USER MOD reduce.3.24.130724 H: found=0, std=0, add=891, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 892 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 85 HIS : no HE2:sc= -2.29 K(o=-2.3,f=-9.9!) USER MOD Set 1.2: A 93 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 14 HIS : no HD1:sc= 0.813 K(o=1.9,f=-1.9!) USER MOD Set 2.2: A 82 TYR OH : rot 27:sc= 1.04 USER MOD Set 3.1: A 37 ASN : amide:sc= 0.788 K(o=1.8,f=0.66!) USER MOD Set 3.2: A 106 THR OG1 : rot -158:sc= 1.05 USER MOD Single : A 1 MET CE :methyl -120:sc= -0.0471 (180deg=-2.07) USER MOD Single : A 1 MET N :NH3+ -162:sc= 0.994 (180deg=-0.303) USER MOD Single : A 2 LYS NZ :NH3+ -175:sc= 1.26 (180deg=1.14) USER MOD Single : A 3 THR OG1 : rot 78:sc= 0.382 USER MOD Single : A 4 THR OG1 : rot 135:sc= 0.817 USER MOD Single : A 10 GLN : amide:sc= -0.715 K(o=-0.72,f=0) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 CYS SG : rot -126:sc= 1.33 USER MOD Single : A 30 THR OG1 : rot -103:sc= 0.75 USER MOD Single : A 32 THR OG1 : rot -70:sc= 1.19 USER MOD Single : A 43 HIS : no HD1:sc= -5.17! C(o=-5.2!,f=-8.7!) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= -0.137 X(o=-0.14,f=-0.38) USER MOD Single : A 74 GLN : amide:sc= -1.42! K(o=-1.4!,f=-0.027) USER MOD Single : A 83 HIS : no HD1:sc= -0.259 K(o=-0.26,f=-2.2) USER MOD Single : A 84 SER OG : rot 180:sc= 0.00958 USER MOD Single : A 88 HIS : no HE2:sc= 0.973 K(o=0.97,f=-5.7!) USER MOD Single : A 95 THR OG1 : rot -45:sc= 0.0151 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 TYR OH : rot -88:sc= -0.192 USER MOD Single : A 111 SER OG : rot -160:sc= 0.86 USER MOD Single : A 121 THR OG1 : rot -6:sc= 1.39 USER MOD Single : A 130 SER OG : rot 180:sc= -0.0342 USER MOD Single : A 133 HIS : no HD1:sc= -0.64 X(o=-0.64,f=-0.5) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.389 -6.517 4.644 1.00 0.00 N ATOM 2 CA MET A 1 -8.517 -6.304 3.471 1.00 0.00 C ATOM 3 C MET A 1 -8.561 -7.510 2.537 1.00 0.00 C ATOM 4 O MET A 1 -8.295 -8.637 2.953 1.00 0.00 O ATOM 5 CB MET A 1 -7.077 -6.057 3.929 1.00 0.00 C ATOM 6 CG MET A 1 -6.086 -5.914 2.783 1.00 0.00 C ATOM 7 SD MET A 1 -4.383 -5.740 3.356 1.00 0.00 S ATOM 8 CE MET A 1 -3.498 -5.759 1.798 1.00 0.00 C ATOM 0 H1 MET A 1 -9.588 -5.603 5.099 1.00 0.00 H new ATOM 0 H2 MET A 1 -10.282 -6.953 4.338 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.912 -7.145 5.322 1.00 0.00 H new ATOM 0 HA MET A 1 -8.880 -5.431 2.928 1.00 0.00 H new ATOM 0 HB2 MET A 1 -7.049 -5.153 4.537 1.00 0.00 H new ATOM 0 HB3 MET A 1 -6.762 -6.881 4.569 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.159 -6.786 2.133 1.00 0.00 H new ATOM 0 HG3 MET A 1 -6.354 -5.045 2.182 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.801 -6.597 1.786 1.00 0.00 H new ATOM 0 HE2 MET A 1 -4.208 -5.866 0.978 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.946 -4.826 1.682 1.00 0.00 H new ATOM 20 N LYS A 2 -8.916 -7.272 1.281 1.00 0.00 N ATOM 21 CA LYS A 2 -8.872 -8.312 0.262 1.00 0.00 C ATOM 22 C LYS A 2 -7.771 -8.013 -0.744 1.00 0.00 C ATOM 23 O LYS A 2 -7.613 -6.869 -1.176 1.00 0.00 O ATOM 24 CB LYS A 2 -10.207 -8.439 -0.484 1.00 0.00 C ATOM 25 CG LYS A 2 -11.322 -9.109 0.307 1.00 0.00 C ATOM 26 CD LYS A 2 -12.016 -8.139 1.245 1.00 0.00 C ATOM 27 CE LYS A 2 -13.177 -8.801 1.972 1.00 0.00 C ATOM 28 NZ LYS A 2 -13.915 -7.832 2.819 1.00 0.00 N ATOM 0 H LYS A 2 -9.238 -6.365 0.943 1.00 0.00 H new ATOM 0 HA LYS A 2 -8.671 -9.254 0.772 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -10.538 -7.443 -0.779 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -10.042 -9.004 -1.401 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -12.052 -9.531 -0.383 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -10.910 -9.938 0.883 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -11.299 -7.759 1.973 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -12.381 -7.282 0.679 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -13.858 -9.242 1.245 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -12.802 -9.615 2.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -14.645 -8.333 3.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -13.253 -7.368 3.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -14.365 -7.115 2.215 1.00 0.00 H new ATOM 42 N THR A 3 -7.008 -9.030 -1.098 1.00 0.00 N ATOM 43 CA THR A 3 -5.986 -8.895 -2.118 1.00 0.00 C ATOM 44 C THR A 3 -5.664 -10.269 -2.699 1.00 0.00 C ATOM 45 O THR A 3 -6.036 -11.293 -2.119 1.00 0.00 O ATOM 46 CB THR A 3 -4.710 -8.219 -1.560 1.00 0.00 C ATOM 47 OG1 THR A 3 -3.845 -7.826 -2.631 1.00 0.00 O ATOM 48 CG2 THR A 3 -3.964 -9.146 -0.612 1.00 0.00 C ATOM 0 H THR A 3 -7.078 -9.963 -0.692 1.00 0.00 H new ATOM 0 HA THR A 3 -6.369 -8.250 -2.909 1.00 0.00 H new ATOM 0 HB THR A 3 -5.020 -7.334 -1.003 1.00 0.00 H new ATOM 0 HG1 THR A 3 -4.184 -7.002 -3.039 1.00 0.00 H new ATOM 0 HG21 THR A 3 -3.073 -8.643 -0.237 1.00 0.00 H new ATOM 0 HG22 THR A 3 -4.611 -9.409 0.225 1.00 0.00 H new ATOM 0 HG23 THR A 3 -3.672 -10.052 -1.143 1.00 0.00 H new ATOM 56 N THR A 4 -5.000 -10.294 -3.841 1.00 0.00 N ATOM 57 CA THR A 4 -4.703 -11.542 -4.520 1.00 0.00 C ATOM 58 C THR A 4 -3.272 -12.001 -4.235 1.00 0.00 C ATOM 59 O THR A 4 -2.388 -11.184 -3.956 1.00 0.00 O ATOM 60 CB THR A 4 -4.935 -11.405 -6.039 1.00 0.00 C ATOM 61 OG1 THR A 4 -4.345 -10.191 -6.515 1.00 0.00 O ATOM 62 CG2 THR A 4 -6.422 -11.417 -6.371 1.00 0.00 C ATOM 0 H THR A 4 -4.655 -9.461 -4.319 1.00 0.00 H new ATOM 0 HA THR A 4 -5.383 -12.301 -4.133 1.00 0.00 H new ATOM 0 HB THR A 4 -4.466 -12.257 -6.531 1.00 0.00 H new ATOM 0 HG1 THR A 4 -3.854 -10.369 -7.345 1.00 0.00 H new ATOM 0 HG21 THR A 4 -6.555 -11.319 -7.448 1.00 0.00 H new ATOM 0 HG22 THR A 4 -6.862 -12.356 -6.035 1.00 0.00 H new ATOM 0 HG23 THR A 4 -6.914 -10.585 -5.867 1.00 0.00 H new ATOM 70 N PRO A 5 -3.033 -13.322 -4.289 1.00 0.00 N ATOM 71 CA PRO A 5 -1.726 -13.921 -3.981 1.00 0.00 C ATOM 72 C PRO A 5 -0.594 -13.371 -4.845 1.00 0.00 C ATOM 73 O PRO A 5 0.543 -13.248 -4.386 1.00 0.00 O ATOM 74 CB PRO A 5 -1.929 -15.415 -4.266 1.00 0.00 C ATOM 75 CG PRO A 5 -3.175 -15.499 -5.080 1.00 0.00 C ATOM 76 CD PRO A 5 -4.028 -14.345 -4.647 1.00 0.00 C ATOM 0 HA PRO A 5 -1.428 -13.701 -2.956 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -1.078 -15.831 -4.806 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -2.026 -15.982 -3.340 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -2.950 -15.440 -6.145 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -3.687 -16.447 -4.914 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -4.687 -14.006 -5.447 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -4.663 -14.606 -3.800 1.00 0.00 H new ATOM 84 N ASP A 6 -0.908 -13.036 -6.092 1.00 0.00 N ATOM 85 CA ASP A 6 0.079 -12.508 -7.016 1.00 0.00 C ATOM 86 C ASP A 6 0.585 -11.147 -6.541 1.00 0.00 C ATOM 87 O ASP A 6 1.754 -10.814 -6.732 1.00 0.00 O ATOM 88 CB ASP A 6 -0.515 -12.405 -8.424 1.00 0.00 C ATOM 89 CG ASP A 6 -1.451 -11.224 -8.596 1.00 0.00 C ATOM 90 OD1 ASP A 6 -2.520 -11.217 -7.962 1.00 0.00 O ATOM 91 OD2 ASP A 6 -1.124 -10.303 -9.379 1.00 0.00 O ATOM 0 H ASP A 6 -1.846 -13.123 -6.484 1.00 0.00 H new ATOM 0 HA ASP A 6 0.927 -13.192 -7.049 1.00 0.00 H new ATOM 0 HB2 ASP A 6 0.296 -12.325 -9.148 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -1.055 -13.324 -8.651 1.00 0.00 H new ATOM 96 N ILE A 7 -0.290 -10.378 -5.900 1.00 0.00 N ATOM 97 CA ILE A 7 0.090 -9.085 -5.349 1.00 0.00 C ATOM 98 C ILE A 7 1.011 -9.281 -4.152 1.00 0.00 C ATOM 99 O ILE A 7 2.046 -8.631 -4.049 1.00 0.00 O ATOM 100 CB ILE A 7 -1.145 -8.254 -4.918 1.00 0.00 C ATOM 101 CG1 ILE A 7 -2.048 -7.962 -6.122 1.00 0.00 C ATOM 102 CG2 ILE A 7 -0.713 -6.955 -4.247 1.00 0.00 C ATOM 103 CD1 ILE A 7 -1.379 -7.146 -7.209 1.00 0.00 C ATOM 0 H ILE A 7 -1.267 -10.630 -5.750 1.00 0.00 H new ATOM 0 HA ILE A 7 0.609 -8.535 -6.134 1.00 0.00 H new ATOM 0 HB ILE A 7 -1.714 -8.840 -4.196 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -2.386 -8.907 -6.547 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -2.936 -7.431 -5.778 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -1.595 -6.387 -3.952 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -0.116 -7.183 -3.364 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -0.118 -6.365 -4.945 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -2.082 -6.982 -8.026 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -1.065 -6.185 -6.802 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -0.508 -7.683 -7.583 1.00 0.00 H new ATOM 115 N LEU A 8 0.637 -10.206 -3.271 1.00 0.00 N ATOM 116 CA LEU A 8 1.434 -10.514 -2.083 1.00 0.00 C ATOM 117 C LEU A 8 2.834 -10.967 -2.475 1.00 0.00 C ATOM 118 O LEU A 8 3.825 -10.585 -1.848 1.00 0.00 O ATOM 119 CB LEU A 8 0.747 -11.601 -1.251 1.00 0.00 C ATOM 120 CG LEU A 8 -0.618 -11.217 -0.678 1.00 0.00 C ATOM 121 CD1 LEU A 8 -1.241 -12.401 0.040 1.00 0.00 C ATOM 122 CD2 LEU A 8 -0.488 -10.033 0.267 1.00 0.00 C ATOM 0 H LEU A 8 -0.216 -10.758 -3.357 1.00 0.00 H new ATOM 0 HA LEU A 8 1.518 -9.607 -1.484 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.626 -12.489 -1.871 1.00 0.00 H new ATOM 0 HB3 LEU A 8 1.405 -11.875 -0.427 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.269 -10.928 -1.503 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -2.212 -12.113 0.443 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.369 -13.225 -0.661 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.589 -12.716 0.855 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -1.470 -9.775 0.664 1.00 0.00 H new ATOM 0 HD22 LEU A 8 0.179 -10.295 1.089 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -0.079 -9.179 -0.274 1.00 0.00 H new ATOM 134 N ASP A 9 2.903 -11.783 -3.517 1.00 0.00 N ATOM 135 CA ASP A 9 4.179 -12.231 -4.065 1.00 0.00 C ATOM 136 C ASP A 9 4.991 -11.042 -4.561 1.00 0.00 C ATOM 137 O ASP A 9 6.173 -10.908 -4.258 1.00 0.00 O ATOM 138 CB ASP A 9 3.935 -13.209 -5.214 1.00 0.00 C ATOM 139 CG ASP A 9 5.213 -13.639 -5.901 1.00 0.00 C ATOM 140 OD1 ASP A 9 5.980 -14.429 -5.307 1.00 0.00 O ATOM 141 OD2 ASP A 9 5.446 -13.201 -7.045 1.00 0.00 O ATOM 0 H ASP A 9 2.086 -12.151 -4.004 1.00 0.00 H new ATOM 0 HA ASP A 9 4.741 -12.733 -3.278 1.00 0.00 H new ATOM 0 HB2 ASP A 9 3.420 -14.090 -4.832 1.00 0.00 H new ATOM 0 HB3 ASP A 9 3.273 -12.745 -5.945 1.00 0.00 H new ATOM 146 N GLN A 10 4.338 -10.172 -5.310 1.00 0.00 N ATOM 147 CA GLN A 10 4.976 -8.963 -5.811 1.00 0.00 C ATOM 148 C GLN A 10 5.438 -8.057 -4.670 1.00 0.00 C ATOM 149 O GLN A 10 6.429 -7.347 -4.810 1.00 0.00 O ATOM 150 CB GLN A 10 4.034 -8.209 -6.753 1.00 0.00 C ATOM 151 CG GLN A 10 3.805 -8.941 -8.065 1.00 0.00 C ATOM 152 CD GLN A 10 2.920 -8.178 -9.031 1.00 0.00 C ATOM 153 OE1 GLN A 10 3.090 -8.268 -10.249 1.00 0.00 O ATOM 154 NE2 GLN A 10 1.967 -7.430 -8.503 1.00 0.00 N ATOM 0 H GLN A 10 3.362 -10.279 -5.587 1.00 0.00 H new ATOM 0 HA GLN A 10 5.861 -9.263 -6.371 1.00 0.00 H new ATOM 0 HB2 GLN A 10 3.076 -8.055 -6.256 1.00 0.00 H new ATOM 0 HB3 GLN A 10 4.448 -7.222 -6.960 1.00 0.00 H new ATOM 0 HG2 GLN A 10 4.768 -9.133 -8.539 1.00 0.00 H new ATOM 0 HG3 GLN A 10 3.353 -9.911 -7.858 1.00 0.00 H new ATOM 0 HE21 GLN A 10 1.859 -7.382 -7.490 1.00 0.00 H new ATOM 0 HE22 GLN A 10 1.340 -6.901 -9.109 1.00 0.00 H new ATOM 163 N ILE A 11 4.729 -8.088 -3.544 1.00 0.00 N ATOM 164 CA ILE A 11 5.108 -7.280 -2.389 1.00 0.00 C ATOM 165 C ILE A 11 6.453 -7.733 -1.818 1.00 0.00 C ATOM 166 O ILE A 11 7.355 -6.913 -1.616 1.00 0.00 O ATOM 167 CB ILE A 11 4.036 -7.315 -1.272 1.00 0.00 C ATOM 168 CG1 ILE A 11 2.719 -6.726 -1.779 1.00 0.00 C ATOM 169 CG2 ILE A 11 4.512 -6.542 -0.046 1.00 0.00 C ATOM 170 CD1 ILE A 11 1.596 -6.765 -0.761 1.00 0.00 C ATOM 0 H ILE A 11 3.895 -8.659 -3.408 1.00 0.00 H new ATOM 0 HA ILE A 11 5.194 -6.254 -2.746 1.00 0.00 H new ATOM 0 HB ILE A 11 3.873 -8.355 -0.989 1.00 0.00 H new ATOM 0 HG12 ILE A 11 2.887 -5.692 -2.081 1.00 0.00 H new ATOM 0 HG13 ILE A 11 2.408 -7.271 -2.670 1.00 0.00 H new ATOM 0 HG21 ILE A 11 3.745 -6.578 0.728 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.431 -6.990 0.333 1.00 0.00 H new ATOM 0 HG23 ILE A 11 4.701 -5.504 -0.321 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.696 -6.330 -1.195 1.00 0.00 H new ATOM 0 HD12 ILE A 11 1.398 -7.799 -0.477 1.00 0.00 H new ATOM 0 HD13 ILE A 11 1.885 -6.195 0.122 1.00 0.00 H new ATOM 182 N ARG A 12 6.602 -9.036 -1.582 1.00 0.00 N ATOM 183 CA ARG A 12 7.850 -9.563 -1.035 1.00 0.00 C ATOM 184 C ARG A 12 9.005 -9.363 -2.017 1.00 0.00 C ATOM 185 O ARG A 12 10.123 -9.047 -1.618 1.00 0.00 O ATOM 186 CB ARG A 12 7.717 -11.043 -0.649 1.00 0.00 C ATOM 187 CG ARG A 12 7.173 -11.935 -1.750 1.00 0.00 C ATOM 188 CD ARG A 12 7.372 -13.408 -1.432 1.00 0.00 C ATOM 189 NE ARG A 12 6.803 -13.788 -0.136 1.00 0.00 N ATOM 190 CZ ARG A 12 6.448 -15.032 0.186 1.00 0.00 C ATOM 191 NH1 ARG A 12 6.523 -16.003 -0.717 1.00 0.00 N ATOM 192 NH2 ARG A 12 5.999 -15.300 1.407 1.00 0.00 N ATOM 0 H ARG A 12 5.883 -9.738 -1.759 1.00 0.00 H new ATOM 0 HA ARG A 12 8.070 -9.002 -0.127 1.00 0.00 H new ATOM 0 HB2 ARG A 12 8.696 -11.416 -0.347 1.00 0.00 H new ATOM 0 HB3 ARG A 12 7.064 -11.121 0.220 1.00 0.00 H new ATOM 0 HG2 ARG A 12 6.111 -11.733 -1.890 1.00 0.00 H new ATOM 0 HG3 ARG A 12 7.669 -11.696 -2.690 1.00 0.00 H new ATOM 0 HD2 ARG A 12 6.913 -14.010 -2.216 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.438 -13.636 -1.437 1.00 0.00 H new ATOM 0 HE ARG A 12 6.671 -13.056 0.562 1.00 0.00 H new ATOM 0 HH11 ARG A 12 6.853 -15.798 -1.660 1.00 0.00 H new ATOM 0 HH12 ARG A 12 6.251 -16.954 -0.467 1.00 0.00 H new ATOM 0 HH21 ARG A 12 5.926 -14.554 2.099 1.00 0.00 H new ATOM 0 HH22 ARG A 12 5.727 -16.252 1.653 1.00 0.00 H new ATOM 206 N VAL A 13 8.723 -9.536 -3.302 1.00 0.00 N ATOM 207 CA VAL A 13 9.722 -9.307 -4.338 1.00 0.00 C ATOM 208 C VAL A 13 10.097 -7.827 -4.396 1.00 0.00 C ATOM 209 O VAL A 13 11.271 -7.480 -4.488 1.00 0.00 O ATOM 210 CB VAL A 13 9.222 -9.776 -5.724 1.00 0.00 C ATOM 211 CG1 VAL A 13 10.240 -9.463 -6.808 1.00 0.00 C ATOM 212 CG2 VAL A 13 8.914 -11.265 -5.705 1.00 0.00 C ATOM 0 H VAL A 13 7.812 -9.834 -3.651 1.00 0.00 H new ATOM 0 HA VAL A 13 10.604 -9.894 -4.080 1.00 0.00 H new ATOM 0 HB VAL A 13 8.305 -9.231 -5.951 1.00 0.00 H new ATOM 0 HG11 VAL A 13 9.862 -9.804 -7.772 1.00 0.00 H new ATOM 0 HG12 VAL A 13 10.412 -8.387 -6.846 1.00 0.00 H new ATOM 0 HG13 VAL A 13 11.177 -9.973 -6.585 1.00 0.00 H new ATOM 0 HG21 VAL A 13 8.564 -11.577 -6.689 1.00 0.00 H new ATOM 0 HG22 VAL A 13 9.816 -11.820 -5.449 1.00 0.00 H new ATOM 0 HG23 VAL A 13 8.141 -11.467 -4.964 1.00 0.00 H new ATOM 222 N HIS A 14 9.087 -6.966 -4.311 1.00 0.00 N ATOM 223 CA HIS A 14 9.291 -5.517 -4.302 1.00 0.00 C ATOM 224 C HIS A 14 10.236 -5.097 -3.177 1.00 0.00 C ATOM 225 O HIS A 14 11.010 -4.158 -3.333 1.00 0.00 O ATOM 226 CB HIS A 14 7.938 -4.798 -4.166 1.00 0.00 C ATOM 227 CG HIS A 14 8.024 -3.329 -3.873 1.00 0.00 C ATOM 228 ND1 HIS A 14 8.301 -2.373 -4.829 1.00 0.00 N ATOM 229 CD2 HIS A 14 7.847 -2.653 -2.713 1.00 0.00 C ATOM 230 CE1 HIS A 14 8.295 -1.179 -4.269 1.00 0.00 C ATOM 231 NE2 HIS A 14 8.020 -1.323 -2.987 1.00 0.00 N ATOM 0 H HIS A 14 8.109 -7.249 -4.247 1.00 0.00 H new ATOM 0 HA HIS A 14 9.753 -5.231 -5.247 1.00 0.00 H new ATOM 0 HB2 HIS A 14 7.376 -4.936 -5.090 1.00 0.00 H new ATOM 0 HB3 HIS A 14 7.367 -5.278 -3.371 1.00 0.00 H new ATOM 0 HD2 HIS A 14 7.613 -3.083 -1.750 1.00 0.00 H new ATOM 0 HE1 HIS A 14 8.483 -0.243 -4.774 1.00 0.00 H new ATOM 0 HE2 HIS A 14 7.948 -0.565 -2.309 1.00 0.00 H new ATOM 240 N GLY A 15 10.168 -5.795 -2.050 1.00 0.00 N ATOM 241 CA GLY A 15 11.033 -5.473 -0.932 1.00 0.00 C ATOM 242 C GLY A 15 12.498 -5.710 -1.240 1.00 0.00 C ATOM 243 O GLY A 15 13.330 -4.831 -1.027 1.00 0.00 O ATOM 0 H GLY A 15 9.531 -6.576 -1.891 1.00 0.00 H new ATOM 0 HA2 GLY A 15 10.888 -4.429 -0.655 1.00 0.00 H new ATOM 0 HA3 GLY A 15 10.745 -6.075 -0.070 1.00 0.00 H new ATOM 247 N ALA A 16 12.812 -6.892 -1.758 1.00 0.00 N ATOM 248 CA ALA A 16 14.193 -7.246 -2.063 1.00 0.00 C ATOM 249 C ALA A 16 14.691 -6.529 -3.318 1.00 0.00 C ATOM 250 O ALA A 16 15.856 -6.138 -3.399 1.00 0.00 O ATOM 251 CB ALA A 16 14.325 -8.752 -2.227 1.00 0.00 C ATOM 0 H ALA A 16 12.131 -7.620 -1.975 1.00 0.00 H new ATOM 0 HA ALA A 16 14.814 -6.923 -1.227 1.00 0.00 H new ATOM 0 HB1 ALA A 16 15.361 -9.004 -2.455 1.00 0.00 H new ATOM 0 HB2 ALA A 16 14.026 -9.246 -1.303 1.00 0.00 H new ATOM 0 HB3 ALA A 16 13.683 -9.087 -3.042 1.00 0.00 H new ATOM 257 N ASP A 17 13.797 -6.358 -4.286 1.00 0.00 N ATOM 258 CA ASP A 17 14.147 -5.772 -5.580 1.00 0.00 C ATOM 259 C ASP A 17 14.484 -4.290 -5.445 1.00 0.00 C ATOM 260 O ASP A 17 15.355 -3.773 -6.147 1.00 0.00 O ATOM 261 CB ASP A 17 12.983 -5.948 -6.557 1.00 0.00 C ATOM 262 CG ASP A 17 13.406 -5.853 -8.010 1.00 0.00 C ATOM 263 OD1 ASP A 17 13.769 -6.897 -8.598 1.00 0.00 O ATOM 264 OD2 ASP A 17 13.368 -4.742 -8.579 1.00 0.00 O ATOM 0 H ASP A 17 12.815 -6.619 -4.199 1.00 0.00 H new ATOM 0 HA ASP A 17 15.029 -6.288 -5.959 1.00 0.00 H new ATOM 0 HB2 ASP A 17 12.515 -6.917 -6.384 1.00 0.00 H new ATOM 0 HB3 ASP A 17 12.228 -5.188 -6.354 1.00 0.00 H new ATOM 269 N ALA A 18 13.783 -3.616 -4.540 1.00 0.00 N ATOM 270 CA ALA A 18 13.968 -2.180 -4.331 1.00 0.00 C ATOM 271 C ALA A 18 15.259 -1.876 -3.573 1.00 0.00 C ATOM 272 O ALA A 18 15.852 -0.807 -3.752 1.00 0.00 O ATOM 273 CB ALA A 18 12.776 -1.590 -3.588 1.00 0.00 C ATOM 0 H ALA A 18 13.079 -4.040 -3.936 1.00 0.00 H new ATOM 0 HA ALA A 18 14.043 -1.717 -5.315 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.931 -0.521 -3.442 1.00 0.00 H new ATOM 0 HB2 ALA A 18 11.869 -1.748 -4.171 1.00 0.00 H new ATOM 0 HB3 ALA A 18 12.674 -2.078 -2.619 1.00 0.00 H new ATOM 279 N TYR A 19 15.684 -2.813 -2.732 1.00 0.00 N ATOM 280 CA TYR A 19 16.902 -2.642 -1.949 1.00 0.00 C ATOM 281 C TYR A 19 18.136 -2.613 -2.850 1.00 0.00 C ATOM 282 O TYR A 19 18.104 -3.119 -3.969 1.00 0.00 O ATOM 283 CB TYR A 19 17.026 -3.747 -0.899 1.00 0.00 C ATOM 284 CG TYR A 19 16.495 -3.340 0.459 1.00 0.00 C ATOM 285 CD1 TYR A 19 15.140 -3.117 0.665 1.00 0.00 C ATOM 286 CD2 TYR A 19 17.355 -3.180 1.539 1.00 0.00 C ATOM 287 CE1 TYR A 19 14.656 -2.744 1.906 1.00 0.00 C ATOM 288 CE2 TYR A 19 16.880 -2.808 2.781 1.00 0.00 C ATOM 289 CZ TYR A 19 15.532 -2.590 2.961 1.00 0.00 C ATOM 290 OH TYR A 19 15.055 -2.230 4.201 1.00 0.00 O ATOM 0 H TYR A 19 15.203 -3.699 -2.575 1.00 0.00 H new ATOM 0 HA TYR A 19 16.840 -1.683 -1.435 1.00 0.00 H new ATOM 0 HB2 TYR A 19 16.487 -4.629 -1.244 1.00 0.00 H new ATOM 0 HB3 TYR A 19 18.074 -4.032 -0.802 1.00 0.00 H new ATOM 0 HD1 TYR A 19 14.452 -3.237 -0.159 1.00 0.00 H new ATOM 0 HD2 TYR A 19 18.413 -3.350 1.404 1.00 0.00 H new ATOM 0 HE1 TYR A 19 13.599 -2.574 2.048 1.00 0.00 H new ATOM 0 HE2 TYR A 19 17.563 -2.688 3.609 1.00 0.00 H new ATOM 0 HH TYR A 19 15.802 -2.165 4.833 1.00 0.00 H new ATOM 300 N PRO A 20 19.261 -2.036 -2.374 1.00 0.00 N ATOM 301 CA PRO A 20 19.426 -1.537 -0.997 1.00 0.00 C ATOM 302 C PRO A 20 18.655 -0.248 -0.706 1.00 0.00 C ATOM 303 O PRO A 20 18.669 0.243 0.421 1.00 0.00 O ATOM 304 CB PRO A 20 20.937 -1.279 -0.876 1.00 0.00 C ATOM 305 CG PRO A 20 21.550 -1.855 -2.111 1.00 0.00 C ATOM 306 CD PRO A 20 20.479 -1.825 -3.159 1.00 0.00 C ATOM 0 HA PRO A 20 19.032 -2.259 -0.282 1.00 0.00 H new ATOM 0 HB2 PRO A 20 21.146 -0.212 -0.797 1.00 0.00 H new ATOM 0 HB3 PRO A 20 21.344 -1.751 0.019 1.00 0.00 H new ATOM 0 HG2 PRO A 20 22.417 -1.273 -2.423 1.00 0.00 H new ATOM 0 HG3 PRO A 20 21.896 -2.874 -1.936 1.00 0.00 H new ATOM 0 HD2 PRO A 20 20.459 -0.874 -3.691 1.00 0.00 H new ATOM 0 HD3 PRO A 20 20.620 -2.606 -3.906 1.00 0.00 H new ATOM 314 N GLU A 21 17.998 0.304 -1.719 1.00 0.00 N ATOM 315 CA GLU A 21 17.250 1.544 -1.554 1.00 0.00 C ATOM 316 C GLU A 21 15.942 1.299 -0.805 1.00 0.00 C ATOM 317 O GLU A 21 15.537 0.154 -0.597 1.00 0.00 O ATOM 318 CB GLU A 21 16.962 2.176 -2.911 1.00 0.00 C ATOM 319 CG GLU A 21 18.210 2.426 -3.734 1.00 0.00 C ATOM 320 CD GLU A 21 17.907 3.119 -5.040 1.00 0.00 C ATOM 321 OE1 GLU A 21 17.304 2.482 -5.927 1.00 0.00 O ATOM 322 OE2 GLU A 21 18.258 4.311 -5.181 1.00 0.00 O ATOM 0 H GLU A 21 17.968 -0.086 -2.661 1.00 0.00 H new ATOM 0 HA GLU A 21 17.861 2.229 -0.965 1.00 0.00 H new ATOM 0 HB2 GLU A 21 16.290 1.526 -3.471 1.00 0.00 H new ATOM 0 HB3 GLU A 21 16.439 3.121 -2.760 1.00 0.00 H new ATOM 0 HG2 GLU A 21 18.907 3.033 -3.157 1.00 0.00 H new ATOM 0 HG3 GLU A 21 18.705 1.476 -3.936 1.00 0.00 H new ATOM 329 N GLU A 22 15.279 2.379 -0.415 1.00 0.00 N ATOM 330 CA GLU A 22 14.039 2.288 0.343 1.00 0.00 C ATOM 331 C GLU A 22 12.845 2.266 -0.606 1.00 0.00 C ATOM 332 O GLU A 22 12.726 3.126 -1.483 1.00 0.00 O ATOM 333 CB GLU A 22 13.926 3.473 1.306 1.00 0.00 C ATOM 334 CG GLU A 22 12.814 3.331 2.337 1.00 0.00 C ATOM 335 CD GLU A 22 12.696 4.543 3.237 1.00 0.00 C ATOM 336 OE1 GLU A 22 13.677 5.308 3.346 1.00 0.00 O ATOM 337 OE2 GLU A 22 11.613 4.757 3.822 1.00 0.00 O ATOM 0 H GLU A 22 15.581 3.333 -0.612 1.00 0.00 H new ATOM 0 HA GLU A 22 14.045 1.364 0.921 1.00 0.00 H new ATOM 0 HB2 GLU A 22 14.876 3.597 1.826 1.00 0.00 H new ATOM 0 HB3 GLU A 22 13.758 4.382 0.729 1.00 0.00 H new ATOM 0 HG2 GLU A 22 11.866 3.171 1.824 1.00 0.00 H new ATOM 0 HG3 GLU A 22 13.000 2.447 2.947 1.00 0.00 H new ATOM 344 N GLY A 23 11.965 1.288 -0.433 1.00 0.00 N ATOM 345 CA GLY A 23 10.832 1.153 -1.328 1.00 0.00 C ATOM 346 C GLY A 23 9.500 1.105 -0.607 1.00 0.00 C ATOM 347 O GLY A 23 8.719 0.174 -0.803 1.00 0.00 O ATOM 0 H GLY A 23 12.015 0.589 0.308 1.00 0.00 H new ATOM 0 HA2 GLY A 23 10.829 1.989 -2.027 1.00 0.00 H new ATOM 0 HA3 GLY A 23 10.951 0.244 -1.918 1.00 0.00 H new ATOM 351 N CYS A 24 9.236 2.101 0.225 1.00 0.00 N ATOM 352 CA CYS A 24 7.952 2.211 0.905 1.00 0.00 C ATOM 353 C CYS A 24 6.929 2.900 -0.003 1.00 0.00 C ATOM 354 O CYS A 24 7.242 3.224 -1.151 1.00 0.00 O ATOM 355 CB CYS A 24 8.124 2.978 2.218 1.00 0.00 C ATOM 356 SG CYS A 24 9.111 4.488 2.067 1.00 0.00 S ATOM 0 H CYS A 24 9.895 2.847 0.447 1.00 0.00 H new ATOM 0 HA CYS A 24 7.581 1.212 1.135 1.00 0.00 H new ATOM 0 HB2 CYS A 24 7.139 3.238 2.607 1.00 0.00 H new ATOM 0 HB3 CYS A 24 8.593 2.322 2.951 1.00 0.00 H new ATOM 0 HG CYS A 24 10.087 4.456 2.926 1.00 0.00 H new ATOM 362 N GLY A 25 5.712 3.109 0.493 1.00 0.00 N ATOM 363 CA GLY A 25 4.707 3.797 -0.296 1.00 0.00 C ATOM 364 C GLY A 25 3.305 3.633 0.262 1.00 0.00 C ATOM 365 O GLY A 25 3.126 3.241 1.413 1.00 0.00 O ATOM 0 H GLY A 25 5.406 2.816 1.421 1.00 0.00 H new ATOM 0 HA2 GLY A 25 4.952 4.858 -0.343 1.00 0.00 H new ATOM 0 HA3 GLY A 25 4.733 3.419 -1.318 1.00 0.00 H new ATOM 369 N PHE A 26 2.310 3.921 -0.568 1.00 0.00 N ATOM 370 CA PHE A 26 0.911 3.834 -0.160 1.00 0.00 C ATOM 371 C PHE A 26 0.189 2.772 -0.982 1.00 0.00 C ATOM 372 O PHE A 26 0.651 2.391 -2.061 1.00 0.00 O ATOM 373 CB PHE A 26 0.202 5.187 -0.329 1.00 0.00 C ATOM 374 CG PHE A 26 0.575 6.229 0.691 1.00 0.00 C ATOM 375 CD1 PHE A 26 1.875 6.701 0.790 1.00 0.00 C ATOM 376 CD2 PHE A 26 -0.387 6.748 1.541 1.00 0.00 C ATOM 377 CE1 PHE A 26 2.207 7.669 1.719 1.00 0.00 C ATOM 378 CE2 PHE A 26 -0.061 7.715 2.473 1.00 0.00 C ATOM 379 CZ PHE A 26 1.238 8.176 2.563 1.00 0.00 C ATOM 0 H PHE A 26 2.446 4.219 -1.534 1.00 0.00 H new ATOM 0 HA PHE A 26 0.884 3.558 0.894 1.00 0.00 H new ATOM 0 HB2 PHE A 26 0.425 5.576 -1.323 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -0.875 5.025 -0.284 1.00 0.00 H new ATOM 0 HD1 PHE A 26 2.637 6.308 0.134 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -1.405 6.393 1.475 1.00 0.00 H new ATOM 0 HE1 PHE A 26 3.223 8.029 1.785 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -0.821 8.110 3.130 1.00 0.00 H new ATOM 0 HZ PHE A 26 1.495 8.931 3.291 1.00 0.00 H new ATOM 389 N LEU A 27 -0.949 2.315 -0.480 1.00 0.00 N ATOM 390 CA LEU A 27 -1.723 1.268 -1.136 1.00 0.00 C ATOM 391 C LEU A 27 -2.848 1.868 -1.972 1.00 0.00 C ATOM 392 O LEU A 27 -3.574 2.752 -1.510 1.00 0.00 O ATOM 393 CB LEU A 27 -2.319 0.321 -0.093 1.00 0.00 C ATOM 394 CG LEU A 27 -1.307 -0.387 0.811 1.00 0.00 C ATOM 395 CD1 LEU A 27 -2.026 -1.168 1.898 1.00 0.00 C ATOM 396 CD2 LEU A 27 -0.413 -1.311 0.001 1.00 0.00 C ATOM 0 H LEU A 27 -1.361 2.656 0.388 1.00 0.00 H new ATOM 0 HA LEU A 27 -1.052 0.714 -1.792 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.007 0.887 0.535 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -2.909 -0.436 -0.610 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.680 0.371 1.280 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -1.294 -1.666 2.533 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -2.625 -0.485 2.501 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -2.676 -1.914 1.441 1.00 0.00 H new ATOM 0 HD21 LEU A 27 0.298 -1.803 0.665 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.024 -2.063 -0.498 1.00 0.00 H new ATOM 0 HD23 LEU A 27 0.129 -0.730 -0.745 1.00 0.00 H new ATOM 408 N LEU A 28 -2.993 1.382 -3.196 1.00 0.00 N ATOM 409 CA LEU A 28 -4.055 1.841 -4.077 1.00 0.00 C ATOM 410 C LEU A 28 -5.054 0.715 -4.306 1.00 0.00 C ATOM 411 O LEU A 28 -4.667 -0.437 -4.525 1.00 0.00 O ATOM 412 CB LEU A 28 -3.477 2.312 -5.416 1.00 0.00 C ATOM 413 CG LEU A 28 -2.407 3.404 -5.320 1.00 0.00 C ATOM 414 CD1 LEU A 28 -1.867 3.741 -6.700 1.00 0.00 C ATOM 415 CD2 LEU A 28 -2.970 4.648 -4.649 1.00 0.00 C ATOM 0 H LEU A 28 -2.387 0.669 -3.602 1.00 0.00 H new ATOM 0 HA LEU A 28 -4.563 2.683 -3.606 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.049 1.452 -5.931 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -4.294 2.681 -6.036 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.586 3.028 -4.710 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.108 4.518 -6.614 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.425 2.850 -7.145 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -2.681 4.097 -7.332 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -2.195 5.412 -4.590 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.810 5.027 -5.231 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.309 4.397 -3.644 1.00 0.00 H new ATOM 427 N GLY A 29 -6.333 1.037 -4.247 1.00 0.00 N ATOM 428 CA GLY A 29 -7.350 0.028 -4.444 1.00 0.00 C ATOM 429 C GLY A 29 -8.740 0.611 -4.408 1.00 0.00 C ATOM 430 O GLY A 29 -8.932 1.774 -4.740 1.00 0.00 O ATOM 0 H GLY A 29 -6.686 1.977 -4.067 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -7.189 -0.466 -5.402 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -7.257 -0.736 -3.672 1.00 0.00 H new ATOM 434 N THR A 30 -9.707 -0.194 -4.018 1.00 0.00 N ATOM 435 CA THR A 30 -11.086 0.254 -3.938 1.00 0.00 C ATOM 436 C THR A 30 -11.743 -0.223 -2.653 1.00 0.00 C ATOM 437 O THR A 30 -11.282 -1.183 -2.030 1.00 0.00 O ATOM 438 CB THR A 30 -11.900 -0.242 -5.145 1.00 0.00 C ATOM 439 OG1 THR A 30 -11.375 -1.497 -5.600 1.00 0.00 O ATOM 440 CG2 THR A 30 -11.873 0.771 -6.278 1.00 0.00 C ATOM 0 H THR A 30 -9.564 -1.168 -3.750 1.00 0.00 H new ATOM 0 HA THR A 30 -11.072 1.344 -3.944 1.00 0.00 H new ATOM 0 HB THR A 30 -12.935 -0.371 -4.830 1.00 0.00 H new ATOM 0 HG1 THR A 30 -10.842 -1.354 -6.410 1.00 0.00 H new ATOM 0 HG21 THR A 30 -12.457 0.393 -7.118 1.00 0.00 H new ATOM 0 HG22 THR A 30 -12.300 1.713 -5.934 1.00 0.00 H new ATOM 0 HG23 THR A 30 -10.843 0.934 -6.596 1.00 0.00 H new ATOM 448 N VAL A 31 -12.809 0.452 -2.255 1.00 0.00 N ATOM 449 CA VAL A 31 -13.557 0.070 -1.069 1.00 0.00 C ATOM 450 C VAL A 31 -14.731 -0.819 -1.460 1.00 0.00 C ATOM 451 O VAL A 31 -15.474 -0.505 -2.388 1.00 0.00 O ATOM 452 CB VAL A 31 -14.076 1.305 -0.298 1.00 0.00 C ATOM 453 CG1 VAL A 31 -14.806 0.888 0.971 1.00 0.00 C ATOM 454 CG2 VAL A 31 -12.931 2.252 0.031 1.00 0.00 C ATOM 0 H VAL A 31 -13.177 1.271 -2.739 1.00 0.00 H new ATOM 0 HA VAL A 31 -12.880 -0.477 -0.413 1.00 0.00 H new ATOM 0 HB VAL A 31 -14.784 1.830 -0.939 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -15.161 1.775 1.495 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -15.655 0.256 0.711 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -14.125 0.334 1.617 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -13.317 3.115 0.574 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -12.196 1.734 0.648 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -12.458 2.586 -0.893 1.00 0.00 H new ATOM 464 N THR A 32 -14.880 -1.938 -0.767 1.00 0.00 N ATOM 465 CA THR A 32 -15.964 -2.868 -1.040 1.00 0.00 C ATOM 466 C THR A 32 -17.220 -2.466 -0.275 1.00 0.00 C ATOM 467 O THR A 32 -17.148 -1.679 0.672 1.00 0.00 O ATOM 468 CB THR A 32 -15.570 -4.313 -0.665 1.00 0.00 C ATOM 469 OG1 THR A 32 -15.150 -4.374 0.704 1.00 0.00 O ATOM 470 CG2 THR A 32 -14.456 -4.822 -1.569 1.00 0.00 C ATOM 0 H THR A 32 -14.261 -2.224 -0.009 1.00 0.00 H new ATOM 0 HA THR A 32 -16.167 -2.831 -2.110 1.00 0.00 H new ATOM 0 HB THR A 32 -16.445 -4.949 -0.800 1.00 0.00 H new ATOM 0 HG1 THR A 32 -14.289 -3.916 0.803 1.00 0.00 H new ATOM 0 HG21 THR A 32 -14.195 -5.842 -1.286 1.00 0.00 H new ATOM 0 HG22 THR A 32 -14.793 -4.808 -2.605 1.00 0.00 H new ATOM 0 HG23 THR A 32 -13.581 -4.181 -1.464 1.00 0.00 H new ATOM 478 N ASP A 33 -18.361 -3.017 -0.671 1.00 0.00 N ATOM 479 CA ASP A 33 -19.640 -2.667 -0.055 1.00 0.00 C ATOM 480 C ASP A 33 -19.695 -3.093 1.409 1.00 0.00 C ATOM 481 O ASP A 33 -20.579 -2.668 2.154 1.00 0.00 O ATOM 482 CB ASP A 33 -20.808 -3.303 -0.809 1.00 0.00 C ATOM 483 CG ASP A 33 -21.014 -2.710 -2.188 1.00 0.00 C ATOM 484 OD1 ASP A 33 -20.837 -1.485 -2.349 1.00 0.00 O ATOM 485 OD2 ASP A 33 -21.373 -3.466 -3.111 1.00 0.00 O ATOM 0 H ASP A 33 -18.429 -3.709 -1.417 1.00 0.00 H new ATOM 0 HA ASP A 33 -19.727 -1.582 -0.107 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -20.633 -4.375 -0.903 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -21.721 -3.179 -0.226 1.00 0.00 H new ATOM 490 N ASP A 34 -18.755 -3.935 1.814 1.00 0.00 N ATOM 491 CA ASP A 34 -18.688 -4.402 3.195 1.00 0.00 C ATOM 492 C ASP A 34 -18.079 -3.341 4.098 1.00 0.00 C ATOM 493 O ASP A 34 -18.151 -3.441 5.322 1.00 0.00 O ATOM 494 CB ASP A 34 -17.861 -5.688 3.298 1.00 0.00 C ATOM 495 CG ASP A 34 -18.478 -6.847 2.548 1.00 0.00 C ATOM 496 OD1 ASP A 34 -19.562 -7.319 2.954 1.00 0.00 O ATOM 497 OD2 ASP A 34 -17.875 -7.306 1.561 1.00 0.00 O ATOM 0 H ASP A 34 -18.027 -4.310 1.207 1.00 0.00 H new ATOM 0 HA ASP A 34 -19.708 -4.606 3.520 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -16.860 -5.502 2.909 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -17.750 -5.959 4.348 1.00 0.00 H new ATOM 502 N GLY A 35 -17.490 -2.319 3.493 1.00 0.00 N ATOM 503 CA GLY A 35 -16.785 -1.311 4.261 1.00 0.00 C ATOM 504 C GLY A 35 -15.339 -1.700 4.484 1.00 0.00 C ATOM 505 O GLY A 35 -14.669 -1.177 5.374 1.00 0.00 O ATOM 0 H GLY A 35 -17.487 -2.169 2.484 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -16.830 -0.355 3.739 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -17.279 -1.172 5.223 1.00 0.00 H new ATOM 509 N ASP A 36 -14.873 -2.632 3.668 1.00 0.00 N ATOM 510 CA ASP A 36 -13.504 -3.122 3.747 1.00 0.00 C ATOM 511 C ASP A 36 -12.780 -2.791 2.447 1.00 0.00 C ATOM 512 O ASP A 36 -13.422 -2.526 1.431 1.00 0.00 O ATOM 513 CB ASP A 36 -13.507 -4.632 4.017 1.00 0.00 C ATOM 514 CG ASP A 36 -12.118 -5.219 4.169 1.00 0.00 C ATOM 515 OD1 ASP A 36 -11.215 -4.516 4.653 1.00 0.00 O ATOM 516 OD2 ASP A 36 -11.929 -6.405 3.816 1.00 0.00 O ATOM 0 H ASP A 36 -15.430 -3.070 2.934 1.00 0.00 H new ATOM 0 HA ASP A 36 -12.978 -2.637 4.570 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.078 -4.830 4.924 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -14.020 -5.139 3.200 1.00 0.00 H new ATOM 521 N ASN A 37 -11.462 -2.806 2.465 1.00 0.00 N ATOM 522 CA ASN A 37 -10.693 -2.338 1.318 1.00 0.00 C ATOM 523 C ASN A 37 -10.072 -3.486 0.528 1.00 0.00 C ATOM 524 O ASN A 37 -9.738 -4.543 1.070 1.00 0.00 O ATOM 525 CB ASN A 37 -9.615 -1.333 1.752 1.00 0.00 C ATOM 526 CG ASN A 37 -8.738 -1.825 2.893 1.00 0.00 C ATOM 527 OD1 ASN A 37 -8.482 -3.020 3.042 1.00 0.00 O ATOM 528 ND2 ASN A 37 -8.270 -0.896 3.710 1.00 0.00 N ATOM 0 H ASN A 37 -10.901 -3.133 3.251 1.00 0.00 H new ATOM 0 HA ASN A 37 -11.394 -1.833 0.653 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -8.983 -1.100 0.895 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -10.099 -0.404 2.053 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -7.675 -1.160 4.495 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -8.504 0.085 3.555 1.00 0.00 H new ATOM 535 N ARG A 38 -9.963 -3.273 -0.775 1.00 0.00 N ATOM 536 CA ARG A 38 -9.293 -4.201 -1.670 1.00 0.00 C ATOM 537 C ARG A 38 -8.069 -3.528 -2.281 1.00 0.00 C ATOM 538 O ARG A 38 -8.201 -2.610 -3.092 1.00 0.00 O ATOM 539 CB ARG A 38 -10.250 -4.655 -2.778 1.00 0.00 C ATOM 540 CG ARG A 38 -9.597 -5.540 -3.830 1.00 0.00 C ATOM 541 CD ARG A 38 -10.565 -5.890 -4.950 1.00 0.00 C ATOM 542 NE ARG A 38 -11.113 -4.696 -5.600 1.00 0.00 N ATOM 543 CZ ARG A 38 -11.269 -4.565 -6.919 1.00 0.00 C ATOM 544 NH1 ARG A 38 -10.847 -5.514 -7.741 1.00 0.00 N ATOM 545 NH2 ARG A 38 -11.822 -3.463 -7.411 1.00 0.00 N ATOM 0 H ARG A 38 -10.339 -2.448 -1.242 1.00 0.00 H new ATOM 0 HA ARG A 38 -8.977 -5.077 -1.103 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -11.082 -5.196 -2.327 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -10.669 -3.775 -3.266 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -8.728 -5.030 -4.246 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -9.236 -6.456 -3.362 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -10.054 -6.503 -5.692 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -11.381 -6.490 -4.548 1.00 0.00 H new ATOM 0 HE ARG A 38 -11.393 -3.915 -5.006 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -10.400 -6.351 -7.367 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -10.969 -5.408 -8.748 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -12.126 -2.720 -6.782 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -11.943 -3.359 -8.418 1.00 0.00 H new ATOM 559 N VAL A 39 -6.885 -3.970 -1.882 1.00 0.00 N ATOM 560 CA VAL A 39 -5.647 -3.412 -2.412 1.00 0.00 C ATOM 561 C VAL A 39 -5.302 -4.088 -3.730 1.00 0.00 C ATOM 562 O VAL A 39 -5.088 -5.302 -3.778 1.00 0.00 O ATOM 563 CB VAL A 39 -4.471 -3.580 -1.428 1.00 0.00 C ATOM 564 CG1 VAL A 39 -3.194 -2.975 -1.999 1.00 0.00 C ATOM 565 CG2 VAL A 39 -4.808 -2.957 -0.080 1.00 0.00 C ATOM 0 H VAL A 39 -6.754 -4.712 -1.194 1.00 0.00 H new ATOM 0 HA VAL A 39 -5.807 -2.345 -2.566 1.00 0.00 H new ATOM 0 HB VAL A 39 -4.301 -4.646 -1.280 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.379 -3.106 -1.287 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.942 -3.474 -2.935 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -3.346 -1.912 -2.184 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -3.966 -3.085 0.601 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.010 -1.894 -0.211 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -5.689 -3.445 0.336 1.00 0.00 H new ATOM 575 N ALA A 40 -5.254 -3.298 -4.792 1.00 0.00 N ATOM 576 CA ALA A 40 -5.060 -3.840 -6.128 1.00 0.00 C ATOM 577 C ALA A 40 -3.802 -3.301 -6.802 1.00 0.00 C ATOM 578 O ALA A 40 -3.295 -3.905 -7.745 1.00 0.00 O ATOM 579 CB ALA A 40 -6.281 -3.547 -6.985 1.00 0.00 C ATOM 0 H ALA A 40 -5.346 -2.283 -4.755 1.00 0.00 H new ATOM 0 HA ALA A 40 -4.929 -4.917 -6.026 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.130 -3.955 -7.984 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -7.161 -4.006 -6.534 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.429 -2.469 -7.052 1.00 0.00 H new ATOM 585 N ALA A 41 -3.298 -2.166 -6.328 1.00 0.00 N ATOM 586 CA ALA A 41 -2.141 -1.543 -6.961 1.00 0.00 C ATOM 587 C ALA A 41 -1.156 -0.995 -5.933 1.00 0.00 C ATOM 588 O ALA A 41 -1.549 -0.479 -4.882 1.00 0.00 O ATOM 589 CB ALA A 41 -2.589 -0.436 -7.907 1.00 0.00 C ATOM 0 H ALA A 41 -3.666 -1.665 -5.519 1.00 0.00 H new ATOM 0 HA ALA A 41 -1.624 -2.315 -7.531 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -1.715 0.020 -8.373 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -3.234 -0.856 -8.679 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -3.139 0.321 -7.347 1.00 0.00 H new ATOM 595 N LEU A 42 0.126 -1.107 -6.249 1.00 0.00 N ATOM 596 CA LEU A 42 1.190 -0.611 -5.388 1.00 0.00 C ATOM 597 C LEU A 42 1.955 0.499 -6.100 1.00 0.00 C ATOM 598 O LEU A 42 1.954 0.564 -7.330 1.00 0.00 O ATOM 599 CB LEU A 42 2.161 -1.744 -5.041 1.00 0.00 C ATOM 600 CG LEU A 42 1.526 -2.991 -4.425 1.00 0.00 C ATOM 601 CD1 LEU A 42 2.561 -4.089 -4.278 1.00 0.00 C ATOM 602 CD2 LEU A 42 0.902 -2.669 -3.077 1.00 0.00 C ATOM 0 H LEU A 42 0.458 -1.544 -7.109 1.00 0.00 H new ATOM 0 HA LEU A 42 0.744 -0.223 -4.472 1.00 0.00 H new ATOM 0 HB2 LEU A 42 2.689 -2.037 -5.949 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.909 -1.358 -4.348 1.00 0.00 H new ATOM 0 HG LEU A 42 0.737 -3.339 -5.092 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.096 -4.971 -3.838 1.00 0.00 H new ATOM 0 HD12 LEU A 42 2.965 -4.342 -5.258 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.368 -3.744 -3.632 1.00 0.00 H new ATOM 0 HD21 LEU A 42 0.456 -3.571 -2.658 1.00 0.00 H new ATOM 0 HD22 LEU A 42 1.670 -2.295 -2.400 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.131 -1.909 -3.205 1.00 0.00 H new ATOM 614 N HIS A 43 2.598 1.380 -5.341 1.00 0.00 N ATOM 615 CA HIS A 43 3.460 2.388 -5.933 1.00 0.00 C ATOM 616 C HIS A 43 4.601 2.734 -4.982 1.00 0.00 C ATOM 617 O HIS A 43 4.514 2.488 -3.777 1.00 0.00 O ATOM 618 CB HIS A 43 2.667 3.648 -6.321 1.00 0.00 C ATOM 619 CG HIS A 43 2.318 4.556 -5.179 1.00 0.00 C ATOM 620 ND1 HIS A 43 1.209 4.374 -4.382 1.00 0.00 N ATOM 621 CD2 HIS A 43 2.934 5.669 -4.711 1.00 0.00 C ATOM 622 CE1 HIS A 43 1.158 5.336 -3.481 1.00 0.00 C ATOM 623 NE2 HIS A 43 2.192 6.129 -3.658 1.00 0.00 N ATOM 0 H HIS A 43 2.538 1.414 -4.323 1.00 0.00 H new ATOM 0 HA HIS A 43 3.884 1.975 -6.848 1.00 0.00 H new ATOM 0 HB2 HIS A 43 3.247 4.213 -7.050 1.00 0.00 H new ATOM 0 HB3 HIS A 43 1.746 3.341 -6.816 1.00 0.00 H new ATOM 0 HD2 HIS A 43 3.841 6.110 -5.097 1.00 0.00 H new ATOM 0 HE1 HIS A 43 0.395 5.453 -2.725 1.00 0.00 H new ATOM 0 HE2 HIS A 43 2.406 6.955 -3.099 1.00 0.00 H new ATOM 632 N ARG A 44 5.660 3.303 -5.531 1.00 0.00 N ATOM 633 CA ARG A 44 6.834 3.670 -4.755 1.00 0.00 C ATOM 634 C ARG A 44 6.657 5.071 -4.186 1.00 0.00 C ATOM 635 O ARG A 44 6.137 5.949 -4.873 1.00 0.00 O ATOM 636 CB ARG A 44 8.075 3.619 -5.650 1.00 0.00 C ATOM 637 CG ARG A 44 8.222 2.306 -6.411 1.00 0.00 C ATOM 638 CD ARG A 44 9.165 2.444 -7.600 1.00 0.00 C ATOM 639 NE ARG A 44 8.737 3.511 -8.507 1.00 0.00 N ATOM 640 CZ ARG A 44 7.931 3.330 -9.559 1.00 0.00 C ATOM 641 NH1 ARG A 44 7.509 2.114 -9.888 1.00 0.00 N ATOM 642 NH2 ARG A 44 7.546 4.370 -10.289 1.00 0.00 N ATOM 0 H ARG A 44 5.731 3.524 -6.524 1.00 0.00 H new ATOM 0 HA ARG A 44 6.959 2.968 -3.931 1.00 0.00 H new ATOM 0 HB2 ARG A 44 8.032 4.441 -6.364 1.00 0.00 H new ATOM 0 HB3 ARG A 44 8.962 3.776 -5.037 1.00 0.00 H new ATOM 0 HG2 ARG A 44 8.597 1.535 -5.737 1.00 0.00 H new ATOM 0 HG3 ARG A 44 7.243 1.976 -6.760 1.00 0.00 H new ATOM 0 HD2 ARG A 44 10.174 2.652 -7.243 1.00 0.00 H new ATOM 0 HD3 ARG A 44 9.208 1.500 -8.143 1.00 0.00 H new ATOM 0 HE ARG A 44 9.076 4.455 -8.324 1.00 0.00 H new ATOM 0 HH11 ARG A 44 7.799 1.307 -9.336 1.00 0.00 H new ATOM 0 HH12 ARG A 44 6.895 1.988 -10.692 1.00 0.00 H new ATOM 0 HH21 ARG A 44 7.865 5.308 -10.048 1.00 0.00 H new ATOM 0 HH22 ARG A 44 6.931 4.231 -11.091 1.00 0.00 H new ATOM 656 N ALA A 45 7.044 5.259 -2.926 1.00 0.00 N ATOM 657 CA ALA A 45 6.969 6.567 -2.279 1.00 0.00 C ATOM 658 C ALA A 45 7.648 7.625 -3.136 1.00 0.00 C ATOM 659 O ALA A 45 8.865 7.592 -3.330 1.00 0.00 O ATOM 660 CB ALA A 45 7.601 6.520 -0.895 1.00 0.00 C ATOM 0 H ALA A 45 7.414 4.518 -2.331 1.00 0.00 H new ATOM 0 HA ALA A 45 5.918 6.833 -2.167 1.00 0.00 H new ATOM 0 HB1 ALA A 45 7.534 7.504 -0.431 1.00 0.00 H new ATOM 0 HB2 ALA A 45 7.074 5.792 -0.279 1.00 0.00 H new ATOM 0 HB3 ALA A 45 8.648 6.230 -0.983 1.00 0.00 H new ATOM 962 N ASP A 63 3.858 12.383 -1.711 1.00 0.00 N ATOM 963 CA ASP A 63 3.471 11.155 -2.407 1.00 0.00 C ATOM 964 C ASP A 63 1.956 11.001 -2.483 1.00 0.00 C ATOM 965 O ASP A 63 1.424 10.564 -3.502 1.00 0.00 O ATOM 966 CB ASP A 63 4.066 9.931 -1.707 1.00 0.00 C ATOM 967 CG ASP A 63 3.635 8.629 -2.359 1.00 0.00 C ATOM 968 OD1 ASP A 63 4.262 8.222 -3.356 1.00 0.00 O ATOM 969 OD2 ASP A 63 2.669 8.005 -1.879 1.00 0.00 O ATOM 0 HA ASP A 63 3.862 11.226 -3.422 1.00 0.00 H new ATOM 0 HB2 ASP A 63 5.154 10.000 -1.722 1.00 0.00 H new ATOM 0 HB3 ASP A 63 3.761 9.929 -0.661 1.00 0.00 H new ATOM 974 N TYR A 64 1.268 11.380 -1.408 1.00 0.00 N ATOM 975 CA TYR A 64 -0.180 11.224 -1.329 1.00 0.00 C ATOM 976 C TYR A 64 -0.875 11.905 -2.503 1.00 0.00 C ATOM 977 O TYR A 64 -1.797 11.347 -3.084 1.00 0.00 O ATOM 978 CB TYR A 64 -0.715 11.781 -0.007 1.00 0.00 C ATOM 979 CG TYR A 64 -2.220 11.684 0.121 1.00 0.00 C ATOM 980 CD1 TYR A 64 -2.835 10.476 0.428 1.00 0.00 C ATOM 981 CD2 TYR A 64 -3.028 12.799 -0.074 1.00 0.00 C ATOM 982 CE1 TYR A 64 -4.210 10.380 0.533 1.00 0.00 C ATOM 983 CE2 TYR A 64 -4.402 12.711 0.031 1.00 0.00 C ATOM 984 CZ TYR A 64 -4.988 11.500 0.335 1.00 0.00 C ATOM 985 OH TYR A 64 -6.360 11.413 0.431 1.00 0.00 O ATOM 0 H TYR A 64 1.692 11.798 -0.580 1.00 0.00 H new ATOM 0 HA TYR A 64 -0.398 10.157 -1.375 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -0.252 11.242 0.820 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -0.416 12.825 0.086 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -2.228 9.597 0.587 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -2.573 13.749 -0.311 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -4.672 9.433 0.769 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -5.015 13.586 -0.124 1.00 0.00 H new ATOM 0 HH TYR A 64 -6.756 12.294 0.264 1.00 0.00 H new ATOM 995 N ARG A 65 -0.427 13.105 -2.853 1.00 0.00 N ATOM 996 CA ARG A 65 -1.037 13.862 -3.937 1.00 0.00 C ATOM 997 C ARG A 65 -0.813 13.187 -5.287 1.00 0.00 C ATOM 998 O ARG A 65 -1.698 13.177 -6.143 1.00 0.00 O ATOM 999 CB ARG A 65 -0.493 15.284 -3.941 1.00 0.00 C ATOM 1000 CG ARG A 65 -0.948 16.082 -2.731 1.00 0.00 C ATOM 1001 CD ARG A 65 -0.371 17.485 -2.716 1.00 0.00 C ATOM 1002 NE ARG A 65 -0.629 18.152 -1.444 1.00 0.00 N ATOM 1003 CZ ARG A 65 0.328 18.530 -0.599 1.00 0.00 C ATOM 1004 NH1 ARG A 65 1.602 18.349 -0.920 1.00 0.00 N ATOM 1005 NH2 ARG A 65 0.010 19.069 0.568 1.00 0.00 N ATOM 0 H ARG A 65 0.358 13.574 -2.401 1.00 0.00 H new ATOM 0 HA ARG A 65 -2.114 13.895 -3.770 1.00 0.00 H new ATOM 0 HB2 ARG A 65 0.596 15.253 -3.964 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -0.817 15.791 -4.850 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -2.036 16.139 -2.725 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -0.651 15.560 -1.822 1.00 0.00 H new ATOM 0 HD2 ARG A 65 0.703 17.440 -2.894 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -0.805 18.067 -3.529 1.00 0.00 H new ATOM 0 HE ARG A 65 -1.598 18.339 -1.187 1.00 0.00 H new ATOM 0 HH11 ARG A 65 1.847 17.921 -1.813 1.00 0.00 H new ATOM 0 HH12 ARG A 65 2.337 18.638 -0.274 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -0.970 19.195 0.821 1.00 0.00 H new ATOM 0 HH22 ARG A 65 0.745 19.358 1.214 1.00 0.00 H new ATOM 1019 N ALA A 66 0.372 12.629 -5.472 1.00 0.00 N ATOM 1020 CA ALA A 66 0.685 11.895 -6.692 1.00 0.00 C ATOM 1021 C ALA A 66 -0.103 10.593 -6.742 1.00 0.00 C ATOM 1022 O ALA A 66 -0.631 10.210 -7.788 1.00 0.00 O ATOM 1023 CB ALA A 66 2.179 11.620 -6.779 1.00 0.00 C ATOM 0 H ALA A 66 1.134 12.669 -4.795 1.00 0.00 H new ATOM 0 HA ALA A 66 0.399 12.505 -7.548 1.00 0.00 H new ATOM 0 HB1 ALA A 66 2.395 11.071 -7.696 1.00 0.00 H new ATOM 0 HB2 ALA A 66 2.723 12.564 -6.785 1.00 0.00 H new ATOM 0 HB3 ALA A 66 2.490 11.027 -5.919 1.00 0.00 H new ATOM 1029 N ALA A 67 -0.184 9.923 -5.598 1.00 0.00 N ATOM 1030 CA ALA A 67 -0.967 8.706 -5.477 1.00 0.00 C ATOM 1031 C ALA A 67 -2.436 8.991 -5.733 1.00 0.00 C ATOM 1032 O ALA A 67 -3.119 8.208 -6.382 1.00 0.00 O ATOM 1033 CB ALA A 67 -0.784 8.092 -4.100 1.00 0.00 C ATOM 0 H ALA A 67 0.287 10.207 -4.739 1.00 0.00 H new ATOM 0 HA ALA A 67 -0.615 7.996 -6.225 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -1.378 7.181 -4.026 1.00 0.00 H new ATOM 0 HB2 ALA A 67 0.268 7.853 -3.945 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.111 8.801 -3.339 1.00 0.00 H new ATOM 1039 N ASP A 68 -2.899 10.123 -5.223 1.00 0.00 N ATOM 1040 CA ASP A 68 -4.283 10.553 -5.393 1.00 0.00 C ATOM 1041 C ASP A 68 -4.631 10.680 -6.870 1.00 0.00 C ATOM 1042 O ASP A 68 -5.681 10.219 -7.315 1.00 0.00 O ATOM 1043 CB ASP A 68 -4.490 11.895 -4.687 1.00 0.00 C ATOM 1044 CG ASP A 68 -5.932 12.360 -4.696 1.00 0.00 C ATOM 1045 OD1 ASP A 68 -6.718 11.879 -3.851 1.00 0.00 O ATOM 1046 OD2 ASP A 68 -6.280 13.227 -5.524 1.00 0.00 O ATOM 0 H ASP A 68 -2.328 10.770 -4.680 1.00 0.00 H new ATOM 0 HA ASP A 68 -4.941 9.804 -4.952 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -4.149 11.811 -3.655 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -3.869 12.650 -5.168 1.00 0.00 H new ATOM 1051 N ALA A 69 -3.730 11.293 -7.628 1.00 0.00 N ATOM 1052 CA ALA A 69 -3.931 11.468 -9.059 1.00 0.00 C ATOM 1053 C ALA A 69 -3.903 10.124 -9.787 1.00 0.00 C ATOM 1054 O ALA A 69 -4.820 9.801 -10.541 1.00 0.00 O ATOM 1055 CB ALA A 69 -2.877 12.405 -9.630 1.00 0.00 C ATOM 0 H ALA A 69 -2.854 11.677 -7.275 1.00 0.00 H new ATOM 0 HA ALA A 69 -4.915 11.912 -9.211 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -3.040 12.526 -10.701 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.949 13.376 -9.140 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -1.886 11.985 -9.459 1.00 0.00 H new ATOM 1061 N ALA A 70 -2.860 9.336 -9.533 1.00 0.00 N ATOM 1062 CA ALA A 70 -2.686 8.045 -10.194 1.00 0.00 C ATOM 1063 C ALA A 70 -3.810 7.082 -9.834 1.00 0.00 C ATOM 1064 O ALA A 70 -4.246 6.287 -10.664 1.00 0.00 O ATOM 1065 CB ALA A 70 -1.332 7.446 -9.831 1.00 0.00 C ATOM 0 H ALA A 70 -2.120 9.571 -8.871 1.00 0.00 H new ATOM 0 HA ALA A 70 -2.722 8.209 -11.271 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -1.214 6.484 -10.330 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -0.538 8.121 -10.151 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -1.274 7.305 -8.752 1.00 0.00 H new ATOM 1071 N ALA A 71 -4.286 7.158 -8.598 1.00 0.00 N ATOM 1072 CA ALA A 71 -5.387 6.317 -8.162 1.00 0.00 C ATOM 1073 C ALA A 71 -6.636 6.631 -8.969 1.00 0.00 C ATOM 1074 O ALA A 71 -7.240 5.735 -9.557 1.00 0.00 O ATOM 1075 CB ALA A 71 -5.659 6.505 -6.678 1.00 0.00 C ATOM 0 H ALA A 71 -3.927 7.792 -7.884 1.00 0.00 H new ATOM 0 HA ALA A 71 -5.109 5.276 -8.328 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -6.488 5.865 -6.376 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -4.769 6.239 -6.108 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -5.916 7.546 -6.484 1.00 0.00 H new ATOM 1081 N GLN A 72 -6.991 7.911 -9.026 1.00 0.00 N ATOM 1082 CA GLN A 72 -8.160 8.355 -9.774 1.00 0.00 C ATOM 1083 C GLN A 72 -8.037 7.963 -11.243 1.00 0.00 C ATOM 1084 O GLN A 72 -9.014 7.536 -11.863 1.00 0.00 O ATOM 1085 CB GLN A 72 -8.339 9.867 -9.639 1.00 0.00 C ATOM 1086 CG GLN A 72 -9.639 10.261 -8.958 1.00 0.00 C ATOM 1087 CD GLN A 72 -9.775 9.677 -7.563 1.00 0.00 C ATOM 1088 OE1 GLN A 72 -8.791 9.481 -6.852 1.00 0.00 O ATOM 1089 NE2 GLN A 72 -11.005 9.403 -7.156 1.00 0.00 N ATOM 0 H GLN A 72 -6.482 8.662 -8.560 1.00 0.00 H new ATOM 0 HA GLN A 72 -9.040 7.864 -9.359 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -7.502 10.276 -9.073 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -8.305 10.320 -10.630 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -9.698 11.348 -8.899 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -10.479 9.929 -9.569 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -11.798 9.579 -7.774 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -11.160 9.016 -6.225 1.00 0.00 H new ATOM 1098 N GLU A 73 -6.829 8.098 -11.782 1.00 0.00 N ATOM 1099 CA GLU A 73 -6.536 7.681 -13.145 1.00 0.00 C ATOM 1100 C GLU A 73 -6.869 6.212 -13.366 1.00 0.00 C ATOM 1101 O GLU A 73 -7.455 5.841 -14.384 1.00 0.00 O ATOM 1102 CB GLU A 73 -5.059 7.919 -13.443 1.00 0.00 C ATOM 1103 CG GLU A 73 -4.701 9.376 -13.642 1.00 0.00 C ATOM 1104 CD GLU A 73 -3.266 9.551 -14.085 1.00 0.00 C ATOM 1105 OE1 GLU A 73 -2.914 9.045 -15.174 1.00 0.00 O ATOM 1106 OE2 GLU A 73 -2.484 10.197 -13.357 1.00 0.00 O ATOM 0 H GLU A 73 -6.031 8.497 -11.288 1.00 0.00 H new ATOM 0 HA GLU A 73 -7.156 8.272 -13.819 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -4.464 7.517 -12.623 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -4.785 7.362 -14.339 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -5.366 9.814 -14.386 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -4.862 9.919 -12.711 1.00 0.00 H new ATOM 1113 N GLN A 74 -6.503 5.390 -12.400 1.00 0.00 N ATOM 1114 CA GLN A 74 -6.687 3.950 -12.496 1.00 0.00 C ATOM 1115 C GLN A 74 -8.088 3.517 -12.066 1.00 0.00 C ATOM 1116 O GLN A 74 -8.419 2.331 -12.123 1.00 0.00 O ATOM 1117 CB GLN A 74 -5.645 3.253 -11.628 1.00 0.00 C ATOM 1118 CG GLN A 74 -4.220 3.458 -12.114 1.00 0.00 C ATOM 1119 CD GLN A 74 -3.178 2.979 -11.121 1.00 0.00 C ATOM 1120 OE1 GLN A 74 -2.098 2.533 -11.507 1.00 0.00 O ATOM 1121 NE2 GLN A 74 -3.476 3.095 -9.836 1.00 0.00 N ATOM 0 H GLN A 74 -6.071 5.698 -11.529 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.565 3.666 -13.541 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -5.729 3.622 -10.606 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -5.861 2.185 -11.600 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -4.085 2.929 -13.057 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -4.060 4.517 -12.317 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -4.382 3.469 -9.554 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -2.799 2.810 -9.128 1.00 0.00 H new ATOM 1130 N GLY A 75 -8.905 4.471 -11.638 1.00 0.00 N ATOM 1131 CA GLY A 75 -10.243 4.148 -11.169 1.00 0.00 C ATOM 1132 C GLY A 75 -10.223 3.575 -9.766 1.00 0.00 C ATOM 1133 O GLY A 75 -11.121 2.827 -9.370 1.00 0.00 O ATOM 0 H GLY A 75 -8.667 5.462 -11.606 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -10.861 5.046 -11.187 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -10.703 3.431 -11.848 1.00 0.00 H new ATOM 1137 N LEU A 76 -9.192 3.936 -9.020 1.00 0.00 N ATOM 1138 CA LEU A 76 -8.994 3.456 -7.664 1.00 0.00 C ATOM 1139 C LEU A 76 -8.859 4.641 -6.713 1.00 0.00 C ATOM 1140 O LEU A 76 -8.959 5.794 -7.131 1.00 0.00 O ATOM 1141 CB LEU A 76 -7.725 2.595 -7.595 1.00 0.00 C ATOM 1142 CG LEU A 76 -7.694 1.385 -8.531 1.00 0.00 C ATOM 1143 CD1 LEU A 76 -6.348 0.682 -8.443 1.00 0.00 C ATOM 1144 CD2 LEU A 76 -8.819 0.416 -8.199 1.00 0.00 C ATOM 0 H LEU A 76 -8.464 4.575 -9.341 1.00 0.00 H new ATOM 0 HA LEU A 76 -9.853 2.853 -7.371 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -6.866 3.227 -7.820 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -7.602 2.243 -6.571 1.00 0.00 H new ATOM 0 HG LEU A 76 -7.838 1.739 -9.552 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -6.341 -0.177 -9.114 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -5.557 1.374 -8.731 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -6.180 0.344 -7.420 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -8.777 -0.436 -8.877 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -8.708 0.068 -7.172 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -9.779 0.921 -8.310 1.00 0.00 H new ATOM 1156 N ASP A 77 -8.646 4.352 -5.442 1.00 0.00 N ATOM 1157 CA ASP A 77 -8.355 5.379 -4.456 1.00 0.00 C ATOM 1158 C ASP A 77 -7.355 4.846 -3.433 1.00 0.00 C ATOM 1159 O ASP A 77 -7.035 3.653 -3.434 1.00 0.00 O ATOM 1160 CB ASP A 77 -9.637 5.870 -3.766 1.00 0.00 C ATOM 1161 CG ASP A 77 -10.421 4.776 -3.061 1.00 0.00 C ATOM 1162 OD1 ASP A 77 -11.293 4.145 -3.704 1.00 0.00 O ATOM 1163 OD2 ASP A 77 -10.211 4.578 -1.849 1.00 0.00 O ATOM 0 H ASP A 77 -8.669 3.405 -5.065 1.00 0.00 H new ATOM 0 HA ASP A 77 -7.914 6.234 -4.968 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -9.374 6.639 -3.040 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -10.280 6.341 -4.510 1.00 0.00 H new ATOM 1168 N VAL A 78 -6.839 5.728 -2.588 1.00 0.00 N ATOM 1169 CA VAL A 78 -5.865 5.330 -1.579 1.00 0.00 C ATOM 1170 C VAL A 78 -6.575 4.701 -0.386 1.00 0.00 C ATOM 1171 O VAL A 78 -7.275 5.384 0.363 1.00 0.00 O ATOM 1172 CB VAL A 78 -5.013 6.525 -1.096 1.00 0.00 C ATOM 1173 CG1 VAL A 78 -3.879 6.052 -0.196 1.00 0.00 C ATOM 1174 CG2 VAL A 78 -4.465 7.308 -2.278 1.00 0.00 C ATOM 0 H VAL A 78 -7.077 6.720 -2.580 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.197 4.603 -2.041 1.00 0.00 H new ATOM 0 HB VAL A 78 -5.657 7.186 -0.516 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -3.293 6.910 0.132 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -4.293 5.542 0.674 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -3.238 5.365 -0.749 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -3.868 8.145 -1.915 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.841 6.656 -2.889 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.292 7.686 -2.879 1.00 0.00 H new ATOM 1184 N VAL A 79 -6.394 3.398 -0.216 1.00 0.00 N ATOM 1185 CA VAL A 79 -7.110 2.660 0.816 1.00 0.00 C ATOM 1186 C VAL A 79 -6.206 2.291 1.989 1.00 0.00 C ATOM 1187 O VAL A 79 -6.670 1.749 2.995 1.00 0.00 O ATOM 1188 CB VAL A 79 -7.750 1.374 0.246 1.00 0.00 C ATOM 1189 CG1 VAL A 79 -8.835 1.721 -0.760 1.00 0.00 C ATOM 1190 CG2 VAL A 79 -6.693 0.481 -0.389 1.00 0.00 C ATOM 0 H VAL A 79 -5.759 2.831 -0.778 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.895 3.325 1.178 1.00 0.00 H new ATOM 0 HB VAL A 79 -8.207 0.825 1.069 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.275 0.804 -1.151 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -9.608 2.315 -0.271 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -8.401 2.294 -1.580 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -7.166 -0.418 -0.784 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.202 1.019 -1.200 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.953 0.203 0.362 1.00 0.00 H new ATOM 1200 N GLY A 80 -4.915 2.575 1.865 1.00 0.00 N ATOM 1201 CA GLY A 80 -3.994 2.235 2.927 1.00 0.00 C ATOM 1202 C GLY A 80 -2.574 2.666 2.644 1.00 0.00 C ATOM 1203 O GLY A 80 -2.302 3.339 1.651 1.00 0.00 O ATOM 0 H GLY A 80 -4.494 3.030 1.055 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -4.330 2.700 3.854 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -4.015 1.157 3.086 1.00 0.00 H new ATOM 1207 N VAL A 81 -1.669 2.261 3.522 1.00 0.00 N ATOM 1208 CA VAL A 81 -0.255 2.600 3.405 1.00 0.00 C ATOM 1209 C VAL A 81 0.581 1.366 3.731 1.00 0.00 C ATOM 1210 O VAL A 81 0.100 0.452 4.399 1.00 0.00 O ATOM 1211 CB VAL A 81 0.150 3.734 4.383 1.00 0.00 C ATOM 1212 CG1 VAL A 81 1.477 4.359 3.978 1.00 0.00 C ATOM 1213 CG2 VAL A 81 -0.937 4.795 4.488 1.00 0.00 C ATOM 0 H VAL A 81 -1.892 1.688 4.336 1.00 0.00 H new ATOM 0 HA VAL A 81 -0.078 2.942 2.385 1.00 0.00 H new ATOM 0 HB VAL A 81 0.273 3.285 5.369 1.00 0.00 H new ATOM 0 HG11 VAL A 81 1.736 5.151 4.681 1.00 0.00 H new ATOM 0 HG12 VAL A 81 2.256 3.597 3.987 1.00 0.00 H new ATOM 0 HG13 VAL A 81 1.391 4.778 2.975 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.620 5.574 5.181 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -1.113 5.234 3.506 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -1.857 4.338 4.852 1.00 0.00 H new ATOM 1223 N TYR A 82 1.825 1.333 3.275 1.00 0.00 N ATOM 1224 CA TYR A 82 2.709 0.227 3.610 1.00 0.00 C ATOM 1225 C TYR A 82 4.131 0.723 3.866 1.00 0.00 C ATOM 1226 O TYR A 82 4.654 1.568 3.138 1.00 0.00 O ATOM 1227 CB TYR A 82 2.692 -0.865 2.521 1.00 0.00 C ATOM 1228 CG TYR A 82 3.435 -0.530 1.242 1.00 0.00 C ATOM 1229 CD1 TYR A 82 2.804 0.128 0.193 1.00 0.00 C ATOM 1230 CD2 TYR A 82 4.767 -0.899 1.074 1.00 0.00 C ATOM 1231 CE1 TYR A 82 3.477 0.407 -0.984 1.00 0.00 C ATOM 1232 CE2 TYR A 82 5.445 -0.618 -0.095 1.00 0.00 C ATOM 1233 CZ TYR A 82 4.798 0.035 -1.122 1.00 0.00 C ATOM 1234 OH TYR A 82 5.470 0.313 -2.293 1.00 0.00 O ATOM 0 H TYR A 82 2.241 2.049 2.680 1.00 0.00 H new ATOM 0 HA TYR A 82 2.336 -0.224 4.529 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.119 -1.776 2.940 1.00 0.00 H new ATOM 0 HB3 TYR A 82 1.655 -1.085 2.270 1.00 0.00 H new ATOM 0 HD1 TYR A 82 1.771 0.427 0.298 1.00 0.00 H new ATOM 0 HD2 TYR A 82 5.279 -1.415 1.873 1.00 0.00 H new ATOM 0 HE1 TYR A 82 2.970 0.914 -1.791 1.00 0.00 H new ATOM 0 HE2 TYR A 82 6.479 -0.909 -0.205 1.00 0.00 H new ATOM 0 HH TYR A 82 5.071 1.099 -2.720 1.00 0.00 H new ATOM 1244 N HIS A 83 4.737 0.205 4.923 1.00 0.00 N ATOM 1245 CA HIS A 83 6.115 0.528 5.264 1.00 0.00 C ATOM 1246 C HIS A 83 6.775 -0.669 5.932 1.00 0.00 C ATOM 1247 O HIS A 83 6.098 -1.495 6.548 1.00 0.00 O ATOM 1248 CB HIS A 83 6.228 1.798 6.139 1.00 0.00 C ATOM 1249 CG HIS A 83 5.363 1.836 7.371 1.00 0.00 C ATOM 1250 ND1 HIS A 83 4.626 2.944 7.723 1.00 0.00 N ATOM 1251 CD2 HIS A 83 5.152 0.927 8.350 1.00 0.00 C ATOM 1252 CE1 HIS A 83 4.001 2.714 8.859 1.00 0.00 C ATOM 1253 NE2 HIS A 83 4.304 1.497 9.272 1.00 0.00 N ATOM 0 H HIS A 83 4.290 -0.448 5.567 1.00 0.00 H new ATOM 0 HA HIS A 83 6.643 0.753 4.338 1.00 0.00 H new ATOM 0 HB2 HIS A 83 7.268 1.911 6.447 1.00 0.00 H new ATOM 0 HB3 HIS A 83 5.983 2.662 5.522 1.00 0.00 H new ATOM 0 HD2 HIS A 83 5.573 -0.066 8.399 1.00 0.00 H new ATOM 0 HE1 HIS A 83 3.348 3.407 9.369 1.00 0.00 H new ATOM 0 HE2 HIS A 83 3.967 1.055 10.127 1.00 0.00 H new ATOM 1262 N SER A 84 8.084 -0.768 5.809 1.00 0.00 N ATOM 1263 CA SER A 84 8.806 -1.927 6.296 1.00 0.00 C ATOM 1264 C SER A 84 9.534 -1.609 7.596 1.00 0.00 C ATOM 1265 O SER A 84 9.814 -0.450 7.898 1.00 0.00 O ATOM 1266 CB SER A 84 9.795 -2.394 5.227 1.00 0.00 C ATOM 1267 OG SER A 84 10.515 -1.299 4.685 1.00 0.00 O ATOM 0 H SER A 84 8.671 -0.057 5.374 1.00 0.00 H new ATOM 0 HA SER A 84 8.094 -2.726 6.502 1.00 0.00 H new ATOM 0 HB2 SER A 84 10.491 -3.112 5.660 1.00 0.00 H new ATOM 0 HB3 SER A 84 9.258 -2.910 4.431 1.00 0.00 H new ATOM 0 HG SER A 84 11.142 -1.624 4.005 1.00 0.00 H new ATOM 1273 N HIS A 85 9.806 -2.645 8.372 1.00 0.00 N ATOM 1274 CA HIS A 85 10.489 -2.491 9.651 1.00 0.00 C ATOM 1275 C HIS A 85 11.794 -3.278 9.685 1.00 0.00 C ATOM 1276 O HIS A 85 11.801 -4.453 10.041 1.00 0.00 O ATOM 1277 CB HIS A 85 9.594 -2.928 10.816 1.00 0.00 C ATOM 1278 CG HIS A 85 8.725 -1.841 11.363 1.00 0.00 C ATOM 1279 ND1 HIS A 85 9.154 -0.948 12.319 1.00 0.00 N ATOM 1280 CD2 HIS A 85 7.435 -1.528 11.114 1.00 0.00 C ATOM 1281 CE1 HIS A 85 8.165 -0.139 12.637 1.00 0.00 C ATOM 1282 NE2 HIS A 85 7.109 -0.466 11.918 1.00 0.00 N ATOM 0 H HIS A 85 9.564 -3.608 8.139 1.00 0.00 H new ATOM 0 HA HIS A 85 10.718 -1.431 9.762 1.00 0.00 H new ATOM 0 HB2 HIS A 85 8.961 -3.751 10.484 1.00 0.00 H new ATOM 0 HB3 HIS A 85 10.223 -3.313 11.618 1.00 0.00 H new ATOM 0 HD1 HIS A 85 10.092 -0.918 12.719 1.00 0.00 H new ATOM 0 HD2 HIS A 85 6.781 -2.023 10.411 1.00 0.00 H new ATOM 0 HE1 HIS A 85 8.211 0.658 13.364 1.00 0.00 H new ATOM 1291 N PRO A 86 12.909 -2.667 9.247 1.00 0.00 N ATOM 1292 CA PRO A 86 14.232 -3.281 9.371 1.00 0.00 C ATOM 1293 C PRO A 86 14.764 -3.175 10.796 1.00 0.00 C ATOM 1294 O PRO A 86 15.799 -3.747 11.145 1.00 0.00 O ATOM 1295 CB PRO A 86 15.091 -2.464 8.408 1.00 0.00 C ATOM 1296 CG PRO A 86 14.446 -1.120 8.369 1.00 0.00 C ATOM 1297 CD PRO A 86 12.970 -1.347 8.586 1.00 0.00 C ATOM 0 HA PRO A 86 14.224 -4.347 9.143 1.00 0.00 H new ATOM 0 HB2 PRO A 86 16.122 -2.398 8.756 1.00 0.00 H new ATOM 0 HB3 PRO A 86 15.117 -2.919 7.418 1.00 0.00 H new ATOM 0 HG2 PRO A 86 14.856 -0.470 9.142 1.00 0.00 H new ATOM 0 HG3 PRO A 86 14.627 -0.631 7.412 1.00 0.00 H new ATOM 0 HD2 PRO A 86 12.533 -0.567 9.209 1.00 0.00 H new ATOM 0 HD3 PRO A 86 12.422 -1.346 7.644 1.00 0.00 H new ATOM 1305 N ASP A 87 14.021 -2.442 11.608 1.00 0.00 N ATOM 1306 CA ASP A 87 14.380 -2.179 12.994 1.00 0.00 C ATOM 1307 C ASP A 87 13.808 -3.250 13.916 1.00 0.00 C ATOM 1308 O ASP A 87 14.451 -3.662 14.881 1.00 0.00 O ATOM 1309 CB ASP A 87 13.856 -0.801 13.412 1.00 0.00 C ATOM 1310 CG ASP A 87 12.348 -0.699 13.298 1.00 0.00 C ATOM 1311 OD1 ASP A 87 11.823 -0.834 12.174 1.00 0.00 O ATOM 1312 OD2 ASP A 87 11.678 -0.521 14.331 1.00 0.00 O ATOM 0 H ASP A 87 13.143 -2.008 11.322 1.00 0.00 H new ATOM 0 HA ASP A 87 15.467 -2.197 13.078 1.00 0.00 H new ATOM 0 HB2 ASP A 87 14.155 -0.598 14.440 1.00 0.00 H new ATOM 0 HB3 ASP A 87 14.318 -0.035 12.789 1.00 0.00 H new ATOM 1317 N HIS A 88 12.594 -3.692 13.617 1.00 0.00 N ATOM 1318 CA HIS A 88 11.919 -4.706 14.417 1.00 0.00 C ATOM 1319 C HIS A 88 11.188 -5.678 13.508 1.00 0.00 C ATOM 1320 O HIS A 88 10.650 -5.279 12.478 1.00 0.00 O ATOM 1321 CB HIS A 88 10.922 -4.063 15.390 1.00 0.00 C ATOM 1322 CG HIS A 88 11.565 -3.298 16.510 1.00 0.00 C ATOM 1323 ND1 HIS A 88 11.763 -1.936 16.478 1.00 0.00 N ATOM 1324 CD2 HIS A 88 12.051 -3.718 17.700 1.00 0.00 C ATOM 1325 CE1 HIS A 88 12.343 -1.552 17.597 1.00 0.00 C ATOM 1326 NE2 HIS A 88 12.530 -2.612 18.359 1.00 0.00 N ATOM 0 H HIS A 88 12.052 -3.361 12.819 1.00 0.00 H new ATOM 0 HA HIS A 88 12.672 -5.241 14.996 1.00 0.00 H new ATOM 0 HB2 HIS A 88 10.269 -3.391 14.833 1.00 0.00 H new ATOM 0 HB3 HIS A 88 10.289 -4.843 15.813 1.00 0.00 H new ATOM 0 HD1 HIS A 88 11.501 -1.320 15.708 1.00 0.00 H new ATOM 0 HD2 HIS A 88 12.061 -4.735 18.065 1.00 0.00 H new ATOM 0 HE1 HIS A 88 12.619 -0.539 17.848 1.00 0.00 H new ATOM 1335 N PRO A 89 11.161 -6.963 13.871 1.00 0.00 N ATOM 1336 CA PRO A 89 10.469 -7.986 13.091 1.00 0.00 C ATOM 1337 C PRO A 89 8.955 -7.800 13.114 1.00 0.00 C ATOM 1338 O PRO A 89 8.285 -8.194 14.077 1.00 0.00 O ATOM 1339 CB PRO A 89 10.863 -9.302 13.773 1.00 0.00 C ATOM 1340 CG PRO A 89 12.024 -8.960 14.643 1.00 0.00 C ATOM 1341 CD PRO A 89 11.822 -7.533 15.050 1.00 0.00 C ATOM 0 HA PRO A 89 10.747 -7.948 12.038 1.00 0.00 H new ATOM 0 HB2 PRO A 89 10.037 -9.704 14.359 1.00 0.00 H new ATOM 0 HB3 PRO A 89 11.132 -10.061 13.038 1.00 0.00 H new ATOM 0 HG2 PRO A 89 12.065 -9.613 15.515 1.00 0.00 H new ATOM 0 HG3 PRO A 89 12.965 -9.084 14.107 1.00 0.00 H new ATOM 0 HD2 PRO A 89 11.204 -7.449 15.944 1.00 0.00 H new ATOM 0 HD3 PRO A 89 12.767 -7.034 15.268 1.00 0.00 H new ATOM 1349 N ALA A 90 8.444 -7.166 12.057 1.00 0.00 N ATOM 1350 CA ALA A 90 7.012 -6.907 11.889 1.00 0.00 C ATOM 1351 C ALA A 90 6.483 -5.942 12.951 1.00 0.00 C ATOM 1352 O ALA A 90 7.254 -5.409 13.748 1.00 0.00 O ATOM 1353 CB ALA A 90 6.222 -8.212 11.902 1.00 0.00 C ATOM 0 H ALA A 90 9.015 -6.815 11.288 1.00 0.00 H new ATOM 0 HA ALA A 90 6.877 -6.430 10.918 1.00 0.00 H new ATOM 0 HB1 ALA A 90 5.161 -7.996 11.776 1.00 0.00 H new ATOM 0 HB2 ALA A 90 6.562 -8.851 11.087 1.00 0.00 H new ATOM 0 HB3 ALA A 90 6.378 -8.722 12.852 1.00 0.00 H new ATOM 1359 N ARG A 91 5.158 -5.728 12.920 1.00 0.00 N ATOM 1360 CA ARG A 91 4.412 -4.864 13.860 1.00 0.00 C ATOM 1361 C ARG A 91 4.943 -3.418 13.929 1.00 0.00 C ATOM 1362 O ARG A 91 6.092 -3.130 13.600 1.00 0.00 O ATOM 1363 CB ARG A 91 4.304 -5.491 15.268 1.00 0.00 C ATOM 1364 CG ARG A 91 5.575 -5.477 16.104 1.00 0.00 C ATOM 1365 CD ARG A 91 6.163 -6.871 16.250 1.00 0.00 C ATOM 1366 NE ARG A 91 5.198 -7.816 16.811 1.00 0.00 N ATOM 1367 CZ ARG A 91 5.402 -9.127 16.914 1.00 0.00 C ATOM 1368 NH1 ARG A 91 6.556 -9.661 16.536 1.00 0.00 N ATOM 1369 NH2 ARG A 91 4.445 -9.910 17.392 1.00 0.00 N ATOM 0 H ARG A 91 4.555 -6.162 12.221 1.00 0.00 H new ATOM 0 HA ARG A 91 3.406 -4.796 13.446 1.00 0.00 H new ATOM 0 HB2 ARG A 91 3.524 -4.965 15.819 1.00 0.00 H new ATOM 0 HB3 ARG A 91 3.976 -6.525 15.159 1.00 0.00 H new ATOM 0 HG2 ARG A 91 6.309 -4.818 15.640 1.00 0.00 H new ATOM 0 HG3 ARG A 91 5.358 -5.068 17.091 1.00 0.00 H new ATOM 0 HD2 ARG A 91 6.496 -7.228 15.275 1.00 0.00 H new ATOM 0 HD3 ARG A 91 7.043 -6.828 16.891 1.00 0.00 H new ATOM 0 HE ARG A 91 4.309 -7.445 17.146 1.00 0.00 H new ATOM 0 HH11 ARG A 91 7.296 -9.066 16.163 1.00 0.00 H new ATOM 0 HH12 ARG A 91 6.704 -10.667 16.618 1.00 0.00 H new ATOM 0 HH21 ARG A 91 3.553 -9.507 17.680 1.00 0.00 H new ATOM 0 HH22 ARG A 91 4.600 -10.915 17.471 1.00 0.00 H new ATOM 1383 N PRO A 92 4.074 -2.473 14.318 1.00 0.00 N ATOM 1384 CA PRO A 92 4.438 -1.063 14.413 1.00 0.00 C ATOM 1385 C PRO A 92 5.097 -0.704 15.742 1.00 0.00 C ATOM 1386 O PRO A 92 4.845 -1.333 16.772 1.00 0.00 O ATOM 1387 CB PRO A 92 3.091 -0.358 14.282 1.00 0.00 C ATOM 1388 CG PRO A 92 2.107 -1.307 14.879 1.00 0.00 C ATOM 1389 CD PRO A 92 2.655 -2.697 14.665 1.00 0.00 C ATOM 0 HA PRO A 92 5.172 -0.781 13.658 1.00 0.00 H new ATOM 0 HB2 PRO A 92 3.091 0.596 14.809 1.00 0.00 H new ATOM 0 HB3 PRO A 92 2.855 -0.146 13.239 1.00 0.00 H new ATOM 0 HG2 PRO A 92 1.971 -1.105 15.941 1.00 0.00 H new ATOM 0 HG3 PRO A 92 1.131 -1.200 14.406 1.00 0.00 H new ATOM 0 HD2 PRO A 92 2.555 -3.308 15.562 1.00 0.00 H new ATOM 0 HD3 PRO A 92 2.126 -3.216 13.866 1.00 0.00 H new ATOM 1397 N SER A 93 5.940 0.314 15.702 1.00 0.00 N ATOM 1398 CA SER A 93 6.598 0.820 16.893 1.00 0.00 C ATOM 1399 C SER A 93 5.936 2.126 17.332 1.00 0.00 C ATOM 1400 O SER A 93 4.947 2.548 16.727 1.00 0.00 O ATOM 1401 CB SER A 93 8.082 1.028 16.600 1.00 0.00 C ATOM 1402 OG SER A 93 8.657 -0.158 16.084 1.00 0.00 O ATOM 0 H SER A 93 6.186 0.811 14.846 1.00 0.00 H new ATOM 0 HA SER A 93 6.502 0.100 17.706 1.00 0.00 H new ATOM 0 HB2 SER A 93 8.207 1.841 15.884 1.00 0.00 H new ATOM 0 HB3 SER A 93 8.601 1.324 17.512 1.00 0.00 H new ATOM 0 HG SER A 93 9.608 -0.007 15.900 1.00 0.00 H new ATOM 1408 N ALA A 94 6.481 2.771 18.358 1.00 0.00 N ATOM 1409 CA ALA A 94 5.855 3.962 18.926 1.00 0.00 C ATOM 1410 C ALA A 94 5.818 5.114 17.928 1.00 0.00 C ATOM 1411 O ALA A 94 4.765 5.701 17.699 1.00 0.00 O ATOM 1412 CB ALA A 94 6.580 4.385 20.195 1.00 0.00 C ATOM 0 H ALA A 94 7.351 2.492 18.812 1.00 0.00 H new ATOM 0 HA ALA A 94 4.824 3.707 19.171 1.00 0.00 H new ATOM 0 HB1 ALA A 94 6.103 5.274 20.608 1.00 0.00 H new ATOM 0 HB2 ALA A 94 6.536 3.577 20.926 1.00 0.00 H new ATOM 0 HB3 ALA A 94 7.621 4.607 19.962 1.00 0.00 H new ATOM 1418 N THR A 95 6.951 5.405 17.301 1.00 0.00 N ATOM 1419 CA THR A 95 7.025 6.507 16.347 1.00 0.00 C ATOM 1420 C THR A 95 6.325 6.130 15.047 1.00 0.00 C ATOM 1421 O THR A 95 5.737 6.976 14.371 1.00 0.00 O ATOM 1422 CB THR A 95 8.487 6.904 16.067 1.00 0.00 C ATOM 1423 OG1 THR A 95 9.164 7.126 17.310 1.00 0.00 O ATOM 1424 CG2 THR A 95 8.565 8.166 15.217 1.00 0.00 C ATOM 0 H THR A 95 7.826 4.898 17.434 1.00 0.00 H new ATOM 0 HA THR A 95 6.519 7.366 16.787 1.00 0.00 H new ATOM 0 HB THR A 95 8.963 6.092 15.517 1.00 0.00 H new ATOM 0 HG1 THR A 95 8.593 7.658 17.903 1.00 0.00 H new ATOM 0 HG21 THR A 95 9.610 8.420 15.037 1.00 0.00 H new ATOM 0 HG22 THR A 95 8.064 7.994 14.264 1.00 0.00 H new ATOM 0 HG23 THR A 95 8.077 8.988 15.741 1.00 0.00 H new ATOM 1432 N ASP A 96 6.382 4.845 14.719 1.00 0.00 N ATOM 1433 CA ASP A 96 5.684 4.309 13.553 1.00 0.00 C ATOM 1434 C ASP A 96 4.183 4.550 13.695 1.00 0.00 C ATOM 1435 O ASP A 96 3.493 4.853 12.723 1.00 0.00 O ATOM 1436 CB ASP A 96 5.976 2.812 13.427 1.00 0.00 C ATOM 1437 CG ASP A 96 5.651 2.242 12.059 1.00 0.00 C ATOM 1438 OD1 ASP A 96 6.157 2.772 11.055 1.00 0.00 O ATOM 1439 OD2 ASP A 96 4.944 1.211 11.986 1.00 0.00 O ATOM 0 H ASP A 96 6.908 4.149 15.247 1.00 0.00 H new ATOM 0 HA ASP A 96 6.034 4.814 12.653 1.00 0.00 H new ATOM 0 HB2 ASP A 96 7.030 2.637 13.643 1.00 0.00 H new ATOM 0 HB3 ASP A 96 5.402 2.274 14.181 1.00 0.00 H new ATOM 1444 N LEU A 97 3.692 4.412 14.923 1.00 0.00 N ATOM 1445 CA LEU A 97 2.305 4.724 15.250 1.00 0.00 C ATOM 1446 C LEU A 97 2.068 6.234 15.189 1.00 0.00 C ATOM 1447 O LEU A 97 1.031 6.692 14.712 1.00 0.00 O ATOM 1448 CB LEU A 97 1.975 4.171 16.649 1.00 0.00 C ATOM 1449 CG LEU A 97 0.511 4.263 17.107 1.00 0.00 C ATOM 1450 CD1 LEU A 97 0.238 3.227 18.186 1.00 0.00 C ATOM 1451 CD2 LEU A 97 0.183 5.653 17.640 1.00 0.00 C ATOM 0 H LEU A 97 4.242 4.082 15.716 1.00 0.00 H new ATOM 0 HA LEU A 97 1.646 4.255 14.520 1.00 0.00 H new ATOM 0 HB2 LEU A 97 2.274 3.123 16.679 1.00 0.00 H new ATOM 0 HB3 LEU A 97 2.592 4.699 17.376 1.00 0.00 H new ATOM 0 HG LEU A 97 -0.123 4.069 16.242 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -0.802 3.299 18.505 1.00 0.00 H new ATOM 0 HD12 LEU A 97 0.427 2.230 17.789 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.892 3.409 19.039 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.860 5.685 17.956 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.827 5.878 18.490 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.347 6.392 16.855 1.00 0.00 H new ATOM 1463 N GLU A 98 3.045 6.998 15.671 1.00 0.00 N ATOM 1464 CA GLU A 98 2.926 8.453 15.747 1.00 0.00 C ATOM 1465 C GLU A 98 2.728 9.094 14.375 1.00 0.00 C ATOM 1466 O GLU A 98 1.952 10.040 14.240 1.00 0.00 O ATOM 1467 CB GLU A 98 4.149 9.059 16.433 1.00 0.00 C ATOM 1468 CG GLU A 98 4.296 8.622 17.878 1.00 0.00 C ATOM 1469 CD GLU A 98 5.474 9.265 18.573 1.00 0.00 C ATOM 1470 OE1 GLU A 98 6.618 8.804 18.381 1.00 0.00 O ATOM 1471 OE2 GLU A 98 5.255 10.230 19.336 1.00 0.00 O ATOM 0 H GLU A 98 3.932 6.632 16.017 1.00 0.00 H new ATOM 0 HA GLU A 98 2.036 8.665 16.340 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.045 8.777 15.881 1.00 0.00 H new ATOM 0 HB3 GLU A 98 4.079 10.146 16.393 1.00 0.00 H new ATOM 0 HG2 GLU A 98 3.383 8.867 18.421 1.00 0.00 H new ATOM 0 HG3 GLU A 98 4.407 7.538 17.914 1.00 0.00 H new ATOM 1478 N GLU A 99 3.416 8.587 13.359 1.00 0.00 N ATOM 1479 CA GLU A 99 3.285 9.150 12.017 1.00 0.00 C ATOM 1480 C GLU A 99 2.022 8.640 11.327 1.00 0.00 C ATOM 1481 O GLU A 99 1.607 9.174 10.297 1.00 0.00 O ATOM 1482 CB GLU A 99 4.532 8.867 11.173 1.00 0.00 C ATOM 1483 CG GLU A 99 4.923 7.404 11.108 1.00 0.00 C ATOM 1484 CD GLU A 99 6.200 7.185 10.319 1.00 0.00 C ATOM 1485 OE1 GLU A 99 7.250 7.744 10.709 1.00 0.00 O ATOM 1486 OE2 GLU A 99 6.168 6.447 9.310 1.00 0.00 O ATOM 0 H GLU A 99 4.061 7.800 13.434 1.00 0.00 H new ATOM 0 HA GLU A 99 3.194 10.231 12.118 1.00 0.00 H new ATOM 0 HB2 GLU A 99 4.361 9.230 10.160 1.00 0.00 H new ATOM 0 HB3 GLU A 99 5.368 9.437 11.579 1.00 0.00 H new ATOM 0 HG2 GLU A 99 5.053 7.019 12.120 1.00 0.00 H new ATOM 0 HG3 GLU A 99 4.114 6.834 10.652 1.00 0.00 H new ATOM 1493 N ALA A 100 1.394 7.628 11.914 1.00 0.00 N ATOM 1494 CA ALA A 100 0.138 7.106 11.397 1.00 0.00 C ATOM 1495 C ALA A 100 -1.010 8.035 11.777 1.00 0.00 C ATOM 1496 O ALA A 100 -1.501 8.016 12.909 1.00 0.00 O ATOM 1497 CB ALA A 100 -0.114 5.698 11.912 1.00 0.00 C ATOM 0 H ALA A 100 1.736 7.153 12.749 1.00 0.00 H new ATOM 0 HA ALA A 100 0.202 7.058 10.310 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -1.058 5.328 11.513 1.00 0.00 H new ATOM 0 HB2 ALA A 100 0.697 5.043 11.592 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.161 5.712 13.001 1.00 0.00 H new ATOM 1503 N THR A 101 -1.410 8.870 10.832 1.00 0.00 N ATOM 1504 CA THR A 101 -2.454 9.854 11.071 1.00 0.00 C ATOM 1505 C THR A 101 -3.494 9.798 9.952 1.00 0.00 C ATOM 1506 O THR A 101 -4.146 10.793 9.625 1.00 0.00 O ATOM 1507 CB THR A 101 -1.847 11.265 11.151 1.00 0.00 C ATOM 1508 OG1 THR A 101 -0.619 11.218 11.893 1.00 0.00 O ATOM 1509 CG2 THR A 101 -2.798 12.241 11.831 1.00 0.00 C ATOM 0 H THR A 101 -1.025 8.886 9.887 1.00 0.00 H new ATOM 0 HA THR A 101 -2.939 9.625 12.020 1.00 0.00 H new ATOM 0 HB THR A 101 -1.664 11.610 10.133 1.00 0.00 H new ATOM 0 HG1 THR A 101 -0.232 12.117 11.942 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.338 13.229 11.871 1.00 0.00 H new ATOM 0 HG22 THR A 101 -3.728 12.296 11.266 1.00 0.00 H new ATOM 0 HG23 THR A 101 -3.009 11.898 12.844 1.00 0.00 H new ATOM 1517 N PHE A 102 -3.649 8.621 9.372 1.00 0.00 N ATOM 1518 CA PHE A 102 -4.599 8.424 8.287 1.00 0.00 C ATOM 1519 C PHE A 102 -5.714 7.473 8.724 1.00 0.00 C ATOM 1520 O PHE A 102 -5.620 6.261 8.527 1.00 0.00 O ATOM 1521 CB PHE A 102 -3.893 7.866 7.046 1.00 0.00 C ATOM 1522 CG PHE A 102 -2.711 8.680 6.592 1.00 0.00 C ATOM 1523 CD1 PHE A 102 -2.884 9.788 5.779 1.00 0.00 C ATOM 1524 CD2 PHE A 102 -1.426 8.332 6.977 1.00 0.00 C ATOM 1525 CE1 PHE A 102 -1.797 10.532 5.358 1.00 0.00 C ATOM 1526 CE2 PHE A 102 -0.337 9.071 6.561 1.00 0.00 C ATOM 1527 CZ PHE A 102 -0.522 10.174 5.751 1.00 0.00 C ATOM 0 H PHE A 102 -3.128 7.784 9.634 1.00 0.00 H new ATOM 0 HA PHE A 102 -5.036 9.391 8.035 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -3.561 6.849 7.257 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -4.612 7.803 6.230 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -3.879 10.074 5.471 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -1.275 7.471 7.611 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -1.945 11.392 4.722 1.00 0.00 H new ATOM 0 HE2 PHE A 102 0.659 8.787 6.869 1.00 0.00 H new ATOM 0 HZ PHE A 102 0.328 10.755 5.426 1.00 0.00 H new ATOM 1537 N PRO A 103 -6.770 8.004 9.363 1.00 0.00 N ATOM 1538 CA PRO A 103 -7.896 7.194 9.840 1.00 0.00 C ATOM 1539 C PRO A 103 -8.707 6.610 8.690 1.00 0.00 C ATOM 1540 O PRO A 103 -9.164 7.336 7.806 1.00 0.00 O ATOM 1541 CB PRO A 103 -8.749 8.184 10.648 1.00 0.00 C ATOM 1542 CG PRO A 103 -7.878 9.376 10.857 1.00 0.00 C ATOM 1543 CD PRO A 103 -6.960 9.424 9.673 1.00 0.00 C ATOM 0 HA PRO A 103 -7.559 6.337 10.424 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -9.658 8.451 10.109 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -9.058 7.751 11.599 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -8.472 10.287 10.928 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -7.314 9.290 11.786 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -7.403 9.966 8.838 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -6.017 9.918 9.910 1.00 0.00 H new ATOM 1551 N GLY A 104 -8.870 5.295 8.704 1.00 0.00 N ATOM 1552 CA GLY A 104 -9.609 4.626 7.651 1.00 0.00 C ATOM 1553 C GLY A 104 -8.687 3.909 6.690 1.00 0.00 C ATOM 1554 O GLY A 104 -9.130 3.138 5.845 1.00 0.00 O ATOM 0 H GLY A 104 -8.503 4.677 9.428 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -10.303 3.911 8.092 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -10.207 5.356 7.106 1.00 0.00 H new ATOM 1558 N PHE A 105 -7.397 4.171 6.827 1.00 0.00 N ATOM 1559 CA PHE A 105 -6.393 3.545 5.984 1.00 0.00 C ATOM 1560 C PHE A 105 -5.801 2.335 6.693 1.00 0.00 C ATOM 1561 O PHE A 105 -5.538 2.377 7.894 1.00 0.00 O ATOM 1562 CB PHE A 105 -5.280 4.544 5.645 1.00 0.00 C ATOM 1563 CG PHE A 105 -5.720 5.704 4.791 1.00 0.00 C ATOM 1564 CD1 PHE A 105 -6.598 6.662 5.282 1.00 0.00 C ATOM 1565 CD2 PHE A 105 -5.249 5.841 3.497 1.00 0.00 C ATOM 1566 CE1 PHE A 105 -6.994 7.727 4.498 1.00 0.00 C ATOM 1567 CE2 PHE A 105 -5.642 6.906 2.711 1.00 0.00 C ATOM 1568 CZ PHE A 105 -6.515 7.850 3.211 1.00 0.00 C ATOM 0 H PHE A 105 -7.019 4.818 7.519 1.00 0.00 H new ATOM 0 HA PHE A 105 -6.869 3.222 5.058 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -4.862 4.931 6.574 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -4.478 4.014 5.131 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -6.976 6.572 6.290 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -4.566 5.106 3.097 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -7.679 8.463 4.893 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -5.265 7.000 1.703 1.00 0.00 H new ATOM 0 HZ PHE A 105 -6.822 8.683 2.596 1.00 0.00 H new ATOM 1578 N THR A 106 -5.597 1.261 5.950 1.00 0.00 N ATOM 1579 CA THR A 106 -5.005 0.059 6.505 1.00 0.00 C ATOM 1580 C THR A 106 -3.496 0.083 6.304 1.00 0.00 C ATOM 1581 O THR A 106 -3.012 0.360 5.205 1.00 0.00 O ATOM 1582 CB THR A 106 -5.601 -1.208 5.859 1.00 0.00 C ATOM 1583 OG1 THR A 106 -7.017 -1.228 6.072 1.00 0.00 O ATOM 1584 CG2 THR A 106 -4.987 -2.472 6.443 1.00 0.00 C ATOM 0 H THR A 106 -5.833 1.198 4.960 1.00 0.00 H new ATOM 0 HA THR A 106 -5.229 0.033 7.571 1.00 0.00 H new ATOM 0 HB THR A 106 -5.378 -1.182 4.792 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.347 -2.147 5.990 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.430 -3.346 5.965 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.911 -2.469 6.268 1.00 0.00 H new ATOM 0 HG23 THR A 106 -5.180 -2.508 7.515 1.00 0.00 H new ATOM 1592 N TYR A 107 -2.762 -0.182 7.366 1.00 0.00 N ATOM 1593 CA TYR A 107 -1.317 -0.146 7.312 1.00 0.00 C ATOM 1594 C TYR A 107 -0.755 -1.554 7.189 1.00 0.00 C ATOM 1595 O TYR A 107 -0.890 -2.372 8.098 1.00 0.00 O ATOM 1596 CB TYR A 107 -0.753 0.544 8.556 1.00 0.00 C ATOM 1597 CG TYR A 107 -1.169 1.994 8.685 1.00 0.00 C ATOM 1598 CD1 TYR A 107 -0.436 3.004 8.075 1.00 0.00 C ATOM 1599 CD2 TYR A 107 -2.289 2.354 9.427 1.00 0.00 C ATOM 1600 CE1 TYR A 107 -0.809 4.329 8.195 1.00 0.00 C ATOM 1601 CE2 TYR A 107 -2.668 3.677 9.550 1.00 0.00 C ATOM 1602 CZ TYR A 107 -1.924 4.660 8.934 1.00 0.00 C ATOM 1603 OH TYR A 107 -2.294 5.979 9.056 1.00 0.00 O ATOM 0 H TYR A 107 -3.145 -0.425 8.279 1.00 0.00 H new ATOM 0 HA TYR A 107 -1.019 0.425 6.433 1.00 0.00 H new ATOM 0 HB2 TYR A 107 -1.080 0.001 9.443 1.00 0.00 H new ATOM 0 HB3 TYR A 107 0.335 0.488 8.531 1.00 0.00 H new ATOM 0 HD1 TYR A 107 0.440 2.749 7.497 1.00 0.00 H new ATOM 0 HD2 TYR A 107 -2.872 1.587 9.915 1.00 0.00 H new ATOM 0 HE1 TYR A 107 -0.229 5.102 7.712 1.00 0.00 H new ATOM 0 HE2 TYR A 107 -3.543 3.939 10.126 1.00 0.00 H new ATOM 0 HH TYR A 107 -1.834 6.378 9.824 1.00 0.00 H new ATOM 1613 N VAL A 108 -0.143 -1.832 6.053 1.00 0.00 N ATOM 1614 CA VAL A 108 0.515 -3.102 5.839 1.00 0.00 C ATOM 1615 C VAL A 108 1.989 -2.964 6.163 1.00 0.00 C ATOM 1616 O VAL A 108 2.705 -2.152 5.571 1.00 0.00 O ATOM 1617 CB VAL A 108 0.344 -3.612 4.391 1.00 0.00 C ATOM 1618 CG1 VAL A 108 1.109 -4.915 4.181 1.00 0.00 C ATOM 1619 CG2 VAL A 108 -1.129 -3.797 4.065 1.00 0.00 C ATOM 0 H VAL A 108 -0.089 -1.190 5.262 1.00 0.00 H new ATOM 0 HA VAL A 108 0.049 -3.834 6.498 1.00 0.00 H new ATOM 0 HB VAL A 108 0.757 -2.865 3.714 1.00 0.00 H new ATOM 0 HG11 VAL A 108 0.974 -5.255 3.154 1.00 0.00 H new ATOM 0 HG12 VAL A 108 2.169 -4.749 4.372 1.00 0.00 H new ATOM 0 HG13 VAL A 108 0.731 -5.673 4.867 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -1.233 -4.157 3.041 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -1.565 -4.523 4.751 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -1.647 -2.844 4.169 1.00 0.00 H new ATOM 1629 N ILE A 109 2.423 -3.741 7.125 1.00 0.00 N ATOM 1630 CA ILE A 109 3.788 -3.703 7.571 1.00 0.00 C ATOM 1631 C ILE A 109 4.497 -4.977 7.160 1.00 0.00 C ATOM 1632 O ILE A 109 4.111 -6.080 7.556 1.00 0.00 O ATOM 1633 CB ILE A 109 3.870 -3.519 9.101 1.00 0.00 C ATOM 1634 CG1 ILE A 109 3.290 -2.157 9.494 1.00 0.00 C ATOM 1635 CG2 ILE A 109 5.309 -3.656 9.583 1.00 0.00 C ATOM 1636 CD1 ILE A 109 3.254 -1.912 10.987 1.00 0.00 C ATOM 0 H ILE A 109 1.838 -4.416 7.618 1.00 0.00 H new ATOM 0 HA ILE A 109 4.278 -2.849 7.103 1.00 0.00 H new ATOM 0 HB ILE A 109 3.281 -4.300 9.582 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.880 -1.372 9.021 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.278 -2.077 9.098 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.345 -3.523 10.664 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.686 -4.646 9.327 1.00 0.00 H new ATOM 0 HG23 ILE A 109 5.927 -2.897 9.103 1.00 0.00 H new ATOM 0 HD11 ILE A 109 2.830 -0.927 11.184 1.00 0.00 H new ATOM 0 HD12 ILE A 109 2.639 -2.674 11.466 1.00 0.00 H new ATOM 0 HD13 ILE A 109 4.267 -1.958 11.388 1.00 0.00 H new ATOM 1648 N VAL A 110 5.518 -4.823 6.349 1.00 0.00 N ATOM 1649 CA VAL A 110 6.297 -5.951 5.901 1.00 0.00 C ATOM 1650 C VAL A 110 7.607 -5.986 6.656 1.00 0.00 C ATOM 1651 O VAL A 110 8.300 -4.973 6.779 1.00 0.00 O ATOM 1652 CB VAL A 110 6.546 -5.912 4.371 1.00 0.00 C ATOM 1653 CG1 VAL A 110 7.168 -4.591 3.943 1.00 0.00 C ATOM 1654 CG2 VAL A 110 7.412 -7.087 3.930 1.00 0.00 C ATOM 0 H VAL A 110 5.829 -3.922 5.985 1.00 0.00 H new ATOM 0 HA VAL A 110 5.733 -6.861 6.106 1.00 0.00 H new ATOM 0 HB VAL A 110 5.578 -5.998 3.877 1.00 0.00 H new ATOM 0 HG11 VAL A 110 7.329 -4.597 2.865 1.00 0.00 H new ATOM 0 HG12 VAL A 110 6.498 -3.772 4.205 1.00 0.00 H new ATOM 0 HG13 VAL A 110 8.122 -4.456 4.452 1.00 0.00 H new ATOM 0 HG21 VAL A 110 7.572 -7.037 2.853 1.00 0.00 H new ATOM 0 HG22 VAL A 110 8.373 -7.043 4.442 1.00 0.00 H new ATOM 0 HG23 VAL A 110 6.911 -8.022 4.179 1.00 0.00 H new ATOM 1664 N SER A 111 7.918 -7.135 7.208 1.00 0.00 N ATOM 1665 CA SER A 111 9.145 -7.295 7.941 1.00 0.00 C ATOM 1666 C SER A 111 10.272 -7.542 6.956 1.00 0.00 C ATOM 1667 O SER A 111 10.370 -8.614 6.361 1.00 0.00 O ATOM 1668 CB SER A 111 9.014 -8.452 8.933 1.00 0.00 C ATOM 1669 OG SER A 111 10.105 -8.484 9.833 1.00 0.00 O ATOM 0 H SER A 111 7.336 -7.971 7.162 1.00 0.00 H new ATOM 0 HA SER A 111 9.364 -6.392 8.511 1.00 0.00 H new ATOM 0 HB2 SER A 111 8.083 -8.352 9.491 1.00 0.00 H new ATOM 0 HB3 SER A 111 8.960 -9.395 8.390 1.00 0.00 H new ATOM 0 HG SER A 111 10.170 -9.374 10.237 1.00 0.00 H new ATOM 1675 N VAL A 112 11.088 -6.528 6.752 1.00 0.00 N ATOM 1676 CA VAL A 112 12.242 -6.646 5.891 1.00 0.00 C ATOM 1677 C VAL A 112 13.477 -6.296 6.685 1.00 0.00 C ATOM 1678 O VAL A 112 13.657 -5.154 7.098 1.00 0.00 O ATOM 1679 CB VAL A 112 12.145 -5.724 4.653 1.00 0.00 C ATOM 1680 CG1 VAL A 112 13.371 -5.876 3.766 1.00 0.00 C ATOM 1681 CG2 VAL A 112 10.877 -6.010 3.861 1.00 0.00 C ATOM 0 H VAL A 112 10.970 -5.607 7.175 1.00 0.00 H new ATOM 0 HA VAL A 112 12.291 -7.673 5.528 1.00 0.00 H new ATOM 0 HB VAL A 112 12.103 -4.694 5.006 1.00 0.00 H new ATOM 0 HG11 VAL A 112 13.279 -5.218 2.902 1.00 0.00 H new ATOM 0 HG12 VAL A 112 14.264 -5.610 4.331 1.00 0.00 H new ATOM 0 HG13 VAL A 112 13.450 -6.909 3.428 1.00 0.00 H new ATOM 0 HG21 VAL A 112 10.832 -5.349 2.995 1.00 0.00 H new ATOM 0 HG22 VAL A 112 10.884 -7.047 3.526 1.00 0.00 H new ATOM 0 HG23 VAL A 112 10.006 -5.839 4.494 1.00 0.00 H new ATOM 1691 N ARG A 113 14.330 -7.273 6.884 1.00 0.00 N ATOM 1692 CA ARG A 113 15.504 -7.083 7.705 1.00 0.00 C ATOM 1693 C ARG A 113 16.684 -6.718 6.831 1.00 0.00 C ATOM 1694 O ARG A 113 17.555 -7.542 6.545 1.00 0.00 O ATOM 1695 CB ARG A 113 15.756 -8.327 8.552 1.00 0.00 C ATOM 1696 CG ARG A 113 14.696 -8.499 9.635 1.00 0.00 C ATOM 1697 CD ARG A 113 14.504 -9.950 10.036 1.00 0.00 C ATOM 1698 NE ARG A 113 15.720 -10.550 10.571 1.00 0.00 N ATOM 1699 CZ ARG A 113 15.806 -11.821 10.947 1.00 0.00 C ATOM 1700 NH1 ARG A 113 14.724 -12.593 10.941 1.00 0.00 N ATOM 1701 NH2 ARG A 113 16.963 -12.309 11.368 1.00 0.00 N ATOM 0 H ARG A 113 14.234 -8.208 6.489 1.00 0.00 H new ATOM 0 HA ARG A 113 15.349 -6.256 8.398 1.00 0.00 H new ATOM 0 HB2 ARG A 113 15.766 -9.208 7.910 1.00 0.00 H new ATOM 0 HB3 ARG A 113 16.741 -8.258 9.015 1.00 0.00 H new ATOM 0 HG2 ARG A 113 14.980 -7.918 10.512 1.00 0.00 H new ATOM 0 HG3 ARG A 113 13.748 -8.096 9.278 1.00 0.00 H new ATOM 0 HD2 ARG A 113 13.713 -10.015 10.783 1.00 0.00 H new ATOM 0 HD3 ARG A 113 14.172 -10.522 9.169 1.00 0.00 H new ATOM 0 HE ARG A 113 16.549 -9.963 10.661 1.00 0.00 H new ATOM 0 HH11 ARG A 113 13.826 -12.210 10.647 1.00 0.00 H new ATOM 0 HH12 ARG A 113 14.792 -13.569 11.230 1.00 0.00 H new ATOM 0 HH21 ARG A 113 17.787 -11.709 11.403 1.00 0.00 H new ATOM 0 HH22 ARG A 113 17.030 -13.285 11.657 1.00 0.00 H new ATOM 1715 N ASP A 114 16.641 -5.473 6.362 1.00 0.00 N ATOM 1716 CA ASP A 114 17.664 -4.899 5.494 1.00 0.00 C ATOM 1717 C ASP A 114 17.914 -5.790 4.284 1.00 0.00 C ATOM 1718 O ASP A 114 19.000 -6.334 4.104 1.00 0.00 O ATOM 1719 CB ASP A 114 18.961 -4.655 6.267 1.00 0.00 C ATOM 1720 CG ASP A 114 19.930 -3.757 5.520 1.00 0.00 C ATOM 1721 OD1 ASP A 114 19.513 -2.666 5.070 1.00 0.00 O ATOM 1722 OD2 ASP A 114 21.119 -4.122 5.400 1.00 0.00 O ATOM 0 H ASP A 114 15.883 -4.826 6.578 1.00 0.00 H new ATOM 0 HA ASP A 114 17.299 -3.937 5.135 1.00 0.00 H new ATOM 0 HB2 ASP A 114 18.725 -4.205 7.231 1.00 0.00 H new ATOM 0 HB3 ASP A 114 19.442 -5.611 6.471 1.00 0.00 H new ATOM 1727 N GLY A 115 16.883 -5.956 3.471 1.00 0.00 N ATOM 1728 CA GLY A 115 17.011 -6.740 2.260 1.00 0.00 C ATOM 1729 C GLY A 115 16.343 -8.093 2.374 1.00 0.00 C ATOM 1730 O GLY A 115 15.915 -8.665 1.374 1.00 0.00 O ATOM 0 H GLY A 115 15.956 -5.560 3.628 1.00 0.00 H new ATOM 0 HA2 GLY A 115 16.572 -6.191 1.427 1.00 0.00 H new ATOM 0 HA3 GLY A 115 18.067 -6.878 2.030 1.00 0.00 H new ATOM 1734 N ALA A 116 16.248 -8.604 3.595 1.00 0.00 N ATOM 1735 CA ALA A 116 15.672 -9.924 3.824 1.00 0.00 C ATOM 1736 C ALA A 116 14.181 -9.837 4.144 1.00 0.00 C ATOM 1737 O ALA A 116 13.802 -9.361 5.213 1.00 0.00 O ATOM 1738 CB ALA A 116 16.417 -10.638 4.945 1.00 0.00 C ATOM 0 H ALA A 116 16.561 -8.126 4.440 1.00 0.00 H new ATOM 0 HA ALA A 116 15.780 -10.500 2.905 1.00 0.00 H new ATOM 0 HB1 ALA A 116 15.977 -11.622 5.105 1.00 0.00 H new ATOM 0 HB2 ALA A 116 17.466 -10.750 4.671 1.00 0.00 H new ATOM 0 HB3 ALA A 116 16.342 -10.053 5.862 1.00 0.00 H new ATOM 1744 N PRO A 117 13.320 -10.291 3.218 1.00 0.00 N ATOM 1745 CA PRO A 117 11.872 -10.318 3.422 1.00 0.00 C ATOM 1746 C PRO A 117 11.460 -11.439 4.371 1.00 0.00 C ATOM 1747 O PRO A 117 11.571 -12.622 4.040 1.00 0.00 O ATOM 1748 CB PRO A 117 11.298 -10.564 2.018 1.00 0.00 C ATOM 1749 CG PRO A 117 12.462 -10.490 1.081 1.00 0.00 C ATOM 1750 CD PRO A 117 13.680 -10.814 1.896 1.00 0.00 C ATOM 0 HA PRO A 117 11.508 -9.396 3.875 1.00 0.00 H new ATOM 0 HB2 PRO A 117 10.811 -11.537 1.960 1.00 0.00 H new ATOM 0 HB3 PRO A 117 10.546 -9.816 1.767 1.00 0.00 H new ATOM 0 HG2 PRO A 117 12.345 -11.196 0.259 1.00 0.00 H new ATOM 0 HG3 PRO A 117 12.543 -9.497 0.639 1.00 0.00 H new ATOM 0 HD2 PRO A 117 13.878 -11.886 1.923 1.00 0.00 H new ATOM 0 HD3 PRO A 117 14.575 -10.334 1.499 1.00 0.00 H new ATOM 1758 N GLU A 118 10.997 -11.062 5.551 1.00 0.00 N ATOM 1759 CA GLU A 118 10.644 -12.019 6.584 1.00 0.00 C ATOM 1760 C GLU A 118 9.174 -12.417 6.487 1.00 0.00 C ATOM 1761 O GLU A 118 8.852 -13.538 6.090 1.00 0.00 O ATOM 1762 CB GLU A 118 10.950 -11.423 7.958 1.00 0.00 C ATOM 1763 CG GLU A 118 10.706 -12.372 9.116 1.00 0.00 C ATOM 1764 CD GLU A 118 11.027 -11.736 10.450 1.00 0.00 C ATOM 1765 OE1 GLU A 118 10.208 -10.928 10.936 1.00 0.00 O ATOM 1766 OE2 GLU A 118 12.098 -12.042 11.021 1.00 0.00 O ATOM 0 H GLU A 118 10.856 -10.088 5.818 1.00 0.00 H new ATOM 0 HA GLU A 118 11.239 -12.921 6.442 1.00 0.00 H new ATOM 0 HB2 GLU A 118 11.992 -11.103 7.979 1.00 0.00 H new ATOM 0 HB3 GLU A 118 10.339 -10.531 8.099 1.00 0.00 H new ATOM 0 HG2 GLU A 118 9.664 -12.692 9.109 1.00 0.00 H new ATOM 0 HG3 GLU A 118 11.315 -13.267 8.985 1.00 0.00 H new ATOM 1773 N ALA A 119 8.281 -11.497 6.832 1.00 0.00 N ATOM 1774 CA ALA A 119 6.854 -11.795 6.845 1.00 0.00 C ATOM 1775 C ALA A 119 6.012 -10.546 6.606 1.00 0.00 C ATOM 1776 O ALA A 119 6.471 -9.421 6.807 1.00 0.00 O ATOM 1777 CB ALA A 119 6.466 -12.442 8.166 1.00 0.00 C ATOM 0 H ALA A 119 8.518 -10.543 7.105 1.00 0.00 H new ATOM 0 HA ALA A 119 6.655 -12.489 6.029 1.00 0.00 H new ATOM 0 HB1 ALA A 119 5.398 -12.660 8.164 1.00 0.00 H new ATOM 0 HB2 ALA A 119 7.025 -13.368 8.296 1.00 0.00 H new ATOM 0 HB3 ALA A 119 6.696 -11.762 8.986 1.00 0.00 H new ATOM 1783 N LEU A 120 4.777 -10.759 6.171 1.00 0.00 N ATOM 1784 CA LEU A 120 3.823 -9.673 5.959 1.00 0.00 C ATOM 1785 C LEU A 120 2.815 -9.620 7.103 1.00 0.00 C ATOM 1786 O LEU A 120 2.352 -10.657 7.573 1.00 0.00 O ATOM 1787 CB LEU A 120 3.077 -9.867 4.636 1.00 0.00 C ATOM 1788 CG LEU A 120 3.859 -9.490 3.376 1.00 0.00 C ATOM 1789 CD1 LEU A 120 3.158 -10.017 2.134 1.00 0.00 C ATOM 1790 CD2 LEU A 120 4.019 -7.982 3.288 1.00 0.00 C ATOM 0 H LEU A 120 4.407 -11.685 5.955 1.00 0.00 H new ATOM 0 HA LEU A 120 4.378 -8.736 5.924 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.778 -10.912 4.558 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.162 -9.275 4.665 1.00 0.00 H new ATOM 0 HG LEU A 120 4.847 -9.946 3.435 1.00 0.00 H new ATOM 0 HD11 LEU A 120 3.729 -9.739 1.248 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.083 -11.103 2.191 1.00 0.00 H new ATOM 0 HD13 LEU A 120 2.158 -9.587 2.071 1.00 0.00 H new ATOM 0 HD21 LEU A 120 4.577 -7.727 2.387 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.036 -7.513 3.250 1.00 0.00 H new ATOM 0 HD23 LEU A 120 4.559 -7.622 4.163 1.00 0.00 H new ATOM 1802 N THR A 121 2.487 -8.416 7.551 1.00 0.00 N ATOM 1803 CA THR A 121 1.483 -8.234 8.588 1.00 0.00 C ATOM 1804 C THR A 121 0.614 -7.028 8.263 1.00 0.00 C ATOM 1805 O THR A 121 1.130 -5.962 7.939 1.00 0.00 O ATOM 1806 CB THR A 121 2.120 -8.046 9.987 1.00 0.00 C ATOM 1807 OG1 THR A 121 3.148 -7.045 9.946 1.00 0.00 O ATOM 1808 CG2 THR A 121 2.701 -9.350 10.511 1.00 0.00 C ATOM 0 H THR A 121 2.903 -7.549 7.211 1.00 0.00 H new ATOM 0 HA THR A 121 0.875 -9.138 8.614 1.00 0.00 H new ATOM 0 HB THR A 121 1.329 -7.722 10.663 1.00 0.00 H new ATOM 0 HG1 THR A 121 3.292 -6.762 9.019 1.00 0.00 H new ATOM 0 HG21 THR A 121 3.140 -9.183 11.495 1.00 0.00 H new ATOM 0 HG22 THR A 121 1.910 -10.096 10.589 1.00 0.00 H new ATOM 0 HG23 THR A 121 3.470 -9.707 9.826 1.00 0.00 H new ATOM 1816 N ALA A 122 -0.695 -7.196 8.331 1.00 0.00 N ATOM 1817 CA ALA A 122 -1.605 -6.099 8.047 1.00 0.00 C ATOM 1818 C ALA A 122 -2.282 -5.636 9.320 1.00 0.00 C ATOM 1819 O ALA A 122 -2.719 -6.451 10.137 1.00 0.00 O ATOM 1820 CB ALA A 122 -2.638 -6.505 7.008 1.00 0.00 C ATOM 0 H ALA A 122 -1.150 -8.075 8.579 1.00 0.00 H new ATOM 0 HA ALA A 122 -1.026 -5.270 7.639 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.307 -5.667 6.813 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -2.133 -6.789 6.085 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.216 -7.351 7.380 1.00 0.00 H new ATOM 1826 N TRP A 123 -2.345 -4.330 9.493 1.00 0.00 N ATOM 1827 CA TRP A 123 -2.840 -3.751 10.725 1.00 0.00 C ATOM 1828 C TRP A 123 -3.889 -2.689 10.445 1.00 0.00 C ATOM 1829 O TRP A 123 -3.735 -1.865 9.540 1.00 0.00 O ATOM 1830 CB TRP A 123 -1.679 -3.136 11.504 1.00 0.00 C ATOM 1831 CG TRP A 123 -0.555 -4.098 11.745 1.00 0.00 C ATOM 1832 CD1 TRP A 123 0.504 -4.350 10.919 1.00 0.00 C ATOM 1833 CD2 TRP A 123 -0.392 -4.950 12.879 1.00 0.00 C ATOM 1834 NE1 TRP A 123 1.324 -5.298 11.483 1.00 0.00 N ATOM 1835 CE2 TRP A 123 0.795 -5.680 12.689 1.00 0.00 C ATOM 1836 CE3 TRP A 123 -1.134 -5.157 14.041 1.00 0.00 C ATOM 1837 CZ2 TRP A 123 1.254 -6.608 13.618 1.00 0.00 C ATOM 1838 CZ3 TRP A 123 -0.680 -6.076 14.964 1.00 0.00 C ATOM 1839 CH2 TRP A 123 0.507 -6.794 14.749 1.00 0.00 C ATOM 0 H TRP A 123 -2.058 -3.648 8.792 1.00 0.00 H new ATOM 0 HA TRP A 123 -3.303 -4.541 11.316 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -1.299 -2.273 10.957 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -2.047 -2.769 12.462 1.00 0.00 H new ATOM 0 HD1 TRP A 123 0.672 -3.874 9.964 1.00 0.00 H new ATOM 0 HE1 TRP A 123 2.185 -5.658 11.072 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -2.048 -4.608 14.215 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 2.167 -7.161 13.453 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -1.247 -6.246 15.867 1.00 0.00 H new ATOM 0 HH2 TRP A 123 0.837 -7.507 15.490 1.00 0.00 H new ATOM 1850 N ALA A 124 -4.954 -2.713 11.224 1.00 0.00 N ATOM 1851 CA ALA A 124 -5.987 -1.707 11.117 1.00 0.00 C ATOM 1852 C ALA A 124 -5.876 -0.733 12.279 1.00 0.00 C ATOM 1853 O ALA A 124 -5.678 -1.142 13.427 1.00 0.00 O ATOM 1854 CB ALA A 124 -7.358 -2.358 11.078 1.00 0.00 C ATOM 0 H ALA A 124 -5.124 -3.421 11.938 1.00 0.00 H new ATOM 0 HA ALA A 124 -5.855 -1.153 10.187 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -8.125 -1.587 10.997 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -7.420 -3.023 10.217 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -7.515 -2.931 11.992 1.00 0.00 H new ATOM 1860 N LEU A 125 -5.987 0.547 11.979 1.00 0.00 N ATOM 1861 CA LEU A 125 -5.838 1.585 12.986 1.00 0.00 C ATOM 1862 C LEU A 125 -7.182 1.886 13.631 1.00 0.00 C ATOM 1863 O LEU A 125 -8.209 1.927 12.952 1.00 0.00 O ATOM 1864 CB LEU A 125 -5.263 2.857 12.348 1.00 0.00 C ATOM 1865 CG LEU A 125 -5.070 4.045 13.295 1.00 0.00 C ATOM 1866 CD1 LEU A 125 -4.024 3.729 14.354 1.00 0.00 C ATOM 1867 CD2 LEU A 125 -4.685 5.291 12.512 1.00 0.00 C ATOM 0 H LEU A 125 -6.181 0.896 11.041 1.00 0.00 H new ATOM 0 HA LEU A 125 -5.150 1.233 13.755 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -4.300 2.613 11.899 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -5.923 3.165 11.537 1.00 0.00 H new ATOM 0 HG LEU A 125 -6.016 4.236 13.803 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -3.904 4.588 15.015 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -4.345 2.865 14.936 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -3.072 3.508 13.871 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -4.552 6.126 13.200 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -3.753 5.110 11.976 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -5.474 5.531 11.799 1.00 0.00 H new ATOM 1879 N ALA A 126 -7.172 2.070 14.947 1.00 0.00 N ATOM 1880 CA ALA A 126 -8.371 2.472 15.666 1.00 0.00 C ATOM 1881 C ALA A 126 -8.824 3.847 15.180 1.00 0.00 C ATOM 1882 O ALA A 126 -7.995 4.730 14.963 1.00 0.00 O ATOM 1883 CB ALA A 126 -8.108 2.489 17.163 1.00 0.00 C ATOM 0 H ALA A 126 -6.347 1.947 15.535 1.00 0.00 H new ATOM 0 HA ALA A 126 -9.165 1.752 15.471 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -9.014 2.792 17.688 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -7.814 1.492 17.492 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -7.308 3.195 17.384 1.00 0.00 H new ATOM 1889 N PRO A 127 -10.140 4.051 15.000 1.00 0.00 N ATOM 1890 CA PRO A 127 -10.689 5.310 14.471 1.00 0.00 C ATOM 1891 C PRO A 127 -10.343 6.515 15.344 1.00 0.00 C ATOM 1892 O PRO A 127 -10.300 7.649 14.869 1.00 0.00 O ATOM 1893 CB PRO A 127 -12.206 5.073 14.457 1.00 0.00 C ATOM 1894 CG PRO A 127 -12.429 3.932 15.389 1.00 0.00 C ATOM 1895 CD PRO A 127 -11.200 3.074 15.291 1.00 0.00 C ATOM 0 HA PRO A 127 -10.276 5.545 13.490 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -12.747 5.961 14.784 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -12.559 4.837 13.453 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -12.579 4.285 16.409 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -13.321 3.370 15.112 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -11.009 2.535 16.219 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -11.290 2.328 14.501 1.00 0.00 H new ATOM 1903 N ASP A 128 -10.083 6.254 16.619 1.00 0.00 N ATOM 1904 CA ASP A 128 -9.740 7.306 17.571 1.00 0.00 C ATOM 1905 C ASP A 128 -8.244 7.623 17.513 1.00 0.00 C ATOM 1906 O ASP A 128 -7.779 8.603 18.098 1.00 0.00 O ATOM 1907 CB ASP A 128 -10.142 6.865 18.983 1.00 0.00 C ATOM 1908 CG ASP A 128 -9.941 7.946 20.024 1.00 0.00 C ATOM 1909 OD1 ASP A 128 -10.636 8.981 19.951 1.00 0.00 O ATOM 1910 OD2 ASP A 128 -9.111 7.752 20.939 1.00 0.00 O ATOM 0 H ASP A 128 -10.103 5.317 17.021 1.00 0.00 H new ATOM 0 HA ASP A 128 -10.284 8.214 17.309 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -11.190 6.564 18.978 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -9.559 5.987 19.262 1.00 0.00 H new ATOM 1915 N ARG A 129 -7.509 6.798 16.765 1.00 0.00 N ATOM 1916 CA ARG A 129 -6.056 6.901 16.663 1.00 0.00 C ATOM 1917 C ARG A 129 -5.432 6.671 18.037 1.00 0.00 C ATOM 1918 O ARG A 129 -5.124 7.614 18.770 1.00 0.00 O ATOM 1919 CB ARG A 129 -5.643 8.261 16.065 1.00 0.00 C ATOM 1920 CG ARG A 129 -4.209 8.338 15.537 1.00 0.00 C ATOM 1921 CD ARG A 129 -3.176 8.390 16.655 1.00 0.00 C ATOM 1922 NE ARG A 129 -1.880 8.879 16.193 1.00 0.00 N ATOM 1923 CZ ARG A 129 -0.920 9.317 17.009 1.00 0.00 C ATOM 1924 NH1 ARG A 129 -1.060 9.208 18.327 1.00 0.00 N ATOM 1925 NH2 ARG A 129 0.186 9.845 16.510 1.00 0.00 N ATOM 0 H ARG A 129 -7.907 6.039 16.213 1.00 0.00 H new ATOM 0 HA ARG A 129 -5.685 6.132 15.985 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -6.326 8.503 15.250 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -5.773 9.029 16.828 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -4.011 7.472 14.905 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -4.104 9.222 14.909 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -3.541 9.036 17.454 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -3.055 7.394 17.081 1.00 0.00 H new ATOM 0 HE ARG A 129 -1.698 8.886 15.189 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -1.904 8.788 18.717 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -0.324 9.544 18.948 1.00 0.00 H new ATOM 0 HH21 ARG A 129 0.306 9.918 15.500 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.919 10.179 17.136 1.00 0.00 H new ATOM 1939 N SER A 130 -5.291 5.407 18.391 1.00 0.00 N ATOM 1940 CA SER A 130 -4.728 5.031 19.676 1.00 0.00 C ATOM 1941 C SER A 130 -3.754 3.869 19.514 1.00 0.00 C ATOM 1942 O SER A 130 -2.580 3.975 19.867 1.00 0.00 O ATOM 1943 CB SER A 130 -5.851 4.660 20.644 1.00 0.00 C ATOM 1944 OG SER A 130 -6.730 3.708 20.062 1.00 0.00 O ATOM 0 H SER A 130 -5.560 4.618 17.803 1.00 0.00 H new ATOM 0 HA SER A 130 -4.178 5.879 20.083 1.00 0.00 H new ATOM 0 HB2 SER A 130 -5.426 4.254 21.562 1.00 0.00 H new ATOM 0 HB3 SER A 130 -6.409 5.555 20.920 1.00 0.00 H new ATOM 0 HG SER A 130 -7.439 3.485 20.700 1.00 0.00 H new ATOM 1950 N GLU A 131 -4.244 2.768 18.962 1.00 0.00 N ATOM 1951 CA GLU A 131 -3.425 1.588 18.757 1.00 0.00 C ATOM 1952 C GLU A 131 -3.747 0.936 17.420 1.00 0.00 C ATOM 1953 O GLU A 131 -4.638 1.378 16.688 1.00 0.00 O ATOM 1954 CB GLU A 131 -3.651 0.571 19.882 1.00 0.00 C ATOM 1955 CG GLU A 131 -5.080 0.057 19.951 1.00 0.00 C ATOM 1956 CD GLU A 131 -5.254 -1.081 20.935 1.00 0.00 C ATOM 1957 OE1 GLU A 131 -5.290 -0.826 22.156 1.00 0.00 O ATOM 1958 OE2 GLU A 131 -5.365 -2.242 20.489 1.00 0.00 O ATOM 0 H GLU A 131 -5.209 2.670 18.648 1.00 0.00 H new ATOM 0 HA GLU A 131 -2.381 1.903 18.761 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -2.975 -0.273 19.741 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -3.391 1.031 20.835 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -5.742 0.877 20.231 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -5.388 -0.277 18.960 1.00 0.00 H new ATOM 1965 N PHE A 132 -3.020 -0.123 17.124 1.00 0.00 N ATOM 1966 CA PHE A 132 -3.251 -0.917 15.930 1.00 0.00 C ATOM 1967 C PHE A 132 -3.764 -2.283 16.328 1.00 0.00 C ATOM 1968 O PHE A 132 -3.361 -2.824 17.358 1.00 0.00 O ATOM 1969 CB PHE A 132 -1.963 -1.090 15.124 1.00 0.00 C ATOM 1970 CG PHE A 132 -1.473 0.167 14.467 1.00 0.00 C ATOM 1971 CD1 PHE A 132 -1.885 0.497 13.187 1.00 0.00 C ATOM 1972 CD2 PHE A 132 -0.595 1.013 15.122 1.00 0.00 C ATOM 1973 CE1 PHE A 132 -1.435 1.649 12.575 1.00 0.00 C ATOM 1974 CE2 PHE A 132 -0.143 2.168 14.515 1.00 0.00 C ATOM 1975 CZ PHE A 132 -0.563 2.486 13.240 1.00 0.00 C ATOM 0 H PHE A 132 -2.251 -0.459 17.704 1.00 0.00 H new ATOM 0 HA PHE A 132 -3.984 -0.397 15.312 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -1.183 -1.469 15.784 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -2.127 -1.847 14.357 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -2.567 -0.155 12.661 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -0.260 0.767 16.119 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -1.765 1.895 11.577 1.00 0.00 H new ATOM 0 HE2 PHE A 132 0.539 2.822 15.038 1.00 0.00 H new ATOM 0 HZ PHE A 132 -0.210 3.388 12.763 1.00 0.00 H new ATOM 1985 N HIS A 133 -4.638 -2.843 15.519 1.00 0.00 N ATOM 1986 CA HIS A 133 -5.113 -4.188 15.759 1.00 0.00 C ATOM 1987 C HIS A 133 -4.869 -5.062 14.547 1.00 0.00 C ATOM 1988 O HIS A 133 -5.082 -4.643 13.407 1.00 0.00 O ATOM 1989 CB HIS A 133 -6.592 -4.230 16.169 1.00 0.00 C ATOM 1990 CG HIS A 133 -7.483 -3.248 15.473 1.00 0.00 C ATOM 1991 ND1 HIS A 133 -8.334 -3.587 14.446 1.00 0.00 N ATOM 1992 CD2 HIS A 133 -7.692 -1.940 15.717 1.00 0.00 C ATOM 1993 CE1 HIS A 133 -9.029 -2.524 14.089 1.00 0.00 C ATOM 1994 NE2 HIS A 133 -8.665 -1.506 14.847 1.00 0.00 N ATOM 0 H HIS A 133 -5.032 -2.391 14.694 1.00 0.00 H new ATOM 0 HA HIS A 133 -4.543 -4.580 16.601 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -6.974 -5.234 15.985 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -6.658 -4.056 17.243 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -7.187 -1.341 16.461 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -9.773 -2.492 13.306 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -9.041 -0.559 14.796 1.00 0.00 H new ATOM 2003 N ARG A 134 -4.395 -6.272 14.815 1.00 0.00 N ATOM 2004 CA ARG A 134 -4.053 -7.229 13.776 1.00 0.00 C ATOM 2005 C ARG A 134 -5.252 -7.519 12.880 1.00 0.00 C ATOM 2006 O ARG A 134 -6.381 -7.655 13.355 1.00 0.00 O ATOM 2007 CB ARG A 134 -3.545 -8.520 14.422 1.00 0.00 C ATOM 2008 CG ARG A 134 -3.290 -9.644 13.436 1.00 0.00 C ATOM 2009 CD ARG A 134 -2.059 -9.399 12.578 1.00 0.00 C ATOM 2010 NE ARG A 134 -1.895 -10.447 11.571 1.00 0.00 N ATOM 2011 CZ ARG A 134 -0.809 -11.216 11.455 1.00 0.00 C ATOM 2012 NH1 ARG A 134 0.210 -11.078 12.297 1.00 0.00 N ATOM 2013 NH2 ARG A 134 -0.753 -12.144 10.508 1.00 0.00 N ATOM 0 H ARG A 134 -4.237 -6.616 15.762 1.00 0.00 H new ATOM 0 HA ARG A 134 -3.268 -6.802 13.151 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -2.622 -8.306 14.960 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -4.273 -8.856 15.160 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -3.168 -10.580 13.981 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -4.161 -9.761 12.791 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -2.143 -8.430 12.087 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -1.173 -9.359 13.212 1.00 0.00 H new ATOM 0 HE ARG A 134 -2.660 -10.601 10.914 1.00 0.00 H new ATOM 0 HH11 ARG A 134 0.167 -10.380 13.040 1.00 0.00 H new ATOM 0 HH12 ARG A 134 1.035 -11.670 12.200 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -1.539 -12.269 9.870 1.00 0.00 H new ATOM 0 HH22 ARG A 134 0.076 -12.732 10.418 1.00 0.00 H new ATOM 2027 N GLU A 135 -5.000 -7.600 11.585 1.00 0.00 N ATOM 2028 CA GLU A 135 -6.047 -7.872 10.618 1.00 0.00 C ATOM 2029 C GLU A 135 -5.670 -9.092 9.781 1.00 0.00 C ATOM 2030 O GLU A 135 -4.499 -9.490 9.752 1.00 0.00 O ATOM 2031 CB GLU A 135 -6.274 -6.640 9.733 1.00 0.00 C ATOM 2032 CG GLU A 135 -7.538 -6.710 8.893 1.00 0.00 C ATOM 2033 CD GLU A 135 -8.748 -7.096 9.716 1.00 0.00 C ATOM 2034 OE1 GLU A 135 -9.292 -6.226 10.429 1.00 0.00 O ATOM 2035 OE2 GLU A 135 -9.144 -8.282 9.661 1.00 0.00 O ATOM 0 H GLU A 135 -4.073 -7.480 11.178 1.00 0.00 H new ATOM 0 HA GLU A 135 -6.979 -8.090 11.139 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -6.319 -5.754 10.366 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -5.416 -6.517 9.072 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -7.714 -5.743 8.422 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -7.400 -7.435 8.091 1.00 0.00 H new ATOM 2042 N ASP A 136 -6.652 -9.690 9.124 1.00 0.00 N ATOM 2043 CA ASP A 136 -6.426 -10.900 8.344 1.00 0.00 C ATOM 2044 C ASP A 136 -6.348 -10.599 6.856 1.00 0.00 C ATOM 2045 O ASP A 136 -6.999 -9.679 6.358 1.00 0.00 O ATOM 2046 CB ASP A 136 -7.532 -11.926 8.600 1.00 0.00 C ATOM 2047 CG ASP A 136 -7.234 -12.813 9.789 1.00 0.00 C ATOM 2048 OD1 ASP A 136 -7.536 -12.409 10.930 1.00 0.00 O ATOM 2049 OD2 ASP A 136 -6.686 -13.918 9.588 1.00 0.00 O ATOM 0 H ASP A 136 -7.616 -9.357 9.115 1.00 0.00 H new ATOM 0 HA ASP A 136 -5.470 -11.314 8.664 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -8.475 -11.405 8.766 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -7.662 -12.545 7.712 1.00 0.00 H new ATOM 2054 N ILE A 137 -5.545 -11.389 6.158 1.00 0.00 N ATOM 2055 CA ILE A 137 -5.409 -11.281 4.714 1.00 0.00 C ATOM 2056 C ILE A 137 -6.296 -12.321 4.047 1.00 0.00 C ATOM 2057 O ILE A 137 -6.087 -13.521 4.219 1.00 0.00 O ATOM 2058 CB ILE A 137 -3.948 -11.501 4.262 1.00 0.00 C ATOM 2059 CG1 ILE A 137 -3.022 -10.470 4.916 1.00 0.00 C ATOM 2060 CG2 ILE A 137 -3.838 -11.433 2.745 1.00 0.00 C ATOM 2061 CD1 ILE A 137 -3.358 -9.033 4.567 1.00 0.00 C ATOM 0 H ILE A 137 -4.971 -12.121 6.576 1.00 0.00 H new ATOM 0 HA ILE A 137 -5.709 -10.275 4.422 1.00 0.00 H new ATOM 0 HB ILE A 137 -3.637 -12.495 4.582 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -3.067 -10.591 5.998 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -1.995 -10.676 4.615 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -2.801 -11.590 2.448 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -4.464 -12.206 2.300 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -4.170 -10.454 2.400 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -2.658 -8.364 5.068 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -3.284 -8.894 3.488 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -4.373 -8.807 4.893 1.00 0.00 H new ATOM 2073 N VAL A 138 -7.299 -11.864 3.312 1.00 0.00 N ATOM 2074 CA VAL A 138 -8.219 -12.774 2.656 1.00 0.00 C ATOM 2075 C VAL A 138 -8.202 -12.556 1.154 1.00 0.00 C ATOM 2076 O VAL A 138 -7.878 -11.467 0.669 1.00 0.00 O ATOM 2077 CB VAL A 138 -9.669 -12.608 3.146 1.00 0.00 C ATOM 2078 CG1 VAL A 138 -10.427 -13.922 3.022 1.00 0.00 C ATOM 2079 CG2 VAL A 138 -9.721 -12.086 4.577 1.00 0.00 C ATOM 0 H VAL A 138 -7.494 -10.875 3.157 1.00 0.00 H new ATOM 0 HA VAL A 138 -7.880 -13.779 2.907 1.00 0.00 H new ATOM 0 HB VAL A 138 -10.152 -11.866 2.510 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -11.450 -13.786 3.373 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -10.440 -14.238 1.979 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -9.935 -14.684 3.626 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -10.760 -11.981 4.889 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -9.213 -12.787 5.239 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -9.227 -11.116 4.628 1.00 0.00 H new ATOM 2089 N ARG A 139 -8.563 -13.597 0.435 1.00 0.00 N ATOM 2090 CA ARG A 139 -8.632 -13.563 -1.010 1.00 0.00 C ATOM 2091 C ARG A 139 -10.063 -13.296 -1.451 1.00 0.00 C ATOM 2092 O ARG A 139 -11.006 -13.837 -0.874 1.00 0.00 O ATOM 2093 CB ARG A 139 -8.131 -14.884 -1.589 1.00 0.00 C ATOM 2094 CG ARG A 139 -6.618 -15.028 -1.545 1.00 0.00 C ATOM 2095 CD ARG A 139 -6.166 -16.410 -1.995 1.00 0.00 C ATOM 2096 NE ARG A 139 -6.473 -17.437 -1.002 1.00 0.00 N ATOM 2097 CZ ARG A 139 -5.838 -18.605 -0.920 1.00 0.00 C ATOM 2098 NH1 ARG A 139 -4.936 -18.936 -1.834 1.00 0.00 N ATOM 2099 NH2 ARG A 139 -6.126 -19.455 0.061 1.00 0.00 N ATOM 0 H ARG A 139 -8.819 -14.498 0.840 1.00 0.00 H new ATOM 0 HA ARG A 139 -7.996 -12.760 -1.381 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -8.583 -15.708 -1.038 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -8.467 -14.970 -2.622 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -6.163 -14.271 -2.184 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -6.265 -14.843 -0.530 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -6.652 -16.661 -2.938 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -5.092 -16.397 -2.183 1.00 0.00 H new ATOM 0 HE ARG A 139 -7.218 -17.248 -0.332 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -4.728 -18.296 -2.600 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -4.450 -19.831 -1.770 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -6.835 -19.213 0.753 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -5.638 -20.349 0.121 1.00 0.00 H new ATOM 2113 N PRO A 140 -10.243 -12.439 -2.459 1.00 0.00 N ATOM 2114 CA PRO A 140 -11.566 -12.055 -2.945 1.00 0.00 C ATOM 2115 C PRO A 140 -12.318 -13.209 -3.603 1.00 0.00 C ATOM 2116 O PRO A 140 -11.947 -13.667 -4.686 1.00 0.00 O ATOM 2117 CB PRO A 140 -11.280 -10.957 -3.977 1.00 0.00 C ATOM 2118 CG PRO A 140 -9.858 -10.564 -3.760 1.00 0.00 C ATOM 2119 CD PRO A 140 -9.170 -11.771 -3.203 1.00 0.00 C ATOM 0 HA PRO A 140 -12.205 -11.732 -2.123 1.00 0.00 H new ATOM 0 HB2 PRO A 140 -11.435 -11.323 -4.992 1.00 0.00 H new ATOM 0 HB3 PRO A 140 -11.947 -10.106 -3.839 1.00 0.00 H new ATOM 0 HG2 PRO A 140 -9.395 -10.249 -4.695 1.00 0.00 H new ATOM 0 HG3 PRO A 140 -9.788 -9.723 -3.070 1.00 0.00 H new ATOM 0 HD2 PRO A 140 -8.767 -12.407 -3.991 1.00 0.00 H new ATOM 0 HD3 PRO A 140 -8.337 -11.499 -2.555 1.00 0.00 H new ATOM 2127 N ASP A 141 -13.358 -13.688 -2.927 1.00 0.00 N ATOM 2128 CA ASP A 141 -14.267 -14.672 -3.507 1.00 0.00 C ATOM 2129 C ASP A 141 -15.342 -13.947 -4.314 1.00 0.00 C ATOM 2130 O ASP A 141 -16.292 -13.404 -3.747 1.00 0.00 O ATOM 2131 CB ASP A 141 -14.923 -15.536 -2.418 1.00 0.00 C ATOM 2132 CG ASP A 141 -13.925 -16.348 -1.610 1.00 0.00 C ATOM 2133 OD1 ASP A 141 -13.150 -17.117 -2.215 1.00 0.00 O ATOM 2134 OD2 ASP A 141 -13.929 -16.240 -0.362 1.00 0.00 O ATOM 0 H ASP A 141 -13.593 -13.410 -1.974 1.00 0.00 H new ATOM 0 HA ASP A 141 -13.695 -15.333 -4.158 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -15.487 -14.891 -1.744 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -15.639 -16.213 -2.884 1.00 0.00 H new