USER MOD reduce.3.24.130724 H: found=0, std=0, add=1584, rem=0, adj=37 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 Single : A 1 MET CE :methyl -143:sc= 0 (180deg=-1.38) USER MOD Single : A 1 MET N :NH3+ -175:sc= 0.588 (180deg=0.57) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.0115 USER MOD Single : A 6 GLN : amide:sc= -0.517 X(o=-0.52,f=-0.21) USER MOD Single : A 8 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00554) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= 0.377 K(o=0.38,f=-6.1!) USER MOD Single : A 13 HIS : no HD1:sc= 0.425 K(o=0.43,f=-3.5!) USER MOD Single : A 16 SER OG : rot -9:sc= 0.721 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= -0.163 K(o=-0.16,f=-1.9!) USER MOD Single : A 25 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0.16 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= -2.04 K(o=-2,f=-0.091) USER MOD Single : A 39 SER OG : rot 180:sc=0.000523 USER MOD Single : A 45 LYS NZ :NH3+ 133:sc= 1.07 (180deg=0.0984) USER MOD Single : A 46 MET CE :methyl 167:sc= -0.103 (180deg=-0.589) USER MOD Single : A 48 ASN : amide:sc= -0.0326 K(o=-0.033,f=-3!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -110:sc= 0.594 (180deg=-0.0611) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -1.95 X(o=-1.9,f=-2.1) USER MOD Single : A 68 ASN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 73:sc= 1.22 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0884) USER MOD Single : A 81 CYS SG : rot 180:sc= -0.0151 USER MOD Single : A 85 LYS NZ :NH3+ 166:sc= 1.49 (180deg=1.22) USER MOD Single : A 86 CYS SG : rot 0:sc= 0.0586 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 52:sc= 0.319 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.0162 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 TYR OH : rot -69:sc= -1.89 USER MOD Single : A 115 HIS : no HE2:sc= -5.49! C(o=-5.5!,f=-4.9!) USER MOD Single : A 117 THR OG1 : rot 49:sc= 0.844 USER MOD Single : A 121 SER OG : rot 180:sc= 0.0264 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 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 134 ASN : amide:sc= -0.034 K(o=-0.034,f=-0.73) 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= 0.859 K(o=0.86,f=-0.16!) USER MOD Single : A 139 GLN : amide:sc= 1.22 K(o=1.2,f=-0.15) 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 145 ASN : amide:sc= 0 K(o=0,f=-2) USER MOD Single : A 146 GLN : amide:sc= -0.729 K(o=-0.73,f=-0.12) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.298) USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0273) USER MOD Single : A 161 LYS NZ :NH3+ 144:sc= 0.27 (180deg=-0.165) USER MOD Single : A 166 THR OG1 : rot 180:sc= 0.0248 USER MOD Single : A 167 TYR OH : rot 180:sc= 0 USER MOD Single : A 171 LYS NZ :NH3+ -146:sc= 1.27 (180deg=-0.502) USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 201 DGT O3' : rot -135:sc= -1.36 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.994 -15.736 6.379 1.00 1.61 N ATOM 2 CA MET A 1 -10.300 -15.057 6.233 1.00 0.85 C ATOM 3 C MET A 1 -10.750 -15.077 4.777 1.00 0.76 C ATOM 4 O MET A 1 -11.762 -15.687 4.440 1.00 0.95 O ATOM 5 CB MET A 1 -10.210 -13.612 6.735 1.00 1.35 C ATOM 6 CG MET A 1 -11.546 -12.888 6.757 1.00 2.03 C ATOM 7 SD MET A 1 -12.845 -13.858 7.546 1.00 2.69 S ATOM 8 CE MET A 1 -14.257 -12.786 7.302 1.00 3.45 C ATOM 0 H1 MET A 1 -8.741 -15.789 7.386 1.00 1.61 H new ATOM 0 H2 MET A 1 -9.057 -16.697 5.987 1.00 1.61 H new ATOM 0 H3 MET A 1 -8.265 -15.200 5.867 1.00 1.61 H new ATOM 0 HA MET A 1 -11.035 -15.592 6.834 1.00 0.85 H new ATOM 0 HB2 MET A 1 -9.790 -13.612 7.741 1.00 1.35 H new ATOM 0 HB3 MET A 1 -9.518 -13.059 6.100 1.00 1.35 H new ATOM 0 HG2 MET A 1 -11.433 -11.941 7.284 1.00 2.03 H new ATOM 0 HG3 MET A 1 -11.844 -12.651 5.736 1.00 2.03 H new ATOM 0 HE1 MET A 1 -14.904 -12.832 8.178 1.00 3.45 H new ATOM 0 HE2 MET A 1 -13.915 -11.761 7.156 1.00 3.45 H new ATOM 0 HE3 MET A 1 -14.813 -13.111 6.423 1.00 3.45 H new ATOM 20 N LEU A 2 -9.989 -14.415 3.918 1.00 0.61 N ATOM 21 CA LEU A 2 -10.310 -14.360 2.502 1.00 0.57 C ATOM 22 C LEU A 2 -9.342 -15.221 1.709 1.00 0.52 C ATOM 23 O LEU A 2 -8.254 -15.544 2.184 1.00 0.60 O ATOM 24 CB LEU A 2 -10.241 -12.920 1.994 1.00 0.59 C ATOM 25 CG LEU A 2 -10.996 -11.894 2.837 1.00 0.64 C ATOM 26 CD1 LEU A 2 -10.025 -11.065 3.664 1.00 1.05 C ATOM 27 CD2 LEU A 2 -11.838 -11.000 1.942 1.00 0.96 C ATOM 0 H LEU A 2 -9.143 -13.908 4.179 1.00 0.61 H new ATOM 0 HA LEU A 2 -11.323 -14.738 2.367 1.00 0.57 H new ATOM 0 HB2 LEU A 2 -9.194 -12.621 1.939 1.00 0.59 H new ATOM 0 HB3 LEU A 2 -10.634 -12.891 0.978 1.00 0.59 H new ATOM 0 HG LEU A 2 -11.659 -12.423 3.521 1.00 0.64 H new ATOM 0 HD11 LEU A 2 -10.581 -10.339 4.258 1.00 1.05 H new ATOM 0 HD12 LEU A 2 -9.460 -11.720 4.327 1.00 1.05 H new ATOM 0 HD13 LEU A 2 -9.338 -10.540 3.000 1.00 1.05 H new ATOM 0 HD21 LEU A 2 -12.372 -10.272 2.553 1.00 0.96 H new ATOM 0 HD22 LEU A 2 -11.191 -10.477 1.238 1.00 0.96 H new ATOM 0 HD23 LEU A 2 -12.556 -11.608 1.392 1.00 0.96 H new ATOM 39 N THR A 3 -9.730 -15.567 0.498 1.00 0.46 N ATOM 40 CA THR A 3 -8.900 -16.380 -0.371 1.00 0.42 C ATOM 41 C THR A 3 -8.412 -15.529 -1.531 1.00 0.39 C ATOM 42 O THR A 3 -8.920 -14.421 -1.729 1.00 0.40 O ATOM 43 CB THR A 3 -9.687 -17.584 -0.914 1.00 0.44 C ATOM 44 OG1 THR A 3 -11.083 -17.259 -0.976 1.00 0.51 O ATOM 45 CG2 THR A 3 -9.480 -18.806 -0.034 1.00 0.52 C ATOM 0 H THR A 3 -10.624 -15.295 0.089 1.00 0.46 H new ATOM 0 HA THR A 3 -8.053 -16.755 0.204 1.00 0.42 H new ATOM 0 HB THR A 3 -9.321 -17.816 -1.914 1.00 0.44 H new ATOM 0 HG1 THR A 3 -11.583 -18.027 -1.324 1.00 0.51 H new ATOM 0 HG21 THR A 3 -10.046 -19.645 -0.438 1.00 0.52 H new ATOM 0 HG22 THR A 3 -8.421 -19.061 -0.009 1.00 0.52 H new ATOM 0 HG23 THR A 3 -9.824 -18.589 0.977 1.00 0.52 H new ATOM 53 N LEU A 4 -7.428 -16.026 -2.275 1.00 0.39 N ATOM 54 CA LEU A 4 -6.882 -15.308 -3.429 1.00 0.40 C ATOM 55 C LEU A 4 -7.999 -14.824 -4.362 1.00 0.39 C ATOM 56 O LEU A 4 -8.040 -13.652 -4.736 1.00 0.41 O ATOM 57 CB LEU A 4 -5.911 -16.229 -4.186 1.00 0.43 C ATOM 58 CG LEU A 4 -4.822 -15.545 -5.028 1.00 0.63 C ATOM 59 CD1 LEU A 4 -5.410 -14.896 -6.271 1.00 1.14 C ATOM 60 CD2 LEU A 4 -4.053 -14.519 -4.206 1.00 1.69 C ATOM 0 H LEU A 4 -6.988 -16.929 -2.100 1.00 0.39 H new ATOM 0 HA LEU A 4 -6.347 -14.427 -3.073 1.00 0.40 H new ATOM 0 HB2 LEU A 4 -5.422 -16.877 -3.459 1.00 0.43 H new ATOM 0 HB3 LEU A 4 -6.496 -16.872 -4.844 1.00 0.43 H new ATOM 0 HG LEU A 4 -4.125 -16.320 -5.347 1.00 0.63 H new ATOM 0 HD11 LEU A 4 -4.614 -14.421 -6.845 1.00 1.14 H new ATOM 0 HD12 LEU A 4 -5.895 -15.656 -6.884 1.00 1.14 H new ATOM 0 HD13 LEU A 4 -6.143 -14.145 -5.977 1.00 1.14 H new ATOM 0 HD21 LEU A 4 -3.290 -14.052 -4.829 1.00 1.69 H new ATOM 0 HD22 LEU A 4 -4.740 -13.756 -3.841 1.00 1.69 H new ATOM 0 HD23 LEU A 4 -3.578 -15.014 -3.359 1.00 1.69 H new ATOM 72 N ILE A 5 -8.914 -15.724 -4.709 1.00 0.40 N ATOM 73 CA ILE A 5 -10.015 -15.383 -5.604 1.00 0.42 C ATOM 74 C ILE A 5 -10.964 -14.358 -4.974 1.00 0.40 C ATOM 75 O ILE A 5 -11.322 -13.363 -5.607 1.00 0.40 O ATOM 76 CB ILE A 5 -10.805 -16.651 -6.020 1.00 0.48 C ATOM 77 CG1 ILE A 5 -12.037 -16.283 -6.845 1.00 1.32 C ATOM 78 CG2 ILE A 5 -11.215 -17.460 -4.797 1.00 1.22 C ATOM 79 CD1 ILE A 5 -11.720 -15.450 -8.062 1.00 1.94 C ATOM 0 H ILE A 5 -8.915 -16.691 -4.386 1.00 0.40 H new ATOM 0 HA ILE A 5 -9.575 -14.933 -6.494 1.00 0.42 H new ATOM 0 HB ILE A 5 -10.147 -17.263 -6.637 1.00 0.48 H new ATOM 0 HG12 ILE A 5 -12.539 -17.197 -7.161 1.00 1.32 H new ATOM 0 HG13 ILE A 5 -12.738 -15.737 -6.213 1.00 1.32 H new ATOM 0 HG21 ILE A 5 -11.768 -18.344 -5.114 1.00 1.22 H new ATOM 0 HG22 ILE A 5 -10.325 -17.766 -4.248 1.00 1.22 H new ATOM 0 HG23 ILE A 5 -11.847 -16.849 -4.152 1.00 1.22 H new ATOM 0 HD11 ILE A 5 -12.641 -15.226 -8.600 1.00 1.94 H new ATOM 0 HD12 ILE A 5 -11.245 -14.519 -7.752 1.00 1.94 H new ATOM 0 HD13 ILE A 5 -11.044 -16.002 -8.715 1.00 1.94 H new ATOM 91 N GLN A 6 -11.349 -14.594 -3.728 1.00 0.38 N ATOM 92 CA GLN A 6 -12.256 -13.697 -3.018 1.00 0.38 C ATOM 93 C GLN A 6 -11.663 -12.301 -2.925 1.00 0.36 C ATOM 94 O GLN A 6 -12.315 -11.319 -3.273 1.00 0.37 O ATOM 95 CB GLN A 6 -12.538 -14.230 -1.613 1.00 0.40 C ATOM 96 CG GLN A 6 -13.840 -13.729 -1.007 1.00 0.77 C ATOM 97 CD GLN A 6 -15.046 -14.187 -1.793 1.00 0.81 C ATOM 98 OE1 GLN A 6 -15.551 -15.287 -1.592 1.00 1.38 O ATOM 99 NE2 GLN A 6 -15.517 -13.349 -2.695 1.00 0.99 N ATOM 0 H GLN A 6 -11.047 -15.402 -3.184 1.00 0.38 H new ATOM 0 HA GLN A 6 -13.191 -13.647 -3.576 1.00 0.38 H new ATOM 0 HB2 GLN A 6 -12.562 -15.319 -1.647 1.00 0.40 H new ATOM 0 HB3 GLN A 6 -11.713 -13.950 -0.958 1.00 0.40 H new ATOM 0 HG2 GLN A 6 -13.921 -14.084 0.020 1.00 0.77 H new ATOM 0 HG3 GLN A 6 -13.826 -12.640 -0.968 1.00 0.77 H new ATOM 0 HE21 GLN A 6 -15.069 -12.443 -2.833 1.00 0.99 H new ATOM 0 HE22 GLN A 6 -16.329 -13.607 -3.255 1.00 0.99 H new ATOM 108 N GLY A 7 -10.424 -12.238 -2.454 1.00 0.35 N ATOM 109 CA GLY A 7 -9.735 -10.967 -2.329 1.00 0.34 C ATOM 110 C GLY A 7 -9.682 -10.222 -3.645 1.00 0.33 C ATOM 111 O GLY A 7 -9.971 -9.029 -3.701 1.00 0.33 O ATOM 0 H GLY A 7 -9.881 -13.048 -2.155 1.00 0.35 H new ATOM 0 HA2 GLY A 7 -10.240 -10.352 -1.584 1.00 0.34 H new ATOM 0 HA3 GLY A 7 -8.721 -11.138 -1.967 1.00 0.34 H new ATOM 115 N LYS A 8 -9.361 -10.942 -4.708 1.00 0.35 N ATOM 116 CA LYS A 8 -9.270 -10.354 -6.037 1.00 0.38 C ATOM 117 C LYS A 8 -10.634 -9.839 -6.499 1.00 0.38 C ATOM 118 O LYS A 8 -10.739 -8.741 -7.047 1.00 0.38 O ATOM 119 CB LYS A 8 -8.718 -11.387 -7.030 1.00 0.44 C ATOM 120 CG LYS A 8 -8.918 -11.011 -8.497 1.00 0.76 C ATOM 121 CD LYS A 8 -8.273 -9.674 -8.845 1.00 0.74 C ATOM 122 CE LYS A 8 -7.594 -9.720 -10.208 1.00 1.24 C ATOM 123 NZ LYS A 8 -6.322 -10.488 -10.171 1.00 1.81 N ATOM 0 H LYS A 8 -9.158 -11.941 -4.677 1.00 0.35 H new ATOM 0 HA LYS A 8 -8.587 -9.505 -5.996 1.00 0.38 H new ATOM 0 HB2 LYS A 8 -7.653 -11.522 -6.843 1.00 0.44 H new ATOM 0 HB3 LYS A 8 -9.199 -12.347 -6.843 1.00 0.44 H new ATOM 0 HG2 LYS A 8 -8.496 -11.791 -9.130 1.00 0.76 H new ATOM 0 HG3 LYS A 8 -9.985 -10.965 -8.716 1.00 0.76 H new ATOM 0 HD2 LYS A 8 -9.031 -8.891 -8.841 1.00 0.74 H new ATOM 0 HD3 LYS A 8 -7.541 -9.412 -8.081 1.00 0.74 H new ATOM 0 HE2 LYS A 8 -8.269 -10.172 -10.934 1.00 1.24 H new ATOM 0 HE3 LYS A 8 -7.394 -8.704 -10.548 1.00 1.24 H new ATOM 0 HZ1 LYS A 8 -5.859 -10.438 -11.101 1.00 1.81 H new ATOM 0 HZ2 LYS A 8 -5.693 -10.083 -9.448 1.00 1.81 H new ATOM 0 HZ3 LYS A 8 -6.523 -11.481 -9.938 1.00 1.81 H new ATOM 137 N LYS A 9 -11.676 -10.620 -6.248 1.00 0.41 N ATOM 138 CA LYS A 9 -13.021 -10.243 -6.656 1.00 0.46 C ATOM 139 C LYS A 9 -13.501 -9.017 -5.896 1.00 0.43 C ATOM 140 O LYS A 9 -13.940 -8.026 -6.495 1.00 0.44 O ATOM 141 CB LYS A 9 -13.997 -11.403 -6.434 1.00 0.53 C ATOM 142 CG LYS A 9 -15.441 -11.047 -6.749 1.00 0.74 C ATOM 143 CD LYS A 9 -16.403 -12.104 -6.241 1.00 0.87 C ATOM 144 CE LYS A 9 -17.851 -11.726 -6.521 1.00 1.29 C ATOM 145 NZ LYS A 9 -18.797 -12.769 -6.046 1.00 1.69 N ATOM 0 H LYS A 9 -11.615 -11.516 -5.765 1.00 0.41 H new ATOM 0 HA LYS A 9 -12.988 -10.002 -7.719 1.00 0.46 H new ATOM 0 HB2 LYS A 9 -13.695 -12.246 -7.055 1.00 0.53 H new ATOM 0 HB3 LYS A 9 -13.930 -11.731 -5.397 1.00 0.53 H new ATOM 0 HG2 LYS A 9 -15.685 -10.085 -6.298 1.00 0.74 H new ATOM 0 HG3 LYS A 9 -15.561 -10.933 -7.826 1.00 0.74 H new ATOM 0 HD2 LYS A 9 -16.178 -13.059 -6.715 1.00 0.87 H new ATOM 0 HD3 LYS A 9 -16.263 -12.239 -5.169 1.00 0.87 H new ATOM 0 HE2 LYS A 9 -18.080 -10.779 -6.033 1.00 1.29 H new ATOM 0 HE3 LYS A 9 -17.986 -11.574 -7.592 1.00 1.29 H new ATOM 0 HZ1 LYS A 9 -19.772 -12.474 -6.255 1.00 1.69 H new ATOM 0 HZ2 LYS A 9 -18.595 -13.667 -6.530 1.00 1.69 H new ATOM 0 HZ3 LYS A 9 -18.686 -12.897 -5.020 1.00 1.69 H new ATOM 159 N ILE A 10 -13.399 -9.078 -4.575 1.00 0.41 N ATOM 160 CA ILE A 10 -13.848 -7.981 -3.743 1.00 0.42 C ATOM 161 C ILE A 10 -13.023 -6.729 -4.001 1.00 0.35 C ATOM 162 O ILE A 10 -13.585 -5.655 -4.128 1.00 0.38 O ATOM 163 CB ILE A 10 -13.853 -8.334 -2.236 1.00 0.46 C ATOM 164 CG1 ILE A 10 -12.437 -8.436 -1.669 1.00 0.45 C ATOM 165 CG2 ILE A 10 -14.603 -9.638 -2.012 1.00 0.57 C ATOM 166 CD1 ILE A 10 -12.374 -8.240 -0.170 1.00 0.58 C ATOM 0 H ILE A 10 -13.012 -9.871 -4.064 1.00 0.41 H new ATOM 0 HA ILE A 10 -14.883 -7.783 -4.023 1.00 0.42 H new ATOM 0 HB ILE A 10 -14.359 -7.526 -1.707 1.00 0.46 H new ATOM 0 HG12 ILE A 10 -12.024 -9.413 -1.918 1.00 0.45 H new ATOM 0 HG13 ILE A 10 -11.806 -7.690 -2.152 1.00 0.45 H new ATOM 0 HG21 ILE A 10 -14.602 -9.880 -0.949 1.00 0.57 H new ATOM 0 HG22 ILE A 10 -15.631 -9.531 -2.359 1.00 0.57 H new ATOM 0 HG23 ILE A 10 -14.114 -10.439 -2.567 1.00 0.57 H new ATOM 0 HD11 ILE A 10 -11.340 -8.325 0.165 1.00 0.58 H new ATOM 0 HD12 ILE A 10 -12.758 -7.252 0.084 1.00 0.58 H new ATOM 0 HD13 ILE A 10 -12.979 -9.002 0.322 1.00 0.58 H new ATOM 178 N VAL A 11 -11.704 -6.871 -4.112 1.00 0.31 N ATOM 179 CA VAL A 11 -10.835 -5.724 -4.374 1.00 0.30 C ATOM 180 C VAL A 11 -11.240 -5.042 -5.672 1.00 0.29 C ATOM 181 O VAL A 11 -11.378 -3.819 -5.723 1.00 0.30 O ATOM 182 CB VAL A 11 -9.345 -6.127 -4.451 1.00 0.35 C ATOM 183 CG1 VAL A 11 -8.532 -5.101 -5.233 1.00 0.39 C ATOM 184 CG2 VAL A 11 -8.768 -6.303 -3.057 1.00 0.41 C ATOM 0 H VAL A 11 -11.215 -7.762 -4.025 1.00 0.31 H new ATOM 0 HA VAL A 11 -10.955 -5.035 -3.538 1.00 0.30 H new ATOM 0 HB VAL A 11 -9.286 -7.078 -4.980 1.00 0.35 H new ATOM 0 HG11 VAL A 11 -7.489 -5.414 -5.269 1.00 0.39 H new ATOM 0 HG12 VAL A 11 -8.923 -5.024 -6.248 1.00 0.39 H new ATOM 0 HG13 VAL A 11 -8.603 -4.130 -4.742 1.00 0.39 H new ATOM 0 HG21 VAL A 11 -7.718 -6.587 -3.131 1.00 0.41 H new ATOM 0 HG22 VAL A 11 -8.853 -5.366 -2.507 1.00 0.41 H new ATOM 0 HG23 VAL A 11 -9.318 -7.083 -2.531 1.00 0.41 H new ATOM 194 N ASN A 12 -11.420 -5.844 -6.716 1.00 0.32 N ATOM 195 CA ASN A 12 -11.826 -5.334 -8.017 1.00 0.37 C ATOM 196 C ASN A 12 -13.082 -4.471 -7.879 1.00 0.36 C ATOM 197 O ASN A 12 -13.139 -3.340 -8.376 1.00 0.38 O ATOM 198 CB ASN A 12 -12.058 -6.501 -8.982 1.00 0.44 C ATOM 199 CG ASN A 12 -12.186 -6.050 -10.424 1.00 0.59 C ATOM 200 OD1 ASN A 12 -11.598 -5.045 -10.829 1.00 1.02 O ATOM 201 ND2 ASN A 12 -12.935 -6.799 -11.212 1.00 1.32 N ATOM 0 H ASN A 12 -11.290 -6.855 -6.684 1.00 0.32 H new ATOM 0 HA ASN A 12 -11.032 -4.706 -8.423 1.00 0.37 H new ATOM 0 HB2 ASN A 12 -11.231 -7.207 -8.898 1.00 0.44 H new ATOM 0 HB3 ASN A 12 -12.963 -7.034 -8.690 1.00 0.44 H new ATOM 0 HD21 ASN A 12 -13.044 -6.554 -12.196 1.00 1.32 H new ATOM 0 HD22 ASN A 12 -13.405 -7.623 -10.837 1.00 1.32 H new ATOM 208 N HIS A 13 -14.065 -4.990 -7.154 1.00 0.35 N ATOM 209 CA HIS A 13 -15.309 -4.264 -6.927 1.00 0.38 C ATOM 210 C HIS A 13 -15.070 -3.065 -6.013 1.00 0.33 C ATOM 211 O HIS A 13 -15.524 -1.957 -6.295 1.00 0.35 O ATOM 212 CB HIS A 13 -16.372 -5.180 -6.313 1.00 0.44 C ATOM 213 CG HIS A 13 -17.114 -6.005 -7.319 1.00 0.64 C ATOM 214 ND1 HIS A 13 -18.485 -5.984 -7.390 1.00 1.05 N ATOM 215 CD2 HIS A 13 -16.633 -6.858 -8.256 1.00 1.07 C ATOM 216 CE1 HIS A 13 -18.805 -6.822 -8.364 1.00 1.21 C ATOM 217 NE2 HIS A 13 -17.717 -7.373 -8.918 1.00 1.22 N ATOM 0 H HIS A 13 -14.026 -5.909 -6.714 1.00 0.35 H new ATOM 0 HA HIS A 13 -15.670 -3.909 -7.892 1.00 0.38 H new ATOM 0 HB2 HIS A 13 -15.894 -5.845 -5.594 1.00 0.44 H new ATOM 0 HB3 HIS A 13 -17.086 -4.571 -5.758 1.00 0.44 H new ATOM 0 HD2 HIS A 13 -15.595 -7.088 -8.445 1.00 1.07 H new ATOM 0 HE1 HIS A 13 -19.818 -7.035 -8.673 1.00 1.21 H new ATOM 0 HE2 HIS A 13 -17.699 -8.046 -9.684 1.00 1.22 H new ATOM 225 N LEU A 14 -14.314 -3.303 -4.948 1.00 0.30 N ATOM 226 CA LEU A 14 -13.987 -2.282 -3.958 1.00 0.31 C ATOM 227 C LEU A 14 -13.386 -1.045 -4.606 1.00 0.31 C ATOM 228 O LEU A 14 -13.823 0.073 -4.346 1.00 0.34 O ATOM 229 CB LEU A 14 -13.000 -2.840 -2.924 1.00 0.35 C ATOM 230 CG LEU A 14 -13.583 -3.823 -1.904 1.00 0.49 C ATOM 231 CD1 LEU A 14 -12.621 -4.020 -0.748 1.00 0.89 C ATOM 232 CD2 LEU A 14 -14.941 -3.351 -1.405 1.00 0.54 C ATOM 0 H LEU A 14 -13.907 -4.216 -4.745 1.00 0.30 H new ATOM 0 HA LEU A 14 -14.917 -1.997 -3.466 1.00 0.31 H new ATOM 0 HB2 LEU A 14 -12.189 -3.337 -3.456 1.00 0.35 H new ATOM 0 HB3 LEU A 14 -12.560 -2.003 -2.382 1.00 0.35 H new ATOM 0 HG LEU A 14 -13.726 -4.783 -2.400 1.00 0.49 H new ATOM 0 HD11 LEU A 14 -13.051 -4.721 -0.033 1.00 0.89 H new ATOM 0 HD12 LEU A 14 -11.678 -4.417 -1.123 1.00 0.89 H new ATOM 0 HD13 LEU A 14 -12.442 -3.064 -0.256 1.00 0.89 H new ATOM 0 HD21 LEU A 14 -15.332 -4.067 -0.682 1.00 0.54 H new ATOM 0 HD22 LEU A 14 -14.835 -2.376 -0.929 1.00 0.54 H new ATOM 0 HD23 LEU A 14 -15.630 -3.271 -2.246 1.00 0.54 H new ATOM 244 N ARG A 15 -12.405 -1.252 -5.476 1.00 0.32 N ATOM 245 CA ARG A 15 -11.744 -0.141 -6.136 1.00 0.37 C ATOM 246 C ARG A 15 -12.678 0.536 -7.141 1.00 0.38 C ATOM 247 O ARG A 15 -12.700 1.754 -7.253 1.00 0.45 O ATOM 248 CB ARG A 15 -10.442 -0.601 -6.802 1.00 0.43 C ATOM 249 CG ARG A 15 -10.620 -1.630 -7.907 1.00 1.21 C ATOM 250 CD ARG A 15 -9.367 -2.472 -8.095 1.00 1.96 C ATOM 251 NE ARG A 15 -9.472 -3.362 -9.250 1.00 2.47 N ATOM 252 CZ ARG A 15 -8.448 -4.049 -9.761 1.00 3.14 C ATOM 253 NH1 ARG A 15 -7.228 -3.920 -9.250 1.00 3.59 N ATOM 254 NH2 ARG A 15 -8.645 -4.866 -10.786 1.00 3.77 N ATOM 0 H ARG A 15 -12.054 -2.173 -5.737 1.00 0.32 H new ATOM 0 HA ARG A 15 -11.486 0.600 -5.379 1.00 0.37 H new ATOM 0 HB2 ARG A 15 -9.934 0.271 -7.215 1.00 0.43 H new ATOM 0 HB3 ARG A 15 -9.787 -1.019 -6.037 1.00 0.43 H new ATOM 0 HG2 ARG A 15 -11.463 -2.279 -7.668 1.00 1.21 H new ATOM 0 HG3 ARG A 15 -10.862 -1.123 -8.841 1.00 1.21 H new ATOM 0 HD2 ARG A 15 -8.505 -1.816 -8.220 1.00 1.96 H new ATOM 0 HD3 ARG A 15 -9.190 -3.063 -7.197 1.00 1.96 H new ATOM 0 HE ARG A 15 -10.385 -3.464 -9.693 1.00 2.47 H new ATOM 0 HH11 ARG A 15 -7.069 -3.293 -8.462 1.00 3.59 H new ATOM 0 HH12 ARG A 15 -6.451 -4.448 -9.646 1.00 3.59 H new ATOM 0 HH21 ARG A 15 -9.579 -4.969 -11.184 1.00 3.77 H new ATOM 0 HH22 ARG A 15 -7.863 -5.391 -11.177 1.00 3.77 H new ATOM 268 N SER A 16 -13.456 -0.257 -7.870 1.00 0.36 N ATOM 269 CA SER A 16 -14.397 0.291 -8.850 1.00 0.41 C ATOM 270 C SER A 16 -15.598 0.982 -8.181 1.00 0.38 C ATOM 271 O SER A 16 -16.369 1.680 -8.838 1.00 0.41 O ATOM 272 CB SER A 16 -14.887 -0.820 -9.783 1.00 0.47 C ATOM 273 OG SER A 16 -15.558 -1.839 -9.059 1.00 1.10 O ATOM 0 H SER A 16 -13.457 -1.275 -7.805 1.00 0.36 H new ATOM 0 HA SER A 16 -13.864 1.048 -9.425 1.00 0.41 H new ATOM 0 HB2 SER A 16 -15.558 -0.400 -10.532 1.00 0.47 H new ATOM 0 HB3 SER A 16 -14.040 -1.248 -10.319 1.00 0.47 H new ATOM 0 HG SER A 16 -15.435 -1.692 -8.098 1.00 1.10 H new ATOM 279 N ARG A 17 -15.748 0.784 -6.885 1.00 0.34 N ATOM 280 CA ARG A 17 -16.867 1.361 -6.143 1.00 0.34 C ATOM 281 C ARG A 17 -16.445 2.459 -5.157 1.00 0.30 C ATOM 282 O ARG A 17 -17.278 2.921 -4.372 1.00 0.32 O ATOM 283 CB ARG A 17 -17.626 0.263 -5.391 1.00 0.40 C ATOM 284 CG ARG A 17 -18.331 -0.738 -6.302 1.00 0.60 C ATOM 285 CD ARG A 17 -18.999 -1.846 -5.504 1.00 1.17 C ATOM 286 NE ARG A 17 -19.419 -2.957 -6.361 1.00 1.61 N ATOM 287 CZ ARG A 17 -20.648 -3.100 -6.864 1.00 2.24 C ATOM 288 NH1 ARG A 17 -21.585 -2.190 -6.617 1.00 2.71 N ATOM 289 NH2 ARG A 17 -20.932 -4.151 -7.620 1.00 2.95 N ATOM 0 H ARG A 17 -15.110 0.227 -6.317 1.00 0.34 H new ATOM 0 HA ARG A 17 -17.513 1.831 -6.884 1.00 0.34 H new ATOM 0 HB2 ARG A 17 -16.927 -0.274 -4.750 1.00 0.40 H new ATOM 0 HB3 ARG A 17 -18.365 0.728 -4.738 1.00 0.40 H new ATOM 0 HG2 ARG A 17 -19.078 -0.220 -6.903 1.00 0.60 H new ATOM 0 HG3 ARG A 17 -17.610 -1.172 -6.995 1.00 0.60 H new ATOM 0 HD2 ARG A 17 -18.309 -2.214 -4.745 1.00 1.17 H new ATOM 0 HD3 ARG A 17 -19.866 -1.444 -4.979 1.00 1.17 H new ATOM 0 HE ARG A 17 -18.726 -3.670 -6.589 1.00 1.61 H new ATOM 0 HH11 ARG A 17 -21.367 -1.377 -6.041 1.00 2.71 H new ATOM 0 HH12 ARG A 17 -22.522 -2.305 -7.004 1.00 2.71 H new ATOM 0 HH21 ARG A 17 -20.213 -4.847 -7.816 1.00 2.95 H new ATOM 0 HH22 ARG A 17 -21.870 -4.263 -8.006 1.00 2.95 H new ATOM 303 N LEU A 18 -15.179 2.890 -5.168 1.00 0.27 N ATOM 304 CA LEU A 18 -14.756 3.868 -4.187 1.00 0.26 C ATOM 305 C LEU A 18 -15.050 5.290 -4.629 1.00 0.24 C ATOM 306 O LEU A 18 -15.011 5.612 -5.818 1.00 0.25 O ATOM 307 CB LEU A 18 -13.268 3.729 -3.903 1.00 0.30 C ATOM 308 CG LEU A 18 -12.889 2.690 -2.860 1.00 0.40 C ATOM 309 CD1 LEU A 18 -11.399 2.403 -2.944 1.00 0.63 C ATOM 310 CD2 LEU A 18 -13.258 3.170 -1.465 1.00 0.49 C ATOM 0 H LEU A 18 -14.460 2.585 -5.824 1.00 0.27 H new ATOM 0 HA LEU A 18 -15.327 3.671 -3.280 1.00 0.26 H new ATOM 0 HB2 LEU A 18 -12.761 3.482 -4.836 1.00 0.30 H new ATOM 0 HB3 LEU A 18 -12.887 4.698 -3.579 1.00 0.30 H new ATOM 0 HG LEU A 18 -13.442 1.772 -3.059 1.00 0.40 H new ATOM 0 HD11 LEU A 18 -11.129 1.658 -2.196 1.00 0.63 H new ATOM 0 HD12 LEU A 18 -11.157 2.024 -3.937 1.00 0.63 H new ATOM 0 HD13 LEU A 18 -10.841 3.321 -2.760 1.00 0.63 H new ATOM 0 HD21 LEU A 18 -12.978 2.412 -0.734 1.00 0.49 H new ATOM 0 HD22 LEU A 18 -12.728 4.097 -1.247 1.00 0.49 H new ATOM 0 HD23 LEU A 18 -14.333 3.345 -1.413 1.00 0.49 H new ATOM 322 N ALA A 19 -15.377 6.122 -3.656 1.00 0.25 N ATOM 323 CA ALA A 19 -15.631 7.536 -3.884 1.00 0.27 C ATOM 324 C ALA A 19 -15.468 8.280 -2.569 1.00 0.29 C ATOM 325 O ALA A 19 -15.977 7.849 -1.547 1.00 0.45 O ATOM 326 CB ALA A 19 -17.036 7.760 -4.443 1.00 0.32 C ATOM 0 H ALA A 19 -15.475 5.836 -2.682 1.00 0.25 H new ATOM 0 HA ALA A 19 -14.918 7.912 -4.618 1.00 0.27 H new ATOM 0 HB1 ALA A 19 -17.198 8.826 -4.604 1.00 0.32 H new ATOM 0 HB2 ALA A 19 -17.139 7.230 -5.390 1.00 0.32 H new ATOM 0 HB3 ALA A 19 -17.774 7.384 -3.734 1.00 0.32 H new ATOM 332 N PHE A 20 -14.757 9.383 -2.578 1.00 0.28 N ATOM 333 CA PHE A 20 -14.578 10.151 -1.363 1.00 0.29 C ATOM 334 C PHE A 20 -15.128 11.548 -1.555 1.00 0.33 C ATOM 335 O PHE A 20 -15.314 11.992 -2.684 1.00 0.35 O ATOM 336 CB PHE A 20 -13.099 10.179 -0.947 1.00 0.31 C ATOM 337 CG PHE A 20 -12.218 11.053 -1.801 1.00 0.32 C ATOM 338 CD1 PHE A 20 -12.129 12.413 -1.563 1.00 1.20 C ATOM 339 CD2 PHE A 20 -11.468 10.508 -2.829 1.00 1.22 C ATOM 340 CE1 PHE A 20 -11.315 13.211 -2.339 1.00 1.21 C ATOM 341 CE2 PHE A 20 -10.649 11.299 -3.606 1.00 1.25 C ATOM 342 CZ PHE A 20 -10.569 12.654 -3.361 1.00 0.41 C ATOM 0 H PHE A 20 -14.296 9.768 -3.403 1.00 0.28 H new ATOM 0 HA PHE A 20 -15.131 9.673 -0.555 1.00 0.29 H new ATOM 0 HB2 PHE A 20 -13.033 10.520 0.086 1.00 0.31 H new ATOM 0 HB3 PHE A 20 -12.710 9.161 -0.972 1.00 0.31 H new ATOM 0 HD1 PHE A 20 -12.703 12.854 -0.761 1.00 1.20 H new ATOM 0 HD2 PHE A 20 -11.525 9.448 -3.025 1.00 1.22 H new ATOM 0 HE1 PHE A 20 -11.260 14.273 -2.148 1.00 1.21 H new ATOM 0 HE2 PHE A 20 -10.071 10.859 -4.405 1.00 1.25 H new ATOM 0 HZ PHE A 20 -9.926 13.277 -3.965 1.00 0.41 H new ATOM 352 N GLU A 21 -15.411 12.229 -0.467 1.00 0.37 N ATOM 353 CA GLU A 21 -15.939 13.567 -0.551 1.00 0.43 C ATOM 354 C GLU A 21 -14.932 14.566 -0.020 1.00 0.46 C ATOM 355 O GLU A 21 -14.336 14.372 1.057 1.00 0.44 O ATOM 356 CB GLU A 21 -17.246 13.676 0.220 1.00 0.48 C ATOM 357 CG GLU A 21 -18.315 14.471 -0.502 1.00 1.11 C ATOM 358 CD GLU A 21 -19.567 14.612 0.327 1.00 1.40 C ATOM 359 OE1 GLU A 21 -19.655 15.574 1.115 1.00 1.92 O ATOM 360 OE2 GLU A 21 -20.462 13.752 0.210 1.00 1.89 O ATOM 0 H GLU A 21 -15.284 11.878 0.482 1.00 0.37 H new ATOM 0 HA GLU A 21 -16.136 13.793 -1.599 1.00 0.43 H new ATOM 0 HB2 GLU A 21 -17.624 12.673 0.420 1.00 0.48 H new ATOM 0 HB3 GLU A 21 -17.050 14.141 1.186 1.00 0.48 H new ATOM 0 HG2 GLU A 21 -17.928 15.460 -0.747 1.00 1.11 H new ATOM 0 HG3 GLU A 21 -18.557 13.981 -1.445 1.00 1.11 H new ATOM 367 N TYR A 22 -14.753 15.625 -0.792 1.00 0.52 N ATOM 368 CA TYR A 22 -13.848 16.689 -0.442 1.00 0.59 C ATOM 369 C TYR A 22 -14.577 18.024 -0.555 1.00 0.65 C ATOM 370 O TYR A 22 -15.010 18.416 -1.643 1.00 0.65 O ATOM 371 CB TYR A 22 -12.605 16.673 -1.337 1.00 0.60 C ATOM 372 CG TYR A 22 -11.811 17.960 -1.268 1.00 0.74 C ATOM 373 CD1 TYR A 22 -11.301 18.411 -0.055 1.00 1.53 C ATOM 374 CD2 TYR A 22 -11.589 18.732 -2.400 1.00 1.38 C ATOM 375 CE1 TYR A 22 -10.591 19.592 0.025 1.00 1.69 C ATOM 376 CE2 TYR A 22 -10.876 19.914 -2.329 1.00 1.48 C ATOM 377 CZ TYR A 22 -10.382 20.342 -1.114 1.00 1.16 C ATOM 378 OH TYR A 22 -9.667 21.518 -1.037 1.00 1.40 O ATOM 0 H TYR A 22 -15.236 15.764 -1.680 1.00 0.52 H new ATOM 0 HA TYR A 22 -13.512 16.546 0.585 1.00 0.59 H new ATOM 0 HB2 TYR A 22 -11.964 15.841 -1.045 1.00 0.60 H new ATOM 0 HB3 TYR A 22 -12.909 16.495 -2.368 1.00 0.60 H new ATOM 0 HD1 TYR A 22 -11.463 17.827 0.839 1.00 1.53 H new ATOM 0 HD2 TYR A 22 -11.980 18.404 -3.352 1.00 1.38 H new ATOM 0 HE1 TYR A 22 -10.201 19.927 0.975 1.00 1.69 H new ATOM 0 HE2 TYR A 22 -10.706 20.500 -3.220 1.00 1.48 H new ATOM 0 HH TYR A 22 -9.609 21.925 -1.927 1.00 1.40 H new ATOM 388 N ASN A 23 -14.736 18.691 0.584 1.00 0.72 N ATOM 389 CA ASN A 23 -15.404 19.989 0.657 1.00 0.80 C ATOM 390 C ASN A 23 -16.797 19.964 0.037 1.00 0.78 C ATOM 391 O ASN A 23 -17.222 20.930 -0.595 1.00 0.83 O ATOM 392 CB ASN A 23 -14.551 21.066 -0.010 1.00 0.87 C ATOM 393 CG ASN A 23 -13.660 21.781 0.986 1.00 1.09 C ATOM 394 OD1 ASN A 23 -13.993 21.890 2.170 1.00 1.72 O ATOM 395 ND2 ASN A 23 -12.525 22.277 0.521 1.00 1.37 N ATOM 0 H ASN A 23 -14.405 18.347 1.485 1.00 0.72 H new ATOM 0 HA ASN A 23 -15.525 20.225 1.714 1.00 0.80 H new ATOM 0 HB2 ASN A 23 -13.935 20.612 -0.787 1.00 0.87 H new ATOM 0 HB3 ASN A 23 -15.200 21.791 -0.501 1.00 0.87 H new ATOM 0 HD21 ASN A 23 -11.889 22.770 1.148 1.00 1.37 H new ATOM 0 HD22 ASN A 23 -12.286 22.166 -0.464 1.00 1.37 H new ATOM 402 N GLY A 24 -17.501 18.859 0.220 1.00 0.73 N ATOM 403 CA GLY A 24 -18.842 18.738 -0.310 1.00 0.73 C ATOM 404 C GLY A 24 -18.874 18.216 -1.731 1.00 0.68 C ATOM 405 O GLY A 24 -19.946 17.931 -2.265 1.00 0.70 O ATOM 0 H GLY A 24 -17.166 18.040 0.728 1.00 0.73 H new ATOM 0 HA2 GLY A 24 -19.420 18.070 0.329 1.00 0.73 H new ATOM 0 HA3 GLY A 24 -19.329 19.713 -0.276 1.00 0.73 H new ATOM 409 N GLN A 25 -17.708 18.098 -2.356 1.00 0.64 N ATOM 410 CA GLN A 25 -17.631 17.601 -3.723 1.00 0.60 C ATOM 411 C GLN A 25 -17.252 16.125 -3.724 1.00 0.54 C ATOM 412 O GLN A 25 -16.288 15.726 -3.069 1.00 0.53 O ATOM 413 CB GLN A 25 -16.617 18.415 -4.526 1.00 0.63 C ATOM 414 CG GLN A 25 -16.797 19.920 -4.384 1.00 0.76 C ATOM 415 CD GLN A 25 -18.049 20.428 -5.067 1.00 1.16 C ATOM 416 OE1 GLN A 25 -18.448 19.923 -6.113 1.00 1.91 O ATOM 417 NE2 GLN A 25 -18.686 21.424 -4.475 1.00 1.56 N ATOM 0 H GLN A 25 -16.808 18.338 -1.940 1.00 0.64 H new ATOM 0 HA GLN A 25 -18.609 17.709 -4.192 1.00 0.60 H new ATOM 0 HB2 GLN A 25 -15.611 18.146 -4.205 1.00 0.63 H new ATOM 0 HB3 GLN A 25 -16.699 18.145 -5.579 1.00 0.63 H new ATOM 0 HG2 GLN A 25 -16.836 20.178 -3.326 1.00 0.76 H new ATOM 0 HG3 GLN A 25 -15.928 20.427 -4.804 1.00 0.76 H new ATOM 0 HE21 GLN A 25 -18.323 21.817 -3.607 1.00 1.56 H new ATOM 0 HE22 GLN A 25 -19.540 21.799 -4.887 1.00 1.56 H new ATOM 426 N LEU A 26 -18.011 15.319 -4.451 1.00 0.50 N ATOM 427 CA LEU A 26 -17.754 13.886 -4.519 1.00 0.46 C ATOM 428 C LEU A 26 -16.704 13.563 -5.572 1.00 0.43 C ATOM 429 O LEU A 26 -16.823 13.954 -6.735 1.00 0.47 O ATOM 430 CB LEU A 26 -19.038 13.113 -4.813 1.00 0.49 C ATOM 431 CG LEU A 26 -19.669 12.403 -3.615 1.00 0.54 C ATOM 432 CD1 LEU A 26 -20.868 11.596 -4.069 1.00 0.59 C ATOM 433 CD2 LEU A 26 -18.664 11.495 -2.918 1.00 0.61 C ATOM 0 H LEU A 26 -18.810 15.631 -5.003 1.00 0.50 H new ATOM 0 HA LEU A 26 -17.374 13.578 -3.545 1.00 0.46 H new ATOM 0 HB2 LEU A 26 -19.770 13.805 -5.230 1.00 0.49 H new ATOM 0 HB3 LEU A 26 -18.826 12.371 -5.583 1.00 0.49 H new ATOM 0 HG LEU A 26 -19.990 13.161 -2.901 1.00 0.54 H new ATOM 0 HD11 LEU A 26 -21.314 11.092 -3.211 1.00 0.59 H new ATOM 0 HD12 LEU A 26 -21.604 12.261 -4.522 1.00 0.59 H new ATOM 0 HD13 LEU A 26 -20.551 10.853 -4.801 1.00 0.59 H new ATOM 0 HD21 LEU A 26 -19.143 11.005 -2.071 1.00 0.61 H new ATOM 0 HD22 LEU A 26 -18.307 10.741 -3.620 1.00 0.61 H new ATOM 0 HD23 LEU A 26 -17.821 12.089 -2.564 1.00 0.61 H new ATOM 445 N ILE A 27 -15.689 12.831 -5.152 1.00 0.39 N ATOM 446 CA ILE A 27 -14.587 12.445 -6.021 1.00 0.39 C ATOM 447 C ILE A 27 -14.431 10.920 -6.037 1.00 0.36 C ATOM 448 O ILE A 27 -14.024 10.322 -5.040 1.00 0.42 O ATOM 449 CB ILE A 27 -13.254 13.085 -5.559 1.00 0.41 C ATOM 450 CG1 ILE A 27 -13.454 14.546 -5.125 1.00 0.46 C ATOM 451 CG2 ILE A 27 -12.209 12.994 -6.660 1.00 0.48 C ATOM 452 CD1 ILE A 27 -13.916 15.478 -6.227 1.00 0.78 C ATOM 0 H ILE A 27 -15.603 12.485 -4.196 1.00 0.39 H new ATOM 0 HA ILE A 27 -14.819 12.804 -7.024 1.00 0.39 H new ATOM 0 HB ILE A 27 -12.899 12.526 -4.693 1.00 0.41 H new ATOM 0 HG12 ILE A 27 -14.183 14.573 -4.316 1.00 0.46 H new ATOM 0 HG13 ILE A 27 -12.514 14.922 -4.720 1.00 0.46 H new ATOM 0 HG21 ILE A 27 -11.279 13.449 -6.318 1.00 0.48 H new ATOM 0 HG22 ILE A 27 -12.032 11.947 -6.908 1.00 0.48 H new ATOM 0 HG23 ILE A 27 -12.566 13.521 -7.545 1.00 0.48 H new ATOM 0 HD11 ILE A 27 -14.030 16.486 -5.827 1.00 0.78 H new ATOM 0 HD12 ILE A 27 -13.178 15.487 -7.029 1.00 0.78 H new ATOM 0 HD13 ILE A 27 -14.873 15.133 -6.618 1.00 0.78 H new ATOM 464 N LYS A 28 -14.771 10.294 -7.160 1.00 0.31 N ATOM 465 CA LYS A 28 -14.681 8.841 -7.296 1.00 0.30 C ATOM 466 C LYS A 28 -13.221 8.370 -7.309 1.00 0.30 C ATOM 467 O LYS A 28 -12.353 9.010 -7.911 1.00 0.35 O ATOM 468 CB LYS A 28 -15.408 8.379 -8.569 1.00 0.32 C ATOM 469 CG LYS A 28 -14.748 8.836 -9.866 1.00 0.66 C ATOM 470 CD LYS A 28 -15.425 8.229 -11.089 1.00 1.05 C ATOM 471 CE LYS A 28 -16.775 8.872 -11.363 1.00 1.84 C ATOM 472 NZ LYS A 28 -17.382 8.368 -12.628 1.00 2.41 N ATOM 0 H LYS A 28 -15.113 10.772 -7.994 1.00 0.31 H new ATOM 0 HA LYS A 28 -15.167 8.391 -6.430 1.00 0.30 H new ATOM 0 HB2 LYS A 28 -15.464 7.290 -8.567 1.00 0.32 H new ATOM 0 HB3 LYS A 28 -16.432 8.751 -8.545 1.00 0.32 H new ATOM 0 HG2 LYS A 28 -14.788 9.923 -9.931 1.00 0.66 H new ATOM 0 HG3 LYS A 28 -13.695 8.555 -9.857 1.00 0.66 H new ATOM 0 HD2 LYS A 28 -14.781 8.351 -11.960 1.00 1.05 H new ATOM 0 HD3 LYS A 28 -15.556 7.158 -10.938 1.00 1.05 H new ATOM 0 HE2 LYS A 28 -17.449 8.670 -10.531 1.00 1.84 H new ATOM 0 HE3 LYS A 28 -16.657 9.954 -11.422 1.00 1.84 H new ATOM 0 HZ1 LYS A 28 -18.301 8.830 -12.780 1.00 2.41 H new ATOM 0 HZ2 LYS A 28 -16.750 8.583 -13.426 1.00 2.41 H new ATOM 0 HZ3 LYS A 28 -17.518 7.339 -12.562 1.00 2.41 H new ATOM 486 N ILE A 29 -12.957 7.248 -6.646 1.00 0.28 N ATOM 487 CA ILE A 29 -11.600 6.698 -6.577 1.00 0.31 C ATOM 488 C ILE A 29 -11.533 5.249 -7.056 1.00 0.29 C ATOM 489 O ILE A 29 -12.180 4.351 -6.494 1.00 0.31 O ATOM 490 CB ILE A 29 -10.998 6.762 -5.156 1.00 0.34 C ATOM 491 CG1 ILE A 29 -12.039 7.222 -4.137 1.00 0.31 C ATOM 492 CG2 ILE A 29 -9.786 7.686 -5.136 1.00 0.43 C ATOM 493 CD1 ILE A 29 -11.643 6.962 -2.694 1.00 0.36 C ATOM 0 H ILE A 29 -13.660 6.701 -6.149 1.00 0.28 H new ATOM 0 HA ILE A 29 -11.014 7.331 -7.243 1.00 0.31 H new ATOM 0 HB ILE A 29 -10.678 5.758 -4.878 1.00 0.34 H new ATOM 0 HG12 ILE A 29 -12.215 8.290 -4.269 1.00 0.31 H new ATOM 0 HG13 ILE A 29 -12.982 6.716 -4.342 1.00 0.31 H new ATOM 0 HG21 ILE A 29 -9.372 7.721 -4.128 1.00 0.43 H new ATOM 0 HG22 ILE A 29 -9.030 7.310 -5.826 1.00 0.43 H new ATOM 0 HG23 ILE A 29 -10.088 8.688 -5.440 1.00 0.43 H new ATOM 0 HD11 ILE A 29 -12.432 7.316 -2.031 1.00 0.36 H new ATOM 0 HD12 ILE A 29 -11.496 5.892 -2.544 1.00 0.36 H new ATOM 0 HD13 ILE A 29 -10.717 7.491 -2.470 1.00 0.36 H new ATOM 505 N LEU A 30 -10.856 5.062 -8.176 1.00 0.30 N ATOM 506 CA LEU A 30 -10.630 3.744 -8.736 1.00 0.31 C ATOM 507 C LEU A 30 -9.182 3.314 -8.575 1.00 0.29 C ATOM 508 O LEU A 30 -8.349 4.059 -8.050 1.00 0.28 O ATOM 509 CB LEU A 30 -11.050 3.640 -10.186 1.00 0.36 C ATOM 510 CG LEU A 30 -12.413 2.969 -10.368 1.00 1.41 C ATOM 511 CD1 LEU A 30 -13.537 3.968 -10.162 1.00 1.97 C ATOM 512 CD2 LEU A 30 -12.521 2.294 -11.726 1.00 2.00 C ATOM 0 H LEU A 30 -10.448 5.821 -8.722 1.00 0.30 H new ATOM 0 HA LEU A 30 -11.264 3.064 -8.167 1.00 0.31 H new ATOM 0 HB2 LEU A 30 -11.082 4.639 -10.622 1.00 0.36 H new ATOM 0 HB3 LEU A 30 -10.297 3.076 -10.737 1.00 0.36 H new ATOM 0 HG LEU A 30 -12.507 2.193 -9.609 1.00 1.41 H new ATOM 0 HD11 LEU A 30 -14.497 3.469 -10.296 1.00 1.97 H new ATOM 0 HD12 LEU A 30 -13.479 4.378 -9.154 1.00 1.97 H new ATOM 0 HD13 LEU A 30 -13.443 4.776 -10.888 1.00 1.97 H new ATOM 0 HD21 LEU A 30 -13.501 1.827 -11.823 1.00 2.00 H new ATOM 0 HD22 LEU A 30 -12.393 3.037 -12.513 1.00 2.00 H new ATOM 0 HD23 LEU A 30 -11.746 1.533 -11.817 1.00 2.00 H new ATOM 524 N SER A 31 -8.892 2.111 -9.067 1.00 0.31 N ATOM 525 CA SER A 31 -7.555 1.521 -9.043 1.00 0.33 C ATOM 526 C SER A 31 -6.506 2.417 -9.714 1.00 0.33 C ATOM 527 O SER A 31 -5.303 2.183 -9.580 1.00 0.36 O ATOM 528 CB SER A 31 -7.611 0.189 -9.773 1.00 0.41 C ATOM 529 OG SER A 31 -8.911 -0.027 -10.299 1.00 1.16 O ATOM 0 H SER A 31 -9.592 1.509 -9.501 1.00 0.31 H new ATOM 0 HA SER A 31 -7.257 1.397 -8.002 1.00 0.33 H new ATOM 0 HB2 SER A 31 -6.878 0.177 -10.579 1.00 0.41 H new ATOM 0 HB3 SER A 31 -7.348 -0.619 -9.091 1.00 0.41 H new ATOM 0 HG SER A 31 -8.935 -0.887 -10.769 1.00 1.16 H new ATOM 535 N LYS A 32 -6.962 3.422 -10.452 1.00 0.34 N ATOM 536 CA LYS A 32 -6.066 4.340 -11.134 1.00 0.38 C ATOM 537 C LYS A 32 -5.202 5.080 -10.114 1.00 0.36 C ATOM 538 O LYS A 32 -4.068 5.474 -10.395 1.00 0.40 O ATOM 539 CB LYS A 32 -6.920 5.341 -11.938 1.00 0.45 C ATOM 540 CG LYS A 32 -6.453 6.791 -11.856 1.00 1.10 C ATOM 541 CD LYS A 32 -7.555 7.713 -11.352 1.00 1.55 C ATOM 542 CE LYS A 32 -8.454 8.190 -12.485 1.00 1.94 C ATOM 543 NZ LYS A 32 -9.288 9.356 -12.086 1.00 2.47 N ATOM 0 H LYS A 32 -7.953 3.620 -10.592 1.00 0.34 H new ATOM 0 HA LYS A 32 -5.405 3.792 -11.806 1.00 0.38 H new ATOM 0 HB2 LYS A 32 -6.925 5.034 -12.984 1.00 0.45 H new ATOM 0 HB3 LYS A 32 -7.949 5.285 -11.584 1.00 0.45 H new ATOM 0 HG2 LYS A 32 -5.591 6.858 -11.192 1.00 1.10 H new ATOM 0 HG3 LYS A 32 -6.124 7.123 -12.841 1.00 1.10 H new ATOM 0 HD2 LYS A 32 -8.155 7.190 -10.607 1.00 1.55 H new ATOM 0 HD3 LYS A 32 -7.109 8.574 -10.854 1.00 1.55 H new ATOM 0 HE2 LYS A 32 -7.840 8.461 -13.344 1.00 1.94 H new ATOM 0 HE3 LYS A 32 -9.102 7.373 -12.801 1.00 1.94 H new ATOM 0 HZ1 LYS A 32 -9.884 9.647 -12.887 1.00 2.47 H new ATOM 0 HZ2 LYS A 32 -9.893 9.091 -11.283 1.00 2.47 H new ATOM 0 HZ3 LYS A 32 -8.671 10.146 -11.809 1.00 2.47 H new ATOM 557 N ASN A 33 -5.753 5.254 -8.924 1.00 0.31 N ATOM 558 CA ASN A 33 -5.061 5.931 -7.848 1.00 0.33 C ATOM 559 C ASN A 33 -4.784 5.000 -6.669 1.00 0.30 C ATOM 560 O ASN A 33 -4.077 5.359 -5.732 1.00 0.38 O ATOM 561 CB ASN A 33 -5.901 7.133 -7.415 1.00 0.36 C ATOM 562 CG ASN A 33 -5.349 8.423 -7.980 1.00 0.75 C ATOM 563 OD1 ASN A 33 -5.441 9.489 -7.374 1.00 1.28 O ATOM 564 ND2 ASN A 33 -4.788 8.317 -9.174 1.00 1.12 N ATOM 0 H ASN A 33 -6.689 4.930 -8.681 1.00 0.31 H new ATOM 0 HA ASN A 33 -4.088 6.266 -8.206 1.00 0.33 H new ATOM 0 HB2 ASN A 33 -6.930 6.999 -7.748 1.00 0.36 H new ATOM 0 HB3 ASN A 33 -5.923 7.190 -6.327 1.00 0.36 H new ATOM 0 HD21 ASN A 33 -4.407 9.144 -9.634 1.00 1.12 H new ATOM 0 HD22 ASN A 33 -4.737 7.408 -9.635 1.00 1.12 H new ATOM 571 N ILE A 34 -5.340 3.798 -6.717 1.00 0.33 N ATOM 572 CA ILE A 34 -5.184 2.852 -5.617 1.00 0.33 C ATOM 573 C ILE A 34 -4.742 1.473 -6.097 1.00 0.29 C ATOM 574 O ILE A 34 -5.266 0.945 -7.076 1.00 0.30 O ATOM 575 CB ILE A 34 -6.512 2.708 -4.851 1.00 0.35 C ATOM 576 CG1 ILE A 34 -7.100 4.091 -4.575 1.00 0.53 C ATOM 577 CG2 ILE A 34 -6.303 1.933 -3.557 1.00 0.58 C ATOM 578 CD1 ILE A 34 -8.427 4.063 -3.867 1.00 0.59 C ATOM 0 H ILE A 34 -5.899 3.455 -7.498 1.00 0.33 H new ATOM 0 HA ILE A 34 -4.407 3.251 -4.964 1.00 0.33 H new ATOM 0 HB ILE A 34 -7.218 2.146 -5.463 1.00 0.35 H new ATOM 0 HG12 ILE A 34 -6.392 4.662 -3.975 1.00 0.53 H new ATOM 0 HG13 ILE A 34 -7.216 4.620 -5.521 1.00 0.53 H new ATOM 0 HG21 ILE A 34 -7.253 1.842 -3.030 1.00 0.58 H new ATOM 0 HG22 ILE A 34 -5.918 0.939 -3.786 1.00 0.58 H new ATOM 0 HG23 ILE A 34 -5.588 2.462 -2.927 1.00 0.58 H new ATOM 0 HD11 ILE A 34 -8.776 5.083 -3.708 1.00 0.59 H new ATOM 0 HD12 ILE A 34 -9.152 3.521 -4.474 1.00 0.59 H new ATOM 0 HD13 ILE A 34 -8.315 3.564 -2.904 1.00 0.59 H new ATOM 590 N VAL A 35 -3.797 0.884 -5.379 1.00 0.27 N ATOM 591 CA VAL A 35 -3.288 -0.437 -5.705 1.00 0.26 C ATOM 592 C VAL A 35 -3.470 -1.366 -4.506 1.00 0.25 C ATOM 593 O VAL A 35 -3.190 -0.980 -3.374 1.00 0.26 O ATOM 594 CB VAL A 35 -1.791 -0.383 -6.101 1.00 0.30 C ATOM 595 CG1 VAL A 35 -1.206 -1.781 -6.219 1.00 0.45 C ATOM 596 CG2 VAL A 35 -1.612 0.373 -7.407 1.00 0.51 C ATOM 0 H VAL A 35 -3.364 1.307 -4.558 1.00 0.27 H new ATOM 0 HA VAL A 35 -3.850 -0.817 -6.558 1.00 0.26 H new ATOM 0 HB VAL A 35 -1.255 0.146 -5.313 1.00 0.30 H new ATOM 0 HG11 VAL A 35 -0.154 -1.713 -6.498 1.00 0.45 H new ATOM 0 HG12 VAL A 35 -1.295 -2.295 -5.262 1.00 0.45 H new ATOM 0 HG13 VAL A 35 -1.748 -2.339 -6.982 1.00 0.45 H new ATOM 0 HG21 VAL A 35 -0.554 0.401 -7.669 1.00 0.51 H new ATOM 0 HG22 VAL A 35 -2.169 -0.130 -8.198 1.00 0.51 H new ATOM 0 HG23 VAL A 35 -1.984 1.391 -7.292 1.00 0.51 H new ATOM 606 N ALA A 36 -3.972 -2.569 -4.749 1.00 0.25 N ATOM 607 CA ALA A 36 -4.178 -3.539 -3.680 1.00 0.25 C ATOM 608 C ALA A 36 -2.863 -4.209 -3.302 1.00 0.24 C ATOM 609 O ALA A 36 -2.051 -4.552 -4.171 1.00 0.27 O ATOM 610 CB ALA A 36 -5.208 -4.575 -4.098 1.00 0.30 C ATOM 0 H ALA A 36 -4.244 -2.897 -5.676 1.00 0.25 H new ATOM 0 HA ALA A 36 -4.555 -3.013 -2.803 1.00 0.25 H new ATOM 0 HB1 ALA A 36 -5.351 -5.292 -3.290 1.00 0.30 H new ATOM 0 HB2 ALA A 36 -6.154 -4.080 -4.316 1.00 0.30 H new ATOM 0 HB3 ALA A 36 -4.858 -5.097 -4.989 1.00 0.30 H new ATOM 616 N VAL A 37 -2.648 -4.385 -2.012 1.00 0.23 N ATOM 617 CA VAL A 37 -1.431 -5.003 -1.523 1.00 0.24 C ATOM 618 C VAL A 37 -1.713 -6.003 -0.414 1.00 0.25 C ATOM 619 O VAL A 37 -2.678 -5.871 0.353 1.00 0.25 O ATOM 620 CB VAL A 37 -0.415 -3.964 -1.017 1.00 0.27 C ATOM 621 CG1 VAL A 37 0.481 -3.488 -2.151 1.00 0.29 C ATOM 622 CG2 VAL A 37 -1.117 -2.794 -0.352 1.00 0.30 C ATOM 0 H VAL A 37 -3.303 -4.107 -1.282 1.00 0.23 H new ATOM 0 HA VAL A 37 -1.000 -5.527 -2.376 1.00 0.24 H new ATOM 0 HB VAL A 37 0.214 -4.445 -0.268 1.00 0.27 H new ATOM 0 HG11 VAL A 37 1.191 -2.754 -1.770 1.00 0.29 H new ATOM 0 HG12 VAL A 37 1.024 -4.337 -2.566 1.00 0.29 H new ATOM 0 HG13 VAL A 37 -0.130 -3.032 -2.930 1.00 0.29 H new ATOM 0 HG21 VAL A 37 -0.375 -2.075 -0.004 1.00 0.30 H new ATOM 0 HG22 VAL A 37 -1.781 -2.312 -1.070 1.00 0.30 H new ATOM 0 HG23 VAL A 37 -1.700 -3.154 0.496 1.00 0.30 H new ATOM 632 N GLY A 38 -0.906 -7.047 -0.395 1.00 0.27 N ATOM 633 CA GLY A 38 -1.044 -8.070 0.602 1.00 0.30 C ATOM 634 C GLY A 38 -0.574 -9.403 0.083 1.00 0.32 C ATOM 635 O GLY A 38 0.179 -9.488 -0.896 1.00 0.32 O ATOM 0 H GLY A 38 -0.150 -7.201 -1.063 1.00 0.27 H new ATOM 0 HA2 GLY A 38 -0.469 -7.798 1.487 1.00 0.30 H new ATOM 0 HA3 GLY A 38 -2.087 -8.144 0.909 1.00 0.30 H new ATOM 639 N SER A 39 -1.053 -10.458 0.713 1.00 0.38 N ATOM 640 CA SER A 39 -0.733 -11.794 0.288 1.00 0.43 C ATOM 641 C SER A 39 -1.328 -12.008 -1.110 1.00 0.43 C ATOM 642 O SER A 39 -0.891 -12.876 -1.864 1.00 0.44 O ATOM 643 CB SER A 39 -1.261 -12.791 1.309 1.00 0.57 C ATOM 644 OG SER A 39 -0.908 -12.381 2.622 1.00 1.40 O ATOM 0 H SER A 39 -1.668 -10.408 1.525 1.00 0.38 H new ATOM 0 HA SER A 39 0.345 -11.945 0.226 1.00 0.43 H new ATOM 0 HB2 SER A 39 -2.345 -12.870 1.224 1.00 0.57 H new ATOM 0 HB3 SER A 39 -0.852 -13.781 1.107 1.00 0.57 H new ATOM 0 HG SER A 39 -1.254 -13.029 3.271 1.00 1.40 H new ATOM 650 N LEU A 40 -2.349 -11.201 -1.436 1.00 0.45 N ATOM 651 CA LEU A 40 -2.989 -11.220 -2.747 1.00 0.51 C ATOM 652 C LEU A 40 -1.950 -10.904 -3.812 1.00 0.47 C ATOM 653 O LEU A 40 -1.938 -11.494 -4.892 1.00 0.52 O ATOM 654 CB LEU A 40 -4.100 -10.169 -2.793 1.00 0.63 C ATOM 655 CG LEU A 40 -5.458 -10.648 -3.314 1.00 0.97 C ATOM 656 CD1 LEU A 40 -5.370 -11.044 -4.781 1.00 1.24 C ATOM 657 CD2 LEU A 40 -5.965 -11.806 -2.473 1.00 2.02 C ATOM 0 H LEU A 40 -2.750 -10.518 -0.793 1.00 0.45 H new ATOM 0 HA LEU A 40 -3.418 -12.205 -2.930 1.00 0.51 H new ATOM 0 HB2 LEU A 40 -4.239 -9.772 -1.787 1.00 0.63 H new ATOM 0 HB3 LEU A 40 -3.765 -9.342 -3.419 1.00 0.63 H new ATOM 0 HG LEU A 40 -6.167 -9.824 -3.233 1.00 0.97 H new ATOM 0 HD11 LEU A 40 -6.348 -11.380 -5.126 1.00 1.24 H new ATOM 0 HD12 LEU A 40 -5.053 -10.185 -5.371 1.00 1.24 H new ATOM 0 HD13 LEU A 40 -4.647 -11.851 -4.897 1.00 1.24 H new ATOM 0 HD21 LEU A 40 -6.931 -12.137 -2.854 1.00 2.02 H new ATOM 0 HD22 LEU A 40 -5.254 -12.630 -2.523 1.00 2.02 H new ATOM 0 HD23 LEU A 40 -6.075 -11.483 -1.438 1.00 2.02 H new ATOM 669 N ARG A 41 -1.075 -9.958 -3.480 1.00 0.43 N ATOM 670 CA ARG A 41 -0.003 -9.554 -4.367 1.00 0.47 C ATOM 671 C ARG A 41 1.049 -10.646 -4.392 1.00 0.47 C ATOM 672 O ARG A 41 1.652 -10.912 -5.428 1.00 0.54 O ATOM 673 CB ARG A 41 0.609 -8.231 -3.905 1.00 0.50 C ATOM 674 CG ARG A 41 1.861 -7.850 -4.668 1.00 0.92 C ATOM 675 CD ARG A 41 2.200 -6.388 -4.475 1.00 1.30 C ATOM 676 NE ARG A 41 1.324 -5.509 -5.255 1.00 1.82 N ATOM 677 CZ ARG A 41 1.678 -4.930 -6.403 1.00 2.29 C ATOM 678 NH1 ARG A 41 2.893 -5.118 -6.905 1.00 2.67 N ATOM 679 NH2 ARG A 41 0.817 -4.156 -7.045 1.00 2.98 N ATOM 0 H ARG A 41 -1.094 -9.456 -2.592 1.00 0.43 H new ATOM 0 HA ARG A 41 -0.399 -9.404 -5.371 1.00 0.47 H new ATOM 0 HB2 ARG A 41 -0.131 -7.438 -4.016 1.00 0.50 H new ATOM 0 HB3 ARG A 41 0.846 -8.300 -2.843 1.00 0.50 H new ATOM 0 HG2 ARG A 41 2.695 -8.466 -4.333 1.00 0.92 H new ATOM 0 HG3 ARG A 41 1.719 -8.056 -5.729 1.00 0.92 H new ATOM 0 HD2 ARG A 41 2.119 -6.134 -3.418 1.00 1.30 H new ATOM 0 HD3 ARG A 41 3.236 -6.216 -4.765 1.00 1.30 H new ATOM 0 HE ARG A 41 0.386 -5.329 -4.898 1.00 1.82 H new ATOM 0 HH11 ARG A 41 3.563 -5.709 -6.412 1.00 2.67 H new ATOM 0 HH12 ARG A 41 3.156 -4.672 -7.784 1.00 2.67 H new ATOM 0 HH21 ARG A 41 -0.116 -4.003 -6.661 1.00 2.98 H new ATOM 0 HH22 ARG A 41 1.086 -3.712 -7.923 1.00 2.98 H new ATOM 693 N ARG A 42 1.262 -11.279 -3.240 1.00 0.43 N ATOM 694 CA ARG A 42 2.243 -12.357 -3.133 1.00 0.48 C ATOM 695 C ARG A 42 1.714 -13.680 -3.697 1.00 0.47 C ATOM 696 O ARG A 42 2.451 -14.668 -3.756 1.00 0.52 O ATOM 697 CB ARG A 42 2.650 -12.541 -1.675 1.00 0.52 C ATOM 698 CG ARG A 42 4.130 -12.813 -1.488 1.00 1.06 C ATOM 699 CD ARG A 42 4.423 -13.405 -0.121 1.00 1.93 C ATOM 700 NE ARG A 42 4.788 -14.817 -0.221 1.00 2.68 N ATOM 701 CZ ARG A 42 4.291 -15.779 0.556 1.00 3.60 C ATOM 702 NH1 ARG A 42 3.484 -15.471 1.566 1.00 3.96 N ATOM 703 NH2 ARG A 42 4.618 -17.052 0.336 1.00 4.52 N ATOM 0 H ARG A 42 0.771 -11.066 -2.372 1.00 0.43 H new ATOM 0 HA ARG A 42 3.110 -12.072 -3.729 1.00 0.48 H new ATOM 0 HB2 ARG A 42 2.380 -11.645 -1.115 1.00 0.52 H new ATOM 0 HB3 ARG A 42 2.081 -13.367 -1.249 1.00 0.52 H new ATOM 0 HG2 ARG A 42 4.475 -13.498 -2.263 1.00 1.06 H new ATOM 0 HG3 ARG A 42 4.689 -11.885 -1.610 1.00 1.06 H new ATOM 0 HD2 ARG A 42 5.233 -12.850 0.352 1.00 1.93 H new ATOM 0 HD3 ARG A 42 3.547 -13.298 0.519 1.00 1.93 H new ATOM 0 HE ARG A 42 5.468 -15.084 -0.933 1.00 2.68 H new ATOM 0 HH11 ARG A 42 3.244 -14.497 1.748 1.00 3.96 H new ATOM 0 HH12 ARG A 42 3.105 -16.209 2.159 1.00 3.96 H new ATOM 0 HH21 ARG A 42 5.250 -17.292 -0.428 1.00 4.52 H new ATOM 0 HH22 ARG A 42 4.237 -17.787 0.932 1.00 4.52 H new ATOM 717 N GLU A 43 0.436 -13.690 -4.086 1.00 0.46 N ATOM 718 CA GLU A 43 -0.212 -14.872 -4.666 1.00 0.50 C ATOM 719 C GLU A 43 -0.310 -16.005 -3.640 1.00 0.47 C ATOM 720 O GLU A 43 0.097 -17.141 -3.893 1.00 0.52 O ATOM 721 CB GLU A 43 0.530 -15.326 -5.937 1.00 0.59 C ATOM 722 CG GLU A 43 0.858 -14.173 -6.871 1.00 0.67 C ATOM 723 CD GLU A 43 1.504 -14.625 -8.160 1.00 0.95 C ATOM 724 OE1 GLU A 43 2.543 -15.313 -8.104 1.00 1.60 O ATOM 725 OE2 GLU A 43 0.971 -14.301 -9.244 1.00 1.53 O ATOM 0 H GLU A 43 -0.179 -12.880 -4.008 1.00 0.46 H new ATOM 0 HA GLU A 43 -1.229 -14.601 -4.950 1.00 0.50 H new ATOM 0 HB2 GLU A 43 1.453 -15.831 -5.652 1.00 0.59 H new ATOM 0 HB3 GLU A 43 -0.082 -16.055 -6.468 1.00 0.59 H new ATOM 0 HG2 GLU A 43 -0.057 -13.627 -7.101 1.00 0.67 H new ATOM 0 HG3 GLU A 43 1.524 -13.477 -6.361 1.00 0.67 H new ATOM 732 N GLU A 44 -0.852 -15.679 -2.477 1.00 0.43 N ATOM 733 CA GLU A 44 -1.004 -16.645 -1.403 1.00 0.43 C ATOM 734 C GLU A 44 -2.389 -17.271 -1.378 1.00 0.43 C ATOM 735 O GLU A 44 -3.368 -16.665 -1.803 1.00 0.52 O ATOM 736 CB GLU A 44 -0.684 -16.013 -0.067 1.00 0.48 C ATOM 737 CG GLU A 44 0.714 -16.328 0.435 1.00 1.24 C ATOM 738 CD GLU A 44 0.945 -17.812 0.709 1.00 1.94 C ATOM 739 OE1 GLU A 44 0.208 -18.660 0.159 1.00 2.57 O ATOM 740 OE2 GLU A 44 1.866 -18.135 1.491 1.00 2.47 O ATOM 0 H GLU A 44 -1.196 -14.745 -2.253 1.00 0.43 H new ATOM 0 HA GLU A 44 -0.292 -17.448 -1.595 1.00 0.43 H new ATOM 0 HB2 GLU A 44 -0.796 -14.932 -0.150 1.00 0.48 H new ATOM 0 HB3 GLU A 44 -1.411 -16.354 0.670 1.00 0.48 H new ATOM 0 HG2 GLU A 44 1.441 -15.986 -0.301 1.00 1.24 H new ATOM 0 HG3 GLU A 44 0.898 -15.765 1.350 1.00 1.24 H new ATOM 747 N LYS A 45 -2.442 -18.481 -0.844 1.00 0.46 N ATOM 748 CA LYS A 45 -3.662 -19.273 -0.767 1.00 0.50 C ATOM 749 C LYS A 45 -4.779 -18.553 -0.001 1.00 0.49 C ATOM 750 O LYS A 45 -5.921 -18.502 -0.459 1.00 0.56 O ATOM 751 CB LYS A 45 -3.363 -20.619 -0.079 1.00 0.59 C ATOM 752 CG LYS A 45 -1.951 -21.165 -0.302 1.00 1.14 C ATOM 753 CD LYS A 45 -1.691 -21.524 -1.759 1.00 1.28 C ATOM 754 CE LYS A 45 -0.677 -20.587 -2.398 1.00 1.42 C ATOM 755 NZ LYS A 45 0.608 -20.544 -1.645 1.00 2.10 N ATOM 0 H LYS A 45 -1.628 -18.948 -0.446 1.00 0.46 H new ATOM 0 HA LYS A 45 -4.009 -19.433 -1.788 1.00 0.50 H new ATOM 0 HB2 LYS A 45 -3.526 -20.505 0.993 1.00 0.59 H new ATOM 0 HB3 LYS A 45 -4.081 -21.358 -0.434 1.00 0.59 H new ATOM 0 HG2 LYS A 45 -1.222 -20.422 0.022 1.00 1.14 H new ATOM 0 HG3 LYS A 45 -1.804 -22.049 0.319 1.00 1.14 H new ATOM 0 HD2 LYS A 45 -1.328 -22.550 -1.822 1.00 1.28 H new ATOM 0 HD3 LYS A 45 -2.627 -21.482 -2.316 1.00 1.28 H new ATOM 0 HE2 LYS A 45 -0.485 -20.907 -3.422 1.00 1.42 H new ATOM 0 HE3 LYS A 45 -1.097 -19.583 -2.452 1.00 1.42 H new ATOM 0 HZ1 LYS A 45 1.403 -20.639 -2.309 1.00 2.10 H new ATOM 0 HZ2 LYS A 45 0.684 -19.638 -1.140 1.00 2.10 H new ATOM 0 HZ3 LYS A 45 0.635 -21.325 -0.959 1.00 2.10 H new ATOM 769 N MET A 46 -4.452 -17.983 1.153 1.00 0.46 N ATOM 770 CA MET A 46 -5.462 -17.299 1.966 1.00 0.48 C ATOM 771 C MET A 46 -4.840 -16.247 2.888 1.00 0.46 C ATOM 772 O MET A 46 -3.743 -16.438 3.413 1.00 0.67 O ATOM 773 CB MET A 46 -6.256 -18.329 2.792 1.00 0.60 C ATOM 774 CG MET A 46 -7.018 -17.727 3.961 1.00 0.67 C ATOM 775 SD MET A 46 -8.143 -18.897 4.744 1.00 1.15 S ATOM 776 CE MET A 46 -7.018 -20.240 5.124 1.00 2.00 C ATOM 0 H MET A 46 -3.511 -17.978 1.546 1.00 0.46 H new ATOM 0 HA MET A 46 -6.137 -16.778 1.287 1.00 0.48 H new ATOM 0 HB2 MET A 46 -6.961 -18.840 2.136 1.00 0.60 H new ATOM 0 HB3 MET A 46 -5.568 -19.085 3.170 1.00 0.60 H new ATOM 0 HG2 MET A 46 -6.307 -17.363 4.703 1.00 0.67 H new ATOM 0 HG3 MET A 46 -7.585 -16.864 3.612 1.00 0.67 H new ATOM 0 HE1 MET A 46 -7.501 -20.936 5.809 1.00 2.00 H new ATOM 0 HE2 MET A 46 -6.751 -20.762 4.205 1.00 2.00 H new ATOM 0 HE3 MET A 46 -6.117 -19.839 5.589 1.00 2.00 H new ATOM 786 N LEU A 47 -5.545 -15.130 3.068 1.00 0.49 N ATOM 787 CA LEU A 47 -5.066 -14.048 3.927 1.00 0.56 C ATOM 788 C LEU A 47 -6.166 -13.547 4.875 1.00 0.55 C ATOM 789 O LEU A 47 -7.342 -13.878 4.698 1.00 0.59 O ATOM 790 CB LEU A 47 -4.490 -12.914 3.074 1.00 0.82 C ATOM 791 CG LEU A 47 -5.452 -12.245 2.085 1.00 0.43 C ATOM 792 CD1 LEU A 47 -6.140 -11.060 2.740 1.00 1.09 C ATOM 793 CD2 LEU A 47 -4.702 -11.794 0.840 1.00 1.09 C ATOM 0 H LEU A 47 -6.449 -14.951 2.631 1.00 0.49 H new ATOM 0 HA LEU A 47 -4.268 -14.439 4.558 1.00 0.56 H new ATOM 0 HB2 LEU A 47 -4.101 -12.147 3.744 1.00 0.82 H new ATOM 0 HB3 LEU A 47 -3.642 -13.306 2.513 1.00 0.82 H new ATOM 0 HG LEU A 47 -6.209 -12.972 1.792 1.00 0.43 H new ATOM 0 HD11 LEU A 47 -6.820 -10.594 2.027 1.00 1.09 H new ATOM 0 HD12 LEU A 47 -6.703 -11.401 3.609 1.00 1.09 H new ATOM 0 HD13 LEU A 47 -5.391 -10.333 3.055 1.00 1.09 H new ATOM 0 HD21 LEU A 47 -5.398 -11.321 0.147 1.00 1.09 H new ATOM 0 HD22 LEU A 47 -3.928 -11.080 1.120 1.00 1.09 H new ATOM 0 HD23 LEU A 47 -4.242 -12.658 0.359 1.00 1.09 H new ATOM 805 N ASN A 48 -5.783 -12.760 5.886 1.00 0.61 N ATOM 806 CA ASN A 48 -6.741 -12.262 6.884 1.00 0.64 C ATOM 807 C ASN A 48 -7.277 -10.865 6.561 1.00 0.52 C ATOM 808 O ASN A 48 -8.487 -10.645 6.535 1.00 0.54 O ATOM 809 CB ASN A 48 -6.086 -12.245 8.272 1.00 0.77 C ATOM 810 CG ASN A 48 -7.087 -11.990 9.388 1.00 1.47 C ATOM 811 OD1 ASN A 48 -8.256 -12.362 9.286 1.00 2.03 O ATOM 812 ND2 ASN A 48 -6.637 -11.362 10.464 1.00 2.14 N ATOM 0 H ASN A 48 -4.822 -12.454 6.036 1.00 0.61 H new ATOM 0 HA ASN A 48 -7.591 -12.945 6.867 1.00 0.64 H new ATOM 0 HB2 ASN A 48 -5.588 -13.199 8.446 1.00 0.77 H new ATOM 0 HB3 ASN A 48 -5.316 -11.474 8.297 1.00 0.77 H new ATOM 0 HD21 ASN A 48 -7.266 -11.172 11.244 1.00 2.14 H new ATOM 0 HD22 ASN A 48 -5.661 -11.069 10.513 1.00 2.14 H new ATOM 819 N ASP A 49 -6.377 -9.930 6.301 1.00 0.49 N ATOM 820 CA ASP A 49 -6.766 -8.550 6.020 1.00 0.39 C ATOM 821 C ASP A 49 -6.279 -8.130 4.640 1.00 0.34 C ATOM 822 O ASP A 49 -5.104 -8.367 4.311 1.00 0.42 O ATOM 823 CB ASP A 49 -6.207 -7.606 7.119 1.00 0.43 C ATOM 824 CG ASP A 49 -5.339 -6.463 6.594 1.00 0.52 C ATOM 825 OD1 ASP A 49 -5.849 -5.635 5.853 1.00 1.05 O ATOM 826 OD2 ASP A 49 -4.114 -6.389 6.917 1.00 1.02 O ATOM 0 H ASP A 49 -5.371 -10.098 6.278 1.00 0.49 H new ATOM 0 HA ASP A 49 -7.854 -8.480 6.027 1.00 0.39 H new ATOM 0 HB2 ASP A 49 -7.043 -7.184 7.676 1.00 0.43 H new ATOM 0 HB3 ASP A 49 -5.621 -8.196 7.823 1.00 0.43 H new ATOM 831 N VAL A 50 -7.150 -7.466 3.869 1.00 0.28 N ATOM 832 CA VAL A 50 -6.790 -7.009 2.524 1.00 0.27 C ATOM 833 C VAL A 50 -6.334 -5.579 2.619 1.00 0.24 C ATOM 834 O VAL A 50 -7.047 -4.725 3.137 1.00 0.26 O ATOM 835 CB VAL A 50 -7.958 -7.068 1.522 1.00 0.36 C ATOM 836 CG1 VAL A 50 -7.442 -6.840 0.106 1.00 0.88 C ATOM 837 CG2 VAL A 50 -8.705 -8.388 1.619 1.00 0.90 C ATOM 0 H VAL A 50 -8.102 -7.235 4.153 1.00 0.28 H new ATOM 0 HA VAL A 50 -6.011 -7.677 2.157 1.00 0.27 H new ATOM 0 HB VAL A 50 -8.663 -6.275 1.772 1.00 0.36 H new ATOM 0 HG11 VAL A 50 -8.275 -6.883 -0.596 1.00 0.88 H new ATOM 0 HG12 VAL A 50 -6.967 -5.861 0.045 1.00 0.88 H new ATOM 0 HG13 VAL A 50 -6.715 -7.612 -0.145 1.00 0.88 H new ATOM 0 HG21 VAL A 50 -9.523 -8.397 0.899 1.00 0.90 H new ATOM 0 HG22 VAL A 50 -8.022 -9.209 1.403 1.00 0.90 H new ATOM 0 HG23 VAL A 50 -9.107 -8.506 2.625 1.00 0.90 H new ATOM 847 N ASP A 51 -5.149 -5.312 2.138 1.00 0.24 N ATOM 848 CA ASP A 51 -4.606 -4.003 2.265 1.00 0.24 C ATOM 849 C ASP A 51 -4.552 -3.256 0.963 1.00 0.24 C ATOM 850 O ASP A 51 -4.458 -3.831 -0.119 1.00 0.26 O ATOM 851 CB ASP A 51 -3.256 -4.199 2.872 1.00 0.27 C ATOM 852 CG ASP A 51 -3.367 -5.031 4.126 1.00 0.31 C ATOM 853 OD1 ASP A 51 -3.543 -6.273 4.044 1.00 0.40 O ATOM 854 OD2 ASP A 51 -3.270 -4.476 5.213 1.00 0.38 O ATOM 0 H ASP A 51 -4.551 -5.985 1.659 1.00 0.24 H new ATOM 0 HA ASP A 51 -5.240 -3.374 2.889 1.00 0.24 H new ATOM 0 HB2 ASP A 51 -2.595 -4.690 2.158 1.00 0.27 H new ATOM 0 HB3 ASP A 51 -2.810 -3.232 3.106 1.00 0.27 H new ATOM 859 N LEU A 52 -4.629 -1.959 1.082 1.00 0.26 N ATOM 860 CA LEU A 52 -4.632 -1.107 -0.062 1.00 0.31 C ATOM 861 C LEU A 52 -3.577 -0.022 0.048 1.00 0.25 C ATOM 862 O LEU A 52 -3.107 0.318 1.138 1.00 0.32 O ATOM 863 CB LEU A 52 -6.015 -0.486 -0.214 1.00 0.41 C ATOM 864 CG LEU A 52 -6.919 -1.130 -1.271 1.00 0.64 C ATOM 865 CD1 LEU A 52 -7.256 -2.569 -0.907 1.00 1.28 C ATOM 866 CD2 LEU A 52 -8.195 -0.321 -1.438 1.00 1.07 C ATOM 0 H LEU A 52 -4.691 -1.470 1.975 1.00 0.26 H new ATOM 0 HA LEU A 52 -4.393 -1.704 -0.942 1.00 0.31 H new ATOM 0 HB2 LEU A 52 -6.522 -0.533 0.749 1.00 0.41 H new ATOM 0 HB3 LEU A 52 -5.895 0.569 -0.459 1.00 0.41 H new ATOM 0 HG LEU A 52 -6.376 -1.138 -2.216 1.00 0.64 H new ATOM 0 HD11 LEU A 52 -7.898 -2.998 -1.676 1.00 1.28 H new ATOM 0 HD12 LEU A 52 -6.337 -3.151 -0.836 1.00 1.28 H new ATOM 0 HD13 LEU A 52 -7.774 -2.590 0.052 1.00 1.28 H new ATOM 0 HD21 LEU A 52 -8.827 -0.790 -2.192 1.00 1.07 H new ATOM 0 HD22 LEU A 52 -8.729 -0.284 -0.489 1.00 1.07 H new ATOM 0 HD23 LEU A 52 -7.945 0.692 -1.754 1.00 1.07 H new ATOM 878 N LEU A 53 -3.253 0.539 -1.098 1.00 0.27 N ATOM 879 CA LEU A 53 -2.263 1.589 -1.204 1.00 0.31 C ATOM 880 C LEU A 53 -2.777 2.675 -2.133 1.00 0.26 C ATOM 881 O LEU A 53 -2.898 2.465 -3.339 1.00 0.26 O ATOM 882 CB LEU A 53 -0.945 1.032 -1.747 1.00 0.48 C ATOM 883 CG LEU A 53 0.322 1.448 -0.988 1.00 0.79 C ATOM 884 CD1 LEU A 53 0.301 2.934 -0.644 1.00 1.59 C ATOM 885 CD2 LEU A 53 0.495 0.609 0.265 1.00 1.06 C ATOM 0 H LEU A 53 -3.673 0.276 -1.990 1.00 0.27 H new ATOM 0 HA LEU A 53 -2.084 2.005 -0.212 1.00 0.31 H new ATOM 0 HB2 LEU A 53 -1.005 -0.056 -1.746 1.00 0.48 H new ATOM 0 HB3 LEU A 53 -0.842 1.344 -2.786 1.00 0.48 H new ATOM 0 HG LEU A 53 1.175 1.271 -1.643 1.00 0.79 H new ATOM 0 HD11 LEU A 53 1.213 3.196 -0.107 1.00 1.59 H new ATOM 0 HD12 LEU A 53 0.240 3.519 -1.562 1.00 1.59 H new ATOM 0 HD13 LEU A 53 -0.564 3.150 -0.017 1.00 1.59 H new ATOM 0 HD21 LEU A 53 1.399 0.920 0.789 1.00 1.06 H new ATOM 0 HD22 LEU A 53 -0.368 0.747 0.917 1.00 1.06 H new ATOM 0 HD23 LEU A 53 0.578 -0.443 -0.010 1.00 1.06 H new ATOM 897 N ILE A 54 -3.101 3.823 -1.571 1.00 0.26 N ATOM 898 CA ILE A 54 -3.596 4.933 -2.365 1.00 0.25 C ATOM 899 C ILE A 54 -2.458 5.901 -2.650 1.00 0.25 C ATOM 900 O ILE A 54 -1.975 6.593 -1.750 1.00 0.27 O ATOM 901 CB ILE A 54 -4.750 5.670 -1.652 1.00 0.29 C ATOM 902 CG1 ILE A 54 -5.822 4.672 -1.202 1.00 0.52 C ATOM 903 CG2 ILE A 54 -5.350 6.737 -2.564 1.00 0.41 C ATOM 904 CD1 ILE A 54 -6.885 5.280 -0.315 1.00 0.58 C ATOM 0 H ILE A 54 -3.031 4.012 -0.571 1.00 0.26 H new ATOM 0 HA ILE A 54 -3.986 4.535 -3.302 1.00 0.25 H new ATOM 0 HB ILE A 54 -4.351 6.167 -0.767 1.00 0.29 H new ATOM 0 HG12 ILE A 54 -6.299 4.243 -2.083 1.00 0.52 H new ATOM 0 HG13 ILE A 54 -5.341 3.852 -0.668 1.00 0.52 H new ATOM 0 HG21 ILE A 54 -6.162 7.246 -2.044 1.00 0.41 H new ATOM 0 HG22 ILE A 54 -4.581 7.461 -2.832 1.00 0.41 H new ATOM 0 HG23 ILE A 54 -5.737 6.267 -3.468 1.00 0.41 H new ATOM 0 HD11 ILE A 54 -7.609 4.514 -0.037 1.00 0.58 H new ATOM 0 HD12 ILE A 54 -6.421 5.684 0.584 1.00 0.58 H new ATOM 0 HD13 ILE A 54 -7.393 6.081 -0.852 1.00 0.58 H new ATOM 916 N ILE A 55 -2.017 5.926 -3.898 1.00 0.25 N ATOM 917 CA ILE A 55 -0.932 6.795 -4.311 1.00 0.26 C ATOM 918 C ILE A 55 -1.483 8.025 -5.016 1.00 0.25 C ATOM 919 O ILE A 55 -2.113 7.923 -6.067 1.00 0.29 O ATOM 920 CB ILE A 55 0.050 6.072 -5.255 1.00 0.30 C ATOM 921 CG1 ILE A 55 -0.071 4.551 -5.122 1.00 0.35 C ATOM 922 CG2 ILE A 55 1.475 6.508 -4.968 1.00 0.48 C ATOM 923 CD1 ILE A 55 -0.922 3.919 -6.201 1.00 0.44 C ATOM 0 H ILE A 55 -2.399 5.348 -4.646 1.00 0.25 H new ATOM 0 HA ILE A 55 -0.393 7.090 -3.411 1.00 0.26 H new ATOM 0 HB ILE A 55 -0.207 6.345 -6.278 1.00 0.30 H new ATOM 0 HG12 ILE A 55 0.926 4.111 -5.151 1.00 0.35 H new ATOM 0 HG13 ILE A 55 -0.496 4.312 -4.147 1.00 0.35 H new ATOM 0 HG21 ILE A 55 2.157 5.989 -5.642 1.00 0.48 H new ATOM 0 HG22 ILE A 55 1.564 7.584 -5.119 1.00 0.48 H new ATOM 0 HG23 ILE A 55 1.729 6.264 -3.936 1.00 0.48 H new ATOM 0 HD11 ILE A 55 -0.965 2.841 -6.046 1.00 0.44 H new ATOM 0 HD12 ILE A 55 -1.930 4.332 -6.158 1.00 0.44 H new ATOM 0 HD13 ILE A 55 -0.486 4.128 -7.178 1.00 0.44 H new ATOM 935 N VAL A 56 -1.231 9.184 -4.442 1.00 0.24 N ATOM 936 CA VAL A 56 -1.732 10.425 -5.007 1.00 0.26 C ATOM 937 C VAL A 56 -0.579 11.363 -5.370 1.00 0.27 C ATOM 938 O VAL A 56 0.356 11.540 -4.589 1.00 0.25 O ATOM 939 CB VAL A 56 -2.693 11.130 -4.025 1.00 0.28 C ATOM 940 CG1 VAL A 56 -3.611 12.094 -4.759 1.00 0.34 C ATOM 941 CG2 VAL A 56 -3.511 10.112 -3.240 1.00 0.33 C ATOM 0 H VAL A 56 -0.685 9.295 -3.588 1.00 0.24 H new ATOM 0 HA VAL A 56 -2.281 10.177 -5.915 1.00 0.26 H new ATOM 0 HB VAL A 56 -2.088 11.702 -3.321 1.00 0.28 H new ATOM 0 HG11 VAL A 56 -4.277 12.577 -4.044 1.00 0.34 H new ATOM 0 HG12 VAL A 56 -3.013 12.851 -5.266 1.00 0.34 H new ATOM 0 HG13 VAL A 56 -4.202 11.546 -5.493 1.00 0.34 H new ATOM 0 HG21 VAL A 56 -4.180 10.633 -2.555 1.00 0.33 H new ATOM 0 HG22 VAL A 56 -4.098 9.507 -3.931 1.00 0.33 H new ATOM 0 HG23 VAL A 56 -2.841 9.467 -2.672 1.00 0.33 H new ATOM 951 N PRO A 57 -0.628 11.975 -6.570 1.00 0.31 N ATOM 952 CA PRO A 57 0.414 12.901 -7.041 1.00 0.34 C ATOM 953 C PRO A 57 0.432 14.225 -6.280 1.00 0.34 C ATOM 954 O PRO A 57 1.239 15.109 -6.575 1.00 0.37 O ATOM 955 CB PRO A 57 0.037 13.142 -8.505 1.00 0.39 C ATOM 956 CG PRO A 57 -1.425 12.879 -8.575 1.00 0.41 C ATOM 957 CD PRO A 57 -1.697 11.794 -7.575 1.00 0.37 C ATOM 0 HA PRO A 57 1.410 12.483 -6.895 1.00 0.34 H new ATOM 0 HB2 PRO A 57 0.269 14.163 -8.809 1.00 0.39 H new ATOM 0 HB3 PRO A 57 0.590 12.478 -9.169 1.00 0.39 H new ATOM 0 HG2 PRO A 57 -1.995 13.778 -8.340 1.00 0.41 H new ATOM 0 HG3 PRO A 57 -1.718 12.568 -9.578 1.00 0.41 H new ATOM 0 HD2 PRO A 57 -2.687 11.897 -7.131 1.00 0.37 H new ATOM 0 HD3 PRO A 57 -1.654 10.806 -8.033 1.00 0.37 H new ATOM 965 N GLU A 58 -0.461 14.363 -5.312 1.00 0.33 N ATOM 966 CA GLU A 58 -0.538 15.571 -4.510 1.00 0.36 C ATOM 967 C GLU A 58 -0.807 15.243 -3.060 1.00 0.35 C ATOM 968 O GLU A 58 -1.671 14.422 -2.745 1.00 0.34 O ATOM 969 CB GLU A 58 -1.637 16.506 -5.001 1.00 0.40 C ATOM 970 CG GLU A 58 -1.171 17.538 -6.005 1.00 0.64 C ATOM 971 CD GLU A 58 -1.908 18.853 -5.864 1.00 1.32 C ATOM 972 OE1 GLU A 58 -2.169 19.280 -4.719 1.00 2.00 O ATOM 973 OE2 GLU A 58 -2.216 19.473 -6.900 1.00 1.99 O ATOM 0 H GLU A 58 -1.145 13.649 -5.063 1.00 0.33 H new ATOM 0 HA GLU A 58 0.427 16.068 -4.607 1.00 0.36 H new ATOM 0 HB2 GLU A 58 -2.431 15.910 -5.451 1.00 0.40 H new ATOM 0 HB3 GLU A 58 -2.071 17.020 -4.143 1.00 0.40 H new ATOM 0 HG2 GLU A 58 -0.102 17.708 -5.878 1.00 0.64 H new ATOM 0 HG3 GLU A 58 -1.314 17.150 -7.014 1.00 0.64 H new ATOM 980 N LYS A 59 -0.082 15.917 -2.186 1.00 0.36 N ATOM 981 CA LYS A 59 -0.234 15.731 -0.753 1.00 0.37 C ATOM 982 C LYS A 59 -1.603 16.238 -0.337 1.00 0.37 C ATOM 983 O LYS A 59 -2.199 15.763 0.631 1.00 0.37 O ATOM 984 CB LYS A 59 0.869 16.469 0.007 1.00 0.42 C ATOM 985 CG LYS A 59 1.025 16.028 1.456 1.00 1.10 C ATOM 986 CD LYS A 59 2.305 16.574 2.060 1.00 1.46 C ATOM 987 CE LYS A 59 2.453 16.181 3.519 1.00 2.16 C ATOM 988 NZ LYS A 59 3.718 16.702 4.108 1.00 2.64 N ATOM 0 H LYS A 59 0.625 16.605 -2.446 1.00 0.36 H new ATOM 0 HA LYS A 59 -0.149 14.671 -0.512 1.00 0.37 H new ATOM 0 HB2 LYS A 59 1.816 16.319 -0.512 1.00 0.42 H new ATOM 0 HB3 LYS A 59 0.659 17.538 -0.016 1.00 0.42 H new ATOM 0 HG2 LYS A 59 0.170 16.372 2.038 1.00 1.10 H new ATOM 0 HG3 LYS A 59 1.030 14.939 1.509 1.00 1.10 H new ATOM 0 HD2 LYS A 59 3.160 16.203 1.495 1.00 1.46 H new ATOM 0 HD3 LYS A 59 2.313 17.661 1.974 1.00 1.46 H new ATOM 0 HE2 LYS A 59 1.604 16.563 4.086 1.00 2.16 H new ATOM 0 HE3 LYS A 59 2.432 15.095 3.607 1.00 2.16 H new ATOM 0 HZ1 LYS A 59 3.782 16.412 5.105 1.00 2.64 H new ATOM 0 HZ2 LYS A 59 4.529 16.318 3.583 1.00 2.64 H new ATOM 0 HZ3 LYS A 59 3.727 17.740 4.048 1.00 2.64 H new ATOM 1002 N LYS A 60 -2.097 17.199 -1.115 1.00 0.40 N ATOM 1003 CA LYS A 60 -3.392 17.799 -0.867 1.00 0.42 C ATOM 1004 C LYS A 60 -4.484 16.787 -1.158 1.00 0.40 C ATOM 1005 O LYS A 60 -5.168 16.339 -0.244 1.00 0.41 O ATOM 1006 CB LYS A 60 -3.586 19.038 -1.758 1.00 0.48 C ATOM 1007 CG LYS A 60 -3.010 20.331 -1.186 1.00 0.69 C ATOM 1008 CD LYS A 60 -1.538 20.197 -0.803 1.00 0.79 C ATOM 1009 CE LYS A 60 -0.655 19.873 -2.001 1.00 0.94 C ATOM 1010 NZ LYS A 60 -0.600 20.983 -2.989 1.00 1.50 N ATOM 0 H LYS A 60 -1.610 17.577 -1.928 1.00 0.40 H new ATOM 0 HA LYS A 60 -3.445 18.105 0.178 1.00 0.42 H new ATOM 0 HB2 LYS A 60 -3.124 18.848 -2.727 1.00 0.48 H new ATOM 0 HB3 LYS A 60 -4.652 19.178 -1.935 1.00 0.48 H new ATOM 0 HG2 LYS A 60 -3.120 21.130 -1.920 1.00 0.69 H new ATOM 0 HG3 LYS A 60 -3.585 20.624 -0.308 1.00 0.69 H new ATOM 0 HD2 LYS A 60 -1.198 21.126 -0.345 1.00 0.79 H new ATOM 0 HD3 LYS A 60 -1.430 19.414 -0.053 1.00 0.79 H new ATOM 0 HE2 LYS A 60 0.354 19.650 -1.654 1.00 0.94 H new ATOM 0 HE3 LYS A 60 -1.029 18.974 -2.491 1.00 0.94 H new ATOM 0 HZ1 LYS A 60 -1.109 20.705 -3.852 1.00 1.50 H new ATOM 0 HZ2 LYS A 60 -1.044 21.831 -2.583 1.00 1.50 H new ATOM 0 HZ3 LYS A 60 0.392 21.190 -3.223 1.00 1.50 H new ATOM 1024 N LEU A 61 -4.581 16.367 -2.421 1.00 0.40 N ATOM 1025 CA LEU A 61 -5.592 15.403 -2.840 1.00 0.40 C ATOM 1026 C LEU A 61 -5.527 14.137 -1.999 1.00 0.37 C ATOM 1027 O LEU A 61 -6.533 13.456 -1.809 1.00 0.42 O ATOM 1028 CB LEU A 61 -5.412 15.050 -4.314 1.00 0.42 C ATOM 1029 CG LEU A 61 -5.400 16.236 -5.283 1.00 0.45 C ATOM 1030 CD1 LEU A 61 -5.058 15.770 -6.690 1.00 0.57 C ATOM 1031 CD2 LEU A 61 -6.742 16.951 -5.275 1.00 0.52 C ATOM 0 H LEU A 61 -3.967 16.683 -3.172 1.00 0.40 H new ATOM 0 HA LEU A 61 -6.569 15.864 -2.696 1.00 0.40 H new ATOM 0 HB2 LEU A 61 -4.476 14.503 -4.426 1.00 0.42 H new ATOM 0 HB3 LEU A 61 -6.214 14.373 -4.607 1.00 0.42 H new ATOM 0 HG LEU A 61 -4.634 16.938 -4.953 1.00 0.45 H new ATOM 0 HD11 LEU A 61 -5.054 16.625 -7.366 1.00 0.57 H new ATOM 0 HD12 LEU A 61 -4.073 15.303 -6.689 1.00 0.57 H new ATOM 0 HD13 LEU A 61 -5.802 15.047 -7.025 1.00 0.57 H new ATOM 0 HD21 LEU A 61 -6.711 17.790 -5.970 1.00 0.52 H new ATOM 0 HD22 LEU A 61 -7.526 16.257 -5.578 1.00 0.52 H new ATOM 0 HD23 LEU A 61 -6.952 17.319 -4.271 1.00 0.52 H new ATOM 1043 N LEU A 62 -4.340 13.834 -1.486 1.00 0.32 N ATOM 1044 CA LEU A 62 -4.135 12.670 -0.644 1.00 0.31 C ATOM 1045 C LEU A 62 -4.848 12.859 0.689 1.00 0.34 C ATOM 1046 O LEU A 62 -5.565 11.978 1.165 1.00 0.36 O ATOM 1047 CB LEU A 62 -2.633 12.482 -0.438 1.00 0.31 C ATOM 1048 CG LEU A 62 -2.210 11.645 0.765 1.00 0.40 C ATOM 1049 CD1 LEU A 62 -1.373 10.470 0.301 1.00 0.65 C ATOM 1050 CD2 LEU A 62 -1.430 12.491 1.760 1.00 0.58 C ATOM 0 H LEU A 62 -3.498 14.388 -1.643 1.00 0.32 H new ATOM 0 HA LEU A 62 -4.549 11.781 -1.120 1.00 0.31 H new ATOM 0 HB2 LEU A 62 -2.221 12.022 -1.336 1.00 0.31 H new ATOM 0 HB3 LEU A 62 -2.175 13.467 -0.346 1.00 0.31 H new ATOM 0 HG LEU A 62 -3.104 11.271 1.265 1.00 0.40 H new ATOM 0 HD11 LEU A 62 -1.073 9.874 1.163 1.00 0.65 H new ATOM 0 HD12 LEU A 62 -1.959 9.853 -0.380 1.00 0.65 H new ATOM 0 HD13 LEU A 62 -0.485 10.837 -0.214 1.00 0.65 H new ATOM 0 HD21 LEU A 62 -1.138 11.875 2.611 1.00 0.58 H new ATOM 0 HD22 LEU A 62 -0.538 12.890 1.277 1.00 0.58 H new ATOM 0 HD23 LEU A 62 -2.055 13.314 2.106 1.00 0.58 H new ATOM 1062 N LYS A 63 -4.650 14.025 1.277 1.00 0.37 N ATOM 1063 CA LYS A 63 -5.268 14.368 2.548 1.00 0.43 C ATOM 1064 C LYS A 63 -6.756 14.687 2.367 1.00 0.46 C ATOM 1065 O LYS A 63 -7.514 14.742 3.338 1.00 0.52 O ATOM 1066 CB LYS A 63 -4.536 15.568 3.152 1.00 0.47 C ATOM 1067 CG LYS A 63 -4.887 15.846 4.599 1.00 1.14 C ATOM 1068 CD LYS A 63 -4.712 17.316 4.927 1.00 1.36 C ATOM 1069 CE LYS A 63 -5.354 17.676 6.253 1.00 1.86 C ATOM 1070 NZ LYS A 63 -5.930 19.046 6.229 1.00 2.13 N ATOM 0 H LYS A 63 -4.058 14.760 0.889 1.00 0.37 H new ATOM 0 HA LYS A 63 -5.192 13.515 3.222 1.00 0.43 H new ATOM 0 HB2 LYS A 63 -3.462 15.400 3.076 1.00 0.47 H new ATOM 0 HB3 LYS A 63 -4.762 16.454 2.558 1.00 0.47 H new ATOM 0 HG2 LYS A 63 -5.917 15.547 4.791 1.00 1.14 H new ATOM 0 HG3 LYS A 63 -4.254 15.246 5.252 1.00 1.14 H new ATOM 0 HD2 LYS A 63 -3.650 17.557 4.960 1.00 1.36 H new ATOM 0 HD3 LYS A 63 -5.152 17.921 4.134 1.00 1.36 H new ATOM 0 HE2 LYS A 63 -6.138 16.955 6.486 1.00 1.86 H new ATOM 0 HE3 LYS A 63 -4.611 17.607 7.048 1.00 1.86 H new ATOM 0 HZ1 LYS A 63 -6.360 19.258 7.152 1.00 2.13 H new ATOM 0 HZ2 LYS A 63 -5.177 19.736 6.031 1.00 2.13 H new ATOM 0 HZ3 LYS A 63 -6.656 19.104 5.487 1.00 2.13 H new ATOM 1084 N HIS A 64 -7.176 14.882 1.118 1.00 0.45 N ATOM 1085 CA HIS A 64 -8.569 15.210 0.806 1.00 0.51 C ATOM 1086 C HIS A 64 -9.485 13.998 0.926 1.00 0.38 C ATOM 1087 O HIS A 64 -10.705 14.143 0.973 1.00 0.37 O ATOM 1088 CB HIS A 64 -8.683 15.789 -0.612 1.00 0.69 C ATOM 1089 CG HIS A 64 -8.062 17.144 -0.769 1.00 0.96 C ATOM 1090 ND1 HIS A 64 -8.071 17.803 -1.974 1.00 1.60 N ATOM 1091 CD2 HIS A 64 -7.425 17.910 0.146 1.00 0.76 C ATOM 1092 CE1 HIS A 64 -7.448 18.949 -1.765 1.00 1.71 C ATOM 1093 NE2 HIS A 64 -7.044 19.062 -0.493 1.00 1.18 N ATOM 0 H HIS A 64 -6.569 14.818 0.301 1.00 0.45 H new ATOM 0 HA HIS A 64 -8.888 15.953 1.537 1.00 0.51 H new ATOM 0 HB2 HIS A 64 -8.211 15.101 -1.313 1.00 0.69 H new ATOM 0 HB3 HIS A 64 -9.737 15.850 -0.885 1.00 0.69 H new ATOM 0 HD2 HIS A 64 -7.250 17.662 1.182 1.00 0.76 H new ATOM 0 HE1 HIS A 64 -7.285 19.700 -2.524 1.00 1.71 H new ATOM 0 HE2 HIS A 64 -6.549 19.852 -0.080 1.00 1.18 H new ATOM 1101 N VAL A 65 -8.898 12.810 0.977 1.00 0.36 N ATOM 1102 CA VAL A 65 -9.682 11.579 1.095 1.00 0.35 C ATOM 1103 C VAL A 65 -10.150 11.356 2.537 1.00 0.37 C ATOM 1104 O VAL A 65 -11.173 10.716 2.780 1.00 0.43 O ATOM 1105 CB VAL A 65 -8.899 10.331 0.589 1.00 0.41 C ATOM 1106 CG1 VAL A 65 -8.267 10.611 -0.768 1.00 1.04 C ATOM 1107 CG2 VAL A 65 -7.844 9.894 1.592 1.00 1.09 C ATOM 0 H VAL A 65 -7.889 12.668 0.939 1.00 0.36 H new ATOM 0 HA VAL A 65 -10.556 11.705 0.456 1.00 0.35 H new ATOM 0 HB VAL A 65 -9.611 9.513 0.479 1.00 0.41 H new ATOM 0 HG11 VAL A 65 -7.724 9.728 -1.106 1.00 1.04 H new ATOM 0 HG12 VAL A 65 -9.047 10.855 -1.489 1.00 1.04 H new ATOM 0 HG13 VAL A 65 -7.577 11.450 -0.682 1.00 1.04 H new ATOM 0 HG21 VAL A 65 -7.316 9.021 1.208 1.00 1.09 H new ATOM 0 HG22 VAL A 65 -7.135 10.706 1.751 1.00 1.09 H new ATOM 0 HG23 VAL A 65 -8.324 9.641 2.538 1.00 1.09 H new ATOM 1117 N LEU A 66 -9.393 11.899 3.482 1.00 0.41 N ATOM 1118 CA LEU A 66 -9.689 11.761 4.909 1.00 0.52 C ATOM 1119 C LEU A 66 -11.040 12.378 5.333 1.00 0.51 C ATOM 1120 O LEU A 66 -11.774 11.741 6.094 1.00 0.56 O ATOM 1121 CB LEU A 66 -8.554 12.374 5.739 1.00 0.67 C ATOM 1122 CG LEU A 66 -7.152 11.856 5.412 1.00 0.86 C ATOM 1123 CD1 LEU A 66 -6.100 12.621 6.205 1.00 1.65 C ATOM 1124 CD2 LEU A 66 -7.049 10.364 5.690 1.00 0.83 C ATOM 0 H LEU A 66 -8.556 12.448 3.285 1.00 0.41 H new ATOM 0 HA LEU A 66 -9.770 10.691 5.100 1.00 0.52 H new ATOM 0 HB2 LEU A 66 -8.566 13.455 5.599 1.00 0.67 H new ATOM 0 HB3 LEU A 66 -8.756 12.187 6.794 1.00 0.67 H new ATOM 0 HG LEU A 66 -6.969 12.018 4.350 1.00 0.86 H new ATOM 0 HD11 LEU A 66 -5.109 12.238 5.959 1.00 1.65 H new ATOM 0 HD12 LEU A 66 -6.153 13.680 5.953 1.00 1.65 H new ATOM 0 HD13 LEU A 66 -6.284 12.493 7.272 1.00 1.65 H new ATOM 0 HD21 LEU A 66 -6.044 10.018 5.450 1.00 0.83 H new ATOM 0 HD22 LEU A 66 -7.256 10.175 6.743 1.00 0.83 H new ATOM 0 HD23 LEU A 66 -7.773 9.829 5.076 1.00 0.83 H new ATOM 1136 N PRO A 67 -11.384 13.622 4.893 1.00 0.50 N ATOM 1137 CA PRO A 67 -12.655 14.279 5.264 1.00 0.53 C ATOM 1138 C PRO A 67 -13.878 13.376 5.120 1.00 0.46 C ATOM 1139 O PRO A 67 -14.659 13.225 6.063 1.00 0.54 O ATOM 1140 CB PRO A 67 -12.747 15.443 4.283 1.00 0.58 C ATOM 1141 CG PRO A 67 -11.338 15.785 3.962 1.00 0.68 C ATOM 1142 CD PRO A 67 -10.569 14.494 4.023 1.00 0.55 C ATOM 0 HA PRO A 67 -12.654 14.569 6.315 1.00 0.53 H new ATOM 0 HB2 PRO A 67 -13.299 15.161 3.386 1.00 0.58 H new ATOM 0 HB3 PRO A 67 -13.269 16.292 4.725 1.00 0.58 H new ATOM 0 HG2 PRO A 67 -11.263 16.237 2.973 1.00 0.68 H new ATOM 0 HG3 PRO A 67 -10.941 16.509 4.674 1.00 0.68 H new ATOM 0 HD2 PRO A 67 -10.443 14.060 3.031 1.00 0.55 H new ATOM 0 HD3 PRO A 67 -9.571 14.645 4.435 1.00 0.55 H new ATOM 1150 N ASN A 68 -14.046 12.781 3.950 1.00 0.38 N ATOM 1151 CA ASN A 68 -15.174 11.899 3.726 1.00 0.43 C ATOM 1152 C ASN A 68 -14.828 10.836 2.706 1.00 0.40 C ATOM 1153 O ASN A 68 -14.219 11.124 1.685 1.00 0.35 O ATOM 1154 CB ASN A 68 -16.397 12.688 3.274 1.00 0.53 C ATOM 1155 CG ASN A 68 -17.695 11.985 3.613 1.00 0.99 C ATOM 1156 OD1 ASN A 68 -18.217 11.204 2.820 1.00 1.73 O ATOM 1157 ND2 ASN A 68 -18.227 12.267 4.796 1.00 1.40 N ATOM 0 H ASN A 68 -13.422 12.892 3.151 1.00 0.38 H new ATOM 0 HA ASN A 68 -15.411 11.409 4.670 1.00 0.43 H new ATOM 0 HB2 ASN A 68 -16.386 13.671 3.744 1.00 0.53 H new ATOM 0 HB3 ASN A 68 -16.345 12.849 2.197 1.00 0.53 H new ATOM 0 HD21 ASN A 68 -19.104 11.829 5.078 1.00 1.40 H new ATOM 0 HD22 ASN A 68 -17.759 12.922 5.423 1.00 1.40 H new ATOM 1164 N ILE A 69 -15.218 9.610 3.001 1.00 0.46 N ATOM 1165 CA ILE A 69 -14.958 8.472 2.133 1.00 0.48 C ATOM 1166 C ILE A 69 -16.183 7.562 2.123 1.00 0.58 C ATOM 1167 O ILE A 69 -16.723 7.233 3.179 1.00 0.79 O ATOM 1168 CB ILE A 69 -13.695 7.689 2.579 1.00 0.56 C ATOM 1169 CG1 ILE A 69 -13.485 6.448 1.706 1.00 0.60 C ATOM 1170 CG2 ILE A 69 -13.784 7.303 4.051 1.00 0.70 C ATOM 1171 CD1 ILE A 69 -12.127 5.800 1.893 1.00 0.71 C ATOM 0 H ILE A 69 -15.726 9.372 3.853 1.00 0.46 H new ATOM 0 HA ILE A 69 -14.766 8.838 1.125 1.00 0.48 H new ATOM 0 HB ILE A 69 -12.833 8.344 2.452 1.00 0.56 H new ATOM 0 HG12 ILE A 69 -14.262 5.718 1.933 1.00 0.60 H new ATOM 0 HG13 ILE A 69 -13.605 6.726 0.659 1.00 0.60 H new ATOM 0 HG21 ILE A 69 -12.887 6.755 4.338 1.00 0.70 H new ATOM 0 HG22 ILE A 69 -13.870 8.204 4.659 1.00 0.70 H new ATOM 0 HG23 ILE A 69 -14.660 6.674 4.210 1.00 0.70 H new ATOM 0 HD11 ILE A 69 -12.048 4.928 1.244 1.00 0.71 H new ATOM 0 HD12 ILE A 69 -11.345 6.515 1.638 1.00 0.71 H new ATOM 0 HD13 ILE A 69 -12.011 5.491 2.932 1.00 0.71 H new ATOM 1183 N ARG A 70 -16.648 7.192 0.939 1.00 0.48 N ATOM 1184 CA ARG A 70 -17.822 6.339 0.813 1.00 0.61 C ATOM 1185 C ARG A 70 -17.582 5.233 -0.213 1.00 0.41 C ATOM 1186 O ARG A 70 -16.623 5.274 -0.988 1.00 0.34 O ATOM 1187 CB ARG A 70 -19.060 7.152 0.392 1.00 0.82 C ATOM 1188 CG ARG A 70 -19.313 8.408 1.219 1.00 1.23 C ATOM 1189 CD ARG A 70 -20.690 8.985 0.926 1.00 1.41 C ATOM 1190 NE ARG A 70 -20.755 10.435 1.131 1.00 1.74 N ATOM 1191 CZ ARG A 70 -21.371 11.020 2.157 1.00 2.19 C ATOM 1192 NH1 ARG A 70 -21.940 10.291 3.110 1.00 2.55 N ATOM 1193 NH2 ARG A 70 -21.418 12.341 2.229 1.00 2.92 N ATOM 0 H ARG A 70 -16.230 7.469 0.051 1.00 0.48 H new ATOM 0 HA ARG A 70 -18.003 5.895 1.792 1.00 0.61 H new ATOM 0 HB2 ARG A 70 -18.950 7.439 -0.654 1.00 0.82 H new ATOM 0 HB3 ARG A 70 -19.938 6.509 0.456 1.00 0.82 H new ATOM 0 HG2 ARG A 70 -19.232 8.172 2.280 1.00 1.23 H new ATOM 0 HG3 ARG A 70 -18.548 9.153 0.999 1.00 1.23 H new ATOM 0 HD2 ARG A 70 -20.963 8.756 -0.104 1.00 1.41 H new ATOM 0 HD3 ARG A 70 -21.426 8.499 1.566 1.00 1.41 H new ATOM 0 HE ARG A 70 -20.299 11.035 0.443 1.00 1.74 H new ATOM 0 HH11 ARG A 70 -21.908 9.273 3.061 1.00 2.55 H new ATOM 0 HH12 ARG A 70 -22.409 10.749 3.891 1.00 2.55 H new ATOM 0 HH21 ARG A 70 -20.983 12.907 1.500 1.00 2.92 H new ATOM 0 HH22 ARG A 70 -21.889 12.793 3.013 1.00 2.92 H new ATOM 1207 N ILE A 71 -18.462 4.244 -0.199 1.00 0.62 N ATOM 1208 CA ILE A 71 -18.391 3.124 -1.126 1.00 0.48 C ATOM 1209 C ILE A 71 -19.786 2.848 -1.673 1.00 0.45 C ATOM 1210 O ILE A 71 -20.776 2.987 -0.951 1.00 0.58 O ATOM 1211 CB ILE A 71 -17.841 1.841 -0.459 1.00 0.56 C ATOM 1212 CG1 ILE A 71 -16.535 2.129 0.285 1.00 0.96 C ATOM 1213 CG2 ILE A 71 -17.628 0.753 -1.503 1.00 0.76 C ATOM 1214 CD1 ILE A 71 -16.066 0.977 1.143 1.00 1.09 C ATOM 0 H ILE A 71 -19.244 4.194 0.454 1.00 0.62 H new ATOM 0 HA ILE A 71 -17.703 3.396 -1.927 1.00 0.48 H new ATOM 0 HB ILE A 71 -18.575 1.492 0.267 1.00 0.56 H new ATOM 0 HG12 ILE A 71 -15.758 2.372 -0.440 1.00 0.96 H new ATOM 0 HG13 ILE A 71 -16.670 3.009 0.914 1.00 0.96 H new ATOM 0 HG21 ILE A 71 -17.241 -0.144 -1.020 1.00 0.76 H new ATOM 0 HG22 ILE A 71 -18.577 0.523 -1.988 1.00 0.76 H new ATOM 0 HG23 ILE A 71 -16.914 1.100 -2.250 1.00 0.76 H new ATOM 0 HD11 ILE A 71 -15.136 1.250 1.641 1.00 1.09 H new ATOM 0 HD12 ILE A 71 -16.825 0.748 1.891 1.00 1.09 H new ATOM 0 HD13 ILE A 71 -15.899 0.101 0.516 1.00 1.09 H new ATOM 1226 N LYS A 72 -19.868 2.471 -2.942 1.00 0.38 N ATOM 1227 CA LYS A 72 -21.156 2.206 -3.580 1.00 0.47 C ATOM 1228 C LYS A 72 -21.831 0.950 -3.024 1.00 0.43 C ATOM 1229 O LYS A 72 -21.417 -0.171 -3.322 1.00 0.49 O ATOM 1230 CB LYS A 72 -20.988 2.056 -5.100 1.00 0.64 C ATOM 1231 CG LYS A 72 -20.260 3.215 -5.767 1.00 0.87 C ATOM 1232 CD LYS A 72 -21.182 4.401 -6.014 1.00 1.57 C ATOM 1233 CE LYS A 72 -21.179 5.371 -4.843 1.00 1.96 C ATOM 1234 NZ LYS A 72 -22.408 6.199 -4.817 1.00 2.63 N ATOM 0 H LYS A 72 -19.060 2.341 -3.551 1.00 0.38 H new ATOM 0 HA LYS A 72 -21.794 3.062 -3.360 1.00 0.47 H new ATOM 0 HB2 LYS A 72 -20.443 1.134 -5.304 1.00 0.64 H new ATOM 0 HB3 LYS A 72 -21.973 1.951 -5.554 1.00 0.64 H new ATOM 0 HG2 LYS A 72 -19.426 3.529 -5.139 1.00 0.87 H new ATOM 0 HG3 LYS A 72 -19.838 2.881 -6.715 1.00 0.87 H new ATOM 0 HD2 LYS A 72 -20.869 4.922 -6.919 1.00 1.57 H new ATOM 0 HD3 LYS A 72 -22.197 4.043 -6.187 1.00 1.57 H new ATOM 0 HE2 LYS A 72 -21.095 4.815 -3.909 1.00 1.96 H new ATOM 0 HE3 LYS A 72 -20.305 6.019 -4.908 1.00 1.96 H new ATOM 0 HZ1 LYS A 72 -22.372 6.849 -4.006 1.00 2.63 H new ATOM 0 HZ2 LYS A 72 -22.475 6.748 -5.698 1.00 2.63 H new ATOM 0 HZ3 LYS A 72 -23.241 5.582 -4.729 1.00 2.63 H new ATOM 1248 N GLY A 73 -22.872 1.156 -2.216 1.00 0.46 N ATOM 1249 CA GLY A 73 -23.640 0.044 -1.667 1.00 0.53 C ATOM 1250 C GLY A 73 -22.895 -0.844 -0.677 1.00 0.47 C ATOM 1251 O GLY A 73 -23.153 -2.050 -0.615 1.00 0.52 O ATOM 0 H GLY A 73 -23.199 2.079 -1.930 1.00 0.46 H new ATOM 0 HA2 GLY A 73 -24.525 0.445 -1.173 1.00 0.53 H new ATOM 0 HA3 GLY A 73 -23.989 -0.576 -2.493 1.00 0.53 H new ATOM 1255 N LEU A 74 -21.981 -0.284 0.093 1.00 0.40 N ATOM 1256 CA LEU A 74 -21.226 -1.083 1.053 1.00 0.36 C ATOM 1257 C LEU A 74 -21.291 -0.517 2.468 1.00 0.34 C ATOM 1258 O LEU A 74 -21.542 0.674 2.660 1.00 0.35 O ATOM 1259 CB LEU A 74 -19.769 -1.170 0.625 1.00 0.38 C ATOM 1260 CG LEU A 74 -19.261 -2.581 0.335 1.00 0.47 C ATOM 1261 CD1 LEU A 74 -19.614 -2.993 -1.082 1.00 0.70 C ATOM 1262 CD2 LEU A 74 -17.764 -2.648 0.565 1.00 0.56 C ATOM 0 H LEU A 74 -21.742 0.707 0.077 1.00 0.40 H new ATOM 0 HA LEU A 74 -21.683 -2.072 1.066 1.00 0.36 H new ATOM 0 HB2 LEU A 74 -19.632 -0.561 -0.268 1.00 0.38 H new ATOM 0 HB3 LEU A 74 -19.150 -0.732 1.408 1.00 0.38 H new ATOM 0 HG LEU A 74 -19.746 -3.280 1.016 1.00 0.47 H new ATOM 0 HD11 LEU A 74 -19.244 -4.001 -1.271 1.00 0.70 H new ATOM 0 HD12 LEU A 74 -20.697 -2.974 -1.207 1.00 0.70 H new ATOM 0 HD13 LEU A 74 -19.155 -2.300 -1.787 1.00 0.70 H new ATOM 0 HD21 LEU A 74 -17.409 -3.657 0.356 1.00 0.56 H new ATOM 0 HD22 LEU A 74 -17.262 -1.942 -0.097 1.00 0.56 H new ATOM 0 HD23 LEU A 74 -17.543 -2.393 1.601 1.00 0.56 H new ATOM 1274 N SER A 75 -21.067 -1.383 3.458 1.00 0.33 N ATOM 1275 CA SER A 75 -21.057 -0.978 4.858 1.00 0.33 C ATOM 1276 C SER A 75 -19.607 -0.892 5.317 1.00 0.31 C ATOM 1277 O SER A 75 -18.834 -1.811 5.052 1.00 0.35 O ATOM 1278 CB SER A 75 -21.818 -2.001 5.706 1.00 0.37 C ATOM 1279 OG SER A 75 -22.590 -2.867 4.885 1.00 0.99 O ATOM 0 H SER A 75 -20.889 -2.376 3.310 1.00 0.33 H new ATOM 0 HA SER A 75 -21.545 -0.010 4.973 1.00 0.33 H new ATOM 0 HB2 SER A 75 -21.113 -2.586 6.297 1.00 0.37 H new ATOM 0 HB3 SER A 75 -22.470 -1.483 6.409 1.00 0.37 H new ATOM 0 HG SER A 75 -21.996 -3.493 4.420 1.00 0.99 H new ATOM 1285 N PHE A 76 -19.216 0.193 5.980 1.00 0.32 N ATOM 1286 CA PHE A 76 -17.830 0.331 6.410 1.00 0.31 C ATOM 1287 C PHE A 76 -17.684 1.074 7.740 1.00 0.32 C ATOM 1288 O PHE A 76 -18.658 1.581 8.301 1.00 0.38 O ATOM 1289 CB PHE A 76 -17.024 1.057 5.328 1.00 0.32 C ATOM 1290 CG PHE A 76 -17.737 2.239 4.739 1.00 0.35 C ATOM 1291 CD1 PHE A 76 -18.559 2.081 3.640 1.00 1.24 C ATOM 1292 CD2 PHE A 76 -17.589 3.503 5.287 1.00 1.26 C ATOM 1293 CE1 PHE A 76 -19.224 3.161 3.096 1.00 1.28 C ATOM 1294 CE2 PHE A 76 -18.251 4.586 4.750 1.00 1.29 C ATOM 1295 CZ PHE A 76 -19.068 4.418 3.653 1.00 0.53 C ATOM 0 H PHE A 76 -19.825 0.973 6.227 1.00 0.32 H new ATOM 0 HA PHE A 76 -17.446 -0.677 6.564 1.00 0.31 H new ATOM 0 HB2 PHE A 76 -16.077 1.390 5.754 1.00 0.32 H new ATOM 0 HB3 PHE A 76 -16.785 0.353 4.531 1.00 0.32 H new ATOM 0 HD1 PHE A 76 -18.683 1.102 3.202 1.00 1.24 H new ATOM 0 HD2 PHE A 76 -16.948 3.641 6.145 1.00 1.26 H new ATOM 0 HE1 PHE A 76 -19.865 3.025 2.237 1.00 1.28 H new ATOM 0 HE2 PHE A 76 -18.130 5.565 5.189 1.00 1.29 H new ATOM 0 HZ PHE A 76 -19.585 5.266 3.229 1.00 0.53 H new ATOM 1305 N SER A 77 -16.453 1.099 8.241 1.00 0.30 N ATOM 1306 CA SER A 77 -16.106 1.794 9.478 1.00 0.32 C ATOM 1307 C SER A 77 -14.742 2.452 9.295 1.00 0.30 C ATOM 1308 O SER A 77 -13.857 1.851 8.693 1.00 0.29 O ATOM 1309 CB SER A 77 -16.092 0.822 10.656 1.00 0.36 C ATOM 1310 OG SER A 77 -17.366 0.219 10.831 1.00 1.18 O ATOM 0 H SER A 77 -15.661 0.634 7.797 1.00 0.30 H new ATOM 0 HA SER A 77 -16.852 2.557 9.697 1.00 0.32 H new ATOM 0 HB2 SER A 77 -15.340 0.051 10.487 1.00 0.36 H new ATOM 0 HB3 SER A 77 -15.808 1.351 11.566 1.00 0.36 H new ATOM 0 HG SER A 77 -17.333 -0.401 11.590 1.00 1.18 H new ATOM 1316 N VAL A 78 -14.558 3.659 9.835 1.00 0.32 N ATOM 1317 CA VAL A 78 -13.309 4.403 9.641 1.00 0.33 C ATOM 1318 C VAL A 78 -12.416 4.423 10.885 1.00 0.34 C ATOM 1319 O VAL A 78 -12.796 4.958 11.928 1.00 0.38 O ATOM 1320 CB VAL A 78 -13.599 5.864 9.232 1.00 0.38 C ATOM 1321 CG1 VAL A 78 -12.307 6.605 8.908 1.00 0.41 C ATOM 1322 CG2 VAL A 78 -14.557 5.915 8.052 1.00 0.40 C ATOM 0 H VAL A 78 -15.252 4.140 10.407 1.00 0.32 H new ATOM 0 HA VAL A 78 -12.777 3.876 8.849 1.00 0.33 H new ATOM 0 HB VAL A 78 -14.073 6.362 10.078 1.00 0.38 H new ATOM 0 HG11 VAL A 78 -12.538 7.631 8.623 1.00 0.41 H new ATOM 0 HG12 VAL A 78 -11.660 6.609 9.785 1.00 0.41 H new ATOM 0 HG13 VAL A 78 -11.798 6.105 8.084 1.00 0.41 H new ATOM 0 HG21 VAL A 78 -14.746 6.954 7.782 1.00 0.40 H new ATOM 0 HG22 VAL A 78 -14.116 5.394 7.202 1.00 0.40 H new ATOM 0 HG23 VAL A 78 -15.496 5.434 8.325 1.00 0.40 H new ATOM 1332 N LYS A 79 -11.235 3.828 10.769 1.00 0.32 N ATOM 1333 CA LYS A 79 -10.259 3.807 11.846 1.00 0.34 C ATOM 1334 C LYS A 79 -8.936 4.387 11.342 1.00 0.34 C ATOM 1335 O LYS A 79 -8.654 4.372 10.142 1.00 0.33 O ATOM 1336 CB LYS A 79 -10.040 2.384 12.378 1.00 0.35 C ATOM 1337 CG LYS A 79 -10.869 2.061 13.611 1.00 0.48 C ATOM 1338 CD LYS A 79 -12.341 1.899 13.264 1.00 0.69 C ATOM 1339 CE LYS A 79 -13.233 2.565 14.298 1.00 0.89 C ATOM 1340 NZ LYS A 79 -12.989 2.038 15.671 1.00 1.48 N ATOM 0 H LYS A 79 -10.929 3.346 9.924 1.00 0.32 H new ATOM 0 HA LYS A 79 -10.641 4.413 12.668 1.00 0.34 H new ATOM 0 HB2 LYS A 79 -10.281 1.670 11.591 1.00 0.35 H new ATOM 0 HB3 LYS A 79 -8.984 2.252 12.615 1.00 0.35 H new ATOM 0 HG2 LYS A 79 -10.499 1.144 14.070 1.00 0.48 H new ATOM 0 HG3 LYS A 79 -10.753 2.856 14.348 1.00 0.48 H new ATOM 0 HD2 LYS A 79 -12.534 2.332 12.282 1.00 0.69 H new ATOM 0 HD3 LYS A 79 -12.586 0.839 13.199 1.00 0.69 H new ATOM 0 HE2 LYS A 79 -13.059 3.641 14.287 1.00 0.89 H new ATOM 0 HE3 LYS A 79 -14.278 2.408 14.030 1.00 0.89 H new ATOM 0 HZ1 LYS A 79 -13.726 2.390 16.314 1.00 1.48 H new ATOM 0 HZ2 LYS A 79 -13.013 0.998 15.653 1.00 1.48 H new ATOM 0 HZ3 LYS A 79 -12.057 2.357 16.005 1.00 1.48 H new ATOM 1354 N VAL A 80 -8.129 4.893 12.247 1.00 0.38 N ATOM 1355 CA VAL A 80 -6.844 5.462 11.879 1.00 0.40 C ATOM 1356 C VAL A 80 -5.720 4.598 12.455 1.00 0.41 C ATOM 1357 O VAL A 80 -5.940 3.851 13.413 1.00 0.43 O ATOM 1358 CB VAL A 80 -6.729 6.920 12.371 1.00 0.48 C ATOM 1359 CG1 VAL A 80 -6.728 6.952 13.879 1.00 1.43 C ATOM 1360 CG2 VAL A 80 -5.493 7.610 11.802 1.00 1.30 C ATOM 0 H VAL A 80 -8.336 4.924 13.245 1.00 0.38 H new ATOM 0 HA VAL A 80 -6.758 5.475 10.793 1.00 0.40 H new ATOM 0 HB VAL A 80 -7.595 7.474 12.009 1.00 0.48 H new ATOM 0 HG11 VAL A 80 -6.647 7.984 14.221 1.00 1.43 H new ATOM 0 HG12 VAL A 80 -7.655 6.518 14.253 1.00 1.43 H new ATOM 0 HG13 VAL A 80 -5.881 6.377 14.255 1.00 1.43 H new ATOM 0 HG21 VAL A 80 -5.446 8.635 12.171 1.00 1.30 H new ATOM 0 HG22 VAL A 80 -4.599 7.071 12.115 1.00 1.30 H new ATOM 0 HG23 VAL A 80 -5.550 7.618 10.714 1.00 1.30 H new ATOM 1370 N CYS A 81 -4.528 4.689 11.884 1.00 0.42 N ATOM 1371 CA CYS A 81 -3.405 3.897 12.355 1.00 0.46 C ATOM 1372 C CYS A 81 -2.093 4.683 12.259 1.00 0.49 C ATOM 1373 O CYS A 81 -1.632 5.040 11.173 1.00 0.45 O ATOM 1374 CB CYS A 81 -3.309 2.585 11.572 1.00 0.47 C ATOM 1375 SG CYS A 81 -1.960 1.504 12.106 1.00 0.89 S ATOM 0 H CYS A 81 -4.315 5.302 11.097 1.00 0.42 H new ATOM 0 HA CYS A 81 -3.576 3.662 13.406 1.00 0.46 H new ATOM 0 HB2 CYS A 81 -4.252 2.047 11.669 1.00 0.47 H new ATOM 0 HB3 CYS A 81 -3.180 2.814 10.514 1.00 0.47 H new ATOM 0 HG CYS A 81 -1.962 0.421 11.387 1.00 0.89 H new ATOM 1381 N GLY A 82 -1.492 4.965 13.397 1.00 0.67 N ATOM 1382 CA GLY A 82 -0.251 5.701 13.392 1.00 0.76 C ATOM 1383 C GLY A 82 -0.414 7.107 12.860 1.00 0.76 C ATOM 1384 O GLY A 82 -1.397 7.785 13.158 1.00 0.88 O ATOM 0 H GLY A 82 -1.837 4.700 14.320 1.00 0.67 H new ATOM 0 HA2 GLY A 82 0.147 5.743 14.406 1.00 0.76 H new ATOM 0 HA3 GLY A 82 0.481 5.169 12.785 1.00 0.76 H new ATOM 1388 N GLU A 83 0.562 7.549 12.089 1.00 0.76 N ATOM 1389 CA GLU A 83 0.539 8.877 11.509 1.00 0.82 C ATOM 1390 C GLU A 83 -0.023 8.878 10.082 1.00 0.69 C ATOM 1391 O GLU A 83 -0.871 9.702 9.743 1.00 0.89 O ATOM 1392 CB GLU A 83 1.958 9.449 11.497 1.00 1.01 C ATOM 1393 CG GLU A 83 2.733 9.175 12.772 1.00 1.35 C ATOM 1394 CD GLU A 83 3.663 7.988 12.637 1.00 1.90 C ATOM 1395 OE1 GLU A 83 3.176 6.843 12.710 1.00 2.50 O ATOM 1396 OE2 GLU A 83 4.879 8.192 12.466 1.00 2.46 O ATOM 0 H GLU A 83 1.388 7.001 11.849 1.00 0.76 H new ATOM 0 HA GLU A 83 -0.118 9.494 12.122 1.00 0.82 H new ATOM 0 HB2 GLU A 83 2.503 9.028 10.652 1.00 1.01 H new ATOM 0 HB3 GLU A 83 1.905 10.526 11.338 1.00 1.01 H new ATOM 0 HG2 GLU A 83 3.312 10.059 13.039 1.00 1.35 H new ATOM 0 HG3 GLU A 83 2.033 8.994 13.588 1.00 1.35 H new ATOM 1403 N ARG A 84 0.458 7.966 9.241 1.00 0.58 N ATOM 1404 CA ARG A 84 0.021 7.920 7.846 1.00 0.72 C ATOM 1405 C ARG A 84 -0.767 6.658 7.497 1.00 0.64 C ATOM 1406 O ARG A 84 -1.209 6.502 6.363 1.00 0.81 O ATOM 1407 CB ARG A 84 1.239 8.017 6.932 1.00 0.98 C ATOM 1408 CG ARG A 84 2.086 9.260 7.154 1.00 1.09 C ATOM 1409 CD ARG A 84 1.381 10.514 6.664 1.00 1.37 C ATOM 1410 NE ARG A 84 0.625 11.178 7.730 1.00 1.46 N ATOM 1411 CZ ARG A 84 0.933 12.375 8.235 1.00 2.05 C ATOM 1412 NH1 ARG A 84 1.992 13.041 7.780 1.00 2.51 N ATOM 1413 NH2 ARG A 84 0.175 12.910 9.191 1.00 2.36 N ATOM 0 H ARG A 84 1.144 7.255 9.496 1.00 0.58 H new ATOM 0 HA ARG A 84 -0.651 8.765 7.700 1.00 0.72 H new ATOM 0 HB2 ARG A 84 1.862 7.135 7.080 1.00 0.98 H new ATOM 0 HB3 ARG A 84 0.904 8.000 5.895 1.00 0.98 H new ATOM 0 HG2 ARG A 84 2.313 9.361 8.215 1.00 1.09 H new ATOM 0 HG3 ARG A 84 3.037 9.150 6.633 1.00 1.09 H new ATOM 0 HD2 ARG A 84 2.117 11.207 6.258 1.00 1.37 H new ATOM 0 HD3 ARG A 84 0.705 10.254 5.850 1.00 1.37 H new ATOM 0 HE ARG A 84 -0.189 10.695 8.110 1.00 1.46 H new ATOM 0 HH11 ARG A 84 2.571 12.637 7.044 1.00 2.51 H new ATOM 0 HH12 ARG A 84 2.225 13.955 8.168 1.00 2.51 H new ATOM 0 HH21 ARG A 84 -0.641 12.405 9.537 1.00 2.36 H new ATOM 0 HH22 ARG A 84 0.411 13.824 9.577 1.00 2.36 H new ATOM 1427 N LYS A 85 -0.934 5.754 8.444 1.00 0.46 N ATOM 1428 CA LYS A 85 -1.668 4.528 8.167 1.00 0.41 C ATOM 1429 C LYS A 85 -3.143 4.688 8.537 1.00 0.38 C ATOM 1430 O LYS A 85 -3.497 5.476 9.418 1.00 0.39 O ATOM 1431 CB LYS A 85 -1.030 3.350 8.910 1.00 0.42 C ATOM 1432 CG LYS A 85 0.494 3.323 8.799 1.00 0.55 C ATOM 1433 CD LYS A 85 1.134 2.522 9.926 1.00 0.88 C ATOM 1434 CE LYS A 85 1.044 1.024 9.679 1.00 1.17 C ATOM 1435 NZ LYS A 85 2.211 0.507 8.908 1.00 1.22 N ATOM 0 H LYS A 85 -0.579 5.840 9.397 1.00 0.46 H new ATOM 0 HA LYS A 85 -1.617 4.321 7.098 1.00 0.41 H new ATOM 0 HB2 LYS A 85 -1.310 3.398 9.962 1.00 0.42 H new ATOM 0 HB3 LYS A 85 -1.433 2.418 8.514 1.00 0.42 H new ATOM 0 HG2 LYS A 85 0.780 2.892 7.840 1.00 0.55 H new ATOM 0 HG3 LYS A 85 0.877 4.343 8.817 1.00 0.55 H new ATOM 0 HD2 LYS A 85 2.180 2.811 10.028 1.00 0.88 H new ATOM 0 HD3 LYS A 85 0.643 2.765 10.868 1.00 0.88 H new ATOM 0 HE2 LYS A 85 0.983 0.503 10.635 1.00 1.17 H new ATOM 0 HE3 LYS A 85 0.125 0.802 9.136 1.00 1.17 H new ATOM 0 HZ1 LYS A 85 2.233 -0.531 8.966 1.00 1.22 H new ATOM 0 HZ2 LYS A 85 2.125 0.797 7.913 1.00 1.22 H new ATOM 0 HZ3 LYS A 85 3.090 0.895 9.307 1.00 1.22 H new ATOM 1449 N CYS A 86 -4.008 3.992 7.826 1.00 0.36 N ATOM 1450 CA CYS A 86 -5.428 4.057 8.095 1.00 0.34 C ATOM 1451 C CYS A 86 -6.016 2.654 8.062 1.00 0.32 C ATOM 1452 O CYS A 86 -5.507 1.772 7.368 1.00 0.32 O ATOM 1453 CB CYS A 86 -6.129 4.968 7.088 1.00 0.38 C ATOM 1454 SG CYS A 86 -5.607 6.697 7.175 1.00 1.14 S ATOM 0 H CYS A 86 -3.750 3.374 7.056 1.00 0.36 H new ATOM 0 HA CYS A 86 -5.584 4.481 9.087 1.00 0.34 H new ATOM 0 HB2 CYS A 86 -5.942 4.593 6.082 1.00 0.38 H new ATOM 0 HB3 CYS A 86 -7.205 4.915 7.253 1.00 0.38 H new ATOM 0 HG CYS A 86 -4.706 6.832 8.103 1.00 1.14 H new ATOM 1460 N VAL A 87 -7.076 2.439 8.818 1.00 0.32 N ATOM 1461 CA VAL A 87 -7.708 1.129 8.867 1.00 0.34 C ATOM 1462 C VAL A 87 -9.208 1.262 8.675 1.00 0.32 C ATOM 1463 O VAL A 87 -9.842 2.117 9.278 1.00 0.36 O ATOM 1464 CB VAL A 87 -7.427 0.411 10.207 1.00 0.40 C ATOM 1465 CG1 VAL A 87 -8.187 -0.905 10.290 1.00 0.80 C ATOM 1466 CG2 VAL A 87 -5.936 0.172 10.387 1.00 0.95 C ATOM 0 H VAL A 87 -7.517 3.148 9.404 1.00 0.32 H new ATOM 0 HA VAL A 87 -7.283 0.532 8.060 1.00 0.34 H new ATOM 0 HB VAL A 87 -7.774 1.058 11.012 1.00 0.40 H new ATOM 0 HG11 VAL A 87 -7.972 -1.390 11.242 1.00 0.80 H new ATOM 0 HG12 VAL A 87 -9.257 -0.713 10.214 1.00 0.80 H new ATOM 0 HG13 VAL A 87 -7.877 -1.556 9.473 1.00 0.80 H new ATOM 0 HG21 VAL A 87 -5.761 -0.334 11.336 1.00 0.95 H new ATOM 0 HG22 VAL A 87 -5.566 -0.449 9.571 1.00 0.95 H new ATOM 0 HG23 VAL A 87 -5.411 1.127 10.383 1.00 0.95 H new ATOM 1476 N LEU A 88 -9.773 0.436 7.827 1.00 0.30 N ATOM 1477 CA LEU A 88 -11.198 0.475 7.592 1.00 0.31 C ATOM 1478 C LEU A 88 -11.778 -0.923 7.655 1.00 0.30 C ATOM 1479 O LEU A 88 -11.075 -1.915 7.483 1.00 0.33 O ATOM 1480 CB LEU A 88 -11.522 1.128 6.247 1.00 0.33 C ATOM 1481 CG LEU A 88 -12.300 2.447 6.341 1.00 0.43 C ATOM 1482 CD1 LEU A 88 -11.359 3.620 6.568 1.00 0.89 C ATOM 1483 CD2 LEU A 88 -13.141 2.668 5.101 1.00 0.48 C ATOM 0 H LEU A 88 -9.270 -0.270 7.289 1.00 0.30 H new ATOM 0 HA LEU A 88 -11.652 1.082 8.375 1.00 0.31 H new ATOM 0 HB2 LEU A 88 -10.589 1.310 5.714 1.00 0.33 H new ATOM 0 HB3 LEU A 88 -12.099 0.424 5.647 1.00 0.33 H new ATOM 0 HG LEU A 88 -12.969 2.380 7.199 1.00 0.43 H new ATOM 0 HD11 LEU A 88 -11.936 4.543 6.631 1.00 0.89 H new ATOM 0 HD12 LEU A 88 -10.810 3.471 7.498 1.00 0.89 H new ATOM 0 HD13 LEU A 88 -10.655 3.688 5.738 1.00 0.89 H new ATOM 0 HD21 LEU A 88 -13.683 3.609 5.192 1.00 0.48 H new ATOM 0 HD22 LEU A 88 -12.494 2.705 4.224 1.00 0.48 H new ATOM 0 HD23 LEU A 88 -13.852 1.849 4.993 1.00 0.48 H new ATOM 1495 N PHE A 89 -13.054 -1.003 7.937 1.00 0.30 N ATOM 1496 CA PHE A 89 -13.730 -2.273 8.003 1.00 0.31 C ATOM 1497 C PHE A 89 -14.833 -2.259 6.972 1.00 0.30 C ATOM 1498 O PHE A 89 -15.478 -1.235 6.785 1.00 0.30 O ATOM 1499 CB PHE A 89 -14.289 -2.498 9.403 1.00 0.34 C ATOM 1500 CG PHE A 89 -13.221 -2.615 10.453 1.00 0.89 C ATOM 1501 CD1 PHE A 89 -12.727 -1.485 11.091 1.00 1.75 C ATOM 1502 CD2 PHE A 89 -12.701 -3.853 10.797 1.00 1.75 C ATOM 1503 CE1 PHE A 89 -11.740 -1.587 12.049 1.00 2.40 C ATOM 1504 CE2 PHE A 89 -11.712 -3.960 11.756 1.00 2.42 C ATOM 1505 CZ PHE A 89 -11.229 -2.825 12.381 1.00 2.50 C ATOM 0 H PHE A 89 -13.649 -0.196 8.126 1.00 0.30 H new ATOM 0 HA PHE A 89 -13.040 -3.090 7.794 1.00 0.31 H new ATOM 0 HB2 PHE A 89 -14.953 -1.673 9.659 1.00 0.34 H new ATOM 0 HB3 PHE A 89 -14.893 -3.405 9.405 1.00 0.34 H new ATOM 0 HD1 PHE A 89 -13.121 -0.513 10.834 1.00 1.75 H new ATOM 0 HD2 PHE A 89 -13.073 -4.743 10.311 1.00 1.75 H new ATOM 0 HE1 PHE A 89 -11.368 -0.699 12.539 1.00 2.40 H new ATOM 0 HE2 PHE A 89 -11.316 -4.930 12.017 1.00 2.42 H new ATOM 0 HZ PHE A 89 -10.453 -2.907 13.128 1.00 2.50 H new ATOM 1515 N ILE A 90 -15.039 -3.369 6.295 1.00 0.30 N ATOM 1516 CA ILE A 90 -16.065 -3.436 5.267 1.00 0.31 C ATOM 1517 C ILE A 90 -16.967 -4.628 5.496 1.00 0.31 C ATOM 1518 O ILE A 90 -16.501 -5.719 5.808 1.00 0.33 O ATOM 1519 CB ILE A 90 -15.467 -3.517 3.851 1.00 0.32 C ATOM 1520 CG1 ILE A 90 -14.241 -4.431 3.839 1.00 0.39 C ATOM 1521 CG2 ILE A 90 -15.113 -2.126 3.347 1.00 0.37 C ATOM 1522 CD1 ILE A 90 -13.834 -4.883 2.458 1.00 0.48 C ATOM 0 H ILE A 90 -14.516 -4.233 6.434 1.00 0.30 H new ATOM 0 HA ILE A 90 -16.642 -2.514 5.338 1.00 0.31 H new ATOM 0 HB ILE A 90 -16.213 -3.944 3.180 1.00 0.32 H new ATOM 0 HG12 ILE A 90 -13.404 -3.908 4.302 1.00 0.39 H new ATOM 0 HG13 ILE A 90 -14.447 -5.308 4.453 1.00 0.39 H new ATOM 0 HG21 ILE A 90 -14.691 -2.199 2.345 1.00 0.37 H new ATOM 0 HG22 ILE A 90 -16.012 -1.510 3.319 1.00 0.37 H new ATOM 0 HG23 ILE A 90 -14.382 -1.672 4.016 1.00 0.37 H new ATOM 0 HD11 ILE A 90 -12.958 -5.527 2.530 1.00 0.48 H new ATOM 0 HD12 ILE A 90 -14.654 -5.435 1.999 1.00 0.48 H new ATOM 0 HD13 ILE A 90 -13.595 -4.013 1.846 1.00 0.48 H new ATOM 1534 N GLU A 91 -18.256 -4.412 5.356 1.00 0.31 N ATOM 1535 CA GLU A 91 -19.229 -5.465 5.564 1.00 0.34 C ATOM 1536 C GLU A 91 -20.204 -5.529 4.400 1.00 0.38 C ATOM 1537 O GLU A 91 -20.680 -4.490 3.909 1.00 0.41 O ATOM 1538 CB GLU A 91 -19.975 -5.223 6.882 1.00 0.39 C ATOM 1539 CG GLU A 91 -19.116 -4.537 7.932 1.00 1.34 C ATOM 1540 CD GLU A 91 -19.824 -4.353 9.259 1.00 1.32 C ATOM 1541 OE1 GLU A 91 -21.070 -4.311 9.277 1.00 1.74 O ATOM 1542 OE2 GLU A 91 -19.136 -4.244 10.295 1.00 1.72 O ATOM 0 H GLU A 91 -18.658 -3.511 5.097 1.00 0.31 H new ATOM 0 HA GLU A 91 -18.711 -6.422 5.621 1.00 0.34 H new ATOM 0 HB2 GLU A 91 -20.857 -4.613 6.687 1.00 0.39 H new ATOM 0 HB3 GLU A 91 -20.327 -6.177 7.275 1.00 0.39 H new ATOM 0 HG2 GLU A 91 -18.210 -5.123 8.090 1.00 1.34 H new ATOM 0 HG3 GLU A 91 -18.804 -3.562 7.556 1.00 1.34 H new ATOM 1549 N TRP A 92 -20.476 -6.746 3.948 1.00 0.41 N ATOM 1550 CA TRP A 92 -21.396 -6.963 2.842 1.00 0.51 C ATOM 1551 C TRP A 92 -21.812 -8.420 2.778 1.00 0.52 C ATOM 1552 O TRP A 92 -21.074 -9.296 3.225 1.00 0.50 O ATOM 1553 CB TRP A 92 -20.810 -6.500 1.497 1.00 0.66 C ATOM 1554 CG TRP A 92 -19.361 -6.842 1.272 1.00 0.82 C ATOM 1555 CD1 TRP A 92 -18.307 -5.976 1.283 1.00 1.79 C ATOM 1556 CD2 TRP A 92 -18.811 -8.130 0.987 1.00 0.89 C ATOM 1557 NE1 TRP A 92 -17.139 -6.645 1.011 1.00 1.87 N ATOM 1558 CE2 TRP A 92 -17.422 -7.970 0.832 1.00 1.04 C ATOM 1559 CE3 TRP A 92 -19.357 -9.401 0.851 1.00 1.87 C ATOM 1560 CZ2 TRP A 92 -16.580 -9.039 0.547 1.00 1.14 C ATOM 1561 CZ3 TRP A 92 -18.527 -10.458 0.571 1.00 2.35 C ATOM 1562 CH2 TRP A 92 -17.150 -10.276 0.420 1.00 1.76 C ATOM 0 H TRP A 92 -20.071 -7.600 4.332 1.00 0.41 H new ATOM 0 HA TRP A 92 -22.279 -6.353 3.029 1.00 0.51 H new ATOM 0 HB2 TRP A 92 -21.399 -6.941 0.692 1.00 0.66 H new ATOM 0 HB3 TRP A 92 -20.926 -5.419 1.422 1.00 0.66 H new ATOM 0 HD1 TRP A 92 -18.381 -4.916 1.478 1.00 1.79 H new ATOM 0 HE1 TRP A 92 -16.213 -6.222 0.952 1.00 1.87 H new ATOM 0 HE3 TRP A 92 -20.420 -9.555 0.964 1.00 1.87 H new ATOM 0 HZ2 TRP A 92 -15.516 -8.898 0.430 1.00 1.14 H new ATOM 0 HZ3 TRP A 92 -18.946 -11.448 0.466 1.00 2.35 H new ATOM 0 HH2 TRP A 92 -16.524 -11.128 0.199 1.00 1.76 H new ATOM 1573 N GLU A 93 -23.035 -8.658 2.310 1.00 0.61 N ATOM 1574 CA GLU A 93 -23.578 -10.006 2.169 1.00 0.67 C ATOM 1575 C GLU A 93 -23.620 -10.713 3.515 1.00 0.61 C ATOM 1576 O GLU A 93 -23.319 -11.901 3.622 1.00 0.64 O ATOM 1577 CB GLU A 93 -22.767 -10.807 1.146 1.00 0.74 C ATOM 1578 CG GLU A 93 -22.721 -10.148 -0.223 1.00 0.88 C ATOM 1579 CD GLU A 93 -22.784 -11.145 -1.359 1.00 1.08 C ATOM 1580 OE1 GLU A 93 -21.717 -11.631 -1.794 1.00 1.63 O ATOM 1581 OE2 GLU A 93 -23.905 -11.441 -1.825 1.00 1.58 O ATOM 0 H GLU A 93 -23.677 -7.921 2.018 1.00 0.61 H new ATOM 0 HA GLU A 93 -24.601 -9.930 1.802 1.00 0.67 H new ATOM 0 HB2 GLU A 93 -21.750 -10.934 1.516 1.00 0.74 H new ATOM 0 HB3 GLU A 93 -23.198 -11.804 1.049 1.00 0.74 H new ATOM 0 HG2 GLU A 93 -23.553 -9.450 -0.313 1.00 0.88 H new ATOM 0 HG3 GLU A 93 -21.804 -9.564 -0.309 1.00 0.88 H new ATOM 1588 N LYS A 94 -24.011 -9.952 4.536 1.00 0.59 N ATOM 1589 CA LYS A 94 -24.118 -10.453 5.904 1.00 0.61 C ATOM 1590 C LYS A 94 -22.764 -10.916 6.430 1.00 0.55 C ATOM 1591 O LYS A 94 -22.690 -11.796 7.290 1.00 0.63 O ATOM 1592 CB LYS A 94 -25.149 -11.593 5.997 1.00 0.71 C ATOM 1593 CG LYS A 94 -26.511 -11.250 5.402 1.00 0.85 C ATOM 1594 CD LYS A 94 -27.050 -9.921 5.921 1.00 0.93 C ATOM 1595 CE LYS A 94 -27.175 -9.911 7.438 1.00 1.23 C ATOM 1596 NZ LYS A 94 -27.628 -8.593 7.947 1.00 1.79 N ATOM 0 H LYS A 94 -24.263 -8.969 4.437 1.00 0.59 H new ATOM 0 HA LYS A 94 -24.461 -9.628 6.529 1.00 0.61 H new ATOM 0 HB2 LYS A 94 -24.752 -12.470 5.486 1.00 0.71 H new ATOM 0 HB3 LYS A 94 -25.280 -11.866 7.044 1.00 0.71 H new ATOM 0 HG2 LYS A 94 -26.431 -11.208 4.316 1.00 0.85 H new ATOM 0 HG3 LYS A 94 -27.219 -12.044 5.639 1.00 0.85 H new ATOM 0 HD2 LYS A 94 -26.389 -9.114 5.606 1.00 0.93 H new ATOM 0 HD3 LYS A 94 -28.025 -9.726 5.475 1.00 0.93 H new ATOM 0 HE2 LYS A 94 -27.880 -10.682 7.749 1.00 1.23 H new ATOM 0 HE3 LYS A 94 -26.212 -10.161 7.883 1.00 1.23 H new ATOM 0 HZ1 LYS A 94 -27.700 -8.628 8.984 1.00 1.79 H new ATOM 0 HZ2 LYS A 94 -26.943 -7.861 7.672 1.00 1.79 H new ATOM 0 HZ3 LYS A 94 -28.559 -8.366 7.542 1.00 1.79 H new ATOM 1610 N LYS A 95 -21.698 -10.319 5.914 1.00 0.47 N ATOM 1611 CA LYS A 95 -20.349 -10.668 6.337 1.00 0.46 C ATOM 1612 C LYS A 95 -19.521 -9.415 6.602 1.00 0.42 C ATOM 1613 O LYS A 95 -19.831 -8.342 6.096 1.00 0.42 O ATOM 1614 CB LYS A 95 -19.676 -11.534 5.277 1.00 0.52 C ATOM 1615 CG LYS A 95 -19.048 -12.809 5.823 1.00 0.63 C ATOM 1616 CD LYS A 95 -20.075 -13.710 6.494 1.00 0.77 C ATOM 1617 CE LYS A 95 -21.167 -14.150 5.527 1.00 0.94 C ATOM 1618 NZ LYS A 95 -22.182 -15.007 6.194 1.00 1.29 N ATOM 0 H LYS A 95 -21.742 -9.590 5.202 1.00 0.47 H new ATOM 0 HA LYS A 95 -20.415 -11.233 7.267 1.00 0.46 H new ATOM 0 HB2 LYS A 95 -20.413 -11.800 4.519 1.00 0.52 H new ATOM 0 HB3 LYS A 95 -18.905 -10.946 4.779 1.00 0.52 H new ATOM 0 HG2 LYS A 95 -18.566 -13.352 5.010 1.00 0.63 H new ATOM 0 HG3 LYS A 95 -18.269 -12.551 6.540 1.00 0.63 H new ATOM 0 HD2 LYS A 95 -19.575 -14.589 6.901 1.00 0.77 H new ATOM 0 HD3 LYS A 95 -20.526 -13.182 7.334 1.00 0.77 H new ATOM 0 HE2 LYS A 95 -21.654 -13.271 5.105 1.00 0.94 H new ATOM 0 HE3 LYS A 95 -20.719 -14.696 4.697 1.00 0.94 H new ATOM 0 HZ1 LYS A 95 -22.908 -15.286 5.504 1.00 1.29 H new ATOM 0 HZ2 LYS A 95 -21.721 -15.858 6.575 1.00 1.29 H new ATOM 0 HZ3 LYS A 95 -22.628 -14.477 6.970 1.00 1.29 H new ATOM 1632 N THR A 96 -18.466 -9.570 7.388 1.00 0.43 N ATOM 1633 CA THR A 96 -17.584 -8.461 7.756 1.00 0.41 C ATOM 1634 C THR A 96 -16.119 -8.790 7.441 1.00 0.40 C ATOM 1635 O THR A 96 -15.682 -9.923 7.639 1.00 0.45 O ATOM 1636 CB THR A 96 -17.696 -8.139 9.265 1.00 0.45 C ATOM 1637 OG1 THR A 96 -17.251 -9.254 10.051 1.00 0.73 O ATOM 1638 CG2 THR A 96 -19.126 -7.797 9.652 1.00 0.55 C ATOM 0 H THR A 96 -18.193 -10.466 7.791 1.00 0.43 H new ATOM 0 HA THR A 96 -17.900 -7.598 7.170 1.00 0.41 H new ATOM 0 HB THR A 96 -17.062 -7.275 9.462 1.00 0.45 H new ATOM 0 HG1 THR A 96 -17.326 -9.034 11.003 1.00 0.73 H new ATOM 0 HG21 THR A 96 -19.171 -7.576 10.718 1.00 0.55 H new ATOM 0 HG22 THR A 96 -19.458 -6.926 9.086 1.00 0.55 H new ATOM 0 HG23 THR A 96 -19.776 -8.643 9.429 1.00 0.55 H new ATOM 1646 N TYR A 97 -15.370 -7.801 6.944 1.00 0.38 N ATOM 1647 CA TYR A 97 -13.959 -7.990 6.606 1.00 0.40 C ATOM 1648 C TYR A 97 -13.139 -6.765 6.997 1.00 0.35 C ATOM 1649 O TYR A 97 -13.688 -5.687 7.244 1.00 0.33 O ATOM 1650 CB TYR A 97 -13.777 -8.267 5.108 1.00 0.47 C ATOM 1651 CG TYR A 97 -14.685 -9.348 4.568 1.00 0.56 C ATOM 1652 CD1 TYR A 97 -16.002 -9.064 4.228 1.00 1.37 C ATOM 1653 CD2 TYR A 97 -14.231 -10.651 4.409 1.00 1.37 C ATOM 1654 CE1 TYR A 97 -16.840 -10.044 3.744 1.00 1.54 C ATOM 1655 CE2 TYR A 97 -15.062 -11.639 3.919 1.00 1.54 C ATOM 1656 CZ TYR A 97 -16.367 -11.332 3.590 1.00 1.13 C ATOM 1657 OH TYR A 97 -17.197 -12.319 3.108 1.00 1.45 O ATOM 0 H TYR A 97 -15.720 -6.859 6.767 1.00 0.38 H new ATOM 0 HA TYR A 97 -13.605 -8.854 7.168 1.00 0.40 H new ATOM 0 HB2 TYR A 97 -13.957 -7.346 4.554 1.00 0.47 H new ATOM 0 HB3 TYR A 97 -12.741 -8.552 4.925 1.00 0.47 H new ATOM 0 HD1 TYR A 97 -16.375 -8.057 4.345 1.00 1.37 H new ATOM 0 HD2 TYR A 97 -13.213 -10.895 4.673 1.00 1.37 H new ATOM 0 HE1 TYR A 97 -17.862 -9.806 3.486 1.00 1.54 H new ATOM 0 HE2 TYR A 97 -14.693 -12.646 3.794 1.00 1.54 H new ATOM 0 HH TYR A 97 -17.614 -12.017 2.274 1.00 1.45 H new ATOM 1667 N GLN A 98 -11.824 -6.940 7.028 1.00 0.37 N ATOM 1668 CA GLN A 98 -10.910 -5.868 7.402 1.00 0.34 C ATOM 1669 C GLN A 98 -10.142 -5.360 6.186 1.00 0.31 C ATOM 1670 O GLN A 98 -9.564 -6.145 5.416 1.00 0.31 O ATOM 1671 CB GLN A 98 -9.935 -6.344 8.482 1.00 0.40 C ATOM 1672 CG GLN A 98 -10.598 -7.134 9.601 1.00 0.80 C ATOM 1673 CD GLN A 98 -9.709 -7.283 10.817 1.00 1.21 C ATOM 1674 OE1 GLN A 98 -8.481 -7.281 10.711 1.00 1.83 O ATOM 1675 NE2 GLN A 98 -10.325 -7.416 11.983 1.00 1.84 N ATOM 0 H GLN A 98 -11.364 -7.821 6.797 1.00 0.37 H new ATOM 0 HA GLN A 98 -11.502 -5.045 7.804 1.00 0.34 H new ATOM 0 HB2 GLN A 98 -9.167 -6.963 8.018 1.00 0.40 H new ATOM 0 HB3 GLN A 98 -9.430 -5.478 8.910 1.00 0.40 H new ATOM 0 HG2 GLN A 98 -11.524 -6.637 9.892 1.00 0.80 H new ATOM 0 HG3 GLN A 98 -10.869 -8.123 9.231 1.00 0.80 H new ATOM 0 HE21 GLN A 98 -11.344 -7.412 12.025 1.00 1.84 H new ATOM 0 HE22 GLN A 98 -9.780 -7.522 12.839 1.00 1.84 H new ATOM 1684 N LEU A 99 -10.139 -4.043 6.034 1.00 0.29 N ATOM 1685 CA LEU A 99 -9.479 -3.385 4.924 1.00 0.28 C ATOM 1686 C LEU A 99 -8.453 -2.375 5.428 1.00 0.26 C ATOM 1687 O LEU A 99 -8.809 -1.371 6.047 1.00 0.28 O ATOM 1688 CB LEU A 99 -10.540 -2.665 4.078 1.00 0.31 C ATOM 1689 CG LEU A 99 -10.179 -2.374 2.614 1.00 0.37 C ATOM 1690 CD1 LEU A 99 -9.122 -1.275 2.512 1.00 0.46 C ATOM 1691 CD2 LEU A 99 -9.705 -3.642 1.915 1.00 0.48 C ATOM 0 H LEU A 99 -10.597 -3.402 6.682 1.00 0.29 H new ATOM 0 HA LEU A 99 -8.958 -4.130 4.323 1.00 0.28 H new ATOM 0 HB2 LEU A 99 -11.449 -3.266 4.090 1.00 0.31 H new ATOM 0 HB3 LEU A 99 -10.777 -1.718 4.564 1.00 0.31 H new ATOM 0 HG LEU A 99 -11.079 -2.019 2.112 1.00 0.37 H new ATOM 0 HD11 LEU A 99 -8.888 -1.092 1.463 1.00 0.46 H new ATOM 0 HD12 LEU A 99 -9.504 -0.360 2.964 1.00 0.46 H new ATOM 0 HD13 LEU A 99 -8.219 -1.589 3.036 1.00 0.46 H new ATOM 0 HD21 LEU A 99 -9.454 -3.414 0.879 1.00 0.48 H new ATOM 0 HD22 LEU A 99 -8.823 -4.031 2.425 1.00 0.48 H new ATOM 0 HD23 LEU A 99 -10.498 -4.390 1.940 1.00 0.48 H new ATOM 1703 N ASP A 100 -7.187 -2.632 5.173 1.00 0.25 N ATOM 1704 CA ASP A 100 -6.143 -1.702 5.577 1.00 0.26 C ATOM 1705 C ASP A 100 -5.871 -0.768 4.413 1.00 0.25 C ATOM 1706 O ASP A 100 -5.830 -1.207 3.271 1.00 0.26 O ATOM 1707 CB ASP A 100 -4.851 -2.427 5.908 1.00 0.32 C ATOM 1708 CG ASP A 100 -4.662 -2.817 7.364 1.00 0.41 C ATOM 1709 OD1 ASP A 100 -5.197 -2.151 8.258 1.00 0.74 O ATOM 1710 OD2 ASP A 100 -3.926 -3.821 7.603 1.00 0.43 O ATOM 0 H ASP A 100 -6.854 -3.468 4.693 1.00 0.25 H new ATOM 0 HA ASP A 100 -6.479 -1.165 6.464 1.00 0.26 H new ATOM 0 HB2 ASP A 100 -4.798 -3.330 5.300 1.00 0.32 H new ATOM 0 HB3 ASP A 100 -4.015 -1.794 5.610 1.00 0.32 H new ATOM 1715 N LEU A 101 -5.691 0.506 4.677 1.00 0.25 N ATOM 1716 CA LEU A 101 -5.417 1.443 3.600 1.00 0.25 C ATOM 1717 C LEU A 101 -4.346 2.443 4.007 1.00 0.25 C ATOM 1718 O LEU A 101 -4.385 3.019 5.096 1.00 0.27 O ATOM 1719 CB LEU A 101 -6.703 2.154 3.168 1.00 0.28 C ATOM 1720 CG LEU A 101 -7.172 3.284 4.081 1.00 0.34 C ATOM 1721 CD1 LEU A 101 -6.936 4.637 3.422 1.00 0.33 C ATOM 1722 CD2 LEU A 101 -8.636 3.109 4.438 1.00 0.51 C ATOM 0 H LEU A 101 -5.727 0.917 5.610 1.00 0.25 H new ATOM 0 HA LEU A 101 -5.036 0.882 2.746 1.00 0.25 H new ATOM 0 HB2 LEU A 101 -6.554 2.558 2.167 1.00 0.28 H new ATOM 0 HB3 LEU A 101 -7.500 1.414 3.098 1.00 0.28 H new ATOM 0 HG LEU A 101 -6.590 3.246 5.002 1.00 0.34 H new ATOM 0 HD11 LEU A 101 -7.276 5.430 4.088 1.00 0.33 H new ATOM 0 HD12 LEU A 101 -5.872 4.763 3.221 1.00 0.33 H new ATOM 0 HD13 LEU A 101 -7.490 4.687 2.485 1.00 0.33 H new ATOM 0 HD21 LEU A 101 -8.952 3.924 5.089 1.00 0.51 H new ATOM 0 HD22 LEU A 101 -9.236 3.118 3.528 1.00 0.51 H new ATOM 0 HD23 LEU A 101 -8.774 2.159 4.954 1.00 0.51 H new ATOM 1734 N PHE A 102 -3.362 2.614 3.145 1.00 0.24 N ATOM 1735 CA PHE A 102 -2.279 3.545 3.415 1.00 0.25 C ATOM 1736 C PHE A 102 -2.280 4.674 2.398 1.00 0.24 C ATOM 1737 O PHE A 102 -2.566 4.462 1.217 1.00 0.24 O ATOM 1738 CB PHE A 102 -0.919 2.839 3.378 1.00 0.28 C ATOM 1739 CG PHE A 102 -0.647 1.897 4.524 1.00 0.39 C ATOM 1740 CD1 PHE A 102 -1.681 1.290 5.220 1.00 1.27 C ATOM 1741 CD2 PHE A 102 0.656 1.605 4.895 1.00 1.29 C ATOM 1742 CE1 PHE A 102 -1.425 0.416 6.254 1.00 1.36 C ATOM 1743 CE2 PHE A 102 0.917 0.734 5.933 1.00 1.40 C ATOM 1744 CZ PHE A 102 -0.127 0.139 6.612 1.00 0.81 C ATOM 0 H PHE A 102 -3.289 2.123 2.254 1.00 0.24 H new ATOM 0 HA PHE A 102 -2.440 3.952 4.413 1.00 0.25 H new ATOM 0 HB2 PHE A 102 -0.844 2.280 2.445 1.00 0.28 H new ATOM 0 HB3 PHE A 102 -0.136 3.597 3.359 1.00 0.28 H new ATOM 0 HD1 PHE A 102 -2.704 1.506 4.947 1.00 1.27 H new ATOM 0 HD2 PHE A 102 1.477 2.065 4.365 1.00 1.29 H new ATOM 0 HE1 PHE A 102 -2.243 -0.051 6.782 1.00 1.36 H new ATOM 0 HE2 PHE A 102 1.937 0.518 6.214 1.00 1.40 H new ATOM 0 HZ PHE A 102 0.076 -0.544 7.424 1.00 0.81 H new ATOM 1754 N THR A 103 -1.977 5.868 2.865 1.00 0.25 N ATOM 1755 CA THR A 103 -1.915 7.032 2.005 1.00 0.25 C ATOM 1756 C THR A 103 -0.460 7.379 1.710 1.00 0.25 C ATOM 1757 O THR A 103 0.338 7.571 2.628 1.00 0.28 O ATOM 1758 CB THR A 103 -2.613 8.239 2.658 1.00 0.29 C ATOM 1759 OG1 THR A 103 -2.842 7.976 4.049 1.00 0.37 O ATOM 1760 CG2 THR A 103 -3.937 8.543 1.973 1.00 0.38 C ATOM 0 H THR A 103 -1.768 6.058 3.845 1.00 0.25 H new ATOM 0 HA THR A 103 -2.432 6.797 1.075 1.00 0.25 H new ATOM 0 HB THR A 103 -1.962 9.106 2.550 1.00 0.29 H new ATOM 0 HG1 THR A 103 -3.285 8.748 4.459 1.00 0.37 H new ATOM 0 HG21 THR A 103 -4.408 9.400 2.455 1.00 0.38 H new ATOM 0 HG22 THR A 103 -3.759 8.770 0.922 1.00 0.38 H new ATOM 0 HG23 THR A 103 -4.594 7.677 2.051 1.00 0.38 H new ATOM 1768 N ALA A 104 -0.115 7.445 0.434 1.00 0.26 N ATOM 1769 CA ALA A 104 1.249 7.749 0.027 1.00 0.28 C ATOM 1770 C ALA A 104 1.263 8.675 -1.182 1.00 0.26 C ATOM 1771 O ALA A 104 0.276 8.767 -1.918 1.00 0.25 O ATOM 1772 CB ALA A 104 1.989 6.458 -0.281 1.00 0.34 C ATOM 0 H ALA A 104 -0.762 7.292 -0.340 1.00 0.26 H new ATOM 0 HA ALA A 104 1.752 8.263 0.846 1.00 0.28 H new ATOM 0 HB1 ALA A 104 3.010 6.688 -0.586 1.00 0.34 H new ATOM 0 HB2 ALA A 104 2.009 5.829 0.609 1.00 0.34 H new ATOM 0 HB3 ALA A 104 1.480 5.930 -1.087 1.00 0.34 H new ATOM 1778 N LEU A 105 2.377 9.357 -1.395 1.00 0.27 N ATOM 1779 CA LEU A 105 2.508 10.264 -2.516 1.00 0.27 C ATOM 1780 C LEU A 105 2.968 9.499 -3.741 1.00 0.26 C ATOM 1781 O LEU A 105 3.461 8.380 -3.630 1.00 0.27 O ATOM 1782 CB LEU A 105 3.497 11.384 -2.183 1.00 0.32 C ATOM 1783 CG LEU A 105 3.153 12.217 -0.944 1.00 0.39 C ATOM 1784 CD1 LEU A 105 4.096 13.404 -0.821 1.00 0.57 C ATOM 1785 CD2 LEU A 105 1.706 12.683 -0.999 1.00 0.49 C ATOM 0 H LEU A 105 3.205 9.297 -0.802 1.00 0.27 H new ATOM 0 HA LEU A 105 1.538 10.715 -2.723 1.00 0.27 H new ATOM 0 HB2 LEU A 105 4.484 10.944 -2.042 1.00 0.32 H new ATOM 0 HB3 LEU A 105 3.566 12.052 -3.042 1.00 0.32 H new ATOM 0 HG LEU A 105 3.276 11.590 -0.061 1.00 0.39 H new ATOM 0 HD11 LEU A 105 3.837 13.984 0.065 1.00 0.57 H new ATOM 0 HD12 LEU A 105 5.122 13.046 -0.733 1.00 0.57 H new ATOM 0 HD13 LEU A 105 4.006 14.033 -1.706 1.00 0.57 H new ATOM 0 HD21 LEU A 105 1.480 13.273 -0.111 1.00 0.49 H new ATOM 0 HD22 LEU A 105 1.554 13.294 -1.889 1.00 0.49 H new ATOM 0 HD23 LEU A 105 1.046 11.816 -1.037 1.00 0.49 H new ATOM 1797 N ALA A 106 2.798 10.105 -4.904 1.00 0.27 N ATOM 1798 CA ALA A 106 3.191 9.486 -6.167 1.00 0.30 C ATOM 1799 C ALA A 106 4.651 9.055 -6.147 1.00 0.31 C ATOM 1800 O ALA A 106 5.036 8.081 -6.795 1.00 0.36 O ATOM 1801 CB ALA A 106 2.944 10.442 -7.323 1.00 0.34 C ATOM 0 H ALA A 106 2.387 11.033 -5.004 1.00 0.27 H new ATOM 0 HA ALA A 106 2.580 8.594 -6.303 1.00 0.30 H new ATOM 0 HB1 ALA A 106 3.242 9.967 -8.258 1.00 0.34 H new ATOM 0 HB2 ALA A 106 1.885 10.695 -7.366 1.00 0.34 H new ATOM 0 HB3 ALA A 106 3.528 11.350 -7.175 1.00 0.34 H new ATOM 1807 N GLU A 107 5.452 9.767 -5.377 1.00 0.31 N ATOM 1808 CA GLU A 107 6.875 9.470 -5.275 1.00 0.35 C ATOM 1809 C GLU A 107 7.139 8.301 -4.325 1.00 0.36 C ATOM 1810 O GLU A 107 8.202 7.683 -4.363 1.00 0.43 O ATOM 1811 CB GLU A 107 7.648 10.710 -4.817 1.00 0.40 C ATOM 1812 CG GLU A 107 6.960 11.502 -3.715 1.00 0.44 C ATOM 1813 CD GLU A 107 6.256 12.734 -4.242 1.00 0.67 C ATOM 1814 OE1 GLU A 107 5.114 12.613 -4.733 1.00 1.38 O ATOM 1815 OE2 GLU A 107 6.846 13.832 -4.169 1.00 1.35 O ATOM 0 H GLU A 107 5.144 10.557 -4.811 1.00 0.31 H new ATOM 0 HA GLU A 107 7.224 9.180 -6.266 1.00 0.35 H new ATOM 0 HB2 GLU A 107 8.633 10.401 -4.467 1.00 0.40 H new ATOM 0 HB3 GLU A 107 7.805 11.364 -5.675 1.00 0.40 H new ATOM 0 HG2 GLU A 107 6.237 10.862 -3.209 1.00 0.44 H new ATOM 0 HG3 GLU A 107 7.698 11.800 -2.970 1.00 0.44 H new ATOM 1822 N GLU A 108 6.162 7.990 -3.489 1.00 0.33 N ATOM 1823 CA GLU A 108 6.297 6.897 -2.535 1.00 0.36 C ATOM 1824 C GLU A 108 5.883 5.569 -3.165 1.00 0.39 C ATOM 1825 O GLU A 108 6.140 4.508 -2.600 1.00 0.59 O ATOM 1826 CB GLU A 108 5.442 7.162 -1.294 1.00 0.39 C ATOM 1827 CG GLU A 108 5.905 8.349 -0.475 1.00 0.75 C ATOM 1828 CD GLU A 108 4.959 8.664 0.668 1.00 1.62 C ATOM 1829 OE1 GLU A 108 4.853 7.847 1.607 1.00 2.31 O ATOM 1830 OE2 GLU A 108 4.308 9.727 0.625 1.00 2.35 O ATOM 0 H GLU A 108 5.267 8.477 -3.450 1.00 0.33 H new ATOM 0 HA GLU A 108 7.346 6.836 -2.244 1.00 0.36 H new ATOM 0 HB2 GLU A 108 4.410 7.326 -1.604 1.00 0.39 H new ATOM 0 HB3 GLU A 108 5.448 6.273 -0.664 1.00 0.39 H new ATOM 0 HG2 GLU A 108 6.899 8.147 -0.076 1.00 0.75 H new ATOM 0 HG3 GLU A 108 5.993 9.222 -1.122 1.00 0.75 H new ATOM 1837 N LYS A 109 5.232 5.649 -4.329 1.00 0.37 N ATOM 1838 CA LYS A 109 4.744 4.466 -5.055 1.00 0.38 C ATOM 1839 C LYS A 109 5.733 3.288 -5.042 1.00 0.34 C ATOM 1840 O LYS A 109 5.395 2.225 -4.524 1.00 0.35 O ATOM 1841 CB LYS A 109 4.370 4.817 -6.498 1.00 0.44 C ATOM 1842 CG LYS A 109 3.531 3.744 -7.172 1.00 0.74 C ATOM 1843 CD LYS A 109 3.833 3.641 -8.658 1.00 1.00 C ATOM 1844 CE LYS A 109 3.155 2.429 -9.273 1.00 1.73 C ATOM 1845 NZ LYS A 109 3.533 2.242 -10.698 1.00 2.18 N ATOM 0 H LYS A 109 5.027 6.532 -4.796 1.00 0.37 H new ATOM 0 HA LYS A 109 3.853 4.140 -4.518 1.00 0.38 H new ATOM 0 HB2 LYS A 109 3.821 5.758 -6.506 1.00 0.44 H new ATOM 0 HB3 LYS A 109 5.281 4.974 -7.076 1.00 0.44 H new ATOM 0 HG2 LYS A 109 3.720 2.782 -6.695 1.00 0.74 H new ATOM 0 HG3 LYS A 109 2.474 3.967 -7.031 1.00 0.74 H new ATOM 0 HD2 LYS A 109 3.496 4.546 -9.164 1.00 1.00 H new ATOM 0 HD3 LYS A 109 4.910 3.574 -8.809 1.00 1.00 H new ATOM 0 HE2 LYS A 109 3.424 1.537 -8.707 1.00 1.73 H new ATOM 0 HE3 LYS A 109 2.073 2.541 -9.197 1.00 1.73 H new ATOM 0 HZ1 LYS A 109 3.048 1.404 -11.079 1.00 2.18 H new ATOM 0 HZ2 LYS A 109 3.254 3.082 -11.244 1.00 2.18 H new ATOM 0 HZ3 LYS A 109 4.562 2.109 -10.770 1.00 2.18 H new ATOM 1859 N PRO A 110 6.958 3.442 -5.596 1.00 0.34 N ATOM 1860 CA PRO A 110 7.936 2.348 -5.630 1.00 0.35 C ATOM 1861 C PRO A 110 8.267 1.802 -4.240 1.00 0.30 C ATOM 1862 O PRO A 110 8.327 0.590 -4.035 1.00 0.31 O ATOM 1863 CB PRO A 110 9.184 2.987 -6.264 1.00 0.42 C ATOM 1864 CG PRO A 110 8.977 4.457 -6.153 1.00 0.41 C ATOM 1865 CD PRO A 110 7.495 4.665 -6.220 1.00 0.37 C ATOM 0 HA PRO A 110 7.551 1.492 -6.184 1.00 0.35 H new ATOM 0 HB2 PRO A 110 10.091 2.678 -5.744 1.00 0.42 H new ATOM 0 HB3 PRO A 110 9.295 2.684 -7.305 1.00 0.42 H new ATOM 0 HG2 PRO A 110 9.384 4.840 -5.217 1.00 0.41 H new ATOM 0 HG3 PRO A 110 9.483 4.986 -6.961 1.00 0.41 H new ATOM 0 HD2 PRO A 110 7.189 5.561 -5.680 1.00 0.37 H new ATOM 0 HD3 PRO A 110 7.150 4.778 -7.248 1.00 0.37 H new ATOM 1873 N TYR A 111 8.458 2.706 -3.288 1.00 0.29 N ATOM 1874 CA TYR A 111 8.802 2.334 -1.920 1.00 0.27 C ATOM 1875 C TYR A 111 7.669 1.579 -1.242 1.00 0.26 C ATOM 1876 O TYR A 111 7.875 0.493 -0.693 1.00 0.26 O ATOM 1877 CB TYR A 111 9.150 3.586 -1.103 1.00 0.31 C ATOM 1878 CG TYR A 111 10.444 4.260 -1.510 1.00 0.27 C ATOM 1879 CD1 TYR A 111 10.739 4.500 -2.842 1.00 1.20 C ATOM 1880 CD2 TYR A 111 11.366 4.662 -0.559 1.00 1.24 C ATOM 1881 CE1 TYR A 111 11.916 5.112 -3.215 1.00 1.21 C ATOM 1882 CE2 TYR A 111 12.547 5.282 -0.923 1.00 1.27 C ATOM 1883 CZ TYR A 111 12.818 5.502 -2.253 1.00 0.41 C ATOM 1884 OH TYR A 111 13.985 6.129 -2.624 1.00 0.53 O ATOM 0 H TYR A 111 8.380 3.712 -3.440 1.00 0.29 H new ATOM 0 HA TYR A 111 9.668 1.674 -1.966 1.00 0.27 H new ATOM 0 HB2 TYR A 111 8.335 4.304 -1.197 1.00 0.31 H new ATOM 0 HB3 TYR A 111 9.213 3.312 -0.050 1.00 0.31 H new ATOM 0 HD1 TYR A 111 10.033 4.202 -3.603 1.00 1.20 H new ATOM 0 HD2 TYR A 111 11.159 4.488 0.487 1.00 1.24 H new ATOM 0 HE1 TYR A 111 12.129 5.285 -4.260 1.00 1.21 H new ATOM 0 HE2 TYR A 111 13.253 5.592 -0.167 1.00 1.27 H new ATOM 0 HH TYR A 111 14.566 5.490 -3.087 1.00 0.53 H new ATOM 1894 N ALA A 112 6.479 2.158 -1.289 1.00 0.26 N ATOM 1895 CA ALA A 112 5.302 1.559 -0.673 1.00 0.27 C ATOM 1896 C ALA A 112 5.042 0.159 -1.214 1.00 0.26 C ATOM 1897 O ALA A 112 4.800 -0.779 -0.448 1.00 0.26 O ATOM 1898 CB ALA A 112 4.084 2.446 -0.891 1.00 0.30 C ATOM 0 H ALA A 112 6.301 3.050 -1.751 1.00 0.26 H new ATOM 0 HA ALA A 112 5.491 1.472 0.397 1.00 0.27 H new ATOM 0 HB1 ALA A 112 3.212 1.987 -0.426 1.00 0.30 H new ATOM 0 HB2 ALA A 112 4.261 3.424 -0.444 1.00 0.30 H new ATOM 0 HB3 ALA A 112 3.906 2.563 -1.960 1.00 0.30 H new ATOM 1904 N ILE A 113 5.100 0.016 -2.533 1.00 0.27 N ATOM 1905 CA ILE A 113 4.869 -1.274 -3.157 1.00 0.29 C ATOM 1906 C ILE A 113 5.965 -2.263 -2.775 1.00 0.29 C ATOM 1907 O ILE A 113 5.675 -3.419 -2.489 1.00 0.31 O ATOM 1908 CB ILE A 113 4.770 -1.171 -4.694 1.00 0.33 C ATOM 1909 CG1 ILE A 113 3.609 -0.255 -5.100 1.00 0.35 C ATOM 1910 CG2 ILE A 113 4.587 -2.551 -5.314 1.00 0.37 C ATOM 1911 CD1 ILE A 113 2.275 -0.641 -4.489 1.00 0.39 C ATOM 0 H ILE A 113 5.304 0.774 -3.184 1.00 0.27 H new ATOM 0 HA ILE A 113 3.910 -1.636 -2.785 1.00 0.29 H new ATOM 0 HB ILE A 113 5.701 -0.742 -5.065 1.00 0.33 H new ATOM 0 HG12 ILE A 113 3.848 0.768 -4.809 1.00 0.35 H new ATOM 0 HG13 ILE A 113 3.516 -0.264 -6.186 1.00 0.35 H new ATOM 0 HG21 ILE A 113 4.519 -2.457 -6.398 1.00 0.37 H new ATOM 0 HG22 ILE A 113 5.438 -3.181 -5.057 1.00 0.37 H new ATOM 0 HG23 ILE A 113 3.672 -3.003 -4.931 1.00 0.37 H new ATOM 0 HD11 ILE A 113 1.506 0.055 -4.825 1.00 0.39 H new ATOM 0 HD12 ILE A 113 2.011 -1.652 -4.801 1.00 0.39 H new ATOM 0 HD13 ILE A 113 2.348 -0.604 -3.402 1.00 0.39 H new ATOM 1923 N PHE A 114 7.219 -1.802 -2.751 1.00 0.28 N ATOM 1924 CA PHE A 114 8.354 -2.654 -2.405 1.00 0.31 C ATOM 1925 C PHE A 114 8.162 -3.284 -1.033 1.00 0.31 C ATOM 1926 O PHE A 114 8.416 -4.473 -0.839 1.00 0.33 O ATOM 1927 CB PHE A 114 9.637 -1.829 -2.448 1.00 0.34 C ATOM 1928 CG PHE A 114 10.858 -2.540 -1.953 1.00 0.36 C ATOM 1929 CD1 PHE A 114 11.337 -3.663 -2.606 1.00 1.27 C ATOM 1930 CD2 PHE A 114 11.527 -2.075 -0.835 1.00 1.24 C ATOM 1931 CE1 PHE A 114 12.468 -4.313 -2.151 1.00 1.33 C ATOM 1932 CE2 PHE A 114 12.658 -2.719 -0.372 1.00 1.26 C ATOM 1933 CZ PHE A 114 13.129 -3.842 -1.031 1.00 0.55 C ATOM 0 H PHE A 114 7.472 -0.838 -2.969 1.00 0.28 H new ATOM 0 HA PHE A 114 8.425 -3.464 -3.131 1.00 0.31 H new ATOM 0 HB2 PHE A 114 9.812 -1.508 -3.475 1.00 0.34 H new ATOM 0 HB3 PHE A 114 9.493 -0.927 -1.853 1.00 0.34 H new ATOM 0 HD1 PHE A 114 10.822 -4.034 -3.479 1.00 1.27 H new ATOM 0 HD2 PHE A 114 11.161 -1.200 -0.319 1.00 1.24 H new ATOM 0 HE1 PHE A 114 12.835 -5.187 -2.669 1.00 1.33 H new ATOM 0 HE2 PHE A 114 13.173 -2.348 0.501 1.00 1.26 H new ATOM 0 HZ PHE A 114 14.012 -4.350 -0.671 1.00 0.55 H new ATOM 1943 N HIS A 115 7.705 -2.476 -0.096 1.00 0.30 N ATOM 1944 CA HIS A 115 7.460 -2.934 1.256 1.00 0.33 C ATOM 1945 C HIS A 115 6.327 -3.974 1.286 1.00 0.32 C ATOM 1946 O HIS A 115 6.492 -5.072 1.815 1.00 0.34 O ATOM 1947 CB HIS A 115 7.148 -1.717 2.145 1.00 0.38 C ATOM 1948 CG HIS A 115 7.112 -2.052 3.598 1.00 0.42 C ATOM 1949 ND1 HIS A 115 7.991 -1.511 4.507 1.00 0.45 N ATOM 1950 CD2 HIS A 115 6.300 -2.899 4.234 1.00 0.47 C ATOM 1951 CE1 HIS A 115 7.689 -2.055 5.671 1.00 0.49 C ATOM 1952 NE2 HIS A 115 6.669 -2.907 5.554 1.00 0.51 N ATOM 0 H HIS A 115 7.494 -1.490 -0.250 1.00 0.30 H new ATOM 0 HA HIS A 115 8.349 -3.431 1.644 1.00 0.33 H new ATOM 0 HB2 HIS A 115 7.900 -0.946 1.974 1.00 0.38 H new ATOM 0 HB3 HIS A 115 6.187 -1.296 1.851 1.00 0.38 H new ATOM 0 HD1 HIS A 115 8.726 -0.829 4.320 1.00 0.45 H new ATOM 0 HD2 HIS A 115 5.500 -3.472 3.790 1.00 0.47 H new ATOM 0 HE1 HIS A 115 8.201 -1.839 6.597 1.00 0.49 H new ATOM 1960 N PHE A 116 5.189 -3.622 0.728 1.00 0.32 N ATOM 1961 CA PHE A 116 4.038 -4.528 0.688 1.00 0.33 C ATOM 1962 C PHE A 116 4.179 -5.636 -0.361 1.00 0.33 C ATOM 1963 O PHE A 116 3.265 -6.441 -0.534 1.00 0.36 O ATOM 1964 CB PHE A 116 2.746 -3.772 0.433 1.00 0.35 C ATOM 1965 CG PHE A 116 2.202 -3.095 1.653 1.00 0.37 C ATOM 1966 CD1 PHE A 116 2.773 -1.929 2.128 1.00 1.29 C ATOM 1967 CD2 PHE A 116 1.125 -3.635 2.330 1.00 1.21 C ATOM 1968 CE1 PHE A 116 2.280 -1.311 3.257 1.00 1.31 C ATOM 1969 CE2 PHE A 116 0.623 -3.023 3.459 1.00 1.25 C ATOM 1970 CZ PHE A 116 1.204 -1.859 3.925 1.00 0.50 C ATOM 0 H PHE A 116 5.026 -2.715 0.292 1.00 0.32 H new ATOM 0 HA PHE A 116 4.006 -4.997 1.672 1.00 0.33 H new ATOM 0 HB2 PHE A 116 2.918 -3.025 -0.342 1.00 0.35 H new ATOM 0 HB3 PHE A 116 1.998 -4.465 0.047 1.00 0.35 H new ATOM 0 HD1 PHE A 116 3.615 -1.497 1.608 1.00 1.29 H new ATOM 0 HD2 PHE A 116 0.671 -4.547 1.971 1.00 1.21 H new ATOM 0 HE1 PHE A 116 2.735 -0.400 3.618 1.00 1.31 H new ATOM 0 HE2 PHE A 116 -0.222 -3.452 3.978 1.00 1.25 H new ATOM 0 HZ PHE A 116 0.816 -1.379 4.811 1.00 0.50 H new ATOM 1980 N THR A 117 5.284 -5.635 -1.100 1.00 0.33 N ATOM 1981 CA THR A 117 5.497 -6.619 -2.155 1.00 0.37 C ATOM 1982 C THR A 117 5.304 -8.066 -1.664 1.00 0.36 C ATOM 1983 O THR A 117 4.321 -8.721 -2.015 1.00 0.47 O ATOM 1984 CB THR A 117 6.925 -6.480 -2.740 1.00 0.63 C ATOM 1985 OG1 THR A 117 6.999 -5.325 -3.574 1.00 1.18 O ATOM 1986 CG2 THR A 117 7.349 -7.708 -3.540 1.00 0.92 C ATOM 0 H THR A 117 6.045 -4.965 -0.988 1.00 0.33 H new ATOM 0 HA THR A 117 4.748 -6.417 -2.921 1.00 0.37 H new ATOM 0 HB THR A 117 7.608 -6.382 -1.896 1.00 0.63 H new ATOM 0 HG1 THR A 117 6.618 -4.556 -3.102 1.00 1.18 H new ATOM 0 HG21 THR A 117 8.357 -7.559 -3.928 1.00 0.92 H new ATOM 0 HG22 THR A 117 7.335 -8.586 -2.894 1.00 0.92 H new ATOM 0 HG23 THR A 117 6.659 -7.857 -4.370 1.00 0.92 H new ATOM 1994 N GLY A 118 6.248 -8.576 -0.884 1.00 0.43 N ATOM 1995 CA GLY A 118 6.120 -9.925 -0.385 1.00 0.59 C ATOM 1996 C GLY A 118 6.462 -10.102 1.065 1.00 0.49 C ATOM 1997 O GLY A 118 5.685 -9.786 1.956 1.00 0.54 O ATOM 0 H GLY A 118 7.092 -8.083 -0.592 1.00 0.43 H new ATOM 0 HA2 GLY A 118 5.095 -10.259 -0.544 1.00 0.59 H new ATOM 0 HA3 GLY A 118 6.763 -10.577 -0.976 1.00 0.59 H new ATOM 2001 N PRO A 119 7.656 -10.649 1.303 1.00 0.51 N ATOM 2002 CA PRO A 119 8.160 -10.933 2.640 1.00 0.52 C ATOM 2003 C PRO A 119 8.776 -9.727 3.344 1.00 0.43 C ATOM 2004 O PRO A 119 9.817 -9.215 2.926 1.00 0.42 O ATOM 2005 CB PRO A 119 9.240 -11.977 2.368 1.00 0.65 C ATOM 2006 CG PRO A 119 9.761 -11.639 1.010 1.00 0.72 C ATOM 2007 CD PRO A 119 8.597 -11.084 0.249 1.00 0.70 C ATOM 0 HA PRO A 119 7.357 -11.249 3.306 1.00 0.52 H new ATOM 0 HB2 PRO A 119 10.030 -11.934 3.117 1.00 0.65 H new ATOM 0 HB3 PRO A 119 8.830 -12.987 2.395 1.00 0.65 H new ATOM 0 HG2 PRO A 119 10.570 -10.911 1.072 1.00 0.72 H new ATOM 0 HG3 PRO A 119 10.165 -12.523 0.516 1.00 0.72 H new ATOM 0 HD2 PRO A 119 8.897 -10.251 -0.387 1.00 0.70 H new ATOM 0 HD3 PRO A 119 8.149 -11.836 -0.400 1.00 0.70 H new ATOM 2015 N VAL A 120 8.118 -9.277 4.410 1.00 0.43 N ATOM 2016 CA VAL A 120 8.608 -8.167 5.221 1.00 0.42 C ATOM 2017 C VAL A 120 10.049 -8.419 5.682 1.00 0.38 C ATOM 2018 O VAL A 120 10.859 -7.492 5.761 1.00 0.37 O ATOM 2019 CB VAL A 120 7.687 -7.916 6.443 1.00 0.49 C ATOM 2020 CG1 VAL A 120 7.533 -9.167 7.292 1.00 0.58 C ATOM 2021 CG2 VAL A 120 8.197 -6.754 7.281 1.00 0.53 C ATOM 0 H VAL A 120 7.234 -9.670 4.734 1.00 0.43 H new ATOM 0 HA VAL A 120 8.597 -7.273 4.597 1.00 0.42 H new ATOM 0 HB VAL A 120 6.701 -7.653 6.060 1.00 0.49 H new ATOM 0 HG11 VAL A 120 6.881 -8.954 8.139 1.00 0.58 H new ATOM 0 HG12 VAL A 120 7.097 -9.964 6.690 1.00 0.58 H new ATOM 0 HG13 VAL A 120 8.511 -9.482 7.657 1.00 0.58 H new ATOM 0 HG21 VAL A 120 7.533 -6.600 8.131 1.00 0.53 H new ATOM 0 HG22 VAL A 120 9.201 -6.978 7.641 1.00 0.53 H new ATOM 0 HG23 VAL A 120 8.223 -5.850 6.672 1.00 0.53 H new ATOM 2031 N SER A 121 10.350 -9.678 5.981 1.00 0.40 N ATOM 2032 CA SER A 121 11.677 -10.080 6.425 1.00 0.40 C ATOM 2033 C SER A 121 12.765 -9.614 5.453 1.00 0.36 C ATOM 2034 O SER A 121 13.820 -9.134 5.871 1.00 0.37 O ATOM 2035 CB SER A 121 11.719 -11.599 6.589 1.00 0.46 C ATOM 2036 OG SER A 121 10.542 -12.070 7.220 1.00 1.24 O ATOM 0 H SER A 121 9.682 -10.446 5.922 1.00 0.40 H new ATOM 0 HA SER A 121 11.877 -9.603 7.385 1.00 0.40 H new ATOM 0 HB2 SER A 121 11.828 -12.072 5.613 1.00 0.46 H new ATOM 0 HB3 SER A 121 12.591 -11.882 7.179 1.00 0.46 H new ATOM 0 HG SER A 121 10.589 -13.044 7.314 1.00 1.24 H new ATOM 2042 N TYR A 122 12.500 -9.756 4.155 1.00 0.36 N ATOM 2043 CA TYR A 122 13.434 -9.341 3.122 1.00 0.35 C ATOM 2044 C TYR A 122 13.753 -7.850 3.252 1.00 0.33 C ATOM 2045 O TYR A 122 14.896 -7.427 3.062 1.00 0.34 O ATOM 2046 CB TYR A 122 12.834 -9.643 1.752 1.00 0.38 C ATOM 2047 CG TYR A 122 13.734 -9.322 0.583 1.00 0.44 C ATOM 2048 CD1 TYR A 122 14.825 -10.122 0.285 1.00 1.29 C ATOM 2049 CD2 TYR A 122 13.481 -8.228 -0.230 1.00 1.29 C ATOM 2050 CE1 TYR A 122 15.645 -9.840 -0.791 1.00 1.36 C ATOM 2051 CE2 TYR A 122 14.294 -7.938 -1.311 1.00 1.35 C ATOM 2052 CZ TYR A 122 15.374 -8.748 -1.587 1.00 0.73 C ATOM 2053 OH TYR A 122 16.188 -8.467 -2.662 1.00 0.91 O ATOM 0 H TYR A 122 11.635 -10.160 3.796 1.00 0.36 H new ATOM 0 HA TYR A 122 14.366 -9.894 3.237 1.00 0.35 H new ATOM 0 HB2 TYR A 122 12.571 -10.700 1.711 1.00 0.38 H new ATOM 0 HB3 TYR A 122 11.907 -9.080 1.644 1.00 0.38 H new ATOM 0 HD1 TYR A 122 15.038 -10.981 0.904 1.00 1.29 H new ATOM 0 HD2 TYR A 122 12.635 -7.592 -0.016 1.00 1.29 H new ATOM 0 HE1 TYR A 122 16.494 -10.472 -1.007 1.00 1.36 H new ATOM 0 HE2 TYR A 122 14.084 -7.082 -1.935 1.00 1.35 H new ATOM 0 HH TYR A 122 15.859 -7.666 -3.120 1.00 0.91 H new ATOM 2063 N LEU A 123 12.737 -7.067 3.599 1.00 0.31 N ATOM 2064 CA LEU A 123 12.897 -5.630 3.771 1.00 0.31 C ATOM 2065 C LEU A 123 13.829 -5.347 4.939 1.00 0.31 C ATOM 2066 O LEU A 123 14.760 -4.550 4.828 1.00 0.31 O ATOM 2067 CB LEU A 123 11.543 -4.964 4.030 1.00 0.32 C ATOM 2068 CG LEU A 123 10.370 -5.527 3.230 1.00 0.34 C ATOM 2069 CD1 LEU A 123 9.061 -4.990 3.778 1.00 0.43 C ATOM 2070 CD2 LEU A 123 10.513 -5.186 1.755 1.00 0.34 C ATOM 0 H LEU A 123 11.790 -7.407 3.767 1.00 0.31 H new ATOM 0 HA LEU A 123 13.324 -5.221 2.855 1.00 0.31 H new ATOM 0 HB2 LEU A 123 11.312 -5.052 5.092 1.00 0.32 H new ATOM 0 HB3 LEU A 123 11.633 -3.900 3.810 1.00 0.32 H new ATOM 0 HG LEU A 123 10.371 -6.613 3.328 1.00 0.34 H new ATOM 0 HD11 LEU A 123 8.231 -5.397 3.201 1.00 0.43 H new ATOM 0 HD12 LEU A 123 8.956 -5.284 4.822 1.00 0.43 H new ATOM 0 HD13 LEU A 123 9.055 -3.902 3.705 1.00 0.43 H new ATOM 0 HD21 LEU A 123 9.667 -5.596 1.203 1.00 0.34 H new ATOM 0 HD22 LEU A 123 10.535 -4.103 1.632 1.00 0.34 H new ATOM 0 HD23 LEU A 123 11.439 -5.614 1.371 1.00 0.34 H new ATOM 2082 N ILE A 124 13.554 -6.005 6.061 1.00 0.36 N ATOM 2083 CA ILE A 124 14.362 -5.858 7.269 1.00 0.41 C ATOM 2084 C ILE A 124 15.833 -6.169 6.984 1.00 0.38 C ATOM 2085 O ILE A 124 16.732 -5.464 7.449 1.00 0.38 O ATOM 2086 CB ILE A 124 13.853 -6.775 8.405 1.00 0.52 C ATOM 2087 CG1 ILE A 124 12.365 -6.542 8.654 1.00 0.76 C ATOM 2088 CG2 ILE A 124 14.638 -6.527 9.680 1.00 1.01 C ATOM 2089 CD1 ILE A 124 11.779 -7.417 9.742 1.00 1.08 C ATOM 0 H ILE A 124 12.771 -6.651 6.160 1.00 0.36 H new ATOM 0 HA ILE A 124 14.271 -4.821 7.591 1.00 0.41 H new ATOM 0 HB ILE A 124 13.999 -7.811 8.099 1.00 0.52 H new ATOM 0 HG12 ILE A 124 12.211 -5.496 8.920 1.00 0.76 H new ATOM 0 HG13 ILE A 124 11.820 -6.718 7.727 1.00 0.76 H new ATOM 0 HG21 ILE A 124 14.266 -7.181 10.469 1.00 1.01 H new ATOM 0 HG22 ILE A 124 15.693 -6.735 9.504 1.00 1.01 H new ATOM 0 HG23 ILE A 124 14.519 -5.487 9.984 1.00 1.01 H new ATOM 0 HD11 ILE A 124 10.719 -7.192 9.859 1.00 1.08 H new ATOM 0 HD12 ILE A 124 11.899 -8.466 9.470 1.00 1.08 H new ATOM 0 HD13 ILE A 124 12.296 -7.224 10.682 1.00 1.08 H new ATOM 2101 N ARG A 125 16.065 -7.213 6.197 1.00 0.38 N ATOM 2102 CA ARG A 125 17.420 -7.622 5.839 1.00 0.41 C ATOM 2103 C ARG A 125 18.106 -6.543 5.010 1.00 0.36 C ATOM 2104 O ARG A 125 19.275 -6.215 5.235 1.00 0.38 O ATOM 2105 CB ARG A 125 17.384 -8.937 5.061 1.00 0.46 C ATOM 2106 CG ARG A 125 16.855 -10.101 5.881 1.00 1.30 C ATOM 2107 CD ARG A 125 17.830 -10.491 6.973 1.00 1.31 C ATOM 2108 NE ARG A 125 17.153 -10.907 8.198 1.00 2.16 N ATOM 2109 CZ ARG A 125 17.756 -11.555 9.190 1.00 2.81 C ATOM 2110 NH1 ARG A 125 19.041 -11.874 9.096 1.00 2.83 N ATOM 2111 NH2 ARG A 125 17.073 -11.879 10.279 1.00 3.80 N ATOM 0 H ARG A 125 15.330 -7.794 5.793 1.00 0.38 H new ATOM 0 HA ARG A 125 17.990 -7.767 6.757 1.00 0.41 H new ATOM 0 HB2 ARG A 125 16.761 -8.811 4.176 1.00 0.46 H new ATOM 0 HB3 ARG A 125 18.389 -9.173 4.712 1.00 0.46 H new ATOM 0 HG2 ARG A 125 15.897 -9.831 6.325 1.00 1.30 H new ATOM 0 HG3 ARG A 125 16.674 -10.956 5.229 1.00 1.30 H new ATOM 0 HD2 ARG A 125 18.464 -11.303 6.618 1.00 1.31 H new ATOM 0 HD3 ARG A 125 18.485 -9.647 7.191 1.00 1.31 H new ATOM 0 HE ARG A 125 16.162 -10.688 8.298 1.00 2.16 H new ATOM 0 HH11 ARG A 125 19.569 -11.622 8.261 1.00 2.83 H new ATOM 0 HH12 ARG A 125 19.500 -12.371 9.859 1.00 2.83 H new ATOM 0 HH21 ARG A 125 16.086 -11.631 10.355 1.00 3.80 H new ATOM 0 HH22 ARG A 125 17.534 -12.376 11.041 1.00 3.80 H new ATOM 2125 N ILE A 126 17.363 -5.991 4.064 1.00 0.34 N ATOM 2126 CA ILE A 126 17.875 -4.942 3.194 1.00 0.33 C ATOM 2127 C ILE A 126 18.156 -3.673 4.000 1.00 0.31 C ATOM 2128 O ILE A 126 19.166 -3.000 3.789 1.00 0.31 O ATOM 2129 CB ILE A 126 16.880 -4.667 2.030 1.00 0.34 C ATOM 2130 CG1 ILE A 126 17.423 -5.254 0.725 1.00 0.39 C ATOM 2131 CG2 ILE A 126 16.587 -3.183 1.856 1.00 0.38 C ATOM 2132 CD1 ILE A 126 17.534 -6.763 0.730 1.00 0.46 C ATOM 0 H ILE A 126 16.395 -6.254 3.878 1.00 0.34 H new ATOM 0 HA ILE A 126 18.816 -5.275 2.755 1.00 0.33 H new ATOM 0 HB ILE A 126 15.939 -5.153 2.287 1.00 0.34 H new ATOM 0 HG12 ILE A 126 16.774 -4.950 -0.096 1.00 0.39 H new ATOM 0 HG13 ILE A 126 18.407 -4.828 0.528 1.00 0.39 H new ATOM 0 HG21 ILE A 126 15.888 -3.044 1.031 1.00 0.38 H new ATOM 0 HG22 ILE A 126 16.149 -2.789 2.773 1.00 0.38 H new ATOM 0 HG23 ILE A 126 17.514 -2.652 1.639 1.00 0.38 H new ATOM 0 HD11 ILE A 126 17.926 -7.102 -0.229 1.00 0.46 H new ATOM 0 HD12 ILE A 126 18.207 -7.076 1.528 1.00 0.46 H new ATOM 0 HD13 ILE A 126 16.549 -7.200 0.894 1.00 0.46 H new ATOM 2144 N ARG A 127 17.275 -3.380 4.945 1.00 0.31 N ATOM 2145 CA ARG A 127 17.412 -2.206 5.793 1.00 0.33 C ATOM 2146 C ARG A 127 18.687 -2.280 6.626 1.00 0.33 C ATOM 2147 O ARG A 127 19.399 -1.287 6.778 1.00 0.34 O ATOM 2148 CB ARG A 127 16.192 -2.060 6.703 1.00 0.38 C ATOM 2149 CG ARG A 127 15.140 -1.107 6.161 1.00 1.09 C ATOM 2150 CD ARG A 127 15.566 0.345 6.331 1.00 1.30 C ATOM 2151 NE ARG A 127 15.818 0.685 7.731 1.00 1.79 N ATOM 2152 CZ ARG A 127 14.978 1.375 8.500 1.00 2.32 C ATOM 2153 NH1 ARG A 127 13.818 1.803 8.015 1.00 2.76 N ATOM 2154 NH2 ARG A 127 15.299 1.634 9.762 1.00 2.94 N ATOM 0 H ARG A 127 16.450 -3.946 5.145 1.00 0.31 H new ATOM 0 HA ARG A 127 17.476 -1.329 5.149 1.00 0.33 H new ATOM 0 HB2 ARG A 127 15.740 -3.041 6.851 1.00 0.38 H new ATOM 0 HB3 ARG A 127 16.519 -1.709 7.682 1.00 0.38 H new ATOM 0 HG2 ARG A 127 14.967 -1.316 5.105 1.00 1.09 H new ATOM 0 HG3 ARG A 127 14.195 -1.274 6.678 1.00 1.09 H new ATOM 0 HD2 ARG A 127 16.467 0.529 5.746 1.00 1.30 H new ATOM 0 HD3 ARG A 127 14.790 0.999 5.934 1.00 1.30 H new ATOM 0 HE ARG A 127 16.696 0.373 8.146 1.00 1.79 H new ATOM 0 HH11 ARG A 127 13.565 1.604 7.047 1.00 2.76 H new ATOM 0 HH12 ARG A 127 13.180 2.331 8.610 1.00 2.76 H new ATOM 0 HH21 ARG A 127 16.187 1.305 10.140 1.00 2.94 H new ATOM 0 HH22 ARG A 127 14.657 2.162 10.353 1.00 2.94 H new ATOM 2168 N ALA A 128 18.971 -3.462 7.156 1.00 0.35 N ATOM 2169 CA ALA A 128 20.165 -3.668 7.966 1.00 0.38 C ATOM 2170 C ALA A 128 21.420 -3.540 7.114 1.00 0.37 C ATOM 2171 O ALA A 128 22.414 -2.938 7.533 1.00 0.39 O ATOM 2172 CB ALA A 128 20.115 -5.025 8.651 1.00 0.42 C ATOM 0 H ALA A 128 18.391 -4.293 7.040 1.00 0.35 H new ATOM 0 HA ALA A 128 20.197 -2.897 8.735 1.00 0.38 H new ATOM 0 HB1 ALA A 128 21.014 -5.163 9.252 1.00 0.42 H new ATOM 0 HB2 ALA A 128 19.237 -5.075 9.295 1.00 0.42 H new ATOM 0 HB3 ALA A 128 20.058 -5.811 7.898 1.00 0.42 H new ATOM 2178 N ALA A 129 21.356 -4.088 5.904 1.00 0.36 N ATOM 2179 CA ALA A 129 22.479 -4.036 4.976 1.00 0.38 C ATOM 2180 C ALA A 129 22.828 -2.591 4.654 1.00 0.36 C ATOM 2181 O ALA A 129 23.990 -2.184 4.739 1.00 0.40 O ATOM 2182 CB ALA A 129 22.154 -4.803 3.703 1.00 0.40 C ATOM 0 H ALA A 129 20.535 -4.574 5.543 1.00 0.36 H new ATOM 0 HA ALA A 129 23.342 -4.505 5.447 1.00 0.38 H new ATOM 0 HB1 ALA A 129 23.003 -4.754 3.022 1.00 0.40 H new ATOM 0 HB2 ALA A 129 21.946 -5.844 3.949 1.00 0.40 H new ATOM 0 HB3 ALA A 129 21.279 -4.361 3.225 1.00 0.40 H new ATOM 2188 N LEU A 130 21.810 -1.812 4.303 1.00 0.33 N ATOM 2189 CA LEU A 130 21.999 -0.408 3.985 1.00 0.32 C ATOM 2190 C LEU A 130 22.550 0.332 5.196 1.00 0.33 C ATOM 2191 O LEU A 130 23.427 1.187 5.068 1.00 0.35 O ATOM 2192 CB LEU A 130 20.682 0.215 3.532 1.00 0.32 C ATOM 2193 CG LEU A 130 20.146 -0.315 2.204 1.00 0.36 C ATOM 2194 CD1 LEU A 130 18.630 -0.257 2.188 1.00 0.38 C ATOM 2195 CD2 LEU A 130 20.730 0.465 1.033 1.00 0.41 C ATOM 0 H LEU A 130 20.845 -2.134 4.233 1.00 0.33 H new ATOM 0 HA LEU A 130 22.717 -0.325 3.169 1.00 0.32 H new ATOM 0 HB2 LEU A 130 19.932 0.045 4.304 1.00 0.32 H new ATOM 0 HB3 LEU A 130 20.816 1.294 3.449 1.00 0.32 H new ATOM 0 HG LEU A 130 20.453 -1.356 2.099 1.00 0.36 H new ATOM 0 HD11 LEU A 130 18.261 -0.638 1.236 1.00 0.38 H new ATOM 0 HD12 LEU A 130 18.234 -0.867 3.000 1.00 0.38 H new ATOM 0 HD13 LEU A 130 18.304 0.775 2.317 1.00 0.38 H new ATOM 0 HD21 LEU A 130 20.333 0.069 0.098 1.00 0.41 H new ATOM 0 HD22 LEU A 130 20.459 1.517 1.125 1.00 0.41 H new ATOM 0 HD23 LEU A 130 21.816 0.368 1.036 1.00 0.41 H new ATOM 2207 N LYS A 131 22.057 -0.024 6.379 1.00 0.33 N ATOM 2208 CA LYS A 131 22.518 0.598 7.614 1.00 0.37 C ATOM 2209 C LYS A 131 24.033 0.466 7.723 1.00 0.39 C ATOM 2210 O LYS A 131 24.722 1.422 8.078 1.00 0.43 O ATOM 2211 CB LYS A 131 21.841 -0.038 8.826 1.00 0.40 C ATOM 2212 CG LYS A 131 21.322 0.979 9.831 1.00 0.53 C ATOM 2213 CD LYS A 131 22.449 1.807 10.431 1.00 0.69 C ATOM 2214 CE LYS A 131 22.291 3.286 10.114 1.00 0.82 C ATOM 2215 NZ LYS A 131 23.465 4.079 10.560 1.00 1.09 N ATOM 0 H LYS A 131 21.340 -0.738 6.507 1.00 0.33 H new ATOM 0 HA LYS A 131 22.252 1.655 7.594 1.00 0.37 H new ATOM 0 HB2 LYS A 131 21.011 -0.658 8.486 1.00 0.40 H new ATOM 0 HB3 LYS A 131 22.550 -0.700 9.323 1.00 0.40 H new ATOM 0 HG2 LYS A 131 20.606 1.640 9.342 1.00 0.53 H new ATOM 0 HG3 LYS A 131 20.787 0.462 10.628 1.00 0.53 H new ATOM 0 HD2 LYS A 131 22.468 1.667 11.512 1.00 0.69 H new ATOM 0 HD3 LYS A 131 23.405 1.453 10.047 1.00 0.69 H new ATOM 0 HE2 LYS A 131 22.154 3.414 9.040 1.00 0.82 H new ATOM 0 HE3 LYS A 131 21.391 3.666 10.598 1.00 0.82 H new ATOM 0 HZ1 LYS A 131 23.317 5.081 10.325 1.00 1.09 H new ATOM 0 HZ2 LYS A 131 23.582 3.978 11.589 1.00 1.09 H new ATOM 0 HZ3 LYS A 131 24.320 3.734 10.079 1.00 1.09 H new ATOM 2229 N LYS A 132 24.546 -0.717 7.401 1.00 0.40 N ATOM 2230 CA LYS A 132 25.982 -0.953 7.438 1.00 0.45 C ATOM 2231 C LYS A 132 26.665 -0.162 6.322 1.00 0.44 C ATOM 2232 O LYS A 132 27.818 0.251 6.455 1.00 0.47 O ATOM 2233 CB LYS A 132 26.297 -2.447 7.309 1.00 0.49 C ATOM 2234 CG LYS A 132 25.494 -3.344 8.250 1.00 0.53 C ATOM 2235 CD LYS A 132 25.460 -2.812 9.678 1.00 0.59 C ATOM 2236 CE LYS A 132 26.836 -2.814 10.325 1.00 0.92 C ATOM 2237 NZ LYS A 132 26.762 -2.487 11.777 1.00 1.39 N ATOM 0 H LYS A 132 23.991 -1.523 7.113 1.00 0.40 H new ATOM 0 HA LYS A 132 26.365 -0.614 8.401 1.00 0.45 H new ATOM 0 HB2 LYS A 132 26.109 -2.758 6.281 1.00 0.49 H new ATOM 0 HB3 LYS A 132 27.359 -2.600 7.499 1.00 0.49 H new ATOM 0 HG2 LYS A 132 24.474 -3.436 7.876 1.00 0.53 H new ATOM 0 HG3 LYS A 132 25.926 -4.345 8.249 1.00 0.53 H new ATOM 0 HD2 LYS A 132 25.063 -1.797 9.676 1.00 0.59 H new ATOM 0 HD3 LYS A 132 24.779 -3.420 10.274 1.00 0.59 H new ATOM 0 HE2 LYS A 132 27.298 -3.793 10.195 1.00 0.92 H new ATOM 0 HE3 LYS A 132 27.476 -2.090 9.821 1.00 0.92 H new ATOM 0 HZ1 LYS A 132 27.719 -2.498 12.184 1.00 1.39 H new ATOM 0 HZ2 LYS A 132 26.344 -1.543 11.899 1.00 1.39 H new ATOM 0 HZ3 LYS A 132 26.171 -3.192 12.262 1.00 1.39 H new ATOM 2251 N LYS A 133 25.928 0.061 5.234 1.00 0.42 N ATOM 2252 CA LYS A 133 26.428 0.823 4.089 1.00 0.44 C ATOM 2253 C LYS A 133 26.305 2.323 4.348 1.00 0.42 C ATOM 2254 O LYS A 133 26.689 3.138 3.508 1.00 0.45 O ATOM 2255 CB LYS A 133 25.639 0.461 2.829 1.00 0.49 C ATOM 2256 CG LYS A 133 25.931 -0.936 2.312 1.00 1.05 C ATOM 2257 CD LYS A 133 27.081 -0.920 1.318 1.00 1.48 C ATOM 2258 CE LYS A 133 27.861 -2.222 1.336 1.00 2.08 C ATOM 2259 NZ LYS A 133 29.236 -2.042 0.809 1.00 2.52 N ATOM 0 H LYS A 133 24.973 -0.279 5.121 1.00 0.42 H new ATOM 0 HA LYS A 133 27.479 0.571 3.945 1.00 0.44 H new ATOM 0 HB2 LYS A 133 24.573 0.546 3.040 1.00 0.49 H new ATOM 0 HB3 LYS A 133 25.867 1.185 2.046 1.00 0.49 H new ATOM 0 HG2 LYS A 133 26.176 -1.593 3.147 1.00 1.05 H new ATOM 0 HG3 LYS A 133 25.040 -1.345 1.836 1.00 1.05 H new ATOM 0 HD2 LYS A 133 26.692 -0.743 0.315 1.00 1.48 H new ATOM 0 HD3 LYS A 133 27.751 -0.092 1.551 1.00 1.48 H new ATOM 0 HE2 LYS A 133 27.909 -2.604 2.356 1.00 2.08 H new ATOM 0 HE3 LYS A 133 27.337 -2.969 0.740 1.00 2.08 H new ATOM 0 HZ1 LYS A 133 29.740 -2.951 0.836 1.00 2.52 H new ATOM 0 HZ2 LYS A 133 29.190 -1.701 -0.172 1.00 2.52 H new ATOM 0 HZ3 LYS A 133 29.744 -1.347 1.393 1.00 2.52 H new ATOM 2273 N ASN A 134 25.745 2.660 5.512 1.00 0.41 N ATOM 2274 CA ASN A 134 25.550 4.051 5.945 1.00 0.42 C ATOM 2275 C ASN A 134 24.402 4.681 5.167 1.00 0.40 C ATOM 2276 O ASN A 134 24.378 5.884 4.899 1.00 0.44 O ATOM 2277 CB ASN A 134 26.837 4.877 5.783 1.00 0.48 C ATOM 2278 CG ASN A 134 27.108 5.781 6.965 1.00 0.78 C ATOM 2279 OD1 ASN A 134 26.188 6.206 7.667 1.00 1.08 O ATOM 2280 ND2 ASN A 134 28.377 6.088 7.192 1.00 1.06 N ATOM 0 H ASN A 134 25.411 1.973 6.187 1.00 0.41 H new ATOM 0 HA ASN A 134 25.299 4.046 7.006 1.00 0.42 H new ATOM 0 HB2 ASN A 134 27.682 4.202 5.647 1.00 0.48 H new ATOM 0 HB3 ASN A 134 26.764 5.481 4.879 1.00 0.48 H new ATOM 0 HD21 ASN A 134 28.623 6.698 7.972 1.00 1.06 H new ATOM 0 HD22 ASN A 134 29.108 5.715 6.587 1.00 1.06 H new ATOM 2287 N TYR A 135 23.448 3.833 4.828 1.00 0.36 N ATOM 2288 CA TYR A 135 22.254 4.219 4.097 1.00 0.35 C ATOM 2289 C TYR A 135 21.022 3.877 4.930 1.00 0.34 C ATOM 2290 O TYR A 135 21.050 2.937 5.721 1.00 0.35 O ATOM 2291 CB TYR A 135 22.185 3.451 2.784 1.00 0.37 C ATOM 2292 CG TYR A 135 22.651 4.217 1.570 1.00 0.55 C ATOM 2293 CD1 TYR A 135 23.999 4.353 1.273 1.00 1.30 C ATOM 2294 CD2 TYR A 135 21.728 4.780 0.708 1.00 1.44 C ATOM 2295 CE1 TYR A 135 24.413 5.042 0.147 1.00 1.46 C ATOM 2296 CE2 TYR A 135 22.131 5.467 -0.422 1.00 1.66 C ATOM 2297 CZ TYR A 135 23.473 5.594 -0.700 1.00 1.17 C ATOM 2298 OH TYR A 135 23.876 6.278 -1.824 1.00 1.51 O ATOM 0 H TYR A 135 23.481 2.840 5.057 1.00 0.36 H new ATOM 0 HA TYR A 135 22.287 5.290 3.896 1.00 0.35 H new ATOM 0 HB2 TYR A 135 22.787 2.547 2.877 1.00 0.37 H new ATOM 0 HB3 TYR A 135 21.155 3.133 2.621 1.00 0.37 H new ATOM 0 HD1 TYR A 135 24.736 3.915 1.930 1.00 1.30 H new ATOM 0 HD2 TYR A 135 20.674 4.681 0.921 1.00 1.44 H new ATOM 0 HE1 TYR A 135 25.466 5.147 -0.068 1.00 1.46 H new ATOM 0 HE2 TYR A 135 21.396 5.902 -1.083 1.00 1.66 H new ATOM 0 HH TYR A 135 23.089 6.601 -2.310 1.00 1.51 H new ATOM 2308 N LYS A 136 19.953 4.639 4.780 1.00 0.34 N ATOM 2309 CA LYS A 136 18.731 4.367 5.507 1.00 0.35 C ATOM 2310 C LYS A 136 17.520 4.627 4.624 1.00 0.34 C ATOM 2311 O LYS A 136 17.312 5.735 4.144 1.00 0.36 O ATOM 2312 CB LYS A 136 18.674 5.221 6.767 1.00 0.39 C ATOM 2313 CG LYS A 136 17.351 5.140 7.505 1.00 1.36 C ATOM 2314 CD LYS A 136 17.384 5.974 8.766 1.00 1.43 C ATOM 2315 CE LYS A 136 17.406 7.459 8.447 1.00 1.18 C ATOM 2316 NZ LYS A 136 17.553 8.289 9.666 1.00 1.36 N ATOM 0 H LYS A 136 19.909 5.449 4.162 1.00 0.34 H new ATOM 0 HA LYS A 136 18.719 3.317 5.799 1.00 0.35 H new ATOM 0 HB2 LYS A 136 19.474 4.912 7.440 1.00 0.39 H new ATOM 0 HB3 LYS A 136 18.866 6.260 6.499 1.00 0.39 H new ATOM 0 HG2 LYS A 136 16.546 5.486 6.856 1.00 1.36 H new ATOM 0 HG3 LYS A 136 17.133 4.102 7.756 1.00 1.36 H new ATOM 0 HD2 LYS A 136 16.512 5.745 9.379 1.00 1.43 H new ATOM 0 HD3 LYS A 136 18.264 5.713 9.354 1.00 1.43 H new ATOM 0 HE2 LYS A 136 18.228 7.670 7.764 1.00 1.18 H new ATOM 0 HE3 LYS A 136 16.485 7.732 7.932 1.00 1.18 H new ATOM 0 HZ1 LYS A 136 17.563 9.295 9.402 1.00 1.36 H new ATOM 0 HZ2 LYS A 136 16.755 8.108 10.308 1.00 1.36 H new ATOM 0 HZ3 LYS A 136 18.444 8.048 10.145 1.00 1.36 H new ATOM 2330 N LEU A 137 16.743 3.586 4.394 1.00 0.34 N ATOM 2331 CA LEU A 137 15.548 3.679 3.575 1.00 0.36 C ATOM 2332 C LEU A 137 14.334 4.009 4.443 1.00 0.35 C ATOM 2333 O LEU A 137 14.256 3.586 5.598 1.00 0.36 O ATOM 2334 CB LEU A 137 15.353 2.350 2.830 1.00 0.43 C ATOM 2335 CG LEU A 137 13.922 2.010 2.399 1.00 0.40 C ATOM 2336 CD1 LEU A 137 13.581 2.695 1.092 1.00 0.66 C ATOM 2337 CD2 LEU A 137 13.749 0.504 2.272 1.00 0.64 C ATOM 0 H LEU A 137 16.921 2.654 4.768 1.00 0.34 H new ATOM 0 HA LEU A 137 15.658 4.482 2.846 1.00 0.36 H new ATOM 0 HB2 LEU A 137 15.983 2.362 1.941 1.00 0.43 H new ATOM 0 HB3 LEU A 137 15.717 1.545 3.468 1.00 0.43 H new ATOM 0 HG LEU A 137 13.237 2.374 3.165 1.00 0.40 H new ATOM 0 HD11 LEU A 137 12.561 2.441 0.803 1.00 0.66 H new ATOM 0 HD12 LEU A 137 13.665 3.775 1.214 1.00 0.66 H new ATOM 0 HD13 LEU A 137 14.271 2.363 0.316 1.00 0.66 H new ATOM 0 HD21 LEU A 137 12.727 0.280 1.965 1.00 0.64 H new ATOM 0 HD22 LEU A 137 14.445 0.119 1.526 1.00 0.64 H new ATOM 0 HD23 LEU A 137 13.951 0.032 3.234 1.00 0.64 H new ATOM 2349 N ASN A 138 13.401 4.768 3.884 1.00 0.35 N ATOM 2350 CA ASN A 138 12.184 5.156 4.583 1.00 0.37 C ATOM 2351 C ASN A 138 11.086 5.350 3.550 1.00 0.40 C ATOM 2352 O ASN A 138 11.378 5.530 2.372 1.00 0.40 O ATOM 2353 CB ASN A 138 12.378 6.436 5.406 1.00 0.40 C ATOM 2354 CG ASN A 138 12.239 6.193 6.898 1.00 0.52 C ATOM 2355 OD1 ASN A 138 11.553 6.936 7.595 1.00 0.68 O ATOM 2356 ND2 ASN A 138 12.898 5.161 7.401 1.00 0.81 N ATOM 0 H ASN A 138 13.467 5.132 2.933 1.00 0.35 H new ATOM 0 HA ASN A 138 11.913 4.370 5.287 1.00 0.37 H new ATOM 0 HB2 ASN A 138 13.364 6.852 5.199 1.00 0.40 H new ATOM 0 HB3 ASN A 138 11.646 7.180 5.092 1.00 0.40 H new ATOM 0 HD21 ASN A 138 12.846 4.960 8.400 1.00 0.81 H new ATOM 0 HD22 ASN A 138 13.458 4.566 6.790 1.00 0.81 H new ATOM 2363 N GLN A 139 9.835 5.342 3.983 1.00 0.45 N ATOM 2364 CA GLN A 139 8.707 5.481 3.055 1.00 0.53 C ATOM 2365 C GLN A 139 8.709 6.827 2.333 1.00 0.60 C ATOM 2366 O GLN A 139 8.072 6.975 1.298 1.00 0.92 O ATOM 2367 CB GLN A 139 7.382 5.303 3.794 1.00 0.63 C ATOM 2368 CG GLN A 139 6.348 4.534 2.987 1.00 1.09 C ATOM 2369 CD GLN A 139 4.942 4.681 3.541 1.00 1.95 C ATOM 2370 OE1 GLN A 139 4.501 3.885 4.371 1.00 2.36 O ATOM 2371 NE2 GLN A 139 4.234 5.704 3.090 1.00 2.87 N ATOM 0 H GLN A 139 9.569 5.242 4.963 1.00 0.45 H new ATOM 0 HA GLN A 139 8.821 4.699 2.304 1.00 0.53 H new ATOM 0 HB2 GLN A 139 7.564 4.780 4.733 1.00 0.63 H new ATOM 0 HB3 GLN A 139 6.980 6.284 4.048 1.00 0.63 H new ATOM 0 HG2 GLN A 139 6.365 4.884 1.955 1.00 1.09 H new ATOM 0 HG3 GLN A 139 6.619 3.478 2.970 1.00 1.09 H new ATOM 0 HE21 GLN A 139 4.638 6.340 2.402 1.00 2.87 H new ATOM 0 HE22 GLN A 139 3.285 5.857 3.430 1.00 2.87 H new ATOM 2380 N TYR A 140 9.454 7.790 2.858 1.00 0.47 N ATOM 2381 CA TYR A 140 9.494 9.121 2.256 1.00 0.53 C ATOM 2382 C TYR A 140 10.677 9.274 1.313 1.00 0.49 C ATOM 2383 O TYR A 140 10.697 10.178 0.477 1.00 0.54 O ATOM 2384 CB TYR A 140 9.567 10.205 3.333 1.00 0.60 C ATOM 2385 CG TYR A 140 8.931 9.803 4.642 1.00 0.63 C ATOM 2386 CD1 TYR A 140 7.580 10.023 4.881 1.00 1.33 C ATOM 2387 CD2 TYR A 140 9.682 9.190 5.632 1.00 1.37 C ATOM 2388 CE1 TYR A 140 7.000 9.642 6.077 1.00 1.38 C ATOM 2389 CE2 TYR A 140 9.113 8.805 6.823 1.00 1.42 C ATOM 2390 CZ TYR A 140 7.772 9.035 7.045 1.00 0.80 C ATOM 2391 OH TYR A 140 7.199 8.653 8.235 1.00 0.92 O ATOM 0 H TYR A 140 10.034 7.680 3.690 1.00 0.47 H new ATOM 0 HA TYR A 140 8.573 9.238 1.684 1.00 0.53 H new ATOM 0 HB2 TYR A 140 10.612 10.459 3.510 1.00 0.60 H new ATOM 0 HB3 TYR A 140 9.078 11.106 2.963 1.00 0.60 H new ATOM 0 HD1 TYR A 140 6.975 10.498 4.123 1.00 1.33 H new ATOM 0 HD2 TYR A 140 10.734 9.011 5.465 1.00 1.37 H new ATOM 0 HE1 TYR A 140 5.949 9.819 6.252 1.00 1.38 H new ATOM 0 HE2 TYR A 140 9.714 8.325 7.581 1.00 1.42 H new ATOM 0 HH TYR A 140 7.878 8.239 8.807 1.00 0.92 H new ATOM 2401 N GLY A 141 11.669 8.406 1.450 1.00 0.43 N ATOM 2402 CA GLY A 141 12.829 8.497 0.594 1.00 0.42 C ATOM 2403 C GLY A 141 14.030 7.785 1.163 1.00 0.38 C ATOM 2404 O GLY A 141 13.898 6.900 2.013 1.00 0.37 O ATOM 0 H GLY A 141 11.690 7.648 2.132 1.00 0.43 H new ATOM 0 HA2 GLY A 141 12.590 8.074 -0.382 1.00 0.42 H new ATOM 0 HA3 GLY A 141 13.076 9.547 0.434 1.00 0.42 H new ATOM 2408 N LEU A 142 15.205 8.178 0.701 1.00 0.38 N ATOM 2409 CA LEU A 142 16.444 7.580 1.152 1.00 0.37 C ATOM 2410 C LEU A 142 17.199 8.537 2.057 1.00 0.38 C ATOM 2411 O LEU A 142 17.022 9.744 1.981 1.00 0.54 O ATOM 2412 CB LEU A 142 17.311 7.216 -0.053 1.00 0.40 C ATOM 2413 CG LEU A 142 17.513 5.716 -0.281 1.00 0.47 C ATOM 2414 CD1 LEU A 142 18.328 5.113 0.851 1.00 0.85 C ATOM 2415 CD2 LEU A 142 16.174 5.005 -0.406 1.00 0.50 C ATOM 0 H LEU A 142 15.324 8.916 0.007 1.00 0.38 H new ATOM 0 HA LEU A 142 16.210 6.677 1.717 1.00 0.37 H new ATOM 0 HB2 LEU A 142 16.860 7.646 -0.948 1.00 0.40 H new ATOM 0 HB3 LEU A 142 18.288 7.684 0.068 1.00 0.40 H new ATOM 0 HG LEU A 142 18.060 5.583 -1.214 1.00 0.47 H new ATOM 0 HD11 LEU A 142 18.463 4.046 0.674 1.00 0.85 H new ATOM 0 HD12 LEU A 142 19.302 5.599 0.897 1.00 0.85 H new ATOM 0 HD13 LEU A 142 17.804 5.261 1.795 1.00 0.85 H new ATOM 0 HD21 LEU A 142 16.341 3.940 -0.568 1.00 0.50 H new ATOM 0 HD22 LEU A 142 15.600 5.147 0.509 1.00 0.50 H new ATOM 0 HD23 LEU A 142 15.620 5.417 -1.250 1.00 0.50 H new ATOM 2427 N PHE A 143 18.012 7.989 2.933 1.00 0.37 N ATOM 2428 CA PHE A 143 18.811 8.788 3.845 1.00 0.39 C ATOM 2429 C PHE A 143 20.261 8.339 3.801 1.00 0.40 C ATOM 2430 O PHE A 143 20.611 7.289 4.340 1.00 0.40 O ATOM 2431 CB PHE A 143 18.289 8.665 5.277 1.00 0.41 C ATOM 2432 CG PHE A 143 17.159 9.591 5.608 1.00 0.44 C ATOM 2433 CD1 PHE A 143 17.386 10.942 5.799 1.00 1.30 C ATOM 2434 CD2 PHE A 143 15.871 9.104 5.742 1.00 1.26 C ATOM 2435 CE1 PHE A 143 16.348 11.794 6.121 1.00 1.34 C ATOM 2436 CE2 PHE A 143 14.826 9.949 6.061 1.00 1.28 C ATOM 2437 CZ PHE A 143 15.063 11.299 6.252 1.00 0.58 C ATOM 0 H PHE A 143 18.140 6.982 3.036 1.00 0.37 H new ATOM 0 HA PHE A 143 18.740 9.829 3.531 1.00 0.39 H new ATOM 0 HB2 PHE A 143 17.962 7.639 5.444 1.00 0.41 H new ATOM 0 HB3 PHE A 143 19.111 8.854 5.967 1.00 0.41 H new ATOM 0 HD1 PHE A 143 18.387 11.335 5.695 1.00 1.30 H new ATOM 0 HD2 PHE A 143 15.680 8.051 5.596 1.00 1.26 H new ATOM 0 HE1 PHE A 143 16.539 12.846 6.270 1.00 1.34 H new ATOM 0 HE2 PHE A 143 13.825 9.557 6.161 1.00 1.28 H new ATOM 0 HZ PHE A 143 14.249 11.963 6.502 1.00 0.58 H new ATOM 2447 N LYS A 144 21.098 9.118 3.140 1.00 0.42 N ATOM 2448 CA LYS A 144 22.509 8.800 3.053 1.00 0.45 C ATOM 2449 C LYS A 144 23.220 9.448 4.231 1.00 0.56 C ATOM 2450 O LYS A 144 23.380 10.673 4.271 1.00 0.64 O ATOM 2451 CB LYS A 144 23.082 9.292 1.723 1.00 0.55 C ATOM 2452 CG LYS A 144 24.287 8.502 1.236 1.00 0.80 C ATOM 2453 CD LYS A 144 25.575 8.938 1.916 1.00 0.97 C ATOM 2454 CE LYS A 144 25.895 10.394 1.614 1.00 1.96 C ATOM 2455 NZ LYS A 144 27.319 10.724 1.879 1.00 2.30 N ATOM 0 H LYS A 144 20.824 9.974 2.657 1.00 0.42 H new ATOM 0 HA LYS A 144 22.656 7.721 3.092 1.00 0.45 H new ATOM 0 HB2 LYS A 144 22.301 9.247 0.964 1.00 0.55 H new ATOM 0 HB3 LYS A 144 23.365 10.339 1.827 1.00 0.55 H new ATOM 0 HG2 LYS A 144 24.122 7.441 1.421 1.00 0.80 H new ATOM 0 HG3 LYS A 144 24.388 8.625 0.158 1.00 0.80 H new ATOM 0 HD2 LYS A 144 25.485 8.799 2.993 1.00 0.97 H new ATOM 0 HD3 LYS A 144 26.397 8.306 1.581 1.00 0.97 H new ATOM 0 HE2 LYS A 144 25.663 10.606 0.570 1.00 1.96 H new ATOM 0 HE3 LYS A 144 25.256 11.037 2.219 1.00 1.96 H new ATOM 0 HZ1 LYS A 144 27.490 11.726 1.659 1.00 2.30 H new ATOM 0 HZ2 LYS A 144 27.536 10.548 2.881 1.00 2.30 H new ATOM 0 HZ3 LYS A 144 27.930 10.130 1.283 1.00 2.30 H new ATOM 2469 N ASN A 145 23.629 8.612 5.182 1.00 0.62 N ATOM 2470 CA ASN A 145 24.291 9.053 6.412 1.00 0.81 C ATOM 2471 C ASN A 145 23.308 9.835 7.285 1.00 0.99 C ATOM 2472 O ASN A 145 22.876 9.353 8.329 1.00 1.97 O ATOM 2473 CB ASN A 145 25.541 9.892 6.128 1.00 0.92 C ATOM 2474 CG ASN A 145 26.376 10.117 7.376 1.00 1.20 C ATOM 2475 OD1 ASN A 145 26.127 11.040 8.150 1.00 1.57 O ATOM 2476 ND2 ASN A 145 27.376 9.274 7.581 1.00 1.70 N ATOM 0 H ASN A 145 23.510 7.601 5.122 1.00 0.62 H new ATOM 0 HA ASN A 145 24.619 8.161 6.947 1.00 0.81 H new ATOM 0 HB2 ASN A 145 26.147 9.393 5.372 1.00 0.92 H new ATOM 0 HB3 ASN A 145 25.244 10.855 5.713 1.00 0.92 H new ATOM 0 HD21 ASN A 145 27.970 9.378 8.403 1.00 1.70 H new ATOM 0 HD22 ASN A 145 27.552 8.520 6.917 1.00 1.70 H new ATOM 2483 N GLN A 146 22.945 11.031 6.840 1.00 0.56 N ATOM 2484 CA GLN A 146 22.004 11.876 7.557 1.00 0.58 C ATOM 2485 C GLN A 146 21.274 12.806 6.590 1.00 0.55 C ATOM 2486 O GLN A 146 20.431 13.605 7.001 1.00 0.60 O ATOM 2487 CB GLN A 146 22.733 12.691 8.629 1.00 0.66 C ATOM 2488 CG GLN A 146 23.918 13.480 8.101 1.00 1.54 C ATOM 2489 CD GLN A 146 23.701 14.981 8.175 1.00 2.42 C ATOM 2490 OE1 GLN A 146 24.639 15.738 8.413 1.00 2.97 O ATOM 2491 NE2 GLN A 146 22.470 15.427 7.962 1.00 3.02 N ATOM 0 H GLN A 146 23.295 11.440 5.974 1.00 0.56 H new ATOM 0 HA GLN A 146 21.267 11.237 8.044 1.00 0.58 H new ATOM 0 HB2 GLN A 146 22.026 13.381 9.091 1.00 0.66 H new ATOM 0 HB3 GLN A 146 23.078 12.016 9.413 1.00 0.66 H new ATOM 0 HG2 GLN A 146 24.808 13.217 8.672 1.00 1.54 H new ATOM 0 HG3 GLN A 146 24.107 13.195 7.066 1.00 1.54 H new ATOM 0 HE21 GLN A 146 21.716 14.769 7.767 1.00 3.02 H new ATOM 0 HE22 GLN A 146 22.278 16.428 7.993 1.00 3.02 H new ATOM 2500 N THR A 147 21.601 12.695 5.306 1.00 0.51 N ATOM 2501 CA THR A 147 21.002 13.535 4.279 1.00 0.52 C ATOM 2502 C THR A 147 19.897 12.804 3.517 1.00 0.47 C ATOM 2503 O THR A 147 20.091 11.675 3.067 1.00 0.46 O ATOM 2504 CB THR A 147 22.072 14.005 3.273 1.00 0.56 C ATOM 2505 OG1 THR A 147 23.192 14.562 3.975 1.00 0.64 O ATOM 2506 CG2 THR A 147 21.504 15.036 2.304 1.00 0.62 C ATOM 0 H THR A 147 22.284 12.025 4.952 1.00 0.51 H new ATOM 0 HA THR A 147 20.565 14.394 4.789 1.00 0.52 H new ATOM 0 HB THR A 147 22.397 13.139 2.696 1.00 0.56 H new ATOM 0 HG1 THR A 147 23.868 14.857 3.330 1.00 0.64 H new ATOM 0 HG21 THR A 147 22.282 15.348 1.607 1.00 0.62 H new ATOM 0 HG22 THR A 147 20.675 14.596 1.749 1.00 0.62 H new ATOM 0 HG23 THR A 147 21.148 15.902 2.862 1.00 0.62 H new ATOM 2514 N LEU A 148 18.739 13.443 3.396 1.00 0.47 N ATOM 2515 CA LEU A 148 17.621 12.857 2.669 1.00 0.44 C ATOM 2516 C LEU A 148 17.880 12.910 1.172 1.00 0.44 C ATOM 2517 O LEU A 148 18.336 13.924 0.640 1.00 0.50 O ATOM 2518 CB LEU A 148 16.303 13.575 2.987 1.00 0.47 C ATOM 2519 CG LEU A 148 15.074 13.029 2.254 1.00 0.49 C ATOM 2520 CD1 LEU A 148 14.690 11.671 2.798 1.00 0.58 C ATOM 2521 CD2 LEU A 148 13.906 13.991 2.371 1.00 0.78 C ATOM 0 H LEU A 148 18.551 14.364 3.791 1.00 0.47 H new ATOM 0 HA LEU A 148 17.531 11.819 2.988 1.00 0.44 H new ATOM 0 HB2 LEU A 148 16.124 13.514 4.060 1.00 0.47 H new ATOM 0 HB3 LEU A 148 16.414 14.631 2.742 1.00 0.47 H new ATOM 0 HG LEU A 148 15.329 12.922 1.200 1.00 0.49 H new ATOM 0 HD11 LEU A 148 13.815 11.300 2.265 1.00 0.58 H new ATOM 0 HD12 LEU A 148 15.519 10.977 2.662 1.00 0.58 H new ATOM 0 HD13 LEU A 148 14.459 11.757 3.860 1.00 0.58 H new ATOM 0 HD21 LEU A 148 13.044 13.583 1.843 1.00 0.78 H new ATOM 0 HD22 LEU A 148 13.654 14.132 3.422 1.00 0.78 H new ATOM 0 HD23 LEU A 148 14.179 14.950 1.932 1.00 0.78 H new ATOM 2533 N VAL A 149 17.598 11.804 0.517 1.00 0.40 N ATOM 2534 CA VAL A 149 17.780 11.667 -0.915 1.00 0.41 C ATOM 2535 C VAL A 149 16.480 11.186 -1.559 1.00 0.39 C ATOM 2536 O VAL A 149 15.913 10.169 -1.145 1.00 0.43 O ATOM 2537 CB VAL A 149 18.919 10.672 -1.242 1.00 0.44 C ATOM 2538 CG1 VAL A 149 19.118 10.548 -2.744 1.00 0.52 C ATOM 2539 CG2 VAL A 149 20.218 11.093 -0.566 1.00 0.48 C ATOM 0 H VAL A 149 17.232 10.965 0.967 1.00 0.40 H new ATOM 0 HA VAL A 149 18.051 12.643 -1.316 1.00 0.41 H new ATOM 0 HB VAL A 149 18.631 9.695 -0.854 1.00 0.44 H new ATOM 0 HG11 VAL A 149 19.924 9.843 -2.947 1.00 0.52 H new ATOM 0 HG12 VAL A 149 18.197 10.189 -3.205 1.00 0.52 H new ATOM 0 HG13 VAL A 149 19.375 11.523 -3.159 1.00 0.52 H new ATOM 0 HG21 VAL A 149 21.004 10.378 -0.811 1.00 0.48 H new ATOM 0 HG22 VAL A 149 20.506 12.084 -0.917 1.00 0.48 H new ATOM 0 HG23 VAL A 149 20.074 11.119 0.514 1.00 0.48 H new ATOM 2549 N PRO A 150 15.970 11.929 -2.553 1.00 0.40 N ATOM 2550 CA PRO A 150 14.734 11.565 -3.248 1.00 0.42 C ATOM 2551 C PRO A 150 14.929 10.384 -4.198 1.00 0.35 C ATOM 2552 O PRO A 150 16.048 9.917 -4.398 1.00 0.42 O ATOM 2553 CB PRO A 150 14.382 12.829 -4.028 1.00 0.53 C ATOM 2554 CG PRO A 150 15.678 13.535 -4.237 1.00 0.68 C ATOM 2555 CD PRO A 150 16.547 13.190 -3.060 1.00 0.48 C ATOM 0 HA PRO A 150 13.955 11.245 -2.556 1.00 0.42 H new ATOM 0 HB2 PRO A 150 13.909 12.585 -4.979 1.00 0.53 H new ATOM 0 HB3 PRO A 150 13.680 13.451 -3.473 1.00 0.53 H new ATOM 0 HG2 PRO A 150 16.145 13.220 -5.170 1.00 0.68 H new ATOM 0 HG3 PRO A 150 15.526 14.612 -4.305 1.00 0.68 H new ATOM 0 HD2 PRO A 150 17.588 13.063 -3.355 1.00 0.48 H new ATOM 0 HD3 PRO A 150 16.524 13.973 -2.303 1.00 0.48 H new ATOM 2563 N LEU A 151 13.845 9.925 -4.808 1.00 0.43 N ATOM 2564 CA LEU A 151 13.904 8.786 -5.709 1.00 0.40 C ATOM 2565 C LEU A 151 13.679 9.190 -7.163 1.00 0.39 C ATOM 2566 O LEU A 151 12.975 10.159 -7.450 1.00 0.56 O ATOM 2567 CB LEU A 151 12.889 7.696 -5.298 1.00 0.62 C ATOM 2568 CG LEU A 151 11.517 8.142 -4.725 1.00 0.87 C ATOM 2569 CD1 LEU A 151 11.642 8.649 -3.291 1.00 1.11 C ATOM 2570 CD2 LEU A 151 10.843 9.184 -5.607 1.00 1.31 C ATOM 0 H LEU A 151 12.914 10.325 -4.694 1.00 0.43 H new ATOM 0 HA LEU A 151 14.911 8.377 -5.629 1.00 0.40 H new ATOM 0 HB2 LEU A 151 12.697 7.075 -6.173 1.00 0.62 H new ATOM 0 HB3 LEU A 151 13.368 7.060 -4.554 1.00 0.62 H new ATOM 0 HG LEU A 151 10.882 7.256 -4.714 1.00 0.87 H new ATOM 0 HD11 LEU A 151 10.661 8.952 -2.925 1.00 1.11 H new ATOM 0 HD12 LEU A 151 12.036 7.855 -2.657 1.00 1.11 H new ATOM 0 HD13 LEU A 151 12.318 9.503 -3.265 1.00 1.11 H new ATOM 0 HD21 LEU A 151 9.886 9.468 -5.169 1.00 1.31 H new ATOM 0 HD22 LEU A 151 11.482 10.064 -5.684 1.00 1.31 H new ATOM 0 HD23 LEU A 151 10.678 8.768 -6.601 1.00 1.31 H new ATOM 2582 N LYS A 152 14.342 8.469 -8.065 1.00 0.40 N ATOM 2583 CA LYS A 152 14.220 8.690 -9.506 1.00 0.53 C ATOM 2584 C LYS A 152 13.621 7.468 -10.186 1.00 0.50 C ATOM 2585 O LYS A 152 13.941 7.161 -11.336 1.00 0.58 O ATOM 2586 CB LYS A 152 15.595 8.972 -10.120 1.00 0.72 C ATOM 2587 CG LYS A 152 16.424 9.947 -9.316 1.00 0.84 C ATOM 2588 CD LYS A 152 15.754 11.296 -9.265 1.00 1.45 C ATOM 2589 CE LYS A 152 15.963 11.963 -7.924 1.00 1.66 C ATOM 2590 NZ LYS A 152 15.416 13.348 -7.910 1.00 2.55 N ATOM 0 H LYS A 152 14.981 7.713 -7.817 1.00 0.40 H new ATOM 0 HA LYS A 152 13.566 9.548 -9.659 1.00 0.53 H new ATOM 0 HB2 LYS A 152 16.142 8.034 -10.214 1.00 0.72 H new ATOM 0 HB3 LYS A 152 15.461 9.366 -11.128 1.00 0.72 H new ATOM 0 HG2 LYS A 152 16.564 9.566 -8.304 1.00 0.84 H new ATOM 0 HG3 LYS A 152 17.415 10.043 -9.760 1.00 0.84 H new ATOM 0 HD2 LYS A 152 16.152 11.932 -10.056 1.00 1.45 H new ATOM 0 HD3 LYS A 152 14.687 11.182 -9.454 1.00 1.45 H new ATOM 0 HE2 LYS A 152 15.481 11.373 -7.144 1.00 1.66 H new ATOM 0 HE3 LYS A 152 17.028 11.989 -7.692 1.00 1.66 H new ATOM 0 HZ1 LYS A 152 15.938 13.920 -7.216 1.00 2.55 H new ATOM 0 HZ2 LYS A 152 15.518 13.771 -8.855 1.00 2.55 H new ATOM 0 HZ3 LYS A 152 14.410 13.321 -7.649 1.00 2.55 H new ATOM 2604 N ILE A 153 12.742 6.779 -9.485 1.00 0.43 N ATOM 2605 CA ILE A 153 12.139 5.567 -10.024 1.00 0.43 C ATOM 2606 C ILE A 153 10.658 5.474 -9.714 1.00 0.45 C ATOM 2607 O ILE A 153 10.109 6.278 -8.963 1.00 0.48 O ATOM 2608 CB ILE A 153 12.820 4.294 -9.477 1.00 0.39 C ATOM 2609 CG1 ILE A 153 12.578 4.149 -7.968 1.00 0.38 C ATOM 2610 CG2 ILE A 153 14.308 4.300 -9.791 1.00 0.42 C ATOM 2611 CD1 ILE A 153 13.686 4.706 -7.104 1.00 0.40 C ATOM 0 H ILE A 153 12.429 7.032 -8.548 1.00 0.43 H new ATOM 0 HA ILE A 153 12.281 5.630 -11.103 1.00 0.43 H new ATOM 0 HB ILE A 153 12.374 3.432 -9.973 1.00 0.39 H new ATOM 0 HG12 ILE A 153 11.646 4.652 -7.711 1.00 0.38 H new ATOM 0 HG13 ILE A 153 12.446 3.093 -7.733 1.00 0.38 H new ATOM 0 HG21 ILE A 153 14.767 3.394 -9.396 1.00 0.42 H new ATOM 0 HG22 ILE A 153 14.452 4.339 -10.871 1.00 0.42 H new ATOM 0 HG23 ILE A 153 14.773 5.172 -9.332 1.00 0.42 H new ATOM 0 HD11 ILE A 153 13.435 4.563 -6.053 1.00 0.40 H new ATOM 0 HD12 ILE A 153 14.618 4.187 -7.328 1.00 0.40 H new ATOM 0 HD13 ILE A 153 13.805 5.770 -7.307 1.00 0.40 H new ATOM 2623 N THR A 154 10.024 4.476 -10.314 1.00 0.47 N ATOM 2624 CA THR A 154 8.606 4.223 -10.101 1.00 0.52 C ATOM 2625 C THR A 154 8.307 2.718 -10.192 1.00 0.53 C ATOM 2626 O THR A 154 7.202 2.267 -9.874 1.00 0.74 O ATOM 2627 CB THR A 154 7.733 5.014 -11.109 1.00 0.61 C ATOM 2628 OG1 THR A 154 6.443 5.290 -10.544 1.00 0.70 O ATOM 2629 CG2 THR A 154 7.562 4.251 -12.413 1.00 0.71 C ATOM 0 H THR A 154 10.474 3.824 -10.957 1.00 0.47 H new ATOM 0 HA THR A 154 8.353 4.569 -9.099 1.00 0.52 H new ATOM 0 HB THR A 154 8.246 5.952 -11.322 1.00 0.61 H new ATOM 0 HG1 THR A 154 5.903 5.791 -11.190 1.00 0.70 H new ATOM 0 HG21 THR A 154 6.945 4.833 -13.097 1.00 0.71 H new ATOM 0 HG22 THR A 154 8.539 4.077 -12.864 1.00 0.71 H new ATOM 0 HG23 THR A 154 7.079 3.294 -12.214 1.00 0.71 H new ATOM 2637 N THR A 155 9.301 1.937 -10.608 1.00 0.45 N ATOM 2638 CA THR A 155 9.136 0.499 -10.733 1.00 0.46 C ATOM 2639 C THR A 155 9.960 -0.222 -9.674 1.00 0.42 C ATOM 2640 O THR A 155 11.033 0.252 -9.300 1.00 0.40 O ATOM 2641 CB THR A 155 9.562 0.015 -12.133 1.00 0.51 C ATOM 2642 OG1 THR A 155 9.047 0.909 -13.130 1.00 0.62 O ATOM 2643 CG2 THR A 155 9.059 -1.400 -12.399 1.00 0.56 C ATOM 0 H THR A 155 10.227 2.280 -10.863 1.00 0.45 H new ATOM 0 HA THR A 155 8.080 0.269 -10.589 1.00 0.46 H new ATOM 0 HB THR A 155 10.651 0.004 -12.177 1.00 0.51 H new ATOM 0 HG1 THR A 155 9.321 0.600 -14.019 1.00 0.62 H new ATOM 0 HG21 THR A 155 9.373 -1.717 -13.393 1.00 0.56 H new ATOM 0 HG22 THR A 155 9.473 -2.079 -11.654 1.00 0.56 H new ATOM 0 HG23 THR A 155 7.971 -1.416 -12.340 1.00 0.56 H new ATOM 2651 N GLU A 156 9.447 -1.348 -9.189 1.00 0.44 N ATOM 2652 CA GLU A 156 10.125 -2.144 -8.170 1.00 0.43 C ATOM 2653 C GLU A 156 11.521 -2.538 -8.634 1.00 0.41 C ATOM 2654 O GLU A 156 12.485 -2.439 -7.876 1.00 0.39 O ATOM 2655 CB GLU A 156 9.305 -3.394 -7.837 1.00 0.50 C ATOM 2656 CG GLU A 156 7.853 -3.095 -7.480 1.00 0.53 C ATOM 2657 CD GLU A 156 6.929 -3.140 -8.683 1.00 1.06 C ATOM 2658 OE1 GLU A 156 6.985 -2.210 -9.521 1.00 1.72 O ATOM 2659 OE2 GLU A 156 6.141 -4.101 -8.799 1.00 1.75 O ATOM 0 H GLU A 156 8.552 -1.734 -9.490 1.00 0.44 H new ATOM 0 HA GLU A 156 10.220 -1.537 -7.270 1.00 0.43 H new ATOM 0 HB2 GLU A 156 9.328 -4.072 -8.691 1.00 0.50 H new ATOM 0 HB3 GLU A 156 9.775 -3.915 -7.003 1.00 0.50 H new ATOM 0 HG2 GLU A 156 7.511 -3.816 -6.738 1.00 0.53 H new ATOM 0 HG3 GLU A 156 7.793 -2.109 -7.018 1.00 0.53 H new ATOM 2666 N LYS A 157 11.621 -2.971 -9.887 1.00 0.44 N ATOM 2667 CA LYS A 157 12.908 -3.356 -10.459 1.00 0.44 C ATOM 2668 C LYS A 157 13.856 -2.162 -10.434 1.00 0.40 C ATOM 2669 O LYS A 157 14.998 -2.252 -9.973 1.00 0.39 O ATOM 2670 CB LYS A 157 12.734 -3.848 -11.899 1.00 0.49 C ATOM 2671 CG LYS A 157 11.736 -4.985 -12.053 1.00 0.69 C ATOM 2672 CD LYS A 157 12.293 -6.299 -11.524 1.00 1.05 C ATOM 2673 CE LYS A 157 12.504 -7.312 -12.641 1.00 1.58 C ATOM 2674 NZ LYS A 157 11.216 -7.799 -13.210 1.00 2.00 N ATOM 0 H LYS A 157 10.830 -3.064 -10.524 1.00 0.44 H new ATOM 0 HA LYS A 157 13.326 -4.168 -9.864 1.00 0.44 H new ATOM 0 HB2 LYS A 157 12.414 -3.012 -12.521 1.00 0.49 H new ATOM 0 HB3 LYS A 157 13.702 -4.175 -12.279 1.00 0.49 H new ATOM 0 HG2 LYS A 157 10.818 -4.738 -11.520 1.00 0.69 H new ATOM 0 HG3 LYS A 157 11.473 -5.098 -13.105 1.00 0.69 H new ATOM 0 HD2 LYS A 157 13.240 -6.115 -11.016 1.00 1.05 H new ATOM 0 HD3 LYS A 157 11.609 -6.712 -10.783 1.00 1.05 H new ATOM 0 HE2 LYS A 157 13.100 -6.858 -13.433 1.00 1.58 H new ATOM 0 HE3 LYS A 157 13.073 -8.159 -12.258 1.00 1.58 H new ATOM 0 HZ1 LYS A 157 11.397 -8.614 -13.830 1.00 2.00 H new ATOM 0 HZ2 LYS A 157 10.581 -8.085 -12.437 1.00 2.00 H new ATOM 0 HZ3 LYS A 157 10.770 -7.038 -13.761 1.00 2.00 H new ATOM 2688 N GLU A 158 13.362 -1.040 -10.925 1.00 0.41 N ATOM 2689 CA GLU A 158 14.136 0.185 -10.956 1.00 0.39 C ATOM 2690 C GLU A 158 14.587 0.552 -9.543 1.00 0.35 C ATOM 2691 O GLU A 158 15.738 0.928 -9.321 1.00 0.34 O ATOM 2692 CB GLU A 158 13.294 1.301 -11.571 1.00 0.43 C ATOM 2693 CG GLU A 158 14.073 2.237 -12.484 1.00 0.53 C ATOM 2694 CD GLU A 158 15.295 1.587 -13.111 1.00 1.06 C ATOM 2695 OE1 GLU A 158 15.139 0.668 -13.939 1.00 1.71 O ATOM 2696 OE2 GLU A 158 16.424 1.998 -12.776 1.00 1.71 O ATOM 0 H GLU A 158 12.421 -0.953 -11.310 1.00 0.41 H new ATOM 0 HA GLU A 158 15.026 0.043 -11.568 1.00 0.39 H new ATOM 0 HB2 GLU A 158 12.477 0.855 -12.138 1.00 0.43 H new ATOM 0 HB3 GLU A 158 12.843 1.885 -10.769 1.00 0.43 H new ATOM 0 HG2 GLU A 158 13.413 2.593 -13.275 1.00 0.53 H new ATOM 0 HG3 GLU A 158 14.388 3.111 -11.914 1.00 0.53 H new ATOM 2703 N LEU A 159 13.680 0.390 -8.589 1.00 0.35 N ATOM 2704 CA LEU A 159 13.965 0.696 -7.198 1.00 0.32 C ATOM 2705 C LEU A 159 15.059 -0.212 -6.644 1.00 0.31 C ATOM 2706 O LEU A 159 16.034 0.278 -6.079 1.00 0.30 O ATOM 2707 CB LEU A 159 12.699 0.559 -6.350 1.00 0.34 C ATOM 2708 CG LEU A 159 12.894 0.794 -4.851 1.00 0.36 C ATOM 2709 CD1 LEU A 159 13.242 2.245 -4.575 1.00 0.55 C ATOM 2710 CD2 LEU A 159 11.649 0.400 -4.084 1.00 0.41 C ATOM 0 H LEU A 159 12.735 0.046 -8.757 1.00 0.35 H new ATOM 0 HA LEU A 159 14.318 1.726 -7.152 1.00 0.32 H new ATOM 0 HB2 LEU A 159 11.955 1.265 -6.719 1.00 0.34 H new ATOM 0 HB3 LEU A 159 12.289 -0.441 -6.495 1.00 0.34 H new ATOM 0 HG LEU A 159 13.722 0.170 -4.516 1.00 0.36 H new ATOM 0 HD11 LEU A 159 13.376 2.389 -3.503 1.00 0.55 H new ATOM 0 HD12 LEU A 159 14.165 2.503 -5.094 1.00 0.55 H new ATOM 0 HD13 LEU A 159 12.435 2.886 -4.929 1.00 0.55 H new ATOM 0 HD21 LEU A 159 11.807 0.574 -3.020 1.00 0.41 H new ATOM 0 HD22 LEU A 159 10.805 0.998 -4.428 1.00 0.41 H new ATOM 0 HD23 LEU A 159 11.438 -0.656 -4.251 1.00 0.41 H new ATOM 2722 N ILE A 160 14.918 -1.531 -6.820 1.00 0.33 N ATOM 2723 CA ILE A 160 15.918 -2.463 -6.304 1.00 0.34 C ATOM 2724 C ILE A 160 17.286 -2.213 -6.932 1.00 0.33 C ATOM 2725 O ILE A 160 18.296 -2.198 -6.223 1.00 0.33 O ATOM 2726 CB ILE A 160 15.516 -3.950 -6.476 1.00 0.38 C ATOM 2727 CG1 ILE A 160 15.040 -4.249 -7.894 1.00 0.40 C ATOM 2728 CG2 ILE A 160 14.439 -4.316 -5.473 1.00 0.43 C ATOM 2729 CD1 ILE A 160 16.078 -4.941 -8.761 1.00 0.42 C ATOM 0 H ILE A 160 14.135 -1.968 -7.307 1.00 0.33 H new ATOM 0 HA ILE A 160 15.976 -2.270 -5.233 1.00 0.34 H new ATOM 0 HB ILE A 160 16.403 -4.557 -6.293 1.00 0.38 H new ATOM 0 HG12 ILE A 160 14.149 -4.875 -7.843 1.00 0.40 H new ATOM 0 HG13 ILE A 160 14.746 -3.315 -8.372 1.00 0.40 H new ATOM 0 HG21 ILE A 160 14.163 -5.363 -5.601 1.00 0.43 H new ATOM 0 HG22 ILE A 160 14.816 -4.161 -4.462 1.00 0.43 H new ATOM 0 HG23 ILE A 160 13.563 -3.687 -5.634 1.00 0.43 H new ATOM 0 HD11 ILE A 160 15.663 -5.119 -9.753 1.00 0.42 H new ATOM 0 HD12 ILE A 160 16.962 -4.309 -8.845 1.00 0.42 H new ATOM 0 HD13 ILE A 160 16.355 -5.893 -8.307 1.00 0.42 H new ATOM 2741 N LYS A 161 17.335 -1.976 -8.249 1.00 0.34 N ATOM 2742 CA LYS A 161 18.622 -1.726 -8.892 1.00 0.35 C ATOM 2743 C LYS A 161 19.151 -0.343 -8.507 1.00 0.34 C ATOM 2744 O LYS A 161 20.363 -0.123 -8.489 1.00 0.37 O ATOM 2745 CB LYS A 161 18.559 -1.910 -10.418 1.00 0.41 C ATOM 2746 CG LYS A 161 17.517 -1.066 -11.115 1.00 0.78 C ATOM 2747 CD LYS A 161 17.024 -1.747 -12.377 1.00 1.43 C ATOM 2748 CE LYS A 161 17.940 -1.445 -13.549 1.00 1.61 C ATOM 2749 NZ LYS A 161 17.853 -0.019 -13.969 1.00 2.63 N ATOM 0 H LYS A 161 16.525 -1.953 -8.869 1.00 0.34 H new ATOM 0 HA LYS A 161 19.325 -2.474 -8.526 1.00 0.35 H new ATOM 0 HB2 LYS A 161 19.537 -1.676 -10.839 1.00 0.41 H new ATOM 0 HB3 LYS A 161 18.361 -2.960 -10.636 1.00 0.41 H new ATOM 0 HG2 LYS A 161 16.678 -0.888 -10.442 1.00 0.78 H new ATOM 0 HG3 LYS A 161 17.939 -0.092 -11.364 1.00 0.78 H new ATOM 0 HD2 LYS A 161 16.974 -2.824 -12.218 1.00 1.43 H new ATOM 0 HD3 LYS A 161 16.012 -1.411 -12.605 1.00 1.43 H new ATOM 0 HE2 LYS A 161 18.969 -1.681 -13.276 1.00 1.61 H new ATOM 0 HE3 LYS A 161 17.678 -2.088 -14.390 1.00 1.61 H new ATOM 0 HZ1 LYS A 161 18.792 0.312 -14.271 1.00 2.63 H new ATOM 0 HZ2 LYS A 161 17.184 0.070 -14.760 1.00 2.63 H new ATOM 0 HZ3 LYS A 161 17.523 0.559 -13.170 1.00 2.63 H new ATOM 2763 N GLU A 162 18.245 0.586 -8.191 1.00 0.33 N ATOM 2764 CA GLU A 162 18.652 1.914 -7.756 1.00 0.35 C ATOM 2765 C GLU A 162 19.235 1.824 -6.342 1.00 0.34 C ATOM 2766 O GLU A 162 20.217 2.489 -6.013 1.00 0.37 O ATOM 2767 CB GLU A 162 17.468 2.884 -7.785 1.00 0.36 C ATOM 2768 CG GLU A 162 17.851 4.321 -8.111 1.00 0.66 C ATOM 2769 CD GLU A 162 17.780 5.248 -6.912 1.00 0.92 C ATOM 2770 OE1 GLU A 162 18.683 5.189 -6.052 1.00 1.73 O ATOM 2771 OE2 GLU A 162 16.828 6.051 -6.829 1.00 1.62 O ATOM 0 H GLU A 162 17.236 0.441 -8.229 1.00 0.33 H new ATOM 0 HA GLU A 162 19.411 2.295 -8.439 1.00 0.35 H new ATOM 0 HB2 GLU A 162 16.745 2.536 -8.522 1.00 0.36 H new ATOM 0 HB3 GLU A 162 16.971 2.863 -6.815 1.00 0.36 H new ATOM 0 HG2 GLU A 162 18.863 4.337 -8.514 1.00 0.66 H new ATOM 0 HG3 GLU A 162 17.190 4.697 -8.892 1.00 0.66 H new ATOM 2778 N LEU A 163 18.626 0.969 -5.516 1.00 0.32 N ATOM 2779 CA LEU A 163 19.074 0.769 -4.139 1.00 0.33 C ATOM 2780 C LEU A 163 20.370 -0.026 -4.090 1.00 0.34 C ATOM 2781 O LEU A 163 21.157 0.118 -3.154 1.00 0.36 O ATOM 2782 CB LEU A 163 18.004 0.041 -3.325 1.00 0.33 C ATOM 2783 CG LEU A 163 16.693 0.801 -3.134 1.00 0.35 C ATOM 2784 CD1 LEU A 163 15.649 -0.108 -2.514 1.00 0.35 C ATOM 2785 CD2 LEU A 163 16.905 2.034 -2.276 1.00 0.46 C ATOM 0 H LEU A 163 17.819 0.404 -5.780 1.00 0.32 H new ATOM 0 HA LEU A 163 19.250 1.754 -3.708 1.00 0.33 H new ATOM 0 HB2 LEU A 163 17.785 -0.909 -3.812 1.00 0.33 H new ATOM 0 HB3 LEU A 163 18.415 -0.192 -2.343 1.00 0.33 H new ATOM 0 HG LEU A 163 16.337 1.128 -4.111 1.00 0.35 H new ATOM 0 HD11 LEU A 163 14.718 0.444 -2.382 1.00 0.35 H new ATOM 0 HD12 LEU A 163 15.475 -0.962 -3.169 1.00 0.35 H new ATOM 0 HD13 LEU A 163 16.002 -0.460 -1.545 1.00 0.35 H new ATOM 0 HD21 LEU A 163 15.958 2.559 -2.154 1.00 0.46 H new ATOM 0 HD22 LEU A 163 17.284 1.736 -1.298 1.00 0.46 H new ATOM 0 HD23 LEU A 163 17.626 2.694 -2.759 1.00 0.46 H new ATOM 2797 N GLY A 164 20.603 -0.848 -5.106 1.00 0.33 N ATOM 2798 CA GLY A 164 21.814 -1.639 -5.145 1.00 0.35 C ATOM 2799 C GLY A 164 21.595 -3.091 -4.769 1.00 0.37 C ATOM 2800 O GLY A 164 22.502 -3.741 -4.245 1.00 0.43 O ATOM 0 H GLY A 164 19.976 -0.979 -5.900 1.00 0.33 H new ATOM 0 HA2 GLY A 164 22.239 -1.591 -6.148 1.00 0.35 H new ATOM 0 HA3 GLY A 164 22.547 -1.202 -4.467 1.00 0.35 H new ATOM 2804 N PHE A 165 20.405 -3.613 -5.038 1.00 0.35 N ATOM 2805 CA PHE A 165 20.098 -5.000 -4.710 1.00 0.38 C ATOM 2806 C PHE A 165 19.503 -5.736 -5.903 1.00 0.41 C ATOM 2807 O PHE A 165 18.908 -5.129 -6.793 1.00 0.45 O ATOM 2808 CB PHE A 165 19.137 -5.075 -3.523 1.00 0.38 C ATOM 2809 CG PHE A 165 19.713 -4.530 -2.243 1.00 0.37 C ATOM 2810 CD1 PHE A 165 20.668 -5.243 -1.538 1.00 1.23 C ATOM 2811 CD2 PHE A 165 19.301 -3.303 -1.750 1.00 1.23 C ATOM 2812 CE1 PHE A 165 21.201 -4.744 -0.361 1.00 1.25 C ATOM 2813 CE2 PHE A 165 19.829 -2.799 -0.576 1.00 1.25 C ATOM 2814 CZ PHE A 165 20.781 -3.520 0.121 1.00 0.48 C ATOM 0 H PHE A 165 19.641 -3.101 -5.479 1.00 0.35 H new ATOM 0 HA PHE A 165 21.036 -5.486 -4.441 1.00 0.38 H new ATOM 0 HB2 PHE A 165 18.229 -4.523 -3.766 1.00 0.38 H new ATOM 0 HB3 PHE A 165 18.846 -6.114 -3.367 1.00 0.38 H new ATOM 0 HD1 PHE A 165 21.001 -6.200 -1.911 1.00 1.23 H new ATOM 0 HD2 PHE A 165 18.559 -2.733 -2.289 1.00 1.23 H new ATOM 0 HE1 PHE A 165 21.944 -5.312 0.179 1.00 1.25 H new ATOM 0 HE2 PHE A 165 19.498 -1.841 -0.203 1.00 1.25 H new ATOM 0 HZ PHE A 165 21.194 -3.128 1.038 1.00 0.48 H new ATOM 2824 N THR A 166 19.684 -7.046 -5.913 1.00 0.47 N ATOM 2825 CA THR A 166 19.167 -7.887 -6.979 1.00 0.52 C ATOM 2826 C THR A 166 17.690 -8.192 -6.750 1.00 0.51 C ATOM 2827 O THR A 166 17.245 -8.279 -5.605 1.00 0.51 O ATOM 2828 CB THR A 166 19.956 -9.202 -7.044 1.00 0.61 C ATOM 2829 OG1 THR A 166 20.073 -9.760 -5.727 1.00 1.46 O ATOM 2830 CG2 THR A 166 21.340 -8.972 -7.616 1.00 1.43 C ATOM 0 H THR A 166 20.190 -7.554 -5.187 1.00 0.47 H new ATOM 0 HA THR A 166 19.277 -7.352 -7.922 1.00 0.52 H new ATOM 0 HB THR A 166 19.419 -9.893 -7.694 1.00 0.61 H new ATOM 0 HG1 THR A 166 20.575 -10.600 -5.771 1.00 1.46 H new ATOM 0 HG21 THR A 166 21.880 -9.918 -7.652 1.00 1.43 H new ATOM 0 HG22 THR A 166 21.254 -8.564 -8.623 1.00 1.43 H new ATOM 0 HG23 THR A 166 21.882 -8.268 -6.985 1.00 1.43 H new ATOM 2838 N TYR A 167 16.935 -8.364 -7.828 1.00 0.55 N ATOM 2839 CA TYR A 167 15.510 -8.645 -7.703 1.00 0.57 C ATOM 2840 C TYR A 167 15.248 -10.110 -7.385 1.00 0.57 C ATOM 2841 O TYR A 167 15.823 -11.012 -7.996 1.00 0.67 O ATOM 2842 CB TYR A 167 14.751 -8.262 -8.972 1.00 0.68 C ATOM 2843 CG TYR A 167 13.251 -8.344 -8.801 1.00 0.74 C ATOM 2844 CD1 TYR A 167 12.576 -7.430 -7.998 1.00 1.43 C ATOM 2845 CD2 TYR A 167 12.512 -9.341 -9.428 1.00 1.41 C ATOM 2846 CE1 TYR A 167 11.208 -7.508 -7.825 1.00 1.49 C ATOM 2847 CE2 TYR A 167 11.144 -9.423 -9.262 1.00 1.49 C ATOM 2848 CZ TYR A 167 10.497 -8.507 -8.459 1.00 0.95 C ATOM 2849 OH TYR A 167 9.134 -8.591 -8.285 1.00 1.08 O ATOM 0 H TYR A 167 17.279 -8.315 -8.787 1.00 0.55 H new ATOM 0 HA TYR A 167 15.149 -8.037 -6.874 1.00 0.57 H new ATOM 0 HB2 TYR A 167 15.025 -7.248 -9.262 1.00 0.68 H new ATOM 0 HB3 TYR A 167 15.056 -8.920 -9.786 1.00 0.68 H new ATOM 0 HD1 TYR A 167 13.131 -6.647 -7.502 1.00 1.43 H new ATOM 0 HD2 TYR A 167 13.016 -10.062 -10.054 1.00 1.41 H new ATOM 0 HE1 TYR A 167 10.698 -6.792 -7.198 1.00 1.49 H new ATOM 0 HE2 TYR A 167 10.583 -10.201 -9.759 1.00 1.49 H new ATOM 0 HH TYR A 167 8.785 -9.348 -8.800 1.00 1.08 H new ATOM 2859 N ARG A 168 14.376 -10.328 -6.417 1.00 0.58 N ATOM 2860 CA ARG A 168 13.986 -11.661 -5.993 1.00 0.64 C ATOM 2861 C ARG A 168 12.475 -11.791 -6.094 1.00 0.61 C ATOM 2862 O ARG A 168 11.783 -10.787 -6.265 1.00 0.65 O ATOM 2863 CB ARG A 168 14.418 -11.891 -4.549 1.00 0.78 C ATOM 2864 CG ARG A 168 15.860 -11.514 -4.277 1.00 1.05 C ATOM 2865 CD ARG A 168 16.770 -12.694 -4.527 1.00 1.59 C ATOM 2866 NE ARG A 168 16.497 -13.781 -3.593 1.00 2.25 N ATOM 2867 CZ ARG A 168 17.180 -14.919 -3.550 1.00 3.01 C ATOM 2868 NH1 ARG A 168 18.203 -15.120 -4.366 1.00 3.43 N ATOM 2869 NH2 ARG A 168 16.852 -15.848 -2.669 1.00 3.74 N ATOM 0 H ARG A 168 13.915 -9.580 -5.899 1.00 0.58 H new ATOM 0 HA ARG A 168 14.466 -12.401 -6.633 1.00 0.64 H new ATOM 0 HB2 ARG A 168 13.770 -11.314 -3.889 1.00 0.78 H new ATOM 0 HB3 ARG A 168 14.273 -12.942 -4.299 1.00 0.78 H new ATOM 0 HG2 ARG A 168 16.151 -10.680 -4.916 1.00 1.05 H new ATOM 0 HG3 ARG A 168 15.966 -11.177 -3.246 1.00 1.05 H new ATOM 0 HD2 ARG A 168 16.637 -13.048 -5.549 1.00 1.59 H new ATOM 0 HD3 ARG A 168 17.810 -12.381 -4.430 1.00 1.59 H new ATOM 0 HE ARG A 168 15.732 -13.659 -2.930 1.00 2.25 H new ATOM 0 HH11 ARG A 168 18.472 -14.398 -5.034 1.00 3.43 H new ATOM 0 HH12 ARG A 168 18.722 -15.997 -4.326 1.00 3.43 H new ATOM 0 HH21 ARG A 168 16.077 -15.689 -2.025 1.00 3.74 H new ATOM 0 HH22 ARG A 168 17.374 -16.724 -2.633 1.00 3.74 H new ATOM 2883 N ILE A 169 11.954 -13.007 -5.988 1.00 0.63 N ATOM 2884 CA ILE A 169 10.517 -13.195 -6.060 1.00 0.61 C ATOM 2885 C ILE A 169 9.939 -13.407 -4.664 1.00 0.59 C ATOM 2886 O ILE A 169 10.371 -14.284 -3.915 1.00 0.56 O ATOM 2887 CB ILE A 169 10.104 -14.353 -7.001 1.00 0.63 C ATOM 2888 CG1 ILE A 169 10.524 -15.717 -6.441 1.00 0.61 C ATOM 2889 CG2 ILE A 169 10.700 -14.134 -8.384 1.00 0.71 C ATOM 2890 CD1 ILE A 169 10.156 -16.882 -7.338 1.00 0.67 C ATOM 0 H ILE A 169 12.496 -13.861 -5.854 1.00 0.63 H new ATOM 0 HA ILE A 169 10.102 -12.283 -6.490 1.00 0.61 H new ATOM 0 HB ILE A 169 9.017 -14.356 -7.076 1.00 0.63 H new ATOM 0 HG12 ILE A 169 11.602 -15.718 -6.282 1.00 0.61 H new ATOM 0 HG13 ILE A 169 10.058 -15.859 -5.466 1.00 0.61 H new ATOM 0 HG21 ILE A 169 10.405 -14.952 -9.041 1.00 0.71 H new ATOM 0 HG22 ILE A 169 10.335 -13.192 -8.792 1.00 0.71 H new ATOM 0 HG23 ILE A 169 11.787 -14.101 -8.311 1.00 0.71 H new ATOM 0 HD11 ILE A 169 10.484 -17.814 -6.877 1.00 0.67 H new ATOM 0 HD12 ILE A 169 9.075 -16.907 -7.477 1.00 0.67 H new ATOM 0 HD13 ILE A 169 10.644 -16.764 -8.306 1.00 0.67 H new ATOM 2902 N PRO A 170 8.946 -12.594 -4.293 1.00 0.65 N ATOM 2903 CA PRO A 170 8.312 -12.667 -2.973 1.00 0.69 C ATOM 2904 C PRO A 170 7.596 -13.992 -2.728 1.00 0.63 C ATOM 2905 O PRO A 170 7.375 -14.388 -1.582 1.00 0.66 O ATOM 2906 CB PRO A 170 7.301 -11.520 -3.007 1.00 0.83 C ATOM 2907 CG PRO A 170 7.063 -11.242 -4.447 1.00 0.83 C ATOM 2908 CD PRO A 170 8.359 -11.538 -5.135 1.00 0.76 C ATOM 0 HA PRO A 170 9.047 -12.595 -2.171 1.00 0.69 H new ATOM 0 HB2 PRO A 170 6.375 -11.798 -2.503 1.00 0.83 H new ATOM 0 HB3 PRO A 170 7.690 -10.639 -2.496 1.00 0.83 H new ATOM 0 HG2 PRO A 170 6.260 -11.866 -4.839 1.00 0.83 H new ATOM 0 HG3 PRO A 170 6.765 -10.205 -4.602 1.00 0.83 H new ATOM 0 HD2 PRO A 170 8.204 -11.878 -6.159 1.00 0.76 H new ATOM 0 HD3 PRO A 170 9.000 -10.658 -5.184 1.00 0.76 H new ATOM 2916 N LYS A 171 7.258 -14.678 -3.810 1.00 0.62 N ATOM 2917 CA LYS A 171 6.553 -15.949 -3.738 1.00 0.63 C ATOM 2918 C LYS A 171 7.339 -16.979 -2.936 1.00 0.63 C ATOM 2919 O LYS A 171 6.782 -17.673 -2.087 1.00 0.73 O ATOM 2920 CB LYS A 171 6.291 -16.470 -5.150 1.00 0.65 C ATOM 2921 CG LYS A 171 5.232 -15.671 -5.896 1.00 0.76 C ATOM 2922 CD LYS A 171 5.831 -14.912 -7.069 1.00 0.79 C ATOM 2923 CE LYS A 171 6.099 -15.836 -8.243 1.00 0.81 C ATOM 2924 NZ LYS A 171 4.863 -16.106 -9.033 1.00 1.03 N ATOM 0 H LYS A 171 7.464 -14.370 -4.760 1.00 0.62 H new ATOM 0 HA LYS A 171 5.605 -15.785 -3.226 1.00 0.63 H new ATOM 0 HB2 LYS A 171 7.221 -16.447 -5.717 1.00 0.65 H new ATOM 0 HB3 LYS A 171 5.978 -17.513 -5.094 1.00 0.65 H new ATOM 0 HG2 LYS A 171 4.453 -16.344 -6.256 1.00 0.76 H new ATOM 0 HG3 LYS A 171 4.755 -14.969 -5.212 1.00 0.76 H new ATOM 0 HD2 LYS A 171 5.151 -14.117 -7.376 1.00 0.79 H new ATOM 0 HD3 LYS A 171 6.761 -14.434 -6.760 1.00 0.79 H new ATOM 0 HE2 LYS A 171 6.854 -15.390 -8.891 1.00 0.81 H new ATOM 0 HE3 LYS A 171 6.509 -16.778 -7.878 1.00 0.81 H new ATOM 0 HZ1 LYS A 171 4.893 -17.077 -9.404 1.00 1.03 H new ATOM 0 HZ2 LYS A 171 4.029 -15.995 -8.422 1.00 1.03 H new ATOM 0 HZ3 LYS A 171 4.804 -15.434 -9.825 1.00 1.03 H new ATOM 2938 N LYS A 172 8.640 -17.038 -3.177 1.00 0.59 N ATOM 2939 CA LYS A 172 9.498 -17.998 -2.496 1.00 0.66 C ATOM 2940 C LYS A 172 10.194 -17.371 -1.291 1.00 0.70 C ATOM 2941 O LYS A 172 11.025 -18.010 -0.648 1.00 0.80 O ATOM 2942 CB LYS A 172 10.533 -18.558 -3.473 1.00 0.70 C ATOM 2943 CG LYS A 172 10.094 -19.848 -4.148 1.00 0.77 C ATOM 2944 CD LYS A 172 8.707 -19.723 -4.760 1.00 0.71 C ATOM 2945 CE LYS A 172 8.345 -20.965 -5.552 1.00 0.82 C ATOM 2946 NZ LYS A 172 6.941 -20.928 -6.039 1.00 1.16 N ATOM 0 H LYS A 172 9.126 -16.433 -3.839 1.00 0.59 H new ATOM 0 HA LYS A 172 8.870 -18.811 -2.130 1.00 0.66 H new ATOM 0 HB2 LYS A 172 10.741 -17.810 -4.238 1.00 0.70 H new ATOM 0 HB3 LYS A 172 11.466 -18.736 -2.939 1.00 0.70 H new ATOM 0 HG2 LYS A 172 10.811 -20.114 -4.925 1.00 0.77 H new ATOM 0 HG3 LYS A 172 10.098 -20.659 -3.419 1.00 0.77 H new ATOM 0 HD2 LYS A 172 7.971 -19.564 -3.972 1.00 0.71 H new ATOM 0 HD3 LYS A 172 8.671 -18.850 -5.411 1.00 0.71 H new ATOM 0 HE2 LYS A 172 9.021 -21.062 -6.402 1.00 0.82 H new ATOM 0 HE3 LYS A 172 8.489 -21.847 -4.928 1.00 0.82 H new ATOM 0 HZ1 LYS A 172 6.736 -21.796 -6.575 1.00 1.16 H new ATOM 0 HZ2 LYS A 172 6.294 -20.861 -5.228 1.00 1.16 H new ATOM 0 HZ3 LYS A 172 6.809 -20.101 -6.656 1.00 1.16 H new ATOM 2960 N ARG A 173 9.783 -16.143 -0.956 1.00 0.68 N ATOM 2961 CA ARG A 173 10.349 -15.380 0.165 1.00 0.76 C ATOM 2962 C ARG A 173 11.850 -15.101 -0.004 1.00 0.61 C ATOM 2963 O ARG A 173 12.581 -15.907 -0.577 1.00 0.97 O ATOM 2964 CB ARG A 173 10.109 -16.096 1.500 1.00 1.36 C ATOM 2965 CG ARG A 173 8.640 -16.250 1.872 1.00 1.98 C ATOM 2966 CD ARG A 173 8.030 -17.502 1.256 1.00 2.47 C ATOM 2967 NE ARG A 173 8.744 -18.715 1.652 1.00 2.99 N ATOM 2968 CZ ARG A 173 8.244 -19.640 2.474 1.00 3.79 C ATOM 2969 NH1 ARG A 173 7.049 -19.472 3.027 1.00 4.07 N ATOM 2970 NH2 ARG A 173 8.946 -20.730 2.757 1.00 4.60 N ATOM 0 H ARG A 173 9.045 -15.647 -1.456 1.00 0.68 H new ATOM 0 HA ARG A 173 9.830 -14.421 0.168 1.00 0.76 H new ATOM 0 HB2 ARG A 173 10.566 -17.084 1.456 1.00 1.36 H new ATOM 0 HB3 ARG A 173 10.617 -15.544 2.291 1.00 1.36 H new ATOM 0 HG2 ARG A 173 8.542 -16.294 2.957 1.00 1.98 H new ATOM 0 HG3 ARG A 173 8.086 -15.373 1.537 1.00 1.98 H new ATOM 0 HD2 ARG A 173 6.986 -17.582 1.558 1.00 2.47 H new ATOM 0 HD3 ARG A 173 8.042 -17.413 0.170 1.00 2.47 H new ATOM 0 HE ARG A 173 9.681 -18.863 1.277 1.00 2.99 H new ATOM 0 HH11 ARG A 173 6.507 -18.632 2.825 1.00 4.07 H new ATOM 0 HH12 ARG A 173 6.673 -20.183 3.654 1.00 4.07 H new ATOM 0 HH21 ARG A 173 9.870 -20.862 2.346 1.00 4.60 H new ATOM 0 HH22 ARG A 173 8.562 -21.435 3.386 1.00 4.60 H new ATOM 2984 N LEU A 174 12.286 -13.950 0.518 1.00 0.60 N ATOM 2985 CA LEU A 174 13.691 -13.528 0.466 1.00 1.13 C ATOM 2986 C LEU A 174 14.372 -13.888 -0.855 1.00 1.70 C ATOM 2987 O LEU A 174 14.025 -13.286 -1.886 1.00 2.14 O ATOM 2988 CB LEU A 174 14.472 -14.138 1.634 1.00 1.32 C ATOM 2989 CG LEU A 174 14.470 -13.313 2.923 1.00 1.64 C ATOM 2990 CD1 LEU A 174 13.093 -13.325 3.566 1.00 1.79 C ATOM 2991 CD2 LEU A 174 15.515 -13.843 3.892 1.00 2.09 C ATOM 2992 OXT LEU A 174 15.268 -14.757 -0.850 1.00 2.37 O ATOM 0 H LEU A 174 11.675 -13.283 0.989 1.00 0.60 H new ATOM 0 HA LEU A 174 13.693 -12.441 0.544 1.00 1.13 H new ATOM 0 HB2 LEU A 174 14.058 -15.123 1.852 1.00 1.32 H new ATOM 0 HB3 LEU A 174 15.505 -14.289 1.320 1.00 1.32 H new ATOM 0 HG LEU A 174 14.720 -12.282 2.672 1.00 1.64 H new ATOM 0 HD11 LEU A 174 13.113 -12.733 4.481 1.00 1.79 H new ATOM 0 HD12 LEU A 174 12.365 -12.900 2.875 1.00 1.79 H new ATOM 0 HD13 LEU A 174 12.812 -14.351 3.804 1.00 1.79 H new ATOM 0 HD21 LEU A 174 15.502 -13.246 4.804 1.00 2.09 H new ATOM 0 HD22 LEU A 174 15.292 -14.882 4.135 1.00 2.09 H new ATOM 0 HD23 LEU A 174 16.502 -13.781 3.433 1.00 2.09 H new TER 3004 LEU A 174 HETATM 3005 PG DGT A 201 -2.395 -10.371 6.280 1.00 0.85 P HETATM 3006 O1G DGT A 201 -2.097 -10.611 7.711 1.00 1.15 O HETATM 3007 O2G DGT A 201 -3.180 -11.388 5.544 1.00 0.98 O HETATM 3008 O3G DGT A 201 -3.241 -9.007 6.153 1.00 0.86 O HETATM 3009 O3B DGT A 201 -1.074 -9.942 5.459 1.00 0.69 O HETATM 3010 PB DGT A 201 -1.394 -9.265 4.043 1.00 0.61 P HETATM 3011 O1B DGT A 201 -0.205 -9.376 3.169 1.00 0.78 O HETATM 3012 O2B DGT A 201 -2.688 -9.732 3.503 1.00 0.74 O HETATM 3013 O3A DGT A 201 -1.580 -7.777 4.636 1.00 0.74 O HETATM 3014 PA DGT A 201 -0.796 -6.385 4.396 1.00 0.89 P HETATM 3015 O1A DGT A 201 -1.183 -5.568 5.569 1.00 1.28 O HETATM 3016 O2A DGT A 201 -1.145 -5.868 3.055 1.00 1.02 O HETATM 3017 O5' DGT A 201 0.811 -6.421 4.488 1.00 0.79 O HETATM 3018 C5' DGT A 201 1.645 -7.307 3.737 1.00 0.62 C HETATM 3019 C4' DGT A 201 3.044 -6.717 3.926 1.00 0.68 C HETATM 3020 O4' DGT A 201 2.771 -5.357 4.307 1.00 0.83 O HETATM 3021 C3' DGT A 201 3.830 -7.334 5.069 1.00 0.97 C HETATM 3022 O3' DGT A 201 5.119 -7.724 4.580 1.00 1.76 O HETATM 3023 C2' DGT A 201 3.962 -6.214 6.090 1.00 0.89 C HETATM 3024 C1' DGT A 201 3.763 -4.963 5.265 1.00 0.56 C HETATM 3025 N9 DGT A 201 3.258 -3.861 6.109 1.00 0.59 N HETATM 3026 C8 DGT A 201 3.804 -2.667 6.316 1.00 0.56 C HETATM 3027 N7 DGT A 201 3.169 -2.096 7.337 1.00 0.55 N HETATM 3028 C5 DGT A 201 2.230 -2.936 7.759 1.00 0.57 C HETATM 3029 C6 DGT A 201 1.374 -2.858 8.774 1.00 0.67 C HETATM 3030 O6 DGT A 201 1.271 -1.829 9.441 1.00 0.79 O HETATM 3031 N1 DGT A 201 0.529 -3.937 9.052 1.00 0.80 N HETATM 3032 C2 DGT A 201 0.589 -5.058 8.216 1.00 0.79 C HETATM 3033 N2 DGT A 201 -0.258 -6.063 8.429 1.00 0.98 N HETATM 3034 N3 DGT A 201 1.464 -5.071 7.206 1.00 0.76 N HETATM 3035 C4 DGT A 201 2.280 -4.024 6.994 1.00 0.64 C HETATM 0 HO3' DGT A 201 5.336 -8.621 4.909 1.00 1.76 H new HETATM 0 HN2A DGT A 201 -0.230 -6.889 7.831 1.00 0.98 H new HETATM 0 H5'A DGT A 201 1.586 -8.329 4.111 1.00 0.62 H new HETATM 0 H2'A DGT A 201 3.214 -6.299 6.878 1.00 0.89 H new HETATM 0 HN2 DGT A 201 -0.935 -6.007 9.190 1.00 0.98 H new HETATM 0 H8 DGT A 201 4.627 -2.232 5.749 1.00 0.56 H new HETATM 0 H5' DGT A 201 1.359 -7.335 2.686 1.00 0.62 H new HETATM 0 H4' DGT A 201 3.636 -6.872 3.024 1.00 0.68 H new HETATM 0 H3' DGT A 201 3.355 -8.216 5.498 1.00 0.97 H new HETATM 0 H2' DGT A 201 4.938 -6.225 6.574 1.00 0.89 H new HETATM 0 H16 DGT A 201 -0.114 -3.908 9.843 1.00 0.80 H new HETATM 0 H1' DGT A 201 4.683 -4.600 4.807 1.00 0.56 H new HETATM 3048 MG MG A 202 -3.428 -4.940 6.645 1.00 0.47 MG HETATM 3049 MG MG A 203 -3.799 -8.231 5.273 1.00 0.82 MG