYS A 72 -19.986 1.969 -5.775 1.00 0.64 H new ATOM 0 HB3 LYS A 72 -21.688 2.265 -6.067 1.00 0.64 H new ATOM 0 HG2 LYS A 72 -21.173 4.762 -5.830 1.00 0.87 H new ATOM 0 HG3 LYS A 72 -19.475 4.329 -5.843 1.00 0.87 H new ATOM 0 HD2 LYS A 72 -20.342 4.962 -8.103 1.00 1.57 H new ATOM 0 HD3 LYS A 72 -19.660 3.348 -8.057 1.00 1.57 H new ATOM 0 HE2 LYS A 72 -21.721 2.306 -8.292 1.00 1.96 H new ATOM 0 HE3 LYS A 72 -22.594 3.599 -7.493 1.00 1.96 H new ATOM 0 HZ1 LYS A 72 -23.079 3.537 -9.845 1.00 2.63 H new ATOM 0 HZ2 LYS A 72 -22.282 4.985 -9.455 1.00 2.63 H new ATOM 0 HZ3 LYS A 72 -21.436 3.732 -10.229 1.00 2.63 H new ATOM 1248 N GLY A 73 -22.942 1.663 -2.940 1.00 0.46 N ATOM 1249 CA GLY A 73 -23.803 0.562 -2.542 1.00 0.53 C ATOM 1250 C GLY A 73 -23.149 -0.430 -1.588 1.00 0.47 C ATOM 1251 O GLY A 73 -23.421 -1.625 -1.673 1.00 0.52 O ATOM 0 H GLY A 73 -23.254 2.582 -2.626 1.00 0.46 H new ATOM 0 HA2 GLY A 73 -24.697 0.968 -2.069 1.00 0.53 H new ATOM 0 HA3 GLY A 73 -24.129 0.029 -3.435 1.00 0.53 H new ATOM 1255 N LEU A 74 -22.268 0.024 -0.712 1.00 0.40 N ATOM 1256 CA LEU A 74 -21.597 -0.891 0.211 1.00 0.36 C ATOM 1257 C LEU A 74 -21.674 -0.422 1.664 1.00 0.34 C ATOM 1258 O LEU A 74 -21.886 0.762 1.929 1.00 0.35 O ATOM 1259 CB LEU A 74 -20.130 -1.025 -0.182 1.00 0.38 C ATOM 1260 CG LEU A 74 -19.618 -2.456 -0.279 1.00 0.47 C ATOM 1261 CD1 LEU A 74 -19.925 -3.043 -1.650 1.00 0.70 C ATOM 1262 CD2 LEU A 74 -18.128 -2.502 0.006 1.00 0.56 C ATOM 0 H LEU A 74 -22.000 1.004 -0.617 1.00 0.40 H new ATOM 0 HA LEU A 74 -22.111 -1.850 0.141 1.00 0.36 H new ATOM 0 HB2 LEU A 74 -19.981 -0.536 -1.145 1.00 0.38 H new ATOM 0 HB3 LEU A 74 -19.524 -0.487 0.546 1.00 0.38 H new ATOM 0 HG LEU A 74 -20.130 -3.060 0.470 1.00 0.47 H new ATOM 0 HD11 LEU A 74 -19.551 -4.066 -1.700 1.00 0.70 H new ATOM 0 HD12 LEU A 74 -21.003 -3.042 -1.813 1.00 0.70 H new ATOM 0 HD13 LEU A 74 -19.441 -2.442 -2.420 1.00 0.70 H new ATOM 0 HD21 LEU A 74 -17.775 -3.531 -0.067 1.00 0.56 H new ATOM 0 HD22 LEU A 74 -17.599 -1.885 -0.721 1.00 0.56 H new ATOM 0 HD23 LEU A 74 -17.938 -2.123 1.010 1.00 0.56 H new ATOM 1274 N SER A 75 -21.514 -1.361 2.604 1.00 0.33 N ATOM 1275 CA SER A 75 -21.517 -1.034 4.026 1.00 0.33 C ATOM 1276 C SER A 75 -20.079 -1.080 4.540 1.00 0.31 C ATOM 1277 O SER A 75 -19.338 -2.002 4.202 1.00 0.35 O ATOM 1278 CB SER A 75 -22.401 -2.026 4.795 1.00 0.37 C ATOM 1279 OG SER A 75 -23.714 -2.066 4.252 1.00 0.99 O ATOM 0 H SER A 75 -21.381 -2.352 2.401 1.00 0.33 H new ATOM 0 HA SER A 75 -21.925 -0.035 4.178 1.00 0.33 H new ATOM 0 HB2 SER A 75 -21.957 -3.021 4.755 1.00 0.37 H new ATOM 0 HB3 SER A 75 -22.447 -1.739 5.846 1.00 0.37 H new ATOM 0 HG SER A 75 -24.258 -2.706 4.757 1.00 0.99 H new ATOM 1285 N PHE A 76 -19.664 -0.089 5.332 1.00 0.32 N ATOM 1286 CA PHE A 76 -18.290 -0.058 5.833 1.00 0.31 C ATOM 1287 C PHE A 76 -18.174 0.613 7.209 1.00 0.32 C ATOM 1288 O PHE A 76 -19.129 1.214 7.701 1.00 0.38 O ATOM 1289 CB PHE A 76 -17.380 0.662 4.823 1.00 0.32 C ATOM 1290 CG PHE A 76 -17.971 1.924 4.269 1.00 0.35 C ATOM 1291 CD1 PHE A 76 -18.817 1.880 3.177 1.00 1.24 C ATOM 1292 CD2 PHE A 76 -17.684 3.148 4.843 1.00 1.26 C ATOM 1293 CE1 PHE A 76 -19.371 3.035 2.665 1.00 1.28 C ATOM 1294 CE2 PHE A 76 -18.234 4.310 4.337 1.00 1.29 C ATOM 1295 CZ PHE A 76 -19.081 4.255 3.246 1.00 0.53 C ATOM 0 H PHE A 76 -20.249 0.690 5.636 1.00 0.32 H new ATOM 0 HA PHE A 76 -17.971 -1.093 5.953 1.00 0.31 H new ATOM 0 HB2 PHE A 76 -16.432 0.897 5.306 1.00 0.32 H new ATOM 0 HB3 PHE A 76 -17.159 -0.017 3.999 1.00 0.32 H new ATOM 0 HD1 PHE A 76 -19.047 0.930 2.719 1.00 1.24 H new ATOM 0 HD2 PHE A 76 -17.023 3.197 5.696 1.00 1.26 H new ATOM 0 HE1 PHE A 76 -20.031 2.986 1.811 1.00 1.28 H new ATOM 0 HE2 PHE A 76 -18.002 5.261 4.794 1.00 1.29 H new ATOM 0 HZ PHE A 76 -19.514 5.161 2.849 1.00 0.53 H new ATOM 1305 N SER A 77 -16.988 0.498 7.810 1.00 0.30 N ATOM 1306 CA SER A 77 -16.689 1.088 9.123 1.00 0.32 C ATOM 1307 C SER A 77 -15.321 1.776 9.054 1.00 0.30 C ATOM 1308 O SER A 77 -14.413 1.249 8.415 1.00 0.29 O ATOM 1309 CB SER A 77 -16.700 -0.003 10.199 1.00 0.36 C ATOM 1310 OG SER A 77 -17.877 -0.794 10.107 1.00 1.18 O ATOM 0 H SER A 77 -16.203 -0.008 7.401 1.00 0.30 H new ATOM 0 HA SER A 77 -17.447 1.826 9.385 1.00 0.32 H new ATOM 0 HB2 SER A 77 -15.821 -0.638 10.088 1.00 0.36 H new ATOM 0 HB3 SER A 77 -16.640 0.454 11.187 1.00 0.36 H new ATOM 0 HG SER A 77 -17.862 -1.485 10.802 1.00 1.18 H new ATOM 1316 N VAL A 78 -15.152 2.925 9.721 1.00 0.32 N ATOM 1317 CA VAL A 78 -13.890 3.679 9.631 1.00 0.33 C ATOM 1318 C VAL A 78 -13.040 3.610 10.913 1.00 0.34 C ATOM 1319 O VAL A 78 -13.467 4.062 11.979 1.00 0.38 O ATOM 1320 CB VAL A 78 -14.152 5.166 9.294 1.00 0.38 C ATOM 1321 CG1 VAL A 78 -12.846 5.908 9.048 1.00 0.41 C ATOM 1322 CG2 VAL A 78 -15.073 5.291 8.089 1.00 0.40 C ATOM 0 H VAL A 78 -15.860 3.350 10.321 1.00 0.32 H new ATOM 0 HA VAL A 78 -13.328 3.199 8.830 1.00 0.33 H new ATOM 0 HB VAL A 78 -14.645 5.623 10.152 1.00 0.38 H new ATOM 0 HG11 VAL A 78 -13.059 6.951 8.813 1.00 0.41 H new ATOM 0 HG12 VAL A 78 -12.224 5.857 9.942 1.00 0.41 H new ATOM 0 HG13 VAL A 78 -12.318 5.448 8.212 1.00 0.41 H new ATOM 0 HG21 VAL A 78 -15.244 6.345 7.869 1.00 0.40 H new ATOM 0 HG22 VAL A 78 -14.611 4.811 7.226 1.00 0.40 H new ATOM 0 HG23 VAL A 78 -16.025 4.807 8.307 1.00 0.40 H new ATOM 1332 N LYS A 79 -11.845 3.044 10.799 1.00 0.32 N ATOM 1333 CA LYS A 79 -10.907 2.947 11.913 1.00 0.34 C ATOM 1334 C LYS A 79 -9.563 3.577 11.524 1.00 0.34 C ATOM 1335 O LYS A 79 -9.266 3.745 10.339 1.00 0.33 O ATOM 1336 CB LYS A 79 -10.689 1.487 12.332 1.00 0.35 C ATOM 1337 CG LYS A 79 -11.040 1.206 13.788 1.00 0.48 C ATOM 1338 CD LYS A 79 -12.541 1.221 14.015 1.00 0.69 C ATOM 1339 CE LYS A 79 -12.972 2.411 14.860 1.00 0.89 C ATOM 1340 NZ LYS A 79 -14.455 2.530 14.944 1.00 1.48 N ATOM 0 H LYS A 79 -11.497 2.638 9.930 1.00 0.32 H new ATOM 0 HA LYS A 79 -11.334 3.486 12.759 1.00 0.34 H new ATOM 0 HB2 LYS A 79 -11.290 0.841 11.692 1.00 0.35 H new ATOM 0 HB3 LYS A 79 -9.646 1.222 12.162 1.00 0.35 H new ATOM 0 HG2 LYS A 79 -10.637 0.236 14.079 1.00 0.48 H new ATOM 0 HG3 LYS A 79 -10.568 1.952 14.427 1.00 0.48 H new ATOM 0 HD2 LYS A 79 -13.054 1.253 13.054 1.00 0.69 H new ATOM 0 HD3 LYS A 79 -12.844 0.297 14.507 1.00 0.69 H new ATOM 0 HE2 LYS A 79 -12.559 2.311 15.864 1.00 0.89 H new ATOM 0 HE3 LYS A 79 -12.559 3.326 14.435 1.00 0.89 H new ATOM 0 HZ1 LYS A 79 -14.705 3.353 15.529 1.00 1.48 H new ATOM 0 HZ2 LYS A 79 -14.848 2.652 13.989 1.00 1.48 H new ATOM 0 HZ3 LYS A 79 -14.849 1.668 15.373 1.00 1.48 H new ATOM 1354 N VAL A 80 -8.757 3.926 12.511 1.00 0.38 N ATOM 1355 CA VAL A 80 -7.445 4.506 12.262 1.00 0.40 C ATOM 1356 C VAL A 80 -6.356 3.548 12.744 1.00 0.41 C ATOM 1357 O VAL A 80 -6.588 2.749 13.652 1.00 0.43 O ATOM 1358 CB VAL A 80 -7.310 5.880 12.956 1.00 0.48 C ATOM 1359 CG1 VAL A 80 -7.449 5.718 14.450 1.00 1.43 C ATOM 1360 CG2 VAL A 80 -5.996 6.566 12.601 1.00 1.30 C ATOM 0 H VAL A 80 -8.988 3.818 13.499 1.00 0.38 H new ATOM 0 HA VAL A 80 -7.329 4.662 11.189 1.00 0.40 H new ATOM 0 HB VAL A 80 -8.113 6.523 12.594 1.00 0.48 H new ATOM 0 HG11 VAL A 80 -7.353 6.691 14.932 1.00 1.43 H new ATOM 0 HG12 VAL A 80 -8.426 5.294 14.681 1.00 1.43 H new ATOM 0 HG13 VAL A 80 -6.669 5.052 14.818 1.00 1.43 H new ATOM 0 HG21 VAL A 80 -5.939 7.529 13.109 1.00 1.30 H new ATOM 0 HG22 VAL A 80 -5.162 5.940 12.917 1.00 1.30 H new ATOM 0 HG23 VAL A 80 -5.946 6.721 11.523 1.00 1.30 H new ATOM 1370 N CYS A 81 -5.182 3.608 12.126 1.00 0.42 N ATOM 1371 CA CYS A 81 -4.078 2.740 12.502 1.00 0.46 C ATOM 1372 C CYS A 81 -2.774 3.533 12.585 1.00 0.49 C ATOM 1373 O CYS A 81 -2.498 4.394 11.742 1.00 0.45 O ATOM 1374 CB CYS A 81 -3.930 1.602 11.487 1.00 0.47 C ATOM 1375 SG CYS A 81 -2.746 0.322 11.964 1.00 0.89 S ATOM 0 H CYS A 81 -4.972 4.250 11.362 1.00 0.42 H new ATOM 0 HA CYS A 81 -4.294 2.318 13.483 1.00 0.46 H new ATOM 0 HB2 CYS A 81 -4.905 1.139 11.335 1.00 0.47 H new ATOM 0 HB3 CYS A 81 -3.624 2.024 10.529 1.00 0.47 H new ATOM 0 HG CYS A 81 -2.699 -0.591 11.040 1.00 0.89 H new ATOM 1381 N GLY A 82 -1.973 3.253 13.602 1.00 0.67 N ATOM 1382 CA GLY A 82 -0.714 3.946 13.761 1.00 0.76 C ATOM 1383 C GLY A 82 -0.886 5.442 13.782 1.00 0.76 C ATOM 1384 O GLY A 82 -1.759 5.976 14.470 1.00 0.88 O ATOM 0 H GLY A 82 -2.174 2.557 14.320 1.00 0.67 H new ATOM 0 HA2 GLY A 82 -0.238 3.624 14.687 1.00 0.76 H new ATOM 0 HA3 GLY A 82 -0.044 3.671 12.946 1.00 0.76 H new ATOM 1388 N GLU A 83 -0.054 6.121 13.015 1.00 0.76 N ATOM 1389 CA GLU A 83 -0.107 7.564 12.934 1.00 0.82 C ATOM 1390 C GLU A 83 -0.868 8.030 11.693 1.00 0.69 C ATOM 1391 O GLU A 83 -1.805 8.828 11.787 1.00 0.89 O ATOM 1392 CB GLU A 83 1.309 8.134 12.926 1.00 1.01 C ATOM 1393 CG GLU A 83 2.201 7.564 14.016 1.00 1.35 C ATOM 1394 CD GLU A 83 3.364 8.473 14.339 1.00 1.90 C ATOM 1395 OE1 GLU A 83 4.416 8.362 13.676 1.00 2.46 O ATOM 1396 OE2 GLU A 83 3.228 9.309 15.250 1.00 2.50 O ATOM 0 H GLU A 83 0.669 5.692 12.438 1.00 0.76 H new ATOM 0 HA GLU A 83 -0.643 7.931 13.809 1.00 0.82 H new ATOM 0 HB2 GLU A 83 1.765 7.938 11.956 1.00 1.01 H new ATOM 0 HB3 GLU A 83 1.256 9.217 13.041 1.00 1.01 H new ATOM 0 HG2 GLU A 83 1.610 7.400 14.917 1.00 1.35 H new ATOM 0 HG3 GLU A 83 2.579 6.591 13.701 1.00 1.35 H new ATOM 1403 N ARG A 84 -0.466 7.528 10.527 1.00 0.58 N ATOM 1404 CA ARG A 84 -1.095 7.925 9.266 1.00 0.72 C ATOM 1405 C ARG A 84 -1.772 6.751 8.565 1.00 0.64 C ATOM 1406 O ARG A 84 -2.218 6.876 7.426 1.00 0.81 O ATOM 1407 CB ARG A 84 -0.045 8.511 8.321 1.00 0.98 C ATOM 1408 CG ARG A 84 0.889 9.536 8.954 1.00 1.09 C ATOM 1409 CD ARG A 84 0.193 10.859 9.239 1.00 1.37 C ATOM 1410 NE ARG A 84 -0.263 10.953 10.627 1.00 1.46 N ATOM 1411 CZ ARG A 84 0.431 11.539 11.609 1.00 2.05 C ATOM 1412 NH1 ARG A 84 1.618 12.084 11.365 1.00 2.51 N ATOM 1413 NH2 ARG A 84 -0.069 11.585 12.838 1.00 2.36 N ATOM 0 H ARG A 84 0.288 6.849 10.428 1.00 0.58 H new ATOM 0 HA ARG A 84 -1.855 8.668 9.510 1.00 0.72 H new ATOM 0 HB2 ARG A 84 0.555 7.695 7.917 1.00 0.98 H new ATOM 0 HB3 ARG A 84 -0.556 8.978 7.479 1.00 0.98 H new ATOM 0 HG2 ARG A 84 1.290 9.132 9.884 1.00 1.09 H new ATOM 0 HG3 ARG A 84 1.736 9.710 8.290 1.00 1.09 H new ATOM 0 HD2 ARG A 84 0.876 11.681 9.026 1.00 1.37 H new ATOM 0 HD3 ARG A 84 -0.660 10.971 8.569 1.00 1.37 H new ATOM 0 HE ARG A 84 -1.168 10.545 10.860 1.00 1.46 H new ATOM 0 HH11 ARG A 84 2.007 12.058 10.423 1.00 2.51 H new ATOM 0 HH12 ARG A 84 2.140 12.529 12.120 1.00 2.51 H new ATOM 0 HH21 ARG A 84 -0.982 11.174 13.033 1.00 2.36 H new ATOM 0 HH22 ARG A 84 0.460 12.032 13.587 1.00 2.36 H new ATOM 1427 N LYS A 85 -1.840 5.614 9.232 1.00 0.46 N ATOM 1428 CA LYS A 85 -2.461 4.430 8.648 1.00 0.41 C ATOM 1429 C LYS A 85 -3.952 4.387 8.978 1.00 0.38 C ATOM 1430 O LYS A 85 -4.390 4.941 9.984 1.00 0.39 O ATOM 1431 CB LYS A 85 -1.749 3.161 9.134 1.00 0.42 C ATOM 1432 CG LYS A 85 -0.333 3.026 8.616 1.00 0.55 C ATOM 1433 CD LYS A 85 0.148 1.585 8.698 1.00 0.88 C ATOM 1434 CE LYS A 85 1.524 1.504 9.314 1.00 1.17 C ATOM 1435 NZ LYS A 85 2.165 0.181 9.079 1.00 1.22 N ATOM 0 H LYS A 85 -1.476 5.481 10.175 1.00 0.46 H new ATOM 0 HA LYS A 85 -2.361 4.481 7.564 1.00 0.41 H new ATOM 0 HB2 LYS A 85 -1.730 3.159 10.224 1.00 0.42 H new ATOM 0 HB3 LYS A 85 -2.325 2.289 8.824 1.00 0.42 H new ATOM 0 HG2 LYS A 85 -0.287 3.369 7.582 1.00 0.55 H new ATOM 0 HG3 LYS A 85 0.331 3.667 9.195 1.00 0.55 H new ATOM 0 HD2 LYS A 85 -0.554 0.998 9.290 1.00 0.88 H new ATOM 0 HD3 LYS A 85 0.167 1.148 7.700 1.00 0.88 H new ATOM 0 HE2 LYS A 85 2.154 2.291 8.898 1.00 1.17 H new ATOM 0 HE3 LYS A 85 1.452 1.686 10.386 1.00 1.17 H new ATOM 0 HZ1 LYS A 85 3.139 0.197 9.444 1.00 1.22 H new ATOM 0 HZ2 LYS A 85 1.624 -0.559 9.570 1.00 1.22 H new ATOM 0 HZ3 LYS A 85 2.181 -0.021 8.059 1.00 1.22 H new ATOM 1449 N CYS A 86 -4.738 3.781 8.107 1.00 0.36 N ATOM 1450 CA CYS A 86 -6.171 3.697 8.336 1.00 0.34 C ATOM 1451 C CYS A 86 -6.681 2.277 8.118 1.00 0.32 C ATOM 1452 O CYS A 86 -6.116 1.505 7.341 1.00 0.32 O ATOM 1453 CB CYS A 86 -6.924 4.682 7.445 1.00 0.38 C ATOM 1454 SG CYS A 86 -6.510 6.416 7.752 1.00 1.14 S ATOM 0 H CYS A 86 -4.415 3.344 7.244 1.00 0.36 H new ATOM 0 HA CYS A 86 -6.357 3.966 9.376 1.00 0.34 H new ATOM 0 HB2 CYS A 86 -6.712 4.448 6.402 1.00 0.38 H new ATOM 0 HB3 CYS A 86 -7.995 4.543 7.592 1.00 0.38 H new ATOM 0 HG CYS A 86 -5.595 6.487 8.673 1.00 1.14 H new ATOM 1460 N VAL A 87 -7.750 1.935 8.818 1.00 0.32 N ATOM 1461 CA VAL A 87 -8.348 0.615 8.711 1.00 0.34 C ATOM 1462 C VAL A 87 -9.835 0.759 8.457 1.00 0.32 C ATOM 1463 O VAL A 87 -10.493 1.579 9.083 1.00 0.36 O ATOM 1464 CB VAL A 87 -8.172 -0.225 9.997 1.00 0.40 C ATOM 1465 CG1 VAL A 87 -8.227 -1.716 9.681 1.00 0.80 C ATOM 1466 CG2 VAL A 87 -6.883 0.124 10.720 1.00 0.95 C ATOM 0 H VAL A 87 -8.224 2.559 9.471 1.00 0.32 H new ATOM 0 HA VAL A 87 -7.842 0.104 7.892 1.00 0.34 H new ATOM 0 HB VAL A 87 -9.000 0.017 10.664 1.00 0.40 H new ATOM 0 HG11 VAL A 87 -8.101 -2.288 10.600 1.00 0.80 H new ATOM 0 HG12 VAL A 87 -9.191 -1.958 9.233 1.00 0.80 H new ATOM 0 HG13 VAL A 87 -7.429 -1.970 8.984 1.00 0.80 H new ATOM 0 HG21 VAL A 87 -6.793 -0.486 11.619 1.00 0.95 H new ATOM 0 HG22 VAL A 87 -6.034 -0.069 10.064 1.00 0.95 H new ATOM 0 HG23 VAL A 87 -6.895 1.178 10.997 1.00 0.95 H new ATOM 1476 N LEU A 88 -10.367 -0.008 7.533 1.00 0.30 N ATOM 1477 CA LEU A 88 -11.784 0.050 7.253 1.00 0.31 C ATOM 1478 C LEU A 88 -12.344 -1.355 7.163 1.00 0.30 C ATOM 1479 O LEU A 88 -11.624 -2.306 6.874 1.00 0.33 O ATOM 1480 CB LEU A 88 -12.076 0.826 5.966 1.00 0.33 C ATOM 1481 CG LEU A 88 -12.789 2.170 6.168 1.00 0.43 C ATOM 1482 CD1 LEU A 88 -11.793 3.278 6.479 1.00 0.89 C ATOM 1483 CD2 LEU A 88 -13.613 2.534 4.945 1.00 0.48 C ATOM 0 H LEU A 88 -9.844 -0.675 6.966 1.00 0.30 H new ATOM 0 HA LEU A 88 -12.270 0.583 8.070 1.00 0.31 H new ATOM 0 HB2 LEU A 88 -11.135 1.005 5.446 1.00 0.33 H new ATOM 0 HB3 LEU A 88 -12.687 0.202 5.314 1.00 0.33 H new ATOM 0 HG LEU A 88 -13.460 2.063 7.020 1.00 0.43 H new ATOM 0 HD11 LEU A 88 -12.326 4.218 6.617 1.00 0.89 H new ATOM 0 HD12 LEU A 88 -11.248 3.032 7.391 1.00 0.89 H new ATOM 0 HD13 LEU A 88 -11.090 3.378 5.652 1.00 0.89 H new ATOM 0 HD21 LEU A 88 -14.109 3.490 5.112 1.00 0.48 H new ATOM 0 HD22 LEU A 88 -12.960 2.611 4.076 1.00 0.48 H new ATOM 0 HD23 LEU A 88 -14.363 1.763 4.768 1.00 0.48 H new ATOM 1495 N PHE A 89 -13.615 -1.494 7.447 1.00 0.30 N ATOM 1496 CA PHE A 89 -14.268 -2.777 7.369 1.00 0.31 C ATOM 1497 C PHE A 89 -15.332 -2.686 6.299 1.00 0.30 C ATOM 1498 O PHE A 89 -15.964 -1.647 6.161 1.00 0.30 O ATOM 1499 CB PHE A 89 -14.894 -3.148 8.713 1.00 0.34 C ATOM 1500 CG PHE A 89 -13.889 -3.481 9.780 1.00 0.89 C ATOM 1501 CD1 PHE A 89 -13.334 -2.482 10.568 1.00 1.75 C ATOM 1502 CD2 PHE A 89 -13.501 -4.794 10.000 1.00 1.75 C ATOM 1503 CE1 PHE A 89 -12.413 -2.788 11.550 1.00 2.40 C ATOM 1504 CE2 PHE A 89 -12.582 -5.100 10.982 1.00 2.42 C ATOM 1505 CZ PHE A 89 -12.041 -4.100 11.757 1.00 2.50 C ATOM 0 H PHE A 89 -14.222 -0.727 7.737 1.00 0.30 H new ATOM 0 HA PHE A 89 -13.544 -3.553 7.121 1.00 0.31 H new ATOM 0 HB2 PHE A 89 -15.513 -2.319 9.056 1.00 0.34 H new ATOM 0 HB3 PHE A 89 -15.556 -4.002 8.571 1.00 0.34 H new ATOM 0 HD1 PHE A 89 -13.626 -1.454 10.411 1.00 1.75 H new ATOM 0 HD2 PHE A 89 -13.922 -5.585 9.397 1.00 1.75 H new ATOM 0 HE1 PHE A 89 -11.985 -2.002 12.155 1.00 2.40 H new ATOM 0 HE2 PHE A 89 -12.287 -6.126 11.143 1.00 2.42 H new ATOM 0 HZ PHE A 89 -11.325 -4.343 12.528 1.00 2.50 H new ATOM 1515 N ILE A 90 -15.519 -3.741 5.537 1.00 0.30 N ATOM 1516 CA ILE A 90 -16.517 -3.727 4.479 1.00 0.31 C ATOM 1517 C ILE A 90 -17.477 -4.881 4.650 1.00 0.31 C ATOM 1518 O ILE A 90 -17.066 -5.996 4.958 1.00 0.33 O ATOM 1519 CB ILE A 90 -15.892 -3.795 3.075 1.00 0.32 C ATOM 1520 CG1 ILE A 90 -14.686 -4.743 3.066 1.00 0.39 C ATOM 1521 CG2 ILE A 90 -15.493 -2.398 2.614 1.00 0.37 C ATOM 1522 CD1 ILE A 90 -14.233 -5.141 1.676 1.00 0.48 C ATOM 0 H ILE A 90 -15.000 -4.615 5.625 1.00 0.30 H new ATOM 0 HA ILE A 90 -17.047 -2.778 4.563 1.00 0.31 H new ATOM 0 HB ILE A 90 -16.632 -4.190 2.378 1.00 0.32 H new ATOM 0 HG12 ILE A 90 -13.856 -4.265 3.586 1.00 0.39 H new ATOM 0 HG13 ILE A 90 -14.938 -5.643 3.628 1.00 0.39 H new ATOM 0 HG21 ILE A 90 -15.051 -2.455 1.619 1.00 0.37 H new ATOM 0 HG22 ILE A 90 -16.376 -1.759 2.583 1.00 0.37 H new ATOM 0 HG23 ILE A 90 -14.766 -1.979 3.310 1.00 0.37 H new ATOM 0 HD11 ILE A 90 -13.377 -5.812 1.750 1.00 0.48 H new ATOM 0 HD12 ILE A 90 -15.048 -5.648 1.159 1.00 0.48 H new ATOM 0 HD13 ILE A 90 -13.948 -4.250 1.117 1.00 0.48 H new ATOM 1534 N GLU A 91 -18.751 -4.614 4.469 1.00 0.31 N ATOM 1535 CA GLU A 91 -19.751 -5.631 4.616 1.00 0.34 C ATOM 1536 C GLU A 91 -20.749 -5.593 3.463 1.00 0.38 C ATOM 1537 O GLU A 91 -21.220 -4.510 3.048 1.00 0.41 O ATOM 1538 CB GLU A 91 -20.449 -5.447 5.964 1.00 0.39 C ATOM 1539 CG GLU A 91 -21.905 -5.837 5.966 1.00 1.34 C ATOM 1540 CD GLU A 91 -22.561 -5.622 7.307 1.00 1.32 C ATOM 1541 OE1 GLU A 91 -22.856 -4.460 7.642 1.00 1.72 O ATOM 1542 OE2 GLU A 91 -22.788 -6.610 8.034 1.00 1.74 O ATOM 0 H GLU A 91 -19.114 -3.694 4.219 1.00 0.31 H new ATOM 0 HA GLU A 91 -19.277 -6.612 4.589 1.00 0.34 H new ATOM 0 HB2 GLU A 91 -19.925 -6.038 6.715 1.00 0.39 H new ATOM 0 HB3 GLU A 91 -20.364 -4.403 6.265 1.00 0.39 H new ATOM 0 HG2 GLU A 91 -22.434 -5.257 5.210 1.00 1.34 H new ATOM 0 HG3 GLU A 91 -21.997 -6.886 5.685 1.00 1.34 H new ATOM 1549 N TRP A 92 -21.026 -6.781 2.930 1.00 0.41 N ATOM 1550 CA TRP A 92 -21.969 -6.951 1.831 1.00 0.51 C ATOM 1551 C TRP A 92 -22.338 -8.423 1.697 1.00 0.52 C ATOM 1552 O TRP A 92 -21.537 -9.293 2.039 1.00 0.50 O ATOM 1553 CB TRP A 92 -21.421 -6.393 0.510 1.00 0.66 C ATOM 1554 CG TRP A 92 -19.953 -6.617 0.298 1.00 0.82 C ATOM 1555 CD1 TRP A 92 -18.960 -5.695 0.437 1.00 1.79 C ATOM 1556 CD2 TRP A 92 -19.318 -7.830 -0.098 1.00 0.89 C ATOM 1557 NE1 TRP A 92 -17.748 -6.258 0.140 1.00 1.87 N ATOM 1558 CE2 TRP A 92 -17.944 -7.570 -0.189 1.00 1.04 C ATOM 1559 CE3 TRP A 92 -19.779 -9.109 -0.384 1.00 1.87 C ATOM 1560 CZ2 TRP A 92 -17.031 -8.543 -0.556 1.00 1.14 C ATOM 1561 CZ3 TRP A 92 -18.873 -10.082 -0.745 1.00 2.35 C ATOM 1562 CH2 TRP A 92 -17.507 -9.795 -0.832 1.00 1.76 C ATOM 0 H TRP A 92 -20.602 -7.652 3.249 1.00 0.41 H new ATOM 0 HA TRP A 92 -22.867 -6.378 2.061 1.00 0.51 H new ATOM 0 HB2 TRP A 92 -21.968 -6.848 -0.316 1.00 0.66 H new ATOM 0 HB3 TRP A 92 -21.621 -5.322 0.473 1.00 0.66 H new ATOM 0 HD1 TRP A 92 -19.108 -4.668 0.738 1.00 1.79 H new ATOM 0 HE1 TRP A 92 -16.848 -5.778 0.161 1.00 1.87 H new ATOM 0 HE3 TRP A 92 -20.833 -9.337 -0.324 1.00 1.87 H new ATOM 0 HZ2 TRP A 92 -15.976 -8.321 -0.622 1.00 1.14 H new ATOM 0 HZ3 TRP A 92 -19.222 -11.080 -0.964 1.00 2.35 H new ATOM 0 HH2 TRP A 92 -16.817 -10.574 -1.122 1.00 1.76 H new ATOM 1573 N GLU A 93 -23.566 -8.690 1.256 1.00 0.61 N ATOM 1574 CA GLU A 93 -24.060 -10.055 1.092 1.00 0.67 C ATOM 1575 C GLU A 93 -24.103 -10.761 2.443 1.00 0.61 C ATOM 1576 O GLU A 93 -23.841 -11.962 2.546 1.00 0.64 O ATOM 1577 CB GLU A 93 -23.180 -10.837 0.114 1.00 0.74 C ATOM 1578 CG GLU A 93 -23.124 -10.241 -1.282 1.00 0.88 C ATOM 1579 CD GLU A 93 -22.430 -11.154 -2.278 1.00 1.08 C ATOM 1580 OE1 GLU A 93 -22.892 -12.301 -2.457 1.00 1.58 O ATOM 1581 OE2 GLU A 93 -21.431 -10.728 -2.903 1.00 1.63 O ATOM 0 H GLU A 93 -24.243 -7.970 1.004 1.00 0.61 H new ATOM 0 HA GLU A 93 -25.069 -10.010 0.682 1.00 0.67 H new ATOM 0 HB2 GLU A 93 -22.168 -10.891 0.515 1.00 0.74 H new ATOM 0 HB3 GLU A 93 -23.551 -11.860 0.046 1.00 0.74 H new ATOM 0 HG2 GLU A 93 -24.138 -10.036 -1.627 1.00 0.88 H new ATOM 0 HG3 GLU A 93 -22.601 -9.285 -1.245 1.00 0.88 H new ATOM 1588 N LYS A 94 -24.436 -9.979 3.477 1.00 0.59 N ATOM 1589 CA LYS A 94 -24.528 -10.465 4.857 1.00 0.61 C ATOM 1590 C LYS A 94 -23.157 -10.890 5.384 1.00 0.55 C ATOM 1591 O LYS A 94 -23.055 -11.554 6.417 1.00 0.63 O ATOM 1592 CB LYS A 94 -25.521 -11.632 4.963 1.00 0.71 C ATOM 1593 CG LYS A 94 -26.910 -11.327 4.417 1.00 0.85 C ATOM 1594 CD LYS A 94 -27.530 -10.101 5.077 1.00 0.93 C ATOM 1595 CE LYS A 94 -27.548 -10.217 6.593 1.00 1.23 C ATOM 1596 NZ LYS A 94 -28.381 -9.157 7.224 1.00 1.79 N ATOM 0 H LYS A 94 -24.650 -8.987 3.378 1.00 0.59 H new ATOM 0 HA LYS A 94 -24.893 -9.642 5.472 1.00 0.61 H new ATOM 0 HB2 LYS A 94 -25.114 -12.490 4.428 1.00 0.71 H new ATOM 0 HB3 LYS A 94 -25.611 -11.923 6.010 1.00 0.71 H new ATOM 0 HG2 LYS A 94 -26.849 -11.166 3.341 1.00 0.85 H new ATOM 0 HG3 LYS A 94 -27.558 -12.189 4.574 1.00 0.85 H new ATOM 0 HD2 LYS A 94 -26.970 -9.212 4.788 1.00 0.93 H new ATOM 0 HD3 LYS A 94 -28.548 -9.969 4.712 1.00 0.93 H new ATOM 0 HE2 LYS A 94 -27.932 -11.197 6.877 1.00 1.23 H new ATOM 0 HE3 LYS A 94 -26.529 -10.152 6.974 1.00 1.23 H new ATOM 0 HZ1 LYS A 94 -28.366 -9.273 8.257 1.00 1.79 H new ATOM 0 HZ2 LYS A 94 -28.000 -8.222 6.975 1.00 1.79 H new ATOM 0 HZ3 LYS A 94 -29.360 -9.235 6.881 1.00 1.79 H new ATOM 1610 N LYS A 95 -22.103 -10.494 4.682 1.00 0.47 N ATOM 1611 CA LYS A 95 -20.754 -10.847 5.080 1.00 0.46 C ATOM 1612 C LYS A 95 -19.923 -9.606 5.369 1.00 0.42 C ATOM 1613 O LYS A 95 -20.237 -8.522 4.901 1.00 0.42 O ATOM 1614 CB LYS A 95 -20.088 -11.690 4.001 1.00 0.52 C ATOM 1615 CG LYS A 95 -19.666 -13.063 4.494 1.00 0.63 C ATOM 1616 CD LYS A 95 -20.865 -13.984 4.717 1.00 0.77 C ATOM 1617 CE LYS A 95 -21.669 -14.196 3.439 1.00 0.94 C ATOM 1618 NZ LYS A 95 -22.659 -15.292 3.579 1.00 1.29 N ATOM 0 H LYS A 95 -22.160 -9.929 3.835 1.00 0.47 H new ATOM 0 HA LYS A 95 -20.816 -11.432 5.998 1.00 0.46 H new ATOM 0 HB2 LYS A 95 -20.776 -11.807 3.163 1.00 0.52 H new ATOM 0 HB3 LYS A 95 -19.213 -11.161 3.624 1.00 0.52 H new ATOM 0 HG2 LYS A 95 -18.990 -13.517 3.769 1.00 0.63 H new ATOM 0 HG3 LYS A 95 -19.110 -12.959 5.426 1.00 0.63 H new ATOM 0 HD2 LYS A 95 -20.517 -14.947 5.090 1.00 0.77 H new ATOM 0 HD3 LYS A 95 -21.511 -13.559 5.485 1.00 0.77 H new ATOM 0 HE2 LYS A 95 -22.186 -13.272 3.179 1.00 0.94 H new ATOM 0 HE3 LYS A 95 -20.990 -14.424 2.617 1.00 0.94 H new ATOM 0 HZ1 LYS A 95 -23.183 -15.402 2.688 1.00 1.29 H new ATOM 0 HZ2 LYS A 95 -22.165 -16.180 3.802 1.00 1.29 H new ATOM 0 HZ3 LYS A 95 -23.324 -15.064 4.346 1.00 1.29 H new ATOM 1632 N THR A 96 -18.861 -9.792 6.135 1.00 0.43 N ATOM 1633 CA THR A 96 -17.970 -8.702 6.533 1.00 0.41 C ATOM 1634 C THR A 96 -16.504 -9.060 6.273 1.00 0.40 C ATOM 1635 O THR A 96 -16.091 -10.200 6.478 1.00 0.45 O ATOM 1636 CB THR A 96 -18.137 -8.372 8.030 1.00 0.45 C ATOM 1637 OG1 THR A 96 -17.914 -9.548 8.823 1.00 0.73 O ATOM 1638 CG2 THR A 96 -19.521 -7.828 8.325 1.00 0.55 C ATOM 0 H THR A 96 -18.587 -10.703 6.502 1.00 0.43 H new ATOM 0 HA THR A 96 -18.242 -7.834 5.933 1.00 0.41 H new ATOM 0 HB THR A 96 -17.402 -7.608 8.284 1.00 0.45 H new ATOM 0 HG1 THR A 96 -18.021 -9.328 9.772 1.00 0.73 H new ATOM 0 HG21 THR A 96 -19.605 -7.606 9.389 1.00 0.55 H new ATOM 0 HG22 THR A 96 -19.684 -6.917 7.750 1.00 0.55 H new ATOM 0 HG23 THR A 96 -20.270 -8.570 8.049 1.00 0.55 H new ATOM 1646 N TYR A 97 -15.729 -8.078 5.821 1.00 0.38 N ATOM 1647 CA TYR A 97 -14.309 -8.273 5.524 1.00 0.40 C ATOM 1648 C TYR A 97 -13.488 -7.075 6.000 1.00 0.35 C ATOM 1649 O TYR A 97 -14.037 -6.008 6.292 1.00 0.33 O ATOM 1650 CB TYR A 97 -14.092 -8.498 4.024 1.00 0.47 C ATOM 1651 CG TYR A 97 -15.060 -9.488 3.415 1.00 0.56 C ATOM 1652 CD1 TYR A 97 -16.343 -9.095 3.038 1.00 1.37 C ATOM 1653 CD2 TYR A 97 -14.699 -10.818 3.231 1.00 1.37 C ATOM 1654 CE1 TYR A 97 -17.233 -9.993 2.499 1.00 1.54 C ATOM 1655 CE2 TYR A 97 -15.592 -11.726 2.686 1.00 1.54 C ATOM 1656 CZ TYR A 97 -16.855 -11.308 2.323 1.00 1.13 C ATOM 1657 OH TYR A 97 -17.738 -12.209 1.777 1.00 1.45 O ATOM 0 H TYR A 97 -16.063 -7.129 5.650 1.00 0.38 H new ATOM 0 HA TYR A 97 -13.973 -9.161 6.060 1.00 0.40 H new ATOM 0 HB2 TYR A 97 -14.186 -7.544 3.505 1.00 0.47 H new ATOM 0 HB3 TYR A 97 -13.074 -8.851 3.861 1.00 0.47 H new ATOM 0 HD1 TYR A 97 -16.643 -8.066 3.172 1.00 1.37 H new ATOM 0 HD2 TYR A 97 -13.711 -11.147 3.516 1.00 1.37 H new ATOM 0 HE1 TYR A 97 -18.224 -9.671 2.215 1.00 1.54 H new ATOM 0 HE2 TYR A 97 -15.300 -12.756 2.546 1.00 1.54 H new ATOM 0 HH TYR A 97 -18.193 -11.799 1.012 1.00 1.45 H new ATOM 1667 N GLN A 98 -12.175 -7.259 6.072 1.00 0.37 N ATOM 1668 CA GLN A 98 -11.263 -6.215 6.532 1.00 0.34 C ATOM 1669 C GLN A 98 -10.507 -5.562 5.373 1.00 0.31 C ATOM 1670 O GLN A 98 -9.869 -6.244 4.551 1.00 0.31 O ATOM 1671 CB GLN A 98 -10.262 -6.791 7.540 1.00 0.40 C ATOM 1672 CG GLN A 98 -10.904 -7.365 8.794 1.00 0.80 C ATOM 1673 CD GLN A 98 -11.449 -8.768 8.599 1.00 1.21 C ATOM 1674 OE1 GLN A 98 -12.639 -8.956 8.360 1.00 1.83 O ATOM 1675 NE2 GLN A 98 -10.582 -9.761 8.690 1.00 1.84 N ATOM 0 H GLN A 98 -11.713 -8.131 5.815 1.00 0.37 H new ATOM 0 HA GLN A 98 -11.868 -5.446 7.012 1.00 0.34 H new ATOM 0 HB2 GLN A 98 -9.681 -7.573 7.052 1.00 0.40 H new ATOM 0 HB3 GLN A 98 -9.562 -6.007 7.829 1.00 0.40 H new ATOM 0 HG2 GLN A 98 -10.168 -7.377 9.598 1.00 0.80 H new ATOM 0 HG3 GLN A 98 -11.714 -6.709 9.113 1.00 0.80 H new ATOM 0 HE21 GLN A 98 -9.601 -9.565 8.890 1.00 1.84 H new ATOM 0 HE22 GLN A 98 -10.894 -10.724 8.560 1.00 1.84 H new ATOM 1684 N LEU A 99 -10.565 -4.234 5.342 1.00 0.29 N ATOM 1685 CA LEU A 99 -9.920 -3.439 4.313 1.00 0.28 C ATOM 1686 C LEU A 99 -8.844 -2.548 4.932 1.00 0.26 C ATOM 1687 O LEU A 99 -9.148 -1.594 5.649 1.00 0.28 O ATOM 1688 CB LEU A 99 -10.973 -2.567 3.614 1.00 0.31 C ATOM 1689 CG LEU A 99 -10.679 -2.181 2.161 1.00 0.37 C ATOM 1690 CD1 LEU A 99 -9.553 -1.161 2.075 1.00 0.46 C ATOM 1691 CD2 LEU A 99 -10.356 -3.417 1.337 1.00 0.48 C ATOM 0 H LEU A 99 -11.065 -3.680 6.037 1.00 0.29 H new ATOM 0 HA LEU A 99 -9.451 -4.103 3.587 1.00 0.28 H new ATOM 0 HB2 LEU A 99 -11.927 -3.094 3.642 1.00 0.31 H new ATOM 0 HB3 LEU A 99 -11.098 -1.652 4.193 1.00 0.31 H new ATOM 0 HG LEU A 99 -11.575 -1.716 1.749 1.00 0.37 H new ATOM 0 HD11 LEU A 99 -9.370 -0.909 1.031 1.00 0.46 H new ATOM 0 HD12 LEU A 99 -9.835 -0.261 2.622 1.00 0.46 H new ATOM 0 HD13 LEU A 99 -8.647 -1.582 2.511 1.00 0.46 H new ATOM 0 HD21 LEU A 99 -10.150 -3.124 0.307 1.00 0.48 H new ATOM 0 HD22 LEU A 99 -9.481 -3.915 1.755 1.00 0.48 H new ATOM 0 HD23 LEU A 99 -11.205 -4.100 1.357 1.00 0.48 H new ATOM 1703 N ASP A 100 -7.593 -2.859 4.661 1.00 0.25 N ATOM 1704 CA ASP A 100 -6.482 -2.077 5.182 1.00 0.26 C ATOM 1705 C ASP A 100 -6.091 -1.028 4.155 1.00 0.25 C ATOM 1706 O ASP A 100 -5.807 -1.361 3.007 1.00 0.26 O ATOM 1707 CB ASP A 100 -5.290 -2.989 5.462 1.00 0.32 C ATOM 1708 CG ASP A 100 -4.749 -2.910 6.880 1.00 0.41 C ATOM 1709 OD1 ASP A 100 -5.243 -2.105 7.679 1.00 0.74 O ATOM 1710 OD2 ASP A 100 -3.811 -3.695 7.200 1.00 0.43 O ATOM 0 H ASP A 100 -7.316 -3.651 4.081 1.00 0.25 H new ATOM 0 HA ASP A 100 -6.782 -1.592 6.111 1.00 0.26 H new ATOM 0 HB2 ASP A 100 -5.582 -4.019 5.256 1.00 0.32 H new ATOM 0 HB3 ASP A 100 -4.488 -2.740 4.767 1.00 0.32 H new ATOM 1715 N LEU A 101 -6.078 0.235 4.548 1.00 0.25 N ATOM 1716 CA LEU A 101 -5.732 1.293 3.613 1.00 0.25 C ATOM 1717 C LEU A 101 -4.658 2.206 4.174 1.00 0.25 C ATOM 1718 O LEU A 101 -4.632 2.524 5.366 1.00 0.27 O ATOM 1719 CB LEU A 101 -6.966 2.114 3.238 1.00 0.28 C ATOM 1720 CG LEU A 101 -7.510 2.995 4.357 1.00 0.34 C ATOM 1721 CD1 LEU A 101 -7.438 4.463 3.967 1.00 0.33 C ATOM 1722 CD2 LEU A 101 -8.930 2.595 4.694 1.00 0.51 C ATOM 0 H LEU A 101 -6.299 0.550 5.493 1.00 0.25 H new ATOM 0 HA LEU A 101 -5.338 0.813 2.717 1.00 0.25 H new ATOM 0 HB2 LEU A 101 -6.720 2.745 2.384 1.00 0.28 H new ATOM 0 HB3 LEU A 101 -7.754 1.434 2.914 1.00 0.28 H new ATOM 0 HG LEU A 101 -6.893 2.853 5.244 1.00 0.34 H new ATOM 0 HD11 LEU A 101 -7.831 5.075 4.779 1.00 0.33 H new ATOM 0 HD12 LEU A 101 -6.401 4.738 3.775 1.00 0.33 H new ATOM 0 HD13 LEU A 101 -8.030 4.630 3.067 1.00 0.33 H new ATOM 0 HD21 LEU A 101 -9.307 3.232 5.494 1.00 0.51 H new ATOM 0 HD22 LEU A 101 -9.560 2.710 3.812 1.00 0.51 H new ATOM 0 HD23 LEU A 101 -8.948 1.555 5.019 1.00 0.51 H new ATOM 1734 N PHE A 102 -3.758 2.615 3.306 1.00 0.24 N ATOM 1735 CA PHE A 102 -2.674 3.486 3.688 1.00 0.25 C ATOM 1736 C PHE A 102 -2.546 4.604 2.678 1.00 0.24 C ATOM 1737 O PHE A 102 -2.621 4.366 1.472 1.00 0.24 O ATOM 1738 CB PHE A 102 -1.380 2.679 3.768 1.00 0.28 C ATOM 1739 CG PHE A 102 -1.581 1.311 4.355 1.00 0.39 C ATOM 1740 CD1 PHE A 102 -1.905 0.240 3.542 1.00 1.27 C ATOM 1741 CD2 PHE A 102 -1.472 1.105 5.720 1.00 1.29 C ATOM 1742 CE1 PHE A 102 -2.116 -1.011 4.077 1.00 1.36 C ATOM 1743 CE2 PHE A 102 -1.677 -0.150 6.262 1.00 1.40 C ATOM 1744 CZ PHE A 102 -2.001 -1.210 5.439 1.00 0.81 C ATOM 0 H PHE A 102 -3.759 2.353 2.320 1.00 0.24 H new ATOM 0 HA PHE A 102 -2.874 3.923 4.666 1.00 0.25 H new ATOM 0 HB2 PHE A 102 -0.956 2.582 2.769 1.00 0.28 H new ATOM 0 HB3 PHE A 102 -0.654 3.225 4.371 1.00 0.28 H new ATOM 0 HD1 PHE A 102 -1.993 0.387 2.476 1.00 1.27 H new ATOM 0 HD2 PHE A 102 -1.224 1.933 6.368 1.00 1.29 H new ATOM 0 HE1 PHE A 102 -2.372 -1.838 3.431 1.00 1.36 H new ATOM 0 HE2 PHE A 102 -1.584 -0.301 7.327 1.00 1.40 H new ATOM 0 HZ PHE A 102 -2.164 -2.192 5.859 1.00 0.81 H new ATOM 1754 N THR A 103 -2.371 5.816 3.160 1.00 0.25 N ATOM 1755 CA THR A 103 -2.244 6.960 2.280 1.00 0.25 C ATOM 1756 C THR A 103 -0.777 7.301 2.042 1.00 0.25 C ATOM 1757 O THR A 103 -0.002 7.439 2.989 1.00 0.28 O ATOM 1758 CB THR A 103 -2.994 8.168 2.864 1.00 0.29 C ATOM 1759 OG1 THR A 103 -3.028 8.074 4.293 1.00 0.37 O ATOM 1760 CG2 THR A 103 -4.416 8.231 2.323 1.00 0.38 C ATOM 0 H THR A 103 -2.313 6.035 4.154 1.00 0.25 H new ATOM 0 HA THR A 103 -2.691 6.706 1.319 1.00 0.25 H new ATOM 0 HB THR A 103 -2.468 9.076 2.570 1.00 0.29 H new ATOM 0 HG1 THR A 103 -3.505 8.847 4.660 1.00 0.37 H new ATOM 0 HG21 THR A 103 -4.929 9.093 2.749 1.00 0.38 H new ATOM 0 HG22 THR A 103 -4.388 8.325 1.237 1.00 0.38 H new ATOM 0 HG23 THR A 103 -4.949 7.320 2.595 1.00 0.38 H new ATOM 1768 N ALA A 104 -0.404 7.420 0.776 1.00 0.26 N ATOM 1769 CA ALA A 104 0.967 7.726 0.408 1.00 0.28 C ATOM 1770 C ALA A 104 1.019 8.735 -0.731 1.00 0.26 C ATOM 1771 O ALA A 104 0.028 8.949 -1.435 1.00 0.25 O ATOM 1772 CB ALA A 104 1.693 6.452 0.008 1.00 0.34 C ATOM 0 H ALA A 104 -1.037 7.308 -0.016 1.00 0.26 H new ATOM 0 HA ALA A 104 1.461 8.167 1.274 1.00 0.28 H new ATOM 0 HB1 ALA A 104 2.721 6.690 -0.267 1.00 0.34 H new ATOM 0 HB2 ALA A 104 1.693 5.755 0.846 1.00 0.34 H new ATOM 0 HB3 ALA A 104 1.186 5.996 -0.843 1.00 0.34 H new ATOM 1778 N LEU A 105 2.178 9.349 -0.913 1.00 0.27 N ATOM 1779 CA LEU A 105 2.372 10.319 -1.968 1.00 0.27 C ATOM 1780 C LEU A 105 2.869 9.614 -3.216 1.00 0.26 C ATOM 1781 O LEU A 105 3.362 8.484 -3.146 1.00 0.27 O ATOM 1782 CB LEU A 105 3.386 11.378 -1.535 1.00 0.32 C ATOM 1783 CG LEU A 105 3.056 12.108 -0.235 1.00 0.39 C ATOM 1784 CD1 LEU A 105 4.135 13.124 0.094 1.00 0.57 C ATOM 1785 CD2 LEU A 105 1.698 12.779 -0.334 1.00 0.49 C ATOM 0 H LEU A 105 3.003 9.187 -0.335 1.00 0.27 H new ATOM 0 HA LEU A 105 1.422 10.810 -2.179 1.00 0.27 H new ATOM 0 HB2 LEU A 105 4.360 10.901 -1.427 1.00 0.32 H new ATOM 0 HB3 LEU A 105 3.479 12.115 -2.332 1.00 0.32 H new ATOM 0 HG LEU A 105 3.019 11.377 0.573 1.00 0.39 H new ATOM 0 HD11 LEU A 105 3.883 13.634 1.024 1.00 0.57 H new ATOM 0 HD12 LEU A 105 5.092 12.615 0.208 1.00 0.57 H new ATOM 0 HD13 LEU A 105 4.206 13.854 -0.713 1.00 0.57 H new ATOM 0 HD21 LEU A 105 1.478 13.295 0.601 1.00 0.49 H new ATOM 0 HD22 LEU A 105 1.707 13.499 -1.152 1.00 0.49 H new ATOM 0 HD23 LEU A 105 0.933 12.026 -0.522 1.00 0.49 H new ATOM 1797 N ALA A 106 2.741 10.279 -4.351 1.00 0.27 N ATOM 1798 CA ALA A 106 3.185 9.728 -5.624 1.00 0.30 C ATOM 1799 C ALA A 106 4.663 9.343 -5.575 1.00 0.31 C ATOM 1800 O ALA A 106 5.098 8.399 -6.234 1.00 0.36 O ATOM 1801 CB ALA A 106 2.934 10.725 -6.744 1.00 0.34 C ATOM 0 H ALA A 106 2.330 11.210 -4.419 1.00 0.27 H new ATOM 0 HA ALA A 106 2.610 8.823 -5.820 1.00 0.30 H new ATOM 0 HB1 ALA A 106 3.270 10.301 -7.690 1.00 0.34 H new ATOM 0 HB2 ALA A 106 1.868 10.945 -6.803 1.00 0.34 H new ATOM 0 HB3 ALA A 106 3.484 11.644 -6.543 1.00 0.34 H new ATOM 1807 N GLU A 107 5.423 10.080 -4.785 1.00 0.31 N ATOM 1808 CA GLU A 107 6.854 9.826 -4.647 1.00 0.35 C ATOM 1809 C GLU A 107 7.140 8.710 -3.650 1.00 0.36 C ATOM 1810 O GLU A 107 8.213 8.113 -3.676 1.00 0.43 O ATOM 1811 CB GLU A 107 7.613 11.103 -4.251 1.00 0.40 C ATOM 1812 CG GLU A 107 6.831 12.046 -3.349 1.00 0.44 C ATOM 1813 CD GLU A 107 5.899 12.949 -4.125 1.00 0.67 C ATOM 1814 OE1 GLU A 107 6.383 13.913 -4.752 1.00 1.38 O ATOM 1815 OE2 GLU A 107 4.680 12.691 -4.113 1.00 1.35 O ATOM 0 H GLU A 107 5.077 10.861 -4.227 1.00 0.31 H new ATOM 0 HA GLU A 107 7.211 9.501 -5.624 1.00 0.35 H new ATOM 0 HB2 GLU A 107 8.537 10.820 -3.746 1.00 0.40 H new ATOM 0 HB3 GLU A 107 7.896 11.638 -5.157 1.00 0.40 H new ATOM 0 HG2 GLU A 107 6.253 11.462 -2.632 1.00 0.44 H new ATOM 0 HG3 GLU A 107 7.528 12.656 -2.775 1.00 0.44 H new ATOM 1822 N GLU A 108 6.185 8.422 -2.777 1.00 0.33 N ATOM 1823 CA GLU A 108 6.362 7.370 -1.782 1.00 0.36 C ATOM 1824 C GLU A 108 6.016 6.012 -2.386 1.00 0.39 C ATOM 1825 O GLU A 108 6.373 4.968 -1.836 1.00 0.59 O ATOM 1826 CB GLU A 108 5.484 7.637 -0.553 1.00 0.39 C ATOM 1827 CG GLU A 108 5.862 8.892 0.215 1.00 0.75 C ATOM 1828 CD GLU A 108 5.012 9.099 1.454 1.00 1.62 C ATOM 1829 OE1 GLU A 108 3.800 9.349 1.303 1.00 2.31 O ATOM 1830 OE2 GLU A 108 5.556 9.018 2.579 1.00 2.35 O ATOM 0 H GLU A 108 5.284 8.898 -2.736 1.00 0.33 H new ATOM 0 HA GLU A 108 7.406 7.364 -1.468 1.00 0.36 H new ATOM 0 HB2 GLU A 108 4.445 7.718 -0.872 1.00 0.39 H new ATOM 0 HB3 GLU A 108 5.546 6.780 0.118 1.00 0.39 H new ATOM 0 HG2 GLU A 108 6.911 8.833 0.505 1.00 0.75 H new ATOM 0 HG3 GLU A 108 5.760 9.758 -0.439 1.00 0.75 H new ATOM 1837 N LYS A 109 5.315 6.055 -3.521 1.00 0.37 N ATOM 1838 CA LYS A 109 4.878 4.863 -4.250 1.00 0.38 C ATOM 1839 C LYS A 109 5.942 3.748 -4.307 1.00 0.34 C ATOM 1840 O LYS A 109 5.667 2.636 -3.858 1.00 0.35 O ATOM 1841 CB LYS A 109 4.439 5.261 -5.661 1.00 0.44 C ATOM 1842 CG LYS A 109 3.934 4.105 -6.494 1.00 0.74 C ATOM 1843 CD LYS A 109 3.750 4.512 -7.946 1.00 1.00 C ATOM 1844 CE LYS A 109 3.361 3.333 -8.815 1.00 1.73 C ATOM 1845 NZ LYS A 109 3.416 3.673 -10.260 1.00 2.18 N ATOM 0 H LYS A 109 5.032 6.929 -3.965 1.00 0.37 H new ATOM 0 HA LYS A 109 4.038 4.442 -3.698 1.00 0.38 H new ATOM 0 HB2 LYS A 109 3.654 6.014 -5.588 1.00 0.44 H new ATOM 0 HB3 LYS A 109 5.280 5.726 -6.175 1.00 0.44 H new ATOM 0 HG2 LYS A 109 4.638 3.275 -6.433 1.00 0.74 H new ATOM 0 HG3 LYS A 109 2.986 3.750 -6.090 1.00 0.74 H new ATOM 0 HD2 LYS A 109 2.982 5.282 -8.013 1.00 1.00 H new ATOM 0 HD3 LYS A 109 4.675 4.951 -8.321 1.00 1.00 H new ATOM 0 HE2 LYS A 109 4.029 2.496 -8.613 1.00 1.73 H new ATOM 0 HE3 LYS A 109 2.354 3.007 -8.556 1.00 1.73 H new ATOM 0 HZ1 LYS A 109 3.127 2.847 -10.822 1.00 2.18 H new ATOM 0 HZ2 LYS A 109 2.773 4.467 -10.455 1.00 2.18 H new ATOM 0 HZ3 LYS A 109 4.387 3.944 -10.516 1.00 2.18 H new ATOM 1859 N PRO A 110 7.157 4.011 -4.854 1.00 0.34 N ATOM 1860 CA PRO A 110 8.218 2.998 -4.944 1.00 0.35 C ATOM 1861 C PRO A 110 8.467 2.278 -3.624 1.00 0.30 C ATOM 1862 O PRO A 110 8.322 1.058 -3.531 1.00 0.31 O ATOM 1863 CB PRO A 110 9.472 3.799 -5.324 1.00 0.42 C ATOM 1864 CG PRO A 110 9.083 5.245 -5.289 1.00 0.41 C ATOM 1865 CD PRO A 110 7.593 5.289 -5.437 1.00 0.37 C ATOM 0 HA PRO A 110 7.947 2.221 -5.659 1.00 0.35 H new ATOM 0 HB2 PRO A 110 10.285 3.600 -4.626 1.00 0.42 H new ATOM 0 HB3 PRO A 110 9.826 3.517 -6.315 1.00 0.42 H new ATOM 0 HG2 PRO A 110 9.393 5.708 -4.352 1.00 0.41 H new ATOM 0 HG3 PRO A 110 9.569 5.797 -6.093 1.00 0.41 H new ATOM 0 HD2 PRO A 110 7.161 6.140 -4.910 1.00 0.37 H new ATOM 0 HD3 PRO A 110 7.295 5.377 -6.482 1.00 0.37 H new ATOM 1873 N TYR A 111 8.833 3.047 -2.611 1.00 0.29 N ATOM 1874 CA TYR A 111 9.127 2.503 -1.291 1.00 0.27 C ATOM 1875 C TYR A 111 7.922 1.797 -0.698 1.00 0.26 C ATOM 1876 O TYR A 111 8.046 0.719 -0.122 1.00 0.26 O ATOM 1877 CB TYR A 111 9.577 3.619 -0.357 1.00 0.31 C ATOM 1878 CG TYR A 111 10.627 4.512 -0.962 1.00 0.27 C ATOM 1879 CD1 TYR A 111 11.959 4.127 -0.989 1.00 1.24 C ATOM 1880 CD2 TYR A 111 10.286 5.742 -1.508 1.00 1.20 C ATOM 1881 CE1 TYR A 111 12.920 4.942 -1.544 1.00 1.27 C ATOM 1882 CE2 TYR A 111 11.243 6.561 -2.062 1.00 1.21 C ATOM 1883 CZ TYR A 111 12.559 6.157 -2.077 1.00 0.41 C ATOM 1884 OH TYR A 111 13.517 6.970 -2.638 1.00 0.53 O ATOM 0 H TYR A 111 8.935 4.060 -2.677 1.00 0.29 H new ATOM 0 HA TYR A 111 9.927 1.771 -1.403 1.00 0.27 H new ATOM 0 HB2 TYR A 111 8.713 4.222 -0.079 1.00 0.31 H new ATOM 0 HB3 TYR A 111 9.968 3.180 0.561 1.00 0.31 H new ATOM 0 HD1 TYR A 111 12.247 3.175 -0.569 1.00 1.24 H new ATOM 0 HD2 TYR A 111 9.254 6.061 -1.498 1.00 1.20 H new ATOM 0 HE1 TYR A 111 13.953 4.628 -1.561 1.00 1.27 H new ATOM 0 HE2 TYR A 111 10.963 7.516 -2.483 1.00 1.21 H new ATOM 0 HH TYR A 111 14.013 6.469 -3.319 1.00 0.53 H new ATOM 1894 N ALA A 112 6.764 2.419 -0.832 1.00 0.26 N ATOM 1895 CA ALA A 112 5.534 1.857 -0.307 1.00 0.27 C ATOM 1896 C ALA A 112 5.268 0.470 -0.880 1.00 0.26 C ATOM 1897 O ALA A 112 5.023 -0.479 -0.135 1.00 0.26 O ATOM 1898 CB ALA A 112 4.360 2.784 -0.589 1.00 0.30 C ATOM 0 H ALA A 112 6.651 3.317 -1.302 1.00 0.26 H new ATOM 0 HA ALA A 112 5.648 1.756 0.772 1.00 0.27 H new ATOM 0 HB1 ALA A 112 3.446 2.346 -0.188 1.00 0.30 H new ATOM 0 HB2 ALA A 112 4.537 3.750 -0.116 1.00 0.30 H new ATOM 0 HB3 ALA A 112 4.255 2.921 -1.665 1.00 0.30 H new ATOM 1904 N ILE A 113 5.329 0.351 -2.202 1.00 0.27 N ATOM 1905 CA ILE A 113 5.093 -0.924 -2.861 1.00 0.29 C ATOM 1906 C ILE A 113 6.162 -1.945 -2.481 1.00 0.29 C ATOM 1907 O ILE A 113 5.846 -3.102 -2.215 1.00 0.31 O ATOM 1908 CB ILE A 113 5.045 -0.780 -4.401 1.00 0.33 C ATOM 1909 CG1 ILE A 113 3.924 0.176 -4.826 1.00 0.35 C ATOM 1910 CG2 ILE A 113 4.849 -2.142 -5.061 1.00 0.37 C ATOM 1911 CD1 ILE A 113 2.546 -0.250 -4.372 1.00 0.39 C ATOM 0 H ILE A 113 5.540 1.122 -2.836 1.00 0.27 H new ATOM 0 HA ILE A 113 4.120 -1.276 -2.518 1.00 0.29 H new ATOM 0 HB ILE A 113 5.997 -0.364 -4.729 1.00 0.33 H new ATOM 0 HG12 ILE A 113 4.136 1.168 -4.427 1.00 0.35 H new ATOM 0 HG13 ILE A 113 3.927 0.262 -5.913 1.00 0.35 H new ATOM 0 HG21 ILE A 113 4.818 -2.021 -6.144 1.00 0.37 H new ATOM 0 HG22 ILE A 113 5.677 -2.799 -4.793 1.00 0.37 H new ATOM 0 HG23 ILE A 113 3.912 -2.581 -4.718 1.00 0.37 H new ATOM 0 HD11 ILE A 113 1.810 0.478 -4.712 1.00 0.39 H new ATOM 0 HD12 ILE A 113 2.311 -1.228 -4.792 1.00 0.39 H new ATOM 0 HD13 ILE A 113 2.523 -0.308 -3.284 1.00 0.39 H new ATOM 1923 N PHE A 114 7.419 -1.508 -2.428 1.00 0.28 N ATOM 1924 CA PHE A 114 8.526 -2.394 -2.079 1.00 0.31 C ATOM 1925 C PHE A 114 8.303 -2.999 -0.699 1.00 0.31 C ATOM 1926 O PHE A 114 8.550 -4.182 -0.469 1.00 0.33 O ATOM 1927 CB PHE A 114 9.841 -1.614 -2.113 1.00 0.34 C ATOM 1928 CG PHE A 114 11.037 -2.433 -1.732 1.00 0.36 C ATOM 1929 CD1 PHE A 114 11.446 -3.490 -2.526 1.00 1.27 C ATOM 1930 CD2 PHE A 114 11.749 -2.148 -0.579 1.00 1.24 C ATOM 1931 CE1 PHE A 114 12.546 -4.249 -2.180 1.00 1.33 C ATOM 1932 CE2 PHE A 114 12.851 -2.903 -0.224 1.00 1.26 C ATOM 1933 CZ PHE A 114 13.251 -3.956 -1.027 1.00 0.55 C ATOM 0 H PHE A 114 7.695 -0.546 -2.622 1.00 0.28 H new ATOM 0 HA PHE A 114 8.576 -3.205 -2.806 1.00 0.31 H new ATOM 0 HB2 PHE A 114 9.990 -1.214 -3.116 1.00 0.34 H new ATOM 0 HB3 PHE A 114 9.765 -0.762 -1.438 1.00 0.34 H new ATOM 0 HD1 PHE A 114 10.898 -3.724 -3.427 1.00 1.27 H new ATOM 0 HD2 PHE A 114 11.440 -1.326 0.050 1.00 1.24 H new ATOM 0 HE1 PHE A 114 12.856 -5.071 -2.809 1.00 1.33 H new ATOM 0 HE2 PHE A 114 13.398 -2.671 0.678 1.00 1.26 H new ATOM 0 HZ PHE A 114 14.112 -4.548 -0.754 1.00 0.55 H new ATOM 1943 N HIS A 115 7.816 -2.168 0.200 1.00 0.30 N ATOM 1944 CA HIS A 115 7.535 -2.568 1.557 1.00 0.33 C ATOM 1945 C HIS A 115 6.410 -3.610 1.609 1.00 0.32 C ATOM 1946 O HIS A 115 6.594 -4.705 2.138 1.00 0.34 O ATOM 1947 CB HIS A 115 7.204 -1.317 2.366 1.00 0.38 C ATOM 1948 CG HIS A 115 7.234 -1.552 3.825 1.00 0.42 C ATOM 1949 ND1 HIS A 115 8.131 -0.925 4.645 1.00 0.45 N ATOM 1950 CD2 HIS A 115 6.477 -2.374 4.546 1.00 0.47 C ATOM 1951 CE1 HIS A 115 7.902 -1.393 5.855 1.00 0.49 C ATOM 1952 NE2 HIS A 115 6.906 -2.279 5.852 1.00 0.51 N ATOM 0 H HIS A 115 7.604 -1.190 0.004 1.00 0.30 H new ATOM 0 HA HIS A 115 8.409 -3.052 1.993 1.00 0.33 H new ATOM 0 HB2 HIS A 115 7.915 -0.529 2.115 1.00 0.38 H new ATOM 0 HB3 HIS A 115 6.215 -0.957 2.081 1.00 0.38 H new ATOM 0 HD1 HIS A 115 8.833 -0.236 4.375 1.00 0.45 H new ATOM 0 HD2 HIS A 115 5.677 -2.998 4.177 1.00 0.47 H new ATOM 0 HE1 HIS A 115 8.451 -1.097 6.737 1.00 0.49 H new ATOM 1960 N PHE A 116 5.257 -3.273 1.065 1.00 0.32 N ATOM 1961 CA PHE A 116 4.123 -4.202 1.056 1.00 0.33 C ATOM 1962 C PHE A 116 4.275 -5.316 0.024 1.00 0.33 C ATOM 1963 O PHE A 116 3.367 -6.134 -0.128 1.00 0.36 O ATOM 1964 CB PHE A 116 2.801 -3.483 0.815 1.00 0.35 C ATOM 1965 CG PHE A 116 2.425 -2.552 1.924 1.00 0.37 C ATOM 1966 CD1 PHE A 116 3.087 -1.356 2.107 1.00 1.21 C ATOM 1967 CD2 PHE A 116 1.413 -2.895 2.796 1.00 1.29 C ATOM 1968 CE1 PHE A 116 2.740 -0.509 3.142 1.00 1.25 C ATOM 1969 CE2 PHE A 116 1.059 -2.059 3.832 1.00 1.31 C ATOM 1970 CZ PHE A 116 1.726 -0.863 4.009 1.00 0.50 C ATOM 0 H PHE A 116 5.072 -2.372 0.624 1.00 0.32 H new ATOM 0 HA PHE A 116 4.116 -4.652 2.049 1.00 0.33 H new ATOM 0 HB2 PHE A 116 2.865 -2.921 -0.117 1.00 0.35 H new ATOM 0 HB3 PHE A 116 2.011 -4.223 0.687 1.00 0.35 H new ATOM 0 HD1 PHE A 116 3.885 -1.079 1.434 1.00 1.21 H new ATOM 0 HD2 PHE A 116 0.891 -3.831 2.665 1.00 1.29 H new ATOM 0 HE1 PHE A 116 3.261 0.428 3.272 1.00 1.25 H new ATOM 0 HE2 PHE A 116 0.261 -2.338 4.504 1.00 1.31 H new ATOM 0 HZ PHE A 116 1.455 -0.207 4.823 1.00 0.50 H new ATOM 1980 N THR A 117 5.377 -5.320 -0.718 1.00 0.33 N ATOM 1981 CA THR A 117 5.583 -6.327 -1.756 1.00 0.37 C ATOM 1982 C THR A 117 5.364 -7.766 -1.243 1.00 0.36 C ATOM 1983 O THR A 117 4.358 -8.394 -1.573 1.00 0.47 O ATOM 1984 CB THR A 117 7.014 -6.208 -2.333 1.00 0.63 C ATOM 1985 OG1 THR A 117 7.060 -5.151 -3.297 1.00 1.18 O ATOM 1986 CG2 THR A 117 7.487 -7.504 -2.989 1.00 0.92 C ATOM 0 H THR A 117 6.136 -4.645 -0.623 1.00 0.33 H new ATOM 0 HA THR A 117 4.841 -6.135 -2.531 1.00 0.37 H new ATOM 0 HB THR A 117 7.681 -5.994 -1.498 1.00 0.63 H new ATOM 0 HG1 THR A 117 6.468 -4.423 -3.013 1.00 1.18 H new ATOM 0 HG21 THR A 117 8.496 -7.368 -3.378 1.00 0.92 H new ATOM 0 HG22 THR A 117 7.488 -8.306 -2.251 1.00 0.92 H new ATOM 0 HG23 THR A 117 6.815 -7.764 -3.807 1.00 0.92 H new ATOM 1994 N GLY A 118 6.287 -8.302 -0.453 1.00 0.43 N ATOM 1995 CA GLY A 118 6.106 -9.645 0.057 1.00 0.59 C ATOM 1996 C GLY A 118 6.309 -9.766 1.539 1.00 0.49 C ATOM 1997 O GLY A 118 5.441 -9.391 2.309 1.00 0.54 O ATOM 0 H GLY A 118 7.146 -7.837 -0.160 1.00 0.43 H new ATOM 0 HA2 GLY A 118 5.100 -9.985 -0.191 1.00 0.59 H new ATOM 0 HA3 GLY A 118 6.802 -10.313 -0.451 1.00 0.59 H new ATOM 2001 N PRO A 119 7.459 -10.331 1.961 1.00 0.51 N ATOM 2002 CA PRO A 119 7.791 -10.508 3.367 1.00 0.52 C ATOM 2003 C PRO A 119 8.653 -9.387 3.948 1.00 0.43 C ATOM 2004 O PRO A 119 9.685 -9.020 3.380 1.00 0.42 O ATOM 2005 CB PRO A 119 8.574 -11.821 3.347 1.00 0.65 C ATOM 2006 CG PRO A 119 9.198 -11.913 1.986 1.00 0.72 C ATOM 2007 CD PRO A 119 8.491 -10.929 1.093 1.00 0.70 C ATOM 0 HA PRO A 119 6.901 -10.504 3.996 1.00 0.52 H new ATOM 0 HB2 PRO A 119 9.336 -11.832 4.126 1.00 0.65 H new ATOM 0 HB3 PRO A 119 7.916 -12.670 3.532 1.00 0.65 H new ATOM 0 HG2 PRO A 119 10.263 -11.687 2.037 1.00 0.72 H new ATOM 0 HG3 PRO A 119 9.106 -12.924 1.590 1.00 0.72 H new ATOM 0 HD2 PRO A 119 9.177 -10.173 0.711 1.00 0.70 H new ATOM 0 HD3 PRO A 119 8.047 -11.423 0.228 1.00 0.70 H new ATOM 2015 N VAL A 120 8.217 -8.863 5.093 1.00 0.43 N ATOM 2016 CA VAL A 120 8.929 -7.796 5.812 1.00 0.42 C ATOM 2017 C VAL A 120 10.409 -8.129 6.020 1.00 0.38 C ATOM 2018 O VAL A 120 11.262 -7.241 6.004 1.00 0.37 O ATOM 2019 CB VAL A 120 8.262 -7.458 7.174 1.00 0.49 C ATOM 2020 CG1 VAL A 120 8.434 -8.577 8.188 1.00 0.58 C ATOM 2021 CG2 VAL A 120 8.811 -6.148 7.725 1.00 0.53 C ATOM 0 H VAL A 120 7.358 -9.164 5.553 1.00 0.43 H new ATOM 0 HA VAL A 120 8.864 -6.914 5.175 1.00 0.42 H new ATOM 0 HB VAL A 120 7.193 -7.347 6.994 1.00 0.49 H new ATOM 0 HG11 VAL A 120 7.952 -8.297 9.125 1.00 0.58 H new ATOM 0 HG12 VAL A 120 7.978 -9.489 7.804 1.00 0.58 H new ATOM 0 HG13 VAL A 120 9.496 -8.749 8.364 1.00 0.58 H new ATOM 0 HG21 VAL A 120 8.333 -5.926 8.679 1.00 0.53 H new ATOM 0 HG22 VAL A 120 9.888 -6.237 7.870 1.00 0.53 H new ATOM 0 HG23 VAL A 120 8.605 -5.342 7.020 1.00 0.53 H new ATOM 2031 N SER A 121 10.699 -9.409 6.236 1.00 0.40 N ATOM 2032 CA SER A 121 12.062 -9.884 6.446 1.00 0.40 C ATOM 2033 C SER A 121 13.009 -9.378 5.351 1.00 0.36 C ATOM 2034 O SER A 121 14.139 -8.980 5.630 1.00 0.37 O ATOM 2035 CB SER A 121 12.054 -11.407 6.471 1.00 0.46 C ATOM 2036 OG SER A 121 10.954 -11.891 7.222 1.00 1.24 O ATOM 0 H SER A 121 9.995 -10.146 6.270 1.00 0.40 H new ATOM 0 HA SER A 121 12.426 -9.495 7.397 1.00 0.40 H new ATOM 0 HB2 SER A 121 12.003 -11.792 5.453 1.00 0.46 H new ATOM 0 HB3 SER A 121 12.985 -11.773 6.904 1.00 0.46 H new ATOM 0 HG SER A 121 10.966 -12.871 7.225 1.00 1.24 H new ATOM 2042 N TYR A 122 12.536 -9.394 4.112 1.00 0.36 N ATOM 2043 CA TYR A 122 13.311 -8.916 2.973 1.00 0.35 C ATOM 2044 C TYR A 122 13.703 -7.446 3.172 1.00 0.33 C ATOM 2045 O TYR A 122 14.853 -7.050 2.950 1.00 0.34 O ATOM 2046 CB TYR A 122 12.452 -9.088 1.716 1.00 0.38 C ATOM 2047 CG TYR A 122 13.146 -8.858 0.390 1.00 0.44 C ATOM 2048 CD1 TYR A 122 14.531 -8.828 0.276 1.00 1.29 C ATOM 2049 CD2 TYR A 122 12.392 -8.684 -0.762 1.00 1.29 C ATOM 2050 CE1 TYR A 122 15.141 -8.626 -0.951 1.00 1.35 C ATOM 2051 CE2 TYR A 122 12.990 -8.482 -1.988 1.00 1.36 C ATOM 2052 CZ TYR A 122 14.363 -8.453 -2.080 1.00 0.73 C ATOM 2053 OH TYR A 122 14.958 -8.249 -3.305 1.00 0.91 O ATOM 0 H TYR A 122 11.607 -9.737 3.868 1.00 0.36 H new ATOM 0 HA TYR A 122 14.234 -9.487 2.873 1.00 0.35 H new ATOM 0 HB2 TYR A 122 12.043 -10.099 1.717 1.00 0.38 H new ATOM 0 HB3 TYR A 122 11.607 -8.402 1.783 1.00 0.38 H new ATOM 0 HD1 TYR A 122 15.140 -8.964 1.157 1.00 1.29 H new ATOM 0 HD2 TYR A 122 11.314 -8.707 -0.697 1.00 1.29 H new ATOM 0 HE1 TYR A 122 16.218 -8.604 -1.025 1.00 1.35 H new ATOM 0 HE2 TYR A 122 12.384 -8.347 -2.872 1.00 1.36 H new ATOM 0 HH TYR A 122 15.853 -8.648 -3.304 1.00 0.91 H new ATOM 2063 N LEU A 123 12.745 -6.667 3.652 1.00 0.31 N ATOM 2064 CA LEU A 123 12.933 -5.239 3.884 1.00 0.31 C ATOM 2065 C LEU A 123 13.926 -4.975 5.005 1.00 0.31 C ATOM 2066 O LEU A 123 14.917 -4.277 4.809 1.00 0.31 O ATOM 2067 CB LEU A 123 11.597 -4.589 4.234 1.00 0.32 C ATOM 2068 CG LEU A 123 10.397 -5.118 3.451 1.00 0.34 C ATOM 2069 CD1 LEU A 123 9.103 -4.668 4.105 1.00 0.43 C ATOM 2070 CD2 LEU A 123 10.460 -4.651 2.007 1.00 0.34 C ATOM 0 H LEU A 123 11.813 -7.006 3.893 1.00 0.31 H new ATOM 0 HA LEU A 123 13.332 -4.808 2.966 1.00 0.31 H new ATOM 0 HB2 LEU A 123 11.409 -4.731 5.298 1.00 0.32 H new ATOM 0 HB3 LEU A 123 11.677 -3.515 4.065 1.00 0.32 H new ATOM 0 HG LEU A 123 10.426 -6.208 3.459 1.00 0.34 H new ATOM 0 HD11 LEU A 123 8.256 -5.052 3.537 1.00 0.43 H new ATOM 0 HD12 LEU A 123 9.059 -5.050 5.125 1.00 0.43 H new ATOM 0 HD13 LEU A 123 9.064 -3.579 4.123 1.00 0.43 H new ATOM 0 HD21 LEU A 123 9.598 -5.036 1.462 1.00 0.34 H new ATOM 0 HD22 LEU A 123 10.451 -3.561 1.976 1.00 0.34 H new ATOM 0 HD23 LEU A 123 11.376 -5.020 1.545 1.00 0.34 H new ATOM 2082 N ILE A 124 13.653 -5.527 6.182 1.00 0.36 N ATOM 2083 CA ILE A 124 14.517 -5.331 7.342 1.00 0.41 C ATOM 2084 C ILE A 124 15.952 -5.769 7.065 1.00 0.38 C ATOM 2085 O ILE A 124 16.899 -5.139 7.541 1.00 0.38 O ATOM 2086 CB ILE A 124 13.979 -6.056 8.594 1.00 0.52 C ATOM 2087 CG1 ILE A 124 13.687 -7.519 8.304 1.00 0.76 C ATOM 2088 CG2 ILE A 124 12.727 -5.369 9.099 1.00 1.01 C ATOM 2089 CD1 ILE A 124 13.506 -8.362 9.546 1.00 1.08 C ATOM 0 H ILE A 124 12.839 -6.115 6.359 1.00 0.36 H new ATOM 0 HA ILE A 124 14.517 -4.259 7.541 1.00 0.41 H new ATOM 0 HB ILE A 124 14.750 -6.011 9.363 1.00 0.52 H new ATOM 0 HG12 ILE A 124 12.785 -7.586 7.696 1.00 0.76 H new ATOM 0 HG13 ILE A 124 14.503 -7.932 7.711 1.00 0.76 H new ATOM 0 HG21 ILE A 124 12.357 -5.890 9.982 1.00 1.01 H new ATOM 0 HG22 ILE A 124 12.958 -4.336 9.357 1.00 1.01 H new ATOM 0 HG23 ILE A 124 11.963 -5.387 8.321 1.00 1.01 H new ATOM 0 HD11 ILE A 124 13.301 -9.393 9.259 1.00 1.08 H new ATOM 0 HD12 ILE A 124 14.415 -8.326 10.146 1.00 1.08 H new ATOM 0 HD13 ILE A 124 12.671 -7.975 10.130 1.00 1.08 H new ATOM 2101 N ARG A 125 16.115 -6.835 6.291 1.00 0.38 N ATOM 2102 CA ARG A 125 17.441 -7.319 5.947 1.00 0.41 C ATOM 2103 C ARG A 125 18.167 -6.278 5.109 1.00 0.36 C ATOM 2104 O ARG A 125 19.312 -5.916 5.390 1.00 0.38 O ATOM 2105 CB ARG A 125 17.364 -8.630 5.174 1.00 0.46 C ATOM 2106 CG ARG A 125 18.731 -9.228 4.898 1.00 1.30 C ATOM 2107 CD ARG A 125 19.293 -9.887 6.139 1.00 1.31 C ATOM 2108 NE ARG A 125 18.765 -11.232 6.307 1.00 2.16 N ATOM 2109 CZ ARG A 125 19.394 -12.333 5.894 1.00 2.81 C ATOM 2110 NH1 ARG A 125 20.613 -12.249 5.372 1.00 2.83 N ATOM 2111 NH2 ARG A 125 18.811 -13.515 6.012 1.00 3.80 N ATOM 0 H ARG A 125 15.348 -7.377 5.893 1.00 0.38 H new ATOM 0 HA ARG A 125 17.988 -7.496 6.873 1.00 0.41 H new ATOM 0 HB2 ARG A 125 16.766 -9.345 5.739 1.00 0.46 H new ATOM 0 HB3 ARG A 125 16.849 -8.460 4.229 1.00 0.46 H new ATOM 0 HG2 ARG A 125 18.656 -9.961 4.094 1.00 1.30 H new ATOM 0 HG3 ARG A 125 19.411 -8.448 4.556 1.00 1.30 H new ATOM 0 HD2 ARG A 125 20.380 -9.926 6.072 1.00 1.31 H new ATOM 0 HD3 ARG A 125 19.049 -9.286 7.015 1.00 1.31 H new ATOM 0 HE ARG A 125 17.861 -11.339 6.767 1.00 2.16 H new ATOM 0 HH11 ARG A 125 21.070 -11.341 5.286 1.00 2.83 H new ATOM 0 HH12 ARG A 125 21.092 -13.093 5.057 1.00 2.83 H new ATOM 0 HH21 ARG A 125 17.879 -13.585 6.420 1.00 3.80 H new ATOM 0 HH22 ARG A 125 19.294 -14.356 5.695 1.00 3.80 H new ATOM 2125 N ILE A 126 17.476 -5.793 4.083 1.00 0.34 N ATOM 2126 CA ILE A 126 18.024 -4.786 3.189 1.00 0.33 C ATOM 2127 C ILE A 126 18.304 -3.489 3.948 1.00 0.31 C ATOM 2128 O ILE A 126 19.296 -2.808 3.690 1.00 0.31 O ATOM 2129 CB ILE A 126 17.067 -4.551 1.985 1.00 0.34 C ATOM 2130 CG1 ILE A 126 17.583 -5.289 0.749 1.00 0.39 C ATOM 2131 CG2 ILE A 126 16.886 -3.072 1.672 1.00 0.38 C ATOM 2132 CD1 ILE A 126 17.729 -6.789 0.941 1.00 0.46 C ATOM 0 H ILE A 126 16.527 -6.086 3.851 1.00 0.34 H new ATOM 0 HA ILE A 126 18.973 -5.146 2.793 1.00 0.33 H new ATOM 0 HB ILE A 126 16.091 -4.946 2.266 1.00 0.34 H new ATOM 0 HG12 ILE A 126 16.903 -5.104 -0.082 1.00 0.39 H new ATOM 0 HG13 ILE A 126 18.551 -4.873 0.468 1.00 0.39 H new ATOM 0 HG21 ILE A 126 16.210 -2.960 0.824 1.00 0.38 H new ATOM 0 HG22 ILE A 126 16.466 -2.565 2.541 1.00 0.38 H new ATOM 0 HG23 ILE A 126 17.852 -2.631 1.426 1.00 0.38 H new ATOM 0 HD11 ILE A 126 18.099 -7.239 0.020 1.00 0.46 H new ATOM 0 HD12 ILE A 126 18.433 -6.985 1.750 1.00 0.46 H new ATOM 0 HD13 ILE A 126 16.760 -7.220 1.191 1.00 0.46 H new ATOM 2144 N ARG A 127 17.443 -3.183 4.912 1.00 0.31 N ATOM 2145 CA ARG A 127 17.580 -1.995 5.732 1.00 0.33 C ATOM 2146 C ARG A 127 18.893 -2.031 6.511 1.00 0.33 C ATOM 2147 O ARG A 127 19.614 -1.032 6.584 1.00 0.34 O ATOM 2148 CB ARG A 127 16.378 -1.903 6.674 1.00 0.38 C ATOM 2149 CG ARG A 127 16.542 -0.916 7.806 1.00 1.09 C ATOM 2150 CD ARG A 127 16.487 0.526 7.324 1.00 1.30 C ATOM 2151 NE ARG A 127 16.245 1.466 8.423 1.00 1.79 N ATOM 2152 CZ ARG A 127 17.117 1.734 9.395 1.00 2.32 C ATOM 2153 NH1 ARG A 127 18.307 1.150 9.410 1.00 2.76 N ATOM 2154 NH2 ARG A 127 16.797 2.597 10.350 1.00 2.94 N ATOM 0 H ARG A 127 16.631 -3.755 5.144 1.00 0.31 H new ATOM 0 HA ARG A 127 17.603 -1.109 5.098 1.00 0.33 H new ATOM 0 HB2 ARG A 127 15.498 -1.627 6.093 1.00 0.38 H new ATOM 0 HB3 ARG A 127 16.186 -2.890 7.095 1.00 0.38 H new ATOM 0 HG2 ARG A 127 15.758 -1.080 8.545 1.00 1.09 H new ATOM 0 HG3 ARG A 127 17.494 -1.094 8.306 1.00 1.09 H new ATOM 0 HD2 ARG A 127 17.426 0.779 6.831 1.00 1.30 H new ATOM 0 HD3 ARG A 127 15.698 0.629 6.579 1.00 1.30 H new ATOM 0 HE ARG A 127 15.347 1.949 8.445 1.00 1.79 H new ATOM 0 HH11 ARG A 127 18.561 0.490 8.674 1.00 2.76 H new ATOM 0 HH12 ARG A 127 18.969 1.360 10.157 1.00 2.76 H new ATOM 0 HH21 ARG A 127 15.885 3.054 10.340 1.00 2.94 H new ATOM 0 HH22 ARG A 127 17.463 2.804 11.095 1.00 2.94 H new ATOM 2168 N ALA A 128 19.200 -3.193 7.077 1.00 0.35 N ATOM 2169 CA ALA A 128 20.430 -3.371 7.838 1.00 0.38 C ATOM 2170 C ALA A 128 21.645 -3.316 6.922 1.00 0.37 C ATOM 2171 O ALA A 128 22.662 -2.707 7.261 1.00 0.39 O ATOM 2172 CB ALA A 128 20.399 -4.690 8.596 1.00 0.42 C ATOM 0 H ALA A 128 18.613 -4.026 7.023 1.00 0.35 H new ATOM 0 HA ALA A 128 20.506 -2.556 8.558 1.00 0.38 H new ATOM 0 HB1 ALA A 128 21.325 -4.808 9.159 1.00 0.42 H new ATOM 0 HB2 ALA A 128 19.553 -4.695 9.283 1.00 0.42 H new ATOM 0 HB3 ALA A 128 20.297 -5.514 7.889 1.00 0.42 H new ATOM 2178 N ALA A 129 21.524 -3.946 5.757 1.00 0.36 N ATOM 2179 CA ALA A 129 22.608 -3.976 4.781 1.00 0.38 C ATOM 2180 C ALA A 129 22.985 -2.558 4.363 1.00 0.36 C ATOM 2181 O ALA A 129 24.163 -2.184 4.372 1.00 0.40 O ATOM 2182 CB ALA A 129 22.208 -4.805 3.571 1.00 0.40 C ATOM 0 H ALA A 129 20.683 -4.444 5.466 1.00 0.36 H new ATOM 0 HA ALA A 129 23.480 -4.441 5.241 1.00 0.38 H new ATOM 0 HB1 ALA A 129 23.027 -4.818 2.852 1.00 0.40 H new ATOM 0 HB2 ALA A 129 21.986 -5.825 3.886 1.00 0.40 H new ATOM 0 HB3 ALA A 129 21.324 -4.368 3.106 1.00 0.40 H new ATOM 2188 N LEU A 130 21.975 -1.764 4.015 1.00 0.33 N ATOM 2189 CA LEU A 130 22.198 -0.384 3.620 1.00 0.32 C ATOM 2190 C LEU A 130 22.839 0.389 4.767 1.00 0.33 C ATOM 2191 O LEU A 130 23.749 1.188 4.554 1.00 0.35 O ATOM 2192 CB LEU A 130 20.882 0.271 3.209 1.00 0.32 C ATOM 2193 CG LEU A 130 20.330 -0.186 1.860 1.00 0.36 C ATOM 2194 CD1 LEU A 130 18.818 -0.172 1.879 1.00 0.38 C ATOM 2195 CD2 LEU A 130 20.863 0.692 0.732 1.00 0.41 C ATOM 0 H LEU A 130 20.998 -2.056 4.000 1.00 0.33 H new ATOM 0 HA LEU A 130 22.873 -0.368 2.764 1.00 0.32 H new ATOM 0 HB2 LEU A 130 20.136 0.068 3.978 1.00 0.32 H new ATOM 0 HB3 LEU A 130 21.024 1.351 3.180 1.00 0.32 H new ATOM 0 HG LEU A 130 20.664 -1.208 1.679 1.00 0.36 H new ATOM 0 HD11 LEU A 130 18.439 -0.500 0.911 1.00 0.38 H new ATOM 0 HD12 LEU A 130 18.458 -0.845 2.657 1.00 0.38 H new ATOM 0 HD13 LEU A 130 18.466 0.839 2.083 1.00 0.38 H new ATOM 0 HD21 LEU A 130 20.457 0.348 -0.219 1.00 0.41 H new ATOM 0 HD22 LEU A 130 20.563 1.726 0.903 1.00 0.41 H new ATOM 0 HD23 LEU A 130 21.951 0.630 0.706 1.00 0.41 H new ATOM 2207 N LYS A 131 22.379 0.125 5.990 1.00 0.33 N ATOM 2208 CA LYS A 131 22.928 0.789 7.169 1.00 0.37 C ATOM 2209 C LYS A 131 24.438 0.582 7.237 1.00 0.39 C ATOM 2210 O LYS A 131 25.192 1.504 7.560 1.00 0.43 O ATOM 2211 CB LYS A 131 22.265 0.252 8.438 1.00 0.40 C ATOM 2212 CG LYS A 131 21.722 1.342 9.346 1.00 0.53 C ATOM 2213 CD LYS A 131 22.836 2.170 9.957 1.00 0.69 C ATOM 2214 CE LYS A 131 22.385 3.594 10.240 1.00 0.82 C ATOM 2215 NZ LYS A 131 23.355 4.329 11.087 1.00 1.09 N ATOM 0 H LYS A 131 21.632 -0.540 6.188 1.00 0.33 H new ATOM 0 HA LYS A 131 22.724 1.857 7.093 1.00 0.37 H new ATOM 0 HB2 LYS A 131 21.450 -0.416 8.158 1.00 0.40 H new ATOM 0 HB3 LYS A 131 22.990 -0.344 8.993 1.00 0.40 H new ATOM 0 HG2 LYS A 131 21.056 1.991 8.777 1.00 0.53 H new ATOM 0 HG3 LYS A 131 21.126 0.891 10.140 1.00 0.53 H new ATOM 0 HD2 LYS A 131 23.171 1.703 10.883 1.00 0.69 H new ATOM 0 HD3 LYS A 131 23.691 2.186 9.281 1.00 0.69 H new ATOM 0 HE2 LYS A 131 22.252 4.125 9.298 1.00 0.82 H new ATOM 0 HE3 LYS A 131 21.414 3.575 10.735 1.00 0.82 H new ATOM 0 HZ1 LYS A 131 23.007 5.295 11.255 1.00 1.09 H new ATOM 0 HZ2 LYS A 131 23.464 3.837 11.997 1.00 1.09 H new ATOM 0 HZ3 LYS A 131 24.275 4.371 10.604 1.00 1.09 H new ATOM 2229 N LYS A 132 24.875 -0.630 6.919 1.00 0.40 N ATOM 2230 CA LYS A 132 26.299 -0.951 6.917 1.00 0.45 C ATOM 2231 C LYS A 132 26.995 -0.215 5.776 1.00 0.44 C ATOM 2232 O LYS A 132 28.170 0.149 5.872 1.00 0.47 O ATOM 2233 CB LYS A 132 26.517 -2.460 6.778 1.00 0.49 C ATOM 2234 CG LYS A 132 25.670 -3.298 7.721 1.00 0.53 C ATOM 2235 CD LYS A 132 25.873 -2.909 9.176 1.00 0.59 C ATOM 2236 CE LYS A 132 27.294 -3.190 9.646 1.00 0.92 C ATOM 2237 NZ LYS A 132 27.417 -3.102 11.123 1.00 1.39 N ATOM 0 H LYS A 132 24.266 -1.406 6.659 1.00 0.40 H new ATOM 0 HA LYS A 132 26.727 -0.630 7.867 1.00 0.45 H new ATOM 0 HB2 LYS A 132 26.299 -2.755 5.752 1.00 0.49 H new ATOM 0 HB3 LYS A 132 27.569 -2.682 6.957 1.00 0.49 H new ATOM 0 HG2 LYS A 132 24.618 -3.184 7.460 1.00 0.53 H new ATOM 0 HG3 LYS A 132 25.918 -4.351 7.590 1.00 0.53 H new ATOM 0 HD2 LYS A 132 25.652 -1.849 9.303 1.00 0.59 H new ATOM 0 HD3 LYS A 132 25.169 -3.459 9.800 1.00 0.59 H new ATOM 0 HE2 LYS A 132 27.596 -4.184 9.315 1.00 0.92 H new ATOM 0 HE3 LYS A 132 27.977 -2.479 9.182 1.00 0.92 H new ATOM 0 HZ1 LYS A 132 28.399 -3.300 11.402 1.00 1.39 H new ATOM 0 HZ2 LYS A 132 27.154 -2.146 11.437 1.00 1.39 H new ATOM 0 HZ3 LYS A 132 26.784 -3.798 11.566 1.00 1.39 H new ATOM 2251 N LYS A 133 26.253 0.013 4.699 1.00 0.42 N ATOM 2252 CA LYS A 133 26.777 0.721 3.536 1.00 0.44 C ATOM 2253 C LYS A 133 26.698 2.230 3.742 1.00 0.42 C ATOM 2254 O LYS A 133 27.168 2.995 2.900 1.00 0.45 O ATOM 2255 CB LYS A 133 25.985 0.341 2.283 1.00 0.49 C ATOM 2256 CG LYS A 133 26.207 -1.081 1.815 1.00 1.05 C ATOM 2257 CD LYS A 133 25.142 -1.496 0.814 1.00 1.48 C ATOM 2258 CE LYS A 133 25.455 -2.843 0.182 1.00 2.08 C ATOM 2259 NZ LYS A 133 26.494 -2.734 -0.876 1.00 2.52 N ATOM 0 H LYS A 133 25.282 -0.284 4.606 1.00 0.42 H new ATOM 0 HA LYS A 133 27.821 0.433 3.409 1.00 0.44 H new ATOM 0 HB2 LYS A 133 24.923 0.485 2.481 1.00 0.49 H new ATOM 0 HB3 LYS A 133 26.254 1.023 1.476 1.00 0.49 H new ATOM 0 HG2 LYS A 133 27.193 -1.168 1.359 1.00 1.05 H new ATOM 0 HG3 LYS A 133 26.190 -1.756 2.670 1.00 1.05 H new ATOM 0 HD2 LYS A 133 24.174 -1.545 1.313 1.00 1.48 H new ATOM 0 HD3 LYS A 133 25.061 -0.739 0.034 1.00 1.48 H new ATOM 0 HE2 LYS A 133 25.794 -3.535 0.953 1.00 2.08 H new ATOM 0 HE3 LYS A 133 24.545 -3.263 -0.246 1.00 2.08 H new ATOM 0 HZ1 LYS A 133 26.677 -3.674 -1.281 1.00 2.52 H new ATOM 0 HZ2 LYS A 133 26.161 -2.094 -1.625 1.00 2.52 H new ATOM 0 HZ3 LYS A 133 27.371 -2.358 -0.464 1.00 2.52 H new ATOM 2273 N ASN A 134 26.098 2.633 4.863 1.00 0.41 N ATOM 2274 CA ASN A 134 25.925 4.049 5.222 1.00 0.42 C ATOM 2275 C ASN A 134 24.829 4.672 4.365 1.00 0.40 C ATOM 2276 O ASN A 134 24.881 5.843 3.982 1.00 0.44 O ATOM 2277 CB ASN A 134 27.240 4.827 5.080 1.00 0.48 C ATOM 2278 CG ASN A 134 27.223 6.145 5.821 1.00 0.78 C ATOM 2279 OD1 ASN A 134 26.578 6.289 6.861 1.00 1.08 O ATOM 2280 ND2 ASN A 134 27.940 7.117 5.286 1.00 1.06 N ATOM 0 H ASN A 134 25.715 1.987 5.553 1.00 0.41 H new ATOM 0 HA ASN A 134 25.627 4.104 6.269 1.00 0.42 H new ATOM 0 HB2 ASN A 134 28.061 4.215 5.454 1.00 0.48 H new ATOM 0 HB3 ASN A 134 27.436 5.012 4.024 1.00 0.48 H new ATOM 0 HD21 ASN A 134 27.975 8.032 5.736 1.00 1.06 H new ATOM 0 HD22 ASN A 134 28.459 6.953 4.423 1.00 1.06 H new ATOM 2287 N TYR A 135 23.828 3.853 4.082 1.00 0.36 N ATOM 2288 CA TYR A 135 22.671 4.256 3.302 1.00 0.35 C ATOM 2289 C TYR A 135 21.416 3.931 4.101 1.00 0.34 C ATOM 2290 O TYR A 135 21.379 2.936 4.818 1.00 0.35 O ATOM 2291 CB TYR A 135 22.638 3.507 1.971 1.00 0.37 C ATOM 2292 CG TYR A 135 22.459 4.385 0.750 1.00 0.55 C ATOM 2293 CD1 TYR A 135 21.638 5.505 0.777 1.00 1.30 C ATOM 2294 CD2 TYR A 135 23.114 4.085 -0.436 1.00 1.44 C ATOM 2295 CE1 TYR A 135 21.478 6.300 -0.343 1.00 1.46 C ATOM 2296 CE2 TYR A 135 22.961 4.873 -1.557 1.00 1.66 C ATOM 2297 CZ TYR A 135 22.144 5.980 -1.507 1.00 1.17 C ATOM 2298 OH TYR A 135 21.998 6.771 -2.623 1.00 1.51 O ATOM 0 H TYR A 135 23.797 2.881 4.391 1.00 0.36 H new ATOM 0 HA TYR A 135 22.724 5.325 3.095 1.00 0.35 H new ATOM 0 HB2 TYR A 135 23.566 2.945 1.864 1.00 0.37 H new ATOM 0 HB3 TYR A 135 21.827 2.780 2.000 1.00 0.37 H new ATOM 0 HD1 TYR A 135 21.116 5.759 1.688 1.00 1.30 H new ATOM 0 HD2 TYR A 135 23.756 3.218 -0.482 1.00 1.44 H new ATOM 0 HE1 TYR A 135 20.835 7.167 -0.306 1.00 1.46 H new ATOM 0 HE2 TYR A 135 23.480 4.623 -2.471 1.00 1.66 H new ATOM 0 HH TYR A 135 22.536 6.405 -3.356 1.00 1.51 H new ATOM 2308 N LYS A 136 20.402 4.761 4.013 1.00 0.34 N ATOM 2309 CA LYS A 136 19.180 4.501 4.736 1.00 0.35 C ATOM 2310 C LYS A 136 17.976 4.912 3.906 1.00 0.34 C ATOM 2311 O LYS A 136 17.863 6.055 3.486 1.00 0.36 O ATOM 2312 CB LYS A 136 19.196 5.242 6.064 1.00 0.39 C ATOM 2313 CG LYS A 136 18.089 4.807 6.999 1.00 1.36 C ATOM 2314 CD LYS A 136 17.951 5.760 8.166 1.00 1.43 C ATOM 2315 CE LYS A 136 17.138 6.986 7.785 1.00 1.18 C ATOM 2316 NZ LYS A 136 16.967 7.917 8.932 1.00 1.36 N ATOM 0 H LYS A 136 20.399 5.614 3.453 1.00 0.34 H new ATOM 0 HA LYS A 136 19.106 3.432 4.934 1.00 0.35 H new ATOM 0 HB2 LYS A 136 20.158 5.083 6.551 1.00 0.39 H new ATOM 0 HB3 LYS A 136 19.106 6.312 5.877 1.00 0.39 H new ATOM 0 HG2 LYS A 136 17.147 4.758 6.453 1.00 1.36 H new ATOM 0 HG3 LYS A 136 18.296 3.803 7.369 1.00 1.36 H new ATOM 0 HD2 LYS A 136 17.472 5.249 9.001 1.00 1.43 H new ATOM 0 HD3 LYS A 136 18.940 6.068 8.506 1.00 1.43 H new ATOM 0 HE2 LYS A 136 17.631 7.508 6.965 1.00 1.18 H new ATOM 0 HE3 LYS A 136 16.159 6.674 7.422 1.00 1.18 H new ATOM 0 HZ1 LYS A 136 16.407 8.740 8.631 1.00 1.36 H new ATOM 0 HZ2 LYS A 136 16.474 7.427 9.706 1.00 1.36 H new ATOM 0 HZ3 LYS A 136 17.900 8.236 9.263 1.00 1.36 H new ATOM 2330 N LEU A 137 17.089 3.971 3.656 1.00 0.34 N ATOM 2331 CA LEU A 137 15.901 4.242 2.871 1.00 0.36 C ATOM 2332 C LEU A 137 14.731 4.586 3.777 1.00 0.35 C ATOM 2333 O LEU A 137 14.674 4.164 4.933 1.00 0.36 O ATOM 2334 CB LEU A 137 15.557 3.044 1.976 1.00 0.43 C ATOM 2335 CG LEU A 137 14.557 2.044 2.564 1.00 0.40 C ATOM 2336 CD1 LEU A 137 13.239 2.093 1.802 1.00 0.66 C ATOM 2337 CD2 LEU A 137 15.131 0.637 2.546 1.00 0.64 C ATOM 0 H LEU A 137 17.168 3.009 3.986 1.00 0.34 H new ATOM 0 HA LEU A 137 16.103 5.100 2.229 1.00 0.36 H new ATOM 0 HB2 LEU A 137 15.157 3.420 1.035 1.00 0.43 H new ATOM 0 HB3 LEU A 137 16.479 2.513 1.741 1.00 0.43 H new ATOM 0 HG LEU A 137 14.366 2.322 3.600 1.00 0.40 H new ATOM 0 HD11 LEU A 137 12.542 1.376 2.235 1.00 0.66 H new ATOM 0 HD12 LEU A 137 12.817 3.096 1.870 1.00 0.66 H new ATOM 0 HD13 LEU A 137 13.414 1.843 0.756 1.00 0.66 H new ATOM 0 HD21 LEU A 137 14.405 -0.058 2.968 1.00 0.64 H new ATOM 0 HD22 LEU A 137 15.355 0.348 1.519 1.00 0.64 H new ATOM 0 HD23 LEU A 137 16.046 0.610 3.138 1.00 0.64 H new ATOM 2349 N ASN A 138 13.809 5.353 3.238 1.00 0.35 N ATOM 2350 CA ASN A 138 12.623 5.777 3.952 1.00 0.37 C ATOM 2351 C ASN A 138 11.521 5.952 2.925 1.00 0.40 C ATOM 2352 O ASN A 138 11.809 6.051 1.736 1.00 0.40 O ATOM 2353 CB ASN A 138 12.867 7.087 4.706 1.00 0.40 C ATOM 2354 CG ASN A 138 12.834 6.916 6.214 1.00 0.52 C ATOM 2355 OD1 ASN A 138 12.276 7.738 6.934 1.00 0.68 O ATOM 2356 ND2 ASN A 138 13.452 5.857 6.704 1.00 0.81 N ATOM 0 H ASN A 138 13.861 5.704 2.282 1.00 0.35 H new ATOM 0 HA ASN A 138 12.346 5.031 4.697 1.00 0.37 H new ATOM 0 HB2 ASN A 138 13.835 7.494 4.413 1.00 0.40 H new ATOM 0 HB3 ASN A 138 12.112 7.816 4.411 1.00 0.40 H new ATOM 0 HD21 ASN A 138 13.476 5.701 7.712 1.00 0.81 H new ATOM 0 HD22 ASN A 138 13.905 5.194 6.075 1.00 0.81 H new ATOM 2363 N GLN A 139 10.275 6.000 3.364 1.00 0.45 N ATOM 2364 CA GLN A 139 9.149 6.153 2.438 1.00 0.53 C ATOM 2365 C GLN A 139 9.248 7.478 1.675 1.00 0.60 C ATOM 2366 O GLN A 139 8.674 7.631 0.601 1.00 0.92 O ATOM 2367 CB GLN A 139 7.825 6.079 3.202 1.00 0.63 C ATOM 2368 CG GLN A 139 6.698 5.420 2.415 1.00 1.09 C ATOM 2369 CD GLN A 139 6.149 4.189 3.104 1.00 1.95 C ATOM 2370 OE1 GLN A 139 5.234 4.276 3.921 1.00 2.36 O ATOM 2371 NE2 GLN A 139 6.700 3.028 2.777 1.00 2.87 N ATOM 0 H GLN A 139 10.011 5.936 4.347 1.00 0.45 H new ATOM 0 HA GLN A 139 9.186 5.339 1.714 1.00 0.53 H new ATOM 0 HB2 GLN A 139 7.981 5.526 4.128 1.00 0.63 H new ATOM 0 HB3 GLN A 139 7.520 7.088 3.481 1.00 0.63 H new ATOM 0 HG2 GLN A 139 5.893 6.140 2.269 1.00 1.09 H new ATOM 0 HG3 GLN A 139 7.063 5.145 1.425 1.00 1.09 H new ATOM 0 HE21 GLN A 139 7.457 2.997 2.095 1.00 2.87 H new ATOM 0 HE22 GLN A 139 6.366 2.166 3.208 1.00 2.87 H new ATOM 2380 N TYR A 140 10.017 8.414 2.226 1.00 0.47 N ATOM 2381 CA TYR A 140 10.181 9.736 1.624 1.00 0.53 C ATOM 2382 C TYR A 140 11.351 9.774 0.645 1.00 0.49 C ATOM 2383 O TYR A 140 11.405 10.650 -0.219 1.00 0.54 O ATOM 2384 CB TYR A 140 10.389 10.790 2.713 1.00 0.60 C ATOM 2385 CG TYR A 140 9.742 10.422 4.031 1.00 0.63 C ATOM 2386 CD1 TYR A 140 8.389 10.647 4.253 1.00 1.37 C ATOM 2387 CD2 TYR A 140 10.485 9.836 5.043 1.00 1.33 C ATOM 2388 CE1 TYR A 140 7.796 10.296 5.447 1.00 1.42 C ATOM 2389 CE2 TYR A 140 9.905 9.482 6.239 1.00 1.38 C ATOM 2390 CZ TYR A 140 8.558 9.712 6.439 1.00 0.80 C ATOM 2391 OH TYR A 140 7.971 9.354 7.630 1.00 0.92 O ATOM 0 H TYR A 140 10.539 8.281 3.092 1.00 0.47 H new ATOM 0 HA TYR A 140 9.270 9.956 1.068 1.00 0.53 H new ATOM 0 HB2 TYR A 140 11.458 10.936 2.869 1.00 0.60 H new ATOM 0 HB3 TYR A 140 9.984 11.742 2.370 1.00 0.60 H new ATOM 0 HD1 TYR A 140 7.792 11.104 3.478 1.00 1.37 H new ATOM 0 HD2 TYR A 140 11.538 9.654 4.890 1.00 1.33 H new ATOM 0 HE1 TYR A 140 6.743 10.477 5.605 1.00 1.42 H new ATOM 0 HE2 TYR A 140 10.500 9.027 7.017 1.00 1.38 H new ATOM 0 HH TYR A 140 8.644 8.955 8.220 1.00 0.92 H new ATOM 2401 N GLY A 141 12.292 8.844 0.780 1.00 0.43 N ATOM 2402 CA GLY A 141 13.428 8.832 -0.123 1.00 0.42 C ATOM 2403 C GLY A 141 14.620 8.066 0.418 1.00 0.38 C ATOM 2404 O GLY A 141 14.473 7.223 1.303 1.00 0.37 O ATOM 0 H GLY A 141 12.289 8.109 1.487 1.00 0.43 H new ATOM 0 HA2 GLY A 141 13.123 8.392 -1.072 1.00 0.42 H new ATOM 0 HA3 GLY A 141 13.729 9.859 -0.330 1.00 0.42 H new ATOM 2408 N LEU A 142 15.802 8.363 -0.111 1.00 0.38 N ATOM 2409 CA LEU A 142 17.028 7.698 0.313 1.00 0.37 C ATOM 2410 C LEU A 142 17.883 8.644 1.144 1.00 0.38 C ATOM 2411 O LEU A 142 17.716 9.855 1.076 1.00 0.54 O ATOM 2412 CB LEU A 142 17.834 7.223 -0.905 1.00 0.40 C ATOM 2413 CG LEU A 142 17.665 5.750 -1.288 1.00 0.47 C ATOM 2414 CD1 LEU A 142 18.085 4.846 -0.139 1.00 0.85 C ATOM 2415 CD2 LEU A 142 16.233 5.461 -1.689 1.00 0.50 C ATOM 0 H LEU A 142 15.937 9.065 -0.839 1.00 0.38 H new ATOM 0 HA LEU A 142 16.752 6.834 0.918 1.00 0.37 H new ATOM 0 HB2 LEU A 142 17.554 7.835 -1.762 1.00 0.40 H new ATOM 0 HB3 LEU A 142 18.891 7.409 -0.712 1.00 0.40 H new ATOM 0 HG LEU A 142 18.310 5.546 -2.143 1.00 0.47 H new ATOM 0 HD11 LEU A 142 17.957 3.804 -0.431 1.00 0.85 H new ATOM 0 HD12 LEU A 142 19.132 5.029 0.104 1.00 0.85 H new ATOM 0 HD13 LEU A 142 17.467 5.056 0.734 1.00 0.85 H new ATOM 0 HD21 LEU A 142 16.135 4.409 -1.957 1.00 0.50 H new ATOM 0 HD22 LEU A 142 15.569 5.686 -0.854 1.00 0.50 H new ATOM 0 HD23 LEU A 142 15.963 6.080 -2.544 1.00 0.50 H new ATOM 2427 N PHE A 143 18.783 8.089 1.933 1.00 0.37 N ATOM 2428 CA PHE A 143 19.662 8.891 2.766 1.00 0.39 C ATOM 2429 C PHE A 143 21.099 8.413 2.649 1.00 0.40 C ATOM 2430 O PHE A 143 21.472 7.390 3.220 1.00 0.40 O ATOM 2431 CB PHE A 143 19.223 8.836 4.234 1.00 0.41 C ATOM 2432 CG PHE A 143 18.024 9.684 4.539 1.00 0.44 C ATOM 2433 CD1 PHE A 143 18.172 11.032 4.818 1.00 1.30 C ATOM 2434 CD2 PHE A 143 16.752 9.132 4.554 1.00 1.26 C ATOM 2435 CE1 PHE A 143 17.073 11.817 5.107 1.00 1.34 C ATOM 2436 CE2 PHE A 143 15.648 9.910 4.842 1.00 1.28 C ATOM 2437 CZ PHE A 143 15.806 11.254 5.119 1.00 0.58 C ATOM 0 H PHE A 143 18.926 7.082 2.015 1.00 0.37 H new ATOM 0 HA PHE A 143 19.600 9.921 2.416 1.00 0.39 H new ATOM 0 HB2 PHE A 143 19.002 7.802 4.499 1.00 0.41 H new ATOM 0 HB3 PHE A 143 20.053 9.156 4.864 1.00 0.41 H new ATOM 0 HD1 PHE A 143 19.157 11.474 4.810 1.00 1.30 H new ATOM 0 HD2 PHE A 143 16.623 8.082 4.338 1.00 1.26 H new ATOM 0 HE1 PHE A 143 17.200 12.867 5.323 1.00 1.34 H new ATOM 0 HE2 PHE A 143 14.663 9.468 4.851 1.00 1.28 H new ATOM 0 HZ PHE A 143 14.944 11.865 5.344 1.00 0.58 H new ATOM 2447 N LYS A 144 21.893 9.153 1.898 1.00 0.42 N ATOM 2448 CA LYS A 144 23.295 8.827 1.702 1.00 0.45 C ATOM 2449 C LYS A 144 24.148 9.694 2.615 1.00 0.56 C ATOM 2450 O LYS A 144 24.222 10.907 2.427 1.00 0.64 O ATOM 2451 CB LYS A 144 23.695 9.037 0.233 1.00 0.55 C ATOM 2452 CG LYS A 144 25.198 9.077 -0.004 1.00 0.80 C ATOM 2453 CD LYS A 144 25.815 7.687 -0.005 1.00 0.97 C ATOM 2454 CE LYS A 144 25.780 7.062 -1.389 1.00 1.96 C ATOM 2455 NZ LYS A 144 26.543 5.785 -1.441 1.00 2.30 N ATOM 0 H LYS A 144 21.587 9.994 1.408 1.00 0.42 H new ATOM 0 HA LYS A 144 23.457 7.778 1.950 1.00 0.45 H new ATOM 0 HB2 LYS A 144 23.265 8.235 -0.367 1.00 0.55 H new ATOM 0 HB3 LYS A 144 23.257 9.970 -0.121 1.00 0.55 H new ATOM 0 HG2 LYS A 144 25.401 9.564 -0.958 1.00 0.80 H new ATOM 0 HG3 LYS A 144 25.670 9.682 0.770 1.00 0.80 H new ATOM 0 HD2 LYS A 144 26.846 7.746 0.343 1.00 0.97 H new ATOM 0 HD3 LYS A 144 25.278 7.049 0.697 1.00 0.97 H new ATOM 0 HE2 LYS A 144 24.745 6.879 -1.678 1.00 1.96 H new ATOM 0 HE3 LYS A 144 26.194 7.762 -2.114 1.00 1.96 H new ATOM 0 HZ1 LYS A 144 26.495 5.391 -2.402 1.00 2.30 H new ATOM 0 HZ2 LYS A 144 27.536 5.964 -1.190 1.00 2.30 H new ATOM 0 HZ3 LYS A 144 26.132 5.107 -0.768 1.00 2.30 H new ATOM 2469 N ASN A 145 24.760 9.072 3.620 1.00 0.62 N ATOM 2470 CA ASN A 145 25.613 9.788 4.571 1.00 0.81 C ATOM 2471 C ASN A 145 24.844 10.939 5.226 1.00 0.99 C ATOM 2472 O ASN A 145 25.346 12.061 5.322 1.00 1.97 O ATOM 2473 CB ASN A 145 26.871 10.318 3.869 1.00 0.92 C ATOM 2474 CG ASN A 145 28.119 10.181 4.718 1.00 1.20 C ATOM 2475 OD1 ASN A 145 28.062 10.206 5.948 1.00 1.57 O ATOM 2476 ND2 ASN A 145 29.261 10.023 4.067 1.00 1.70 N ATOM 0 H ASN A 145 24.682 8.071 3.799 1.00 0.62 H new ATOM 0 HA ASN A 145 25.917 9.090 5.351 1.00 0.81 H new ATOM 0 HB2 ASN A 145 27.013 9.779 2.932 1.00 0.92 H new ATOM 0 HB3 ASN A 145 26.724 11.367 3.614 1.00 0.92 H new ATOM 0 HD21 ASN A 145 30.133 9.917 4.585 1.00 1.70 H new ATOM 0 HD22 ASN A 145 29.269 10.007 3.047 1.00 1.70 H new ATOM 2483 N GLN A 146 23.610 10.641 5.647 1.00 0.56 N ATOM 2484 CA GLN A 146 22.721 11.616 6.301 1.00 0.58 C ATOM 2485 C GLN A 146 22.142 12.638 5.316 1.00 0.55 C ATOM 2486 O GLN A 146 21.394 13.531 5.712 1.00 0.60 O ATOM 2487 CB GLN A 146 23.432 12.338 7.454 1.00 0.66 C ATOM 2488 CG GLN A 146 23.306 11.632 8.786 1.00 1.54 C ATOM 2489 CD GLN A 146 22.022 11.992 9.502 1.00 2.42 C ATOM 2490 OE1 GLN A 146 22.006 12.850 10.382 1.00 2.97 O ATOM 2491 NE2 GLN A 146 20.935 11.358 9.108 1.00 3.02 N ATOM 0 H GLN A 146 23.195 9.715 5.545 1.00 0.56 H new ATOM 0 HA GLN A 146 21.888 11.042 6.707 1.00 0.58 H new ATOM 0 HB2 GLN A 146 24.489 12.444 7.208 1.00 0.66 H new ATOM 0 HB3 GLN A 146 23.024 13.345 7.547 1.00 0.66 H new ATOM 0 HG2 GLN A 146 23.343 10.554 8.629 1.00 1.54 H new ATOM 0 HG3 GLN A 146 24.157 11.892 9.416 1.00 1.54 H new ATOM 0 HE21 GLN A 146 20.994 10.653 8.374 1.00 3.02 H new ATOM 0 HE22 GLN A 146 20.035 11.573 9.538 1.00 3.02 H new ATOM 2500 N THR A 147 22.484 12.512 4.044 1.00 0.51 N ATOM 2501 CA THR A 147 21.975 13.420 3.025 1.00 0.52 C ATOM 2502 C THR A 147 20.816 12.777 2.260 1.00 0.47 C ATOM 2503 O THR A 147 20.966 11.703 1.679 1.00 0.46 O ATOM 2504 CB THR A 147 23.095 13.823 2.041 1.00 0.56 C ATOM 2505 OG1 THR A 147 24.159 14.468 2.754 1.00 0.64 O ATOM 2506 CG2 THR A 147 22.572 14.753 0.953 1.00 0.62 C ATOM 0 H THR A 147 23.112 11.790 3.691 1.00 0.51 H new ATOM 0 HA THR A 147 21.611 14.317 3.526 1.00 0.52 H new ATOM 0 HB THR A 147 23.466 12.916 1.564 1.00 0.56 H new ATOM 0 HG1 THR A 147 24.868 14.720 2.126 1.00 0.64 H new ATOM 0 HG21 THR A 147 23.386 15.017 0.278 1.00 0.62 H new ATOM 0 HG22 THR A 147 21.784 14.250 0.392 1.00 0.62 H new ATOM 0 HG23 THR A 147 22.171 15.658 1.410 1.00 0.62 H new ATOM 2514 N LEU A 148 19.656 13.431 2.281 1.00 0.47 N ATOM 2515 CA LEU A 148 18.475 12.917 1.594 1.00 0.44 C ATOM 2516 C LEU A 148 18.659 12.921 0.082 1.00 0.44 C ATOM 2517 O LEU A 148 19.188 13.870 -0.503 1.00 0.50 O ATOM 2518 CB LEU A 148 17.226 13.723 1.962 1.00 0.47 C ATOM 2519 CG LEU A 148 15.945 13.289 1.245 1.00 0.49 C ATOM 2520 CD1 LEU A 148 15.547 11.891 1.676 1.00 0.58 C ATOM 2521 CD2 LEU A 148 14.816 14.262 1.523 1.00 0.78 C ATOM 0 H LEU A 148 19.510 14.316 2.766 1.00 0.47 H new ATOM 0 HA LEU A 148 18.341 11.887 1.923 1.00 0.44 H new ATOM 0 HB2 LEU A 148 17.066 13.648 3.038 1.00 0.47 H new ATOM 0 HB3 LEU A 148 17.411 14.774 1.740 1.00 0.47 H new ATOM 0 HG LEU A 148 16.140 13.285 0.173 1.00 0.49 H new ATOM 0 HD11 LEU A 148 14.634 11.596 1.158 1.00 0.58 H new ATOM 0 HD12 LEU A 148 16.346 11.193 1.429 1.00 0.58 H new ATOM 0 HD13 LEU A 148 15.374 11.878 2.752 1.00 0.58 H new ATOM 0 HD21 LEU A 148 13.916 13.933 1.003 1.00 0.78 H new ATOM 0 HD22 LEU A 148 14.623 14.299 2.595 1.00 0.78 H new ATOM 0 HD23 LEU A 148 15.096 15.255 1.171 1.00 0.78 H new ATOM 2533 N VAL A 149 18.209 11.843 -0.529 1.00 0.40 N ATOM 2534 CA VAL A 149 18.285 11.650 -1.965 1.00 0.41 C ATOM 2535 C VAL A 149 16.893 11.307 -2.513 1.00 0.39 C ATOM 2536 O VAL A 149 16.238 10.388 -2.016 1.00 0.43 O ATOM 2537 CB VAL A 149 19.274 10.516 -2.313 1.00 0.44 C ATOM 2538 CG1 VAL A 149 19.362 10.301 -3.815 1.00 0.52 C ATOM 2539 CG2 VAL A 149 20.650 10.804 -1.726 1.00 0.48 C ATOM 0 H VAL A 149 17.773 11.064 -0.035 1.00 0.40 H new ATOM 0 HA VAL A 149 18.642 12.573 -2.421 1.00 0.41 H new ATOM 0 HB VAL A 149 18.896 9.595 -1.868 1.00 0.44 H new ATOM 0 HG11 VAL A 149 20.066 9.496 -4.027 1.00 0.52 H new ATOM 0 HG12 VAL A 149 18.379 10.034 -4.203 1.00 0.52 H new ATOM 0 HG13 VAL A 149 19.704 11.218 -4.294 1.00 0.52 H new ATOM 0 HG21 VAL A 149 21.332 9.993 -1.982 1.00 0.48 H new ATOM 0 HG22 VAL A 149 21.030 11.741 -2.133 1.00 0.48 H new ATOM 0 HG23 VAL A 149 20.573 10.884 -0.642 1.00 0.48 H new ATOM 2549 N PRO A 150 16.414 12.057 -3.520 1.00 0.40 N ATOM 2550 CA PRO A 150 15.094 11.827 -4.129 1.00 0.42 C ATOM 2551 C PRO A 150 15.043 10.552 -4.972 1.00 0.35 C ATOM 2552 O PRO A 150 16.067 9.908 -5.212 1.00 0.42 O ATOM 2553 CB PRO A 150 14.898 13.058 -5.010 1.00 0.53 C ATOM 2554 CG PRO A 150 16.268 13.533 -5.330 1.00 0.68 C ATOM 2555 CD PRO A 150 17.115 13.196 -4.140 1.00 0.48 C ATOM 0 HA PRO A 150 14.319 11.691 -3.375 1.00 0.42 H new ATOM 0 HB2 PRO A 150 14.346 12.809 -5.916 1.00 0.53 H new ATOM 0 HB3 PRO A 150 14.327 13.827 -4.490 1.00 0.53 H new ATOM 0 HG2 PRO A 150 16.648 13.048 -6.229 1.00 0.68 H new ATOM 0 HG3 PRO A 150 16.274 14.606 -5.521 1.00 0.68 H new ATOM 0 HD2 PRO A 150 18.130 12.929 -4.434 1.00 0.48 H new ATOM 0 HD3 PRO A 150 17.194 14.039 -3.453 1.00 0.48 H new ATOM 2563 N LEU A 151 13.848 10.197 -5.439 1.00 0.43 N ATOM 2564 CA LEU A 151 13.676 8.997 -6.244 1.00 0.40 C ATOM 2565 C LEU A 151 13.303 9.332 -7.685 1.00 0.39 C ATOM 2566 O LEU A 151 12.656 10.341 -7.961 1.00 0.56 O ATOM 2567 CB LEU A 151 12.642 8.013 -5.626 1.00 0.62 C ATOM 2568 CG LEU A 151 11.320 8.577 -5.043 1.00 0.87 C ATOM 2569 CD1 LEU A 151 11.556 9.386 -3.775 1.00 1.11 C ATOM 2570 CD2 LEU A 151 10.548 9.395 -6.067 1.00 1.31 C ATOM 0 H LEU A 151 12.990 10.723 -5.273 1.00 0.43 H new ATOM 0 HA LEU A 151 14.643 8.494 -6.251 1.00 0.40 H new ATOM 0 HB2 LEU A 151 12.379 7.287 -6.395 1.00 0.62 H new ATOM 0 HB3 LEU A 151 13.145 7.465 -4.829 1.00 0.62 H new ATOM 0 HG LEU A 151 10.709 7.714 -4.779 1.00 0.87 H new ATOM 0 HD11 LEU A 151 10.604 9.762 -3.401 1.00 1.11 H new ATOM 0 HD12 LEU A 151 12.018 8.751 -3.019 1.00 1.11 H new ATOM 0 HD13 LEU A 151 12.216 10.225 -3.996 1.00 1.11 H new ATOM 0 HD21 LEU A 151 9.630 9.770 -5.615 1.00 1.31 H new ATOM 0 HD22 LEU A 151 11.159 10.235 -6.397 1.00 1.31 H new ATOM 0 HD23 LEU A 151 10.301 8.767 -6.923 1.00 1.31 H new ATOM 2582 N LYS A 152 13.757 8.494 -8.606 1.00 0.40 N ATOM 2583 CA LYS A 152 13.463 8.662 -10.021 1.00 0.53 C ATOM 2584 C LYS A 152 12.891 7.369 -10.573 1.00 0.50 C ATOM 2585 O LYS A 152 13.120 7.005 -11.728 1.00 0.58 O ATOM 2586 CB LYS A 152 14.725 9.033 -10.795 1.00 0.72 C ATOM 2587 CG LYS A 152 15.447 10.244 -10.240 1.00 0.84 C ATOM 2588 CD LYS A 152 16.865 9.892 -9.834 1.00 1.45 C ATOM 2589 CE LYS A 152 16.986 9.689 -8.333 1.00 1.66 C ATOM 2590 NZ LYS A 152 18.144 8.824 -7.984 1.00 2.55 N ATOM 0 H LYS A 152 14.337 7.682 -8.394 1.00 0.40 H new ATOM 0 HA LYS A 152 12.738 9.468 -10.134 1.00 0.53 H new ATOM 0 HB2 LYS A 152 15.406 8.182 -10.791 1.00 0.72 H new ATOM 0 HB3 LYS A 152 14.460 9.224 -11.835 1.00 0.72 H new ATOM 0 HG2 LYS A 152 15.465 11.036 -10.989 1.00 0.84 H new ATOM 0 HG3 LYS A 152 14.904 10.632 -9.378 1.00 0.84 H new ATOM 0 HD2 LYS A 152 17.177 8.984 -10.350 1.00 1.45 H new ATOM 0 HD3 LYS A 152 17.542 10.686 -10.150 1.00 1.45 H new ATOM 0 HE2 LYS A 152 17.094 10.657 -7.843 1.00 1.66 H new ATOM 0 HE3 LYS A 152 16.069 9.240 -7.952 1.00 1.66 H new ATOM 0 HZ1 LYS A 152 18.254 8.792 -6.950 1.00 2.55 H new ATOM 0 HZ2 LYS A 152 17.980 7.863 -8.345 1.00 2.55 H new ATOM 0 HZ3 LYS A 152 19.009 9.212 -8.412 1.00 2.55 H new ATOM 2604 N ILE A 153 12.145 6.677 -9.733 1.00 0.43 N ATOM 2605 CA ILE A 153 11.564 5.400 -10.107 1.00 0.43 C ATOM 2606 C ILE A 153 10.098 5.319 -9.725 1.00 0.45 C ATOM 2607 O ILE A 153 9.594 6.143 -8.961 1.00 0.48 O ATOM 2608 CB ILE A 153 12.291 4.212 -9.442 1.00 0.39 C ATOM 2609 CG1 ILE A 153 12.192 4.295 -7.912 1.00 0.38 C ATOM 2610 CG2 ILE A 153 13.743 4.133 -9.900 1.00 0.42 C ATOM 2611 CD1 ILE A 153 13.400 4.905 -7.247 1.00 0.40 C ATOM 0 H ILE A 153 11.926 6.978 -8.783 1.00 0.43 H new ATOM 0 HA ILE A 153 11.674 5.335 -11.190 1.00 0.43 H new ATOM 0 HB ILE A 153 11.795 3.294 -9.757 1.00 0.39 H new ATOM 0 HG12 ILE A 153 11.311 4.880 -7.647 1.00 0.38 H new ATOM 0 HG13 ILE A 153 12.040 3.292 -7.514 1.00 0.38 H new ATOM 0 HG21 ILE A 153 14.232 3.287 -9.416 1.00 0.42 H new ATOM 0 HG22 ILE A 153 13.777 4.001 -10.982 1.00 0.42 H new ATOM 0 HG23 ILE A 153 14.260 5.054 -9.630 1.00 0.42 H new ATOM 0 HD11 ILE A 153 13.249 4.926 -6.168 1.00 0.40 H new ATOM 0 HD12 ILE A 153 14.283 4.309 -7.478 1.00 0.40 H new ATOM 0 HD13 ILE A 153 13.543 5.922 -7.614 1.00 0.40 H new ATOM 2623 N THR A 154 9.431 4.306 -10.257 1.00 0.47 N ATOM 2624 CA THR A 154 8.026 4.074 -9.969 1.00 0.52 C ATOM 2625 C THR A 154 7.742 2.574 -9.872 1.00 0.53 C ATOM 2626 O THR A 154 6.640 2.158 -9.515 1.00 0.74 O ATOM 2627 CB THR A 154 7.126 4.722 -11.049 1.00 0.61 C ATOM 2628 OG1 THR A 154 5.826 5.002 -10.518 1.00 0.70 O ATOM 2629 CG2 THR A 154 7.000 3.830 -12.275 1.00 0.71 C ATOM 0 H THR A 154 9.845 3.627 -10.896 1.00 0.47 H new ATOM 0 HA THR A 154 7.796 4.538 -9.010 1.00 0.52 H new ATOM 0 HB THR A 154 7.598 5.656 -11.352 1.00 0.61 H new ATOM 0 HG1 THR A 154 5.275 5.427 -11.208 1.00 0.70 H new ATOM 0 HG21 THR A 154 6.362 4.315 -13.014 1.00 0.71 H new ATOM 0 HG22 THR A 154 7.987 3.660 -12.704 1.00 0.71 H new ATOM 0 HG23 THR A 154 6.561 2.875 -11.987 1.00 0.71 H new ATOM 2637 N THR A 155 8.756 1.761 -10.166 1.00 0.45 N ATOM 2638 CA THR A 155 8.616 0.312 -10.123 1.00 0.46 C ATOM 2639 C THR A 155 9.545 -0.304 -9.084 1.00 0.42 C ATOM 2640 O THR A 155 10.609 0.243 -8.796 1.00 0.40 O ATOM 2641 CB THR A 155 8.935 -0.319 -11.494 1.00 0.51 C ATOM 2642 OG1 THR A 155 8.659 0.618 -12.550 1.00 0.62 O ATOM 2643 CG2 THR A 155 8.124 -1.589 -11.704 1.00 0.56 C ATOM 0 H THR A 155 9.684 2.085 -10.437 1.00 0.45 H new ATOM 0 HA THR A 155 7.580 0.106 -9.855 1.00 0.46 H new ATOM 0 HB THR A 155 9.994 -0.576 -11.513 1.00 0.51 H new ATOM 0 HG1 THR A 155 9.418 0.645 -13.170 1.00 0.62 H new ATOM 0 HG21 THR A 155 8.364 -2.018 -12.677 1.00 0.56 H new ATOM 0 HG22 THR A 155 8.365 -2.308 -10.921 1.00 0.56 H new ATOM 0 HG23 THR A 155 7.061 -1.352 -11.665 1.00 0.56 H new ATOM 2651 N GLU A 156 9.131 -1.437 -8.524 1.00 0.44 N ATOM 2652 CA GLU A 156 9.934 -2.152 -7.532 1.00 0.43 C ATOM 2653 C GLU A 156 11.309 -2.489 -8.089 1.00 0.41 C ATOM 2654 O GLU A 156 12.324 -2.283 -7.427 1.00 0.39 O ATOM 2655 CB GLU A 156 9.248 -3.446 -7.116 1.00 0.50 C ATOM 2656 CG GLU A 156 7.787 -3.283 -6.757 1.00 0.53 C ATOM 2657 CD GLU A 156 6.927 -4.345 -7.400 1.00 1.06 C ATOM 2658 OE1 GLU A 156 7.342 -5.522 -7.421 1.00 1.75 O ATOM 2659 OE2 GLU A 156 5.829 -4.012 -7.894 1.00 1.72 O ATOM 0 H GLU A 156 8.240 -1.883 -8.741 1.00 0.44 H new ATOM 0 HA GLU A 156 10.041 -1.498 -6.667 1.00 0.43 H new ATOM 0 HB2 GLU A 156 9.333 -4.167 -7.929 1.00 0.50 H new ATOM 0 HB3 GLU A 156 9.777 -3.866 -6.260 1.00 0.50 H new ATOM 0 HG2 GLU A 156 7.672 -3.329 -5.674 1.00 0.53 H new ATOM 0 HG3 GLU A 156 7.443 -2.298 -7.072 1.00 0.53 H new ATOM 2666 N LYS A 157 11.334 -3.019 -9.311 1.00 0.44 N ATOM 2667 CA LYS A 157 12.580 -3.380 -9.963 1.00 0.44 C ATOM 2668 C LYS A 157 13.458 -2.151 -10.107 1.00 0.40 C ATOM 2669 O LYS A 157 14.651 -2.173 -9.799 1.00 0.39 O ATOM 2670 CB LYS A 157 12.310 -3.996 -11.337 1.00 0.49 C ATOM 2671 CG LYS A 157 11.422 -5.231 -11.281 1.00 0.69 C ATOM 2672 CD LYS A 157 12.235 -6.514 -11.273 1.00 1.05 C ATOM 2673 CE LYS A 157 12.851 -6.798 -12.634 1.00 1.58 C ATOM 2674 NZ LYS A 157 13.409 -8.170 -12.716 1.00 2.00 N ATOM 0 H LYS A 157 10.499 -3.206 -9.867 1.00 0.44 H new ATOM 0 HA LYS A 157 13.094 -4.120 -9.350 1.00 0.44 H new ATOM 0 HB2 LYS A 157 11.840 -3.248 -11.976 1.00 0.49 H new ATOM 0 HB3 LYS A 157 13.260 -4.261 -11.801 1.00 0.49 H new ATOM 0 HG2 LYS A 157 10.800 -5.190 -10.387 1.00 0.69 H new ATOM 0 HG3 LYS A 157 10.749 -5.233 -12.138 1.00 0.69 H new ATOM 0 HD2 LYS A 157 13.024 -6.440 -10.525 1.00 1.05 H new ATOM 0 HD3 LYS A 157 11.596 -7.348 -10.981 1.00 1.05 H new ATOM 0 HE2 LYS A 157 12.095 -6.667 -13.408 1.00 1.58 H new ATOM 0 HE3 LYS A 157 13.640 -6.073 -12.833 1.00 1.58 H new ATOM 0 HZ1 LYS A 157 13.819 -8.322 -13.660 1.00 2.00 H new ATOM 0 HZ2 LYS A 157 14.148 -8.288 -11.994 1.00 2.00 H new ATOM 0 HZ3 LYS A 157 12.651 -8.863 -12.552 1.00 2.00 H new ATOM 2688 N GLU A 158 12.856 -1.077 -10.574 1.00 0.41 N ATOM 2689 CA GLU A 158 13.549 0.165 -10.733 1.00 0.39 C ATOM 2690 C GLU A 158 14.115 0.615 -9.392 1.00 0.35 C ATOM 2691 O GLU A 158 15.262 1.052 -9.307 1.00 0.34 O ATOM 2692 CB GLU A 158 12.579 1.192 -11.280 1.00 0.43 C ATOM 2693 CG GLU A 158 12.860 1.605 -12.711 1.00 0.53 C ATOM 2694 CD GLU A 158 12.614 0.468 -13.684 1.00 1.06 C ATOM 2695 OE1 GLU A 158 11.480 -0.054 -13.719 1.00 1.71 O ATOM 2696 OE2 GLU A 158 13.559 0.085 -14.405 1.00 1.71 O ATOM 0 H GLU A 158 11.875 -1.050 -10.851 1.00 0.41 H new ATOM 0 HA GLU A 158 14.380 0.049 -11.429 1.00 0.39 H new ATOM 0 HB2 GLU A 158 11.568 0.789 -11.221 1.00 0.43 H new ATOM 0 HB3 GLU A 158 12.607 2.077 -10.645 1.00 0.43 H new ATOM 0 HG2 GLU A 158 12.228 2.453 -12.975 1.00 0.53 H new ATOM 0 HG3 GLU A 158 13.894 1.939 -12.796 1.00 0.53 H new ATOM 2703 N LEU A 159 13.312 0.464 -8.340 1.00 0.35 N ATOM 2704 CA LEU A 159 13.725 0.848 -7.002 1.00 0.32 C ATOM 2705 C LEU A 159 14.887 -0.008 -6.512 1.00 0.31 C ATOM 2706 O LEU A 159 15.858 0.526 -5.989 1.00 0.30 O ATOM 2707 CB LEU A 159 12.563 0.766 -6.015 1.00 0.34 C ATOM 2708 CG LEU A 159 12.917 1.176 -4.580 1.00 0.36 C ATOM 2709 CD1 LEU A 159 13.296 2.648 -4.513 1.00 0.55 C ATOM 2710 CD2 LEU A 159 11.765 0.882 -3.639 1.00 0.41 C ATOM 0 H LEU A 159 12.370 0.077 -8.395 1.00 0.35 H new ATOM 0 HA LEU A 159 14.058 1.884 -7.057 1.00 0.32 H new ATOM 0 HB2 LEU A 159 11.754 1.403 -6.372 1.00 0.34 H new ATOM 0 HB3 LEU A 159 12.183 -0.256 -6.004 1.00 0.34 H new ATOM 0 HG LEU A 159 13.779 0.588 -4.265 1.00 0.36 H new ATOM 0 HD11 LEU A 159 13.543 2.914 -3.485 1.00 0.55 H new ATOM 0 HD12 LEU A 159 14.160 2.831 -5.152 1.00 0.55 H new ATOM 0 HD13 LEU A 159 12.458 3.255 -4.854 1.00 0.55 H new ATOM 0 HD21 LEU A 159 12.037 1.180 -2.627 1.00 0.41 H new ATOM 0 HD22 LEU A 159 10.884 1.439 -3.957 1.00 0.41 H new ATOM 0 HD23 LEU A 159 11.545 -0.185 -3.656 1.00 0.41 H new ATOM 2722 N ILE A 160 14.800 -1.330 -6.669 1.00 0.33 N ATOM 2723 CA ILE A 160 15.892 -2.197 -6.226 1.00 0.34 C ATOM 2724 C ILE A 160 17.163 -1.875 -7.000 1.00 0.33 C ATOM 2725 O ILE A 160 18.252 -1.851 -6.428 1.00 0.33 O ATOM 2726 CB ILE A 160 15.564 -3.710 -6.319 1.00 0.38 C ATOM 2727 CG1 ILE A 160 15.050 -4.090 -7.699 1.00 0.40 C ATOM 2728 CG2 ILE A 160 14.552 -4.095 -5.255 1.00 0.43 C ATOM 2729 CD1 ILE A 160 16.078 -4.802 -8.562 1.00 0.42 C ATOM 0 H ILE A 160 14.006 -1.814 -7.089 1.00 0.33 H new ATOM 0 HA ILE A 160 16.042 -1.989 -5.167 1.00 0.34 H new ATOM 0 HB ILE A 160 16.489 -4.261 -6.148 1.00 0.38 H new ATOM 0 HG12 ILE A 160 14.176 -4.732 -7.587 1.00 0.40 H new ATOM 0 HG13 ILE A 160 14.719 -3.188 -8.214 1.00 0.40 H new ATOM 0 HG21 ILE A 160 14.331 -5.160 -5.332 1.00 0.43 H new ATOM 0 HG22 ILE A 160 14.962 -3.880 -4.268 1.00 0.43 H new ATOM 0 HG23 ILE A 160 13.636 -3.523 -5.400 1.00 0.43 H new ATOM 0 HD11 ILE A 160 15.638 -5.041 -9.530 1.00 0.42 H new ATOM 0 HD12 ILE A 160 16.943 -4.155 -8.706 1.00 0.42 H new ATOM 0 HD13 ILE A 160 16.392 -5.722 -8.069 1.00 0.42 H new ATOM 2741 N LYS A 161 17.024 -1.627 -8.301 1.00 0.34 N ATOM 2742 CA LYS A 161 18.163 -1.257 -9.133 1.00 0.35 C ATOM 2743 C LYS A 161 18.723 0.083 -8.664 1.00 0.34 C ATOM 2744 O LYS A 161 19.934 0.310 -8.678 1.00 0.37 O ATOM 2745 CB LYS A 161 17.738 -1.160 -10.596 1.00 0.41 C ATOM 2746 CG LYS A 161 17.511 -2.506 -11.263 1.00 0.78 C ATOM 2747 CD LYS A 161 16.441 -2.423 -12.344 1.00 1.43 C ATOM 2748 CE LYS A 161 16.737 -1.317 -13.345 1.00 1.61 C ATOM 2749 NZ LYS A 161 15.778 -1.313 -14.484 1.00 2.63 N ATOM 0 H LYS A 161 16.135 -1.676 -8.799 1.00 0.34 H new ATOM 0 HA LYS A 161 18.934 -2.023 -9.043 1.00 0.35 H new ATOM 0 HB2 LYS A 161 16.820 -0.575 -10.659 1.00 0.41 H new ATOM 0 HB3 LYS A 161 18.502 -0.615 -11.151 1.00 0.41 H new ATOM 0 HG2 LYS A 161 18.445 -2.858 -11.701 1.00 0.78 H new ATOM 0 HG3 LYS A 161 17.215 -3.239 -10.513 1.00 0.78 H new ATOM 0 HD2 LYS A 161 16.376 -3.378 -12.866 1.00 1.43 H new ATOM 0 HD3 LYS A 161 15.470 -2.245 -11.882 1.00 1.43 H new ATOM 0 HE2 LYS A 161 16.700 -0.352 -12.839 1.00 1.61 H new ATOM 0 HE3 LYS A 161 17.751 -1.438 -13.727 1.00 1.61 H new ATOM 0 HZ1 LYS A 161 16.231 -0.886 -15.317 1.00 2.63 H new ATOM 0 HZ2 LYS A 161 15.497 -2.290 -14.705 1.00 2.63 H new ATOM 0 HZ3 LYS A 161 14.936 -0.760 -14.227 1.00 2.63 H new ATOM 2763 N GLU A 162 17.817 0.966 -8.255 1.00 0.33 N ATOM 2764 CA GLU A 162 18.171 2.286 -7.751 1.00 0.35 C ATOM 2765 C GLU A 162 18.821 2.171 -6.367 1.00 0.34 C ATOM 2766 O GLU A 162 19.707 2.957 -6.024 1.00 0.37 O ATOM 2767 CB GLU A 162 16.906 3.154 -7.701 1.00 0.36 C ATOM 2768 CG GLU A 162 17.136 4.627 -7.411 1.00 0.66 C ATOM 2769 CD GLU A 162 17.826 5.371 -8.539 1.00 0.92 C ATOM 2770 OE1 GLU A 162 18.875 4.900 -9.027 1.00 1.62 O ATOM 2771 OE2 GLU A 162 17.317 6.437 -8.946 1.00 1.73 O ATOM 0 H GLU A 162 16.813 0.784 -8.264 1.00 0.33 H new ATOM 0 HA GLU A 162 18.897 2.755 -8.416 1.00 0.35 H new ATOM 0 HB2 GLU A 162 16.388 3.066 -8.656 1.00 0.36 H new ATOM 0 HB3 GLU A 162 16.240 2.751 -6.938 1.00 0.36 H new ATOM 0 HG2 GLU A 162 16.176 5.102 -7.208 1.00 0.66 H new ATOM 0 HG3 GLU A 162 17.736 4.721 -6.506 1.00 0.66 H new ATOM 2778 N LEU A 163 18.394 1.173 -5.591 1.00 0.32 N ATOM 2779 CA LEU A 163 18.929 0.937 -4.247 1.00 0.33 C ATOM 2780 C LEU A 163 20.244 0.164 -4.297 1.00 0.34 C ATOM 2781 O LEU A 163 21.065 0.257 -3.380 1.00 0.36 O ATOM 2782 CB LEU A 163 17.930 0.140 -3.396 1.00 0.33 C ATOM 2783 CG LEU A 163 16.653 0.876 -2.993 1.00 0.35 C ATOM 2784 CD1 LEU A 163 15.600 -0.114 -2.527 1.00 0.35 C ATOM 2785 CD2 LEU A 163 16.943 1.888 -1.900 1.00 0.46 C ATOM 0 H LEU A 163 17.673 0.509 -5.873 1.00 0.32 H new ATOM 0 HA LEU A 163 19.103 1.915 -3.799 1.00 0.33 H new ATOM 0 HB2 LEU A 163 17.649 -0.758 -3.947 1.00 0.33 H new ATOM 0 HB3 LEU A 163 18.437 -0.189 -2.489 1.00 0.33 H new ATOM 0 HG LEU A 163 16.272 1.409 -3.864 1.00 0.35 H new ATOM 0 HD11 LEU A 163 14.695 0.424 -2.243 1.00 0.35 H new ATOM 0 HD12 LEU A 163 15.371 -0.808 -3.335 1.00 0.35 H new ATOM 0 HD13 LEU A 163 15.977 -0.669 -1.668 1.00 0.35 H new ATOM 0 HD21 LEU A 163 16.022 2.402 -1.626 1.00 0.46 H new ATOM 0 HD22 LEU A 163 17.345 1.375 -1.027 1.00 0.46 H new ATOM 0 HD23 LEU A 163 17.671 2.615 -2.261 1.00 0.46 H new ATOM 2797 N GLY A 164 20.436 -0.603 -5.359 1.00 0.33 N ATOM 2798 CA GLY A 164 21.644 -1.381 -5.496 1.00 0.35 C ATOM 2799 C GLY A 164 21.491 -2.799 -4.970 1.00 0.37 C ATOM 2800 O GLY A 164 22.419 -3.344 -4.369 1.00 0.43 O ATOM 0 H GLY A 164 19.774 -0.699 -6.129 1.00 0.33 H new ATOM 0 HA2 GLY A 164 21.931 -1.417 -6.547 1.00 0.35 H new ATOM 0 HA3 GLY A 164 22.454 -0.885 -4.961 1.00 0.35 H new ATOM 2804 N PHE A 165 20.325 -3.400 -5.188 1.00 0.35 N ATOM 2805 CA PHE A 165 20.070 -4.762 -4.722 1.00 0.38 C ATOM 2806 C PHE A 165 19.429 -5.618 -5.805 1.00 0.41 C ATOM 2807 O PHE A 165 18.869 -5.103 -6.773 1.00 0.45 O ATOM 2808 CB PHE A 165 19.179 -4.748 -3.479 1.00 0.38 C ATOM 2809 CG PHE A 165 19.899 -4.296 -2.244 1.00 0.37 C ATOM 2810 CD1 PHE A 165 20.841 -5.111 -1.636 1.00 1.23 C ATOM 2811 CD2 PHE A 165 19.640 -3.055 -1.698 1.00 1.23 C ATOM 2812 CE1 PHE A 165 21.508 -4.698 -0.504 1.00 1.25 C ATOM 2813 CE2 PHE A 165 20.306 -2.632 -0.564 1.00 1.25 C ATOM 2814 CZ PHE A 165 21.241 -3.453 0.035 1.00 0.48 C ATOM 0 H PHE A 165 19.544 -2.969 -5.682 1.00 0.35 H new ATOM 0 HA PHE A 165 21.035 -5.202 -4.469 1.00 0.38 H new ATOM 0 HB2 PHE A 165 18.328 -4.091 -3.657 1.00 0.38 H new ATOM 0 HB3 PHE A 165 18.780 -5.749 -3.314 1.00 0.38 H new ATOM 0 HD1 PHE A 165 21.055 -6.083 -2.056 1.00 1.23 H new ATOM 0 HD2 PHE A 165 18.910 -2.409 -2.162 1.00 1.23 H new ATOM 0 HE1 PHE A 165 22.237 -5.345 -0.039 1.00 1.25 H new ATOM 0 HE2 PHE A 165 20.095 -1.659 -0.146 1.00 1.25 H new ATOM 0 HZ PHE A 165 21.762 -3.124 0.922 1.00 0.48 H new ATOM 2824 N THR A 166 19.521 -6.929 -5.627 1.00 0.47 N ATOM 2825 CA THR A 166 18.958 -7.886 -6.572 1.00 0.52 C ATOM 2826 C THR A 166 17.505 -8.201 -6.222 1.00 0.51 C ATOM 2827 O THR A 166 17.205 -8.568 -5.083 1.00 0.51 O ATOM 2828 CB THR A 166 19.764 -9.200 -6.557 1.00 0.61 C ATOM 2829 OG1 THR A 166 19.800 -9.723 -5.221 1.00 1.46 O ATOM 2830 CG2 THR A 166 21.183 -8.976 -7.055 1.00 1.43 C ATOM 0 H THR A 166 19.986 -7.359 -4.827 1.00 0.47 H new ATOM 0 HA THR A 166 19.005 -7.436 -7.564 1.00 0.52 H new ATOM 0 HB THR A 166 19.276 -9.912 -7.222 1.00 0.61 H new ATOM 0 HG1 THR A 166 19.022 -9.398 -4.722 1.00 1.46 H new ATOM 0 HG21 THR A 166 21.729 -9.919 -7.034 1.00 1.43 H new ATOM 0 HG22 THR A 166 21.154 -8.596 -8.076 1.00 1.43 H new ATOM 0 HG23 THR A 166 21.684 -8.252 -6.412 1.00 1.43 H new ATOM 2838 N TYR A 167 16.614 -8.075 -7.201 1.00 0.55 N ATOM 2839 CA TYR A 167 15.199 -8.349 -6.983 1.00 0.57 C ATOM 2840 C TYR A 167 14.934 -9.847 -6.951 1.00 0.57 C ATOM 2841 O TYR A 167 15.293 -10.573 -7.882 1.00 0.67 O ATOM 2842 CB TYR A 167 14.344 -7.708 -8.076 1.00 0.68 C ATOM 2843 CG TYR A 167 12.856 -7.743 -7.795 1.00 0.74 C ATOM 2844 CD1 TYR A 167 12.297 -6.927 -6.819 1.00 1.43 C ATOM 2845 CD2 TYR A 167 12.010 -8.582 -8.513 1.00 1.41 C ATOM 2846 CE1 TYR A 167 10.935 -6.947 -6.566 1.00 1.49 C ATOM 2847 CE2 TYR A 167 10.650 -8.608 -8.265 1.00 1.49 C ATOM 2848 CZ TYR A 167 10.117 -7.789 -7.294 1.00 0.95 C ATOM 2849 OH TYR A 167 8.759 -7.807 -7.052 1.00 1.08 O ATOM 0 H TYR A 167 16.847 -7.785 -8.151 1.00 0.55 H new ATOM 0 HA TYR A 167 14.928 -7.918 -6.019 1.00 0.57 H new ATOM 0 HB2 TYR A 167 14.655 -6.671 -8.205 1.00 0.68 H new ATOM 0 HB3 TYR A 167 14.537 -8.218 -9.020 1.00 0.68 H new ATOM 0 HD1 TYR A 167 12.934 -6.267 -6.249 1.00 1.43 H new ATOM 0 HD2 TYR A 167 12.423 -9.224 -9.277 1.00 1.41 H new ATOM 0 HE1 TYR A 167 10.515 -6.308 -5.804 1.00 1.49 H new ATOM 0 HE2 TYR A 167 10.008 -9.268 -8.830 1.00 1.49 H new ATOM 0 HH TYR A 167 8.368 -6.948 -7.316 1.00 1.08 H new ATOM 2859 N ARG A 168 14.314 -10.293 -5.877 1.00 0.58 N ATOM 2860 CA ARG A 168 13.968 -11.698 -5.703 1.00 0.64 C ATOM 2861 C ARG A 168 12.454 -11.827 -5.644 1.00 0.61 C ATOM 2862 O ARG A 168 11.755 -10.823 -5.521 1.00 0.65 O ATOM 2863 CB ARG A 168 14.580 -12.257 -4.412 1.00 0.78 C ATOM 2864 CG ARG A 168 16.092 -12.140 -4.332 1.00 1.05 C ATOM 2865 CD ARG A 168 16.783 -13.066 -5.319 1.00 1.59 C ATOM 2866 NE ARG A 168 18.232 -13.117 -5.094 1.00 2.25 N ATOM 2867 CZ ARG A 168 19.120 -13.466 -6.021 1.00 3.01 C ATOM 2868 NH1 ARG A 168 18.723 -13.799 -7.242 1.00 3.43 N ATOM 2869 NH2 ARG A 168 20.411 -13.481 -5.726 1.00 3.74 N ATOM 0 H ARG A 168 14.034 -9.696 -5.099 1.00 0.58 H new ATOM 0 HA ARG A 168 14.365 -12.267 -6.544 1.00 0.64 H new ATOM 0 HB2 ARG A 168 14.142 -11.735 -3.561 1.00 0.78 H new ATOM 0 HB3 ARG A 168 14.304 -13.307 -4.318 1.00 0.78 H new ATOM 0 HG2 ARG A 168 16.388 -11.110 -4.532 1.00 1.05 H new ATOM 0 HG3 ARG A 168 16.422 -12.376 -3.320 1.00 1.05 H new ATOM 0 HD2 ARG A 168 16.366 -14.069 -5.230 1.00 1.59 H new ATOM 0 HD3 ARG A 168 16.585 -12.727 -6.336 1.00 1.59 H new ATOM 0 HE ARG A 168 18.581 -12.869 -4.168 1.00 2.25 H new ATOM 0 HH11 ARG A 168 17.730 -13.789 -7.476 1.00 3.43 H new ATOM 0 HH12 ARG A 168 19.410 -14.065 -7.947 1.00 3.43 H new ATOM 0 HH21 ARG A 168 20.723 -13.225 -4.789 1.00 3.74 H new ATOM 0 HH22 ARG A 168 21.093 -13.748 -6.436 1.00 3.74 H new ATOM 2883 N ILE A 169 11.939 -13.046 -5.736 1.00 0.63 N ATOM 2884 CA ILE A 169 10.504 -13.248 -5.673 1.00 0.61 C ATOM 2885 C ILE A 169 10.063 -13.444 -4.221 1.00 0.59 C ATOM 2886 O ILE A 169 10.596 -14.292 -3.505 1.00 0.56 O ATOM 2887 CB ILE A 169 10.044 -14.445 -6.540 1.00 0.63 C ATOM 2888 CG1 ILE A 169 10.637 -15.763 -6.029 1.00 0.61 C ATOM 2889 CG2 ILE A 169 10.429 -14.217 -7.997 1.00 0.71 C ATOM 2890 CD1 ILE A 169 10.219 -16.974 -6.834 1.00 0.67 C ATOM 0 H ILE A 169 12.488 -13.898 -5.853 1.00 0.63 H new ATOM 0 HA ILE A 169 10.030 -12.354 -6.078 1.00 0.61 H new ATOM 0 HB ILE A 169 8.959 -14.518 -6.468 1.00 0.63 H new ATOM 0 HG12 ILE A 169 11.724 -15.689 -6.039 1.00 0.61 H new ATOM 0 HG13 ILE A 169 10.337 -15.907 -4.991 1.00 0.61 H new ATOM 0 HG21 ILE A 169 10.100 -15.065 -8.597 1.00 0.71 H new ATOM 0 HG22 ILE A 169 9.951 -13.308 -8.362 1.00 0.71 H new ATOM 0 HG23 ILE A 169 11.511 -14.115 -8.076 1.00 0.71 H new ATOM 0 HD11 ILE A 169 10.678 -17.868 -6.412 1.00 0.67 H new ATOM 0 HD12 ILE A 169 9.134 -17.075 -6.803 1.00 0.67 H new ATOM 0 HD13 ILE A 169 10.543 -16.853 -7.868 1.00 0.67 H new ATOM 2902 N PRO A 170 9.070 -12.665 -3.770 1.00 0.65 N ATOM 2903 CA PRO A 170 8.571 -12.739 -2.393 1.00 0.69 C ATOM 2904 C PRO A 170 7.904 -14.074 -2.082 1.00 0.63 C ATOM 2905 O PRO A 170 7.706 -14.435 -0.920 1.00 0.66 O ATOM 2906 CB PRO A 170 7.548 -11.603 -2.325 1.00 0.83 C ATOM 2907 CG PRO A 170 7.137 -11.361 -3.733 1.00 0.83 C ATOM 2908 CD PRO A 170 8.351 -11.653 -4.566 1.00 0.76 C ATOM 0 HA PRO A 170 9.378 -12.652 -1.665 1.00 0.69 H new ATOM 0 HB2 PRO A 170 6.693 -11.880 -1.708 1.00 0.83 H new ATOM 0 HB3 PRO A 170 7.984 -10.707 -1.883 1.00 0.83 H new ATOM 0 HG2 PRO A 170 6.305 -12.006 -4.014 1.00 0.83 H new ATOM 0 HG3 PRO A 170 6.804 -10.332 -3.873 1.00 0.83 H new ATOM 0 HD2 PRO A 170 8.081 -12.033 -5.551 1.00 0.76 H new ATOM 0 HD3 PRO A 170 8.956 -10.760 -4.723 1.00 0.76 H new ATOM 2916 N LYS A 171 7.576 -14.804 -3.134 1.00 0.62 N ATOM 2917 CA LYS A 171 6.924 -16.097 -3.015 1.00 0.63 C ATOM 2918 C LYS A 171 7.804 -17.097 -2.282 1.00 0.63 C ATOM 2919 O LYS A 171 7.320 -17.893 -1.481 1.00 0.73 O ATOM 2920 CB LYS A 171 6.592 -16.619 -4.407 1.00 0.65 C ATOM 2921 CG LYS A 171 5.428 -15.894 -5.054 1.00 0.76 C ATOM 2922 CD LYS A 171 5.741 -15.515 -6.491 1.00 0.79 C ATOM 2923 CE LYS A 171 5.926 -16.743 -7.363 1.00 0.81 C ATOM 2924 NZ LYS A 171 4.670 -17.525 -7.505 1.00 1.03 N ATOM 0 H LYS A 171 7.754 -14.517 -4.096 1.00 0.62 H new ATOM 0 HA LYS A 171 6.010 -15.972 -2.435 1.00 0.63 H new ATOM 0 HB2 LYS A 171 7.471 -16.522 -5.044 1.00 0.65 H new ATOM 0 HB3 LYS A 171 6.360 -17.682 -4.344 1.00 0.65 H new ATOM 0 HG2 LYS A 171 4.542 -16.529 -5.028 1.00 0.76 H new ATOM 0 HG3 LYS A 171 5.193 -14.996 -4.482 1.00 0.76 H new ATOM 0 HD2 LYS A 171 4.933 -14.902 -6.891 1.00 0.79 H new ATOM 0 HD3 LYS A 171 6.646 -14.908 -6.519 1.00 0.79 H new ATOM 0 HE2 LYS A 171 6.275 -16.437 -8.349 1.00 0.81 H new ATOM 0 HE3 LYS A 171 6.701 -17.378 -6.934 1.00 0.81 H new ATOM 0 HZ1 LYS A 171 4.614 -17.921 -8.465 1.00 1.03 H new ATOM 0 HZ2 LYS A 171 4.662 -18.299 -6.810 1.00 1.03 H new ATOM 0 HZ3 LYS A 171 3.853 -16.903 -7.339 1.00 1.03 H new ATOM 2938 N LYS A 172 9.099 -17.029 -2.548 1.00 0.59 N ATOM 2939 CA LYS A 172 10.055 -17.940 -1.939 1.00 0.66 C ATOM 2940 C LYS A 172 10.736 -17.306 -0.724 1.00 0.70 C ATOM 2941 O LYS A 172 11.712 -17.852 -0.207 1.00 0.80 O ATOM 2942 CB LYS A 172 11.094 -18.373 -2.977 1.00 0.70 C ATOM 2943 CG LYS A 172 10.726 -19.644 -3.726 1.00 0.77 C ATOM 2944 CD LYS A 172 9.321 -19.577 -4.313 1.00 0.71 C ATOM 2945 CE LYS A 172 9.040 -20.759 -5.223 1.00 0.82 C ATOM 2946 NZ LYS A 172 9.130 -22.057 -4.502 1.00 1.16 N ATOM 0 H LYS A 172 9.514 -16.349 -3.185 1.00 0.59 H new ATOM 0 HA LYS A 172 9.514 -18.819 -1.588 1.00 0.66 H new ATOM 0 HB2 LYS A 172 11.232 -17.566 -3.697 1.00 0.70 H new ATOM 0 HB3 LYS A 172 12.051 -18.522 -2.478 1.00 0.70 H new ATOM 0 HG2 LYS A 172 11.445 -19.813 -4.527 1.00 0.77 H new ATOM 0 HG3 LYS A 172 10.796 -20.496 -3.050 1.00 0.77 H new ATOM 0 HD2 LYS A 172 8.589 -19.556 -3.506 1.00 0.71 H new ATOM 0 HD3 LYS A 172 9.204 -18.649 -4.873 1.00 0.71 H new ATOM 0 HE2 LYS A 172 8.045 -20.654 -5.656 1.00 0.82 H new ATOM 0 HE3 LYS A 172 9.749 -20.755 -6.051 1.00 0.82 H new ATOM 0 HZ1 LYS A 172 8.832 -22.827 -5.135 1.00 1.16 H new ATOM 0 HZ2 LYS A 172 10.112 -22.218 -4.198 1.00 1.16 H new ATOM 0 HZ3 LYS A 172 8.509 -22.035 -3.668 1.00 1.16 H new ATOM 2960 N ARG A 173 10.189 -16.171 -0.261 1.00 0.68 N ATOM 2961 CA ARG A 173 10.714 -15.443 0.909 1.00 0.76 C ATOM 2962 C ARG A 173 12.101 -14.844 0.654 1.00 0.61 C ATOM 2963 O ARG A 173 13.040 -15.557 0.295 1.00 0.97 O ATOM 2964 CB ARG A 173 10.763 -16.341 2.153 1.00 1.36 C ATOM 2965 CG ARG A 173 9.395 -16.740 2.693 1.00 1.98 C ATOM 2966 CD ARG A 173 8.904 -18.049 2.090 1.00 2.47 C ATOM 2967 NE ARG A 173 9.901 -19.114 2.197 1.00 2.99 N ATOM 2968 CZ ARG A 173 9.775 -20.187 2.978 1.00 3.79 C ATOM 2969 NH1 ARG A 173 8.698 -20.342 3.734 1.00 4.07 N ATOM 2970 NH2 ARG A 173 10.734 -21.101 3.004 1.00 4.60 N ATOM 0 H ARG A 173 9.372 -15.731 -0.685 1.00 0.68 H new ATOM 0 HA ARG A 173 10.020 -14.622 1.087 1.00 0.76 H new ATOM 0 HB2 ARG A 173 11.323 -17.245 1.913 1.00 1.36 H new ATOM 0 HB3 ARG A 173 11.314 -15.824 2.939 1.00 1.36 H new ATOM 0 HG2 ARG A 173 9.448 -16.837 3.777 1.00 1.98 H new ATOM 0 HG3 ARG A 173 8.676 -15.950 2.478 1.00 1.98 H new ATOM 0 HD2 ARG A 173 7.988 -18.359 2.594 1.00 2.47 H new ATOM 0 HD3 ARG A 173 8.653 -17.892 1.041 1.00 2.47 H new ATOM 0 HE ARG A 173 10.749 -19.030 1.637 1.00 2.99 H new ATOM 0 HH11 ARG A 173 7.960 -19.638 3.720 1.00 4.07 H new ATOM 0 HH12 ARG A 173 8.607 -21.165 4.330 1.00 4.07 H new ATOM 0 HH21 ARG A 173 11.567 -20.983 2.427 1.00 4.60 H new ATOM 0 HH22 ARG A 173 10.639 -21.923 3.601 1.00 4.60 H new ATOM 2984 N LEU A 174 12.218 -13.533 0.892 1.00 0.60 N ATOM 2985 CA LEU A 174 13.465 -12.797 0.701 1.00 1.13 C ATOM 2986 C LEU A 174 14.007 -12.975 -0.714 1.00 1.70 C ATOM 2987 O LEU A 174 15.247 -13.012 -0.880 1.00 2.14 O ATOM 2988 CB LEU A 174 14.506 -13.242 1.728 1.00 1.32 C ATOM 2989 CG LEU A 174 14.342 -12.643 3.130 1.00 1.64 C ATOM 2990 CD1 LEU A 174 13.681 -13.645 4.061 1.00 1.79 C ATOM 2991 CD2 LEU A 174 15.688 -12.204 3.683 1.00 2.09 C ATOM 2992 OXT LEU A 174 13.191 -13.089 -1.648 1.00 2.37 O ATOM 0 H LEU A 174 11.446 -12.954 1.223 1.00 0.60 H new ATOM 0 HA LEU A 174 13.253 -11.738 0.846 1.00 1.13 H new ATOM 0 HB2 LEU A 174 14.471 -14.328 1.809 1.00 1.32 H new ATOM 0 HB3 LEU A 174 15.496 -12.982 1.353 1.00 1.32 H new ATOM 0 HG LEU A 174 13.700 -11.765 3.058 1.00 1.64 H new ATOM 0 HD11 LEU A 174 13.572 -13.204 5.052 1.00 1.79 H new ATOM 0 HD12 LEU A 174 12.698 -13.910 3.672 1.00 1.79 H new ATOM 0 HD13 LEU A 174 14.298 -14.541 4.128 1.00 1.79 H new ATOM 0 HD21 LEU A 174 15.552 -11.781 4.679 1.00 2.09 H new ATOM 0 HD22 LEU A 174 16.355 -13.064 3.742 1.00 2.09 H new ATOM 0 HD23 LEU A 174 16.123 -11.451 3.026 1.00 2.09 H new TER 3004 LEU A 174 HETATM 3005 PG DGT A 201 -1.227 -10.479 6.601 1.00 0.85 P HETATM 3006 O1G DGT A 201 -0.567 -10.813 7.882 1.00 1.15 O HETATM 3007 O2G DGT A 201 -1.919 -11.537 5.839 1.00 0.98 O HETATM 3008 O3G DGT A 201 -2.348 -9.359 6.891 1.00 0.86 O HETATM 3009 O3B DGT A 201 -0.215 -9.656 5.657 1.00 0.69 O HETATM 3010 PB DGT A 201 -0.968 -8.803 4.518 1.00 0.61 P HETATM 3011 O1B DGT A 201 -0.153 -8.898 3.284 1.00 0.78 O HETATM 3012 O2B DGT A 201 -2.393 -9.190 4.468 1.00 0.74 O HETATM 3013 O3A DGT A 201 -0.902 -7.296 5.071 1.00 0.74 O HETATM 3014 PA DGT A 201 -0.245 -6.035 4.318 1.00 0.89 P HETATM 3015 O1A DGT A 201 -0.618 -4.897 5.192 1.00 1.28 O HETATM 3016 O2A DGT A 201 -0.730 -6.034 2.920 1.00 1.02 O HETATM 3017 O5' DGT A 201 1.364 -6.067 4.245 1.00 0.79 O HETATM 3018 C5' DGT A 201 2.184 -7.167 3.822 1.00 0.62 C HETATM 3019 C4' DGT A 201 3.568 -6.541 4.007 1.00 0.68 C HETATM 3020 O4' DGT A 201 3.359 -5.140 4.241 1.00 0.83 O HETATM 3021 C3' DGT A 201 4.342 -7.062 5.202 1.00 0.97 C HETATM 3022 O3' DGT A 201 5.710 -7.258 4.823 1.00 1.76 O HETATM 3023 C2' DGT A 201 4.189 -5.974 6.257 1.00 0.89 C HETATM 3024 C1' DGT A 201 4.158 -4.742 5.369 1.00 0.56 C HETATM 3025 N9 DGT A 201 3.506 -3.604 6.059 1.00 0.59 N HETATM 3026 C8 DGT A 201 4.050 -2.438 6.395 1.00 0.56 C HETATM 3027 N7 DGT A 201 3.402 -1.985 7.464 1.00 0.55 N HETATM 3028 C5 DGT A 201 2.456 -2.859 7.783 1.00 0.57 C HETATM 3029 C6 DGT A 201 1.773 -3.023 8.912 1.00 0.67 C HETATM 3030 O6 DGT A 201 1.946 -2.247 9.850 1.00 0.79 O HETATM 3031 N1 DGT A 201 1.030 -4.193 9.109 1.00 0.80 N HETATM 3032 C2 DGT A 201 0.979 -5.131 8.072 1.00 0.79 C HETATM 3033 N2 DGT A 201 0.433 -6.328 8.248 1.00 0.98 N HETATM 3034 N3 DGT A 201 1.670 -4.886 6.949 1.00 0.76 N HETATM 3035 C4 DGT A 201 2.453 -3.806 6.846 1.00 0.64 C HETATM 0 HO3' DGT A 201 5.756 -7.898 4.082 1.00 1.76 H new HETATM 0 HN2A DGT A 201 0.407 -6.995 7.477 1.00 0.98 H new HETATM 0 H5'A DGT A 201 2.041 -8.056 4.437 1.00 0.62 H new HETATM 0 H2'A DGT A 201 3.277 -6.088 6.843 1.00 0.89 H new HETATM 0 HN2 DGT A 201 0.039 -6.581 9.154 1.00 0.98 H new HETATM 0 H8 DGT A 201 4.877 -1.943 5.886 1.00 0.56 H new HETATM 0 H5' DGT A 201 1.992 -7.459 2.790 1.00 0.62 H new HETATM 0 H4' DGT A 201 4.147 -6.781 3.115 1.00 0.68 H new HETATM 0 H3' DGT A 201 3.984 -8.021 5.577 1.00 0.97 H new HETATM 0 H2' DGT A 201 5.020 -5.958 6.962 1.00 0.89 H new HETATM 0 H16 DGT A 201 0.538 -4.358 9.987 1.00 0.80 H new HETATM 0 H1' DGT A 201 5.161 -4.413 5.095 1.00 0.56 H new HETATM 3048 MG MG A 202 -3.039 -4.824 6.454 1.00 0.47 MG HETATM 3049 MG MG A 203 -3.228 -8.692 6.188 1.00 0.82 MG