USER MOD reduce.3.24.130724 H: found=0, std=0, add=1175, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1175 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 116 ASN : amide:sc= -1.84! C(o=-1.9!,f=-2!) USER MOD Set 1.2: A 125 LYS NZ :NH3+ 165:sc= -0.0192 (180deg=-0.238) USER MOD Set 2.1: A 5 ASN : amide:sc= 0.465 K(o=1.1,f=-1.2) USER MOD Set 2.2: A 106 LYS NZ :NH3+ -171:sc= 0.595 (180deg=0) USER MOD Set 3.1: A 102 HIS : no HD1:sc= -4.19! C(o=-4.2!,f=-7.1!) USER MOD Set 3.2: A 126 MET CE :methyl 176:sc= -0.0238 (180deg=-0.0399) USER MOD Set 4.1: A 4 ASN : amide:sc= 0.19 K(o=0.45,f=-0.062) USER MOD Set 4.2: A 80 THR OG1 : rot 43:sc= 0.261 USER MOD Set 5.1: A 75 SER OG : rot 180:sc= 0.926 USER MOD Set 5.2: A 86 THR OG1 : rot -96:sc= 1.11 USER MOD Set 6.1: A 69 GLN : amide:sc= -1.23! K(o=-1.5!,f=-0.4) USER MOD Set 6.2: A 72 THR OG1 : rot -71:sc= -0.311 USER MOD Set 7.1: A 45 GLN : amide:sc= 0.793 K(o=1.7,f=-2.4) USER MOD Set 7.2: A 47 LYS NZ :NH3+ -170:sc= 0.9 (180deg=0) USER MOD Set 8.1: A 31 THR OG1 : rot 180:sc= -0.0648 USER MOD Set 8.2: A 32 SER OG : rot 180:sc= 0.0481 USER MOD Set 9.1: A 3 GLN : amide:sc= -0.678 X(o=-0.18,f=0.065) USER MOD Set 9.2: A 61 SER OG : rot 100:sc= 0.499 USER MOD Single : A 1 MET CE :methyl 159:sc= -0.162 (180deg=-0.827) USER MOD Single : A 1 MET N :NH3+ 177:sc= -0.0477! (180deg=-0.19) USER MOD Single : A 7 ASN : amide:sc= -3.83! C(o=-3.8!,f=-8.2!) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 146:sc= -7.6! (180deg=-8.95!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= -0.346 X(o=-0.35,f=-0.71) USER MOD Single : A 24 LYS NZ :NH3+ 140:sc= 0.775 (180deg=-0.434) USER MOD Single : A 28 THR OG1 : rot 65:sc= 0.262 USER MOD Single : A 30 SER OG : rot 59:sc= -2.51! USER MOD Single : A 37 LYS NZ :NH3+ 161:sc= -0.146 (180deg=-0.713) USER MOD Single : A 40 MET CE :methyl -144:sc= -0.073 (180deg=-1.41) USER MOD Single : A 42 ASN : amide:sc= 1.01 K(o=1,f=-0.64) USER MOD Single : A 50 GLN : amide:sc= -19.2! C(o=-19!,f=-15!) USER MOD Single : A 53 HIS : no HD1:sc= -0.742 X(o=-0.74,f=-1) USER MOD Single : A 55 GLN : amide:sc= -0.191 X(o=-0.19,f=-0.39) USER MOD Single : A 56 SER OG : rot 180:sc= -0.0437 USER MOD Single : A 63 CYS SG : rot 102:sc= -2.86! USER MOD Single : A 64 LYS NZ :NH3+ 156:sc= -1.83 (180deg=-3.03!) USER MOD Single : A 88 GLN : amide:sc= -0.258 K(o=-0.26,f=-2) USER MOD Single : A 95 LYS NZ :NH3+ -172:sc= 0.872 (180deg=0.822) USER MOD Single : A 96 THR OG1 : rot -84:sc= -0.325! USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= -0.0435 USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=-0.00049) USER MOD Single : A 110 GLN : amide:sc= -0.485 X(o=-0.48,f=0) USER MOD Single : A 114 LYS NZ :NH3+ -135:sc= -0.17 (180deg=-0.78) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 SER OG : rot 127:sc= 0.256 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot 180:sc= 0.00789 USER MOD Single : A 135 ASN : amide:sc= -5.25! K(o=-5.3!,f=-1.6) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 HIS : no HD1:sc= -2.15! K(o=-2.1!,f=-0.22) USER MOD Single : A 148 HIS : no HD1:sc= -0.25 X(o=-0.25,f=-0.013) USER MOD Single : A 149 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 150 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 151 HIS : no HD1:sc= -0.218 X(o=-0.22,f=-0.21) USER MOD Single : A 152 HIS : no HD1:sc= -0.0911 X(o=-0.091,f=-0.19) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.547 6.411 -3.677 1.00 0.00 N ATOM 2 CA MET A 1 15.353 7.187 -2.710 1.00 0.00 C ATOM 3 C MET A 1 14.970 6.839 -1.270 1.00 0.00 C ATOM 4 O MET A 1 14.822 7.721 -0.418 1.00 0.00 O ATOM 5 CB MET A 1 15.192 8.693 -2.973 1.00 0.00 C ATOM 6 CG MET A 1 13.750 9.179 -2.948 1.00 0.00 C ATOM 7 SD MET A 1 13.588 10.914 -3.414 1.00 0.00 S ATOM 8 CE MET A 1 14.178 10.870 -5.106 1.00 0.00 C ATOM 0 H1 MET A 1 14.791 6.703 -4.645 1.00 0.00 H new ATOM 0 H2 MET A 1 14.746 5.397 -3.560 1.00 0.00 H new ATOM 0 H3 MET A 1 13.536 6.587 -3.507 1.00 0.00 H new ATOM 0 HA MET A 1 16.402 6.922 -2.845 1.00 0.00 H new ATOM 0 HB2 MET A 1 15.763 9.244 -2.226 1.00 0.00 H new ATOM 0 HB3 MET A 1 15.627 8.930 -3.944 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.154 8.568 -3.626 1.00 0.00 H new ATOM 0 HG3 MET A 1 13.341 9.037 -1.948 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.806 11.742 -5.644 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.268 10.878 -5.112 1.00 0.00 H new ATOM 0 HE3 MET A 1 13.820 9.963 -5.593 1.00 0.00 H new ATOM 20 N ALA A 2 14.815 5.546 -1.003 1.00 0.00 N ATOM 21 CA ALA A 2 14.526 5.070 0.343 1.00 0.00 C ATOM 22 C ALA A 2 15.826 4.887 1.123 1.00 0.00 C ATOM 23 O ALA A 2 16.880 5.363 0.696 1.00 0.00 O ATOM 24 CB ALA A 2 13.742 3.768 0.282 1.00 0.00 C ATOM 0 H ALA A 2 14.885 4.808 -1.704 1.00 0.00 H new ATOM 0 HA ALA A 2 13.916 5.811 0.860 1.00 0.00 H new ATOM 0 HB1 ALA A 2 13.532 3.422 1.294 1.00 0.00 H new ATOM 0 HB2 ALA A 2 12.803 3.933 -0.247 1.00 0.00 H new ATOM 0 HB3 ALA A 2 14.328 3.015 -0.245 1.00 0.00 H new ATOM 30 N GLN A 3 15.761 4.206 2.260 1.00 0.00 N ATOM 31 CA GLN A 3 16.948 3.999 3.082 1.00 0.00 C ATOM 32 C GLN A 3 17.967 3.114 2.369 1.00 0.00 C ATOM 33 O GLN A 3 19.152 3.448 2.310 1.00 0.00 O ATOM 34 CB GLN A 3 16.572 3.401 4.440 1.00 0.00 C ATOM 35 CG GLN A 3 15.896 4.397 5.372 1.00 0.00 C ATOM 36 CD GLN A 3 16.819 5.530 5.792 1.00 0.00 C ATOM 37 OE1 GLN A 3 16.382 6.663 5.999 1.00 0.00 O ATOM 38 NE2 GLN A 3 18.100 5.232 5.949 1.00 0.00 N ATOM 0 H GLN A 3 14.907 3.790 2.632 1.00 0.00 H new ATOM 0 HA GLN A 3 17.408 4.972 3.251 1.00 0.00 H new ATOM 0 HB2 GLN A 3 15.907 2.552 4.283 1.00 0.00 H new ATOM 0 HB3 GLN A 3 17.471 3.017 4.921 1.00 0.00 H new ATOM 0 HG2 GLN A 3 15.019 4.813 4.877 1.00 0.00 H new ATOM 0 HG3 GLN A 3 15.542 3.874 6.261 1.00 0.00 H new ATOM 0 HE21 GLN A 3 18.429 4.283 5.769 1.00 0.00 H new ATOM 0 HE22 GLN A 3 18.758 5.951 6.250 1.00 0.00 H new ATOM 47 N ASN A 4 17.513 1.993 1.819 1.00 0.00 N ATOM 48 CA ASN A 4 18.406 1.087 1.105 1.00 0.00 C ATOM 49 C ASN A 4 17.728 0.543 -0.149 1.00 0.00 C ATOM 50 O ASN A 4 16.613 0.031 -0.085 1.00 0.00 O ATOM 51 CB ASN A 4 18.818 -0.097 1.996 1.00 0.00 C ATOM 52 CG ASN A 4 19.416 0.317 3.330 1.00 0.00 C ATOM 53 OD1 ASN A 4 18.701 0.477 4.323 1.00 0.00 O ATOM 54 ND2 ASN A 4 20.728 0.481 3.370 1.00 0.00 N ATOM 0 H ASN A 4 16.539 1.691 1.853 1.00 0.00 H new ATOM 0 HA ASN A 4 19.293 1.656 0.827 1.00 0.00 H new ATOM 0 HB2 ASN A 4 17.945 -0.723 2.179 1.00 0.00 H new ATOM 0 HB3 ASN A 4 19.542 -0.709 1.458 1.00 0.00 H new ATOM 0 HD21 ASN A 4 21.182 0.749 4.243 1.00 0.00 H new ATOM 0 HD22 ASN A 4 21.286 0.340 2.528 1.00 0.00 H new ATOM 61 N ASN A 5 18.394 0.660 -1.291 1.00 0.00 N ATOM 62 CA ASN A 5 17.920 0.003 -2.502 1.00 0.00 C ATOM 63 C ASN A 5 18.880 -1.117 -2.887 1.00 0.00 C ATOM 64 O ASN A 5 20.071 -0.890 -3.105 1.00 0.00 O ATOM 65 CB ASN A 5 17.722 1.001 -3.661 1.00 0.00 C ATOM 66 CG ASN A 5 18.990 1.724 -4.098 1.00 0.00 C ATOM 67 OD1 ASN A 5 19.722 1.256 -4.972 1.00 0.00 O ATOM 68 ND2 ASN A 5 19.241 2.886 -3.514 1.00 0.00 N ATOM 0 H ASN A 5 19.254 1.197 -1.404 1.00 0.00 H new ATOM 0 HA ASN A 5 16.940 -0.428 -2.297 1.00 0.00 H new ATOM 0 HB2 ASN A 5 17.311 0.466 -4.517 1.00 0.00 H new ATOM 0 HB3 ASN A 5 16.981 1.743 -3.362 1.00 0.00 H new ATOM 0 HD21 ASN A 5 20.063 3.425 -3.784 1.00 0.00 H new ATOM 0 HD22 ASN A 5 18.612 3.241 -2.794 1.00 0.00 H new ATOM 75 N GLU A 6 18.366 -2.334 -2.943 1.00 0.00 N ATOM 76 CA GLU A 6 19.187 -3.485 -3.227 1.00 0.00 C ATOM 77 C GLU A 6 18.940 -3.999 -4.642 1.00 0.00 C ATOM 78 O GLU A 6 19.781 -3.857 -5.525 1.00 0.00 O ATOM 79 CB GLU A 6 18.887 -4.577 -2.203 1.00 0.00 C ATOM 80 CG GLU A 6 19.583 -5.885 -2.495 1.00 0.00 C ATOM 81 CD GLU A 6 21.094 -5.763 -2.443 1.00 0.00 C ATOM 82 OE1 GLU A 6 21.677 -5.960 -1.353 1.00 0.00 O ATOM 83 OE2 GLU A 6 21.710 -5.454 -3.482 1.00 0.00 O ATOM 0 H GLU A 6 17.379 -2.545 -2.794 1.00 0.00 H new ATOM 0 HA GLU A 6 20.236 -3.198 -3.159 1.00 0.00 H new ATOM 0 HB2 GLU A 6 19.186 -4.229 -1.214 1.00 0.00 H new ATOM 0 HB3 GLU A 6 17.811 -4.747 -2.170 1.00 0.00 H new ATOM 0 HG2 GLU A 6 19.257 -6.635 -1.774 1.00 0.00 H new ATOM 0 HG3 GLU A 6 19.284 -6.240 -3.481 1.00 0.00 H new ATOM 90 N ASN A 7 17.771 -4.576 -4.844 1.00 0.00 N ATOM 91 CA ASN A 7 17.421 -5.183 -6.110 1.00 0.00 C ATOM 92 C ASN A 7 15.916 -5.060 -6.307 1.00 0.00 C ATOM 93 O ASN A 7 15.454 -4.551 -7.317 1.00 0.00 O ATOM 94 CB ASN A 7 17.872 -6.642 -6.108 1.00 0.00 C ATOM 95 CG ASN A 7 18.672 -7.020 -7.339 1.00 0.00 C ATOM 96 OD1 ASN A 7 18.601 -8.154 -7.811 1.00 0.00 O ATOM 97 ND2 ASN A 7 19.470 -6.092 -7.843 1.00 0.00 N ATOM 0 H ASN A 7 17.040 -4.636 -4.135 1.00 0.00 H new ATOM 0 HA ASN A 7 17.921 -4.679 -6.937 1.00 0.00 H new ATOM 0 HB2 ASN A 7 18.475 -6.828 -5.219 1.00 0.00 H new ATOM 0 HB3 ASN A 7 16.996 -7.287 -6.040 1.00 0.00 H new ATOM 0 HD21 ASN A 7 20.054 -6.306 -8.651 1.00 0.00 H new ATOM 0 HD22 ASN A 7 19.501 -5.163 -7.423 1.00 0.00 H new ATOM 104 N ALA A 8 15.164 -5.545 -5.334 1.00 0.00 N ATOM 105 CA ALA A 8 13.764 -5.165 -5.155 1.00 0.00 C ATOM 106 C ALA A 8 12.810 -5.663 -6.247 1.00 0.00 C ATOM 107 O ALA A 8 13.206 -6.116 -7.321 1.00 0.00 O ATOM 108 CB ALA A 8 13.653 -3.650 -5.030 1.00 0.00 C ATOM 0 H ALA A 8 15.503 -6.214 -4.643 1.00 0.00 H new ATOM 0 HA ALA A 8 13.444 -5.663 -4.239 1.00 0.00 H new ATOM 0 HB1 ALA A 8 12.608 -3.372 -4.897 1.00 0.00 H new ATOM 0 HB2 ALA A 8 14.231 -3.313 -4.170 1.00 0.00 H new ATOM 0 HB3 ALA A 8 14.041 -3.181 -5.934 1.00 0.00 H new ATOM 114 N LEU A 9 11.534 -5.608 -5.887 1.00 0.00 N ATOM 115 CA LEU A 9 10.422 -5.833 -6.780 1.00 0.00 C ATOM 116 C LEU A 9 10.304 -4.639 -7.719 1.00 0.00 C ATOM 117 O LEU A 9 10.314 -3.499 -7.264 1.00 0.00 O ATOM 118 CB LEU A 9 9.153 -5.929 -5.911 1.00 0.00 C ATOM 119 CG LEU A 9 7.987 -6.752 -6.437 1.00 0.00 C ATOM 120 CD1 LEU A 9 6.778 -6.529 -5.542 1.00 0.00 C ATOM 121 CD2 LEU A 9 7.645 -6.422 -7.879 1.00 0.00 C ATOM 0 H LEU A 9 11.243 -5.398 -4.932 1.00 0.00 H new ATOM 0 HA LEU A 9 10.557 -6.742 -7.366 1.00 0.00 H new ATOM 0 HB2 LEU A 9 9.441 -6.339 -4.943 1.00 0.00 H new ATOM 0 HB3 LEU A 9 8.793 -4.916 -5.733 1.00 0.00 H new ATOM 0 HG LEU A 9 8.281 -7.801 -6.419 1.00 0.00 H new ATOM 0 HD11 LEU A 9 5.938 -7.116 -5.913 1.00 0.00 H new ATOM 0 HD12 LEU A 9 7.016 -6.839 -4.525 1.00 0.00 H new ATOM 0 HD13 LEU A 9 6.512 -5.472 -5.546 1.00 0.00 H new ATOM 0 HD21 LEU A 9 6.806 -7.038 -8.204 1.00 0.00 H new ATOM 0 HD22 LEU A 9 7.374 -5.369 -7.957 1.00 0.00 H new ATOM 0 HD23 LEU A 9 8.509 -6.622 -8.513 1.00 0.00 H new ATOM 133 N PRO A 10 10.219 -4.878 -9.035 1.00 0.00 N ATOM 134 CA PRO A 10 9.838 -3.840 -9.995 1.00 0.00 C ATOM 135 C PRO A 10 8.413 -3.366 -9.749 1.00 0.00 C ATOM 136 O PRO A 10 7.912 -3.409 -8.629 1.00 0.00 O ATOM 137 CB PRO A 10 9.939 -4.539 -11.357 1.00 0.00 C ATOM 138 CG PRO A 10 10.764 -5.755 -11.118 1.00 0.00 C ATOM 139 CD PRO A 10 10.513 -6.156 -9.694 1.00 0.00 C ATOM 0 HA PRO A 10 10.471 -2.956 -9.922 1.00 0.00 H new ATOM 0 HB2 PRO A 10 8.952 -4.803 -11.737 1.00 0.00 H new ATOM 0 HB3 PRO A 10 10.403 -3.889 -12.099 1.00 0.00 H new ATOM 0 HG2 PRO A 10 10.485 -6.556 -11.803 1.00 0.00 H new ATOM 0 HG3 PRO A 10 11.821 -5.547 -11.284 1.00 0.00 H new ATOM 0 HD2 PRO A 10 9.679 -6.853 -9.613 1.00 0.00 H new ATOM 0 HD3 PRO A 10 11.382 -6.646 -9.254 1.00 0.00 H new ATOM 147 N ASP A 11 7.758 -2.900 -10.779 1.00 0.00 N ATOM 148 CA ASP A 11 6.367 -2.505 -10.646 1.00 0.00 C ATOM 149 C ASP A 11 5.469 -3.734 -10.504 1.00 0.00 C ATOM 150 O ASP A 11 5.371 -4.564 -11.409 1.00 0.00 O ATOM 151 CB ASP A 11 5.909 -1.639 -11.829 1.00 0.00 C ATOM 152 CG ASP A 11 5.996 -2.352 -13.167 1.00 0.00 C ATOM 153 OD1 ASP A 11 7.122 -2.646 -13.617 1.00 0.00 O ATOM 154 OD2 ASP A 11 4.937 -2.625 -13.774 1.00 0.00 O ATOM 0 H ASP A 11 8.153 -2.783 -11.712 1.00 0.00 H new ATOM 0 HA ASP A 11 6.282 -1.903 -9.742 1.00 0.00 H new ATOM 0 HB2 ASP A 11 4.880 -1.322 -11.661 1.00 0.00 H new ATOM 0 HB3 ASP A 11 6.519 -0.736 -11.866 1.00 0.00 H new ATOM 159 N ILE A 12 4.851 -3.874 -9.342 1.00 0.00 N ATOM 160 CA ILE A 12 3.801 -4.855 -9.168 1.00 0.00 C ATOM 161 C ILE A 12 2.478 -4.124 -9.136 1.00 0.00 C ATOM 162 O ILE A 12 2.309 -3.155 -8.400 1.00 0.00 O ATOM 163 CB ILE A 12 3.991 -5.718 -7.878 1.00 0.00 C ATOM 164 CG1 ILE A 12 4.199 -7.189 -8.261 1.00 0.00 C ATOM 165 CG2 ILE A 12 2.813 -5.594 -6.905 1.00 0.00 C ATOM 166 CD1 ILE A 12 3.034 -7.799 -9.011 1.00 0.00 C ATOM 0 H ILE A 12 5.060 -3.321 -8.510 1.00 0.00 H new ATOM 0 HA ILE A 12 3.833 -5.555 -10.003 1.00 0.00 H new ATOM 0 HB ILE A 12 4.873 -5.337 -7.364 1.00 0.00 H new ATOM 0 HG12 ILE A 12 5.096 -7.271 -8.875 1.00 0.00 H new ATOM 0 HG13 ILE A 12 4.378 -7.768 -7.355 1.00 0.00 H new ATOM 0 HG21 ILE A 12 2.999 -6.214 -6.028 1.00 0.00 H new ATOM 0 HG22 ILE A 12 2.703 -4.554 -6.598 1.00 0.00 H new ATOM 0 HG23 ILE A 12 1.899 -5.926 -7.397 1.00 0.00 H new ATOM 0 HD11 ILE A 12 3.257 -8.840 -9.246 1.00 0.00 H new ATOM 0 HD12 ILE A 12 2.138 -7.751 -8.392 1.00 0.00 H new ATOM 0 HD13 ILE A 12 2.867 -7.246 -9.935 1.00 0.00 H new ATOM 178 N THR A 13 1.564 -4.540 -9.973 1.00 0.00 N ATOM 179 CA THR A 13 0.270 -3.938 -9.995 1.00 0.00 C ATOM 180 C THR A 13 -0.795 -4.964 -9.680 1.00 0.00 C ATOM 181 O THR A 13 -0.798 -6.076 -10.213 1.00 0.00 O ATOM 182 CB THR A 13 -0.005 -3.290 -11.358 1.00 0.00 C ATOM 183 OG1 THR A 13 0.630 -4.043 -12.399 1.00 0.00 O ATOM 184 CG2 THR A 13 0.479 -1.848 -11.387 1.00 0.00 C ATOM 0 H THR A 13 1.698 -5.294 -10.646 1.00 0.00 H new ATOM 0 HA THR A 13 0.244 -3.160 -9.232 1.00 0.00 H new ATOM 0 HB THR A 13 -1.083 -3.290 -11.522 1.00 0.00 H new ATOM 0 HG1 THR A 13 0.447 -3.622 -13.265 1.00 0.00 H new ATOM 0 HG21 THR A 13 0.271 -1.414 -12.365 1.00 0.00 H new ATOM 0 HG22 THR A 13 -0.039 -1.275 -10.618 1.00 0.00 H new ATOM 0 HG23 THR A 13 1.552 -1.821 -11.199 1.00 0.00 H new ATOM 192 N LYS A 14 -1.683 -4.579 -8.802 1.00 0.00 N ATOM 193 CA LYS A 14 -2.797 -5.400 -8.416 1.00 0.00 C ATOM 194 C LYS A 14 -4.016 -4.509 -8.417 1.00 0.00 C ATOM 195 O LYS A 14 -4.019 -3.475 -7.770 1.00 0.00 O ATOM 196 CB LYS A 14 -2.535 -5.966 -7.014 1.00 0.00 C ATOM 197 CG LYS A 14 -3.147 -7.333 -6.763 1.00 0.00 C ATOM 198 CD LYS A 14 -4.654 -7.318 -6.900 1.00 0.00 C ATOM 199 CE LYS A 14 -5.297 -6.332 -5.944 1.00 0.00 C ATOM 200 NZ LYS A 14 -6.766 -6.276 -6.137 1.00 0.00 N ATOM 0 H LYS A 14 -1.652 -3.675 -8.330 1.00 0.00 H new ATOM 0 HA LYS A 14 -2.944 -6.238 -9.097 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -1.458 -6.029 -6.857 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -2.924 -5.266 -6.275 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -2.727 -8.052 -7.466 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -2.878 -7.672 -5.762 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -4.923 -7.060 -7.924 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -5.046 -8.317 -6.710 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -5.074 -6.620 -4.917 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -4.870 -5.341 -6.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -7.230 -6.108 -5.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -7.001 -5.503 -6.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -7.099 -7.178 -6.533 1.00 0.00 H new ATOM 214 N SER A 15 -5.062 -4.900 -9.095 1.00 0.00 N ATOM 215 CA SER A 15 -6.177 -4.025 -9.233 1.00 0.00 C ATOM 216 C SER A 15 -7.457 -4.659 -8.757 1.00 0.00 C ATOM 217 O SER A 15 -7.619 -5.883 -8.732 1.00 0.00 O ATOM 218 CB SER A 15 -6.325 -3.604 -10.669 1.00 0.00 C ATOM 219 OG SER A 15 -5.064 -3.310 -11.250 1.00 0.00 O ATOM 0 H SER A 15 -5.158 -5.807 -9.552 1.00 0.00 H new ATOM 0 HA SER A 15 -5.986 -3.153 -8.608 1.00 0.00 H new ATOM 0 HB2 SER A 15 -6.813 -4.398 -11.235 1.00 0.00 H new ATOM 0 HB3 SER A 15 -6.969 -2.727 -10.729 1.00 0.00 H new ATOM 0 HG SER A 15 -5.189 -3.041 -12.184 1.00 0.00 H new ATOM 225 N ILE A 16 -8.313 -3.797 -8.295 1.00 0.00 N ATOM 226 CA ILE A 16 -9.635 -4.129 -7.858 1.00 0.00 C ATOM 227 C ILE A 16 -10.514 -2.917 -8.027 1.00 0.00 C ATOM 228 O ILE A 16 -10.055 -1.791 -7.897 1.00 0.00 O ATOM 229 CB ILE A 16 -9.676 -4.583 -6.391 1.00 0.00 C ATOM 230 CG1 ILE A 16 -11.114 -4.497 -5.869 1.00 0.00 C ATOM 231 CG2 ILE A 16 -8.705 -3.774 -5.544 1.00 0.00 C ATOM 232 CD1 ILE A 16 -11.348 -3.527 -4.743 1.00 0.00 C ATOM 0 H ILE A 16 -8.100 -2.803 -8.209 1.00 0.00 H new ATOM 0 HA ILE A 16 -9.988 -4.964 -8.464 1.00 0.00 H new ATOM 0 HB ILE A 16 -9.354 -5.622 -6.323 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -11.765 -4.224 -6.699 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -11.419 -5.489 -5.537 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -8.753 -4.115 -4.510 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -7.692 -3.908 -5.923 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -8.973 -2.719 -5.591 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -12.399 -3.550 -4.455 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -10.732 -3.806 -3.888 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -11.083 -2.521 -5.068 1.00 0.00 H new ATOM 244 N THR A 17 -11.760 -3.133 -8.305 1.00 0.00 N ATOM 245 CA THR A 17 -12.681 -2.040 -8.329 1.00 0.00 C ATOM 246 C THR A 17 -13.367 -1.942 -6.979 1.00 0.00 C ATOM 247 O THR A 17 -14.048 -2.874 -6.540 1.00 0.00 O ATOM 248 CB THR A 17 -13.716 -2.233 -9.437 1.00 0.00 C ATOM 249 OG1 THR A 17 -13.048 -2.480 -10.685 1.00 0.00 O ATOM 250 CG2 THR A 17 -14.593 -1.005 -9.561 1.00 0.00 C ATOM 0 H THR A 17 -12.161 -4.046 -8.517 1.00 0.00 H new ATOM 0 HA THR A 17 -12.139 -1.116 -8.532 1.00 0.00 H new ATOM 0 HB THR A 17 -14.344 -3.087 -9.185 1.00 0.00 H new ATOM 0 HG1 THR A 17 -13.714 -2.605 -11.393 1.00 0.00 H new ATOM 0 HG21 THR A 17 -15.324 -1.159 -10.354 1.00 0.00 H new ATOM 0 HG22 THR A 17 -15.111 -0.831 -8.618 1.00 0.00 H new ATOM 0 HG23 THR A 17 -13.975 -0.139 -9.800 1.00 0.00 H new ATOM 258 N LEU A 18 -13.190 -0.806 -6.325 1.00 0.00 N ATOM 259 CA LEU A 18 -13.754 -0.580 -5.030 1.00 0.00 C ATOM 260 C LEU A 18 -15.087 0.029 -5.259 1.00 0.00 C ATOM 261 O LEU A 18 -15.162 1.152 -5.714 1.00 0.00 O ATOM 262 CB LEU A 18 -12.909 0.416 -4.224 1.00 0.00 C ATOM 263 CG LEU A 18 -11.445 0.058 -4.060 1.00 0.00 C ATOM 264 CD1 LEU A 18 -10.643 1.287 -3.685 1.00 0.00 C ATOM 265 CD2 LEU A 18 -11.276 -1.012 -3.002 1.00 0.00 C ATOM 0 H LEU A 18 -12.649 -0.022 -6.688 1.00 0.00 H new ATOM 0 HA LEU A 18 -13.802 -1.517 -4.475 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.973 1.391 -4.706 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -13.351 0.520 -3.233 1.00 0.00 H new ATOM 0 HG LEU A 18 -11.077 -0.329 -5.010 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -9.594 1.016 -3.570 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -10.740 2.038 -4.469 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -11.017 1.693 -2.745 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -10.219 -1.257 -2.898 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -11.660 -0.646 -2.050 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.828 -1.905 -3.296 1.00 0.00 H new ATOM 277 N GLU A 19 -16.149 -0.678 -5.022 1.00 0.00 N ATOM 278 CA GLU A 19 -17.406 -0.011 -5.135 1.00 0.00 C ATOM 279 C GLU A 19 -17.534 0.896 -3.924 1.00 0.00 C ATOM 280 O GLU A 19 -18.066 0.506 -2.888 1.00 0.00 O ATOM 281 CB GLU A 19 -18.504 -1.069 -5.160 1.00 0.00 C ATOM 282 CG GLU A 19 -18.118 -2.336 -4.405 1.00 0.00 C ATOM 283 CD GLU A 19 -19.190 -3.407 -4.454 1.00 0.00 C ATOM 284 OE1 GLU A 19 -19.603 -3.787 -5.569 1.00 0.00 O ATOM 285 OE2 GLU A 19 -19.625 -3.871 -3.376 1.00 0.00 O ATOM 0 H GLU A 19 -16.175 -1.664 -4.763 1.00 0.00 H new ATOM 0 HA GLU A 19 -17.487 0.585 -6.044 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -19.413 -0.654 -4.724 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -18.734 -1.323 -6.195 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -17.195 -2.735 -4.825 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -17.912 -2.084 -3.365 1.00 0.00 H new ATOM 292 N ALA A 20 -17.027 2.113 -4.086 1.00 0.00 N ATOM 293 CA ALA A 20 -17.084 3.125 -3.049 1.00 0.00 C ATOM 294 C ALA A 20 -16.994 4.510 -3.654 1.00 0.00 C ATOM 295 O ALA A 20 -16.580 4.659 -4.786 1.00 0.00 O ATOM 296 CB ALA A 20 -15.956 2.923 -2.063 1.00 0.00 C ATOM 0 H ALA A 20 -16.566 2.421 -4.942 1.00 0.00 H new ATOM 0 HA ALA A 20 -18.037 3.031 -2.528 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -16.008 3.688 -1.289 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -16.044 1.937 -1.606 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -15.001 2.997 -2.583 1.00 0.00 H new ATOM 302 N PRO A 21 -17.308 5.547 -2.903 1.00 0.00 N ATOM 303 CA PRO A 21 -17.017 6.904 -3.332 1.00 0.00 C ATOM 304 C PRO A 21 -15.542 7.225 -3.113 1.00 0.00 C ATOM 305 O PRO A 21 -14.896 6.611 -2.254 1.00 0.00 O ATOM 306 CB PRO A 21 -17.895 7.737 -2.420 1.00 0.00 C ATOM 307 CG PRO A 21 -17.945 6.944 -1.159 1.00 0.00 C ATOM 308 CD PRO A 21 -17.939 5.499 -1.577 1.00 0.00 C ATOM 0 HA PRO A 21 -17.208 7.081 -4.391 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -17.473 8.728 -2.254 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -18.889 7.881 -2.843 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -17.090 7.169 -0.522 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -18.841 7.180 -0.585 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -17.373 4.879 -0.882 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -18.947 5.087 -1.623 1.00 0.00 H new ATOM 316 N ILE A 22 -15.009 8.171 -3.872 1.00 0.00 N ATOM 317 CA ILE A 22 -13.597 8.545 -3.761 1.00 0.00 C ATOM 318 C ILE A 22 -13.229 8.874 -2.315 1.00 0.00 C ATOM 319 O ILE A 22 -12.160 8.520 -1.825 1.00 0.00 O ATOM 320 CB ILE A 22 -13.270 9.739 -4.690 1.00 0.00 C ATOM 321 CG1 ILE A 22 -11.848 10.244 -4.441 1.00 0.00 C ATOM 322 CG2 ILE A 22 -14.289 10.860 -4.522 1.00 0.00 C ATOM 323 CD1 ILE A 22 -11.378 11.252 -5.460 1.00 0.00 C ATOM 0 H ILE A 22 -15.529 8.697 -4.574 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.999 7.690 -4.077 1.00 0.00 H new ATOM 0 HB ILE A 22 -13.329 9.391 -5.721 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -11.799 10.693 -3.449 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -11.165 9.395 -4.440 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -14.035 11.686 -5.187 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -15.283 10.488 -4.770 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -14.279 11.209 -3.489 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -10.362 11.565 -5.220 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -11.394 10.801 -6.452 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -12.038 12.119 -5.445 1.00 0.00 H new ATOM 335 N GLN A 23 -14.169 9.501 -1.647 1.00 0.00 N ATOM 336 CA GLN A 23 -14.046 9.924 -0.256 1.00 0.00 C ATOM 337 C GLN A 23 -13.802 8.769 0.732 1.00 0.00 C ATOM 338 O GLN A 23 -13.134 8.954 1.744 1.00 0.00 O ATOM 339 CB GLN A 23 -15.316 10.658 0.096 1.00 0.00 C ATOM 340 CG GLN A 23 -16.509 9.794 -0.171 1.00 0.00 C ATOM 341 CD GLN A 23 -17.795 10.583 -0.356 1.00 0.00 C ATOM 342 OE1 GLN A 23 -18.141 10.976 -1.469 1.00 0.00 O ATOM 343 NE2 GLN A 23 -18.511 10.810 0.733 1.00 0.00 N ATOM 0 H GLN A 23 -15.070 9.742 -2.061 1.00 0.00 H new ATOM 0 HA GLN A 23 -13.165 10.559 -0.166 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -15.297 10.948 1.147 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -15.386 11.576 -0.487 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -16.325 9.199 -1.065 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -16.635 9.096 0.656 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -18.187 10.466 1.637 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -19.387 11.329 0.669 1.00 0.00 H new ATOM 352 N LYS A 24 -14.337 7.582 0.463 1.00 0.00 N ATOM 353 CA LYS A 24 -14.173 6.474 1.406 1.00 0.00 C ATOM 354 C LYS A 24 -12.800 5.843 1.237 1.00 0.00 C ATOM 355 O LYS A 24 -12.126 5.484 2.204 1.00 0.00 O ATOM 356 CB LYS A 24 -15.243 5.411 1.165 1.00 0.00 C ATOM 357 CG LYS A 24 -16.606 5.740 1.740 1.00 0.00 C ATOM 358 CD LYS A 24 -16.596 5.687 3.256 1.00 0.00 C ATOM 359 CE LYS A 24 -17.994 5.461 3.802 1.00 0.00 C ATOM 360 NZ LYS A 24 -18.554 4.152 3.362 1.00 0.00 N ATOM 0 H LYS A 24 -14.874 7.362 -0.376 1.00 0.00 H new ATOM 0 HA LYS A 24 -14.273 6.867 2.418 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.345 5.255 0.091 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -14.902 4.468 1.593 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -16.911 6.734 1.411 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -17.344 5.037 1.355 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -15.937 4.886 3.591 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -16.193 6.619 3.653 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -17.970 5.498 4.891 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -18.649 6.267 3.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -19.072 3.714 4.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -19.202 4.303 2.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -17.779 3.525 3.066 1.00 0.00 H new ATOM 374 N VAL A 25 -12.374 5.761 -0.004 1.00 0.00 N ATOM 375 CA VAL A 25 -11.031 5.344 -0.336 1.00 0.00 C ATOM 376 C VAL A 25 -10.044 6.408 0.134 1.00 0.00 C ATOM 377 O VAL A 25 -8.925 6.110 0.522 1.00 0.00 O ATOM 378 CB VAL A 25 -10.882 5.019 -1.837 1.00 0.00 C ATOM 379 CG1 VAL A 25 -9.634 4.178 -2.057 1.00 0.00 C ATOM 380 CG2 VAL A 25 -12.126 4.282 -2.349 1.00 0.00 C ATOM 0 H VAL A 25 -12.952 5.983 -0.814 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.808 4.413 0.186 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.784 5.950 -2.396 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -9.531 3.950 -3.118 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -8.758 4.731 -1.718 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -9.717 3.249 -1.493 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -12.006 4.059 -3.409 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -12.252 3.352 -1.795 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -13.005 4.910 -2.207 1.00 0.00 H new ATOM 390 N TRP A 26 -10.487 7.654 0.082 1.00 0.00 N ATOM 391 CA TRP A 26 -9.746 8.792 0.628 1.00 0.00 C ATOM 392 C TRP A 26 -9.415 8.538 2.080 1.00 0.00 C ATOM 393 O TRP A 26 -8.319 8.825 2.533 1.00 0.00 O ATOM 394 CB TRP A 26 -10.679 9.992 0.578 1.00 0.00 C ATOM 395 CG TRP A 26 -10.059 11.331 0.423 1.00 0.00 C ATOM 396 CD1 TRP A 26 -9.165 11.981 1.222 1.00 0.00 C ATOM 397 CD2 TRP A 26 -10.380 12.209 -0.625 1.00 0.00 C ATOM 398 NE1 TRP A 26 -8.907 13.230 0.696 1.00 0.00 N ATOM 399 CE2 TRP A 26 -9.649 13.385 -0.452 1.00 0.00 C ATOM 400 CE3 TRP A 26 -11.224 12.075 -1.708 1.00 0.00 C ATOM 401 CZ2 TRP A 26 -9.752 14.449 -1.348 1.00 0.00 C ATOM 402 CZ3 TRP A 26 -11.336 13.102 -2.594 1.00 0.00 C ATOM 403 CH2 TRP A 26 -10.601 14.290 -2.419 1.00 0.00 C ATOM 0 H TRP A 26 -11.378 7.912 -0.343 1.00 0.00 H new ATOM 0 HA TRP A 26 -8.828 8.952 0.062 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -11.374 9.845 -0.249 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -11.270 9.998 1.494 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -8.728 11.581 2.125 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -8.272 13.923 1.092 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -11.789 11.166 -1.851 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -9.189 15.360 -1.207 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -11.997 13.004 -3.442 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -10.705 15.090 -3.137 1.00 0.00 H new ATOM 414 N GLU A 27 -10.396 8.024 2.790 1.00 0.00 N ATOM 415 CA GLU A 27 -10.239 7.593 4.168 1.00 0.00 C ATOM 416 C GLU A 27 -9.342 6.357 4.271 1.00 0.00 C ATOM 417 O GLU A 27 -8.746 6.093 5.316 1.00 0.00 O ATOM 418 CB GLU A 27 -11.608 7.298 4.760 1.00 0.00 C ATOM 419 CG GLU A 27 -11.603 7.077 6.260 1.00 0.00 C ATOM 420 CD GLU A 27 -12.992 7.162 6.848 1.00 0.00 C ATOM 421 OE1 GLU A 27 -13.605 8.249 6.767 1.00 0.00 O ATOM 422 OE2 GLU A 27 -13.484 6.147 7.385 1.00 0.00 O ATOM 0 H GLU A 27 -11.339 7.891 2.424 1.00 0.00 H new ATOM 0 HA GLU A 27 -9.758 8.395 4.728 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -12.278 8.126 4.529 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -12.018 6.412 4.275 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -11.175 6.099 6.481 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -10.962 7.820 6.734 1.00 0.00 H new ATOM 429 N THR A 28 -9.336 5.550 3.220 1.00 0.00 N ATOM 430 CA THR A 28 -8.661 4.262 3.250 1.00 0.00 C ATOM 431 C THR A 28 -7.266 4.161 2.563 1.00 0.00 C ATOM 432 O THR A 28 -6.621 3.133 2.696 1.00 0.00 O ATOM 433 CB THR A 28 -9.590 3.164 2.739 1.00 0.00 C ATOM 434 OG1 THR A 28 -10.901 3.360 3.288 1.00 0.00 O ATOM 435 CG2 THR A 28 -9.078 1.809 3.174 1.00 0.00 C ATOM 0 H THR A 28 -9.793 5.766 2.334 1.00 0.00 H new ATOM 0 HA THR A 28 -8.426 4.128 4.306 1.00 0.00 H new ATOM 0 HB THR A 28 -9.626 3.207 1.650 1.00 0.00 H new ATOM 0 HG1 THR A 28 -11.279 4.196 2.943 1.00 0.00 H new ATOM 0 HG21 THR A 28 -9.747 1.032 2.805 1.00 0.00 H new ATOM 0 HG22 THR A 28 -8.079 1.650 2.769 1.00 0.00 H new ATOM 0 HG23 THR A 28 -9.039 1.767 4.262 1.00 0.00 H new ATOM 443 N VAL A 29 -6.789 5.156 1.811 1.00 0.00 N ATOM 444 CA VAL A 29 -5.503 4.980 1.089 1.00 0.00 C ATOM 445 C VAL A 29 -4.530 6.150 1.261 1.00 0.00 C ATOM 446 O VAL A 29 -3.456 5.992 1.819 1.00 0.00 O ATOM 447 CB VAL A 29 -5.666 4.663 -0.424 1.00 0.00 C ATOM 448 CG1 VAL A 29 -6.414 3.372 -0.615 1.00 0.00 C ATOM 449 CG2 VAL A 29 -6.351 5.778 -1.187 1.00 0.00 C ATOM 0 H VAL A 29 -7.243 6.060 1.681 1.00 0.00 H new ATOM 0 HA VAL A 29 -5.070 4.104 1.573 1.00 0.00 H new ATOM 0 HB VAL A 29 -4.660 4.566 -0.832 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.519 3.166 -1.680 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.864 2.559 -0.141 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -7.402 3.454 -0.163 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -6.437 5.501 -2.238 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -7.345 5.945 -0.773 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -5.764 6.692 -1.100 1.00 0.00 H new ATOM 459 N SER A 30 -4.866 7.315 0.783 1.00 0.00 N ATOM 460 CA SER A 30 -3.946 8.431 0.899 1.00 0.00 C ATOM 461 C SER A 30 -4.333 9.253 2.100 1.00 0.00 C ATOM 462 O SER A 30 -4.827 10.372 1.981 1.00 0.00 O ATOM 463 CB SER A 30 -3.962 9.264 -0.369 1.00 0.00 C ATOM 464 OG SER A 30 -5.289 9.578 -0.747 1.00 0.00 O ATOM 0 H SER A 30 -5.749 7.523 0.317 1.00 0.00 H new ATOM 0 HA SER A 30 -2.929 8.063 1.032 1.00 0.00 H new ATOM 0 HB2 SER A 30 -3.396 10.183 -0.213 1.00 0.00 H new ATOM 0 HB3 SER A 30 -3.469 8.719 -1.174 1.00 0.00 H new ATOM 0 HG SER A 30 -5.729 10.066 -0.020 1.00 0.00 H new ATOM 470 N THR A 31 -4.170 8.651 3.257 1.00 0.00 N ATOM 471 CA THR A 31 -4.740 9.190 4.456 1.00 0.00 C ATOM 472 C THR A 31 -4.006 8.685 5.672 1.00 0.00 C ATOM 473 O THR A 31 -2.964 8.040 5.557 1.00 0.00 O ATOM 474 CB THR A 31 -6.243 8.878 4.501 1.00 0.00 C ATOM 475 OG1 THR A 31 -6.853 9.295 5.732 1.00 0.00 O ATOM 476 CG2 THR A 31 -6.457 7.402 4.267 1.00 0.00 C ATOM 0 H THR A 31 -3.645 7.786 3.386 1.00 0.00 H new ATOM 0 HA THR A 31 -4.629 10.274 4.457 1.00 0.00 H new ATOM 0 HB THR A 31 -6.728 9.448 3.709 1.00 0.00 H new ATOM 0 HG1 THR A 31 -7.808 9.077 5.714 1.00 0.00 H new ATOM 0 HG21 THR A 31 -7.524 7.179 4.299 1.00 0.00 H new ATOM 0 HG22 THR A 31 -6.058 7.127 3.291 1.00 0.00 H new ATOM 0 HG23 THR A 31 -5.944 6.833 5.042 1.00 0.00 H new ATOM 484 N SER A 32 -4.527 9.039 6.819 1.00 0.00 N ATOM 485 CA SER A 32 -3.987 8.633 8.084 1.00 0.00 C ATOM 486 C SER A 32 -4.008 7.123 8.182 1.00 0.00 C ATOM 487 O SER A 32 -4.568 6.436 7.325 1.00 0.00 O ATOM 488 CB SER A 32 -4.786 9.218 9.237 1.00 0.00 C ATOM 489 OG SER A 32 -6.172 9.251 8.939 1.00 0.00 O ATOM 0 H SER A 32 -5.355 9.629 6.897 1.00 0.00 H new ATOM 0 HA SER A 32 -2.963 9.002 8.150 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.619 8.624 10.136 1.00 0.00 H new ATOM 0 HB3 SER A 32 -4.434 10.227 9.451 1.00 0.00 H new ATOM 0 HG SER A 32 -6.661 9.630 9.699 1.00 0.00 H new ATOM 495 N GLU A 33 -3.336 6.639 9.206 1.00 0.00 N ATOM 496 CA GLU A 33 -2.867 5.266 9.346 1.00 0.00 C ATOM 497 C GLU A 33 -3.946 4.208 9.082 1.00 0.00 C ATOM 498 O GLU A 33 -3.642 3.016 9.042 1.00 0.00 O ATOM 499 CB GLU A 33 -2.328 5.130 10.760 1.00 0.00 C ATOM 500 CG GLU A 33 -1.535 6.354 11.184 1.00 0.00 C ATOM 501 CD GLU A 33 -1.263 6.403 12.667 1.00 0.00 C ATOM 502 OE1 GLU A 33 -2.125 6.910 13.413 1.00 0.00 O ATOM 503 OE2 GLU A 33 -0.181 5.959 13.092 1.00 0.00 O ATOM 0 H GLU A 33 -3.087 7.219 10.007 1.00 0.00 H new ATOM 0 HA GLU A 33 -2.103 5.081 8.591 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -3.157 4.977 11.451 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.693 4.246 10.823 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -0.587 6.368 10.647 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.080 7.251 10.892 1.00 0.00 H new ATOM 510 N GLY A 34 -5.191 4.632 8.924 1.00 0.00 N ATOM 511 CA GLY A 34 -6.241 3.709 8.553 1.00 0.00 C ATOM 512 C GLY A 34 -5.948 3.006 7.238 1.00 0.00 C ATOM 513 O GLY A 34 -6.273 1.829 7.086 1.00 0.00 O ATOM 0 H GLY A 34 -5.492 5.599 9.046 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -6.364 2.966 9.341 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -7.185 4.248 8.473 1.00 0.00 H new ATOM 517 N ILE A 35 -5.341 3.713 6.278 1.00 0.00 N ATOM 518 CA ILE A 35 -4.917 3.080 5.058 1.00 0.00 C ATOM 519 C ILE A 35 -3.852 2.020 5.301 1.00 0.00 C ATOM 520 O ILE A 35 -3.868 0.949 4.707 1.00 0.00 O ATOM 521 CB ILE A 35 -4.405 4.099 4.031 1.00 0.00 C ATOM 522 CG1 ILE A 35 -3.553 3.404 2.960 1.00 0.00 C ATOM 523 CG2 ILE A 35 -3.642 5.245 4.687 1.00 0.00 C ATOM 524 CD1 ILE A 35 -2.069 3.535 3.204 1.00 0.00 C ATOM 0 H ILE A 35 -5.141 4.712 6.335 1.00 0.00 H new ATOM 0 HA ILE A 35 -5.803 2.591 4.652 1.00 0.00 H new ATOM 0 HB ILE A 35 -5.276 4.540 3.546 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.817 2.347 2.924 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -3.793 3.826 1.984 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.300 5.940 3.920 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.298 5.767 5.383 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.782 4.848 5.227 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.523 3.022 2.412 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.793 4.589 3.211 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -1.818 3.088 4.166 1.00 0.00 H new ATOM 536 N ALA A 36 -2.925 2.329 6.173 1.00 0.00 N ATOM 537 CA ALA A 36 -1.826 1.419 6.458 1.00 0.00 C ATOM 538 C ALA A 36 -2.362 0.052 6.900 1.00 0.00 C ATOM 539 O ALA A 36 -1.773 -0.991 6.604 1.00 0.00 O ATOM 540 CB ALA A 36 -0.899 2.024 7.503 1.00 0.00 C ATOM 0 H ALA A 36 -2.903 3.201 6.701 1.00 0.00 H new ATOM 0 HA ALA A 36 -1.246 1.265 5.548 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -0.081 1.333 7.707 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -0.495 2.965 7.130 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -1.457 2.208 8.421 1.00 0.00 H new ATOM 546 N LYS A 37 -3.512 0.094 7.563 1.00 0.00 N ATOM 547 CA LYS A 37 -4.108 -1.053 8.237 1.00 0.00 C ATOM 548 C LYS A 37 -4.349 -2.283 7.335 1.00 0.00 C ATOM 549 O LYS A 37 -4.141 -3.405 7.800 1.00 0.00 O ATOM 550 CB LYS A 37 -5.420 -0.602 8.892 1.00 0.00 C ATOM 551 CG LYS A 37 -6.027 -1.594 9.877 1.00 0.00 C ATOM 552 CD LYS A 37 -6.946 -2.594 9.194 1.00 0.00 C ATOM 553 CE LYS A 37 -7.733 -3.401 10.212 1.00 0.00 C ATOM 554 NZ LYS A 37 -8.571 -2.522 11.073 1.00 0.00 N ATOM 0 H LYS A 37 -4.068 0.945 7.649 1.00 0.00 H new ATOM 0 HA LYS A 37 -3.386 -1.394 8.979 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.243 0.340 9.412 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -6.149 -0.401 8.107 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -5.228 -2.129 10.390 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -6.586 -1.051 10.639 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -7.634 -2.067 8.533 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -6.357 -3.266 8.570 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -8.369 -4.120 9.695 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -7.045 -3.974 10.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -9.319 -3.088 11.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -7.977 -2.087 11.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -9.004 -1.777 10.491 1.00 0.00 H new ATOM 568 N TRP A 38 -4.793 -2.119 6.069 1.00 0.00 N ATOM 569 CA TRP A 38 -5.177 -3.309 5.281 1.00 0.00 C ATOM 570 C TRP A 38 -3.999 -4.273 5.105 1.00 0.00 C ATOM 571 O TRP A 38 -4.197 -5.489 5.109 1.00 0.00 O ATOM 572 CB TRP A 38 -5.857 -3.031 3.894 1.00 0.00 C ATOM 573 CG TRP A 38 -5.780 -1.632 3.351 1.00 0.00 C ATOM 574 CD1 TRP A 38 -6.279 -0.529 3.947 1.00 0.00 C ATOM 575 CD2 TRP A 38 -5.264 -1.190 2.065 1.00 0.00 C ATOM 576 NE1 TRP A 38 -6.019 0.576 3.178 1.00 0.00 N ATOM 577 CE2 TRP A 38 -5.399 0.199 2.029 1.00 0.00 C ATOM 578 CE3 TRP A 38 -4.666 -1.807 0.958 1.00 0.00 C ATOM 579 CZ2 TRP A 38 -4.961 0.969 0.951 1.00 0.00 C ATOM 580 CZ3 TRP A 38 -4.248 -1.023 -0.109 1.00 0.00 C ATOM 581 CH2 TRP A 38 -4.392 0.344 -0.093 1.00 0.00 C ATOM 0 H TRP A 38 -4.891 -1.223 5.591 1.00 0.00 H new ATOM 0 HA TRP A 38 -5.955 -3.770 5.889 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -5.410 -3.702 3.160 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -6.909 -3.303 3.975 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -6.805 -0.518 4.890 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -6.255 1.536 3.430 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -4.532 -2.878 0.935 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -5.077 2.043 0.956 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -3.800 -1.497 -0.970 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -4.042 0.925 -0.933 1.00 0.00 H new ATOM 592 N PHE A 39 -2.780 -3.752 5.002 1.00 0.00 N ATOM 593 CA PHE A 39 -1.619 -4.604 4.734 1.00 0.00 C ATOM 594 C PHE A 39 -0.638 -4.624 5.903 1.00 0.00 C ATOM 595 O PHE A 39 -0.232 -5.689 6.374 1.00 0.00 O ATOM 596 CB PHE A 39 -0.901 -4.134 3.467 1.00 0.00 C ATOM 597 CG PHE A 39 0.275 -4.991 3.075 1.00 0.00 C ATOM 598 CD1 PHE A 39 0.101 -6.325 2.747 1.00 0.00 C ATOM 599 CD2 PHE A 39 1.552 -4.457 3.028 1.00 0.00 C ATOM 600 CE1 PHE A 39 1.175 -7.112 2.382 1.00 0.00 C ATOM 601 CE2 PHE A 39 2.632 -5.239 2.663 1.00 0.00 C ATOM 602 CZ PHE A 39 2.443 -6.569 2.341 1.00 0.00 C ATOM 0 H PHE A 39 -2.569 -2.759 5.098 1.00 0.00 H new ATOM 0 HA PHE A 39 -1.989 -5.620 4.594 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -1.614 -4.115 2.643 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.558 -3.110 3.615 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -0.889 -6.756 2.777 1.00 0.00 H new ATOM 0 HD2 PHE A 39 1.706 -3.418 3.279 1.00 0.00 H new ATOM 0 HE1 PHE A 39 1.023 -8.151 2.129 1.00 0.00 H new ATOM 0 HE2 PHE A 39 3.623 -4.810 2.630 1.00 0.00 H new ATOM 0 HZ PHE A 39 3.286 -7.182 2.058 1.00 0.00 H new ATOM 612 N MET A 40 -0.264 -3.448 6.369 1.00 0.00 N ATOM 613 CA MET A 40 0.770 -3.313 7.385 1.00 0.00 C ATOM 614 C MET A 40 0.143 -2.896 8.710 1.00 0.00 C ATOM 615 O MET A 40 -1.084 -2.875 8.827 1.00 0.00 O ATOM 616 CB MET A 40 1.801 -2.264 6.932 1.00 0.00 C ATOM 617 CG MET A 40 2.581 -2.660 5.690 1.00 0.00 C ATOM 618 SD MET A 40 3.652 -4.085 5.957 1.00 0.00 S ATOM 619 CE MET A 40 4.857 -3.394 7.089 1.00 0.00 C ATOM 0 H MET A 40 -0.664 -2.562 6.058 1.00 0.00 H new ATOM 0 HA MET A 40 1.272 -4.271 7.521 1.00 0.00 H new ATOM 0 HB2 MET A 40 1.286 -1.323 6.740 1.00 0.00 H new ATOM 0 HB3 MET A 40 2.502 -2.083 7.747 1.00 0.00 H new ATOM 0 HG2 MET A 40 1.882 -2.884 4.884 1.00 0.00 H new ATOM 0 HG3 MET A 40 3.185 -1.814 5.362 1.00 0.00 H new ATOM 0 HE1 MET A 40 5.840 -3.815 6.876 1.00 0.00 H new ATOM 0 HE2 MET A 40 4.892 -2.311 6.967 1.00 0.00 H new ATOM 0 HE3 MET A 40 4.574 -3.635 8.114 1.00 0.00 H new ATOM 629 N PRO A 41 0.957 -2.603 9.745 1.00 0.00 N ATOM 630 CA PRO A 41 0.478 -1.868 10.918 1.00 0.00 C ATOM 631 C PRO A 41 0.044 -0.460 10.516 1.00 0.00 C ATOM 632 O PRO A 41 -0.230 -0.195 9.351 1.00 0.00 O ATOM 633 CB PRO A 41 1.703 -1.805 11.843 1.00 0.00 C ATOM 634 CG PRO A 41 2.617 -2.877 11.359 1.00 0.00 C ATOM 635 CD PRO A 41 2.368 -3.002 9.887 1.00 0.00 C ATOM 0 HA PRO A 41 -0.383 -2.340 11.391 1.00 0.00 H new ATOM 0 HB2 PRO A 41 2.183 -0.827 11.794 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.420 -1.969 12.883 1.00 0.00 H new ATOM 0 HG2 PRO A 41 3.658 -2.621 11.558 1.00 0.00 H new ATOM 0 HG3 PRO A 41 2.417 -3.819 11.869 1.00 0.00 H new ATOM 0 HD2 PRO A 41 3.029 -2.354 9.311 1.00 0.00 H new ATOM 0 HD3 PRO A 41 2.535 -4.020 9.536 1.00 0.00 H new ATOM 643 N ASN A 42 -0.003 0.450 11.461 1.00 0.00 N ATOM 644 CA ASN A 42 -0.340 1.823 11.136 1.00 0.00 C ATOM 645 C ASN A 42 0.935 2.641 11.041 1.00 0.00 C ATOM 646 O ASN A 42 1.865 2.430 11.818 1.00 0.00 O ATOM 647 CB ASN A 42 -1.296 2.395 12.183 1.00 0.00 C ATOM 648 CG ASN A 42 -0.711 2.385 13.587 1.00 0.00 C ATOM 649 OD1 ASN A 42 -0.777 1.375 14.289 1.00 0.00 O ATOM 650 ND2 ASN A 42 -0.158 3.505 14.019 1.00 0.00 N ATOM 0 H ASN A 42 0.184 0.272 12.448 1.00 0.00 H new ATOM 0 HA ASN A 42 -0.849 1.861 10.173 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -1.556 3.418 11.910 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -2.221 1.819 12.176 1.00 0.00 H new ATOM 0 HD21 ASN A 42 0.231 3.551 14.961 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -0.120 4.323 13.411 1.00 0.00 H new ATOM 657 N ASP A 43 0.976 3.570 10.090 1.00 0.00 N ATOM 658 CA ASP A 43 2.213 4.282 9.781 1.00 0.00 C ATOM 659 C ASP A 43 1.972 5.384 8.748 1.00 0.00 C ATOM 660 O ASP A 43 2.285 6.549 8.991 1.00 0.00 O ATOM 661 CB ASP A 43 3.260 3.287 9.259 1.00 0.00 C ATOM 662 CG ASP A 43 4.639 3.895 9.089 1.00 0.00 C ATOM 663 OD1 ASP A 43 5.309 4.158 10.115 1.00 0.00 O ATOM 664 OD2 ASP A 43 5.068 4.075 7.929 1.00 0.00 O ATOM 0 H ASP A 43 0.174 3.846 9.524 1.00 0.00 H new ATOM 0 HA ASP A 43 2.579 4.753 10.693 1.00 0.00 H new ATOM 0 HB2 ASP A 43 3.325 2.445 9.948 1.00 0.00 H new ATOM 0 HB3 ASP A 43 2.926 2.889 8.301 1.00 0.00 H new ATOM 669 N PHE A 44 1.403 5.014 7.596 1.00 0.00 N ATOM 670 CA PHE A 44 1.171 5.978 6.516 1.00 0.00 C ATOM 671 C PHE A 44 0.108 7.019 6.872 1.00 0.00 C ATOM 672 O PHE A 44 -0.905 6.721 7.497 1.00 0.00 O ATOM 673 CB PHE A 44 0.762 5.289 5.210 1.00 0.00 C ATOM 674 CG PHE A 44 0.710 6.272 4.074 1.00 0.00 C ATOM 675 CD1 PHE A 44 1.819 7.035 3.787 1.00 0.00 C ATOM 676 CD2 PHE A 44 -0.442 6.471 3.329 1.00 0.00 C ATOM 677 CE1 PHE A 44 1.798 7.975 2.783 1.00 0.00 C ATOM 678 CE2 PHE A 44 -0.468 7.419 2.319 1.00 0.00 C ATOM 679 CZ PHE A 44 0.653 8.169 2.047 1.00 0.00 C ATOM 0 H PHE A 44 1.097 4.063 7.389 1.00 0.00 H new ATOM 0 HA PHE A 44 2.126 6.485 6.377 1.00 0.00 H new ATOM 0 HB2 PHE A 44 1.471 4.495 4.976 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -0.214 4.819 5.333 1.00 0.00 H new ATOM 0 HD1 PHE A 44 2.723 6.893 4.361 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -1.324 5.884 3.537 1.00 0.00 H new ATOM 0 HE1 PHE A 44 2.681 8.561 2.573 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -1.370 7.570 1.744 1.00 0.00 H new ATOM 0 HZ PHE A 44 0.634 8.907 1.259 1.00 0.00 H new ATOM 689 N GLN A 45 0.396 8.241 6.457 1.00 0.00 N ATOM 690 CA GLN A 45 -0.512 9.381 6.508 1.00 0.00 C ATOM 691 C GLN A 45 -0.267 10.115 5.211 1.00 0.00 C ATOM 692 O GLN A 45 0.865 10.079 4.733 1.00 0.00 O ATOM 693 CB GLN A 45 -0.164 10.294 7.694 1.00 0.00 C ATOM 694 CG GLN A 45 0.011 9.570 9.018 1.00 0.00 C ATOM 695 CD GLN A 45 0.368 10.521 10.145 1.00 0.00 C ATOM 696 OE1 GLN A 45 1.535 10.865 10.334 1.00 0.00 O ATOM 697 NE2 GLN A 45 -0.627 10.937 10.911 1.00 0.00 N ATOM 0 H GLN A 45 1.305 8.478 6.059 1.00 0.00 H new ATOM 0 HA GLN A 45 -1.551 9.075 6.633 1.00 0.00 H new ATOM 0 HB2 GLN A 45 0.756 10.832 7.464 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -0.950 11.041 7.804 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -0.910 9.043 9.267 1.00 0.00 H new ATOM 0 HG3 GLN A 45 0.793 8.817 8.918 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -1.580 10.629 10.721 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -0.441 11.566 11.692 1.00 0.00 H new ATOM 706 N LEU A 46 -1.251 10.774 4.603 1.00 0.00 N ATOM 707 CA LEU A 46 -0.927 11.425 3.350 1.00 0.00 C ATOM 708 C LEU A 46 -0.086 12.651 3.648 1.00 0.00 C ATOM 709 O LEU A 46 -0.544 13.681 4.141 1.00 0.00 O ATOM 710 CB LEU A 46 -2.153 11.767 2.484 1.00 0.00 C ATOM 711 CG LEU A 46 -2.944 13.020 2.859 1.00 0.00 C ATOM 712 CD1 LEU A 46 -3.938 13.375 1.764 1.00 0.00 C ATOM 713 CD2 LEU A 46 -3.666 12.840 4.188 1.00 0.00 C ATOM 0 H LEU A 46 -2.212 10.866 4.932 1.00 0.00 H new ATOM 0 HA LEU A 46 -0.361 10.718 2.743 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.819 11.875 1.452 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.834 10.916 2.511 1.00 0.00 H new ATOM 0 HG LEU A 46 -2.234 13.840 2.967 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.491 14.270 2.051 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -3.403 13.562 0.833 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -4.634 12.548 1.622 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -4.220 13.748 4.427 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -4.358 12.001 4.115 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -2.937 12.642 4.974 1.00 0.00 H new ATOM 725 N LYS A 47 1.175 12.462 3.390 1.00 0.00 N ATOM 726 CA LYS A 47 2.201 13.444 3.589 1.00 0.00 C ATOM 727 C LYS A 47 2.999 13.503 2.327 1.00 0.00 C ATOM 728 O LYS A 47 3.008 12.549 1.591 1.00 0.00 O ATOM 729 CB LYS A 47 3.089 13.065 4.759 1.00 0.00 C ATOM 730 CG LYS A 47 2.637 13.649 6.084 1.00 0.00 C ATOM 731 CD LYS A 47 3.543 13.207 7.226 1.00 0.00 C ATOM 732 CE LYS A 47 3.213 13.909 8.537 1.00 0.00 C ATOM 733 NZ LYS A 47 1.948 13.420 9.147 1.00 0.00 N ATOM 0 H LYS A 47 1.532 11.581 3.019 1.00 0.00 H new ATOM 0 HA LYS A 47 1.763 14.415 3.819 1.00 0.00 H new ATOM 0 HB2 LYS A 47 3.120 11.979 4.843 1.00 0.00 H new ATOM 0 HB3 LYS A 47 4.106 13.398 4.554 1.00 0.00 H new ATOM 0 HG2 LYS A 47 2.633 14.737 6.021 1.00 0.00 H new ATOM 0 HG3 LYS A 47 1.613 13.338 6.289 1.00 0.00 H new ATOM 0 HD2 LYS A 47 3.452 12.129 7.362 1.00 0.00 H new ATOM 0 HD3 LYS A 47 4.581 13.408 6.961 1.00 0.00 H new ATOM 0 HE2 LYS A 47 4.032 13.760 9.240 1.00 0.00 H new ATOM 0 HE3 LYS A 47 3.136 14.982 8.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 1.682 14.040 9.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 1.192 13.428 8.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 2.084 12.450 9.497 1.00 0.00 H new ATOM 747 N GLU A 48 3.562 14.623 2.004 1.00 0.00 N ATOM 748 CA GLU A 48 4.392 14.694 0.838 1.00 0.00 C ATOM 749 C GLU A 48 5.797 15.186 1.120 1.00 0.00 C ATOM 750 O GLU A 48 6.000 16.194 1.796 1.00 0.00 O ATOM 751 CB GLU A 48 3.700 15.436 -0.269 1.00 0.00 C ATOM 752 CG GLU A 48 3.335 14.460 -1.334 1.00 0.00 C ATOM 753 CD GLU A 48 4.517 14.170 -2.223 1.00 0.00 C ATOM 754 OE1 GLU A 48 5.469 13.517 -1.760 1.00 0.00 O ATOM 755 OE2 GLU A 48 4.505 14.622 -3.384 1.00 0.00 O ATOM 0 H GLU A 48 3.466 15.495 2.524 1.00 0.00 H new ATOM 0 HA GLU A 48 4.542 13.672 0.489 1.00 0.00 H new ATOM 0 HB2 GLU A 48 2.808 15.936 0.109 1.00 0.00 H new ATOM 0 HB3 GLU A 48 4.353 16.211 -0.672 1.00 0.00 H new ATOM 0 HG2 GLU A 48 2.981 13.535 -0.880 1.00 0.00 H new ATOM 0 HG3 GLU A 48 2.514 14.857 -1.931 1.00 0.00 H new ATOM 762 N GLY A 49 6.751 14.442 0.581 1.00 0.00 N ATOM 763 CA GLY A 49 8.167 14.717 0.794 1.00 0.00 C ATOM 764 C GLY A 49 8.513 14.822 2.268 1.00 0.00 C ATOM 765 O GLY A 49 9.276 15.691 2.692 1.00 0.00 O ATOM 0 H GLY A 49 6.569 13.634 -0.014 1.00 0.00 H new ATOM 0 HA2 GLY A 49 8.762 13.926 0.338 1.00 0.00 H new ATOM 0 HA3 GLY A 49 8.435 15.647 0.292 1.00 0.00 H new ATOM 769 N GLN A 50 7.915 13.930 3.030 1.00 0.00 N ATOM 770 CA GLN A 50 7.965 13.922 4.469 1.00 0.00 C ATOM 771 C GLN A 50 8.806 12.761 4.935 1.00 0.00 C ATOM 772 O GLN A 50 9.260 11.963 4.120 1.00 0.00 O ATOM 773 CB GLN A 50 6.546 13.767 4.993 1.00 0.00 C ATOM 774 CG GLN A 50 6.143 12.324 5.184 1.00 0.00 C ATOM 775 CD GLN A 50 6.082 11.600 3.871 1.00 0.00 C ATOM 776 OE1 GLN A 50 6.413 10.433 3.784 1.00 0.00 O ATOM 777 NE2 GLN A 50 5.655 12.299 2.837 1.00 0.00 N ATOM 0 H GLN A 50 7.362 13.164 2.646 1.00 0.00 H new ATOM 0 HA GLN A 50 8.404 14.849 4.839 1.00 0.00 H new ATOM 0 HB2 GLN A 50 6.456 14.293 5.944 1.00 0.00 H new ATOM 0 HB3 GLN A 50 5.854 14.243 4.299 1.00 0.00 H new ATOM 0 HG2 GLN A 50 6.856 11.829 5.843 1.00 0.00 H new ATOM 0 HG3 GLN A 50 5.170 12.277 5.674 1.00 0.00 H new ATOM 0 HE21 GLN A 50 5.388 13.276 2.957 1.00 0.00 H new ATOM 0 HE22 GLN A 50 5.592 11.862 1.917 1.00 0.00 H new ATOM 786 N GLU A 51 9.043 12.680 6.219 1.00 0.00 N ATOM 787 CA GLU A 51 9.353 11.394 6.794 1.00 0.00 C ATOM 788 C GLU A 51 8.360 11.084 7.914 1.00 0.00 C ATOM 789 O GLU A 51 8.139 11.908 8.801 1.00 0.00 O ATOM 790 CB GLU A 51 10.793 11.342 7.298 1.00 0.00 C ATOM 791 CG GLU A 51 11.820 11.496 6.189 1.00 0.00 C ATOM 792 CD GLU A 51 13.234 11.263 6.667 1.00 0.00 C ATOM 793 OE1 GLU A 51 13.753 12.107 7.428 1.00 0.00 O ATOM 794 OE2 GLU A 51 13.838 10.243 6.274 1.00 0.00 O ATOM 0 H GLU A 51 9.029 13.464 6.872 1.00 0.00 H new ATOM 0 HA GLU A 51 9.261 10.632 6.020 1.00 0.00 H new ATOM 0 HB2 GLU A 51 10.942 12.131 8.035 1.00 0.00 H new ATOM 0 HB3 GLU A 51 10.959 10.393 7.809 1.00 0.00 H new ATOM 0 HG2 GLU A 51 11.591 10.793 5.388 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.744 12.498 5.766 1.00 0.00 H new ATOM 801 N PHE A 52 7.755 9.900 7.858 1.00 0.00 N ATOM 802 CA PHE A 52 6.770 9.485 8.857 1.00 0.00 C ATOM 803 C PHE A 52 7.019 8.068 9.355 1.00 0.00 C ATOM 804 O PHE A 52 7.280 7.172 8.570 1.00 0.00 O ATOM 805 CB PHE A 52 5.334 9.605 8.318 1.00 0.00 C ATOM 806 CG PHE A 52 5.093 9.132 6.918 1.00 0.00 C ATOM 807 CD1 PHE A 52 5.793 8.087 6.350 1.00 0.00 C ATOM 808 CD2 PHE A 52 4.143 9.775 6.161 1.00 0.00 C ATOM 809 CE1 PHE A 52 5.548 7.699 5.060 1.00 0.00 C ATOM 810 CE2 PHE A 52 3.895 9.399 4.877 1.00 0.00 C ATOM 811 CZ PHE A 52 4.598 8.354 4.318 1.00 0.00 C ATOM 0 H PHE A 52 7.930 9.208 7.129 1.00 0.00 H new ATOM 0 HA PHE A 52 6.885 10.165 9.701 1.00 0.00 H new ATOM 0 HB2 PHE A 52 4.675 9.047 8.983 1.00 0.00 H new ATOM 0 HB3 PHE A 52 5.036 10.652 8.378 1.00 0.00 H new ATOM 0 HD1 PHE A 52 6.543 7.569 6.930 1.00 0.00 H new ATOM 0 HD2 PHE A 52 3.584 10.592 6.592 1.00 0.00 H new ATOM 0 HE1 PHE A 52 6.102 6.879 4.627 1.00 0.00 H new ATOM 0 HE2 PHE A 52 3.148 9.919 4.296 1.00 0.00 H new ATOM 0 HZ PHE A 52 4.402 8.052 3.300 1.00 0.00 H new ATOM 821 N HIS A 53 6.972 7.857 10.657 1.00 0.00 N ATOM 822 CA HIS A 53 7.006 6.496 11.173 1.00 0.00 C ATOM 823 C HIS A 53 6.206 6.395 12.457 1.00 0.00 C ATOM 824 O HIS A 53 6.330 7.270 13.312 1.00 0.00 O ATOM 825 CB HIS A 53 8.446 6.053 11.425 1.00 0.00 C ATOM 826 CG HIS A 53 8.661 4.577 11.281 1.00 0.00 C ATOM 827 ND1 HIS A 53 9.196 3.791 12.275 1.00 0.00 N ATOM 828 CD2 HIS A 53 8.463 3.755 10.221 1.00 0.00 C ATOM 829 CE1 HIS A 53 9.323 2.552 11.833 1.00 0.00 C ATOM 830 NE2 HIS A 53 8.886 2.500 10.587 1.00 0.00 N ATOM 0 H HIS A 53 6.912 8.589 11.365 1.00 0.00 H new ATOM 0 HA HIS A 53 6.561 5.839 10.426 1.00 0.00 H new ATOM 0 HB2 HIS A 53 9.103 6.576 10.730 1.00 0.00 H new ATOM 0 HB3 HIS A 53 8.739 6.357 12.430 1.00 0.00 H new ATOM 0 HD2 HIS A 53 8.049 4.035 9.264 1.00 0.00 H new ATOM 0 HE1 HIS A 53 9.718 1.720 12.397 1.00 0.00 H new ATOM 0 HE2 HIS A 53 8.866 1.669 9.997 1.00 0.00 H new ATOM 839 N LEU A 54 5.420 5.315 12.567 1.00 0.00 N ATOM 840 CA LEU A 54 4.669 4.943 13.782 1.00 0.00 C ATOM 841 C LEU A 54 4.321 6.138 14.674 1.00 0.00 C ATOM 842 O LEU A 54 3.266 6.759 14.527 1.00 0.00 O ATOM 843 CB LEU A 54 5.461 3.909 14.589 1.00 0.00 C ATOM 844 CG LEU A 54 5.808 2.622 13.841 1.00 0.00 C ATOM 845 CD1 LEU A 54 6.733 1.759 14.682 1.00 0.00 C ATOM 846 CD2 LEU A 54 4.547 1.853 13.482 1.00 0.00 C ATOM 0 H LEU A 54 5.283 4.659 11.798 1.00 0.00 H new ATOM 0 HA LEU A 54 3.723 4.520 13.443 1.00 0.00 H new ATOM 0 HB2 LEU A 54 6.387 4.371 14.931 1.00 0.00 H new ATOM 0 HB3 LEU A 54 4.887 3.649 15.478 1.00 0.00 H new ATOM 0 HG LEU A 54 6.321 2.888 12.917 1.00 0.00 H new ATOM 0 HD11 LEU A 54 6.973 0.845 14.138 1.00 0.00 H new ATOM 0 HD12 LEU A 54 7.651 2.308 14.892 1.00 0.00 H new ATOM 0 HD13 LEU A 54 6.240 1.504 15.620 1.00 0.00 H new ATOM 0 HD21 LEU A 54 4.816 0.940 12.950 1.00 0.00 H new ATOM 0 HD22 LEU A 54 4.006 1.596 14.393 1.00 0.00 H new ATOM 0 HD23 LEU A 54 3.913 2.470 12.845 1.00 0.00 H new ATOM 858 N GLN A 55 5.223 6.441 15.602 1.00 0.00 N ATOM 859 CA GLN A 55 5.107 7.615 16.450 1.00 0.00 C ATOM 860 C GLN A 55 6.505 8.166 16.730 1.00 0.00 C ATOM 861 O GLN A 55 6.965 8.202 17.871 1.00 0.00 O ATOM 862 CB GLN A 55 4.381 7.267 17.755 1.00 0.00 C ATOM 863 CG GLN A 55 4.105 8.471 18.644 1.00 0.00 C ATOM 864 CD GLN A 55 3.290 9.537 17.942 1.00 0.00 C ATOM 865 OE1 GLN A 55 3.840 10.430 17.294 1.00 0.00 O ATOM 866 NE2 GLN A 55 1.979 9.455 18.069 1.00 0.00 N ATOM 0 H GLN A 55 6.054 5.878 15.785 1.00 0.00 H new ATOM 0 HA GLN A 55 4.518 8.378 15.941 1.00 0.00 H new ATOM 0 HB2 GLN A 55 3.436 6.780 17.515 1.00 0.00 H new ATOM 0 HB3 GLN A 55 4.979 6.546 18.312 1.00 0.00 H new ATOM 0 HG2 GLN A 55 3.575 8.144 19.539 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.051 8.900 18.973 1.00 0.00 H new ATOM 0 HE21 GLN A 55 1.566 8.699 18.615 1.00 0.00 H new ATOM 0 HE22 GLN A 55 1.379 10.148 17.621 1.00 0.00 H new ATOM 875 N SER A 56 7.198 8.549 15.669 1.00 0.00 N ATOM 876 CA SER A 56 8.552 9.071 15.789 1.00 0.00 C ATOM 877 C SER A 56 8.855 10.060 14.663 1.00 0.00 C ATOM 878 O SER A 56 9.216 9.657 13.557 1.00 0.00 O ATOM 879 CB SER A 56 9.561 7.919 15.762 1.00 0.00 C ATOM 880 OG SER A 56 9.291 6.977 16.791 1.00 0.00 O ATOM 0 H SER A 56 6.845 8.508 14.713 1.00 0.00 H new ATOM 0 HA SER A 56 8.635 9.598 16.740 1.00 0.00 H new ATOM 0 HB2 SER A 56 9.525 7.423 14.792 1.00 0.00 H new ATOM 0 HB3 SER A 56 10.570 8.313 15.881 1.00 0.00 H new ATOM 0 HG SER A 56 9.948 6.251 16.751 1.00 0.00 H new ATOM 886 N PRO A 57 8.695 11.367 14.926 1.00 0.00 N ATOM 887 CA PRO A 57 9.006 12.415 13.946 1.00 0.00 C ATOM 888 C PRO A 57 10.506 12.517 13.689 1.00 0.00 C ATOM 889 O PRO A 57 10.949 12.710 12.557 1.00 0.00 O ATOM 890 CB PRO A 57 8.491 13.706 14.604 1.00 0.00 C ATOM 891 CG PRO A 57 7.646 13.265 15.753 1.00 0.00 C ATOM 892 CD PRO A 57 8.184 11.930 16.182 1.00 0.00 C ATOM 0 HA PRO A 57 8.549 12.214 12.977 1.00 0.00 H new ATOM 0 HB2 PRO A 57 9.318 14.329 14.943 1.00 0.00 H new ATOM 0 HB3 PRO A 57 7.912 14.301 13.898 1.00 0.00 H new ATOM 0 HG2 PRO A 57 7.694 13.985 16.570 1.00 0.00 H new ATOM 0 HG3 PRO A 57 6.599 13.186 15.459 1.00 0.00 H new ATOM 0 HD2 PRO A 57 8.971 12.032 16.929 1.00 0.00 H new ATOM 0 HD3 PRO A 57 7.408 11.303 16.620 1.00 0.00 H new ATOM 900 N PHE A 58 11.285 12.389 14.755 1.00 0.00 N ATOM 901 CA PHE A 58 12.737 12.412 14.656 1.00 0.00 C ATOM 902 C PHE A 58 13.328 11.177 15.314 1.00 0.00 C ATOM 903 O PHE A 58 12.779 10.660 16.292 1.00 0.00 O ATOM 904 CB PHE A 58 13.309 13.679 15.296 1.00 0.00 C ATOM 905 CG PHE A 58 13.089 14.920 14.477 1.00 0.00 C ATOM 906 CD1 PHE A 58 13.943 15.229 13.429 1.00 0.00 C ATOM 907 CD2 PHE A 58 12.034 15.777 14.752 1.00 0.00 C ATOM 908 CE1 PHE A 58 13.749 16.368 12.672 1.00 0.00 C ATOM 909 CE2 PHE A 58 11.836 16.918 13.998 1.00 0.00 C ATOM 910 CZ PHE A 58 12.694 17.215 12.958 1.00 0.00 C ATOM 0 H PHE A 58 10.932 12.267 15.704 1.00 0.00 H new ATOM 0 HA PHE A 58 13.007 12.413 13.600 1.00 0.00 H new ATOM 0 HB2 PHE A 58 12.855 13.817 16.278 1.00 0.00 H new ATOM 0 HB3 PHE A 58 14.379 13.544 15.455 1.00 0.00 H new ATOM 0 HD1 PHE A 58 14.769 14.572 13.202 1.00 0.00 H new ATOM 0 HD2 PHE A 58 11.360 15.550 15.564 1.00 0.00 H new ATOM 0 HE1 PHE A 58 14.421 16.597 11.858 1.00 0.00 H new ATOM 0 HE2 PHE A 58 11.010 17.577 14.222 1.00 0.00 H new ATOM 0 HZ PHE A 58 12.542 18.107 12.369 1.00 0.00 H new ATOM 920 N GLY A 59 14.444 10.714 14.777 1.00 0.00 N ATOM 921 CA GLY A 59 15.063 9.502 15.265 1.00 0.00 C ATOM 922 C GLY A 59 15.298 8.517 14.142 1.00 0.00 C ATOM 923 O GLY A 59 16.228 8.689 13.352 1.00 0.00 O ATOM 0 H GLY A 59 14.937 11.161 14.004 1.00 0.00 H new ATOM 0 HA2 GLY A 59 16.011 9.743 15.745 1.00 0.00 H new ATOM 0 HA3 GLY A 59 14.428 9.047 16.025 1.00 0.00 H new ATOM 927 N PRO A 60 14.462 7.477 14.037 1.00 0.00 N ATOM 928 CA PRO A 60 14.545 6.505 12.954 1.00 0.00 C ATOM 929 C PRO A 60 13.945 7.058 11.664 1.00 0.00 C ATOM 930 O PRO A 60 12.725 7.049 11.488 1.00 0.00 O ATOM 931 CB PRO A 60 13.717 5.308 13.462 1.00 0.00 C ATOM 932 CG PRO A 60 13.280 5.662 14.850 1.00 0.00 C ATOM 933 CD PRO A 60 13.374 7.157 14.962 1.00 0.00 C ATOM 0 HA PRO A 60 15.576 6.241 12.717 1.00 0.00 H new ATOM 0 HB2 PRO A 60 12.857 5.128 12.817 1.00 0.00 H new ATOM 0 HB3 PRO A 60 14.312 4.395 13.462 1.00 0.00 H new ATOM 0 HG2 PRO A 60 12.260 5.323 15.033 1.00 0.00 H new ATOM 0 HG3 PRO A 60 13.915 5.177 15.592 1.00 0.00 H new ATOM 0 HD2 PRO A 60 12.442 7.645 14.676 1.00 0.00 H new ATOM 0 HD3 PRO A 60 13.601 7.474 15.980 1.00 0.00 H new ATOM 941 N SER A 61 14.808 7.562 10.783 1.00 0.00 N ATOM 942 CA SER A 61 14.382 8.075 9.485 1.00 0.00 C ATOM 943 C SER A 61 13.754 6.953 8.667 1.00 0.00 C ATOM 944 O SER A 61 14.438 6.013 8.259 1.00 0.00 O ATOM 945 CB SER A 61 15.579 8.675 8.747 1.00 0.00 C ATOM 946 OG SER A 61 16.677 7.772 8.739 1.00 0.00 O ATOM 0 H SER A 61 15.813 7.625 10.948 1.00 0.00 H new ATOM 0 HA SER A 61 13.637 8.857 9.631 1.00 0.00 H new ATOM 0 HB2 SER A 61 15.295 8.917 7.723 1.00 0.00 H new ATOM 0 HB3 SER A 61 15.875 9.609 9.225 1.00 0.00 H new ATOM 0 HG SER A 61 16.716 7.312 7.875 1.00 0.00 H new ATOM 952 N PRO A 62 12.436 7.016 8.448 1.00 0.00 N ATOM 953 CA PRO A 62 11.699 5.935 7.834 1.00 0.00 C ATOM 954 C PRO A 62 11.460 6.105 6.342 1.00 0.00 C ATOM 955 O PRO A 62 12.348 5.919 5.510 1.00 0.00 O ATOM 956 CB PRO A 62 10.370 6.027 8.570 1.00 0.00 C ATOM 957 CG PRO A 62 10.159 7.503 8.758 1.00 0.00 C ATOM 958 CD PRO A 62 11.539 8.133 8.807 1.00 0.00 C ATOM 0 HA PRO A 62 12.234 4.988 7.909 1.00 0.00 H new ATOM 0 HB2 PRO A 62 9.562 5.579 7.992 1.00 0.00 H new ATOM 0 HB3 PRO A 62 10.406 5.504 9.526 1.00 0.00 H new ATOM 0 HG2 PRO A 62 9.572 7.918 7.939 1.00 0.00 H new ATOM 0 HG3 PRO A 62 9.609 7.702 9.678 1.00 0.00 H new ATOM 0 HD2 PRO A 62 11.628 8.962 8.105 1.00 0.00 H new ATOM 0 HD3 PRO A 62 11.766 8.529 9.797 1.00 0.00 H new ATOM 966 N CYS A 63 10.239 6.488 6.042 1.00 0.00 N ATOM 967 CA CYS A 63 9.720 6.506 4.713 1.00 0.00 C ATOM 968 C CYS A 63 9.326 7.917 4.305 1.00 0.00 C ATOM 969 O CYS A 63 9.121 8.781 5.159 1.00 0.00 O ATOM 970 CB CYS A 63 8.531 5.560 4.703 1.00 0.00 C ATOM 971 SG CYS A 63 7.620 5.525 6.258 1.00 0.00 S ATOM 0 H CYS A 63 9.569 6.803 6.744 1.00 0.00 H new ATOM 0 HA CYS A 63 10.468 6.183 3.989 1.00 0.00 H new ATOM 0 HB2 CYS A 63 7.853 5.852 3.901 1.00 0.00 H new ATOM 0 HB3 CYS A 63 8.881 4.553 4.474 1.00 0.00 H new ATOM 0 HG CYS A 63 6.542 6.242 6.145 1.00 0.00 H new ATOM 977 N LYS A 64 9.224 8.140 3.005 1.00 0.00 N ATOM 978 CA LYS A 64 8.929 9.453 2.467 1.00 0.00 C ATOM 979 C LYS A 64 7.954 9.300 1.329 1.00 0.00 C ATOM 980 O LYS A 64 8.057 8.354 0.547 1.00 0.00 O ATOM 981 CB LYS A 64 10.203 10.136 1.951 1.00 0.00 C ATOM 982 CG LYS A 64 10.890 9.399 0.809 1.00 0.00 C ATOM 983 CD LYS A 64 11.903 10.282 0.091 1.00 0.00 C ATOM 984 CE LYS A 64 11.257 11.166 -0.979 1.00 0.00 C ATOM 985 NZ LYS A 64 10.299 12.160 -0.420 1.00 0.00 N ATOM 0 H LYS A 64 9.343 7.416 2.296 1.00 0.00 H new ATOM 0 HA LYS A 64 8.505 10.071 3.258 1.00 0.00 H new ATOM 0 HB2 LYS A 64 9.952 11.143 1.619 1.00 0.00 H new ATOM 0 HB3 LYS A 64 10.907 10.238 2.777 1.00 0.00 H new ATOM 0 HG2 LYS A 64 11.392 8.513 1.198 1.00 0.00 H new ATOM 0 HG3 LYS A 64 10.141 9.053 0.097 1.00 0.00 H new ATOM 0 HD2 LYS A 64 12.411 10.913 0.820 1.00 0.00 H new ATOM 0 HD3 LYS A 64 12.664 9.654 -0.372 1.00 0.00 H new ATOM 0 HE2 LYS A 64 12.039 11.693 -1.526 1.00 0.00 H new ATOM 0 HE3 LYS A 64 10.736 10.533 -1.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 10.208 12.962 -1.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 9.370 11.712 -0.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 10.649 12.502 0.498 1.00 0.00 H new ATOM 999 N VAL A 65 6.994 10.193 1.226 1.00 0.00 N ATOM 1000 CA VAL A 65 6.114 10.135 0.095 1.00 0.00 C ATOM 1001 C VAL A 65 6.799 10.763 -1.096 1.00 0.00 C ATOM 1002 O VAL A 65 7.435 11.809 -0.982 1.00 0.00 O ATOM 1003 CB VAL A 65 4.762 10.794 0.385 1.00 0.00 C ATOM 1004 CG1 VAL A 65 3.935 10.943 -0.873 1.00 0.00 C ATOM 1005 CG2 VAL A 65 3.994 9.970 1.410 1.00 0.00 C ATOM 0 H VAL A 65 6.811 10.943 1.892 1.00 0.00 H new ATOM 0 HA VAL A 65 5.897 9.090 -0.128 1.00 0.00 H new ATOM 0 HB VAL A 65 4.954 11.791 0.782 1.00 0.00 H new ATOM 0 HG11 VAL A 65 2.983 11.414 -0.629 1.00 0.00 H new ATOM 0 HG12 VAL A 65 4.473 11.562 -1.591 1.00 0.00 H new ATOM 0 HG13 VAL A 65 3.753 9.960 -1.307 1.00 0.00 H new ATOM 0 HG21 VAL A 65 3.033 10.444 1.612 1.00 0.00 H new ATOM 0 HG22 VAL A 65 3.828 8.966 1.019 1.00 0.00 H new ATOM 0 HG23 VAL A 65 4.570 9.909 2.333 1.00 0.00 H new ATOM 1015 N LEU A 66 6.740 10.049 -2.199 1.00 0.00 N ATOM 1016 CA LEU A 66 7.279 10.502 -3.458 1.00 0.00 C ATOM 1017 C LEU A 66 6.333 11.499 -4.081 1.00 0.00 C ATOM 1018 O LEU A 66 6.745 12.539 -4.594 1.00 0.00 O ATOM 1019 CB LEU A 66 7.475 9.305 -4.391 1.00 0.00 C ATOM 1020 CG LEU A 66 8.875 8.696 -4.373 1.00 0.00 C ATOM 1021 CD1 LEU A 66 9.902 9.701 -4.870 1.00 0.00 C ATOM 1022 CD2 LEU A 66 9.219 8.227 -2.970 1.00 0.00 C ATOM 0 H LEU A 66 6.310 9.125 -2.245 1.00 0.00 H new ATOM 0 HA LEU A 66 8.243 10.983 -3.293 1.00 0.00 H new ATOM 0 HB2 LEU A 66 6.755 8.532 -4.122 1.00 0.00 H new ATOM 0 HB3 LEU A 66 7.243 9.616 -5.410 1.00 0.00 H new ATOM 0 HG LEU A 66 8.892 7.836 -5.043 1.00 0.00 H new ATOM 0 HD11 LEU A 66 10.893 9.248 -4.850 1.00 0.00 H new ATOM 0 HD12 LEU A 66 9.658 9.996 -5.891 1.00 0.00 H new ATOM 0 HD13 LEU A 66 9.891 10.581 -4.226 1.00 0.00 H new ATOM 0 HD21 LEU A 66 10.219 7.794 -2.966 1.00 0.00 H new ATOM 0 HD22 LEU A 66 9.188 9.074 -2.285 1.00 0.00 H new ATOM 0 HD23 LEU A 66 8.497 7.476 -2.650 1.00 0.00 H new ATOM 1034 N ALA A 67 5.061 11.150 -4.046 1.00 0.00 N ATOM 1035 CA ALA A 67 4.016 12.000 -4.556 1.00 0.00 C ATOM 1036 C ALA A 67 2.704 11.632 -3.907 1.00 0.00 C ATOM 1037 O ALA A 67 2.389 10.454 -3.773 1.00 0.00 O ATOM 1038 CB ALA A 67 3.914 11.874 -6.057 1.00 0.00 C ATOM 0 H ALA A 67 4.728 10.266 -3.661 1.00 0.00 H new ATOM 0 HA ALA A 67 4.255 13.037 -4.319 1.00 0.00 H new ATOM 0 HB1 ALA A 67 3.119 12.524 -6.423 1.00 0.00 H new ATOM 0 HB2 ALA A 67 4.860 12.167 -6.512 1.00 0.00 H new ATOM 0 HB3 ALA A 67 3.689 10.841 -6.321 1.00 0.00 H new ATOM 1044 N VAL A 68 1.938 12.612 -3.494 1.00 0.00 N ATOM 1045 CA VAL A 68 0.621 12.312 -2.978 1.00 0.00 C ATOM 1046 C VAL A 68 -0.430 13.193 -3.630 1.00 0.00 C ATOM 1047 O VAL A 68 -0.302 14.419 -3.708 1.00 0.00 O ATOM 1048 CB VAL A 68 0.508 12.326 -1.426 1.00 0.00 C ATOM 1049 CG1 VAL A 68 0.107 13.690 -0.874 1.00 0.00 C ATOM 1050 CG2 VAL A 68 -0.469 11.242 -0.987 1.00 0.00 C ATOM 0 H VAL A 68 2.192 13.600 -3.503 1.00 0.00 H new ATOM 0 HA VAL A 68 0.431 11.275 -3.253 1.00 0.00 H new ATOM 0 HB VAL A 68 1.496 12.119 -1.013 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.044 13.638 0.213 1.00 0.00 H new ATOM 0 HG12 VAL A 68 0.853 14.432 -1.160 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.863 13.976 -1.280 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -0.553 11.246 0.100 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -1.447 11.434 -1.427 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -0.106 10.269 -1.319 1.00 0.00 H new ATOM 1060 N GLN A 69 -1.440 12.527 -4.148 1.00 0.00 N ATOM 1061 CA GLN A 69 -2.494 13.142 -4.916 1.00 0.00 C ATOM 1062 C GLN A 69 -3.828 12.620 -4.452 1.00 0.00 C ATOM 1063 O GLN A 69 -3.994 11.401 -4.297 1.00 0.00 O ATOM 1064 CB GLN A 69 -2.306 12.789 -6.377 1.00 0.00 C ATOM 1065 CG GLN A 69 -1.219 13.580 -7.079 1.00 0.00 C ATOM 1066 CD GLN A 69 -1.096 13.219 -8.548 1.00 0.00 C ATOM 1067 OE1 GLN A 69 -0.014 13.298 -9.129 1.00 0.00 O ATOM 1068 NE2 GLN A 69 -2.202 12.818 -9.160 1.00 0.00 N ATOM 0 H GLN A 69 -1.551 11.519 -4.042 1.00 0.00 H new ATOM 0 HA GLN A 69 -2.461 14.223 -4.783 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -2.073 11.727 -6.454 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -3.249 12.947 -6.900 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -1.431 14.645 -6.986 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -0.265 13.401 -6.583 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -3.080 12.766 -8.644 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -2.174 12.562 -10.147 1.00 0.00 H new ATOM 1077 N ALA A 70 -4.802 13.517 -4.341 1.00 0.00 N ATOM 1078 CA ALA A 70 -6.043 13.194 -3.671 1.00 0.00 C ATOM 1079 C ALA A 70 -6.764 12.138 -4.460 1.00 0.00 C ATOM 1080 O ALA A 70 -7.031 12.330 -5.646 1.00 0.00 O ATOM 1081 CB ALA A 70 -6.934 14.415 -3.515 1.00 0.00 C ATOM 0 H ALA A 70 -4.751 14.468 -4.707 1.00 0.00 H new ATOM 0 HA ALA A 70 -5.808 12.828 -2.671 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -7.856 14.130 -3.007 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -6.415 15.172 -2.927 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -7.172 14.820 -4.499 1.00 0.00 H new ATOM 1087 N PRO A 71 -7.148 11.056 -3.765 1.00 0.00 N ATOM 1088 CA PRO A 71 -7.464 9.759 -4.311 1.00 0.00 C ATOM 1089 C PRO A 71 -7.377 9.645 -5.823 1.00 0.00 C ATOM 1090 O PRO A 71 -8.360 9.388 -6.517 1.00 0.00 O ATOM 1091 CB PRO A 71 -8.846 9.604 -3.734 1.00 0.00 C ATOM 1092 CG PRO A 71 -8.621 10.021 -2.312 1.00 0.00 C ATOM 1093 CD PRO A 71 -7.474 11.024 -2.340 1.00 0.00 C ATOM 0 HA PRO A 71 -6.760 8.967 -4.054 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -9.575 10.239 -4.238 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -9.210 8.579 -3.809 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -9.521 10.470 -1.891 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -8.372 9.162 -1.689 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -7.776 12.002 -1.966 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -6.629 10.698 -1.733 1.00 0.00 H new ATOM 1101 N THR A 72 -6.159 9.857 -6.300 1.00 0.00 N ATOM 1102 CA THR A 72 -5.786 9.598 -7.667 1.00 0.00 C ATOM 1103 C THR A 72 -4.467 8.847 -7.696 1.00 0.00 C ATOM 1104 O THR A 72 -4.374 7.777 -8.286 1.00 0.00 O ATOM 1105 CB THR A 72 -5.654 10.902 -8.465 1.00 0.00 C ATOM 1106 OG1 THR A 72 -5.050 11.910 -7.648 1.00 0.00 O ATOM 1107 CG2 THR A 72 -7.011 11.374 -8.938 1.00 0.00 C ATOM 0 H THR A 72 -5.395 10.220 -5.731 1.00 0.00 H new ATOM 0 HA THR A 72 -6.569 8.996 -8.128 1.00 0.00 H new ATOM 0 HB THR A 72 -5.026 10.716 -9.336 1.00 0.00 H new ATOM 0 HG1 THR A 72 -5.685 12.197 -6.959 1.00 0.00 H new ATOM 0 HG21 THR A 72 -6.898 12.300 -9.502 1.00 0.00 H new ATOM 0 HG22 THR A 72 -7.459 10.613 -9.576 1.00 0.00 H new ATOM 0 HG23 THR A 72 -7.655 11.550 -8.077 1.00 0.00 H new ATOM 1115 N GLU A 73 -3.459 9.390 -7.012 1.00 0.00 N ATOM 1116 CA GLU A 73 -2.136 8.774 -6.998 1.00 0.00 C ATOM 1117 C GLU A 73 -1.499 8.929 -5.633 1.00 0.00 C ATOM 1118 O GLU A 73 -1.511 10.002 -5.038 1.00 0.00 O ATOM 1119 CB GLU A 73 -1.225 9.395 -8.062 1.00 0.00 C ATOM 1120 CG GLU A 73 0.104 8.668 -8.202 1.00 0.00 C ATOM 1121 CD GLU A 73 1.014 9.284 -9.239 1.00 0.00 C ATOM 1122 OE1 GLU A 73 0.720 9.156 -10.446 1.00 0.00 O ATOM 1123 OE2 GLU A 73 2.034 9.888 -8.854 1.00 0.00 O ATOM 0 H GLU A 73 -3.534 10.248 -6.465 1.00 0.00 H new ATOM 0 HA GLU A 73 -2.260 7.715 -7.223 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -1.740 9.388 -9.023 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -1.038 10.438 -7.808 1.00 0.00 H new ATOM 0 HG2 GLU A 73 0.612 8.665 -7.238 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -0.085 7.627 -8.466 1.00 0.00 H new ATOM 1130 N LEU A 74 -0.963 7.848 -5.137 1.00 0.00 N ATOM 1131 CA LEU A 74 -0.215 7.865 -3.915 1.00 0.00 C ATOM 1132 C LEU A 74 1.095 7.178 -4.178 1.00 0.00 C ATOM 1133 O LEU A 74 1.107 6.071 -4.656 1.00 0.00 O ATOM 1134 CB LEU A 74 -1.029 7.110 -2.867 1.00 0.00 C ATOM 1135 CG LEU A 74 -0.484 7.051 -1.465 1.00 0.00 C ATOM 1136 CD1 LEU A 74 -1.621 6.759 -0.525 1.00 0.00 C ATOM 1137 CD2 LEU A 74 0.577 5.994 -1.319 1.00 0.00 C ATOM 0 H LEU A 74 -1.034 6.928 -5.572 1.00 0.00 H new ATOM 0 HA LEU A 74 -0.023 8.876 -3.557 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -2.020 7.562 -2.823 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -1.161 6.087 -3.219 1.00 0.00 H new ATOM 0 HG LEU A 74 -0.022 8.010 -1.231 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.245 6.712 0.497 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -2.368 7.549 -0.601 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -2.075 5.804 -0.789 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.943 5.985 -0.292 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.155 5.019 -1.562 1.00 0.00 H new ATOM 0 HD23 LEU A 74 1.403 6.211 -1.997 1.00 0.00 H new ATOM 1149 N SER A 75 2.188 7.821 -3.888 1.00 0.00 N ATOM 1150 CA SER A 75 3.479 7.174 -4.052 1.00 0.00 C ATOM 1151 C SER A 75 4.364 7.494 -2.887 1.00 0.00 C ATOM 1152 O SER A 75 4.569 8.653 -2.570 1.00 0.00 O ATOM 1153 CB SER A 75 4.160 7.636 -5.330 1.00 0.00 C ATOM 1154 OG SER A 75 3.395 7.311 -6.477 1.00 0.00 O ATOM 0 H SER A 75 2.224 8.779 -3.541 1.00 0.00 H new ATOM 0 HA SER A 75 3.311 6.099 -4.108 1.00 0.00 H new ATOM 0 HB2 SER A 75 4.316 8.714 -5.290 1.00 0.00 H new ATOM 0 HB3 SER A 75 5.144 7.174 -5.406 1.00 0.00 H new ATOM 0 HG SER A 75 3.861 7.624 -7.280 1.00 0.00 H new ATOM 1160 N PHE A 76 4.892 6.483 -2.259 1.00 0.00 N ATOM 1161 CA PHE A 76 5.787 6.685 -1.154 1.00 0.00 C ATOM 1162 C PHE A 76 6.768 5.537 -1.056 1.00 0.00 C ATOM 1163 O PHE A 76 6.488 4.444 -1.537 1.00 0.00 O ATOM 1164 CB PHE A 76 4.989 6.987 0.121 1.00 0.00 C ATOM 1165 CG PHE A 76 4.390 5.821 0.862 1.00 0.00 C ATOM 1166 CD1 PHE A 76 3.225 5.205 0.419 1.00 0.00 C ATOM 1167 CD2 PHE A 76 4.985 5.362 2.025 1.00 0.00 C ATOM 1168 CE1 PHE A 76 2.676 4.148 1.128 1.00 0.00 C ATOM 1169 CE2 PHE A 76 4.440 4.309 2.735 1.00 0.00 C ATOM 1170 CZ PHE A 76 3.288 3.699 2.284 1.00 0.00 C ATOM 0 H PHE A 76 4.718 5.506 -2.494 1.00 0.00 H new ATOM 0 HA PHE A 76 6.408 7.566 -1.313 1.00 0.00 H new ATOM 0 HB2 PHE A 76 5.645 7.521 0.809 1.00 0.00 H new ATOM 0 HB3 PHE A 76 4.180 7.669 -0.143 1.00 0.00 H new ATOM 0 HD1 PHE A 76 2.745 5.552 -0.484 1.00 0.00 H new ATOM 0 HD2 PHE A 76 5.888 5.834 2.383 1.00 0.00 H new ATOM 0 HE1 PHE A 76 1.770 3.675 0.778 1.00 0.00 H new ATOM 0 HE2 PHE A 76 4.915 3.964 3.641 1.00 0.00 H new ATOM 0 HZ PHE A 76 2.864 2.871 2.833 1.00 0.00 H new ATOM 1180 N GLU A 77 7.912 5.779 -0.459 1.00 0.00 N ATOM 1181 CA GLU A 77 8.919 4.736 -0.354 1.00 0.00 C ATOM 1182 C GLU A 77 9.164 4.447 1.102 1.00 0.00 C ATOM 1183 O GLU A 77 9.377 5.361 1.897 1.00 0.00 O ATOM 1184 CB GLU A 77 10.251 5.147 -0.994 1.00 0.00 C ATOM 1185 CG GLU A 77 10.259 5.164 -2.513 1.00 0.00 C ATOM 1186 CD GLU A 77 11.629 5.480 -3.077 1.00 0.00 C ATOM 1187 OE1 GLU A 77 11.972 6.674 -3.201 1.00 0.00 O ATOM 1188 OE2 GLU A 77 12.382 4.535 -3.393 1.00 0.00 O ATOM 0 H GLU A 77 8.171 6.673 -0.043 1.00 0.00 H new ATOM 0 HA GLU A 77 8.545 3.859 -0.883 1.00 0.00 H new ATOM 0 HB2 GLU A 77 10.518 6.141 -0.634 1.00 0.00 H new ATOM 0 HB3 GLU A 77 11.028 4.464 -0.650 1.00 0.00 H new ATOM 0 HG2 GLU A 77 9.929 4.195 -2.887 1.00 0.00 H new ATOM 0 HG3 GLU A 77 9.542 5.904 -2.870 1.00 0.00 H new ATOM 1195 N TRP A 78 9.138 3.159 1.437 1.00 0.00 N ATOM 1196 CA TRP A 78 8.967 2.759 2.824 1.00 0.00 C ATOM 1197 C TRP A 78 10.236 2.195 3.464 1.00 0.00 C ATOM 1198 O TRP A 78 10.825 1.236 2.971 1.00 0.00 O ATOM 1199 CB TRP A 78 7.827 1.748 2.968 1.00 0.00 C ATOM 1200 CG TRP A 78 7.280 1.723 4.364 1.00 0.00 C ATOM 1201 CD1 TRP A 78 6.448 2.648 4.923 1.00 0.00 C ATOM 1202 CD2 TRP A 78 7.532 0.746 5.380 1.00 0.00 C ATOM 1203 NE1 TRP A 78 6.179 2.319 6.224 1.00 0.00 N ATOM 1204 CE2 TRP A 78 6.828 1.152 6.529 1.00 0.00 C ATOM 1205 CE3 TRP A 78 8.285 -0.428 5.433 1.00 0.00 C ATOM 1206 CZ2 TRP A 78 6.854 0.426 7.715 1.00 0.00 C ATOM 1207 CZ3 TRP A 78 8.309 -1.150 6.611 1.00 0.00 C ATOM 1208 CH2 TRP A 78 7.599 -0.720 7.738 1.00 0.00 C ATOM 0 H TRP A 78 9.232 2.388 0.776 1.00 0.00 H new ATOM 0 HA TRP A 78 8.721 3.675 3.360 1.00 0.00 H new ATOM 0 HB2 TRP A 78 7.029 1.998 2.269 1.00 0.00 H new ATOM 0 HB3 TRP A 78 8.186 0.754 2.700 1.00 0.00 H new ATOM 0 HD1 TRP A 78 6.057 3.516 4.412 1.00 0.00 H new ATOM 0 HE1 TRP A 78 5.591 2.855 6.862 1.00 0.00 H new ATOM 0 HE3 TRP A 78 8.839 -0.766 4.569 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 6.306 0.755 8.585 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 8.886 -2.062 6.663 1.00 0.00 H new ATOM 0 HH2 TRP A 78 7.641 -1.306 8.644 1.00 0.00 H new ATOM 1219 N ASP A 79 10.610 2.821 4.583 1.00 0.00 N ATOM 1220 CA ASP A 79 11.693 2.372 5.482 1.00 0.00 C ATOM 1221 C ASP A 79 12.961 1.919 4.756 1.00 0.00 C ATOM 1222 O ASP A 79 13.478 2.606 3.869 1.00 0.00 O ATOM 1223 CB ASP A 79 11.207 1.243 6.409 1.00 0.00 C ATOM 1224 CG ASP A 79 11.713 1.402 7.838 1.00 0.00 C ATOM 1225 OD1 ASP A 79 12.944 1.446 8.040 1.00 0.00 O ATOM 1226 OD2 ASP A 79 10.877 1.472 8.771 1.00 0.00 O ATOM 0 H ASP A 79 10.160 3.678 4.903 1.00 0.00 H new ATOM 0 HA ASP A 79 11.960 3.253 6.066 1.00 0.00 H new ATOM 0 HB2 ASP A 79 10.117 1.224 6.413 1.00 0.00 H new ATOM 0 HB3 ASP A 79 11.541 0.284 6.014 1.00 0.00 H new ATOM 1231 N THR A 80 13.450 0.755 5.168 1.00 0.00 N ATOM 1232 CA THR A 80 14.739 0.234 4.747 1.00 0.00 C ATOM 1233 C THR A 80 14.692 -0.337 3.342 1.00 0.00 C ATOM 1234 O THR A 80 15.686 -0.318 2.618 1.00 0.00 O ATOM 1235 CB THR A 80 15.213 -0.857 5.730 1.00 0.00 C ATOM 1236 OG1 THR A 80 16.474 -1.402 5.314 1.00 0.00 O ATOM 1237 CG2 THR A 80 14.167 -1.966 5.841 1.00 0.00 C ATOM 0 H THR A 80 12.953 0.140 5.813 1.00 0.00 H new ATOM 0 HA THR A 80 15.442 1.067 4.746 1.00 0.00 H new ATOM 0 HB THR A 80 15.343 -0.400 6.711 1.00 0.00 H new ATOM 0 HG1 THR A 80 17.066 -0.675 5.028 1.00 0.00 H new ATOM 0 HG21 THR A 80 14.517 -2.728 6.538 1.00 0.00 H new ATOM 0 HG22 THR A 80 13.229 -1.546 6.203 1.00 0.00 H new ATOM 0 HG23 THR A 80 14.009 -2.416 4.861 1.00 0.00 H new ATOM 1245 N GLU A 81 13.540 -0.839 2.970 1.00 0.00 N ATOM 1246 CA GLU A 81 13.360 -1.448 1.670 1.00 0.00 C ATOM 1247 C GLU A 81 13.127 -0.355 0.638 1.00 0.00 C ATOM 1248 O GLU A 81 12.557 0.685 0.949 1.00 0.00 O ATOM 1249 CB GLU A 81 12.200 -2.432 1.721 1.00 0.00 C ATOM 1250 CG GLU A 81 12.360 -3.440 2.842 1.00 0.00 C ATOM 1251 CD GLU A 81 11.495 -3.156 4.055 1.00 0.00 C ATOM 1252 OE1 GLU A 81 11.413 -1.990 4.482 1.00 0.00 O ATOM 1253 OE2 GLU A 81 10.910 -4.118 4.594 1.00 0.00 O ATOM 0 H GLU A 81 12.704 -0.838 3.554 1.00 0.00 H new ATOM 0 HA GLU A 81 14.253 -2.004 1.384 1.00 0.00 H new ATOM 0 HB2 GLU A 81 11.267 -1.885 1.855 1.00 0.00 H new ATOM 0 HB3 GLU A 81 12.128 -2.957 0.769 1.00 0.00 H new ATOM 0 HG2 GLU A 81 12.119 -4.433 2.461 1.00 0.00 H new ATOM 0 HG3 GLU A 81 13.405 -3.462 3.151 1.00 0.00 H new ATOM 1260 N GLY A 82 13.568 -0.583 -0.583 1.00 0.00 N ATOM 1261 CA GLY A 82 13.509 0.455 -1.587 1.00 0.00 C ATOM 1262 C GLY A 82 12.182 0.477 -2.305 1.00 0.00 C ATOM 1263 O GLY A 82 12.134 0.701 -3.513 1.00 0.00 O ATOM 0 H GLY A 82 13.966 -1.467 -0.899 1.00 0.00 H new ATOM 0 HA2 GLY A 82 13.682 1.423 -1.117 1.00 0.00 H new ATOM 0 HA3 GLY A 82 14.310 0.304 -2.311 1.00 0.00 H new ATOM 1267 N TRP A 83 11.101 0.224 -1.570 1.00 0.00 N ATOM 1268 CA TRP A 83 9.780 0.220 -2.181 1.00 0.00 C ATOM 1269 C TRP A 83 9.357 1.610 -2.521 1.00 0.00 C ATOM 1270 O TRP A 83 9.186 2.416 -1.625 1.00 0.00 O ATOM 1271 CB TRP A 83 8.649 -0.238 -1.278 1.00 0.00 C ATOM 1272 CG TRP A 83 8.561 -1.684 -0.916 1.00 0.00 C ATOM 1273 CD1 TRP A 83 8.452 -2.748 -1.757 1.00 0.00 C ATOM 1274 CD2 TRP A 83 8.481 -2.206 0.412 1.00 0.00 C ATOM 1275 NE1 TRP A 83 8.343 -3.911 -1.028 1.00 0.00 N ATOM 1276 CE2 TRP A 83 8.364 -3.599 0.311 1.00 0.00 C ATOM 1277 CE3 TRP A 83 8.517 -1.621 1.678 1.00 0.00 C ATOM 1278 CZ2 TRP A 83 8.278 -4.421 1.438 1.00 0.00 C ATOM 1279 CZ3 TRP A 83 8.428 -2.433 2.789 1.00 0.00 C ATOM 1280 CH2 TRP A 83 8.313 -3.819 2.663 1.00 0.00 C ATOM 0 H TRP A 83 11.114 0.023 -0.570 1.00 0.00 H new ATOM 0 HA TRP A 83 9.910 -0.458 -3.024 1.00 0.00 H new ATOM 0 HB2 TRP A 83 8.715 0.331 -0.351 1.00 0.00 H new ATOM 0 HB3 TRP A 83 7.710 0.041 -1.757 1.00 0.00 H new ATOM 0 HD1 TRP A 83 8.451 -2.689 -2.835 1.00 0.00 H new ATOM 0 HE1 TRP A 83 8.260 -4.850 -1.417 1.00 0.00 H new ATOM 0 HE3 TRP A 83 8.613 -0.551 1.786 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 8.187 -5.493 1.343 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 8.448 -1.989 3.774 1.00 0.00 H new ATOM 0 HH2 TRP A 83 8.250 -4.427 3.553 1.00 0.00 H new ATOM 1291 N VAL A 84 9.137 1.864 -3.779 1.00 0.00 N ATOM 1292 CA VAL A 84 8.281 2.958 -4.157 1.00 0.00 C ATOM 1293 C VAL A 84 6.891 2.372 -4.398 1.00 0.00 C ATOM 1294 O VAL A 84 6.576 1.841 -5.462 1.00 0.00 O ATOM 1295 CB VAL A 84 8.817 3.761 -5.370 1.00 0.00 C ATOM 1296 CG1 VAL A 84 9.009 2.888 -6.603 1.00 0.00 C ATOM 1297 CG2 VAL A 84 7.915 4.958 -5.674 1.00 0.00 C ATOM 0 H VAL A 84 9.533 1.335 -4.556 1.00 0.00 H new ATOM 0 HA VAL A 84 8.245 3.697 -3.357 1.00 0.00 H new ATOM 0 HB VAL A 84 9.803 4.137 -5.095 1.00 0.00 H new ATOM 0 HG11 VAL A 84 9.386 3.497 -7.425 1.00 0.00 H new ATOM 0 HG12 VAL A 84 9.724 2.096 -6.380 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.055 2.445 -6.887 1.00 0.00 H new ATOM 0 HG21 VAL A 84 8.312 5.505 -6.529 1.00 0.00 H new ATOM 0 HG22 VAL A 84 6.909 4.607 -5.904 1.00 0.00 H new ATOM 0 HG23 VAL A 84 7.880 5.617 -4.806 1.00 0.00 H new ATOM 1307 N VAL A 85 6.120 2.347 -3.328 1.00 0.00 N ATOM 1308 CA VAL A 85 4.791 1.795 -3.337 1.00 0.00 C ATOM 1309 C VAL A 85 3.775 2.872 -3.694 1.00 0.00 C ATOM 1310 O VAL A 85 3.742 3.947 -3.088 1.00 0.00 O ATOM 1311 CB VAL A 85 4.461 1.136 -1.975 1.00 0.00 C ATOM 1312 CG1 VAL A 85 5.236 -0.158 -1.820 1.00 0.00 C ATOM 1313 CG2 VAL A 85 4.791 2.059 -0.812 1.00 0.00 C ATOM 0 H VAL A 85 6.408 2.715 -2.421 1.00 0.00 H new ATOM 0 HA VAL A 85 4.740 1.017 -4.099 1.00 0.00 H new ATOM 0 HB VAL A 85 3.390 0.932 -1.961 1.00 0.00 H new ATOM 0 HG11 VAL A 85 4.996 -0.613 -0.859 1.00 0.00 H new ATOM 0 HG12 VAL A 85 4.965 -0.843 -2.623 1.00 0.00 H new ATOM 0 HG13 VAL A 85 6.305 0.050 -1.866 1.00 0.00 H new ATOM 0 HG21 VAL A 85 4.546 1.563 0.127 1.00 0.00 H new ATOM 0 HG22 VAL A 85 5.854 2.300 -0.829 1.00 0.00 H new ATOM 0 HG23 VAL A 85 4.210 2.977 -0.900 1.00 0.00 H new ATOM 1323 N THR A 86 2.960 2.578 -4.690 1.00 0.00 N ATOM 1324 CA THR A 86 2.054 3.555 -5.249 1.00 0.00 C ATOM 1325 C THR A 86 0.613 3.048 -5.268 1.00 0.00 C ATOM 1326 O THR A 86 0.342 1.911 -5.626 1.00 0.00 O ATOM 1327 CB THR A 86 2.487 3.942 -6.683 1.00 0.00 C ATOM 1328 OG1 THR A 86 3.780 4.559 -6.648 1.00 0.00 O ATOM 1329 CG2 THR A 86 1.479 4.901 -7.328 1.00 0.00 C ATOM 0 H THR A 86 2.910 1.659 -5.130 1.00 0.00 H new ATOM 0 HA THR A 86 2.096 4.435 -4.607 1.00 0.00 H new ATOM 0 HB THR A 86 2.526 3.032 -7.282 1.00 0.00 H new ATOM 0 HG1 THR A 86 3.677 5.534 -6.637 1.00 0.00 H new ATOM 0 HG21 THR A 86 1.811 5.155 -8.335 1.00 0.00 H new ATOM 0 HG22 THR A 86 0.501 4.422 -7.378 1.00 0.00 H new ATOM 0 HG23 THR A 86 1.407 5.810 -6.730 1.00 0.00 H new ATOM 1337 N PHE A 87 -0.312 3.898 -4.883 1.00 0.00 N ATOM 1338 CA PHE A 87 -1.714 3.566 -4.959 1.00 0.00 C ATOM 1339 C PHE A 87 -2.354 4.431 -6.038 1.00 0.00 C ATOM 1340 O PHE A 87 -2.161 5.640 -6.063 1.00 0.00 O ATOM 1341 CB PHE A 87 -2.390 3.781 -3.588 1.00 0.00 C ATOM 1342 CG PHE A 87 -1.798 2.928 -2.488 1.00 0.00 C ATOM 1343 CD1 PHE A 87 -1.263 1.681 -2.772 1.00 0.00 C ATOM 1344 CD2 PHE A 87 -1.764 3.376 -1.177 1.00 0.00 C ATOM 1345 CE1 PHE A 87 -0.698 0.901 -1.776 1.00 0.00 C ATOM 1346 CE2 PHE A 87 -1.204 2.600 -0.181 1.00 0.00 C ATOM 1347 CZ PHE A 87 -0.666 1.360 -0.485 1.00 0.00 C ATOM 0 H PHE A 87 -0.116 4.828 -4.513 1.00 0.00 H new ATOM 0 HA PHE A 87 -1.842 2.515 -5.220 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -2.305 4.831 -3.309 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -3.454 3.560 -3.677 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -1.287 1.311 -3.787 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -2.180 4.342 -0.932 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -0.284 -0.067 -2.016 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -1.185 2.961 0.837 1.00 0.00 H new ATOM 0 HZ PHE A 87 -0.223 0.757 0.293 1.00 0.00 H new ATOM 1357 N GLN A 88 -3.098 3.808 -6.932 1.00 0.00 N ATOM 1358 CA GLN A 88 -3.756 4.527 -8.015 1.00 0.00 C ATOM 1359 C GLN A 88 -5.265 4.434 -7.883 1.00 0.00 C ATOM 1360 O GLN A 88 -5.832 3.357 -7.726 1.00 0.00 O ATOM 1361 CB GLN A 88 -3.305 3.983 -9.354 1.00 0.00 C ATOM 1362 CG GLN A 88 -2.130 4.739 -9.925 1.00 0.00 C ATOM 1363 CD GLN A 88 -2.507 6.061 -10.562 1.00 0.00 C ATOM 1364 OE1 GLN A 88 -2.422 7.107 -9.937 1.00 0.00 O ATOM 1365 NE2 GLN A 88 -2.947 6.017 -11.808 1.00 0.00 N ATOM 0 H GLN A 88 -3.264 2.802 -6.932 1.00 0.00 H new ATOM 0 HA GLN A 88 -3.474 5.578 -7.953 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -3.036 2.933 -9.243 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -4.136 4.027 -10.058 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -1.406 4.922 -9.131 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -1.635 4.115 -10.669 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -3.004 5.124 -12.298 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -3.230 6.876 -12.280 1.00 0.00 H new ATOM 1374 N LEU A 89 -5.890 5.580 -7.916 1.00 0.00 N ATOM 1375 CA LEU A 89 -7.309 5.703 -7.639 1.00 0.00 C ATOM 1376 C LEU A 89 -8.090 6.364 -8.777 1.00 0.00 C ATOM 1377 O LEU A 89 -7.580 7.251 -9.462 1.00 0.00 O ATOM 1378 CB LEU A 89 -7.512 6.432 -6.325 1.00 0.00 C ATOM 1379 CG LEU A 89 -8.200 5.612 -5.242 1.00 0.00 C ATOM 1380 CD1 LEU A 89 -8.283 6.414 -3.965 1.00 0.00 C ATOM 1381 CD2 LEU A 89 -9.586 5.179 -5.691 1.00 0.00 C ATOM 0 H LEU A 89 -5.432 6.465 -8.137 1.00 0.00 H new ATOM 0 HA LEU A 89 -7.715 4.695 -7.556 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -6.541 6.759 -5.953 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -8.101 7.330 -6.511 1.00 0.00 H new ATOM 0 HG LEU A 89 -7.611 4.714 -5.058 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -8.776 5.821 -3.195 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -7.278 6.676 -3.634 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -8.855 7.325 -4.144 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -10.058 4.595 -4.901 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -10.192 6.060 -5.902 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -9.503 4.571 -6.592 1.00 0.00 H new ATOM 1393 N GLU A 90 -9.319 5.905 -8.982 1.00 0.00 N ATOM 1394 CA GLU A 90 -10.223 6.503 -9.954 1.00 0.00 C ATOM 1395 C GLU A 90 -11.361 7.188 -9.206 1.00 0.00 C ATOM 1396 O GLU A 90 -12.103 6.530 -8.461 1.00 0.00 O ATOM 1397 CB GLU A 90 -10.754 5.391 -10.882 1.00 0.00 C ATOM 1398 CG GLU A 90 -12.223 5.509 -11.301 1.00 0.00 C ATOM 1399 CD GLU A 90 -12.685 4.309 -12.111 1.00 0.00 C ATOM 1400 OE1 GLU A 90 -12.043 3.996 -13.137 1.00 0.00 O ATOM 1401 OE2 GLU A 90 -13.692 3.678 -11.733 1.00 0.00 O ATOM 0 H GLU A 90 -9.715 5.110 -8.480 1.00 0.00 H new ATOM 0 HA GLU A 90 -9.710 7.248 -10.562 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -10.140 5.373 -11.783 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -10.615 4.432 -10.383 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -12.846 5.607 -10.412 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -12.360 6.417 -11.889 1.00 0.00 H new ATOM 1408 N ASP A 91 -11.492 8.505 -9.415 1.00 0.00 N ATOM 1409 CA ASP A 91 -12.466 9.309 -8.685 1.00 0.00 C ATOM 1410 C ASP A 91 -13.805 9.215 -9.336 1.00 0.00 C ATOM 1411 O ASP A 91 -14.012 9.774 -10.413 1.00 0.00 O ATOM 1412 CB ASP A 91 -12.147 10.808 -8.675 1.00 0.00 C ATOM 1413 CG ASP A 91 -10.722 11.181 -9.035 1.00 0.00 C ATOM 1414 OD1 ASP A 91 -10.253 10.776 -10.121 1.00 0.00 O ATOM 1415 OD2 ASP A 91 -10.091 11.940 -8.272 1.00 0.00 O ATOM 0 H ASP A 91 -10.932 9.031 -10.086 1.00 0.00 H new ATOM 0 HA ASP A 91 -12.442 8.912 -7.670 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.821 11.308 -9.371 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.366 11.200 -7.682 1.00 0.00 H new ATOM 1420 N LEU A 92 -14.707 8.531 -8.699 1.00 0.00 N ATOM 1421 CA LEU A 92 -16.081 8.610 -9.064 1.00 0.00 C ATOM 1422 C LEU A 92 -16.922 8.940 -7.825 1.00 0.00 C ATOM 1423 O LEU A 92 -16.651 8.432 -6.733 1.00 0.00 O ATOM 1424 CB LEU A 92 -16.506 7.280 -9.674 1.00 0.00 C ATOM 1425 CG LEU A 92 -15.777 6.819 -10.946 1.00 0.00 C ATOM 1426 CD1 LEU A 92 -16.462 5.603 -11.543 1.00 0.00 C ATOM 1427 CD2 LEU A 92 -15.706 7.933 -11.980 1.00 0.00 C ATOM 0 H LEU A 92 -14.509 7.907 -7.917 1.00 0.00 H new ATOM 0 HA LEU A 92 -16.233 9.400 -9.799 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -16.382 6.507 -8.916 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -17.571 7.338 -9.899 1.00 0.00 H new ATOM 0 HG LEU A 92 -14.759 6.551 -10.662 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -15.931 5.292 -12.443 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -16.456 4.789 -10.818 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -17.492 5.854 -11.798 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -15.184 7.573 -12.867 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -16.715 8.241 -12.253 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -15.167 8.784 -11.562 1.00 0.00 H new ATOM 1439 N GLY A 93 -17.872 9.864 -7.985 1.00 0.00 N ATOM 1440 CA GLY A 93 -19.009 9.956 -7.056 1.00 0.00 C ATOM 1441 C GLY A 93 -19.787 8.660 -7.142 1.00 0.00 C ATOM 1442 O GLY A 93 -20.506 8.241 -6.233 1.00 0.00 O ATOM 0 H GLY A 93 -17.881 10.552 -8.738 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -18.657 10.123 -6.038 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -19.646 10.801 -7.316 1.00 0.00 H new ATOM 1446 N GLU A 94 -19.612 8.073 -8.307 1.00 0.00 N ATOM 1447 CA GLU A 94 -19.705 6.651 -8.570 1.00 0.00 C ATOM 1448 C GLU A 94 -18.766 5.916 -7.619 1.00 0.00 C ATOM 1449 O GLU A 94 -18.418 6.401 -6.545 1.00 0.00 O ATOM 1450 CB GLU A 94 -19.334 6.324 -10.012 1.00 0.00 C ATOM 1451 CG GLU A 94 -19.902 5.004 -10.505 1.00 0.00 C ATOM 1452 CD GLU A 94 -21.392 4.897 -10.281 1.00 0.00 C ATOM 1453 OE1 GLU A 94 -21.806 4.519 -9.164 1.00 0.00 O ATOM 1454 OE2 GLU A 94 -22.159 5.199 -11.220 1.00 0.00 O ATOM 0 H GLU A 94 -19.388 8.607 -9.146 1.00 0.00 H new ATOM 0 HA GLU A 94 -20.736 6.333 -8.413 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -19.688 7.126 -10.660 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -18.248 6.298 -10.101 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -19.689 4.895 -11.568 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -19.401 4.182 -9.993 1.00 0.00 H new ATOM 1461 N LYS A 95 -18.400 4.726 -7.985 1.00 0.00 N ATOM 1462 CA LYS A 95 -17.621 3.886 -7.144 1.00 0.00 C ATOM 1463 C LYS A 95 -16.186 4.042 -7.608 1.00 0.00 C ATOM 1464 O LYS A 95 -15.928 4.732 -8.582 1.00 0.00 O ATOM 1465 CB LYS A 95 -18.075 2.448 -7.377 1.00 0.00 C ATOM 1466 CG LYS A 95 -18.048 2.051 -8.858 1.00 0.00 C ATOM 1467 CD LYS A 95 -16.755 1.343 -9.245 1.00 0.00 C ATOM 1468 CE LYS A 95 -15.788 2.238 -10.023 1.00 0.00 C ATOM 1469 NZ LYS A 95 -16.072 2.267 -11.479 1.00 0.00 N ATOM 0 H LYS A 95 -18.639 4.311 -8.886 1.00 0.00 H new ATOM 0 HA LYS A 95 -17.722 4.136 -6.088 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -17.432 1.773 -6.812 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -19.086 2.324 -6.990 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -18.895 1.399 -9.072 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -18.169 2.943 -9.473 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -16.261 0.983 -8.342 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -16.994 0.467 -9.848 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -15.842 3.252 -9.627 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -14.768 1.887 -9.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -15.310 2.776 -11.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -16.128 1.294 -11.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -16.977 2.752 -11.647 1.00 0.00 H new ATOM 1483 N THR A 96 -15.252 3.436 -6.941 1.00 0.00 N ATOM 1484 CA THR A 96 -13.889 3.860 -7.066 1.00 0.00 C ATOM 1485 C THR A 96 -13.070 2.808 -7.758 1.00 0.00 C ATOM 1486 O THR A 96 -13.100 1.635 -7.398 1.00 0.00 O ATOM 1487 CB THR A 96 -13.312 4.139 -5.669 1.00 0.00 C ATOM 1488 OG1 THR A 96 -14.192 3.607 -4.679 1.00 0.00 O ATOM 1489 CG2 THR A 96 -13.119 5.630 -5.430 1.00 0.00 C ATOM 0 H THR A 96 -15.405 2.651 -6.308 1.00 0.00 H new ATOM 0 HA THR A 96 -13.855 4.770 -7.664 1.00 0.00 H new ATOM 0 HB THR A 96 -12.336 3.659 -5.603 1.00 0.00 H new ATOM 0 HG1 THR A 96 -14.904 4.254 -4.493 1.00 0.00 H new ATOM 0 HG21 THR A 96 -12.710 5.789 -4.432 1.00 0.00 H new ATOM 0 HG22 THR A 96 -12.430 6.031 -6.173 1.00 0.00 H new ATOM 0 HG23 THR A 96 -14.079 6.139 -5.513 1.00 0.00 H new ATOM 1497 N GLY A 97 -12.338 3.214 -8.763 1.00 0.00 N ATOM 1498 CA GLY A 97 -11.564 2.235 -9.490 1.00 0.00 C ATOM 1499 C GLY A 97 -10.164 2.182 -8.966 1.00 0.00 C ATOM 1500 O GLY A 97 -9.421 3.154 -9.055 1.00 0.00 O ATOM 0 H GLY A 97 -12.260 4.177 -9.090 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -12.030 1.254 -9.400 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -11.553 2.486 -10.551 1.00 0.00 H new ATOM 1504 N PHE A 98 -9.796 1.056 -8.394 1.00 0.00 N ATOM 1505 CA PHE A 98 -8.535 0.991 -7.702 1.00 0.00 C ATOM 1506 C PHE A 98 -7.485 0.222 -8.477 1.00 0.00 C ATOM 1507 O PHE A 98 -7.718 -0.887 -8.963 1.00 0.00 O ATOM 1508 CB PHE A 98 -8.649 0.381 -6.313 1.00 0.00 C ATOM 1509 CG PHE A 98 -7.499 0.826 -5.457 1.00 0.00 C ATOM 1510 CD1 PHE A 98 -7.459 2.125 -4.972 1.00 0.00 C ATOM 1511 CD2 PHE A 98 -6.446 -0.021 -5.172 1.00 0.00 C ATOM 1512 CE1 PHE A 98 -6.394 2.567 -4.216 1.00 0.00 C ATOM 1513 CE2 PHE A 98 -5.380 0.414 -4.412 1.00 0.00 C ATOM 1514 CZ PHE A 98 -5.351 1.709 -3.935 1.00 0.00 C ATOM 0 H PHE A 98 -10.340 0.193 -8.395 1.00 0.00 H new ATOM 0 HA PHE A 98 -8.225 2.032 -7.607 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -9.591 0.679 -5.853 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -8.659 -0.707 -6.385 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -8.274 2.800 -5.190 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -6.457 -1.033 -5.548 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -6.376 3.581 -3.845 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -4.566 -0.260 -4.190 1.00 0.00 H new ATOM 0 HZ PHE A 98 -4.514 2.050 -3.343 1.00 0.00 H new ATOM 1524 N THR A 99 -6.337 0.838 -8.581 1.00 0.00 N ATOM 1525 CA THR A 99 -5.154 0.193 -9.099 1.00 0.00 C ATOM 1526 C THR A 99 -4.068 0.259 -8.046 1.00 0.00 C ATOM 1527 O THR A 99 -3.709 1.332 -7.587 1.00 0.00 O ATOM 1528 CB THR A 99 -4.664 0.857 -10.397 1.00 0.00 C ATOM 1529 OG1 THR A 99 -5.745 0.952 -11.331 1.00 0.00 O ATOM 1530 CG2 THR A 99 -3.518 0.068 -11.019 1.00 0.00 C ATOM 0 H THR A 99 -6.193 1.810 -8.307 1.00 0.00 H new ATOM 0 HA THR A 99 -5.397 -0.843 -9.335 1.00 0.00 H new ATOM 0 HB THR A 99 -4.300 1.855 -10.152 1.00 0.00 H new ATOM 0 HG1 THR A 99 -5.429 1.377 -12.155 1.00 0.00 H new ATOM 0 HG21 THR A 99 -3.192 0.561 -11.935 1.00 0.00 H new ATOM 0 HG22 THR A 99 -2.686 0.020 -10.317 1.00 0.00 H new ATOM 0 HG23 THR A 99 -3.855 -0.942 -11.251 1.00 0.00 H new ATOM 1538 N LEU A 100 -3.556 -0.871 -7.643 1.00 0.00 N ATOM 1539 CA LEU A 100 -2.520 -0.881 -6.644 1.00 0.00 C ATOM 1540 C LEU A 100 -1.201 -1.169 -7.311 1.00 0.00 C ATOM 1541 O LEU A 100 -1.094 -2.025 -8.179 1.00 0.00 O ATOM 1542 CB LEU A 100 -2.826 -1.939 -5.581 1.00 0.00 C ATOM 1543 CG LEU A 100 -2.075 -1.865 -4.234 1.00 0.00 C ATOM 1544 CD1 LEU A 100 -0.690 -1.285 -4.323 1.00 0.00 C ATOM 1545 CD2 LEU A 100 -2.907 -1.145 -3.200 1.00 0.00 C ATOM 0 H LEU A 100 -3.835 -1.790 -7.986 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.471 0.091 -6.153 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.894 -1.897 -5.368 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -2.627 -2.917 -6.019 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.927 -2.899 -3.921 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -0.237 -1.271 -3.332 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -0.082 -1.895 -4.991 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.746 -0.268 -4.711 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -2.360 -1.103 -2.258 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -3.117 -0.132 -3.543 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.845 -1.679 -3.052 1.00 0.00 H new ATOM 1557 N ILE A 101 -0.210 -0.426 -6.903 1.00 0.00 N ATOM 1558 CA ILE A 101 1.125 -0.603 -7.379 1.00 0.00 C ATOM 1559 C ILE A 101 2.062 -0.750 -6.188 1.00 0.00 C ATOM 1560 O ILE A 101 2.120 0.100 -5.308 1.00 0.00 O ATOM 1561 CB ILE A 101 1.553 0.623 -8.191 1.00 0.00 C ATOM 1562 CG1 ILE A 101 0.413 1.048 -9.125 1.00 0.00 C ATOM 1563 CG2 ILE A 101 2.825 0.331 -8.979 1.00 0.00 C ATOM 1564 CD1 ILE A 101 0.305 2.535 -9.300 1.00 0.00 C ATOM 0 H ILE A 101 -0.312 0.327 -6.223 1.00 0.00 H new ATOM 0 HA ILE A 101 1.168 -1.492 -8.008 1.00 0.00 H new ATOM 0 HB ILE A 101 1.769 1.444 -7.507 1.00 0.00 H new ATOM 0 HG12 ILE A 101 0.562 0.585 -10.101 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -0.529 0.667 -8.732 1.00 0.00 H new ATOM 0 HG21 ILE A 101 3.111 1.215 -9.549 1.00 0.00 H new ATOM 0 HG22 ILE A 101 3.628 0.068 -8.290 1.00 0.00 H new ATOM 0 HG23 ILE A 101 2.647 -0.499 -9.663 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -0.522 2.763 -9.973 1.00 0.00 H new ATOM 0 HD12 ILE A 101 0.125 3.003 -8.332 1.00 0.00 H new ATOM 0 HD13 ILE A 101 1.233 2.920 -9.722 1.00 0.00 H new ATOM 1576 N HIS A 102 2.774 -1.829 -6.135 1.00 0.00 N ATOM 1577 CA HIS A 102 3.841 -1.966 -5.181 1.00 0.00 C ATOM 1578 C HIS A 102 5.090 -2.166 -5.978 1.00 0.00 C ATOM 1579 O HIS A 102 5.264 -3.182 -6.642 1.00 0.00 O ATOM 1580 CB HIS A 102 3.571 -3.134 -4.231 1.00 0.00 C ATOM 1581 CG HIS A 102 3.003 -2.706 -2.911 1.00 0.00 C ATOM 1582 ND1 HIS A 102 3.343 -3.317 -1.718 1.00 0.00 N ATOM 1583 CD2 HIS A 102 2.154 -1.691 -2.587 1.00 0.00 C ATOM 1584 CE1 HIS A 102 2.749 -2.689 -0.720 1.00 0.00 C ATOM 1585 NE2 HIS A 102 2.026 -1.702 -1.218 1.00 0.00 N ATOM 0 H HIS A 102 2.639 -2.637 -6.743 1.00 0.00 H new ATOM 0 HA HIS A 102 3.933 -1.084 -4.548 1.00 0.00 H new ATOM 0 HB2 HIS A 102 2.880 -3.829 -4.708 1.00 0.00 H new ATOM 0 HB3 HIS A 102 4.501 -3.676 -4.060 1.00 0.00 H new ATOM 0 HD2 HIS A 102 1.674 -1.009 -3.273 1.00 0.00 H new ATOM 0 HE1 HIS A 102 2.839 -2.940 0.327 1.00 0.00 H new ATOM 0 HE2 HIS A 102 1.462 -1.050 -0.673 1.00 0.00 H new ATOM 1594 N SER A 103 5.942 -1.193 -5.919 1.00 0.00 N ATOM 1595 CA SER A 103 7.082 -1.157 -6.774 1.00 0.00 C ATOM 1596 C SER A 103 8.262 -0.715 -5.967 1.00 0.00 C ATOM 1597 O SER A 103 8.100 -0.197 -4.873 1.00 0.00 O ATOM 1598 CB SER A 103 6.813 -0.208 -7.952 1.00 0.00 C ATOM 1599 OG SER A 103 7.945 -0.074 -8.800 1.00 0.00 O ATOM 0 H SER A 103 5.866 -0.403 -5.278 1.00 0.00 H new ATOM 0 HA SER A 103 7.289 -2.144 -7.188 1.00 0.00 H new ATOM 0 HB2 SER A 103 5.969 -0.581 -8.532 1.00 0.00 H new ATOM 0 HB3 SER A 103 6.529 0.772 -7.570 1.00 0.00 H new ATOM 0 HG SER A 103 7.731 0.536 -9.537 1.00 0.00 H new ATOM 1605 N GLY A 104 9.422 -0.962 -6.496 1.00 0.00 N ATOM 1606 CA GLY A 104 10.646 -0.550 -5.872 1.00 0.00 C ATOM 1607 C GLY A 104 11.661 -0.222 -6.943 1.00 0.00 C ATOM 1608 O GLY A 104 11.673 -0.878 -7.988 1.00 0.00 O ATOM 0 H GLY A 104 9.548 -1.458 -7.378 1.00 0.00 H new ATOM 0 HA2 GLY A 104 10.471 0.321 -5.240 1.00 0.00 H new ATOM 0 HA3 GLY A 104 11.024 -1.342 -5.226 1.00 0.00 H new ATOM 1612 N TRP A 105 12.490 0.787 -6.739 1.00 0.00 N ATOM 1613 CA TRP A 105 13.453 1.145 -7.773 1.00 0.00 C ATOM 1614 C TRP A 105 14.655 0.201 -7.731 1.00 0.00 C ATOM 1615 O TRP A 105 15.354 0.148 -6.714 1.00 0.00 O ATOM 1616 CB TRP A 105 13.915 2.596 -7.587 1.00 0.00 C ATOM 1617 CG TRP A 105 14.690 3.139 -8.752 1.00 0.00 C ATOM 1618 CD1 TRP A 105 15.941 2.769 -9.154 1.00 0.00 C ATOM 1619 CD2 TRP A 105 14.266 4.165 -9.657 1.00 0.00 C ATOM 1620 NE1 TRP A 105 16.314 3.491 -10.261 1.00 0.00 N ATOM 1621 CE2 TRP A 105 15.304 4.356 -10.586 1.00 0.00 C ATOM 1622 CE3 TRP A 105 13.107 4.935 -9.775 1.00 0.00 C ATOM 1623 CZ2 TRP A 105 15.220 5.285 -11.619 1.00 0.00 C ATOM 1624 CZ3 TRP A 105 13.024 5.861 -10.800 1.00 0.00 C ATOM 1625 CH2 TRP A 105 14.075 6.028 -11.710 1.00 0.00 C ATOM 0 H TRP A 105 12.520 1.359 -5.895 1.00 0.00 H new ATOM 0 HA TRP A 105 12.970 1.051 -8.745 1.00 0.00 H new ATOM 0 HB2 TRP A 105 13.042 3.227 -7.418 1.00 0.00 H new ATOM 0 HB3 TRP A 105 14.532 2.659 -6.691 1.00 0.00 H new ATOM 0 HD1 TRP A 105 16.549 2.018 -8.672 1.00 0.00 H new ATOM 0 HE1 TRP A 105 17.199 3.398 -10.760 1.00 0.00 H new ATOM 0 HE3 TRP A 105 12.291 4.810 -9.079 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 16.029 5.414 -12.323 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 12.134 6.465 -10.900 1.00 0.00 H new ATOM 0 HH2 TRP A 105 13.980 6.758 -12.500 1.00 0.00 H new ATOM 1636 N LYS A 106 14.884 -0.493 -8.867 1.00 0.00 N ATOM 1637 CA LYS A 106 16.031 -1.403 -9.094 1.00 0.00 C ATOM 1638 C LYS A 106 15.596 -2.552 -10.024 1.00 0.00 C ATOM 1639 O LYS A 106 14.518 -2.496 -10.619 1.00 0.00 O ATOM 1640 CB LYS A 106 16.577 -1.994 -7.791 1.00 0.00 C ATOM 1641 CG LYS A 106 18.093 -2.080 -7.738 1.00 0.00 C ATOM 1642 CD LYS A 106 18.717 -0.695 -7.740 1.00 0.00 C ATOM 1643 CE LYS A 106 20.228 -0.759 -7.608 1.00 0.00 C ATOM 1644 NZ LYS A 106 20.837 0.597 -7.618 1.00 0.00 N ATOM 0 H LYS A 106 14.261 -0.435 -9.673 1.00 0.00 H new ATOM 0 HA LYS A 106 16.827 -0.814 -9.550 1.00 0.00 H new ATOM 0 HB2 LYS A 106 16.228 -1.388 -6.955 1.00 0.00 H new ATOM 0 HB3 LYS A 106 16.162 -2.993 -7.655 1.00 0.00 H new ATOM 0 HG2 LYS A 106 18.399 -2.619 -6.842 1.00 0.00 H new ATOM 0 HG3 LYS A 106 18.459 -2.649 -8.593 1.00 0.00 H new ATOM 0 HD2 LYS A 106 18.454 -0.179 -8.663 1.00 0.00 H new ATOM 0 HD3 LYS A 106 18.305 -0.109 -6.919 1.00 0.00 H new ATOM 0 HE2 LYS A 106 20.491 -1.270 -6.682 1.00 0.00 H new ATOM 0 HE3 LYS A 106 20.640 -1.350 -8.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 21.872 0.512 -7.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 20.484 1.130 -8.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 20.582 1.098 -6.743 1.00 0.00 H new ATOM 1658 N GLU A 107 16.440 -3.581 -10.146 1.00 0.00 N ATOM 1659 CA GLU A 107 16.157 -4.737 -11.007 1.00 0.00 C ATOM 1660 C GLU A 107 15.902 -5.998 -10.171 1.00 0.00 C ATOM 1661 O GLU A 107 16.596 -6.244 -9.193 1.00 0.00 O ATOM 1662 CB GLU A 107 17.327 -4.978 -11.969 1.00 0.00 C ATOM 1663 CG GLU A 107 17.149 -4.343 -13.341 1.00 0.00 C ATOM 1664 CD GLU A 107 16.904 -2.849 -13.282 1.00 0.00 C ATOM 1665 OE1 GLU A 107 17.833 -2.103 -12.910 1.00 0.00 O ATOM 1666 OE2 GLU A 107 15.787 -2.412 -13.631 1.00 0.00 O ATOM 0 H GLU A 107 17.332 -3.638 -9.655 1.00 0.00 H new ATOM 0 HA GLU A 107 15.257 -4.518 -11.582 1.00 0.00 H new ATOM 0 HB2 GLU A 107 18.240 -4.590 -11.517 1.00 0.00 H new ATOM 0 HB3 GLU A 107 17.465 -6.052 -12.093 1.00 0.00 H new ATOM 0 HG2 GLU A 107 18.039 -4.535 -13.941 1.00 0.00 H new ATOM 0 HG3 GLU A 107 16.312 -4.822 -13.850 1.00 0.00 H new ATOM 1673 N PRO A 108 14.928 -6.833 -10.580 1.00 0.00 N ATOM 1674 CA PRO A 108 14.424 -7.950 -9.758 1.00 0.00 C ATOM 1675 C PRO A 108 15.371 -9.151 -9.637 1.00 0.00 C ATOM 1676 O PRO A 108 15.981 -9.584 -10.619 1.00 0.00 O ATOM 1677 CB PRO A 108 13.156 -8.372 -10.495 1.00 0.00 C ATOM 1678 CG PRO A 108 13.408 -8.011 -11.916 1.00 0.00 C ATOM 1679 CD PRO A 108 14.239 -6.759 -11.883 1.00 0.00 C ATOM 0 HA PRO A 108 14.287 -7.626 -8.727 1.00 0.00 H new ATOM 0 HB2 PRO A 108 12.971 -9.440 -10.385 1.00 0.00 H new ATOM 0 HB3 PRO A 108 12.280 -7.855 -10.104 1.00 0.00 H new ATOM 0 HG2 PRO A 108 13.932 -8.813 -12.436 1.00 0.00 H new ATOM 0 HG3 PRO A 108 12.472 -7.844 -12.448 1.00 0.00 H new ATOM 0 HD2 PRO A 108 14.948 -6.727 -12.710 1.00 0.00 H new ATOM 0 HD3 PRO A 108 13.620 -5.865 -11.959 1.00 0.00 H new ATOM 1687 N ASN A 109 15.453 -9.676 -8.408 1.00 0.00 N ATOM 1688 CA ASN A 109 16.158 -10.926 -8.076 1.00 0.00 C ATOM 1689 C ASN A 109 16.212 -11.067 -6.556 1.00 0.00 C ATOM 1690 O ASN A 109 15.643 -11.992 -5.969 1.00 0.00 O ATOM 1691 CB ASN A 109 17.580 -10.960 -8.654 1.00 0.00 C ATOM 1692 CG ASN A 109 18.302 -12.264 -8.354 1.00 0.00 C ATOM 1693 OD1 ASN A 109 19.008 -12.385 -7.352 1.00 0.00 O ATOM 1694 ND2 ASN A 109 18.125 -13.252 -9.221 1.00 0.00 N ATOM 0 H ASN A 109 15.022 -9.235 -7.596 1.00 0.00 H new ATOM 0 HA ASN A 109 15.611 -11.757 -8.521 1.00 0.00 H new ATOM 0 HB2 ASN A 109 17.533 -10.815 -9.733 1.00 0.00 H new ATOM 0 HB3 ASN A 109 18.154 -10.129 -8.245 1.00 0.00 H new ATOM 0 HD21 ASN A 109 18.582 -14.151 -9.069 1.00 0.00 H new ATOM 0 HD22 ASN A 109 17.532 -13.112 -10.039 1.00 0.00 H new ATOM 1701 N GLN A 110 16.891 -10.119 -5.936 1.00 0.00 N ATOM 1702 CA GLN A 110 16.944 -9.983 -4.489 1.00 0.00 C ATOM 1703 C GLN A 110 15.925 -8.933 -4.059 1.00 0.00 C ATOM 1704 O GLN A 110 15.493 -8.140 -4.881 1.00 0.00 O ATOM 1705 CB GLN A 110 18.349 -9.625 -4.015 1.00 0.00 C ATOM 1706 CG GLN A 110 18.498 -9.698 -2.508 1.00 0.00 C ATOM 1707 CD GLN A 110 19.942 -9.699 -2.049 1.00 0.00 C ATOM 1708 OE1 GLN A 110 20.269 -10.261 -1.002 1.00 0.00 O ATOM 1709 NE2 GLN A 110 20.820 -9.099 -2.834 1.00 0.00 N ATOM 0 H GLN A 110 17.431 -9.409 -6.431 1.00 0.00 H new ATOM 0 HA GLN A 110 16.695 -10.938 -4.026 1.00 0.00 H new ATOM 0 HB2 GLN A 110 19.067 -10.301 -4.480 1.00 0.00 H new ATOM 0 HB3 GLN A 110 18.595 -8.618 -4.351 1.00 0.00 H new ATOM 0 HG2 GLN A 110 17.981 -8.851 -2.057 1.00 0.00 H new ATOM 0 HG3 GLN A 110 18.008 -10.601 -2.144 1.00 0.00 H new ATOM 0 HE21 GLN A 110 20.509 -8.645 -3.693 1.00 0.00 H new ATOM 0 HE22 GLN A 110 21.808 -9.090 -2.581 1.00 0.00 H new ATOM 1718 N VAL A 111 15.524 -8.913 -2.794 1.00 0.00 N ATOM 1719 CA VAL A 111 14.334 -8.184 -2.401 1.00 0.00 C ATOM 1720 C VAL A 111 14.597 -6.701 -2.246 1.00 0.00 C ATOM 1721 O VAL A 111 15.714 -6.225 -2.444 1.00 0.00 O ATOM 1722 CB VAL A 111 13.788 -8.700 -1.047 1.00 0.00 C ATOM 1723 CG1 VAL A 111 14.431 -7.983 0.145 1.00 0.00 C ATOM 1724 CG2 VAL A 111 12.281 -8.592 -0.994 1.00 0.00 C ATOM 0 H VAL A 111 16.004 -9.391 -2.031 1.00 0.00 H new ATOM 0 HA VAL A 111 13.609 -8.346 -3.198 1.00 0.00 H new ATOM 0 HB VAL A 111 14.059 -9.753 -0.973 1.00 0.00 H new ATOM 0 HG11 VAL A 111 14.018 -8.378 1.073 1.00 0.00 H new ATOM 0 HG12 VAL A 111 15.509 -8.146 0.130 1.00 0.00 H new ATOM 0 HG13 VAL A 111 14.225 -6.915 0.081 1.00 0.00 H new ATOM 0 HG21 VAL A 111 11.923 -8.961 -0.033 1.00 0.00 H new ATOM 0 HG22 VAL A 111 11.986 -7.550 -1.115 1.00 0.00 H new ATOM 0 HG23 VAL A 111 11.845 -9.188 -1.796 1.00 0.00 H new ATOM 1734 N ILE A 112 13.541 -5.990 -1.916 1.00 0.00 N ATOM 1735 CA ILE A 112 13.561 -4.544 -1.820 1.00 0.00 C ATOM 1736 C ILE A 112 14.694 -4.058 -0.912 1.00 0.00 C ATOM 1737 O ILE A 112 15.385 -3.091 -1.226 1.00 0.00 O ATOM 1738 CB ILE A 112 12.226 -4.043 -1.257 1.00 0.00 C ATOM 1739 CG1 ILE A 112 11.129 -5.089 -1.436 1.00 0.00 C ATOM 1740 CG2 ILE A 112 11.823 -2.763 -1.946 1.00 0.00 C ATOM 1741 CD1 ILE A 112 10.742 -5.371 -2.872 1.00 0.00 C ATOM 0 H ILE A 112 12.633 -6.403 -1.704 1.00 0.00 H new ATOM 0 HA ILE A 112 13.723 -4.148 -2.822 1.00 0.00 H new ATOM 0 HB ILE A 112 12.356 -3.858 -0.191 1.00 0.00 H new ATOM 0 HG12 ILE A 112 11.457 -6.020 -0.974 1.00 0.00 H new ATOM 0 HG13 ILE A 112 10.242 -4.760 -0.894 1.00 0.00 H new ATOM 0 HG21 ILE A 112 10.874 -2.414 -1.540 1.00 0.00 H new ATOM 0 HG22 ILE A 112 12.588 -2.005 -1.781 1.00 0.00 H new ATOM 0 HG23 ILE A 112 11.715 -2.944 -3.016 1.00 0.00 H new ATOM 0 HD11 ILE A 112 9.957 -6.127 -2.896 1.00 0.00 H new ATOM 0 HD12 ILE A 112 10.378 -4.455 -3.337 1.00 0.00 H new ATOM 0 HD13 ILE A 112 11.612 -5.735 -3.419 1.00 0.00 H new ATOM 1753 N GLY A 113 14.891 -4.760 0.193 1.00 0.00 N ATOM 1754 CA GLY A 113 15.968 -4.443 1.111 1.00 0.00 C ATOM 1755 C GLY A 113 15.991 -5.418 2.267 1.00 0.00 C ATOM 1756 O GLY A 113 16.909 -6.225 2.400 1.00 0.00 O ATOM 0 H GLY A 113 14.316 -5.554 0.474 1.00 0.00 H new ATOM 0 HA2 GLY A 113 16.922 -4.473 0.584 1.00 0.00 H new ATOM 0 HA3 GLY A 113 15.844 -3.428 1.488 1.00 0.00 H new ATOM 1760 N LYS A 114 14.954 -5.351 3.082 1.00 0.00 N ATOM 1761 CA LYS A 114 14.763 -6.278 4.187 1.00 0.00 C ATOM 1762 C LYS A 114 13.322 -6.796 4.148 1.00 0.00 C ATOM 1763 O LYS A 114 12.828 -7.415 5.087 1.00 0.00 O ATOM 1764 CB LYS A 114 15.048 -5.555 5.510 1.00 0.00 C ATOM 1765 CG LYS A 114 14.944 -6.438 6.739 1.00 0.00 C ATOM 1766 CD LYS A 114 14.947 -5.618 8.015 1.00 0.00 C ATOM 1767 CE LYS A 114 14.521 -6.466 9.196 1.00 0.00 C ATOM 1768 NZ LYS A 114 13.142 -6.996 9.023 1.00 0.00 N ATOM 0 H LYS A 114 14.217 -4.651 2.997 1.00 0.00 H new ATOM 0 HA LYS A 114 15.447 -7.123 4.102 1.00 0.00 H new ATOM 0 HB2 LYS A 114 16.050 -5.127 5.468 1.00 0.00 H new ATOM 0 HB3 LYS A 114 14.350 -4.724 5.614 1.00 0.00 H new ATOM 0 HG2 LYS A 114 14.030 -7.029 6.687 1.00 0.00 H new ATOM 0 HG3 LYS A 114 15.777 -7.141 6.755 1.00 0.00 H new ATOM 0 HD2 LYS A 114 15.944 -5.214 8.191 1.00 0.00 H new ATOM 0 HD3 LYS A 114 14.273 -4.768 7.909 1.00 0.00 H new ATOM 0 HE2 LYS A 114 15.217 -7.296 9.318 1.00 0.00 H new ATOM 0 HE3 LYS A 114 14.571 -5.871 10.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 12.610 -6.875 9.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 12.664 -6.477 8.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 13.186 -8.006 8.781 1.00 0.00 H new ATOM 1782 N ALA A 115 12.676 -6.557 3.012 1.00 0.00 N ATOM 1783 CA ALA A 115 11.237 -6.750 2.868 1.00 0.00 C ATOM 1784 C ALA A 115 10.798 -8.185 3.132 1.00 0.00 C ATOM 1785 O ALA A 115 9.796 -8.415 3.812 1.00 0.00 O ATOM 1786 CB ALA A 115 10.829 -6.347 1.471 1.00 0.00 C ATOM 0 H ALA A 115 13.135 -6.224 2.164 1.00 0.00 H new ATOM 0 HA ALA A 115 10.746 -6.128 3.617 1.00 0.00 H new ATOM 0 HB1 ALA A 115 9.755 -6.487 1.351 1.00 0.00 H new ATOM 0 HB2 ALA A 115 11.079 -5.299 1.307 1.00 0.00 H new ATOM 0 HB3 ALA A 115 11.358 -6.964 0.745 1.00 0.00 H new ATOM 1792 N ASN A 116 11.561 -9.141 2.613 1.00 0.00 N ATOM 1793 CA ASN A 116 11.216 -10.556 2.740 1.00 0.00 C ATOM 1794 C ASN A 116 12.196 -11.406 1.939 1.00 0.00 C ATOM 1795 O ASN A 116 11.803 -12.358 1.275 1.00 0.00 O ATOM 1796 CB ASN A 116 9.778 -10.812 2.255 1.00 0.00 C ATOM 1797 CG ASN A 116 9.228 -12.169 2.672 1.00 0.00 C ATOM 1798 OD1 ASN A 116 8.382 -12.743 1.984 1.00 0.00 O ATOM 1799 ND2 ASN A 116 9.686 -12.685 3.804 1.00 0.00 N ATOM 0 H ASN A 116 12.424 -8.963 2.099 1.00 0.00 H new ATOM 0 HA ASN A 116 11.279 -10.833 3.792 1.00 0.00 H new ATOM 0 HB2 ASN A 116 9.127 -10.030 2.645 1.00 0.00 H new ATOM 0 HB3 ASN A 116 9.751 -10.737 1.168 1.00 0.00 H new ATOM 0 HD21 ASN A 116 9.338 -13.586 4.131 1.00 0.00 H new ATOM 0 HD22 ASN A 116 10.387 -12.181 4.348 1.00 0.00 H new ATOM 1806 N GLU A 117 13.473 -11.031 1.992 1.00 0.00 N ATOM 1807 CA GLU A 117 14.550 -11.782 1.336 1.00 0.00 C ATOM 1808 C GLU A 117 14.496 -11.687 -0.199 1.00 0.00 C ATOM 1809 O GLU A 117 15.358 -11.055 -0.810 1.00 0.00 O ATOM 1810 CB GLU A 117 14.515 -13.243 1.787 1.00 0.00 C ATOM 1811 CG GLU A 117 15.668 -14.083 1.275 1.00 0.00 C ATOM 1812 CD GLU A 117 15.609 -15.491 1.818 1.00 0.00 C ATOM 1813 OE1 GLU A 117 15.922 -15.679 3.011 1.00 0.00 O ATOM 1814 OE2 GLU A 117 15.226 -16.409 1.064 1.00 0.00 O ATOM 0 H GLU A 117 13.793 -10.200 2.489 1.00 0.00 H new ATOM 0 HA GLU A 117 15.493 -11.327 1.640 1.00 0.00 H new ATOM 0 HB2 GLU A 117 14.514 -13.274 2.877 1.00 0.00 H new ATOM 0 HB3 GLU A 117 13.579 -13.691 1.454 1.00 0.00 H new ATOM 0 HG2 GLU A 117 15.644 -14.110 0.186 1.00 0.00 H new ATOM 0 HG3 GLU A 117 16.612 -13.620 1.562 1.00 0.00 H new ATOM 1821 N LYS A 118 13.521 -12.343 -0.821 1.00 0.00 N ATOM 1822 CA LYS A 118 13.419 -12.364 -2.282 1.00 0.00 C ATOM 1823 C LYS A 118 12.480 -11.291 -2.822 1.00 0.00 C ATOM 1824 O LYS A 118 11.386 -11.089 -2.302 1.00 0.00 O ATOM 1825 CB LYS A 118 12.930 -13.719 -2.768 1.00 0.00 C ATOM 1826 CG LYS A 118 13.741 -14.880 -2.240 1.00 0.00 C ATOM 1827 CD LYS A 118 15.219 -14.751 -2.591 1.00 0.00 C ATOM 1828 CE LYS A 118 16.045 -15.854 -1.947 1.00 0.00 C ATOM 1829 NZ LYS A 118 17.492 -15.738 -2.276 1.00 0.00 N ATOM 0 H LYS A 118 12.790 -12.867 -0.340 1.00 0.00 H new ATOM 0 HA LYS A 118 14.423 -12.164 -2.656 1.00 0.00 H new ATOM 0 HB2 LYS A 118 11.889 -13.848 -2.470 1.00 0.00 H new ATOM 0 HB3 LYS A 118 12.954 -13.735 -3.858 1.00 0.00 H new ATOM 0 HG2 LYS A 118 13.629 -14.938 -1.157 1.00 0.00 H new ATOM 0 HG3 LYS A 118 13.351 -15.811 -2.651 1.00 0.00 H new ATOM 0 HD2 LYS A 118 15.341 -14.789 -3.673 1.00 0.00 H new ATOM 0 HD3 LYS A 118 15.588 -13.780 -2.262 1.00 0.00 H new ATOM 0 HE2 LYS A 118 15.916 -15.818 -0.865 1.00 0.00 H new ATOM 0 HE3 LYS A 118 15.675 -16.824 -2.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 18.016 -16.510 -1.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 17.620 -15.799 -3.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 17.853 -14.824 -1.936 1.00 0.00 H new ATOM 1843 N SER A 119 12.900 -10.620 -3.886 1.00 0.00 N ATOM 1844 CA SER A 119 12.020 -9.698 -4.598 1.00 0.00 C ATOM 1845 C SER A 119 10.847 -10.465 -5.217 1.00 0.00 C ATOM 1846 O SER A 119 9.739 -9.955 -5.340 1.00 0.00 O ATOM 1847 CB SER A 119 12.777 -8.955 -5.691 1.00 0.00 C ATOM 1848 OG SER A 119 13.365 -9.862 -6.603 1.00 0.00 O ATOM 0 H SER A 119 13.840 -10.695 -4.275 1.00 0.00 H new ATOM 0 HA SER A 119 11.642 -8.969 -3.881 1.00 0.00 H new ATOM 0 HB2 SER A 119 12.097 -8.289 -6.222 1.00 0.00 H new ATOM 0 HB3 SER A 119 13.550 -8.330 -5.243 1.00 0.00 H new ATOM 0 HG SER A 119 13.096 -9.629 -7.516 1.00 0.00 H new ATOM 1854 N SER A 120 11.119 -11.679 -5.660 1.00 0.00 N ATOM 1855 CA SER A 120 10.087 -12.516 -6.242 1.00 0.00 C ATOM 1856 C SER A 120 9.050 -12.936 -5.193 1.00 0.00 C ATOM 1857 O SER A 120 7.857 -13.007 -5.481 1.00 0.00 O ATOM 1858 CB SER A 120 10.724 -13.743 -6.897 1.00 0.00 C ATOM 1859 OG SER A 120 11.722 -13.353 -7.831 1.00 0.00 O ATOM 0 H SER A 120 12.045 -12.106 -5.628 1.00 0.00 H new ATOM 0 HA SER A 120 9.564 -11.938 -7.003 1.00 0.00 H new ATOM 0 HB2 SER A 120 11.165 -14.382 -6.132 1.00 0.00 H new ATOM 0 HB3 SER A 120 9.957 -14.332 -7.401 1.00 0.00 H new ATOM 0 HG SER A 120 12.119 -14.151 -8.238 1.00 0.00 H new ATOM 1865 N VAL A 121 9.493 -13.209 -3.973 1.00 0.00 N ATOM 1866 CA VAL A 121 8.566 -13.636 -2.935 1.00 0.00 C ATOM 1867 C VAL A 121 7.699 -12.468 -2.493 1.00 0.00 C ATOM 1868 O VAL A 121 6.513 -12.638 -2.246 1.00 0.00 O ATOM 1869 CB VAL A 121 9.267 -14.301 -1.724 1.00 0.00 C ATOM 1870 CG1 VAL A 121 10.145 -15.448 -2.186 1.00 0.00 C ATOM 1871 CG2 VAL A 121 10.058 -13.295 -0.920 1.00 0.00 C ATOM 0 H VAL A 121 10.468 -13.144 -3.682 1.00 0.00 H new ATOM 0 HA VAL A 121 7.933 -14.407 -3.373 1.00 0.00 H new ATOM 0 HB VAL A 121 8.496 -14.703 -1.066 1.00 0.00 H new ATOM 0 HG11 VAL A 121 10.631 -15.905 -1.324 1.00 0.00 H new ATOM 0 HG12 VAL A 121 9.533 -16.193 -2.695 1.00 0.00 H new ATOM 0 HG13 VAL A 121 10.904 -15.072 -2.872 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.536 -13.797 -0.079 1.00 0.00 H new ATOM 0 HG22 VAL A 121 10.821 -12.842 -1.553 1.00 0.00 H new ATOM 0 HG23 VAL A 121 9.388 -12.520 -0.547 1.00 0.00 H new ATOM 1881 N VAL A 122 8.285 -11.269 -2.432 1.00 0.00 N ATOM 1882 CA VAL A 122 7.552 -10.095 -2.005 1.00 0.00 C ATOM 1883 C VAL A 122 6.470 -9.728 -3.020 1.00 0.00 C ATOM 1884 O VAL A 122 5.372 -9.311 -2.651 1.00 0.00 O ATOM 1885 CB VAL A 122 8.497 -8.911 -1.755 1.00 0.00 C ATOM 1886 CG1 VAL A 122 9.176 -8.494 -3.034 1.00 0.00 C ATOM 1887 CG2 VAL A 122 7.763 -7.741 -1.117 1.00 0.00 C ATOM 0 H VAL A 122 9.261 -11.096 -2.674 1.00 0.00 H new ATOM 0 HA VAL A 122 7.062 -10.333 -1.061 1.00 0.00 H new ATOM 0 HB VAL A 122 9.265 -9.237 -1.053 1.00 0.00 H new ATOM 0 HG11 VAL A 122 9.841 -7.654 -2.836 1.00 0.00 H new ATOM 0 HG12 VAL A 122 9.754 -9.330 -3.428 1.00 0.00 H new ATOM 0 HG13 VAL A 122 8.424 -8.197 -3.765 1.00 0.00 H new ATOM 0 HG21 VAL A 122 8.461 -6.920 -0.953 1.00 0.00 H new ATOM 0 HG22 VAL A 122 6.962 -7.410 -1.778 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.340 -8.054 -0.162 1.00 0.00 H new ATOM 1897 N ARG A 123 6.774 -9.902 -4.303 1.00 0.00 N ATOM 1898 CA ARG A 123 5.778 -9.678 -5.340 1.00 0.00 C ATOM 1899 C ARG A 123 4.704 -10.749 -5.242 1.00 0.00 C ATOM 1900 O ARG A 123 3.550 -10.517 -5.581 1.00 0.00 O ATOM 1901 CB ARG A 123 6.415 -9.599 -6.746 1.00 0.00 C ATOM 1902 CG ARG A 123 7.059 -10.877 -7.272 1.00 0.00 C ATOM 1903 CD ARG A 123 6.041 -11.843 -7.872 1.00 0.00 C ATOM 1904 NE ARG A 123 5.284 -11.234 -8.965 1.00 0.00 N ATOM 1905 CZ ARG A 123 4.147 -11.727 -9.454 1.00 0.00 C ATOM 1906 NH1 ARG A 123 3.649 -12.864 -8.982 1.00 0.00 N ATOM 1907 NH2 ARG A 123 3.516 -11.085 -10.430 1.00 0.00 N ATOM 0 H ARG A 123 7.690 -10.194 -4.644 1.00 0.00 H new ATOM 0 HA ARG A 123 5.309 -8.707 -5.181 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.645 -9.289 -7.453 1.00 0.00 H new ATOM 0 HB3 ARG A 123 7.172 -8.815 -6.734 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.801 -10.621 -8.028 1.00 0.00 H new ATOM 0 HG3 ARG A 123 7.590 -11.373 -6.460 1.00 0.00 H new ATOM 0 HD2 ARG A 123 6.556 -12.731 -8.239 1.00 0.00 H new ATOM 0 HD3 ARG A 123 5.352 -12.173 -7.094 1.00 0.00 H new ATOM 0 HE ARG A 123 5.650 -10.377 -9.380 1.00 0.00 H new ATOM 0 HH11 ARG A 123 4.137 -13.366 -8.240 1.00 0.00 H new ATOM 0 HH12 ARG A 123 2.778 -13.236 -9.361 1.00 0.00 H new ATOM 0 HH21 ARG A 123 3.902 -10.218 -10.803 1.00 0.00 H new ATOM 0 HH22 ARG A 123 2.645 -11.459 -10.807 1.00 0.00 H new ATOM 1921 N GLY A 124 5.102 -11.913 -4.744 1.00 0.00 N ATOM 1922 CA GLY A 124 4.152 -12.986 -4.491 1.00 0.00 C ATOM 1923 C GLY A 124 3.219 -12.639 -3.344 1.00 0.00 C ATOM 1924 O GLY A 124 2.029 -12.988 -3.356 1.00 0.00 O ATOM 0 H GLY A 124 6.069 -12.136 -4.509 1.00 0.00 H new ATOM 0 HA2 GLY A 124 3.569 -13.178 -5.392 1.00 0.00 H new ATOM 0 HA3 GLY A 124 4.691 -13.904 -4.259 1.00 0.00 H new ATOM 1928 N LYS A 125 3.751 -11.904 -2.371 1.00 0.00 N ATOM 1929 CA LYS A 125 2.971 -11.435 -1.234 1.00 0.00 C ATOM 1930 C LYS A 125 1.846 -10.566 -1.724 1.00 0.00 C ATOM 1931 O LYS A 125 0.704 -10.665 -1.280 1.00 0.00 O ATOM 1932 CB LYS A 125 3.859 -10.601 -0.329 1.00 0.00 C ATOM 1933 CG LYS A 125 5.168 -11.295 -0.030 1.00 0.00 C ATOM 1934 CD LYS A 125 6.000 -10.537 0.991 1.00 0.00 C ATOM 1935 CE LYS A 125 5.360 -10.566 2.371 1.00 0.00 C ATOM 1936 NZ LYS A 125 5.297 -11.943 2.933 1.00 0.00 N ATOM 0 H LYS A 125 4.730 -11.619 -2.350 1.00 0.00 H new ATOM 0 HA LYS A 125 2.574 -12.293 -0.691 1.00 0.00 H new ATOM 0 HB2 LYS A 125 4.058 -9.639 -0.801 1.00 0.00 H new ATOM 0 HB3 LYS A 125 3.335 -10.396 0.605 1.00 0.00 H new ATOM 0 HG2 LYS A 125 4.968 -12.300 0.341 1.00 0.00 H new ATOM 0 HG3 LYS A 125 5.739 -11.404 -0.952 1.00 0.00 H new ATOM 0 HD2 LYS A 125 6.998 -10.973 1.043 1.00 0.00 H new ATOM 0 HD3 LYS A 125 6.120 -9.503 0.667 1.00 0.00 H new ATOM 0 HE2 LYS A 125 5.927 -9.925 3.046 1.00 0.00 H new ATOM 0 HE3 LYS A 125 4.353 -10.153 2.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 5.096 -11.893 3.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 4.542 -12.478 2.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 6.208 -12.421 2.783 1.00 0.00 H new ATOM 1950 N MET A 126 2.198 -9.734 -2.675 1.00 0.00 N ATOM 1951 CA MET A 126 1.260 -8.828 -3.287 1.00 0.00 C ATOM 1952 C MET A 126 0.386 -9.590 -4.270 1.00 0.00 C ATOM 1953 O MET A 126 -0.747 -9.224 -4.533 1.00 0.00 O ATOM 1954 CB MET A 126 2.033 -7.721 -4.001 1.00 0.00 C ATOM 1955 CG MET A 126 3.238 -7.232 -3.204 1.00 0.00 C ATOM 1956 SD MET A 126 2.786 -6.508 -1.613 1.00 0.00 S ATOM 1957 CE MET A 126 4.383 -6.451 -0.804 1.00 0.00 C ATOM 0 H MET A 126 3.146 -9.667 -3.046 1.00 0.00 H new ATOM 0 HA MET A 126 0.618 -8.381 -2.527 1.00 0.00 H new ATOM 0 HB2 MET A 126 2.369 -8.087 -4.971 1.00 0.00 H new ATOM 0 HB3 MET A 126 1.364 -6.882 -4.191 1.00 0.00 H new ATOM 0 HG2 MET A 126 3.919 -8.067 -3.037 1.00 0.00 H new ATOM 0 HG3 MET A 126 3.780 -6.492 -3.793 1.00 0.00 H new ATOM 0 HE1 MET A 126 4.283 -5.962 0.165 1.00 0.00 H new ATOM 0 HE2 MET A 126 4.755 -7.466 -0.661 1.00 0.00 H new ATOM 0 HE3 MET A 126 5.084 -5.891 -1.423 1.00 0.00 H new ATOM 1967 N ASP A 127 0.889 -10.703 -4.758 1.00 0.00 N ATOM 1968 CA ASP A 127 0.219 -11.393 -5.848 1.00 0.00 C ATOM 1969 C ASP A 127 -0.957 -12.222 -5.340 1.00 0.00 C ATOM 1970 O ASP A 127 -1.818 -12.642 -6.111 1.00 0.00 O ATOM 1971 CB ASP A 127 1.217 -12.282 -6.576 1.00 0.00 C ATOM 1972 CG ASP A 127 0.694 -12.760 -7.916 1.00 0.00 C ATOM 1973 OD1 ASP A 127 0.114 -11.943 -8.664 1.00 0.00 O ATOM 1974 OD2 ASP A 127 0.886 -13.947 -8.238 1.00 0.00 O ATOM 0 H ASP A 127 1.745 -11.147 -4.427 1.00 0.00 H new ATOM 0 HA ASP A 127 -0.176 -10.648 -6.538 1.00 0.00 H new ATOM 0 HB2 ASP A 127 2.146 -11.733 -6.727 1.00 0.00 H new ATOM 0 HB3 ASP A 127 1.454 -13.144 -5.953 1.00 0.00 H new ATOM 1979 N GLY A 128 -1.009 -12.432 -4.037 1.00 0.00 N ATOM 1980 CA GLY A 128 -2.189 -13.048 -3.442 1.00 0.00 C ATOM 1981 C GLY A 128 -2.823 -12.166 -2.381 1.00 0.00 C ATOM 1982 O GLY A 128 -4.036 -11.880 -2.408 1.00 0.00 O ATOM 0 H GLY A 128 -0.267 -12.192 -3.379 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -2.920 -13.257 -4.223 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -1.913 -14.005 -2.999 1.00 0.00 H new ATOM 1986 N GLY A 129 -1.991 -11.706 -1.460 1.00 0.00 N ATOM 1987 CA GLY A 129 -2.468 -10.912 -0.356 1.00 0.00 C ATOM 1988 C GLY A 129 -3.111 -9.620 -0.801 1.00 0.00 C ATOM 1989 O GLY A 129 -4.004 -9.111 -0.132 1.00 0.00 O ATOM 0 H GLY A 129 -0.985 -11.872 -1.461 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -3.189 -11.493 0.219 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -1.636 -10.688 0.311 1.00 0.00 H new ATOM 1993 N TRP A 130 -2.688 -9.093 -1.945 1.00 0.00 N ATOM 1994 CA TRP A 130 -3.178 -7.804 -2.391 1.00 0.00 C ATOM 1995 C TRP A 130 -4.646 -7.847 -2.817 1.00 0.00 C ATOM 1996 O TRP A 130 -5.324 -6.829 -2.765 1.00 0.00 O ATOM 1997 CB TRP A 130 -2.320 -7.278 -3.524 1.00 0.00 C ATOM 1998 CG TRP A 130 -1.598 -6.002 -3.230 1.00 0.00 C ATOM 1999 CD1 TRP A 130 -0.873 -5.279 -4.123 1.00 0.00 C ATOM 2000 CD2 TRP A 130 -1.524 -5.291 -1.983 1.00 0.00 C ATOM 2001 NE1 TRP A 130 -0.378 -4.156 -3.529 1.00 0.00 N ATOM 2002 CE2 TRP A 130 -0.770 -4.130 -2.219 1.00 0.00 C ATOM 2003 CE3 TRP A 130 -2.032 -5.505 -0.697 1.00 0.00 C ATOM 2004 CZ2 TRP A 130 -0.518 -3.186 -1.228 1.00 0.00 C ATOM 2005 CZ3 TRP A 130 -1.774 -4.571 0.284 1.00 0.00 C ATOM 2006 CH2 TRP A 130 -1.029 -3.422 0.013 1.00 0.00 C ATOM 0 H TRP A 130 -2.015 -9.536 -2.570 1.00 0.00 H new ATOM 0 HA TRP A 130 -3.112 -7.128 -1.539 1.00 0.00 H new ATOM 0 HB2 TRP A 130 -1.587 -8.040 -3.789 1.00 0.00 H new ATOM 0 HB3 TRP A 130 -2.953 -7.127 -4.399 1.00 0.00 H new ATOM 0 HD1 TRP A 130 -0.712 -5.554 -5.155 1.00 0.00 H new ATOM 0 HE1 TRP A 130 0.194 -3.448 -3.989 1.00 0.00 H new ATOM 0 HE3 TRP A 130 -2.616 -6.386 -0.477 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 0.062 -2.299 -1.435 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 -2.156 -4.732 1.281 1.00 0.00 H new ATOM 0 HH2 TRP A 130 -0.854 -2.706 0.802 1.00 0.00 H new ATOM 2017 N THR A 131 -5.164 -8.987 -3.259 1.00 0.00 N ATOM 2018 CA THR A 131 -6.590 -9.048 -3.521 1.00 0.00 C ATOM 2019 C THR A 131 -7.369 -9.285 -2.249 1.00 0.00 C ATOM 2020 O THR A 131 -8.421 -8.707 -2.058 1.00 0.00 O ATOM 2021 CB THR A 131 -7.010 -10.098 -4.548 1.00 0.00 C ATOM 2022 OG1 THR A 131 -6.220 -11.282 -4.395 1.00 0.00 O ATOM 2023 CG2 THR A 131 -6.888 -9.556 -5.964 1.00 0.00 C ATOM 0 H THR A 131 -4.642 -9.845 -3.436 1.00 0.00 H new ATOM 0 HA THR A 131 -6.823 -8.072 -3.947 1.00 0.00 H new ATOM 0 HB THR A 131 -8.056 -10.348 -4.373 1.00 0.00 H new ATOM 0 HG1 THR A 131 -6.498 -11.949 -5.057 1.00 0.00 H new ATOM 0 HG21 THR A 131 -7.193 -10.324 -6.675 1.00 0.00 H new ATOM 0 HG22 THR A 131 -7.530 -8.682 -6.076 1.00 0.00 H new ATOM 0 HG23 THR A 131 -5.853 -9.273 -6.157 1.00 0.00 H new ATOM 2031 N GLY A 132 -6.875 -10.120 -1.370 1.00 0.00 N ATOM 2032 CA GLY A 132 -7.545 -10.244 -0.102 1.00 0.00 C ATOM 2033 C GLY A 132 -7.615 -8.897 0.576 1.00 0.00 C ATOM 2034 O GLY A 132 -8.693 -8.385 0.882 1.00 0.00 O ATOM 0 H GLY A 132 -6.047 -10.701 -1.499 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -8.550 -10.639 -0.249 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -7.013 -10.953 0.532 1.00 0.00 H new ATOM 2038 N ILE A 133 -6.462 -8.279 0.691 1.00 0.00 N ATOM 2039 CA ILE A 133 -6.327 -7.034 1.406 1.00 0.00 C ATOM 2040 C ILE A 133 -6.867 -5.836 0.621 1.00 0.00 C ATOM 2041 O ILE A 133 -7.752 -5.140 1.094 1.00 0.00 O ATOM 2042 CB ILE A 133 -4.838 -6.824 1.700 1.00 0.00 C ATOM 2043 CG1 ILE A 133 -4.384 -7.796 2.792 1.00 0.00 C ATOM 2044 CG2 ILE A 133 -4.538 -5.388 2.076 1.00 0.00 C ATOM 2045 CD1 ILE A 133 -2.889 -7.819 3.006 1.00 0.00 C ATOM 0 H ILE A 133 -5.591 -8.627 0.290 1.00 0.00 H new ATOM 0 HA ILE A 133 -6.916 -7.097 2.321 1.00 0.00 H new ATOM 0 HB ILE A 133 -4.274 -7.032 0.791 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -4.872 -7.528 3.729 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -4.720 -8.800 2.534 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -3.472 -5.280 2.277 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -4.821 -4.730 1.254 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -5.104 -5.119 2.968 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -2.645 -8.531 3.795 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -2.394 -8.117 2.082 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -2.548 -6.825 3.296 1.00 0.00 H new ATOM 2057 N VAL A 134 -6.387 -5.612 -0.591 1.00 0.00 N ATOM 2058 CA VAL A 134 -6.854 -4.469 -1.355 1.00 0.00 C ATOM 2059 C VAL A 134 -8.163 -4.780 -2.053 1.00 0.00 C ATOM 2060 O VAL A 134 -9.099 -3.997 -2.004 1.00 0.00 O ATOM 2061 CB VAL A 134 -5.830 -4.001 -2.399 1.00 0.00 C ATOM 2062 CG1 VAL A 134 -6.289 -2.714 -3.024 1.00 0.00 C ATOM 2063 CG2 VAL A 134 -4.480 -3.792 -1.767 1.00 0.00 C ATOM 0 H VAL A 134 -5.690 -6.192 -1.058 1.00 0.00 H new ATOM 0 HA VAL A 134 -7.000 -3.663 -0.635 1.00 0.00 H new ATOM 0 HB VAL A 134 -5.746 -4.773 -3.164 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -5.558 -2.388 -3.764 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -7.252 -2.869 -3.510 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -6.390 -1.951 -2.253 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -3.771 -3.461 -2.525 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -4.557 -3.035 -0.987 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -4.134 -4.729 -1.331 1.00 0.00 H new ATOM 2073 N ASN A 135 -8.270 -5.955 -2.647 1.00 0.00 N ATOM 2074 CA ASN A 135 -9.435 -6.228 -3.466 1.00 0.00 C ATOM 2075 C ASN A 135 -10.629 -6.426 -2.572 1.00 0.00 C ATOM 2076 O ASN A 135 -11.717 -5.923 -2.849 1.00 0.00 O ATOM 2077 CB ASN A 135 -9.215 -7.455 -4.360 1.00 0.00 C ATOM 2078 CG ASN A 135 -10.463 -7.939 -5.079 1.00 0.00 C ATOM 2079 OD1 ASN A 135 -11.244 -8.710 -4.526 1.00 0.00 O ATOM 2080 ND2 ASN A 135 -10.635 -7.534 -6.327 1.00 0.00 N ATOM 0 H ASN A 135 -7.589 -6.712 -2.582 1.00 0.00 H new ATOM 0 HA ASN A 135 -9.610 -5.378 -4.125 1.00 0.00 H new ATOM 0 HB2 ASN A 135 -8.452 -7.217 -5.102 1.00 0.00 H new ATOM 0 HB3 ASN A 135 -8.823 -8.269 -3.750 1.00 0.00 H new ATOM 0 HD21 ASN A 135 -11.438 -7.863 -6.864 1.00 0.00 H new ATOM 0 HD22 ASN A 135 -9.965 -6.893 -6.752 1.00 0.00 H new ATOM 2087 N GLU A 136 -10.432 -7.113 -1.462 1.00 0.00 N ATOM 2088 CA GLU A 136 -11.548 -7.369 -0.622 1.00 0.00 C ATOM 2089 C GLU A 136 -11.631 -6.367 0.525 1.00 0.00 C ATOM 2090 O GLU A 136 -12.679 -5.772 0.723 1.00 0.00 O ATOM 2091 CB GLU A 136 -11.492 -8.830 -0.168 1.00 0.00 C ATOM 2092 CG GLU A 136 -12.277 -9.116 1.100 1.00 0.00 C ATOM 2093 CD GLU A 136 -12.548 -10.592 1.299 1.00 0.00 C ATOM 2094 OE1 GLU A 136 -13.407 -11.147 0.583 1.00 0.00 O ATOM 2095 OE2 GLU A 136 -11.905 -11.201 2.176 1.00 0.00 O ATOM 0 H GLU A 136 -9.537 -7.485 -1.143 1.00 0.00 H new ATOM 0 HA GLU A 136 -12.477 -7.227 -1.175 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -11.873 -9.463 -0.969 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -10.451 -9.110 -0.009 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -11.725 -8.733 1.958 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -13.225 -8.578 1.065 1.00 0.00 H new ATOM 2102 N ARG A 137 -10.518 -6.083 1.198 1.00 0.00 N ATOM 2103 CA ARG A 137 -10.545 -5.196 2.357 1.00 0.00 C ATOM 2104 C ARG A 137 -10.526 -3.730 1.982 1.00 0.00 C ATOM 2105 O ARG A 137 -11.102 -2.934 2.685 1.00 0.00 O ATOM 2106 CB ARG A 137 -9.441 -5.516 3.361 1.00 0.00 C ATOM 2107 CG ARG A 137 -9.049 -4.355 4.291 1.00 0.00 C ATOM 2108 CD ARG A 137 -10.199 -3.894 5.189 1.00 0.00 C ATOM 2109 NE ARG A 137 -10.538 -4.876 6.215 1.00 0.00 N ATOM 2110 CZ ARG A 137 -11.552 -4.739 7.069 1.00 0.00 C ATOM 2111 NH1 ARG A 137 -12.350 -3.680 6.998 1.00 0.00 N ATOM 2112 NH2 ARG A 137 -11.765 -5.656 7.999 1.00 0.00 N ATOM 0 H ARG A 137 -9.596 -6.450 0.964 1.00 0.00 H new ATOM 0 HA ARG A 137 -11.501 -5.388 2.844 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -9.761 -6.359 3.973 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -8.555 -5.838 2.813 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -8.210 -4.664 4.914 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -8.706 -3.514 3.688 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -9.927 -2.953 5.667 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -11.078 -3.697 4.575 1.00 0.00 H new ATOM 0 HE ARG A 137 -9.965 -5.717 6.282 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -12.188 -2.966 6.287 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -13.125 -3.580 7.654 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -11.153 -6.469 8.063 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -12.541 -5.550 8.652 1.00 0.00 H new ATOM 2126 N LEU A 138 -9.871 -3.343 0.911 1.00 0.00 N ATOM 2127 CA LEU A 138 -9.889 -1.937 0.564 1.00 0.00 C ATOM 2128 C LEU A 138 -11.313 -1.561 0.261 1.00 0.00 C ATOM 2129 O LEU A 138 -11.790 -0.533 0.707 1.00 0.00 O ATOM 2130 CB LEU A 138 -8.954 -1.629 -0.595 1.00 0.00 C ATOM 2131 CG LEU A 138 -8.789 -0.159 -0.942 1.00 0.00 C ATOM 2132 CD1 LEU A 138 -8.480 0.669 0.284 1.00 0.00 C ATOM 2133 CD2 LEU A 138 -7.682 -0.004 -1.947 1.00 0.00 C ATOM 0 H LEU A 138 -9.340 -3.950 0.287 1.00 0.00 H new ATOM 0 HA LEU A 138 -9.521 -1.340 1.398 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -7.972 -2.040 -0.363 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -9.318 -2.152 -1.479 1.00 0.00 H new ATOM 0 HG LEU A 138 -9.729 0.199 -1.361 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -8.369 1.715 -0.002 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -9.295 0.574 1.002 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -7.554 0.316 0.737 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -7.562 1.050 -2.197 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -6.752 -0.385 -1.525 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -7.928 -0.565 -2.849 1.00 0.00 H new ATOM 2145 N ARG A 139 -12.010 -2.450 -0.431 1.00 0.00 N ATOM 2146 CA ARG A 139 -13.437 -2.290 -0.634 1.00 0.00 C ATOM 2147 C ARG A 139 -14.155 -2.392 0.708 1.00 0.00 C ATOM 2148 O ARG A 139 -15.186 -1.767 0.915 1.00 0.00 O ATOM 2149 CB ARG A 139 -13.953 -3.341 -1.623 1.00 0.00 C ATOM 2150 CG ARG A 139 -15.200 -2.919 -2.400 1.00 0.00 C ATOM 2151 CD ARG A 139 -16.430 -2.813 -1.513 1.00 0.00 C ATOM 2152 NE ARG A 139 -16.655 -4.039 -0.757 1.00 0.00 N ATOM 2153 CZ ARG A 139 -17.831 -4.403 -0.264 1.00 0.00 C ATOM 2154 NH1 ARG A 139 -18.916 -3.682 -0.517 1.00 0.00 N ATOM 2155 NH2 ARG A 139 -17.920 -5.506 0.464 1.00 0.00 N ATOM 0 H ARG A 139 -11.610 -3.285 -0.859 1.00 0.00 H new ATOM 0 HA ARG A 139 -13.638 -1.307 -1.060 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -13.159 -3.575 -2.333 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -14.173 -4.259 -1.077 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -15.017 -1.957 -2.879 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -15.390 -3.640 -3.195 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -16.311 -1.977 -0.824 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -17.305 -2.598 -2.127 1.00 0.00 H new ATOM 0 HE ARG A 139 -15.858 -4.655 -0.597 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -18.848 -2.843 -1.093 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -19.818 -3.967 -0.135 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -17.088 -6.068 0.642 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -18.821 -5.793 0.847 1.00 0.00 H new ATOM 2169 N LYS A 140 -13.616 -3.170 1.634 1.00 0.00 N ATOM 2170 CA LYS A 140 -14.247 -3.293 2.929 1.00 0.00 C ATOM 2171 C LYS A 140 -14.064 -2.052 3.804 1.00 0.00 C ATOM 2172 O LYS A 140 -15.009 -1.550 4.379 1.00 0.00 O ATOM 2173 CB LYS A 140 -13.739 -4.519 3.675 1.00 0.00 C ATOM 2174 CG LYS A 140 -14.139 -5.827 3.031 1.00 0.00 C ATOM 2175 CD LYS A 140 -13.955 -6.989 3.969 1.00 0.00 C ATOM 2176 CE LYS A 140 -12.486 -7.341 4.143 1.00 0.00 C ATOM 2177 NZ LYS A 140 -12.301 -8.457 5.111 1.00 0.00 N ATOM 0 H LYS A 140 -12.761 -3.713 1.513 1.00 0.00 H new ATOM 0 HA LYS A 140 -15.313 -3.402 2.730 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -12.652 -4.472 3.737 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -14.118 -4.496 4.697 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -15.182 -5.774 2.717 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -13.543 -5.987 2.132 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -14.389 -6.746 4.939 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -14.494 -7.855 3.586 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -12.062 -7.621 3.179 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -11.940 -6.464 4.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -11.288 -8.670 5.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -12.684 -8.180 6.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -12.802 -9.301 4.768 1.00 0.00 H new ATOM 2191 N ALA A 141 -12.868 -1.536 3.871 1.00 0.00 N ATOM 2192 CA ALA A 141 -12.583 -0.396 4.715 1.00 0.00 C ATOM 2193 C ALA A 141 -13.282 0.835 4.174 1.00 0.00 C ATOM 2194 O ALA A 141 -13.670 1.728 4.926 1.00 0.00 O ATOM 2195 CB ALA A 141 -11.090 -0.175 4.814 1.00 0.00 C ATOM 0 H ALA A 141 -12.065 -1.886 3.349 1.00 0.00 H new ATOM 0 HA ALA A 141 -12.960 -0.592 5.719 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -10.891 0.686 5.452 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -10.619 -1.060 5.241 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -10.683 0.009 3.820 1.00 0.00 H new ATOM 2201 N VAL A 142 -13.466 0.863 2.863 1.00 0.00 N ATOM 2202 CA VAL A 142 -14.167 1.947 2.235 1.00 0.00 C ATOM 2203 C VAL A 142 -15.660 1.680 2.288 1.00 0.00 C ATOM 2204 O VAL A 142 -16.467 2.605 2.230 1.00 0.00 O ATOM 2205 CB VAL A 142 -13.719 2.158 0.773 1.00 0.00 C ATOM 2206 CG1 VAL A 142 -12.227 2.424 0.710 1.00 0.00 C ATOM 2207 CG2 VAL A 142 -14.083 0.985 -0.122 1.00 0.00 C ATOM 0 H VAL A 142 -13.135 0.142 2.222 1.00 0.00 H new ATOM 0 HA VAL A 142 -13.931 2.860 2.781 1.00 0.00 H new ATOM 0 HB VAL A 142 -14.258 3.028 0.397 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -11.927 2.571 -0.328 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -11.992 3.319 1.286 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -11.688 1.573 1.127 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -13.745 1.185 -1.139 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -13.601 0.081 0.249 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -15.164 0.847 -0.119 1.00 0.00 H new ATOM 2217 N GLU A 143 -16.026 0.407 2.446 1.00 0.00 N ATOM 2218 CA GLU A 143 -17.435 0.025 2.442 1.00 0.00 C ATOM 2219 C GLU A 143 -17.731 -1.166 3.364 1.00 0.00 C ATOM 2220 O GLU A 143 -18.487 -1.038 4.327 1.00 0.00 O ATOM 2221 CB GLU A 143 -17.881 -0.312 1.019 1.00 0.00 C ATOM 2222 CG GLU A 143 -18.010 0.899 0.106 1.00 0.00 C ATOM 2223 CD GLU A 143 -19.252 1.723 0.387 1.00 0.00 C ATOM 2224 OE1 GLU A 143 -20.314 1.410 -0.195 1.00 0.00 O ATOM 2225 OE2 GLU A 143 -19.179 2.688 1.176 1.00 0.00 O ATOM 0 H GLU A 143 -15.374 -0.367 2.577 1.00 0.00 H new ATOM 0 HA GLU A 143 -17.994 0.880 2.823 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -17.167 -1.009 0.581 1.00 0.00 H new ATOM 0 HB3 GLU A 143 -18.842 -0.825 1.063 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -17.128 1.530 0.221 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -18.029 0.565 -0.931 1.00 0.00 H new ATOM 2232 N GLU A 144 -17.101 -2.302 3.074 1.00 0.00 N ATOM 2233 CA GLU A 144 -17.418 -3.593 3.718 1.00 0.00 C ATOM 2234 C GLU A 144 -18.938 -3.831 3.785 1.00 0.00 C ATOM 2235 O GLU A 144 -19.480 -4.285 4.795 1.00 0.00 O ATOM 2236 CB GLU A 144 -16.769 -3.694 5.111 1.00 0.00 C ATOM 2237 CG GLU A 144 -16.816 -5.100 5.696 1.00 0.00 C ATOM 2238 CD GLU A 144 -16.025 -5.242 6.979 1.00 0.00 C ATOM 2239 OE1 GLU A 144 -14.781 -5.309 6.912 1.00 0.00 O ATOM 2240 OE2 GLU A 144 -16.640 -5.328 8.060 1.00 0.00 O ATOM 0 H GLU A 144 -16.352 -2.363 2.384 1.00 0.00 H new ATOM 0 HA GLU A 144 -16.994 -4.383 3.099 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -15.730 -3.370 5.045 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -17.275 -3.008 5.791 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -17.854 -5.373 5.885 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -16.431 -5.805 4.960 1.00 0.00 H new ATOM 2247 N LEU A 145 -19.630 -3.501 2.698 1.00 0.00 N ATOM 2248 CA LEU A 145 -21.049 -3.817 2.575 1.00 0.00 C ATOM 2249 C LEU A 145 -21.218 -5.237 2.049 1.00 0.00 C ATOM 2250 O LEU A 145 -20.480 -5.670 1.162 1.00 0.00 O ATOM 2251 CB LEU A 145 -21.772 -2.836 1.641 1.00 0.00 C ATOM 2252 CG LEU A 145 -22.265 -1.526 2.277 1.00 0.00 C ATOM 2253 CD1 LEU A 145 -23.083 -1.807 3.526 1.00 0.00 C ATOM 2254 CD2 LEU A 145 -21.109 -0.595 2.590 1.00 0.00 C ATOM 0 H LEU A 145 -19.233 -3.017 1.893 1.00 0.00 H new ATOM 0 HA LEU A 145 -21.495 -3.730 3.566 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -21.099 -2.586 0.821 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -22.630 -3.348 1.205 1.00 0.00 H new ATOM 0 HG LEU A 145 -22.907 -1.027 1.552 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -23.421 -0.866 3.959 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -23.947 -2.418 3.265 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -22.468 -2.340 4.251 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -21.491 0.322 3.039 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -20.427 -1.083 3.287 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -20.576 -0.354 1.670 1.00 0.00 H new ATOM 2266 N GLU A 146 -22.179 -5.962 2.589 1.00 0.00 N ATOM 2267 CA GLU A 146 -22.403 -7.340 2.184 1.00 0.00 C ATOM 2268 C GLU A 146 -23.272 -7.401 0.936 1.00 0.00 C ATOM 2269 O GLU A 146 -24.497 -7.486 1.018 1.00 0.00 O ATOM 2270 CB GLU A 146 -23.045 -8.134 3.318 1.00 0.00 C ATOM 2271 CG GLU A 146 -22.215 -8.146 4.589 1.00 0.00 C ATOM 2272 CD GLU A 146 -22.838 -8.986 5.677 1.00 0.00 C ATOM 2273 OE1 GLU A 146 -23.810 -8.518 6.310 1.00 0.00 O ATOM 2274 OE2 GLU A 146 -22.368 -10.119 5.901 1.00 0.00 O ATOM 0 H GLU A 146 -22.817 -5.622 3.308 1.00 0.00 H new ATOM 0 HA GLU A 146 -21.437 -7.787 1.951 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -24.026 -7.712 3.537 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -23.206 -9.160 2.988 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -21.219 -8.528 4.365 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -22.092 -7.124 4.949 1.00 0.00 H new ATOM 2281 N HIS A 147 -22.627 -7.321 -0.219 1.00 0.00 N ATOM 2282 CA HIS A 147 -23.310 -7.466 -1.499 1.00 0.00 C ATOM 2283 C HIS A 147 -22.463 -8.303 -2.444 1.00 0.00 C ATOM 2284 O HIS A 147 -22.140 -7.869 -3.549 1.00 0.00 O ATOM 2285 CB HIS A 147 -23.600 -6.102 -2.141 1.00 0.00 C ATOM 2286 CG HIS A 147 -24.564 -5.251 -1.371 1.00 0.00 C ATOM 2287 ND1 HIS A 147 -25.932 -5.351 -1.497 1.00 0.00 N ATOM 2288 CD2 HIS A 147 -24.345 -4.279 -0.457 1.00 0.00 C ATOM 2289 CE1 HIS A 147 -26.511 -4.479 -0.695 1.00 0.00 C ATOM 2290 NE2 HIS A 147 -25.570 -3.816 -0.052 1.00 0.00 N ATOM 0 H HIS A 147 -21.624 -7.155 -0.297 1.00 0.00 H new ATOM 0 HA HIS A 147 -24.262 -7.964 -1.315 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -22.662 -5.559 -2.252 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -23.996 -6.262 -3.144 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -23.383 -3.932 -0.110 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -27.575 -4.333 -0.584 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -25.728 -3.079 0.635 1.00 0.00 H new ATOM 2299 N HIS A 148 -22.077 -9.494 -1.996 1.00 0.00 N ATOM 2300 CA HIS A 148 -21.276 -10.398 -2.822 1.00 0.00 C ATOM 2301 C HIS A 148 -21.215 -11.808 -2.234 1.00 0.00 C ATOM 2302 O HIS A 148 -20.392 -12.620 -2.650 1.00 0.00 O ATOM 2303 CB HIS A 148 -19.849 -9.855 -3.028 1.00 0.00 C ATOM 2304 CG HIS A 148 -19.029 -9.745 -1.775 1.00 0.00 C ATOM 2305 ND1 HIS A 148 -18.711 -8.540 -1.193 1.00 0.00 N ATOM 2306 CD2 HIS A 148 -18.447 -10.696 -1.004 1.00 0.00 C ATOM 2307 CE1 HIS A 148 -17.972 -8.755 -0.121 1.00 0.00 C ATOM 2308 NE2 HIS A 148 -17.799 -10.055 0.020 1.00 0.00 N ATOM 0 H HIS A 148 -22.304 -9.857 -1.070 1.00 0.00 H new ATOM 0 HA HIS A 148 -21.773 -10.455 -3.790 1.00 0.00 H new ATOM 0 HB2 HIS A 148 -19.327 -10.504 -3.731 1.00 0.00 H new ATOM 0 HB3 HIS A 148 -19.914 -8.870 -3.491 1.00 0.00 H new ATOM 0 HD2 HIS A 148 -18.487 -11.763 -1.167 1.00 0.00 H new ATOM 0 HE1 HIS A 148 -17.575 -7.993 0.533 1.00 0.00 H new ATOM 0 HE2 HIS A 148 -17.271 -10.508 0.766 1.00 0.00 H new ATOM 2317 N HIS A 149 -22.062 -12.095 -1.254 1.00 0.00 N ATOM 2318 CA HIS A 149 -22.144 -13.445 -0.711 1.00 0.00 C ATOM 2319 C HIS A 149 -23.021 -14.285 -1.636 1.00 0.00 C ATOM 2320 O HIS A 149 -22.603 -15.329 -2.133 1.00 0.00 O ATOM 2321 CB HIS A 149 -22.721 -13.420 0.710 1.00 0.00 C ATOM 2322 CG HIS A 149 -22.351 -14.609 1.546 1.00 0.00 C ATOM 2323 ND1 HIS A 149 -22.170 -14.537 2.909 1.00 0.00 N ATOM 2324 CD2 HIS A 149 -22.127 -15.902 1.210 1.00 0.00 C ATOM 2325 CE1 HIS A 149 -21.850 -15.729 3.372 1.00 0.00 C ATOM 2326 NE2 HIS A 149 -21.817 -16.576 2.362 1.00 0.00 N ATOM 0 H HIS A 149 -22.695 -11.421 -0.823 1.00 0.00 H new ATOM 0 HA HIS A 149 -21.147 -13.882 -0.653 1.00 0.00 H new ATOM 0 HB2 HIS A 149 -22.378 -12.516 1.213 1.00 0.00 H new ATOM 0 HB3 HIS A 149 -23.807 -13.358 0.648 1.00 0.00 H new ATOM 0 HD2 HIS A 149 -22.183 -16.324 0.217 1.00 0.00 H new ATOM 0 HE1 HIS A 149 -21.649 -15.971 4.405 1.00 0.00 H new ATOM 0 HE2 HIS A 149 -21.597 -17.570 2.428 1.00 0.00 H new ATOM 2335 N HIS A 150 -24.247 -13.818 -1.831 1.00 0.00 N ATOM 2336 CA HIS A 150 -25.143 -14.340 -2.866 1.00 0.00 C ATOM 2337 C HIS A 150 -25.756 -13.159 -3.605 1.00 0.00 C ATOM 2338 O HIS A 150 -26.977 -13.016 -3.659 1.00 0.00 O ATOM 2339 CB HIS A 150 -26.254 -15.207 -2.257 1.00 0.00 C ATOM 2340 CG HIS A 150 -25.784 -16.534 -1.746 1.00 0.00 C ATOM 2341 ND1 HIS A 150 -25.914 -17.700 -2.464 1.00 0.00 N ATOM 2342 CD2 HIS A 150 -25.176 -16.875 -0.587 1.00 0.00 C ATOM 2343 CE1 HIS A 150 -25.407 -18.700 -1.769 1.00 0.00 C ATOM 2344 NE2 HIS A 150 -24.952 -18.226 -0.626 1.00 0.00 N ATOM 0 H HIS A 150 -24.654 -13.064 -1.277 1.00 0.00 H new ATOM 0 HA HIS A 150 -24.573 -14.969 -3.550 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -26.720 -14.659 -1.438 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -27.025 -15.372 -3.010 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -24.915 -16.206 0.220 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -25.371 -19.733 -2.083 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -24.506 -18.775 0.109 1.00 0.00 H new ATOM 2353 N HIS A 151 -24.875 -12.308 -4.148 1.00 0.00 N ATOM 2354 CA HIS A 151 -25.235 -10.960 -4.616 1.00 0.00 C ATOM 2355 C HIS A 151 -25.531 -10.076 -3.401 1.00 0.00 C ATOM 2356 O HIS A 151 -25.799 -8.881 -3.512 1.00 0.00 O ATOM 2357 CB HIS A 151 -26.426 -10.990 -5.594 1.00 0.00 C ATOM 2358 CG HIS A 151 -26.845 -9.637 -6.083 1.00 0.00 C ATOM 2359 ND1 HIS A 151 -26.129 -8.911 -7.005 1.00 0.00 N ATOM 2360 CD2 HIS A 151 -27.905 -8.866 -5.745 1.00 0.00 C ATOM 2361 CE1 HIS A 151 -26.726 -7.754 -7.213 1.00 0.00 C ATOM 2362 NE2 HIS A 151 -27.808 -7.700 -6.459 1.00 0.00 N ATOM 0 H HIS A 151 -23.889 -12.535 -4.276 1.00 0.00 H new ATOM 0 HA HIS A 151 -24.395 -10.543 -5.171 1.00 0.00 H new ATOM 0 HB2 HIS A 151 -26.164 -11.610 -6.451 1.00 0.00 H new ATOM 0 HB3 HIS A 151 -27.274 -11.467 -5.103 1.00 0.00 H new ATOM 0 HD2 HIS A 151 -28.684 -9.122 -5.042 1.00 0.00 H new ATOM 0 HE1 HIS A 151 -26.387 -6.981 -7.887 1.00 0.00 H new ATOM 0 HE2 HIS A 151 -28.463 -6.920 -6.415 1.00 0.00 H new ATOM 2371 N HIS A 152 -25.433 -10.689 -2.238 1.00 0.00 N ATOM 2372 CA HIS A 152 -25.713 -10.044 -0.976 1.00 0.00 C ATOM 2373 C HIS A 152 -24.816 -10.666 0.091 1.00 0.00 C ATOM 2374 O HIS A 152 -25.298 -11.521 0.858 1.00 0.00 O ATOM 2375 CB HIS A 152 -27.198 -10.219 -0.636 1.00 0.00 C ATOM 2376 CG HIS A 152 -27.605 -9.656 0.688 1.00 0.00 C ATOM 2377 ND1 HIS A 152 -27.955 -10.446 1.756 1.00 0.00 N ATOM 2378 CD2 HIS A 152 -27.738 -8.376 1.106 1.00 0.00 C ATOM 2379 CE1 HIS A 152 -28.289 -9.683 2.775 1.00 0.00 C ATOM 2380 NE2 HIS A 152 -28.165 -8.421 2.411 1.00 0.00 N ATOM 2381 OXT HIS A 152 -23.609 -10.348 0.099 1.00 0.00 O ATOM 0 H HIS A 152 -25.152 -11.665 -2.145 1.00 0.00 H new ATOM 0 HA HIS A 152 -25.507 -8.975 -1.028 1.00 0.00 H new ATOM 0 HB2 HIS A 152 -27.794 -9.745 -1.416 1.00 0.00 H new ATOM 0 HB3 HIS A 152 -27.438 -11.282 -0.653 1.00 0.00 H new ATOM 0 HD2 HIS A 152 -27.545 -7.487 0.524 1.00 0.00 H new ATOM 0 HE1 HIS A 152 -28.610 -10.031 3.745 1.00 0.00 H new ATOM 0 HE2 HIS A 152 -28.355 -7.611 3.002 1.00 0.00 H new TER 2390 HIS A 152