USER MOD reduce.3.24.130724 H: found=0, std=0, add=1085, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1085 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 NoAdj : A 139 ASNHD21 : A 139 ASN OD1 : A 201 CUCU :(metal ligand) USER MOD NoAdj : A 139 ASNHD22 : A 139 ASN OD1 : A 201 CUCU :(metal ligand) USER MOD Set 1.1: A 131 ASN : amide:sc= -0.377 K(o=-1.5,f=-2.9) USER MOD Set 1.2: A 134 SER OG : rot 175:sc= -1.14! USER MOD Set 2.1: A 63 HIS : no HD1:sc=-0.00227 X(o=0.82,f=0.82) USER MOD Set 2.2: A 135 THR OG1 : rot 58:sc= 0.819 USER MOD Set 3.1: A 48 HIS : no HE2:sc= 0.0818 K(o=0.056,f=-4!) USER MOD Set 3.2: A 65 ASN : amide:sc= -0.0261 K(o=0.056,f=-1.2!) USER MOD Set 4.1: A 43 HIS : no HD1:sc= -1.37! K(o=-3.5!,f=-0.88) USER MOD Set 4.2: A 86 ASN : amide:sc= -2.08 K(o=-3.5,f=-11!) USER MOD Set 5.1: A 3 LYS NZ :NH3+ -162:sc= 1.17 (180deg=0) USER MOD Set 5.2: A 153 GLN : amide:sc= 0.515 K(o=1.7,f=-9!) USER MOD Single : A 1 ALA N :NH3+ -173:sc= -0.0341 (180deg=-0.116) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= -0.876 K(o=-0.88,f=0) USER MOD Single : A 19 ASN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 22 GLN : amide:sc= -1.31 K(o=-1.3,f=-12!) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot -130:sc= -0.943 USER MOD Single : A 26 ASN : amide:sc= -1.15 K(o=-1.1,f=-0.01) USER MOD Single : A 30 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.017) USER MOD Single : A 34 SER OG : rot 180:sc= 0.0237 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 38:sc= 1.19 USER MOD Single : A 46 HIS : no HD1:sc= -2.28 K(o=-2.3,f=-7.6!) USER MOD Single : A 53 ASN : amide:sc= 0.772 K(o=0.77,f=-9.7!) USER MOD Single : A 54 THR OG1 : rot 141:sc= 0.956 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0.108 USER MOD Single : A 68 SER OG : rot -51:sc= -1.33! USER MOD Single : A 70 LYS NZ :NH3+ -177:sc= 1.29 (180deg=1.18) USER MOD Single : A 71 HIS : no HD1:sc= -0.787 K(o=-0.79,f=-1.3!) USER MOD Single : A 75 LYS NZ :NH3+ -133:sc= -0.208 (180deg=-1.49!) USER MOD Single : A 80 HIS : no HE2:sc= 1.01 K(o=1,f=-6.8!) USER MOD Single : A 88 THR OG1 : rot 33:sc= 0.611 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 65:sc= 0.404 USER MOD Single : A 102 SER OG : rot -157:sc= 0.0471 USER MOD Single : A 105 SER OG : rot 110:sc=-0.00471 USER MOD Single : A 107 SER OG : rot 4:sc= -0.777 USER MOD Single : A 110 HIS : no HE2:sc= 1.16 K(o=1.2,f=-4.4!) USER MOD Single : A 111 SER OG : rot 180:sc= 0.0557 USER MOD Single : A 116 THR OG1 : rot 43:sc= 0.397 USER MOD Single : A 120 HIS : no HE2:sc= -0.842 K(o=-0.84,f=-3.7!) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0868) USER MOD Single : A 136 LYS NZ :NH3+ 174:sc= 1.26 (180deg=1.11) USER MOD Single : A 137 THR OG1 : rot 180:sc= -0.238 USER MOD Single : A 142 SER OG : rot 130:sc= 0.0594 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 7.676 -11.862 2.571 1.00 0.00 N ATOM 2 CA ALA A 1 8.055 -11.843 1.157 1.00 0.00 C ATOM 3 C ALA A 1 7.181 -12.783 0.351 1.00 0.00 C ATOM 4 O ALA A 1 6.678 -12.411 -0.685 1.00 0.00 O ATOM 5 CB ALA A 1 9.521 -12.213 0.991 1.00 0.00 C ATOM 0 H1 ALA A 1 8.205 -11.127 3.082 1.00 0.00 H new ATOM 0 H2 ALA A 1 6.656 -11.679 2.660 1.00 0.00 H new ATOM 0 H3 ALA A 1 7.897 -12.793 2.977 1.00 0.00 H new ATOM 0 HA ALA A 1 7.907 -10.830 0.782 1.00 0.00 H new ATOM 0 HB1 ALA A 1 9.784 -12.193 -0.067 1.00 0.00 H new ATOM 0 HB2 ALA A 1 10.140 -11.498 1.532 1.00 0.00 H new ATOM 0 HB3 ALA A 1 9.691 -13.214 1.389 1.00 0.00 H new ATOM 13 N THR A 2 6.984 -13.984 0.860 1.00 0.00 N ATOM 14 CA THR A 2 6.246 -15.021 0.171 1.00 0.00 C ATOM 15 C THR A 2 4.700 -14.800 0.213 1.00 0.00 C ATOM 16 O THR A 2 3.974 -15.271 -0.668 1.00 0.00 O ATOM 17 CB THR A 2 6.626 -16.370 0.819 1.00 0.00 C ATOM 18 OG1 THR A 2 8.059 -16.410 0.954 1.00 0.00 O ATOM 19 CG2 THR A 2 6.184 -17.549 -0.035 1.00 0.00 C ATOM 0 H THR A 2 7.337 -14.269 1.774 1.00 0.00 H new ATOM 0 HA THR A 2 6.513 -15.003 -0.886 1.00 0.00 H new ATOM 0 HB THR A 2 6.127 -16.447 1.785 1.00 0.00 H new ATOM 0 HG1 THR A 2 8.325 -17.259 1.366 1.00 0.00 H new ATOM 0 HG21 THR A 2 6.469 -18.480 0.455 1.00 0.00 H new ATOM 0 HG22 THR A 2 5.102 -17.522 -0.160 1.00 0.00 H new ATOM 0 HG23 THR A 2 6.664 -17.491 -1.012 1.00 0.00 H new ATOM 27 N LYS A 3 4.213 -14.145 1.226 1.00 0.00 N ATOM 28 CA LYS A 3 2.801 -13.899 1.357 1.00 0.00 C ATOM 29 C LYS A 3 2.657 -12.647 2.153 1.00 0.00 C ATOM 30 O LYS A 3 3.664 -12.172 2.719 1.00 0.00 O ATOM 31 CB LYS A 3 2.100 -15.067 2.092 1.00 0.00 C ATOM 32 CG LYS A 3 2.581 -15.259 3.530 1.00 0.00 C ATOM 33 CD LYS A 3 1.804 -16.329 4.282 1.00 0.00 C ATOM 34 CE LYS A 3 2.034 -17.728 3.731 1.00 0.00 C ATOM 35 NZ LYS A 3 1.345 -18.739 4.554 1.00 0.00 N ATOM 0 H LYS A 3 4.779 -13.766 1.985 1.00 0.00 H new ATOM 0 HA LYS A 3 2.339 -13.807 0.374 1.00 0.00 H new ATOM 0 HB2 LYS A 3 1.025 -14.889 2.098 1.00 0.00 H new ATOM 0 HB3 LYS A 3 2.267 -15.989 1.535 1.00 0.00 H new ATOM 0 HG2 LYS A 3 3.638 -15.525 3.521 1.00 0.00 H new ATOM 0 HG3 LYS A 3 2.495 -14.313 4.065 1.00 0.00 H new ATOM 0 HD2 LYS A 3 2.091 -16.307 5.333 1.00 0.00 H new ATOM 0 HD3 LYS A 3 0.740 -16.097 4.237 1.00 0.00 H new ATOM 0 HE2 LYS A 3 1.673 -17.782 2.704 1.00 0.00 H new ATOM 0 HE3 LYS A 3 3.103 -17.942 3.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 1.748 -19.678 4.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 1.469 -18.510 5.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 0.331 -18.743 4.323 1.00 0.00 H new ATOM 49 N ALA A 4 1.480 -12.092 2.190 1.00 0.00 N ATOM 50 CA ALA A 4 1.241 -10.960 2.998 1.00 0.00 C ATOM 51 C ALA A 4 -0.210 -10.957 3.359 1.00 0.00 C ATOM 52 O ALA A 4 -0.994 -11.553 2.653 1.00 0.00 O ATOM 53 CB ALA A 4 1.686 -9.684 2.300 1.00 0.00 C ATOM 0 H ALA A 4 0.672 -12.418 1.660 1.00 0.00 H new ATOM 0 HA ALA A 4 1.830 -11.005 3.914 1.00 0.00 H new ATOM 0 HB1 ALA A 4 1.490 -8.828 2.946 1.00 0.00 H new ATOM 0 HB2 ALA A 4 2.753 -9.740 2.086 1.00 0.00 H new ATOM 0 HB3 ALA A 4 1.134 -9.568 1.367 1.00 0.00 H new ATOM 59 N VAL A 5 -0.547 -10.384 4.472 1.00 0.00 N ATOM 60 CA VAL A 5 -1.912 -10.323 4.926 1.00 0.00 C ATOM 61 C VAL A 5 -2.179 -8.902 5.400 1.00 0.00 C ATOM 62 O VAL A 5 -1.320 -8.274 6.033 1.00 0.00 O ATOM 63 CB VAL A 5 -2.202 -11.347 6.076 1.00 0.00 C ATOM 64 CG1 VAL A 5 -3.657 -11.270 6.529 1.00 0.00 C ATOM 65 CG2 VAL A 5 -1.872 -12.779 5.649 1.00 0.00 C ATOM 0 H VAL A 5 0.121 -9.939 5.102 1.00 0.00 H new ATOM 0 HA VAL A 5 -2.574 -10.591 4.103 1.00 0.00 H new ATOM 0 HB VAL A 5 -1.557 -11.076 6.912 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.828 -11.992 7.328 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -3.871 -10.266 6.895 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -4.312 -11.497 5.688 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -2.085 -13.462 6.471 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.479 -13.050 4.785 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -0.816 -12.846 5.386 1.00 0.00 H new ATOM 75 N ALA A 6 -3.322 -8.397 5.067 1.00 0.00 N ATOM 76 CA ALA A 6 -3.678 -7.029 5.361 1.00 0.00 C ATOM 77 C ALA A 6 -4.754 -6.923 6.448 1.00 0.00 C ATOM 78 O ALA A 6 -5.746 -7.662 6.422 1.00 0.00 O ATOM 79 CB ALA A 6 -4.174 -6.397 4.089 1.00 0.00 C ATOM 0 H ALA A 6 -4.049 -8.920 4.578 1.00 0.00 H new ATOM 0 HA ALA A 6 -2.796 -6.514 5.743 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -4.451 -5.360 4.282 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -3.387 -6.428 3.336 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -5.045 -6.944 3.726 1.00 0.00 H new ATOM 85 N VAL A 7 -4.554 -6.019 7.408 1.00 0.00 N ATOM 86 CA VAL A 7 -5.553 -5.757 8.450 1.00 0.00 C ATOM 87 C VAL A 7 -5.699 -4.245 8.601 1.00 0.00 C ATOM 88 O VAL A 7 -4.853 -3.621 9.186 1.00 0.00 O ATOM 89 CB VAL A 7 -5.118 -6.346 9.837 1.00 0.00 C ATOM 90 CG1 VAL A 7 -6.202 -6.135 10.890 1.00 0.00 C ATOM 91 CG2 VAL A 7 -4.751 -7.820 9.737 1.00 0.00 C ATOM 0 H VAL A 7 -3.708 -5.454 7.487 1.00 0.00 H new ATOM 0 HA VAL A 7 -6.489 -6.230 8.154 1.00 0.00 H new ATOM 0 HB VAL A 7 -4.226 -5.803 10.148 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -5.872 -6.554 11.841 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -6.391 -5.068 11.009 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -7.119 -6.632 10.573 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -4.456 -8.189 10.719 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -5.612 -8.386 9.381 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -3.922 -7.942 9.039 1.00 0.00 H new ATOM 101 N LEU A 8 -6.747 -3.679 8.058 1.00 0.00 N ATOM 102 CA LEU A 8 -6.938 -2.219 8.122 1.00 0.00 C ATOM 103 C LEU A 8 -8.194 -1.823 8.881 1.00 0.00 C ATOM 104 O LEU A 8 -9.259 -2.388 8.662 1.00 0.00 O ATOM 105 CB LEU A 8 -6.890 -1.553 6.707 1.00 0.00 C ATOM 106 CG LEU A 8 -7.905 -2.026 5.620 1.00 0.00 C ATOM 107 CD1 LEU A 8 -7.910 -1.051 4.459 1.00 0.00 C ATOM 108 CD2 LEU A 8 -7.550 -3.411 5.081 1.00 0.00 C ATOM 0 H LEU A 8 -7.484 -4.185 7.567 1.00 0.00 H new ATOM 0 HA LEU A 8 -6.093 -1.833 8.691 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.027 -0.480 6.842 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -5.886 -1.698 6.307 1.00 0.00 H new ATOM 0 HG LEU A 8 -8.887 -2.070 6.091 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -8.621 -1.388 3.704 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -8.200 -0.063 4.815 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.913 -1.001 4.022 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -8.279 -3.706 4.327 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.556 -3.384 4.634 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -7.561 -4.133 5.898 1.00 0.00 H new ATOM 120 N LYS A 9 -8.045 -0.859 9.796 1.00 0.00 N ATOM 121 CA LYS A 9 -9.134 -0.344 10.604 1.00 0.00 C ATOM 122 C LYS A 9 -9.003 1.185 10.686 1.00 0.00 C ATOM 123 O LYS A 9 -7.879 1.713 10.806 1.00 0.00 O ATOM 124 CB LYS A 9 -9.056 -0.952 12.016 1.00 0.00 C ATOM 125 CG LYS A 9 -9.017 -2.478 12.032 1.00 0.00 C ATOM 126 CD LYS A 9 -8.976 -3.032 13.440 1.00 0.00 C ATOM 127 CE LYS A 9 -8.896 -4.551 13.425 1.00 0.00 C ATOM 128 NZ LYS A 9 -8.999 -5.119 14.776 1.00 0.00 N ATOM 0 H LYS A 9 -7.148 -0.414 9.992 1.00 0.00 H new ATOM 0 HA LYS A 9 -10.092 -0.609 10.157 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -8.166 -0.570 12.516 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -9.916 -0.614 12.594 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -9.894 -2.868 11.515 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -8.142 -2.824 11.481 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -8.116 -2.624 13.970 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -9.866 -2.716 13.985 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -9.696 -4.950 12.801 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.954 -4.860 12.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -8.940 -6.156 14.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -8.221 -4.758 15.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -9.909 -4.846 15.199 1.00 0.00 H new ATOM 142 N GLY A 10 -10.106 1.894 10.584 1.00 0.00 N ATOM 143 CA GLY A 10 -10.072 3.327 10.656 1.00 0.00 C ATOM 144 C GLY A 10 -11.389 3.903 11.124 1.00 0.00 C ATOM 145 O GLY A 10 -12.193 3.205 11.740 1.00 0.00 O ATOM 0 H GLY A 10 -11.035 1.495 10.451 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -9.279 3.637 11.336 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -9.827 3.733 9.675 1.00 0.00 H new ATOM 149 N ASP A 11 -11.589 5.182 10.802 1.00 0.00 N ATOM 150 CA ASP A 11 -12.841 5.873 11.129 1.00 0.00 C ATOM 151 C ASP A 11 -13.979 5.217 10.383 1.00 0.00 C ATOM 152 O ASP A 11 -15.011 4.865 10.963 1.00 0.00 O ATOM 153 CB ASP A 11 -12.784 7.360 10.753 1.00 0.00 C ATOM 154 CG ASP A 11 -11.738 8.137 11.509 1.00 0.00 C ATOM 155 OD1 ASP A 11 -12.035 8.677 12.593 1.00 0.00 O ATOM 156 OD2 ASP A 11 -10.594 8.227 11.025 1.00 0.00 O ATOM 0 H ASP A 11 -10.903 5.760 10.317 1.00 0.00 H new ATOM 0 HA ASP A 11 -12.995 5.802 12.206 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -12.587 7.448 9.684 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -13.760 7.809 10.936 1.00 0.00 H new ATOM 161 N GLY A 12 -13.792 5.061 9.088 1.00 0.00 N ATOM 162 CA GLY A 12 -14.758 4.358 8.285 1.00 0.00 C ATOM 163 C GLY A 12 -14.412 2.890 8.291 1.00 0.00 C ATOM 164 O GLY A 12 -13.229 2.554 8.487 1.00 0.00 O ATOM 0 H GLY A 12 -12.982 5.411 8.576 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -15.762 4.512 8.680 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -14.755 4.743 7.265 1.00 0.00 H new ATOM 168 N PRO A 13 -15.361 1.970 8.071 1.00 0.00 N ATOM 169 CA PRO A 13 -15.065 0.589 8.148 1.00 0.00 C ATOM 170 C PRO A 13 -14.546 0.100 6.830 1.00 0.00 C ATOM 171 O PRO A 13 -15.199 0.204 5.774 1.00 0.00 O ATOM 172 CB PRO A 13 -16.422 -0.064 8.475 1.00 0.00 C ATOM 173 CG PRO A 13 -17.448 1.012 8.267 1.00 0.00 C ATOM 174 CD PRO A 13 -16.725 2.186 7.661 1.00 0.00 C ATOM 0 HA PRO A 13 -14.301 0.356 8.890 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -16.613 -0.918 7.825 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -16.443 -0.433 9.501 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -18.244 0.666 7.608 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -17.914 1.290 9.212 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -16.823 2.204 6.576 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -17.113 3.135 8.032 1.00 0.00 H new ATOM 182 N VAL A 14 -13.418 -0.458 6.911 1.00 0.00 N ATOM 183 CA VAL A 14 -12.720 -0.981 5.842 1.00 0.00 C ATOM 184 C VAL A 14 -12.301 -2.328 6.273 1.00 0.00 C ATOM 185 O VAL A 14 -12.122 -2.565 7.475 1.00 0.00 O ATOM 186 CB VAL A 14 -11.482 -0.112 5.471 1.00 0.00 C ATOM 187 CG1 VAL A 14 -11.916 1.198 4.838 1.00 0.00 C ATOM 188 CG2 VAL A 14 -10.641 0.181 6.706 1.00 0.00 C ATOM 0 H VAL A 14 -12.926 -0.566 7.798 1.00 0.00 H new ATOM 0 HA VAL A 14 -13.340 -1.007 4.946 1.00 0.00 H new ATOM 0 HB VAL A 14 -10.884 -0.675 4.755 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -11.036 1.790 4.587 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -12.486 0.993 3.932 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -12.538 1.753 5.540 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.781 0.789 6.425 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -11.244 0.720 7.437 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -10.295 -0.756 7.142 1.00 0.00 H new ATOM 198 N GLN A 15 -12.246 -3.202 5.380 1.00 0.00 N ATOM 199 CA GLN A 15 -11.792 -4.521 5.652 1.00 0.00 C ATOM 200 C GLN A 15 -11.376 -5.131 4.358 1.00 0.00 C ATOM 201 O GLN A 15 -12.166 -5.169 3.432 1.00 0.00 O ATOM 202 CB GLN A 15 -12.887 -5.377 6.301 1.00 0.00 C ATOM 203 CG GLN A 15 -12.458 -6.809 6.585 1.00 0.00 C ATOM 204 CD GLN A 15 -13.550 -7.650 7.205 1.00 0.00 C ATOM 205 OE1 GLN A 15 -13.613 -8.857 6.980 1.00 0.00 O ATOM 206 NE2 GLN A 15 -14.410 -7.042 7.987 1.00 0.00 N ATOM 0 H GLN A 15 -12.516 -3.042 4.410 1.00 0.00 H new ATOM 0 HA GLN A 15 -10.960 -4.478 6.355 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -13.196 -4.908 7.235 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -13.759 -5.391 5.648 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -12.135 -7.275 5.654 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -11.596 -6.797 7.252 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -14.328 -6.039 8.152 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -15.160 -7.572 8.430 1.00 0.00 H new ATOM 215 N GLY A 16 -10.164 -5.573 4.271 1.00 0.00 N ATOM 216 CA GLY A 16 -9.721 -6.164 3.086 1.00 0.00 C ATOM 217 C GLY A 16 -8.641 -7.126 3.347 1.00 0.00 C ATOM 218 O GLY A 16 -7.965 -7.023 4.371 1.00 0.00 O ATOM 0 H GLY A 16 -9.472 -5.528 5.019 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -10.552 -6.670 2.595 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -9.368 -5.393 2.401 1.00 0.00 H new ATOM 222 N ILE A 17 -8.448 -8.040 2.446 1.00 0.00 N ATOM 223 CA ILE A 17 -7.425 -9.027 2.588 1.00 0.00 C ATOM 224 C ILE A 17 -6.527 -8.968 1.376 1.00 0.00 C ATOM 225 O ILE A 17 -6.899 -9.386 0.281 1.00 0.00 O ATOM 226 CB ILE A 17 -7.984 -10.474 2.797 1.00 0.00 C ATOM 227 CG1 ILE A 17 -9.018 -10.845 1.709 1.00 0.00 C ATOM 228 CG2 ILE A 17 -8.581 -10.625 4.197 1.00 0.00 C ATOM 229 CD1 ILE A 17 -9.471 -12.282 1.753 1.00 0.00 C ATOM 0 H ILE A 17 -8.997 -8.122 1.590 1.00 0.00 H new ATOM 0 HA ILE A 17 -6.862 -8.798 3.493 1.00 0.00 H new ATOM 0 HB ILE A 17 -7.150 -11.170 2.704 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -9.889 -10.198 1.815 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -8.587 -10.641 0.729 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -8.964 -11.638 4.322 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -7.810 -10.434 4.944 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -9.395 -9.911 4.324 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -10.195 -12.460 0.958 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -8.612 -12.939 1.615 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -9.934 -12.488 2.718 1.00 0.00 H new ATOM 241 N ILE A 18 -5.391 -8.372 1.541 1.00 0.00 N ATOM 242 CA ILE A 18 -4.453 -8.257 0.444 1.00 0.00 C ATOM 243 C ILE A 18 -3.268 -9.218 0.706 1.00 0.00 C ATOM 244 O ILE A 18 -2.709 -9.184 1.794 1.00 0.00 O ATOM 245 CB ILE A 18 -3.899 -6.774 0.258 1.00 0.00 C ATOM 246 CG1 ILE A 18 -4.996 -5.675 0.021 1.00 0.00 C ATOM 247 CG2 ILE A 18 -2.926 -6.740 -0.906 1.00 0.00 C ATOM 248 CD1 ILE A 18 -5.927 -5.375 1.181 1.00 0.00 C ATOM 0 H ILE A 18 -5.080 -7.954 2.418 1.00 0.00 H new ATOM 0 HA ILE A 18 -4.980 -8.518 -0.474 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.420 -6.528 1.206 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -4.494 -4.749 -0.260 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -5.603 -5.979 -0.832 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -2.547 -5.726 -1.034 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -2.095 -7.416 -0.705 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -3.437 -7.054 -1.816 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -6.635 -4.600 0.888 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -6.471 -6.279 1.454 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -5.344 -5.030 2.035 1.00 0.00 H new ATOM 260 N ASN A 19 -2.905 -10.079 -0.268 1.00 0.00 N ATOM 261 CA ASN A 19 -1.772 -10.996 -0.101 1.00 0.00 C ATOM 262 C ASN A 19 -0.699 -10.646 -1.107 1.00 0.00 C ATOM 263 O ASN A 19 -0.977 -10.566 -2.296 1.00 0.00 O ATOM 264 CB ASN A 19 -2.174 -12.515 -0.172 1.00 0.00 C ATOM 265 CG ASN A 19 -2.693 -13.030 -1.524 1.00 0.00 C ATOM 266 OD1 ASN A 19 -3.299 -12.301 -2.320 1.00 0.00 O ATOM 267 ND2 ASN A 19 -2.468 -14.299 -1.792 1.00 0.00 N ATOM 0 H ASN A 19 -3.379 -10.154 -1.168 1.00 0.00 H new ATOM 0 HA ASN A 19 -1.383 -10.862 0.908 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -1.305 -13.110 0.108 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -2.942 -12.699 0.580 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -2.795 -14.700 -2.671 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -1.966 -14.881 -1.121 1.00 0.00 H new ATOM 274 N PHE A 20 0.514 -10.416 -0.632 1.00 0.00 N ATOM 275 CA PHE A 20 1.577 -9.882 -1.487 1.00 0.00 C ATOM 276 C PHE A 20 2.829 -10.743 -1.462 1.00 0.00 C ATOM 277 O PHE A 20 3.327 -11.096 -0.390 1.00 0.00 O ATOM 278 CB PHE A 20 1.878 -8.442 -1.017 1.00 0.00 C ATOM 279 CG PHE A 20 3.058 -7.769 -1.643 1.00 0.00 C ATOM 280 CD1 PHE A 20 2.943 -7.104 -2.840 1.00 0.00 C ATOM 281 CD2 PHE A 20 4.285 -7.791 -1.007 1.00 0.00 C ATOM 282 CE1 PHE A 20 4.029 -6.478 -3.392 1.00 0.00 C ATOM 283 CE2 PHE A 20 5.373 -7.164 -1.553 1.00 0.00 C ATOM 284 CZ PHE A 20 5.245 -6.507 -2.746 1.00 0.00 C ATOM 0 H PHE A 20 0.792 -10.587 0.334 1.00 0.00 H new ATOM 0 HA PHE A 20 1.241 -9.884 -2.524 1.00 0.00 H new ATOM 0 HB2 PHE A 20 0.996 -7.830 -1.206 1.00 0.00 H new ATOM 0 HB3 PHE A 20 2.028 -8.460 0.062 1.00 0.00 H new ATOM 0 HD1 PHE A 20 1.991 -7.075 -3.349 1.00 0.00 H new ATOM 0 HD2 PHE A 20 4.387 -8.310 -0.066 1.00 0.00 H new ATOM 0 HE1 PHE A 20 3.932 -5.961 -4.335 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.326 -7.188 -1.045 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.099 -6.010 -3.182 1.00 0.00 H new ATOM 294 N GLU A 21 3.329 -11.076 -2.638 1.00 0.00 N ATOM 295 CA GLU A 21 4.551 -11.821 -2.753 1.00 0.00 C ATOM 296 C GLU A 21 5.445 -11.238 -3.853 1.00 0.00 C ATOM 297 O GLU A 21 5.177 -11.398 -5.055 1.00 0.00 O ATOM 298 CB GLU A 21 4.261 -13.305 -2.993 1.00 0.00 C ATOM 299 CG GLU A 21 3.436 -13.616 -4.229 1.00 0.00 C ATOM 300 CD GLU A 21 3.181 -15.071 -4.390 1.00 0.00 C ATOM 301 OE1 GLU A 21 4.128 -15.822 -4.699 1.00 0.00 O ATOM 302 OE2 GLU A 21 2.033 -15.512 -4.173 1.00 0.00 O ATOM 0 H GLU A 21 2.896 -10.835 -3.530 1.00 0.00 H new ATOM 0 HA GLU A 21 5.093 -11.738 -1.811 1.00 0.00 H new ATOM 0 HB2 GLU A 21 5.210 -13.836 -3.068 1.00 0.00 H new ATOM 0 HB3 GLU A 21 3.741 -13.702 -2.121 1.00 0.00 H new ATOM 0 HG2 GLU A 21 2.484 -13.088 -4.169 1.00 0.00 H new ATOM 0 HG3 GLU A 21 3.954 -13.241 -5.112 1.00 0.00 H new ATOM 309 N GLN A 22 6.456 -10.503 -3.451 1.00 0.00 N ATOM 310 CA GLN A 22 7.376 -9.965 -4.380 1.00 0.00 C ATOM 311 C GLN A 22 8.721 -9.797 -3.753 1.00 0.00 C ATOM 312 O GLN A 22 8.879 -9.039 -2.794 1.00 0.00 O ATOM 313 CB GLN A 22 6.873 -8.665 -4.952 1.00 0.00 C ATOM 314 CG GLN A 22 7.843 -7.983 -5.870 1.00 0.00 C ATOM 315 CD GLN A 22 7.238 -6.812 -6.584 1.00 0.00 C ATOM 316 OE1 GLN A 22 7.666 -6.475 -7.654 1.00 0.00 O ATOM 317 NE2 GLN A 22 6.252 -6.193 -5.997 1.00 0.00 N ATOM 0 H GLN A 22 6.648 -10.272 -2.476 1.00 0.00 H new ATOM 0 HA GLN A 22 7.475 -10.669 -5.206 1.00 0.00 H new ATOM 0 HB2 GLN A 22 5.947 -8.854 -5.495 1.00 0.00 H new ATOM 0 HB3 GLN A 22 6.630 -7.990 -4.132 1.00 0.00 H new ATOM 0 HG2 GLN A 22 8.706 -7.647 -5.295 1.00 0.00 H new ATOM 0 HG3 GLN A 22 8.209 -8.701 -6.604 1.00 0.00 H new ATOM 0 HE21 GLN A 22 5.919 -6.512 -5.087 1.00 0.00 H new ATOM 0 HE22 GLN A 22 5.814 -5.390 -6.447 1.00 0.00 H new ATOM 326 N LYS A 23 9.649 -10.554 -4.258 1.00 0.00 N ATOM 327 CA LYS A 23 11.040 -10.500 -3.881 1.00 0.00 C ATOM 328 C LYS A 23 11.801 -11.442 -4.783 1.00 0.00 C ATOM 329 O LYS A 23 12.442 -11.035 -5.746 1.00 0.00 O ATOM 330 CB LYS A 23 11.248 -10.915 -2.409 1.00 0.00 C ATOM 331 CG LYS A 23 12.704 -10.930 -1.978 1.00 0.00 C ATOM 332 CD LYS A 23 12.864 -11.494 -0.587 1.00 0.00 C ATOM 333 CE LYS A 23 14.328 -11.644 -0.245 1.00 0.00 C ATOM 334 NZ LYS A 23 14.541 -12.171 1.111 1.00 0.00 N ATOM 0 H LYS A 23 9.455 -11.256 -4.973 1.00 0.00 H new ATOM 0 HA LYS A 23 11.399 -9.476 -3.986 1.00 0.00 H new ATOM 0 HB2 LYS A 23 10.695 -10.230 -1.766 1.00 0.00 H new ATOM 0 HB3 LYS A 23 10.823 -11.907 -2.257 1.00 0.00 H new ATOM 0 HG2 LYS A 23 13.287 -11.524 -2.682 1.00 0.00 H new ATOM 0 HG3 LYS A 23 13.104 -9.917 -2.009 1.00 0.00 H new ATOM 0 HD2 LYS A 23 12.380 -10.838 0.136 1.00 0.00 H new ATOM 0 HD3 LYS A 23 12.367 -12.462 -0.521 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.800 -12.310 -0.968 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.820 -10.675 -0.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 15.561 -12.254 1.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 14.116 -11.524 1.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 14.097 -13.108 1.193 1.00 0.00 H new ATOM 348 N GLU A 24 11.632 -12.713 -4.516 1.00 0.00 N ATOM 349 CA GLU A 24 12.308 -13.752 -5.232 1.00 0.00 C ATOM 350 C GLU A 24 11.476 -14.178 -6.411 1.00 0.00 C ATOM 351 O GLU A 24 11.910 -14.990 -7.244 1.00 0.00 O ATOM 352 CB GLU A 24 12.634 -14.902 -4.303 1.00 0.00 C ATOM 353 CG GLU A 24 13.486 -14.450 -3.132 1.00 0.00 C ATOM 354 CD GLU A 24 13.912 -15.564 -2.249 1.00 0.00 C ATOM 355 OE1 GLU A 24 14.963 -16.165 -2.525 1.00 0.00 O ATOM 356 OE2 GLU A 24 13.217 -15.848 -1.253 1.00 0.00 O ATOM 0 H GLU A 24 11.010 -13.054 -3.783 1.00 0.00 H new ATOM 0 HA GLU A 24 13.257 -13.381 -5.619 1.00 0.00 H new ATOM 0 HB2 GLU A 24 11.709 -15.344 -3.932 1.00 0.00 H new ATOM 0 HB3 GLU A 24 13.159 -15.680 -4.857 1.00 0.00 H new ATOM 0 HG2 GLU A 24 14.370 -13.939 -3.512 1.00 0.00 H new ATOM 0 HG3 GLU A 24 12.926 -13.723 -2.543 1.00 0.00 H new ATOM 363 N SER A 25 10.253 -13.663 -6.441 1.00 0.00 N ATOM 364 CA SER A 25 9.338 -13.813 -7.542 1.00 0.00 C ATOM 365 C SER A 25 10.069 -13.366 -8.808 1.00 0.00 C ATOM 366 O SER A 25 10.140 -14.107 -9.799 1.00 0.00 O ATOM 367 CB SER A 25 8.177 -12.873 -7.276 1.00 0.00 C ATOM 368 OG SER A 25 8.061 -12.667 -5.871 1.00 0.00 O ATOM 0 H SER A 25 9.869 -13.115 -5.672 1.00 0.00 H new ATOM 0 HA SER A 25 8.986 -14.838 -7.655 1.00 0.00 H new ATOM 0 HB2 SER A 25 8.338 -11.922 -7.784 1.00 0.00 H new ATOM 0 HB3 SER A 25 7.253 -13.294 -7.673 1.00 0.00 H new ATOM 0 HG SER A 25 7.132 -12.813 -5.595 1.00 0.00 H new ATOM 374 N ASN A 26 10.670 -12.156 -8.710 1.00 0.00 N ATOM 375 CA ASN A 26 11.478 -11.542 -9.757 1.00 0.00 C ATOM 376 C ASN A 26 10.715 -11.596 -11.068 1.00 0.00 C ATOM 377 O ASN A 26 11.084 -12.299 -12.005 1.00 0.00 O ATOM 378 CB ASN A 26 12.863 -12.244 -9.824 1.00 0.00 C ATOM 379 CG ASN A 26 13.954 -11.517 -10.625 1.00 0.00 C ATOM 380 OD1 ASN A 26 15.118 -11.561 -10.235 1.00 0.00 O ATOM 381 ND2 ASN A 26 13.638 -10.948 -11.754 1.00 0.00 N ATOM 0 H ASN A 26 10.596 -11.576 -7.874 1.00 0.00 H new ATOM 0 HA ASN A 26 11.670 -10.491 -9.539 1.00 0.00 H new ATOM 0 HB2 ASN A 26 13.224 -12.388 -8.806 1.00 0.00 H new ATOM 0 HB3 ASN A 26 12.724 -13.235 -10.256 1.00 0.00 H new ATOM 0 HD21 ASN A 26 14.364 -10.527 -12.334 1.00 0.00 H new ATOM 0 HD22 ASN A 26 12.665 -10.923 -12.058 1.00 0.00 H new ATOM 388 N GLY A 27 9.617 -10.909 -11.079 1.00 0.00 N ATOM 389 CA GLY A 27 8.724 -10.927 -12.181 1.00 0.00 C ATOM 390 C GLY A 27 7.437 -10.368 -11.722 1.00 0.00 C ATOM 391 O GLY A 27 7.422 -9.780 -10.643 1.00 0.00 O ATOM 0 H GLY A 27 9.316 -10.312 -10.308 1.00 0.00 H new ATOM 0 HA2 GLY A 27 9.124 -10.339 -13.007 1.00 0.00 H new ATOM 0 HA3 GLY A 27 8.590 -11.944 -12.549 1.00 0.00 H new ATOM 395 N PRO A 28 6.335 -10.554 -12.462 1.00 0.00 N ATOM 396 CA PRO A 28 5.048 -9.997 -12.086 1.00 0.00 C ATOM 397 C PRO A 28 4.632 -10.469 -10.703 1.00 0.00 C ATOM 398 O PRO A 28 4.565 -11.683 -10.427 1.00 0.00 O ATOM 399 CB PRO A 28 4.077 -10.517 -13.158 1.00 0.00 C ATOM 400 CG PRO A 28 4.789 -11.646 -13.819 1.00 0.00 C ATOM 401 CD PRO A 28 6.252 -11.342 -13.697 1.00 0.00 C ATOM 0 HA PRO A 28 5.068 -8.908 -12.037 1.00 0.00 H new ATOM 0 HB2 PRO A 28 3.140 -10.850 -12.712 1.00 0.00 H new ATOM 0 HB3 PRO A 28 3.828 -9.735 -13.875 1.00 0.00 H new ATOM 0 HG2 PRO A 28 4.546 -12.594 -13.339 1.00 0.00 H new ATOM 0 HG3 PRO A 28 4.495 -11.734 -14.865 1.00 0.00 H new ATOM 0 HD2 PRO A 28 6.847 -12.253 -13.633 1.00 0.00 H new ATOM 0 HD3 PRO A 28 6.619 -10.781 -14.557 1.00 0.00 H new ATOM 409 N VAL A 29 4.358 -9.530 -9.855 1.00 0.00 N ATOM 410 CA VAL A 29 4.000 -9.811 -8.503 1.00 0.00 C ATOM 411 C VAL A 29 2.585 -10.352 -8.422 1.00 0.00 C ATOM 412 O VAL A 29 1.652 -9.826 -9.041 1.00 0.00 O ATOM 413 CB VAL A 29 4.148 -8.534 -7.603 1.00 0.00 C ATOM 414 CG1 VAL A 29 3.427 -7.328 -8.211 1.00 0.00 C ATOM 415 CG2 VAL A 29 3.624 -8.790 -6.196 1.00 0.00 C ATOM 0 H VAL A 29 4.377 -8.536 -10.085 1.00 0.00 H new ATOM 0 HA VAL A 29 4.684 -10.573 -8.129 1.00 0.00 H new ATOM 0 HB VAL A 29 5.213 -8.307 -7.548 1.00 0.00 H new ATOM 0 HG11 VAL A 29 3.552 -6.463 -7.560 1.00 0.00 H new ATOM 0 HG12 VAL A 29 3.849 -7.108 -9.191 1.00 0.00 H new ATOM 0 HG13 VAL A 29 2.366 -7.553 -8.315 1.00 0.00 H new ATOM 0 HG21 VAL A 29 3.739 -7.888 -5.595 1.00 0.00 H new ATOM 0 HG22 VAL A 29 2.569 -9.061 -6.244 1.00 0.00 H new ATOM 0 HG23 VAL A 29 4.188 -9.604 -5.740 1.00 0.00 H new ATOM 425 N LYS A 30 2.454 -11.451 -7.719 1.00 0.00 N ATOM 426 CA LYS A 30 1.165 -12.022 -7.478 1.00 0.00 C ATOM 427 C LYS A 30 0.610 -11.500 -6.173 1.00 0.00 C ATOM 428 O LYS A 30 0.973 -11.940 -5.087 1.00 0.00 O ATOM 429 CB LYS A 30 1.168 -13.545 -7.494 1.00 0.00 C ATOM 430 CG LYS A 30 1.378 -14.156 -8.863 1.00 0.00 C ATOM 431 CD LYS A 30 1.186 -15.663 -8.816 1.00 0.00 C ATOM 432 CE LYS A 30 1.275 -16.293 -10.199 1.00 0.00 C ATOM 433 NZ LYS A 30 2.612 -16.148 -10.802 1.00 0.00 N ATOM 0 H LYS A 30 3.232 -11.964 -7.305 1.00 0.00 H new ATOM 0 HA LYS A 30 0.520 -11.715 -8.302 1.00 0.00 H new ATOM 0 HB2 LYS A 30 1.952 -13.902 -6.826 1.00 0.00 H new ATOM 0 HB3 LYS A 30 0.220 -13.902 -7.092 1.00 0.00 H new ATOM 0 HG2 LYS A 30 0.677 -13.717 -9.573 1.00 0.00 H new ATOM 0 HG3 LYS A 30 2.381 -13.924 -9.220 1.00 0.00 H new ATOM 0 HD2 LYS A 30 1.942 -16.105 -8.167 1.00 0.00 H new ATOM 0 HD3 LYS A 30 0.215 -15.891 -8.376 1.00 0.00 H new ATOM 0 HE2 LYS A 30 1.025 -17.352 -10.129 1.00 0.00 H new ATOM 0 HE3 LYS A 30 0.534 -15.833 -10.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 2.639 -16.651 -11.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 2.815 -15.140 -10.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 3.327 -16.550 -10.162 1.00 0.00 H new ATOM 447 N VAL A 31 -0.230 -10.548 -6.286 1.00 0.00 N ATOM 448 CA VAL A 31 -0.844 -9.889 -5.179 1.00 0.00 C ATOM 449 C VAL A 31 -2.317 -9.680 -5.525 1.00 0.00 C ATOM 450 O VAL A 31 -2.636 -9.502 -6.692 1.00 0.00 O ATOM 451 CB VAL A 31 -0.069 -8.549 -4.841 1.00 0.00 C ATOM 452 CG1 VAL A 31 0.118 -7.667 -6.053 1.00 0.00 C ATOM 453 CG2 VAL A 31 -0.738 -7.767 -3.734 1.00 0.00 C ATOM 0 H VAL A 31 -0.530 -10.182 -7.190 1.00 0.00 H new ATOM 0 HA VAL A 31 -0.792 -10.489 -4.270 1.00 0.00 H new ATOM 0 HB VAL A 31 0.917 -8.861 -4.495 1.00 0.00 H new ATOM 0 HG11 VAL A 31 0.654 -6.763 -5.766 1.00 0.00 H new ATOM 0 HG12 VAL A 31 0.691 -8.204 -6.809 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -0.856 -7.397 -6.460 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -0.171 -6.857 -3.537 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.752 -7.505 -4.035 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -0.774 -8.375 -2.830 1.00 0.00 H new ATOM 463 N TRP A 32 -3.186 -9.828 -4.583 1.00 0.00 N ATOM 464 CA TRP A 32 -4.596 -9.648 -4.838 1.00 0.00 C ATOM 465 C TRP A 32 -5.230 -9.237 -3.551 1.00 0.00 C ATOM 466 O TRP A 32 -4.838 -9.742 -2.482 1.00 0.00 O ATOM 467 CB TRP A 32 -5.214 -10.976 -5.334 1.00 0.00 C ATOM 468 CG TRP A 32 -6.586 -10.853 -5.938 1.00 0.00 C ATOM 469 CD1 TRP A 32 -6.870 -10.610 -7.250 1.00 0.00 C ATOM 470 CD2 TRP A 32 -7.854 -10.987 -5.273 1.00 0.00 C ATOM 471 NE1 TRP A 32 -8.228 -10.566 -7.440 1.00 0.00 N ATOM 472 CE2 TRP A 32 -8.856 -10.797 -6.244 1.00 0.00 C ATOM 473 CE3 TRP A 32 -8.238 -11.245 -3.954 1.00 0.00 C ATOM 474 CZ2 TRP A 32 -10.211 -10.854 -5.938 1.00 0.00 C ATOM 475 CZ3 TRP A 32 -9.581 -11.304 -3.653 1.00 0.00 C ATOM 476 CH2 TRP A 32 -10.554 -11.111 -4.639 1.00 0.00 C ATOM 0 H TRP A 32 -2.954 -10.074 -3.621 1.00 0.00 H new ATOM 0 HA TRP A 32 -4.758 -8.891 -5.606 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -4.546 -11.416 -6.074 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -5.263 -11.671 -4.496 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -6.132 -10.472 -8.027 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -8.695 -10.390 -8.329 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -7.495 -11.395 -3.185 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -10.964 -10.701 -6.697 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -9.888 -11.503 -2.637 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -11.598 -11.166 -4.369 1.00 0.00 H new ATOM 487 N GLY A 33 -6.139 -8.309 -3.605 1.00 0.00 N ATOM 488 CA GLY A 33 -6.812 -7.947 -2.417 1.00 0.00 C ATOM 489 C GLY A 33 -8.151 -7.321 -2.667 1.00 0.00 C ATOM 490 O GLY A 33 -8.318 -6.538 -3.586 1.00 0.00 O ATOM 0 H GLY A 33 -6.420 -7.804 -4.446 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -6.942 -8.833 -1.796 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -6.192 -7.251 -1.853 1.00 0.00 H new ATOM 494 N SER A 34 -9.078 -7.669 -1.858 1.00 0.00 N ATOM 495 CA SER A 34 -10.407 -7.207 -1.925 1.00 0.00 C ATOM 496 C SER A 34 -10.682 -6.376 -0.691 1.00 0.00 C ATOM 497 O SER A 34 -10.288 -6.772 0.388 1.00 0.00 O ATOM 498 CB SER A 34 -11.271 -8.447 -2.011 1.00 0.00 C ATOM 499 OG SER A 34 -10.808 -9.437 -1.083 1.00 0.00 O ATOM 0 H SER A 34 -8.919 -8.320 -1.089 1.00 0.00 H new ATOM 0 HA SER A 34 -10.611 -6.569 -2.785 1.00 0.00 H new ATOM 0 HB2 SER A 34 -12.309 -8.192 -1.795 1.00 0.00 H new ATOM 0 HB3 SER A 34 -11.246 -8.848 -3.024 1.00 0.00 H new ATOM 0 HG SER A 34 -11.374 -10.234 -1.146 1.00 0.00 H new ATOM 505 N ILE A 35 -11.293 -5.224 -0.847 1.00 0.00 N ATOM 506 CA ILE A 35 -11.593 -4.355 0.285 1.00 0.00 C ATOM 507 C ILE A 35 -13.053 -3.984 0.277 1.00 0.00 C ATOM 508 O ILE A 35 -13.650 -3.759 -0.783 1.00 0.00 O ATOM 509 CB ILE A 35 -10.727 -3.037 0.291 1.00 0.00 C ATOM 510 CG1 ILE A 35 -9.252 -3.369 0.422 1.00 0.00 C ATOM 511 CG2 ILE A 35 -11.145 -2.073 1.418 1.00 0.00 C ATOM 512 CD1 ILE A 35 -8.349 -2.167 0.373 1.00 0.00 C ATOM 0 H ILE A 35 -11.597 -4.859 -1.750 1.00 0.00 H new ATOM 0 HA ILE A 35 -11.345 -4.918 1.185 1.00 0.00 H new ATOM 0 HB ILE A 35 -10.904 -2.536 -0.661 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -9.090 -3.894 1.363 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -8.972 -4.054 -0.378 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -10.521 -1.180 1.383 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -12.190 -1.791 1.287 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -11.020 -2.565 2.383 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -7.312 -2.487 0.473 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -8.480 -1.652 -0.579 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.600 -1.490 1.189 1.00 0.00 H new ATOM 524 N LYS A 36 -13.619 -3.959 1.434 1.00 0.00 N ATOM 525 CA LYS A 36 -14.937 -3.533 1.635 1.00 0.00 C ATOM 526 C LYS A 36 -14.824 -2.216 2.391 1.00 0.00 C ATOM 527 O LYS A 36 -14.436 -2.198 3.560 1.00 0.00 O ATOM 528 CB LYS A 36 -15.679 -4.574 2.446 1.00 0.00 C ATOM 529 CG LYS A 36 -15.715 -5.959 1.827 1.00 0.00 C ATOM 530 CD LYS A 36 -16.541 -6.899 2.677 1.00 0.00 C ATOM 531 CE LYS A 36 -16.538 -8.307 2.117 1.00 0.00 C ATOM 532 NZ LYS A 36 -17.443 -9.194 2.873 1.00 0.00 N ATOM 0 H LYS A 36 -13.148 -4.248 2.291 1.00 0.00 H new ATOM 0 HA LYS A 36 -15.488 -3.400 0.704 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -15.217 -4.644 3.431 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -16.703 -4.233 2.598 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -16.135 -5.904 0.823 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -14.701 -6.346 1.728 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -16.149 -6.911 3.694 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -17.566 -6.532 2.735 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -16.841 -8.284 1.070 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -15.525 -8.709 2.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -17.416 -10.149 2.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -17.138 -9.235 3.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -18.413 -8.823 2.824 1.00 0.00 H new ATOM 546 N GLY A 37 -15.095 -1.162 1.695 1.00 0.00 N ATOM 547 CA GLY A 37 -14.868 0.186 2.153 1.00 0.00 C ATOM 548 C GLY A 37 -15.985 1.056 1.690 1.00 0.00 C ATOM 549 O GLY A 37 -16.880 0.560 1.014 1.00 0.00 O ATOM 0 H GLY A 37 -15.495 -1.208 0.758 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -14.802 0.207 3.241 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -13.918 0.558 1.769 1.00 0.00 H new ATOM 553 N LEU A 38 -15.999 2.297 2.089 1.00 0.00 N ATOM 554 CA LEU A 38 -17.067 3.206 1.692 1.00 0.00 C ATOM 555 C LEU A 38 -16.996 3.536 0.182 1.00 0.00 C ATOM 556 O LEU A 38 -16.057 3.136 -0.498 1.00 0.00 O ATOM 557 CB LEU A 38 -17.094 4.475 2.595 1.00 0.00 C ATOM 558 CG LEU A 38 -15.770 5.248 2.815 1.00 0.00 C ATOM 559 CD1 LEU A 38 -15.283 5.947 1.552 1.00 0.00 C ATOM 560 CD2 LEU A 38 -15.918 6.242 3.959 1.00 0.00 C ATOM 0 H LEU A 38 -15.288 2.714 2.690 1.00 0.00 H new ATOM 0 HA LEU A 38 -18.020 2.700 1.847 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -17.818 5.170 2.170 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -17.473 4.179 3.573 1.00 0.00 H new ATOM 0 HG LEU A 38 -15.010 4.512 3.079 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -14.352 6.473 1.763 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -15.112 5.207 0.770 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -16.036 6.661 1.218 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -14.979 6.777 4.100 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -16.709 6.954 3.722 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -16.173 5.708 4.874 1.00 0.00 H new ATOM 572 N THR A 39 -18.019 4.180 -0.361 1.00 0.00 N ATOM 573 CA THR A 39 -17.985 4.513 -1.775 1.00 0.00 C ATOM 574 C THR A 39 -16.950 5.612 -2.079 1.00 0.00 C ATOM 575 O THR A 39 -17.140 6.794 -1.741 1.00 0.00 O ATOM 576 CB THR A 39 -19.428 4.940 -2.282 1.00 0.00 C ATOM 577 OG1 THR A 39 -19.408 5.487 -3.606 1.00 0.00 O ATOM 578 CG2 THR A 39 -20.112 5.915 -1.327 1.00 0.00 C ATOM 0 H THR A 39 -18.858 4.474 0.139 1.00 0.00 H new ATOM 0 HA THR A 39 -17.676 3.619 -2.317 1.00 0.00 H new ATOM 0 HB THR A 39 -20.010 4.019 -2.307 1.00 0.00 H new ATOM 0 HG1 THR A 39 -18.762 4.994 -4.154 1.00 0.00 H new ATOM 0 HG21 THR A 39 -21.095 6.177 -1.717 1.00 0.00 H new ATOM 0 HG22 THR A 39 -20.223 5.448 -0.348 1.00 0.00 H new ATOM 0 HG23 THR A 39 -19.507 6.817 -1.233 1.00 0.00 H new ATOM 586 N GLU A 40 -15.858 5.183 -2.683 1.00 0.00 N ATOM 587 CA GLU A 40 -14.819 6.028 -3.244 1.00 0.00 C ATOM 588 C GLU A 40 -13.820 5.118 -3.945 1.00 0.00 C ATOM 589 O GLU A 40 -13.112 4.364 -3.290 1.00 0.00 O ATOM 590 CB GLU A 40 -14.105 6.879 -2.182 1.00 0.00 C ATOM 591 CG GLU A 40 -13.086 7.859 -2.765 1.00 0.00 C ATOM 592 CD GLU A 40 -13.717 8.945 -3.605 1.00 0.00 C ATOM 593 OE1 GLU A 40 -14.128 8.690 -4.754 1.00 0.00 O ATOM 594 OE2 GLU A 40 -13.789 10.100 -3.131 1.00 0.00 O ATOM 0 H GLU A 40 -15.661 4.189 -2.802 1.00 0.00 H new ATOM 0 HA GLU A 40 -15.275 6.733 -3.939 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -14.850 7.437 -1.615 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -13.599 6.218 -1.479 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -12.526 8.318 -1.950 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -12.369 7.308 -3.374 1.00 0.00 H new ATOM 601 N GLY A 41 -13.722 5.154 -5.205 1.00 0.00 N ATOM 602 CA GLY A 41 -12.799 4.249 -5.837 1.00 0.00 C ATOM 603 C GLY A 41 -11.876 4.911 -6.802 1.00 0.00 C ATOM 604 O GLY A 41 -11.979 4.689 -7.996 1.00 0.00 O ATOM 0 H GLY A 41 -14.242 5.773 -5.827 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -12.209 3.750 -5.068 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -13.362 3.475 -6.359 1.00 0.00 H new ATOM 608 N LEU A 42 -10.893 5.608 -6.287 1.00 0.00 N ATOM 609 CA LEU A 42 -9.964 6.349 -7.120 1.00 0.00 C ATOM 610 C LEU A 42 -8.659 5.556 -7.137 1.00 0.00 C ATOM 611 O LEU A 42 -8.237 5.059 -6.081 1.00 0.00 O ATOM 612 CB LEU A 42 -9.767 7.774 -6.547 1.00 0.00 C ATOM 613 CG LEU A 42 -9.390 8.920 -7.538 1.00 0.00 C ATOM 614 CD1 LEU A 42 -8.072 8.679 -8.261 1.00 0.00 C ATOM 615 CD2 LEU A 42 -10.512 9.156 -8.539 1.00 0.00 C ATOM 0 H LEU A 42 -10.711 5.681 -5.286 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.337 6.469 -8.137 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -10.689 8.060 -6.042 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -8.989 7.722 -5.785 1.00 0.00 H new ATOM 0 HG LEU A 42 -9.253 9.816 -6.933 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -7.869 9.512 -8.934 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -7.266 8.597 -7.531 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -8.136 7.755 -8.836 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -10.229 9.958 -9.220 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -10.690 8.243 -9.108 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -11.421 9.436 -8.007 1.00 0.00 H new ATOM 627 N HIS A 43 -8.043 5.427 -8.325 1.00 0.00 N ATOM 628 CA HIS A 43 -6.894 4.596 -8.564 1.00 0.00 C ATOM 629 C HIS A 43 -5.794 4.950 -7.637 1.00 0.00 C ATOM 630 O HIS A 43 -5.330 6.099 -7.592 1.00 0.00 O ATOM 631 CB HIS A 43 -6.383 4.745 -10.012 1.00 0.00 C ATOM 632 CG HIS A 43 -7.345 4.345 -11.094 1.00 0.00 C ATOM 633 ND1 HIS A 43 -7.772 5.205 -12.072 1.00 0.00 N ATOM 634 CD2 HIS A 43 -7.931 3.160 -11.368 1.00 0.00 C ATOM 635 CE1 HIS A 43 -8.577 4.573 -12.894 1.00 0.00 C ATOM 636 NE2 HIS A 43 -8.689 3.329 -12.490 1.00 0.00 N ATOM 0 H HIS A 43 -8.356 5.922 -9.160 1.00 0.00 H new ATOM 0 HA HIS A 43 -7.204 3.564 -8.398 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -6.100 5.786 -10.171 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -5.477 4.148 -10.120 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -7.820 2.246 -10.803 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -9.064 5.003 -13.756 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -9.251 2.607 -12.941 1.00 0.00 H new ATOM 645 N GLY A 44 -5.384 3.994 -6.908 1.00 0.00 N ATOM 646 CA GLY A 44 -4.333 4.200 -6.036 1.00 0.00 C ATOM 647 C GLY A 44 -3.922 2.975 -5.315 1.00 0.00 C ATOM 648 O GLY A 44 -4.730 2.268 -4.731 1.00 0.00 O ATOM 0 H GLY A 44 -5.774 3.051 -6.907 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.480 4.590 -6.592 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -4.616 4.963 -5.310 1.00 0.00 H new ATOM 652 N PHE A 45 -2.708 2.680 -5.486 1.00 0.00 N ATOM 653 CA PHE A 45 -1.966 1.760 -4.622 1.00 0.00 C ATOM 654 C PHE A 45 -1.854 2.530 -3.294 1.00 0.00 C ATOM 655 O PHE A 45 -1.690 3.752 -3.330 1.00 0.00 O ATOM 656 CB PHE A 45 -0.525 1.580 -5.149 1.00 0.00 C ATOM 657 CG PHE A 45 -0.367 1.533 -6.652 1.00 0.00 C ATOM 658 CD1 PHE A 45 -0.524 0.361 -7.351 1.00 0.00 C ATOM 659 CD2 PHE A 45 -0.025 2.679 -7.352 1.00 0.00 C ATOM 660 CE1 PHE A 45 -0.349 0.319 -8.717 1.00 0.00 C ATOM 661 CE2 PHE A 45 0.149 2.649 -8.716 1.00 0.00 C ATOM 662 CZ PHE A 45 -0.011 1.467 -9.400 1.00 0.00 C ATOM 0 H PHE A 45 -2.147 3.064 -6.246 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.447 0.784 -4.556 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.085 2.398 -4.765 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -0.120 0.658 -4.733 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.789 -0.542 -6.821 1.00 0.00 H new ATOM 0 HD2 PHE A 45 0.107 3.609 -6.819 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -0.476 -0.611 -9.251 1.00 0.00 H new ATOM 0 HE2 PHE A 45 0.411 3.551 -9.248 1.00 0.00 H new ATOM 0 HZ PHE A 45 0.128 1.438 -10.471 1.00 0.00 H new ATOM 672 N HIS A 46 -1.941 1.908 -2.133 1.00 0.00 N ATOM 673 CA HIS A 46 -1.965 2.700 -0.953 1.00 0.00 C ATOM 674 C HIS A 46 -0.890 2.176 -0.063 1.00 0.00 C ATOM 675 O HIS A 46 -1.084 1.219 0.649 1.00 0.00 O ATOM 676 CB HIS A 46 -3.333 2.605 -0.277 1.00 0.00 C ATOM 677 CG HIS A 46 -4.555 2.637 -1.183 1.00 0.00 C ATOM 678 ND1 HIS A 46 -5.180 3.784 -1.620 1.00 0.00 N ATOM 679 CD2 HIS A 46 -5.276 1.616 -1.703 1.00 0.00 C ATOM 680 CE1 HIS A 46 -6.222 3.452 -2.365 1.00 0.00 C ATOM 681 NE2 HIS A 46 -6.301 2.157 -2.424 1.00 0.00 N ATOM 0 H HIS A 46 -1.993 0.898 -1.998 1.00 0.00 H new ATOM 0 HA HIS A 46 -1.795 3.753 -1.180 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -3.363 1.680 0.299 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -3.417 3.427 0.434 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -5.076 0.563 -1.571 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -6.897 4.145 -2.846 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -7.014 1.629 -2.928 1.00 0.00 H new ATOM 690 N VAL A 47 0.266 2.738 -0.193 1.00 0.00 N ATOM 691 CA VAL A 47 1.432 2.215 0.470 1.00 0.00 C ATOM 692 C VAL A 47 2.181 3.219 1.349 1.00 0.00 C ATOM 693 O VAL A 47 1.934 4.453 1.285 1.00 0.00 O ATOM 694 CB VAL A 47 2.409 1.632 -0.576 1.00 0.00 C ATOM 695 CG1 VAL A 47 1.890 0.338 -1.116 1.00 0.00 C ATOM 696 CG2 VAL A 47 2.590 2.605 -1.729 1.00 0.00 C ATOM 0 H VAL A 47 0.437 3.570 -0.758 1.00 0.00 H new ATOM 0 HA VAL A 47 1.058 1.445 1.145 1.00 0.00 H new ATOM 0 HB VAL A 47 3.366 1.463 -0.083 1.00 0.00 H new ATOM 0 HG11 VAL A 47 2.591 -0.057 -1.851 1.00 0.00 H new ATOM 0 HG12 VAL A 47 1.777 -0.377 -0.301 1.00 0.00 H new ATOM 0 HG13 VAL A 47 0.923 0.503 -1.590 1.00 0.00 H new ATOM 0 HG21 VAL A 47 3.281 2.181 -2.458 1.00 0.00 H new ATOM 0 HG22 VAL A 47 1.627 2.788 -2.205 1.00 0.00 H new ATOM 0 HG23 VAL A 47 2.993 3.545 -1.352 1.00 0.00 H new ATOM 706 N HIS A 48 3.017 2.628 2.221 1.00 0.00 N ATOM 707 CA HIS A 48 4.049 3.238 3.101 1.00 0.00 C ATOM 708 C HIS A 48 4.853 2.089 3.703 1.00 0.00 C ATOM 709 O HIS A 48 4.271 1.254 4.395 1.00 0.00 O ATOM 710 CB HIS A 48 3.502 4.096 4.267 1.00 0.00 C ATOM 711 CG HIS A 48 3.030 5.457 3.898 1.00 0.00 C ATOM 712 ND1 HIS A 48 3.812 6.378 3.233 1.00 0.00 N ATOM 713 CD2 HIS A 48 1.836 6.057 4.085 1.00 0.00 C ATOM 714 CE1 HIS A 48 3.124 7.467 3.031 1.00 0.00 C ATOM 715 NE2 HIS A 48 1.920 7.309 3.534 1.00 0.00 N ATOM 0 H HIS A 48 2.991 1.616 2.345 1.00 0.00 H new ATOM 0 HA HIS A 48 4.631 3.918 2.479 1.00 0.00 H new ATOM 0 HB2 HIS A 48 2.676 3.559 4.733 1.00 0.00 H new ATOM 0 HB3 HIS A 48 4.284 4.194 5.020 1.00 0.00 H new ATOM 0 HD1 HIS A 48 4.779 6.230 2.944 1.00 0.00 H new ATOM 0 HD2 HIS A 48 0.975 5.630 4.577 1.00 0.00 H new ATOM 0 HE1 HIS A 48 3.485 8.354 2.532 1.00 0.00 H new ATOM 724 N GLU A 49 6.149 2.005 3.473 1.00 0.00 N ATOM 725 CA GLU A 49 6.859 0.851 3.999 1.00 0.00 C ATOM 726 C GLU A 49 7.680 1.176 5.286 1.00 0.00 C ATOM 727 O GLU A 49 8.905 1.375 5.271 1.00 0.00 O ATOM 728 CB GLU A 49 7.721 0.162 2.891 1.00 0.00 C ATOM 729 CG GLU A 49 8.982 0.920 2.366 1.00 0.00 C ATOM 730 CD GLU A 49 8.713 2.245 1.664 1.00 0.00 C ATOM 731 OE1 GLU A 49 8.221 3.179 2.316 1.00 0.00 O ATOM 732 OE2 GLU A 49 9.050 2.379 0.465 1.00 0.00 O ATOM 0 H GLU A 49 6.710 2.681 2.954 1.00 0.00 H new ATOM 0 HA GLU A 49 6.104 0.131 4.314 1.00 0.00 H new ATOM 0 HB2 GLU A 49 8.048 -0.804 3.275 1.00 0.00 H new ATOM 0 HB3 GLU A 49 7.072 -0.037 2.038 1.00 0.00 H new ATOM 0 HG2 GLU A 49 9.648 1.105 3.208 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.515 0.266 1.676 1.00 0.00 H new ATOM 739 N PHE A 50 6.952 1.124 6.403 1.00 0.00 N ATOM 740 CA PHE A 50 7.431 1.396 7.757 1.00 0.00 C ATOM 741 C PHE A 50 6.218 1.529 8.662 1.00 0.00 C ATOM 742 O PHE A 50 5.376 2.398 8.456 1.00 0.00 O ATOM 743 CB PHE A 50 8.358 2.675 7.853 1.00 0.00 C ATOM 744 CG PHE A 50 7.762 4.036 7.467 1.00 0.00 C ATOM 745 CD1 PHE A 50 7.194 4.259 6.217 1.00 0.00 C ATOM 746 CD2 PHE A 50 7.795 5.086 8.365 1.00 0.00 C ATOM 747 CE1 PHE A 50 6.678 5.491 5.881 1.00 0.00 C ATOM 748 CE2 PHE A 50 7.284 6.322 8.026 1.00 0.00 C ATOM 749 CZ PHE A 50 6.721 6.522 6.786 1.00 0.00 C ATOM 0 H PHE A 50 5.962 0.878 6.385 1.00 0.00 H new ATOM 0 HA PHE A 50 8.063 0.566 8.073 1.00 0.00 H new ATOM 0 HB2 PHE A 50 8.718 2.749 8.879 1.00 0.00 H new ATOM 0 HB3 PHE A 50 9.229 2.502 7.221 1.00 0.00 H new ATOM 0 HD1 PHE A 50 7.157 3.453 5.499 1.00 0.00 H new ATOM 0 HD2 PHE A 50 8.226 4.937 9.344 1.00 0.00 H new ATOM 0 HE1 PHE A 50 6.240 5.646 4.906 1.00 0.00 H new ATOM 0 HE2 PHE A 50 7.326 7.135 8.736 1.00 0.00 H new ATOM 0 HZ PHE A 50 6.314 7.488 6.526 1.00 0.00 H new ATOM 759 N GLY A 51 6.056 0.608 9.579 1.00 0.00 N ATOM 760 CA GLY A 51 4.940 0.715 10.487 1.00 0.00 C ATOM 761 C GLY A 51 5.240 0.171 11.836 1.00 0.00 C ATOM 762 O GLY A 51 6.413 0.089 12.223 1.00 0.00 O ATOM 0 H GLY A 51 6.662 -0.201 9.716 1.00 0.00 H new ATOM 0 HA2 GLY A 51 4.651 1.762 10.579 1.00 0.00 H new ATOM 0 HA3 GLY A 51 4.085 0.184 10.068 1.00 0.00 H new ATOM 766 N ASP A 52 4.191 -0.253 12.532 1.00 0.00 N ATOM 767 CA ASP A 52 4.320 -0.777 13.878 1.00 0.00 C ATOM 768 C ASP A 52 2.987 -1.317 14.361 1.00 0.00 C ATOM 769 O ASP A 52 2.801 -2.514 14.502 1.00 0.00 O ATOM 770 CB ASP A 52 4.792 0.314 14.854 1.00 0.00 C ATOM 771 CG ASP A 52 5.112 -0.235 16.221 1.00 0.00 C ATOM 772 OD1 ASP A 52 4.201 -0.422 17.054 1.00 0.00 O ATOM 773 OD2 ASP A 52 6.296 -0.497 16.495 1.00 0.00 O ATOM 0 H ASP A 52 3.235 -0.242 12.178 1.00 0.00 H new ATOM 0 HA ASP A 52 5.060 -1.577 13.850 1.00 0.00 H new ATOM 0 HB2 ASP A 52 5.676 0.804 14.446 1.00 0.00 H new ATOM 0 HB3 ASP A 52 4.018 1.076 14.944 1.00 0.00 H new ATOM 778 N ASN A 53 2.056 -0.425 14.566 1.00 0.00 N ATOM 779 CA ASN A 53 0.761 -0.756 15.138 1.00 0.00 C ATOM 780 C ASN A 53 -0.270 -0.929 14.016 1.00 0.00 C ATOM 781 O ASN A 53 -0.385 -0.073 13.144 1.00 0.00 O ATOM 782 CB ASN A 53 0.358 0.391 16.081 1.00 0.00 C ATOM 783 CG ASN A 53 -0.894 0.146 16.900 1.00 0.00 C ATOM 784 OD1 ASN A 53 -1.787 -0.597 16.513 1.00 0.00 O ATOM 785 ND2 ASN A 53 -0.986 0.804 18.011 1.00 0.00 N ATOM 0 H ASN A 53 2.167 0.564 14.342 1.00 0.00 H new ATOM 0 HA ASN A 53 0.808 -1.692 15.695 1.00 0.00 H new ATOM 0 HB2 ASN A 53 1.186 0.587 16.763 1.00 0.00 H new ATOM 0 HB3 ASN A 53 0.213 1.294 15.487 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -1.820 0.711 18.591 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -0.225 1.415 18.306 1.00 0.00 H new ATOM 792 N THR A 54 -1.025 -2.022 14.044 1.00 0.00 N ATOM 793 CA THR A 54 -1.992 -2.299 12.993 1.00 0.00 C ATOM 794 C THR A 54 -3.332 -1.579 13.235 1.00 0.00 C ATOM 795 O THR A 54 -4.223 -1.622 12.400 1.00 0.00 O ATOM 796 CB THR A 54 -2.226 -3.834 12.788 1.00 0.00 C ATOM 797 OG1 THR A 54 -2.932 -4.059 11.559 1.00 0.00 O ATOM 798 CG2 THR A 54 -3.029 -4.446 13.936 1.00 0.00 C ATOM 0 H THR A 54 -0.985 -2.727 14.780 1.00 0.00 H new ATOM 0 HA THR A 54 -1.557 -1.904 12.075 1.00 0.00 H new ATOM 0 HB THR A 54 -1.247 -4.311 12.759 1.00 0.00 H new ATOM 0 HG1 THR A 54 -2.573 -4.856 11.116 1.00 0.00 H new ATOM 0 HG21 THR A 54 -3.169 -5.512 13.755 1.00 0.00 H new ATOM 0 HG22 THR A 54 -2.490 -4.305 14.873 1.00 0.00 H new ATOM 0 HG23 THR A 54 -4.002 -3.958 14.000 1.00 0.00 H new ATOM 806 N ALA A 55 -3.470 -0.943 14.373 1.00 0.00 N ATOM 807 CA ALA A 55 -4.688 -0.221 14.683 1.00 0.00 C ATOM 808 C ALA A 55 -4.486 1.268 14.474 1.00 0.00 C ATOM 809 O ALA A 55 -5.427 1.997 14.188 1.00 0.00 O ATOM 810 CB ALA A 55 -5.128 -0.504 16.104 1.00 0.00 C ATOM 0 H ALA A 55 -2.757 -0.908 15.102 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.473 -0.562 14.008 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -6.044 0.047 16.318 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -5.311 -1.572 16.222 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -4.346 -0.191 16.796 1.00 0.00 H new ATOM 816 N GLY A 56 -3.260 1.702 14.578 1.00 0.00 N ATOM 817 CA GLY A 56 -2.956 3.090 14.427 1.00 0.00 C ATOM 818 C GLY A 56 -1.609 3.245 13.819 1.00 0.00 C ATOM 819 O GLY A 56 -0.636 2.740 14.333 1.00 0.00 O ATOM 0 H GLY A 56 -2.454 1.107 14.768 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -3.706 3.570 13.799 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.987 3.586 15.397 1.00 0.00 H new ATOM 823 N CYS A 57 -1.537 3.840 12.693 1.00 0.00 N ATOM 824 CA CYS A 57 -0.281 3.993 12.077 1.00 0.00 C ATOM 825 C CYS A 57 0.293 5.370 12.340 1.00 0.00 C ATOM 826 O CYS A 57 0.068 6.315 11.589 1.00 0.00 O ATOM 827 CB CYS A 57 -0.347 3.609 10.588 1.00 0.00 C ATOM 828 SG CYS A 57 -1.605 4.462 9.560 1.00 0.00 S ATOM 0 H CYS A 57 -2.329 4.228 12.181 1.00 0.00 H new ATOM 0 HA CYS A 57 0.424 3.295 12.528 1.00 0.00 H new ATOM 0 HB2 CYS A 57 0.632 3.794 10.147 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -0.528 2.536 10.523 1.00 0.00 H new ATOM 833 N THR A 58 1.000 5.479 13.451 1.00 0.00 N ATOM 834 CA THR A 58 1.653 6.701 13.835 1.00 0.00 C ATOM 835 C THR A 58 2.966 6.864 13.069 1.00 0.00 C ATOM 836 O THR A 58 3.304 7.961 12.614 1.00 0.00 O ATOM 837 CB THR A 58 1.920 6.694 15.349 1.00 0.00 C ATOM 838 OG1 THR A 58 0.696 6.388 16.035 1.00 0.00 O ATOM 839 CG2 THR A 58 2.438 8.042 15.831 1.00 0.00 C ATOM 0 H THR A 58 1.133 4.713 14.111 1.00 0.00 H new ATOM 0 HA THR A 58 1.003 7.541 13.592 1.00 0.00 H new ATOM 0 HB THR A 58 2.681 5.943 15.560 1.00 0.00 H new ATOM 0 HG1 THR A 58 0.856 6.379 17.002 1.00 0.00 H new ATOM 0 HG21 THR A 58 2.616 8.000 16.906 1.00 0.00 H new ATOM 0 HG22 THR A 58 3.370 8.278 15.318 1.00 0.00 H new ATOM 0 HG23 THR A 58 1.699 8.814 15.615 1.00 0.00 H new ATOM 847 N SER A 59 3.668 5.745 12.911 1.00 0.00 N ATOM 848 CA SER A 59 4.977 5.675 12.291 1.00 0.00 C ATOM 849 C SER A 59 4.983 6.321 10.895 1.00 0.00 C ATOM 850 O SER A 59 5.834 7.156 10.590 1.00 0.00 O ATOM 851 CB SER A 59 5.327 4.205 12.181 1.00 0.00 C ATOM 852 OG SER A 59 4.881 3.527 13.353 1.00 0.00 O ATOM 0 H SER A 59 3.326 4.836 13.223 1.00 0.00 H new ATOM 0 HA SER A 59 5.704 6.221 12.892 1.00 0.00 H new ATOM 0 HB2 SER A 59 4.859 3.773 11.296 1.00 0.00 H new ATOM 0 HB3 SER A 59 6.404 4.083 12.064 1.00 0.00 H new ATOM 0 HG SER A 59 5.104 2.575 13.285 1.00 0.00 H new ATOM 858 N ALA A 60 3.988 5.973 10.095 1.00 0.00 N ATOM 859 CA ALA A 60 3.882 6.424 8.719 1.00 0.00 C ATOM 860 C ALA A 60 3.393 7.874 8.602 1.00 0.00 C ATOM 861 O ALA A 60 3.405 8.439 7.505 1.00 0.00 O ATOM 862 CB ALA A 60 2.981 5.483 7.931 1.00 0.00 C ATOM 0 H ALA A 60 3.224 5.363 10.387 1.00 0.00 H new ATOM 0 HA ALA A 60 4.886 6.405 8.295 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.907 5.829 6.900 1.00 0.00 H new ATOM 0 HB2 ALA A 60 3.402 4.478 7.947 1.00 0.00 H new ATOM 0 HB3 ALA A 60 1.988 5.468 8.381 1.00 0.00 H new ATOM 868 N GLY A 61 2.960 8.446 9.732 1.00 0.00 N ATOM 869 CA GLY A 61 2.399 9.812 9.820 1.00 0.00 C ATOM 870 C GLY A 61 3.103 10.869 8.957 1.00 0.00 C ATOM 871 O GLY A 61 2.496 11.392 8.017 1.00 0.00 O ATOM 0 H GLY A 61 2.988 7.968 10.632 1.00 0.00 H new ATOM 0 HA2 GLY A 61 1.348 9.774 9.533 1.00 0.00 H new ATOM 0 HA3 GLY A 61 2.434 10.135 10.861 1.00 0.00 H new ATOM 875 N PRO A 62 4.389 11.187 9.220 1.00 0.00 N ATOM 876 CA PRO A 62 5.131 12.218 8.463 1.00 0.00 C ATOM 877 C PRO A 62 5.469 11.793 7.018 1.00 0.00 C ATOM 878 O PRO A 62 6.099 12.547 6.275 1.00 0.00 O ATOM 879 CB PRO A 62 6.417 12.385 9.274 1.00 0.00 C ATOM 880 CG PRO A 62 6.602 11.076 9.947 1.00 0.00 C ATOM 881 CD PRO A 62 5.224 10.601 10.292 1.00 0.00 C ATOM 0 HA PRO A 62 4.542 13.129 8.351 1.00 0.00 H new ATOM 0 HB2 PRO A 62 7.264 12.624 8.631 1.00 0.00 H new ATOM 0 HB3 PRO A 62 6.328 13.195 9.998 1.00 0.00 H new ATOM 0 HG2 PRO A 62 7.108 10.367 9.292 1.00 0.00 H new ATOM 0 HG3 PRO A 62 7.216 11.179 10.841 1.00 0.00 H new ATOM 0 HD2 PRO A 62 5.163 9.513 10.301 1.00 0.00 H new ATOM 0 HD3 PRO A 62 4.914 10.946 11.278 1.00 0.00 H new ATOM 889 N HIS A 63 5.037 10.594 6.636 1.00 0.00 N ATOM 890 CA HIS A 63 5.263 10.006 5.316 1.00 0.00 C ATOM 891 C HIS A 63 6.712 10.035 4.849 1.00 0.00 C ATOM 892 O HIS A 63 6.988 10.195 3.663 1.00 0.00 O ATOM 893 CB HIS A 63 4.239 10.470 4.211 1.00 0.00 C ATOM 894 CG HIS A 63 4.053 11.957 3.940 1.00 0.00 C ATOM 895 ND1 HIS A 63 4.545 12.591 2.821 1.00 0.00 N ATOM 896 CD2 HIS A 63 3.321 12.889 4.597 1.00 0.00 C ATOM 897 CE1 HIS A 63 4.120 13.840 2.803 1.00 0.00 C ATOM 898 NE2 HIS A 63 3.375 14.047 3.869 1.00 0.00 N ATOM 0 H HIS A 63 4.503 9.985 7.255 1.00 0.00 H new ATOM 0 HA HIS A 63 5.045 8.949 5.471 1.00 0.00 H new ATOM 0 HB2 HIS A 63 4.536 10.001 3.273 1.00 0.00 H new ATOM 0 HB3 HIS A 63 3.264 10.062 4.477 1.00 0.00 H new ATOM 0 HD2 HIS A 63 2.791 12.744 5.527 1.00 0.00 H new ATOM 0 HE1 HIS A 63 4.346 14.571 2.041 1.00 0.00 H new ATOM 0 HE2 HIS A 63 2.915 14.924 4.112 1.00 0.00 H new ATOM 907 N PHE A 64 7.639 9.835 5.780 1.00 0.00 N ATOM 908 CA PHE A 64 9.039 9.775 5.434 1.00 0.00 C ATOM 909 C PHE A 64 9.414 8.346 5.063 1.00 0.00 C ATOM 910 O PHE A 64 9.759 7.515 5.910 1.00 0.00 O ATOM 911 CB PHE A 64 9.942 10.325 6.540 1.00 0.00 C ATOM 912 CG PHE A 64 11.387 10.415 6.126 1.00 0.00 C ATOM 913 CD1 PHE A 64 11.802 11.397 5.243 1.00 0.00 C ATOM 914 CD2 PHE A 64 12.322 9.510 6.595 1.00 0.00 C ATOM 915 CE1 PHE A 64 13.117 11.478 4.842 1.00 0.00 C ATOM 916 CE2 PHE A 64 13.637 9.585 6.193 1.00 0.00 C ATOM 917 CZ PHE A 64 14.036 10.568 5.318 1.00 0.00 C ATOM 0 H PHE A 64 7.439 9.713 6.773 1.00 0.00 H new ATOM 0 HA PHE A 64 9.199 10.420 4.570 1.00 0.00 H new ATOM 0 HB2 PHE A 64 9.590 11.315 6.831 1.00 0.00 H new ATOM 0 HB3 PHE A 64 9.860 9.687 7.420 1.00 0.00 H new ATOM 0 HD1 PHE A 64 11.085 12.109 4.863 1.00 0.00 H new ATOM 0 HD2 PHE A 64 12.017 8.736 7.284 1.00 0.00 H new ATOM 0 HE1 PHE A 64 13.427 12.253 4.156 1.00 0.00 H new ATOM 0 HE2 PHE A 64 14.356 8.871 6.566 1.00 0.00 H new ATOM 0 HZ PHE A 64 15.068 10.627 5.004 1.00 0.00 H new ATOM 927 N ASN A 65 9.271 8.082 3.815 1.00 0.00 N ATOM 928 CA ASN A 65 9.512 6.804 3.206 1.00 0.00 C ATOM 929 C ASN A 65 10.716 6.883 2.241 1.00 0.00 C ATOM 930 O ASN A 65 10.618 7.422 1.133 1.00 0.00 O ATOM 931 CB ASN A 65 8.194 6.268 2.582 1.00 0.00 C ATOM 932 CG ASN A 65 7.367 7.300 1.797 1.00 0.00 C ATOM 933 OD1 ASN A 65 6.126 7.314 1.900 1.00 0.00 O ATOM 934 ND2 ASN A 65 7.997 8.117 0.985 1.00 0.00 N ATOM 0 H ASN A 65 8.965 8.786 3.144 1.00 0.00 H new ATOM 0 HA ASN A 65 9.805 6.065 3.952 1.00 0.00 H new ATOM 0 HB2 ASN A 65 8.438 5.441 1.916 1.00 0.00 H new ATOM 0 HB3 ASN A 65 7.573 5.862 3.380 1.00 0.00 H new ATOM 0 HD21 ASN A 65 7.469 8.783 0.421 1.00 0.00 H new ATOM 0 HD22 ASN A 65 9.014 8.086 0.919 1.00 0.00 H new ATOM 941 N PRO A 66 11.912 6.474 2.725 1.00 0.00 N ATOM 942 CA PRO A 66 13.164 6.620 1.987 1.00 0.00 C ATOM 943 C PRO A 66 13.488 5.499 0.975 1.00 0.00 C ATOM 944 O PRO A 66 14.396 5.653 0.158 1.00 0.00 O ATOM 945 CB PRO A 66 14.221 6.680 3.087 1.00 0.00 C ATOM 946 CG PRO A 66 13.628 5.966 4.269 1.00 0.00 C ATOM 947 CD PRO A 66 12.136 5.838 4.039 1.00 0.00 C ATOM 0 HA PRO A 66 13.114 7.501 1.348 1.00 0.00 H new ATOM 0 HB2 PRO A 66 15.146 6.202 2.766 1.00 0.00 H new ATOM 0 HB3 PRO A 66 14.466 7.712 3.337 1.00 0.00 H new ATOM 0 HG2 PRO A 66 14.081 4.982 4.386 1.00 0.00 H new ATOM 0 HG3 PRO A 66 13.826 6.519 5.187 1.00 0.00 H new ATOM 0 HD2 PRO A 66 11.823 4.794 4.034 1.00 0.00 H new ATOM 0 HD3 PRO A 66 11.568 6.337 4.824 1.00 0.00 H new ATOM 955 N LEU A 67 12.779 4.382 1.026 1.00 0.00 N ATOM 956 CA LEU A 67 13.046 3.271 0.094 1.00 0.00 C ATOM 957 C LEU A 67 12.332 3.493 -1.114 1.00 0.00 C ATOM 958 O LEU A 67 12.705 3.044 -2.149 1.00 0.00 O ATOM 959 CB LEU A 67 12.622 1.931 0.688 1.00 0.00 C ATOM 960 CG LEU A 67 12.895 0.689 -0.184 1.00 0.00 C ATOM 961 CD1 LEU A 67 14.386 0.476 -0.393 1.00 0.00 C ATOM 962 CD2 LEU A 67 12.253 -0.545 0.413 1.00 0.00 C ATOM 0 H LEU A 67 12.023 4.211 1.689 1.00 0.00 H new ATOM 0 HA LEU A 67 14.119 3.236 -0.097 1.00 0.00 H new ATOM 0 HB2 LEU A 67 13.134 1.801 1.642 1.00 0.00 H new ATOM 0 HB3 LEU A 67 11.554 1.973 0.902 1.00 0.00 H new ATOM 0 HG LEU A 67 12.445 0.867 -1.161 1.00 0.00 H new ATOM 0 HD11 LEU A 67 14.544 -0.407 -1.012 1.00 0.00 H new ATOM 0 HD12 LEU A 67 14.812 1.348 -0.890 1.00 0.00 H new ATOM 0 HD13 LEU A 67 14.872 0.335 0.572 1.00 0.00 H new ATOM 0 HD21 LEU A 67 12.461 -1.406 -0.222 1.00 0.00 H new ATOM 0 HD22 LEU A 67 12.660 -0.721 1.409 1.00 0.00 H new ATOM 0 HD23 LEU A 67 11.175 -0.397 0.482 1.00 0.00 H new ATOM 974 N SER A 68 11.352 4.323 -0.982 1.00 0.00 N ATOM 975 CA SER A 68 10.490 4.779 -1.964 1.00 0.00 C ATOM 976 C SER A 68 11.195 5.812 -2.787 1.00 0.00 C ATOM 977 O SER A 68 10.564 6.592 -3.422 1.00 0.00 O ATOM 978 CB SER A 68 9.388 5.450 -1.230 1.00 0.00 C ATOM 979 OG SER A 68 9.326 4.941 0.087 1.00 0.00 O ATOM 0 H SER A 68 11.131 4.729 -0.073 1.00 0.00 H new ATOM 0 HA SER A 68 10.142 3.974 -2.612 1.00 0.00 H new ATOM 0 HB2 SER A 68 9.553 6.527 -1.208 1.00 0.00 H new ATOM 0 HB3 SER A 68 8.440 5.283 -1.742 1.00 0.00 H new ATOM 0 HG SER A 68 9.301 3.962 0.058 1.00 0.00 H new ATOM 985 N ARG A 69 12.520 5.687 -2.863 1.00 0.00 N ATOM 986 CA ARG A 69 13.472 6.581 -3.467 1.00 0.00 C ATOM 987 C ARG A 69 13.390 6.498 -4.972 1.00 0.00 C ATOM 988 O ARG A 69 14.337 6.203 -5.659 1.00 0.00 O ATOM 989 CB ARG A 69 14.876 6.275 -2.961 1.00 0.00 C ATOM 990 CG ARG A 69 15.922 7.311 -3.321 1.00 0.00 C ATOM 991 CD ARG A 69 17.270 6.896 -2.801 1.00 0.00 C ATOM 992 NE ARG A 69 18.306 7.866 -3.122 1.00 0.00 N ATOM 993 CZ ARG A 69 19.609 7.600 -3.172 1.00 0.00 C ATOM 994 NH1 ARG A 69 20.064 6.373 -2.897 1.00 0.00 N ATOM 995 NH2 ARG A 69 20.449 8.560 -3.487 1.00 0.00 N ATOM 0 H ARG A 69 12.985 4.874 -2.460 1.00 0.00 H new ATOM 0 HA ARG A 69 13.232 7.605 -3.181 1.00 0.00 H new ATOM 0 HB2 ARG A 69 14.842 6.175 -1.876 1.00 0.00 H new ATOM 0 HB3 ARG A 69 15.188 5.310 -3.360 1.00 0.00 H new ATOM 0 HG2 ARG A 69 15.964 7.434 -4.403 1.00 0.00 H new ATOM 0 HG3 ARG A 69 15.645 8.278 -2.901 1.00 0.00 H new ATOM 0 HD2 ARG A 69 17.217 6.768 -1.720 1.00 0.00 H new ATOM 0 HD3 ARG A 69 17.538 5.928 -3.223 1.00 0.00 H new ATOM 0 HE ARG A 69 18.011 8.821 -3.324 1.00 0.00 H new ATOM 0 HH11 ARG A 69 19.411 5.631 -2.646 1.00 0.00 H new ATOM 0 HH12 ARG A 69 21.065 6.179 -2.938 1.00 0.00 H new ATOM 0 HH21 ARG A 69 20.100 9.497 -3.690 1.00 0.00 H new ATOM 0 HH22 ARG A 69 21.450 8.368 -3.529 1.00 0.00 H new ATOM 1009 N LYS A 70 12.226 6.473 -5.413 1.00 0.00 N ATOM 1010 CA LYS A 70 11.950 6.670 -6.754 1.00 0.00 C ATOM 1011 C LYS A 70 10.704 7.544 -6.869 1.00 0.00 C ATOM 1012 O LYS A 70 10.432 8.142 -7.905 1.00 0.00 O ATOM 1013 CB LYS A 70 11.781 5.395 -7.593 1.00 0.00 C ATOM 1014 CG LYS A 70 11.835 5.627 -9.102 1.00 0.00 C ATOM 1015 CD LYS A 70 11.604 4.346 -9.894 1.00 0.00 C ATOM 1016 CE LYS A 70 12.648 3.268 -9.603 1.00 0.00 C ATOM 1017 NZ LYS A 70 14.033 3.653 -9.996 1.00 0.00 N ATOM 0 H LYS A 70 11.402 6.309 -4.834 1.00 0.00 H new ATOM 0 HA LYS A 70 12.831 7.155 -7.175 1.00 0.00 H new ATOM 0 HB2 LYS A 70 12.562 4.686 -7.317 1.00 0.00 H new ATOM 0 HB3 LYS A 70 10.827 4.932 -7.342 1.00 0.00 H new ATOM 0 HG2 LYS A 70 11.082 6.364 -9.381 1.00 0.00 H new ATOM 0 HG3 LYS A 70 12.805 6.046 -9.368 1.00 0.00 H new ATOM 0 HD2 LYS A 70 10.613 3.956 -9.663 1.00 0.00 H new ATOM 0 HD3 LYS A 70 11.615 4.577 -10.959 1.00 0.00 H new ATOM 0 HE2 LYS A 70 12.633 3.038 -8.538 1.00 0.00 H new ATOM 0 HE3 LYS A 70 12.371 2.355 -10.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 14.678 2.857 -9.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 14.053 3.894 -11.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 14.336 4.477 -9.438 1.00 0.00 H new ATOM 1031 N HIS A 71 9.960 7.598 -5.771 1.00 0.00 N ATOM 1032 CA HIS A 71 8.755 8.388 -5.592 1.00 0.00 C ATOM 1033 C HIS A 71 7.606 7.836 -6.415 1.00 0.00 C ATOM 1034 O HIS A 71 6.618 8.529 -6.646 1.00 0.00 O ATOM 1035 CB HIS A 71 8.994 9.875 -5.883 1.00 0.00 C ATOM 1036 CG HIS A 71 8.386 10.796 -4.865 1.00 0.00 C ATOM 1037 ND1 HIS A 71 7.137 11.358 -4.990 1.00 0.00 N ATOM 1038 CD2 HIS A 71 8.892 11.274 -3.701 1.00 0.00 C ATOM 1039 CE1 HIS A 71 6.904 12.143 -3.957 1.00 0.00 C ATOM 1040 NE2 HIS A 71 7.953 12.110 -3.160 1.00 0.00 N ATOM 0 H HIS A 71 10.197 7.061 -4.937 1.00 0.00 H new ATOM 0 HA HIS A 71 8.474 8.312 -4.541 1.00 0.00 H new ATOM 0 HB2 HIS A 71 10.067 10.059 -5.930 1.00 0.00 H new ATOM 0 HB3 HIS A 71 8.586 10.114 -6.865 1.00 0.00 H new ATOM 0 HD2 HIS A 71 9.858 11.038 -3.279 1.00 0.00 H new ATOM 0 HE1 HIS A 71 6.004 12.717 -3.792 1.00 0.00 H new ATOM 0 HE2 HIS A 71 8.049 12.623 -2.284 1.00 0.00 H new ATOM 1049 N GLY A 72 7.721 6.583 -6.818 1.00 0.00 N ATOM 1050 CA GLY A 72 6.656 5.951 -7.525 1.00 0.00 C ATOM 1051 C GLY A 72 6.905 5.766 -9.000 1.00 0.00 C ATOM 1052 O GLY A 72 7.434 6.657 -9.695 1.00 0.00 O ATOM 0 H GLY A 72 8.542 5.998 -6.662 1.00 0.00 H new ATOM 0 HA2 GLY A 72 6.468 4.976 -7.076 1.00 0.00 H new ATOM 0 HA3 GLY A 72 5.749 6.542 -7.394 1.00 0.00 H new ATOM 1056 N GLY A 73 6.538 4.609 -9.462 1.00 0.00 N ATOM 1057 CA GLY A 73 6.598 4.259 -10.842 1.00 0.00 C ATOM 1058 C GLY A 73 5.458 3.309 -11.173 1.00 0.00 C ATOM 1059 O GLY A 73 4.836 2.746 -10.239 1.00 0.00 O ATOM 0 H GLY A 73 6.178 3.862 -8.868 1.00 0.00 H new ATOM 0 HA2 GLY A 73 6.530 5.155 -11.459 1.00 0.00 H new ATOM 0 HA3 GLY A 73 7.555 3.789 -11.068 1.00 0.00 H new ATOM 1063 N PRO A 74 5.112 3.136 -12.459 1.00 0.00 N ATOM 1064 CA PRO A 74 4.030 2.236 -12.880 1.00 0.00 C ATOM 1065 C PRO A 74 4.411 0.754 -12.762 1.00 0.00 C ATOM 1066 O PRO A 74 3.583 -0.083 -12.430 1.00 0.00 O ATOM 1067 CB PRO A 74 3.799 2.609 -14.356 1.00 0.00 C ATOM 1068 CG PRO A 74 4.551 3.877 -14.572 1.00 0.00 C ATOM 1069 CD PRO A 74 5.699 3.835 -13.616 1.00 0.00 C ATOM 0 HA PRO A 74 3.148 2.353 -12.251 1.00 0.00 H new ATOM 0 HB2 PRO A 74 4.158 1.823 -15.020 1.00 0.00 H new ATOM 0 HB3 PRO A 74 2.738 2.742 -14.565 1.00 0.00 H new ATOM 0 HG2 PRO A 74 4.901 3.954 -15.601 1.00 0.00 H new ATOM 0 HG3 PRO A 74 3.918 4.744 -14.385 1.00 0.00 H new ATOM 0 HD2 PRO A 74 6.553 3.296 -14.028 1.00 0.00 H new ATOM 0 HD3 PRO A 74 6.048 4.834 -13.354 1.00 0.00 H new ATOM 1077 N LYS A 75 5.643 0.433 -13.085 1.00 0.00 N ATOM 1078 CA LYS A 75 6.125 -0.933 -12.976 1.00 0.00 C ATOM 1079 C LYS A 75 7.024 -1.057 -11.752 1.00 0.00 C ATOM 1080 O LYS A 75 7.152 -2.108 -11.183 1.00 0.00 O ATOM 1081 CB LYS A 75 6.861 -1.351 -14.275 1.00 0.00 C ATOM 1082 CG LYS A 75 7.968 -0.395 -14.703 1.00 0.00 C ATOM 1083 CD LYS A 75 8.712 -0.805 -15.987 1.00 0.00 C ATOM 1084 CE LYS A 75 7.820 -0.876 -17.237 1.00 0.00 C ATOM 1085 NZ LYS A 75 7.083 -2.158 -17.370 1.00 0.00 N ATOM 0 H LYS A 75 6.335 1.099 -13.427 1.00 0.00 H new ATOM 0 HA LYS A 75 5.281 -1.611 -12.850 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.289 -2.344 -14.133 1.00 0.00 H new ATOM 0 HB3 LYS A 75 6.133 -1.430 -15.082 1.00 0.00 H new ATOM 0 HG2 LYS A 75 7.537 0.596 -14.850 1.00 0.00 H new ATOM 0 HG3 LYS A 75 8.691 -0.311 -13.892 1.00 0.00 H new ATOM 0 HD2 LYS A 75 9.518 -0.094 -16.169 1.00 0.00 H new ATOM 0 HD3 LYS A 75 9.176 -1.779 -15.830 1.00 0.00 H new ATOM 0 HE2 LYS A 75 7.103 -0.056 -17.208 1.00 0.00 H new ATOM 0 HE3 LYS A 75 8.438 -0.728 -18.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 7.179 -2.514 -18.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 7.476 -2.855 -16.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 6.077 -2.004 -17.155 1.00 0.00 H new ATOM 1099 N ASP A 76 7.595 0.087 -11.394 1.00 0.00 N ATOM 1100 CA ASP A 76 8.516 0.361 -10.266 1.00 0.00 C ATOM 1101 C ASP A 76 9.709 -0.599 -10.153 1.00 0.00 C ATOM 1102 O ASP A 76 10.049 -1.330 -11.100 1.00 0.00 O ATOM 1103 CB ASP A 76 7.796 0.538 -8.927 1.00 0.00 C ATOM 1104 CG ASP A 76 8.479 1.607 -8.036 1.00 0.00 C ATOM 1105 OD1 ASP A 76 9.590 1.347 -7.468 1.00 0.00 O ATOM 1106 OD2 ASP A 76 7.901 2.702 -7.895 1.00 0.00 O ATOM 0 H ASP A 76 7.416 0.936 -11.930 1.00 0.00 H new ATOM 0 HA ASP A 76 8.953 1.325 -10.526 1.00 0.00 H new ATOM 0 HB2 ASP A 76 6.760 0.825 -9.108 1.00 0.00 H new ATOM 0 HB3 ASP A 76 7.775 -0.415 -8.398 1.00 0.00 H new ATOM 1111 N GLU A 77 10.345 -0.571 -9.002 1.00 0.00 N ATOM 1112 CA GLU A 77 11.599 -1.212 -8.773 1.00 0.00 C ATOM 1113 C GLU A 77 11.641 -1.749 -7.354 1.00 0.00 C ATOM 1114 O GLU A 77 11.822 -2.947 -7.160 1.00 0.00 O ATOM 1115 CB GLU A 77 12.670 -0.142 -8.945 1.00 0.00 C ATOM 1116 CG GLU A 77 14.102 -0.565 -8.732 1.00 0.00 C ATOM 1117 CD GLU A 77 15.009 0.636 -8.727 1.00 0.00 C ATOM 1118 OE1 GLU A 77 15.262 1.215 -9.802 1.00 0.00 O ATOM 1119 OE2 GLU A 77 15.473 1.041 -7.649 1.00 0.00 O ATOM 0 H GLU A 77 9.984 -0.084 -8.182 1.00 0.00 H new ATOM 0 HA GLU A 77 11.753 -2.043 -9.462 1.00 0.00 H new ATOM 0 HB2 GLU A 77 12.583 0.265 -9.953 1.00 0.00 H new ATOM 0 HB3 GLU A 77 12.451 0.671 -8.253 1.00 0.00 H new ATOM 0 HG2 GLU A 77 14.193 -1.101 -7.787 1.00 0.00 H new ATOM 0 HG3 GLU A 77 14.405 -1.254 -9.520 1.00 0.00 H new ATOM 1126 N GLU A 78 11.418 -0.836 -6.388 1.00 0.00 N ATOM 1127 CA GLU A 78 11.468 -1.092 -4.918 1.00 0.00 C ATOM 1128 C GLU A 78 10.980 0.146 -4.223 1.00 0.00 C ATOM 1129 O GLU A 78 10.378 0.108 -3.163 1.00 0.00 O ATOM 1130 CB GLU A 78 12.905 -1.351 -4.362 1.00 0.00 C ATOM 1131 CG GLU A 78 13.590 -2.652 -4.743 1.00 0.00 C ATOM 1132 CD GLU A 78 14.931 -2.803 -4.059 1.00 0.00 C ATOM 1133 OE1 GLU A 78 15.929 -2.242 -4.541 1.00 0.00 O ATOM 1134 OE2 GLU A 78 15.020 -3.488 -3.015 1.00 0.00 O ATOM 0 H GLU A 78 11.190 0.134 -6.607 1.00 0.00 H new ATOM 0 HA GLU A 78 10.866 -1.983 -4.740 1.00 0.00 H new ATOM 0 HB2 GLU A 78 13.543 -0.529 -4.688 1.00 0.00 H new ATOM 0 HB3 GLU A 78 12.856 -1.305 -3.274 1.00 0.00 H new ATOM 0 HG2 GLU A 78 12.949 -3.492 -4.475 1.00 0.00 H new ATOM 0 HG3 GLU A 78 13.727 -2.687 -5.824 1.00 0.00 H new ATOM 1141 N ARG A 79 11.230 1.258 -4.866 1.00 0.00 N ATOM 1142 CA ARG A 79 11.037 2.513 -4.367 1.00 0.00 C ATOM 1143 C ARG A 79 9.590 2.968 -4.645 1.00 0.00 C ATOM 1144 O ARG A 79 9.341 4.152 -4.933 1.00 0.00 O ATOM 1145 CB ARG A 79 11.987 3.388 -5.154 1.00 0.00 C ATOM 1146 CG ARG A 79 13.341 2.767 -5.631 1.00 0.00 C ATOM 1147 CD ARG A 79 14.278 2.349 -4.515 1.00 0.00 C ATOM 1148 NE ARG A 79 15.503 1.747 -5.045 1.00 0.00 N ATOM 1149 CZ ARG A 79 16.613 1.494 -4.335 1.00 0.00 C ATOM 1150 NH1 ARG A 79 16.688 1.832 -3.049 1.00 0.00 N ATOM 1151 NH2 ARG A 79 17.651 0.914 -4.919 1.00 0.00 N ATOM 0 H ARG A 79 11.599 1.264 -5.817 1.00 0.00 H new ATOM 0 HA ARG A 79 11.207 2.560 -3.291 1.00 0.00 H new ATOM 0 HB2 ARG A 79 11.456 3.746 -6.036 1.00 0.00 H new ATOM 0 HB3 ARG A 79 12.218 4.261 -4.544 1.00 0.00 H new ATOM 0 HG2 ARG A 79 13.127 1.897 -6.251 1.00 0.00 H new ATOM 0 HG3 ARG A 79 13.853 3.491 -6.264 1.00 0.00 H new ATOM 0 HD2 ARG A 79 14.531 3.217 -3.906 1.00 0.00 H new ATOM 0 HD3 ARG A 79 13.774 1.637 -3.862 1.00 0.00 H new ATOM 0 HE ARG A 79 15.513 1.500 -6.035 1.00 0.00 H new ATOM 0 HH11 ARG A 79 15.897 2.288 -2.595 1.00 0.00 H new ATOM 0 HH12 ARG A 79 17.537 1.635 -2.519 1.00 0.00 H new ATOM 0 HH21 ARG A 79 17.605 0.661 -5.906 1.00 0.00 H new ATOM 0 HH22 ARG A 79 18.496 0.721 -4.382 1.00 0.00 H new ATOM 1165 N HIS A 80 8.656 2.063 -4.465 1.00 0.00 N ATOM 1166 CA HIS A 80 7.265 2.288 -4.833 1.00 0.00 C ATOM 1167 C HIS A 80 6.463 2.781 -3.626 1.00 0.00 C ATOM 1168 O HIS A 80 5.229 2.817 -3.679 1.00 0.00 O ATOM 1169 CB HIS A 80 6.685 0.956 -5.366 1.00 0.00 C ATOM 1170 CG HIS A 80 5.486 1.058 -6.272 1.00 0.00 C ATOM 1171 ND1 HIS A 80 4.812 -0.045 -6.731 1.00 0.00 N ATOM 1172 CD2 HIS A 80 4.926 2.113 -6.896 1.00 0.00 C ATOM 1173 CE1 HIS A 80 3.898 0.314 -7.593 1.00 0.00 C ATOM 1174 NE2 HIS A 80 3.940 1.630 -7.724 1.00 0.00 N ATOM 0 H HIS A 80 8.834 1.145 -4.058 1.00 0.00 H new ATOM 0 HA HIS A 80 7.203 3.055 -5.604 1.00 0.00 H new ATOM 0 HB2 HIS A 80 7.475 0.431 -5.904 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.415 0.336 -4.511 1.00 0.00 H new ATOM 0 HD1 HIS A 80 4.997 -1.005 -6.442 1.00 0.00 H new ATOM 0 HD2 HIS A 80 5.202 3.150 -6.769 1.00 0.00 H new ATOM 0 HE1 HIS A 80 3.223 -0.351 -8.111 1.00 0.00 H new ATOM 1183 N VAL A 81 7.189 3.187 -2.551 1.00 0.00 N ATOM 1184 CA VAL A 81 6.588 3.655 -1.265 1.00 0.00 C ATOM 1185 C VAL A 81 5.988 2.422 -0.567 1.00 0.00 C ATOM 1186 O VAL A 81 5.124 2.488 0.286 1.00 0.00 O ATOM 1187 CB VAL A 81 5.511 4.806 -1.512 1.00 0.00 C ATOM 1188 CG1 VAL A 81 4.925 5.351 -0.221 1.00 0.00 C ATOM 1189 CG2 VAL A 81 6.103 5.966 -2.320 1.00 0.00 C ATOM 0 H VAL A 81 8.209 3.200 -2.548 1.00 0.00 H new ATOM 0 HA VAL A 81 7.346 4.104 -0.623 1.00 0.00 H new ATOM 0 HB VAL A 81 4.708 4.337 -2.080 1.00 0.00 H new ATOM 0 HG11 VAL A 81 4.199 6.131 -0.452 1.00 0.00 H new ATOM 0 HG12 VAL A 81 4.432 4.546 0.323 1.00 0.00 H new ATOM 0 HG13 VAL A 81 5.723 5.769 0.393 1.00 0.00 H new ATOM 0 HG21 VAL A 81 5.341 6.731 -2.469 1.00 0.00 H new ATOM 0 HG22 VAL A 81 6.946 6.394 -1.778 1.00 0.00 H new ATOM 0 HG23 VAL A 81 6.443 5.599 -3.288 1.00 0.00 H new ATOM 1199 N GLY A 82 6.567 1.318 -0.885 1.00 0.00 N ATOM 1200 CA GLY A 82 6.058 0.053 -0.531 1.00 0.00 C ATOM 1201 C GLY A 82 5.739 -0.611 -1.812 1.00 0.00 C ATOM 1202 O GLY A 82 6.440 -0.377 -2.776 1.00 0.00 O ATOM 0 H GLY A 82 7.437 1.276 -1.416 1.00 0.00 H new ATOM 0 HA2 GLY A 82 6.790 -0.520 0.038 1.00 0.00 H new ATOM 0 HA3 GLY A 82 5.171 0.147 0.095 1.00 0.00 H new ATOM 1206 N ASP A 83 4.723 -1.419 -1.861 1.00 0.00 N ATOM 1207 CA ASP A 83 4.284 -2.005 -3.111 1.00 0.00 C ATOM 1208 C ASP A 83 2.997 -2.680 -2.863 1.00 0.00 C ATOM 1209 O ASP A 83 2.879 -3.487 -1.938 1.00 0.00 O ATOM 1210 CB ASP A 83 5.278 -2.993 -3.721 1.00 0.00 C ATOM 1211 CG ASP A 83 4.974 -3.252 -5.189 1.00 0.00 C ATOM 1212 OD1 ASP A 83 5.425 -2.452 -6.036 1.00 0.00 O ATOM 1213 OD2 ASP A 83 4.303 -4.224 -5.516 1.00 0.00 O ATOM 0 H ASP A 83 4.173 -1.695 -1.048 1.00 0.00 H new ATOM 0 HA ASP A 83 4.191 -1.199 -3.839 1.00 0.00 H new ATOM 0 HB2 ASP A 83 6.290 -2.601 -3.621 1.00 0.00 H new ATOM 0 HB3 ASP A 83 5.244 -3.933 -3.170 1.00 0.00 H new ATOM 1218 N LEU A 84 2.028 -2.319 -3.615 1.00 0.00 N ATOM 1219 CA LEU A 84 0.728 -2.844 -3.482 1.00 0.00 C ATOM 1220 C LEU A 84 0.059 -2.537 -4.781 1.00 0.00 C ATOM 1221 O LEU A 84 0.626 -1.804 -5.596 1.00 0.00 O ATOM 1222 CB LEU A 84 -0.009 -2.156 -2.325 1.00 0.00 C ATOM 1223 CG LEU A 84 -1.077 -2.972 -1.612 1.00 0.00 C ATOM 1224 CD1 LEU A 84 -0.441 -4.138 -0.870 1.00 0.00 C ATOM 1225 CD2 LEU A 84 -1.869 -2.095 -0.657 1.00 0.00 C ATOM 0 H LEU A 84 2.122 -1.630 -4.361 1.00 0.00 H new ATOM 0 HA LEU A 84 0.733 -3.912 -3.263 1.00 0.00 H new ATOM 0 HB2 LEU A 84 0.731 -1.846 -1.587 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -0.475 -1.249 -2.710 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.766 -3.371 -2.357 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.216 -4.714 -0.364 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.082 -4.779 -1.580 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.267 -3.758 -0.134 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -2.628 -2.696 -0.156 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.197 -1.667 0.086 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.351 -1.292 -1.215 1.00 0.00 H new ATOM 1237 N GLY A 85 -1.100 -3.058 -4.981 1.00 0.00 N ATOM 1238 CA GLY A 85 -1.780 -2.858 -6.193 1.00 0.00 C ATOM 1239 C GLY A 85 -2.824 -1.823 -5.998 1.00 0.00 C ATOM 1240 O GLY A 85 -3.031 -1.342 -4.867 1.00 0.00 O ATOM 0 H GLY A 85 -1.597 -3.635 -4.302 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.081 -2.546 -6.969 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -2.233 -3.791 -6.528 1.00 0.00 H new ATOM 1244 N ASN A 86 -3.469 -1.470 -7.046 1.00 0.00 N ATOM 1245 CA ASN A 86 -4.532 -0.517 -6.987 1.00 0.00 C ATOM 1246 C ASN A 86 -5.748 -1.226 -6.440 1.00 0.00 C ATOM 1247 O ASN A 86 -5.981 -2.361 -6.788 1.00 0.00 O ATOM 1248 CB ASN A 86 -4.824 -0.002 -8.391 1.00 0.00 C ATOM 1249 CG ASN A 86 -6.092 0.808 -8.480 1.00 0.00 C ATOM 1250 OD1 ASN A 86 -6.450 1.547 -7.571 1.00 0.00 O ATOM 1251 ND2 ASN A 86 -6.800 0.643 -9.558 1.00 0.00 N ATOM 0 H ASN A 86 -3.279 -1.832 -7.980 1.00 0.00 H new ATOM 0 HA ASN A 86 -4.265 0.327 -6.352 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -3.987 0.610 -8.727 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -4.894 -0.849 -9.073 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -7.685 1.137 -9.667 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -6.470 0.019 -10.294 1.00 0.00 H new ATOM 1258 N VAL A 87 -6.477 -0.597 -5.583 1.00 0.00 N ATOM 1259 CA VAL A 87 -7.660 -1.189 -5.054 1.00 0.00 C ATOM 1260 C VAL A 87 -8.599 -0.044 -4.725 1.00 0.00 C ATOM 1261 O VAL A 87 -8.203 0.936 -4.055 1.00 0.00 O ATOM 1262 CB VAL A 87 -7.295 -2.118 -3.847 1.00 0.00 C ATOM 1263 CG1 VAL A 87 -6.677 -1.378 -2.681 1.00 0.00 C ATOM 1264 CG2 VAL A 87 -8.420 -3.001 -3.413 1.00 0.00 C ATOM 0 H VAL A 87 -6.272 0.338 -5.230 1.00 0.00 H new ATOM 0 HA VAL A 87 -8.168 -1.848 -5.758 1.00 0.00 H new ATOM 0 HB VAL A 87 -6.520 -2.778 -4.237 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -6.450 -2.083 -1.882 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -5.758 -0.890 -3.006 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -7.377 -0.627 -2.314 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -8.096 -3.617 -2.574 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -9.267 -2.387 -3.107 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -8.718 -3.644 -4.241 1.00 0.00 H new ATOM 1274 N THR A 88 -9.803 -0.128 -5.238 1.00 0.00 N ATOM 1275 CA THR A 88 -10.712 0.960 -5.252 1.00 0.00 C ATOM 1276 C THR A 88 -12.096 0.456 -4.974 1.00 0.00 C ATOM 1277 O THR A 88 -12.573 -0.415 -5.699 1.00 0.00 O ATOM 1278 CB THR A 88 -10.705 1.571 -6.679 1.00 0.00 C ATOM 1279 OG1 THR A 88 -10.883 0.527 -7.654 1.00 0.00 O ATOM 1280 CG2 THR A 88 -9.418 2.281 -6.975 1.00 0.00 C ATOM 0 H THR A 88 -10.172 -0.979 -5.663 1.00 0.00 H new ATOM 0 HA THR A 88 -10.424 1.696 -4.501 1.00 0.00 H new ATOM 0 HB THR A 88 -11.521 2.292 -6.729 1.00 0.00 H new ATOM 0 HG1 THR A 88 -11.465 -0.170 -7.285 1.00 0.00 H new ATOM 0 HG21 THR A 88 -9.454 2.694 -7.983 1.00 0.00 H new ATOM 0 HG22 THR A 88 -9.274 3.088 -6.257 1.00 0.00 H new ATOM 0 HG23 THR A 88 -8.589 1.577 -6.901 1.00 0.00 H new ATOM 1288 N ALA A 89 -12.753 0.931 -3.974 1.00 0.00 N ATOM 1289 CA ALA A 89 -14.095 0.521 -3.836 1.00 0.00 C ATOM 1290 C ALA A 89 -14.938 1.707 -4.169 1.00 0.00 C ATOM 1291 O ALA A 89 -15.176 2.555 -3.347 1.00 0.00 O ATOM 1292 CB ALA A 89 -14.336 0.033 -2.420 1.00 0.00 C ATOM 0 H ALA A 89 -12.398 1.577 -3.269 1.00 0.00 H new ATOM 0 HA ALA A 89 -14.342 -0.307 -4.500 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -15.374 -0.283 -2.316 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -13.677 -0.809 -2.208 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -14.130 0.840 -1.717 1.00 0.00 H new ATOM 1298 N ASP A 90 -15.495 1.688 -5.329 1.00 0.00 N ATOM 1299 CA ASP A 90 -16.157 2.869 -5.851 1.00 0.00 C ATOM 1300 C ASP A 90 -17.590 2.820 -5.537 1.00 0.00 C ATOM 1301 O ASP A 90 -18.205 3.800 -5.172 1.00 0.00 O ATOM 1302 CB ASP A 90 -15.947 2.964 -7.367 1.00 0.00 C ATOM 1303 CG ASP A 90 -16.599 4.175 -7.986 1.00 0.00 C ATOM 1304 OD1 ASP A 90 -16.094 5.290 -7.808 1.00 0.00 O ATOM 1305 OD2 ASP A 90 -17.635 4.020 -8.680 1.00 0.00 O ATOM 0 H ASP A 90 -15.515 0.877 -5.947 1.00 0.00 H new ATOM 0 HA ASP A 90 -15.725 3.754 -5.383 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -14.878 2.988 -7.578 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -16.344 2.065 -7.839 1.00 0.00 H new ATOM 1310 N LYS A 91 -18.106 1.665 -5.648 1.00 0.00 N ATOM 1311 CA LYS A 91 -19.524 1.412 -5.430 1.00 0.00 C ATOM 1312 C LYS A 91 -19.835 1.172 -3.936 1.00 0.00 C ATOM 1313 O LYS A 91 -20.964 0.884 -3.586 1.00 0.00 O ATOM 1314 CB LYS A 91 -20.001 0.229 -6.323 1.00 0.00 C ATOM 1315 CG LYS A 91 -21.523 -0.102 -6.325 1.00 0.00 C ATOM 1316 CD LYS A 91 -22.412 0.856 -7.166 1.00 0.00 C ATOM 1317 CE LYS A 91 -22.510 2.284 -6.624 1.00 0.00 C ATOM 1318 NZ LYS A 91 -23.507 3.086 -7.373 1.00 0.00 N ATOM 0 H LYS A 91 -17.571 0.833 -5.896 1.00 0.00 H new ATOM 0 HA LYS A 91 -20.082 2.301 -5.723 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -19.701 0.440 -7.349 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -19.462 -0.666 -6.012 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -21.656 -1.117 -6.700 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -21.881 -0.093 -5.296 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -22.020 0.894 -8.182 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -23.416 0.436 -7.228 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -22.784 2.255 -5.569 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -21.534 2.765 -6.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -23.546 4.047 -6.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -23.232 3.134 -8.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -24.443 2.640 -7.292 1.00 0.00 H new ATOM 1332 N ASP A 92 -18.828 1.346 -3.073 1.00 0.00 N ATOM 1333 CA ASP A 92 -18.940 1.068 -1.615 1.00 0.00 C ATOM 1334 C ASP A 92 -18.933 -0.411 -1.332 1.00 0.00 C ATOM 1335 O ASP A 92 -19.949 -1.076 -1.429 1.00 0.00 O ATOM 1336 CB ASP A 92 -20.175 1.754 -0.927 1.00 0.00 C ATOM 1337 CG ASP A 92 -20.392 1.371 0.537 1.00 0.00 C ATOM 1338 OD1 ASP A 92 -19.810 2.006 1.427 1.00 0.00 O ATOM 1339 OD2 ASP A 92 -21.204 0.461 0.823 1.00 0.00 O ATOM 0 H ASP A 92 -17.907 1.683 -3.354 1.00 0.00 H new ATOM 0 HA ASP A 92 -18.053 1.519 -1.170 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -20.053 2.835 -0.990 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -21.073 1.501 -1.490 1.00 0.00 H new ATOM 1344 N GLY A 93 -17.767 -0.927 -1.057 1.00 0.00 N ATOM 1345 CA GLY A 93 -17.665 -2.281 -0.606 1.00 0.00 C ATOM 1346 C GLY A 93 -17.134 -3.272 -1.597 1.00 0.00 C ATOM 1347 O GLY A 93 -17.212 -4.469 -1.343 1.00 0.00 O ATOM 0 H GLY A 93 -16.880 -0.431 -1.138 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -17.024 -2.301 0.275 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -18.654 -2.611 -0.288 1.00 0.00 H new ATOM 1351 N VAL A 94 -16.552 -2.829 -2.702 1.00 0.00 N ATOM 1352 CA VAL A 94 -16.059 -3.760 -3.667 1.00 0.00 C ATOM 1353 C VAL A 94 -14.868 -3.105 -4.191 1.00 0.00 C ATOM 1354 O VAL A 94 -14.970 -2.145 -4.943 1.00 0.00 O ATOM 1355 CB VAL A 94 -17.050 -4.014 -4.866 1.00 0.00 C ATOM 1356 CG1 VAL A 94 -16.490 -5.062 -5.824 1.00 0.00 C ATOM 1357 CG2 VAL A 94 -18.441 -4.431 -4.396 1.00 0.00 C ATOM 0 H VAL A 94 -16.418 -1.846 -2.937 1.00 0.00 H new ATOM 0 HA VAL A 94 -15.897 -4.734 -3.206 1.00 0.00 H new ATOM 0 HB VAL A 94 -17.150 -3.064 -5.391 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -17.193 -5.219 -6.642 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -15.537 -4.716 -6.225 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -16.340 -6.000 -5.290 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -19.084 -4.593 -5.261 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -18.369 -5.353 -3.819 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -18.865 -3.645 -3.771 1.00 0.00 H new ATOM 1367 N ALA A 95 -13.754 -3.534 -3.767 1.00 0.00 N ATOM 1368 CA ALA A 95 -12.588 -2.914 -4.199 1.00 0.00 C ATOM 1369 C ALA A 95 -11.943 -3.681 -5.291 1.00 0.00 C ATOM 1370 O ALA A 95 -11.593 -4.857 -5.116 1.00 0.00 O ATOM 1371 CB ALA A 95 -11.666 -2.636 -3.059 1.00 0.00 C ATOM 0 H ALA A 95 -13.628 -4.313 -3.121 1.00 0.00 H new ATOM 0 HA ALA A 95 -12.855 -1.945 -4.620 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -10.764 -2.151 -3.431 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -12.161 -1.981 -2.342 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -11.399 -3.573 -2.570 1.00 0.00 H new ATOM 1377 N ASP A 96 -11.836 -3.047 -6.424 1.00 0.00 N ATOM 1378 CA ASP A 96 -11.230 -3.644 -7.580 1.00 0.00 C ATOM 1379 C ASP A 96 -9.742 -3.560 -7.478 1.00 0.00 C ATOM 1380 O ASP A 96 -9.173 -2.459 -7.488 1.00 0.00 O ATOM 1381 CB ASP A 96 -11.697 -2.970 -8.866 1.00 0.00 C ATOM 1382 CG ASP A 96 -10.949 -3.483 -10.078 1.00 0.00 C ATOM 1383 OD1 ASP A 96 -11.261 -4.596 -10.563 1.00 0.00 O ATOM 1384 OD2 ASP A 96 -10.040 -2.789 -10.562 1.00 0.00 O ATOM 0 H ASP A 96 -12.169 -2.094 -6.573 1.00 0.00 H new ATOM 0 HA ASP A 96 -11.536 -4.690 -7.615 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -12.765 -3.143 -8.999 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -11.557 -1.892 -8.782 1.00 0.00 H new ATOM 1389 N VAL A 97 -9.118 -4.692 -7.310 1.00 0.00 N ATOM 1390 CA VAL A 97 -7.710 -4.740 -7.255 1.00 0.00 C ATOM 1391 C VAL A 97 -7.142 -4.884 -8.659 1.00 0.00 C ATOM 1392 O VAL A 97 -7.506 -5.793 -9.427 1.00 0.00 O ATOM 1393 CB VAL A 97 -7.172 -5.851 -6.304 1.00 0.00 C ATOM 1394 CG1 VAL A 97 -7.565 -7.242 -6.761 1.00 0.00 C ATOM 1395 CG2 VAL A 97 -5.664 -5.738 -6.115 1.00 0.00 C ATOM 0 H VAL A 97 -9.581 -5.595 -7.209 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.369 -3.798 -6.827 1.00 0.00 H new ATOM 0 HB VAL A 97 -7.645 -5.691 -5.335 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -7.166 -7.980 -6.065 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -8.652 -7.322 -6.791 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -7.160 -7.426 -7.756 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -5.321 -6.527 -5.446 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -5.168 -5.839 -7.080 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -5.423 -4.767 -5.683 1.00 0.00 H new ATOM 1405 N SER A 98 -6.324 -3.970 -9.001 1.00 0.00 N ATOM 1406 CA SER A 98 -5.638 -3.968 -10.230 1.00 0.00 C ATOM 1407 C SER A 98 -4.157 -3.935 -9.942 1.00 0.00 C ATOM 1408 O SER A 98 -3.625 -2.932 -9.469 1.00 0.00 O ATOM 1409 CB SER A 98 -6.065 -2.770 -11.076 1.00 0.00 C ATOM 1410 OG SER A 98 -7.449 -2.841 -11.410 1.00 0.00 O ATOM 0 H SER A 98 -6.104 -3.169 -8.409 1.00 0.00 H new ATOM 0 HA SER A 98 -5.877 -4.866 -10.799 1.00 0.00 H new ATOM 0 HB2 SER A 98 -5.867 -1.847 -10.531 1.00 0.00 H new ATOM 0 HB3 SER A 98 -5.469 -2.735 -11.988 1.00 0.00 H new ATOM 0 HG SER A 98 -7.987 -2.768 -10.594 1.00 0.00 H new ATOM 1416 N ILE A 99 -3.515 -5.044 -10.135 1.00 0.00 N ATOM 1417 CA ILE A 99 -2.098 -5.117 -9.925 1.00 0.00 C ATOM 1418 C ILE A 99 -1.354 -4.870 -11.230 1.00 0.00 C ATOM 1419 O ILE A 99 -1.907 -5.053 -12.317 1.00 0.00 O ATOM 1420 CB ILE A 99 -1.711 -6.483 -9.254 1.00 0.00 C ATOM 1421 CG1 ILE A 99 -1.966 -7.733 -10.155 1.00 0.00 C ATOM 1422 CG2 ILE A 99 -2.509 -6.626 -7.977 1.00 0.00 C ATOM 1423 CD1 ILE A 99 -0.878 -8.044 -11.175 1.00 0.00 C ATOM 0 H ILE A 99 -3.949 -5.916 -10.439 1.00 0.00 H new ATOM 0 HA ILE A 99 -1.795 -4.330 -9.234 1.00 0.00 H new ATOM 0 HB ILE A 99 -0.637 -6.454 -9.071 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -2.094 -8.603 -9.511 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -2.907 -7.589 -10.687 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -2.256 -7.569 -7.493 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -2.273 -5.800 -7.306 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -3.574 -6.612 -8.210 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -1.157 -8.930 -11.746 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -0.762 -7.198 -11.852 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.064 -8.227 -10.658 1.00 0.00 H new ATOM 1435 N GLU A 100 -0.148 -4.412 -11.104 1.00 0.00 N ATOM 1436 CA GLU A 100 0.706 -4.037 -12.201 1.00 0.00 C ATOM 1437 C GLU A 100 2.017 -4.784 -12.086 1.00 0.00 C ATOM 1438 O GLU A 100 2.314 -5.322 -11.015 1.00 0.00 O ATOM 1439 CB GLU A 100 0.865 -2.509 -12.331 1.00 0.00 C ATOM 1440 CG GLU A 100 -0.473 -1.808 -12.598 1.00 0.00 C ATOM 1441 CD GLU A 100 -0.348 -0.387 -13.081 1.00 0.00 C ATOM 1442 OE1 GLU A 100 -0.074 -0.196 -14.284 1.00 0.00 O ATOM 1443 OE2 GLU A 100 -0.597 0.551 -12.315 1.00 0.00 O ATOM 0 H GLU A 100 0.294 -4.281 -10.194 1.00 0.00 H new ATOM 0 HA GLU A 100 0.237 -4.332 -13.140 1.00 0.00 H new ATOM 0 HB2 GLU A 100 1.305 -2.112 -11.416 1.00 0.00 H new ATOM 0 HB3 GLU A 100 1.559 -2.285 -13.142 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -1.028 -2.383 -13.339 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -1.062 -1.816 -11.681 1.00 0.00 H new ATOM 1450 N ASP A 101 2.747 -4.879 -13.137 1.00 0.00 N ATOM 1451 CA ASP A 101 3.886 -5.722 -13.129 1.00 0.00 C ATOM 1452 C ASP A 101 5.046 -4.990 -12.503 1.00 0.00 C ATOM 1453 O ASP A 101 5.691 -4.129 -13.140 1.00 0.00 O ATOM 1454 CB ASP A 101 4.253 -6.170 -14.551 1.00 0.00 C ATOM 1455 CG ASP A 101 3.114 -6.830 -15.306 1.00 0.00 C ATOM 1456 OD1 ASP A 101 2.359 -6.117 -16.011 1.00 0.00 O ATOM 1457 OD2 ASP A 101 2.967 -8.063 -15.250 1.00 0.00 O ATOM 0 H ASP A 101 2.577 -4.384 -14.013 1.00 0.00 H new ATOM 0 HA ASP A 101 3.655 -6.613 -12.545 1.00 0.00 H new ATOM 0 HB2 ASP A 101 4.595 -5.303 -15.116 1.00 0.00 H new ATOM 0 HB3 ASP A 101 5.090 -6.866 -14.496 1.00 0.00 H new ATOM 1462 N SER A 102 5.271 -5.289 -11.267 1.00 0.00 N ATOM 1463 CA SER A 102 6.400 -4.812 -10.555 1.00 0.00 C ATOM 1464 C SER A 102 7.437 -5.913 -10.654 1.00 0.00 C ATOM 1465 O SER A 102 7.085 -7.037 -11.028 1.00 0.00 O ATOM 1466 CB SER A 102 6.009 -4.525 -9.098 1.00 0.00 C ATOM 1467 OG SER A 102 4.902 -3.637 -9.001 1.00 0.00 O ATOM 0 H SER A 102 4.657 -5.887 -10.714 1.00 0.00 H new ATOM 0 HA SER A 102 6.791 -3.879 -10.961 1.00 0.00 H new ATOM 0 HB2 SER A 102 5.765 -5.462 -8.598 1.00 0.00 H new ATOM 0 HB3 SER A 102 6.863 -4.097 -8.573 1.00 0.00 H new ATOM 0 HG SER A 102 4.910 -3.199 -8.124 1.00 0.00 H new ATOM 1473 N VAL A 103 8.690 -5.629 -10.403 1.00 0.00 N ATOM 1474 CA VAL A 103 9.685 -6.682 -10.531 1.00 0.00 C ATOM 1475 C VAL A 103 10.161 -7.271 -9.193 1.00 0.00 C ATOM 1476 O VAL A 103 9.916 -8.452 -8.907 1.00 0.00 O ATOM 1477 CB VAL A 103 10.908 -6.275 -11.432 1.00 0.00 C ATOM 1478 CG1 VAL A 103 10.502 -6.234 -12.894 1.00 0.00 C ATOM 1479 CG2 VAL A 103 11.488 -4.912 -11.027 1.00 0.00 C ATOM 0 H VAL A 103 9.044 -4.716 -10.119 1.00 0.00 H new ATOM 0 HA VAL A 103 9.148 -7.480 -11.044 1.00 0.00 H new ATOM 0 HB VAL A 103 11.679 -7.032 -11.286 1.00 0.00 H new ATOM 0 HG11 VAL A 103 11.361 -5.951 -13.502 1.00 0.00 H new ATOM 0 HG12 VAL A 103 10.149 -7.218 -13.201 1.00 0.00 H new ATOM 0 HG13 VAL A 103 9.704 -5.504 -13.030 1.00 0.00 H new ATOM 0 HG21 VAL A 103 12.331 -4.668 -11.674 1.00 0.00 H new ATOM 0 HG22 VAL A 103 10.720 -4.145 -11.128 1.00 0.00 H new ATOM 0 HG23 VAL A 103 11.826 -4.953 -9.991 1.00 0.00 H new ATOM 1489 N ILE A 104 10.814 -6.452 -8.378 1.00 0.00 N ATOM 1490 CA ILE A 104 11.433 -6.899 -7.133 1.00 0.00 C ATOM 1491 C ILE A 104 11.055 -5.909 -6.004 1.00 0.00 C ATOM 1492 O ILE A 104 11.777 -5.733 -5.025 1.00 0.00 O ATOM 1493 CB ILE A 104 13.006 -7.012 -7.290 1.00 0.00 C ATOM 1494 CG1 ILE A 104 13.369 -7.785 -8.580 1.00 0.00 C ATOM 1495 CG2 ILE A 104 13.616 -7.753 -6.092 1.00 0.00 C ATOM 1496 CD1 ILE A 104 14.857 -7.890 -8.856 1.00 0.00 C ATOM 0 H ILE A 104 10.930 -5.455 -8.561 1.00 0.00 H new ATOM 0 HA ILE A 104 11.064 -7.893 -6.880 1.00 0.00 H new ATOM 0 HB ILE A 104 13.407 -6.000 -7.341 1.00 0.00 H new ATOM 0 HG12 ILE A 104 12.953 -8.790 -8.515 1.00 0.00 H new ATOM 0 HG13 ILE A 104 12.889 -7.296 -9.428 1.00 0.00 H new ATOM 0 HG21 ILE A 104 14.697 -7.821 -6.218 1.00 0.00 H new ATOM 0 HG22 ILE A 104 13.391 -7.209 -5.175 1.00 0.00 H new ATOM 0 HG23 ILE A 104 13.194 -8.756 -6.032 1.00 0.00 H new ATOM 0 HD11 ILE A 104 15.017 -8.447 -9.779 1.00 0.00 H new ATOM 0 HD12 ILE A 104 15.280 -6.890 -8.958 1.00 0.00 H new ATOM 0 HD13 ILE A 104 15.345 -8.408 -8.030 1.00 0.00 H new ATOM 1508 N SER A 105 9.947 -5.241 -6.159 1.00 0.00 N ATOM 1509 CA SER A 105 9.575 -4.247 -5.222 1.00 0.00 C ATOM 1510 C SER A 105 8.983 -4.895 -3.968 1.00 0.00 C ATOM 1511 O SER A 105 7.802 -5.158 -3.875 1.00 0.00 O ATOM 1512 CB SER A 105 8.605 -3.249 -5.886 1.00 0.00 C ATOM 1513 OG SER A 105 8.334 -2.127 -5.074 1.00 0.00 O ATOM 0 H SER A 105 9.292 -5.375 -6.930 1.00 0.00 H new ATOM 0 HA SER A 105 10.455 -3.688 -4.903 1.00 0.00 H new ATOM 0 HB2 SER A 105 9.028 -2.913 -6.833 1.00 0.00 H new ATOM 0 HB3 SER A 105 7.670 -3.758 -6.118 1.00 0.00 H new ATOM 0 HG SER A 105 8.755 -1.332 -5.463 1.00 0.00 H new ATOM 1519 N LEU A 106 9.854 -5.226 -3.059 1.00 0.00 N ATOM 1520 CA LEU A 106 9.491 -5.699 -1.784 1.00 0.00 C ATOM 1521 C LEU A 106 8.921 -4.533 -1.054 1.00 0.00 C ATOM 1522 O LEU A 106 9.598 -3.503 -0.917 1.00 0.00 O ATOM 1523 CB LEU A 106 10.736 -6.166 -1.026 1.00 0.00 C ATOM 1524 CG LEU A 106 10.489 -6.790 0.346 1.00 0.00 C ATOM 1525 CD1 LEU A 106 10.014 -8.219 0.214 1.00 0.00 C ATOM 1526 CD2 LEU A 106 11.721 -6.698 1.218 1.00 0.00 C ATOM 0 H LEU A 106 10.862 -5.167 -3.203 1.00 0.00 H new ATOM 0 HA LEU A 106 8.789 -6.529 -1.865 1.00 0.00 H new ATOM 0 HB2 LEU A 106 11.262 -6.893 -1.644 1.00 0.00 H new ATOM 0 HB3 LEU A 106 11.402 -5.313 -0.900 1.00 0.00 H new ATOM 0 HG LEU A 106 9.698 -6.221 0.835 1.00 0.00 H new ATOM 0 HD11 LEU A 106 9.846 -8.640 1.205 1.00 0.00 H new ATOM 0 HD12 LEU A 106 9.083 -8.242 -0.353 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.770 -8.807 -0.306 1.00 0.00 H new ATOM 0 HD21 LEU A 106 11.515 -7.150 2.188 1.00 0.00 H new ATOM 0 HD22 LEU A 106 12.546 -7.226 0.739 1.00 0.00 H new ATOM 0 HD23 LEU A 106 11.992 -5.651 1.356 1.00 0.00 H new ATOM 1538 N SER A 107 7.702 -4.636 -0.631 1.00 0.00 N ATOM 1539 CA SER A 107 7.148 -3.592 0.137 1.00 0.00 C ATOM 1540 C SER A 107 7.750 -3.678 1.521 1.00 0.00 C ATOM 1541 O SER A 107 7.231 -4.358 2.396 1.00 0.00 O ATOM 1542 CB SER A 107 5.615 -3.728 0.193 1.00 0.00 C ATOM 1543 OG SER A 107 5.014 -2.659 0.910 1.00 0.00 O ATOM 0 H SER A 107 7.084 -5.428 -0.807 1.00 0.00 H new ATOM 0 HA SER A 107 7.371 -2.623 -0.308 1.00 0.00 H new ATOM 0 HB2 SER A 107 5.216 -3.755 -0.821 1.00 0.00 H new ATOM 0 HB3 SER A 107 5.352 -4.675 0.665 1.00 0.00 H new ATOM 0 HG SER A 107 5.703 -2.013 1.173 1.00 0.00 H new ATOM 1549 N GLY A 108 8.875 -3.050 1.695 1.00 0.00 N ATOM 1550 CA GLY A 108 9.476 -3.040 2.972 1.00 0.00 C ATOM 1551 C GLY A 108 10.958 -2.826 2.956 1.00 0.00 C ATOM 1552 O GLY A 108 11.679 -3.411 2.149 1.00 0.00 O ATOM 0 H GLY A 108 9.383 -2.545 0.968 1.00 0.00 H new ATOM 0 HA2 GLY A 108 9.014 -2.255 3.571 1.00 0.00 H new ATOM 0 HA3 GLY A 108 9.263 -3.987 3.468 1.00 0.00 H new ATOM 1556 N ASP A 109 11.403 -1.980 3.855 1.00 0.00 N ATOM 1557 CA ASP A 109 12.824 -1.740 4.082 1.00 0.00 C ATOM 1558 C ASP A 109 13.326 -2.716 5.127 1.00 0.00 C ATOM 1559 O ASP A 109 14.317 -3.414 4.922 1.00 0.00 O ATOM 1560 CB ASP A 109 13.055 -0.291 4.544 1.00 0.00 C ATOM 1561 CG ASP A 109 14.413 -0.069 5.183 1.00 0.00 C ATOM 1562 OD1 ASP A 109 14.536 -0.283 6.426 1.00 0.00 O ATOM 1563 OD2 ASP A 109 15.362 0.339 4.485 1.00 0.00 O ATOM 0 H ASP A 109 10.791 -1.431 4.458 1.00 0.00 H new ATOM 0 HA ASP A 109 13.373 -1.889 3.152 1.00 0.00 H new ATOM 0 HB2 ASP A 109 12.952 0.376 3.688 1.00 0.00 H new ATOM 0 HB3 ASP A 109 12.278 -0.017 5.257 1.00 0.00 H new ATOM 1568 N HIS A 110 12.628 -2.756 6.255 1.00 0.00 N ATOM 1569 CA HIS A 110 12.953 -3.701 7.317 1.00 0.00 C ATOM 1570 C HIS A 110 12.494 -5.091 6.902 1.00 0.00 C ATOM 1571 O HIS A 110 13.243 -6.070 6.996 1.00 0.00 O ATOM 1572 CB HIS A 110 12.283 -3.288 8.639 1.00 0.00 C ATOM 1573 CG HIS A 110 12.955 -2.164 9.400 1.00 0.00 C ATOM 1574 ND1 HIS A 110 13.641 -1.111 8.814 1.00 0.00 N ATOM 1575 CD2 HIS A 110 13.068 -1.970 10.733 1.00 0.00 C ATOM 1576 CE1 HIS A 110 14.139 -0.337 9.760 1.00 0.00 C ATOM 1577 NE2 HIS A 110 13.806 -0.834 10.929 1.00 0.00 N ATOM 0 H HIS A 110 11.835 -2.147 6.458 1.00 0.00 H new ATOM 0 HA HIS A 110 14.031 -3.704 7.476 1.00 0.00 H new ATOM 0 HB2 HIS A 110 11.256 -2.993 8.426 1.00 0.00 H new ATOM 0 HB3 HIS A 110 12.235 -4.162 9.288 1.00 0.00 H new ATOM 0 HD1 HIS A 110 13.744 -0.959 7.811 1.00 0.00 H new ATOM 0 HD2 HIS A 110 12.651 -2.599 11.505 1.00 0.00 H new ATOM 0 HE1 HIS A 110 14.723 0.557 9.599 1.00 0.00 H new ATOM 1586 N SER A 111 11.273 -5.141 6.434 1.00 0.00 N ATOM 1587 CA SER A 111 10.640 -6.311 5.875 1.00 0.00 C ATOM 1588 C SER A 111 9.264 -5.833 5.513 1.00 0.00 C ATOM 1589 O SER A 111 9.036 -4.629 5.573 1.00 0.00 O ATOM 1590 CB SER A 111 10.568 -7.477 6.895 1.00 0.00 C ATOM 1591 OG SER A 111 9.980 -8.649 6.315 1.00 0.00 O ATOM 0 H SER A 111 10.661 -4.325 6.432 1.00 0.00 H new ATOM 0 HA SER A 111 11.194 -6.710 5.025 1.00 0.00 H new ATOM 0 HB2 SER A 111 11.571 -7.711 7.253 1.00 0.00 H new ATOM 0 HB3 SER A 111 9.985 -7.167 7.762 1.00 0.00 H new ATOM 0 HG SER A 111 9.951 -9.365 6.983 1.00 0.00 H new ATOM 1597 N ILE A 112 8.369 -6.717 5.147 1.00 0.00 N ATOM 1598 CA ILE A 112 7.009 -6.323 4.836 1.00 0.00 C ATOM 1599 C ILE A 112 6.191 -6.382 6.132 1.00 0.00 C ATOM 1600 O ILE A 112 5.183 -5.701 6.297 1.00 0.00 O ATOM 1601 CB ILE A 112 6.349 -7.276 3.799 1.00 0.00 C ATOM 1602 CG1 ILE A 112 7.329 -7.630 2.682 1.00 0.00 C ATOM 1603 CG2 ILE A 112 5.132 -6.591 3.185 1.00 0.00 C ATOM 1604 CD1 ILE A 112 6.757 -8.592 1.667 1.00 0.00 C ATOM 0 H ILE A 112 8.554 -7.716 5.056 1.00 0.00 H new ATOM 0 HA ILE A 112 7.030 -5.320 4.409 1.00 0.00 H new ATOM 0 HB ILE A 112 6.054 -8.190 4.313 1.00 0.00 H new ATOM 0 HG12 ILE A 112 7.635 -6.716 2.173 1.00 0.00 H new ATOM 0 HG13 ILE A 112 8.226 -8.067 3.120 1.00 0.00 H new ATOM 0 HG21 ILE A 112 4.668 -7.257 2.458 1.00 0.00 H new ATOM 0 HG22 ILE A 112 4.414 -6.353 3.970 1.00 0.00 H new ATOM 0 HG23 ILE A 112 5.444 -5.672 2.688 1.00 0.00 H new ATOM 0 HD11 ILE A 112 7.505 -8.801 0.902 1.00 0.00 H new ATOM 0 HD12 ILE A 112 6.477 -9.521 2.164 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.876 -8.149 1.202 1.00 0.00 H new ATOM 1616 N ILE A 113 6.662 -7.188 7.059 1.00 0.00 N ATOM 1617 CA ILE A 113 5.977 -7.389 8.323 1.00 0.00 C ATOM 1618 C ILE A 113 6.037 -6.127 9.183 1.00 0.00 C ATOM 1619 O ILE A 113 7.067 -5.442 9.252 1.00 0.00 O ATOM 1620 CB ILE A 113 6.527 -8.630 9.116 1.00 0.00 C ATOM 1621 CG1 ILE A 113 5.777 -8.809 10.458 1.00 0.00 C ATOM 1622 CG2 ILE A 113 8.037 -8.535 9.336 1.00 0.00 C ATOM 1623 CD1 ILE A 113 6.215 -10.018 11.266 1.00 0.00 C ATOM 0 H ILE A 113 7.526 -7.721 6.961 1.00 0.00 H new ATOM 0 HA ILE A 113 4.935 -7.601 8.085 1.00 0.00 H new ATOM 0 HB ILE A 113 6.343 -9.515 8.507 1.00 0.00 H new ATOM 0 HG12 ILE A 113 5.919 -7.913 11.062 1.00 0.00 H new ATOM 0 HG13 ILE A 113 4.709 -8.890 10.255 1.00 0.00 H new ATOM 0 HG21 ILE A 113 8.380 -9.410 9.887 1.00 0.00 H new ATOM 0 HG22 ILE A 113 8.543 -8.492 8.372 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.266 -7.635 9.906 1.00 0.00 H new ATOM 0 HD11 ILE A 113 5.638 -10.067 12.190 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.046 -10.925 10.685 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.275 -9.932 11.504 1.00 0.00 H new ATOM 1635 N GLY A 114 4.898 -5.752 9.714 1.00 0.00 N ATOM 1636 CA GLY A 114 4.827 -4.661 10.619 1.00 0.00 C ATOM 1637 C GLY A 114 4.669 -3.357 9.916 1.00 0.00 C ATOM 1638 O GLY A 114 4.409 -2.361 10.533 1.00 0.00 O ATOM 0 H GLY A 114 4.003 -6.202 9.523 1.00 0.00 H new ATOM 0 HA2 GLY A 114 3.988 -4.809 11.299 1.00 0.00 H new ATOM 0 HA3 GLY A 114 5.731 -4.637 11.228 1.00 0.00 H new ATOM 1642 N ARG A 115 4.803 -3.363 8.612 1.00 0.00 N ATOM 1643 CA ARG A 115 4.757 -2.135 7.866 1.00 0.00 C ATOM 1644 C ARG A 115 3.327 -1.747 7.655 1.00 0.00 C ATOM 1645 O ARG A 115 2.535 -2.535 7.158 1.00 0.00 O ATOM 1646 CB ARG A 115 5.439 -2.275 6.510 1.00 0.00 C ATOM 1647 CG ARG A 115 6.825 -2.916 6.510 1.00 0.00 C ATOM 1648 CD ARG A 115 7.866 -2.215 7.384 1.00 0.00 C ATOM 1649 NE ARG A 115 7.702 -2.470 8.831 1.00 0.00 N ATOM 1650 CZ ARG A 115 8.392 -1.863 9.815 1.00 0.00 C ATOM 1651 NH1 ARG A 115 9.334 -0.965 9.520 1.00 0.00 N ATOM 1652 NH2 ARG A 115 8.149 -2.158 11.090 1.00 0.00 N ATOM 0 H ARG A 115 4.944 -4.202 8.050 1.00 0.00 H new ATOM 0 HA ARG A 115 5.287 -1.371 8.435 1.00 0.00 H new ATOM 0 HB2 ARG A 115 4.791 -2.863 5.861 1.00 0.00 H new ATOM 0 HB3 ARG A 115 5.521 -1.283 6.065 1.00 0.00 H new ATOM 0 HG2 ARG A 115 6.730 -3.949 6.844 1.00 0.00 H new ATOM 0 HG3 ARG A 115 7.195 -2.945 5.485 1.00 0.00 H new ATOM 0 HD2 ARG A 115 8.861 -2.539 7.078 1.00 0.00 H new ATOM 0 HD3 ARG A 115 7.812 -1.141 7.206 1.00 0.00 H new ATOM 0 HE ARG A 115 7.008 -3.164 9.107 1.00 0.00 H new ATOM 0 HH11 ARG A 115 9.533 -0.736 8.546 1.00 0.00 H new ATOM 0 HH12 ARG A 115 9.855 -0.507 10.268 1.00 0.00 H new ATOM 0 HH21 ARG A 115 7.436 -2.848 11.327 1.00 0.00 H new ATOM 0 HH22 ARG A 115 8.676 -1.694 11.830 1.00 0.00 H new ATOM 1666 N THR A 116 2.977 -0.583 8.065 1.00 0.00 N ATOM 1667 CA THR A 116 1.678 -0.132 7.866 1.00 0.00 C ATOM 1668 C THR A 116 1.582 0.575 6.534 1.00 0.00 C ATOM 1669 O THR A 116 2.029 1.730 6.385 1.00 0.00 O ATOM 1670 CB THR A 116 1.256 0.798 9.019 1.00 0.00 C ATOM 1671 OG1 THR A 116 2.262 1.808 9.210 1.00 0.00 O ATOM 1672 CG2 THR A 116 1.096 0.012 10.308 1.00 0.00 C ATOM 0 H THR A 116 3.593 0.072 8.546 1.00 0.00 H new ATOM 0 HA THR A 116 0.997 -0.983 7.854 1.00 0.00 H new ATOM 0 HB THR A 116 0.302 1.259 8.763 1.00 0.00 H new ATOM 0 HG1 THR A 116 2.552 2.149 8.338 1.00 0.00 H new ATOM 0 HG21 THR A 116 0.798 0.686 11.111 1.00 0.00 H new ATOM 0 HG22 THR A 116 0.332 -0.754 10.175 1.00 0.00 H new ATOM 0 HG23 THR A 116 2.043 -0.462 10.565 1.00 0.00 H new ATOM 1680 N LEU A 117 1.052 -0.123 5.570 1.00 0.00 N ATOM 1681 CA LEU A 117 0.787 0.454 4.294 1.00 0.00 C ATOM 1682 C LEU A 117 -0.537 1.079 4.459 1.00 0.00 C ATOM 1683 O LEU A 117 -1.491 0.408 4.836 1.00 0.00 O ATOM 1684 CB LEU A 117 0.752 -0.598 3.161 1.00 0.00 C ATOM 1685 CG LEU A 117 2.096 -1.152 2.616 1.00 0.00 C ATOM 1686 CD1 LEU A 117 2.982 -1.727 3.710 1.00 0.00 C ATOM 1687 CD2 LEU A 117 1.816 -2.222 1.578 1.00 0.00 C ATOM 0 H LEU A 117 0.794 -1.106 5.652 1.00 0.00 H new ATOM 0 HA LEU A 117 1.568 1.156 4.002 1.00 0.00 H new ATOM 0 HB2 LEU A 117 0.164 -1.445 3.515 1.00 0.00 H new ATOM 0 HB3 LEU A 117 0.210 -0.162 2.322 1.00 0.00 H new ATOM 0 HG LEU A 117 2.635 -0.315 2.171 1.00 0.00 H new ATOM 0 HD11 LEU A 117 3.907 -2.099 3.271 1.00 0.00 H new ATOM 0 HD12 LEU A 117 3.213 -0.949 4.438 1.00 0.00 H new ATOM 0 HD13 LEU A 117 2.461 -2.546 4.207 1.00 0.00 H new ATOM 0 HD21 LEU A 117 2.759 -2.612 1.194 1.00 0.00 H new ATOM 0 HD22 LEU A 117 1.247 -3.032 2.035 1.00 0.00 H new ATOM 0 HD23 LEU A 117 1.241 -1.792 0.758 1.00 0.00 H new ATOM 1699 N VAL A 118 -0.619 2.346 4.266 1.00 0.00 N ATOM 1700 CA VAL A 118 -1.854 2.963 4.586 1.00 0.00 C ATOM 1701 C VAL A 118 -2.764 3.030 3.387 1.00 0.00 C ATOM 1702 O VAL A 118 -2.517 3.761 2.415 1.00 0.00 O ATOM 1703 CB VAL A 118 -1.718 4.295 5.272 1.00 0.00 C ATOM 1704 CG1 VAL A 118 -3.012 4.561 5.996 1.00 0.00 C ATOM 1705 CG2 VAL A 118 -0.545 4.286 6.247 1.00 0.00 C ATOM 0 H VAL A 118 0.117 2.953 3.905 1.00 0.00 H new ATOM 0 HA VAL A 118 -2.323 2.315 5.327 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.520 5.080 4.543 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -2.952 5.522 6.508 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -3.832 4.583 5.279 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -3.189 3.771 6.726 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -0.467 5.260 6.731 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -0.706 3.517 7.003 1.00 0.00 H new ATOM 0 HG23 VAL A 118 0.377 4.075 5.705 1.00 0.00 H new ATOM 1715 N VAL A 119 -3.834 2.323 3.546 1.00 0.00 N ATOM 1716 CA VAL A 119 -4.775 1.934 2.554 1.00 0.00 C ATOM 1717 C VAL A 119 -6.169 2.365 2.946 1.00 0.00 C ATOM 1718 O VAL A 119 -6.596 2.136 4.044 1.00 0.00 O ATOM 1719 CB VAL A 119 -4.800 0.368 2.436 1.00 0.00 C ATOM 1720 CG1 VAL A 119 -5.705 -0.101 1.324 1.00 0.00 C ATOM 1721 CG2 VAL A 119 -3.414 -0.241 2.290 1.00 0.00 C ATOM 0 H VAL A 119 -4.094 1.970 4.467 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.480 2.401 1.614 1.00 0.00 H new ATOM 0 HB VAL A 119 -5.208 0.012 3.382 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -5.692 -1.190 1.279 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.722 0.242 1.514 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -5.356 0.306 0.375 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -3.499 -1.325 2.213 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.938 0.150 1.391 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -2.811 0.015 3.161 1.00 0.00 H new ATOM 1731 N HIS A 120 -6.837 3.016 2.047 1.00 0.00 N ATOM 1732 CA HIS A 120 -8.240 3.320 2.164 1.00 0.00 C ATOM 1733 C HIS A 120 -8.662 3.590 0.763 1.00 0.00 C ATOM 1734 O HIS A 120 -7.829 4.043 -0.013 1.00 0.00 O ATOM 1735 CB HIS A 120 -8.486 4.565 3.052 1.00 0.00 C ATOM 1736 CG HIS A 120 -9.948 4.863 3.358 1.00 0.00 C ATOM 1737 ND1 HIS A 120 -10.520 4.651 4.590 1.00 0.00 N ATOM 1738 CD2 HIS A 120 -10.945 5.330 2.572 1.00 0.00 C ATOM 1739 CE1 HIS A 120 -11.801 4.956 4.530 1.00 0.00 C ATOM 1740 NE2 HIS A 120 -12.084 5.366 3.319 1.00 0.00 N ATOM 0 H HIS A 120 -6.416 3.363 1.185 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.797 2.510 2.635 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -7.954 4.431 3.994 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.049 5.434 2.560 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -10.031 4.312 5.418 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -10.854 5.622 1.536 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -12.503 4.880 5.347 1.00 0.00 H new ATOM 1749 N GLU A 121 -9.876 3.282 0.422 1.00 0.00 N ATOM 1750 CA GLU A 121 -10.404 3.531 -0.890 1.00 0.00 C ATOM 1751 C GLU A 121 -10.559 5.050 -1.112 1.00 0.00 C ATOM 1752 O GLU A 121 -11.570 5.665 -0.823 1.00 0.00 O ATOM 1753 CB GLU A 121 -11.721 2.724 -1.112 1.00 0.00 C ATOM 1754 CG GLU A 121 -12.915 3.007 -0.150 1.00 0.00 C ATOM 1755 CD GLU A 121 -12.660 2.715 1.325 1.00 0.00 C ATOM 1756 OE1 GLU A 121 -11.741 1.944 1.646 1.00 0.00 O ATOM 1757 OE2 GLU A 121 -13.345 3.317 2.189 1.00 0.00 O ATOM 0 H GLU A 121 -10.542 2.842 1.057 1.00 0.00 H new ATOM 0 HA GLU A 121 -9.707 3.176 -1.649 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -12.060 2.909 -2.131 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -11.480 1.663 -1.044 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -13.198 4.055 -0.250 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -13.769 2.414 -0.476 1.00 0.00 H new ATOM 1764 N LYS A 122 -9.483 5.613 -1.592 1.00 0.00 N ATOM 1765 CA LYS A 122 -9.273 7.019 -1.747 1.00 0.00 C ATOM 1766 C LYS A 122 -8.013 7.122 -2.572 1.00 0.00 C ATOM 1767 O LYS A 122 -7.181 6.204 -2.511 1.00 0.00 O ATOM 1768 CB LYS A 122 -8.993 7.610 -0.341 1.00 0.00 C ATOM 1769 CG LYS A 122 -8.723 9.108 -0.275 1.00 0.00 C ATOM 1770 CD LYS A 122 -9.978 9.923 -0.499 1.00 0.00 C ATOM 1771 CE LYS A 122 -9.680 11.407 -0.374 1.00 0.00 C ATOM 1772 NZ LYS A 122 -10.906 12.225 -0.423 1.00 0.00 N ATOM 0 H LYS A 122 -8.682 5.063 -1.903 1.00 0.00 H new ATOM 0 HA LYS A 122 -10.117 7.538 -2.202 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -9.848 7.389 0.298 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -8.134 7.089 0.083 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -8.298 9.357 0.698 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -7.979 9.375 -1.025 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -10.385 9.710 -1.488 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.739 9.637 0.227 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -9.157 11.594 0.564 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -9.010 11.711 -1.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -10.656 13.231 -0.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -11.392 12.068 -1.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -11.535 11.954 0.359 1.00 0.00 H new ATOM 1786 N ALA A 123 -7.867 8.159 -3.341 1.00 0.00 N ATOM 1787 CA ALA A 123 -6.663 8.346 -4.122 1.00 0.00 C ATOM 1788 C ALA A 123 -5.468 8.510 -3.206 1.00 0.00 C ATOM 1789 O ALA A 123 -5.424 9.432 -2.376 1.00 0.00 O ATOM 1790 CB ALA A 123 -6.783 9.559 -5.014 1.00 0.00 C ATOM 0 H ALA A 123 -8.564 8.895 -3.450 1.00 0.00 H new ATOM 0 HA ALA A 123 -6.525 7.464 -4.747 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -5.866 9.679 -5.591 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -7.625 9.429 -5.694 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -6.945 10.446 -4.402 1.00 0.00 H new ATOM 1796 N ASP A 124 -4.524 7.610 -3.316 1.00 0.00 N ATOM 1797 CA ASP A 124 -3.340 7.724 -2.527 1.00 0.00 C ATOM 1798 C ASP A 124 -2.313 8.392 -3.405 1.00 0.00 C ATOM 1799 O ASP A 124 -2.182 9.571 -3.366 1.00 0.00 O ATOM 1800 CB ASP A 124 -2.843 6.343 -1.980 1.00 0.00 C ATOM 1801 CG ASP A 124 -1.676 6.475 -1.009 1.00 0.00 C ATOM 1802 OD1 ASP A 124 -0.899 7.308 -1.067 1.00 0.00 O ATOM 1803 OD2 ASP A 124 -1.521 5.806 -0.011 1.00 0.00 O ATOM 0 H ASP A 124 -4.557 6.802 -3.938 1.00 0.00 H new ATOM 0 HA ASP A 124 -3.533 8.315 -1.631 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -3.669 5.837 -1.480 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -2.543 5.713 -2.817 1.00 0.00 H new ATOM 1808 N ASP A 125 -1.714 7.587 -4.244 1.00 0.00 N ATOM 1809 CA ASP A 125 -0.740 7.924 -5.297 1.00 0.00 C ATOM 1810 C ASP A 125 0.644 8.212 -4.732 1.00 0.00 C ATOM 1811 O ASP A 125 0.811 8.463 -3.535 1.00 0.00 O ATOM 1812 CB ASP A 125 -1.220 9.036 -6.245 1.00 0.00 C ATOM 1813 CG ASP A 125 -0.560 8.954 -7.613 1.00 0.00 C ATOM 1814 OD1 ASP A 125 0.621 9.374 -7.776 1.00 0.00 O ATOM 1815 OD2 ASP A 125 -1.215 8.442 -8.554 1.00 0.00 O ATOM 0 H ASP A 125 -1.900 6.584 -4.221 1.00 0.00 H new ATOM 0 HA ASP A 125 -0.656 7.028 -5.912 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -2.302 8.969 -6.361 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -1.007 10.007 -5.799 1.00 0.00 H new ATOM 1820 N LEU A 126 1.630 7.956 -5.544 1.00 0.00 N ATOM 1821 CA LEU A 126 3.010 8.148 -5.176 1.00 0.00 C ATOM 1822 C LEU A 126 3.576 9.493 -5.608 1.00 0.00 C ATOM 1823 O LEU A 126 3.976 10.333 -4.793 1.00 0.00 O ATOM 1824 CB LEU A 126 3.883 7.038 -5.738 1.00 0.00 C ATOM 1825 CG LEU A 126 3.451 5.587 -5.491 1.00 0.00 C ATOM 1826 CD1 LEU A 126 2.962 5.354 -4.074 1.00 0.00 C ATOM 1827 CD2 LEU A 126 2.444 5.103 -6.527 1.00 0.00 C ATOM 0 H LEU A 126 1.500 7.604 -6.492 1.00 0.00 H new ATOM 0 HA LEU A 126 3.024 8.124 -4.086 1.00 0.00 H new ATOM 0 HB2 LEU A 126 3.958 7.185 -6.815 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.886 7.162 -5.329 1.00 0.00 H new ATOM 0 HG LEU A 126 4.348 4.980 -5.610 1.00 0.00 H new ATOM 0 HD11 LEU A 126 2.670 4.310 -3.957 1.00 0.00 H new ATOM 0 HD12 LEU A 126 3.761 5.588 -3.370 1.00 0.00 H new ATOM 0 HD13 LEU A 126 2.104 5.996 -3.875 1.00 0.00 H new ATOM 0 HD21 LEU A 126 2.168 4.071 -6.311 1.00 0.00 H new ATOM 0 HD22 LEU A 126 1.554 5.732 -6.491 1.00 0.00 H new ATOM 0 HD23 LEU A 126 2.889 5.159 -7.521 1.00 0.00 H new ATOM 1839 N GLY A 127 3.623 9.665 -6.924 1.00 0.00 N ATOM 1840 CA GLY A 127 4.309 10.782 -7.529 1.00 0.00 C ATOM 1841 C GLY A 127 3.506 12.026 -7.525 1.00 0.00 C ATOM 1842 O GLY A 127 4.048 13.124 -7.701 1.00 0.00 O ATOM 0 H GLY A 127 3.185 9.032 -7.593 1.00 0.00 H new ATOM 0 HA2 GLY A 127 5.244 10.958 -6.997 1.00 0.00 H new ATOM 0 HA3 GLY A 127 4.570 10.528 -8.556 1.00 0.00 H new ATOM 1846 N LYS A 128 2.224 11.869 -7.324 1.00 0.00 N ATOM 1847 CA LYS A 128 1.323 12.982 -7.276 1.00 0.00 C ATOM 1848 C LYS A 128 1.664 13.830 -6.048 1.00 0.00 C ATOM 1849 O LYS A 128 1.679 15.073 -6.111 1.00 0.00 O ATOM 1850 CB LYS A 128 -0.104 12.449 -7.190 1.00 0.00 C ATOM 1851 CG LYS A 128 -1.210 13.451 -7.454 1.00 0.00 C ATOM 1852 CD LYS A 128 -2.567 12.775 -7.294 1.00 0.00 C ATOM 1853 CE LYS A 128 -3.713 13.666 -7.731 1.00 0.00 C ATOM 1854 NZ LYS A 128 -3.731 13.865 -9.193 1.00 0.00 N ATOM 0 H LYS A 128 1.778 10.962 -7.189 1.00 0.00 H new ATOM 0 HA LYS A 128 1.414 13.601 -8.169 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -0.207 11.630 -7.902 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -0.253 12.028 -6.196 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -1.127 14.289 -6.762 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -1.112 13.858 -8.461 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -2.583 11.855 -7.879 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -2.708 12.492 -6.251 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -4.657 13.224 -7.413 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -3.631 14.633 -7.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -4.625 14.319 -9.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -2.933 14.472 -9.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -3.648 12.944 -9.670 1.00 0.00 H new ATOM 1868 N GLY A 129 1.956 13.169 -4.944 1.00 0.00 N ATOM 1869 CA GLY A 129 2.298 13.822 -3.743 1.00 0.00 C ATOM 1870 C GLY A 129 3.692 14.393 -3.698 1.00 0.00 C ATOM 1871 O GLY A 129 4.526 13.922 -2.929 1.00 0.00 O ATOM 0 H GLY A 129 1.956 12.151 -4.879 1.00 0.00 H new ATOM 0 HA2 GLY A 129 1.586 14.629 -3.572 1.00 0.00 H new ATOM 0 HA3 GLY A 129 2.185 13.117 -2.920 1.00 0.00 H new ATOM 1875 N GLY A 130 3.940 15.434 -4.461 1.00 0.00 N ATOM 1876 CA GLY A 130 5.247 16.038 -4.432 1.00 0.00 C ATOM 1877 C GLY A 130 5.248 17.542 -4.524 1.00 0.00 C ATOM 1878 O GLY A 130 6.257 18.129 -4.897 1.00 0.00 O ATOM 0 H GLY A 130 3.270 15.870 -5.094 1.00 0.00 H new ATOM 0 HA2 GLY A 130 5.748 15.744 -3.510 1.00 0.00 H new ATOM 0 HA3 GLY A 130 5.836 15.637 -5.257 1.00 0.00 H new ATOM 1882 N ASN A 131 4.163 18.193 -4.147 1.00 0.00 N ATOM 1883 CA ASN A 131 4.162 19.714 -4.202 1.00 0.00 C ATOM 1884 C ASN A 131 3.622 20.221 -2.876 1.00 0.00 C ATOM 1885 O ASN A 131 3.236 19.374 -2.097 1.00 0.00 O ATOM 1886 CB ASN A 131 3.345 20.223 -5.399 1.00 0.00 C ATOM 1887 CG ASN A 131 3.492 21.709 -5.656 1.00 0.00 C ATOM 1888 OD1 ASN A 131 4.535 22.304 -5.372 1.00 0.00 O ATOM 1889 ND2 ASN A 131 2.459 22.313 -6.173 1.00 0.00 N ATOM 0 H ASN A 131 3.301 17.761 -3.813 1.00 0.00 H new ATOM 0 HA ASN A 131 5.173 20.095 -4.350 1.00 0.00 H new ATOM 0 HB2 ASN A 131 3.650 19.678 -6.292 1.00 0.00 H new ATOM 0 HB3 ASN A 131 2.292 19.996 -5.231 1.00 0.00 H new ATOM 0 HD21 ASN A 131 2.494 23.316 -6.358 1.00 0.00 H new ATOM 0 HD22 ASN A 131 1.616 21.783 -6.393 1.00 0.00 H new ATOM 1896 N GLU A 132 3.562 21.572 -2.578 1.00 0.00 N ATOM 1897 CA GLU A 132 3.126 21.961 -1.204 1.00 0.00 C ATOM 1898 C GLU A 132 1.769 21.329 -0.783 1.00 0.00 C ATOM 1899 O GLU A 132 1.689 20.614 0.231 1.00 0.00 O ATOM 1900 CB GLU A 132 3.161 23.480 -0.944 1.00 0.00 C ATOM 1901 CG GLU A 132 2.095 24.352 -1.611 1.00 0.00 C ATOM 1902 CD GLU A 132 2.040 24.219 -3.095 1.00 0.00 C ATOM 1903 OE1 GLU A 132 2.829 24.876 -3.790 1.00 0.00 O ATOM 1904 OE2 GLU A 132 1.185 23.459 -3.586 1.00 0.00 O ATOM 0 H GLU A 132 3.789 22.337 -3.213 1.00 0.00 H new ATOM 0 HA GLU A 132 3.884 21.528 -0.551 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.092 23.635 0.133 1.00 0.00 H new ATOM 0 HB3 GLU A 132 4.137 23.849 -1.258 1.00 0.00 H new ATOM 0 HG2 GLU A 132 1.120 24.095 -1.198 1.00 0.00 H new ATOM 0 HG3 GLU A 132 2.284 25.395 -1.357 1.00 0.00 H new ATOM 1911 N GLU A 133 0.736 21.570 -1.558 1.00 0.00 N ATOM 1912 CA GLU A 133 -0.549 20.976 -1.290 1.00 0.00 C ATOM 1913 C GLU A 133 -0.649 19.604 -1.912 1.00 0.00 C ATOM 1914 O GLU A 133 -1.236 18.694 -1.343 1.00 0.00 O ATOM 1915 CB GLU A 133 -1.690 21.869 -1.763 1.00 0.00 C ATOM 1916 CG GLU A 133 -1.823 23.159 -0.975 1.00 0.00 C ATOM 1917 CD GLU A 133 -2.016 22.902 0.501 1.00 0.00 C ATOM 1918 OE1 GLU A 133 -3.024 22.252 0.886 1.00 0.00 O ATOM 1919 OE2 GLU A 133 -1.168 23.332 1.315 1.00 0.00 O ATOM 0 H GLU A 133 0.763 22.174 -2.379 1.00 0.00 H new ATOM 0 HA GLU A 133 -0.641 20.870 -0.209 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -1.538 22.110 -2.815 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -2.626 21.314 -1.695 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -0.932 23.768 -1.124 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -2.668 23.732 -1.357 1.00 0.00 H new ATOM 1926 N SER A 134 -0.020 19.440 -3.055 1.00 0.00 N ATOM 1927 CA SER A 134 -0.108 18.210 -3.802 1.00 0.00 C ATOM 1928 C SER A 134 0.564 17.033 -3.077 1.00 0.00 C ATOM 1929 O SER A 134 0.241 15.921 -3.327 1.00 0.00 O ATOM 1930 CB SER A 134 0.512 18.407 -5.162 1.00 0.00 C ATOM 1931 OG SER A 134 0.225 19.720 -5.629 1.00 0.00 O ATOM 0 H SER A 134 0.564 20.154 -3.489 1.00 0.00 H new ATOM 0 HA SER A 134 -1.163 17.957 -3.904 1.00 0.00 H new ATOM 0 HB2 SER A 134 1.590 18.257 -5.107 1.00 0.00 H new ATOM 0 HB3 SER A 134 0.122 17.667 -5.862 1.00 0.00 H new ATOM 0 HG SER A 134 0.695 19.876 -6.475 1.00 0.00 H new ATOM 1937 N THR A 135 1.489 17.292 -2.150 1.00 0.00 N ATOM 1938 CA THR A 135 2.150 16.197 -1.424 1.00 0.00 C ATOM 1939 C THR A 135 1.253 15.698 -0.317 1.00 0.00 C ATOM 1940 O THR A 135 1.451 14.631 0.249 1.00 0.00 O ATOM 1941 CB THR A 135 3.536 16.617 -0.850 1.00 0.00 C ATOM 1942 OG1 THR A 135 4.319 15.451 -0.512 1.00 0.00 O ATOM 1943 CG2 THR A 135 3.405 17.496 0.397 1.00 0.00 C ATOM 0 H THR A 135 1.795 18.228 -1.886 1.00 0.00 H new ATOM 0 HA THR A 135 2.331 15.394 -2.138 1.00 0.00 H new ATOM 0 HB THR A 135 4.033 17.194 -1.630 1.00 0.00 H new ATOM 0 HG1 THR A 135 4.436 14.893 -1.309 1.00 0.00 H new ATOM 0 HG21 THR A 135 4.398 17.763 0.760 1.00 0.00 H new ATOM 0 HG22 THR A 135 2.854 18.403 0.147 1.00 0.00 H new ATOM 0 HG23 THR A 135 2.870 16.949 1.173 1.00 0.00 H new ATOM 1951 N LYS A 136 0.259 16.457 -0.071 1.00 0.00 N ATOM 1952 CA LYS A 136 -0.655 16.186 1.009 1.00 0.00 C ATOM 1953 C LYS A 136 -1.731 15.285 0.467 1.00 0.00 C ATOM 1954 O LYS A 136 -2.085 14.260 1.048 1.00 0.00 O ATOM 1955 CB LYS A 136 -1.264 17.505 1.485 1.00 0.00 C ATOM 1956 CG LYS A 136 -2.269 17.397 2.619 1.00 0.00 C ATOM 1957 CD LYS A 136 -3.003 18.720 2.820 1.00 0.00 C ATOM 1958 CE LYS A 136 -2.063 19.862 3.191 1.00 0.00 C ATOM 1959 NZ LYS A 136 -2.771 21.151 3.305 1.00 0.00 N ATOM 0 H LYS A 136 0.038 17.296 -0.607 1.00 0.00 H new ATOM 0 HA LYS A 136 -0.151 15.710 1.850 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -0.455 18.163 1.803 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -1.752 17.985 0.637 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -2.987 16.607 2.400 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -1.757 17.116 3.539 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -3.538 18.977 1.906 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -3.751 18.601 3.604 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -1.572 19.634 4.137 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -1.280 19.945 2.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -2.115 21.877 3.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -3.131 21.433 2.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -3.566 21.053 3.968 1.00 0.00 H new ATOM 1973 N THR A 137 -2.212 15.669 -0.666 1.00 0.00 N ATOM 1974 CA THR A 137 -3.249 14.990 -1.339 1.00 0.00 C ATOM 1975 C THR A 137 -2.729 13.857 -2.205 1.00 0.00 C ATOM 1976 O THR A 137 -3.398 12.836 -2.376 1.00 0.00 O ATOM 1977 CB THR A 137 -3.962 16.001 -2.214 1.00 0.00 C ATOM 1978 OG1 THR A 137 -2.969 16.804 -2.877 1.00 0.00 O ATOM 1979 CG2 THR A 137 -4.872 16.892 -1.386 1.00 0.00 C ATOM 0 H THR A 137 -1.877 16.495 -1.161 1.00 0.00 H new ATOM 0 HA THR A 137 -3.917 14.547 -0.601 1.00 0.00 H new ATOM 0 HB THR A 137 -4.580 15.476 -2.942 1.00 0.00 H new ATOM 0 HG1 THR A 137 -3.412 17.464 -3.450 1.00 0.00 H new ATOM 0 HG21 THR A 137 -5.371 17.608 -2.038 1.00 0.00 H new ATOM 0 HG22 THR A 137 -5.619 16.280 -0.880 1.00 0.00 H new ATOM 0 HG23 THR A 137 -4.280 17.428 -0.644 1.00 0.00 H new ATOM 1987 N GLY A 138 -1.553 14.041 -2.743 1.00 0.00 N ATOM 1988 CA GLY A 138 -0.992 13.127 -3.696 1.00 0.00 C ATOM 1989 C GLY A 138 -0.428 11.872 -3.108 1.00 0.00 C ATOM 1990 O GLY A 138 0.131 11.088 -3.827 1.00 0.00 O ATOM 0 H GLY A 138 -0.953 14.838 -2.529 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -1.763 12.858 -4.418 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -0.204 13.639 -4.248 1.00 0.00 H new ATOM 1994 N ASN A 139 -0.432 11.782 -1.811 1.00 0.00 N ATOM 1995 CA ASN A 139 -0.217 10.500 -1.115 1.00 0.00 C ATOM 1996 C ASN A 139 -1.117 10.444 0.124 1.00 0.00 C ATOM 1997 O ASN A 139 -0.846 11.099 1.117 1.00 0.00 O ATOM 1998 CB ASN A 139 1.278 10.298 -0.708 1.00 0.00 C ATOM 1999 CG ASN A 139 1.677 8.860 -0.191 1.00 0.00 C ATOM 2000 OD1 ASN A 139 0.880 8.069 0.478 1.00 0.00 O ATOM 2001 ND2 ASN A 139 2.890 8.478 -0.499 1.00 0.00 N ATOM 0 H ASN A 139 -0.581 12.576 -1.189 1.00 0.00 H new ATOM 0 HA ASN A 139 -0.474 9.692 -1.800 1.00 0.00 H new ATOM 0 HB2 ASN A 139 1.902 10.537 -1.569 1.00 0.00 H new ATOM 0 HB3 ASN A 139 1.521 11.021 0.071 1.00 0.00 H new ATOM 0 HD21 ASN A 139 3.221 7.556 -0.217 1.00 0.00 H new ATOM 0 HD22 ASN A 139 3.504 9.103 -1.021 1.00 0.00 H new ATOM 2008 N ALA A 140 -2.204 9.666 0.042 1.00 0.00 N ATOM 2009 CA ALA A 140 -3.094 9.420 1.204 1.00 0.00 C ATOM 2010 C ALA A 140 -2.350 8.561 2.192 1.00 0.00 C ATOM 2011 O ALA A 140 -1.364 7.783 1.755 1.00 0.00 O ATOM 2012 CB ALA A 140 -4.388 8.742 0.784 1.00 0.00 C ATOM 0 H ALA A 140 -2.496 9.192 -0.813 1.00 0.00 H new ATOM 0 HA ALA A 140 -3.366 10.374 1.656 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.014 8.578 1.661 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.918 9.377 0.074 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -4.162 7.784 0.316 1.00 0.00 H new ATOM 2018 N GLY A 141 -2.766 8.543 3.417 1.00 0.00 N ATOM 2019 CA GLY A 141 -1.933 8.006 4.380 1.00 0.00 C ATOM 2020 C GLY A 141 -2.587 7.670 5.665 1.00 0.00 C ATOM 2021 O GLY A 141 -3.812 7.465 5.745 1.00 0.00 O ATOM 0 H GLY A 141 -3.666 8.893 3.746 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -1.474 7.103 3.978 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -1.127 8.713 4.575 1.00 0.00 H new ATOM 2025 N SER A 142 -1.739 7.746 6.643 1.00 0.00 N ATOM 2026 CA SER A 142 -1.782 7.283 8.016 1.00 0.00 C ATOM 2027 C SER A 142 -3.024 7.543 8.878 1.00 0.00 C ATOM 2028 O SER A 142 -2.986 7.311 10.083 1.00 0.00 O ATOM 2029 CB SER A 142 -0.571 7.876 8.648 1.00 0.00 C ATOM 2030 OG SER A 142 0.516 7.757 7.722 1.00 0.00 O ATOM 0 H SER A 142 -0.848 8.212 6.474 1.00 0.00 H new ATOM 0 HA SER A 142 -1.823 6.195 7.968 1.00 0.00 H new ATOM 0 HB2 SER A 142 -0.746 8.922 8.898 1.00 0.00 H new ATOM 0 HB3 SER A 142 -0.336 7.361 9.579 1.00 0.00 H new ATOM 0 HG SER A 142 0.959 8.626 7.624 1.00 0.00 H new ATOM 2036 N ARG A 143 -4.057 8.038 8.344 1.00 0.00 N ATOM 2037 CA ARG A 143 -5.221 8.256 9.159 1.00 0.00 C ATOM 2038 C ARG A 143 -6.435 7.589 8.568 1.00 0.00 C ATOM 2039 O ARG A 143 -7.325 7.121 9.301 1.00 0.00 O ATOM 2040 CB ARG A 143 -5.440 9.750 9.438 1.00 0.00 C ATOM 2041 CG ARG A 143 -4.265 10.374 10.181 1.00 0.00 C ATOM 2042 CD ARG A 143 -4.493 11.815 10.554 1.00 0.00 C ATOM 2043 NE ARG A 143 -3.318 12.365 11.251 1.00 0.00 N ATOM 2044 CZ ARG A 143 -3.343 13.313 12.203 1.00 0.00 C ATOM 2045 NH1 ARG A 143 -4.486 13.870 12.569 1.00 0.00 N ATOM 2046 NH2 ARG A 143 -2.212 13.711 12.765 1.00 0.00 N ATOM 0 H ARG A 143 -4.146 8.305 7.363 1.00 0.00 H new ATOM 0 HA ARG A 143 -5.048 7.785 10.127 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -5.592 10.276 8.495 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -6.349 9.879 10.025 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -4.069 9.798 11.086 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -3.372 10.304 9.559 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -4.697 12.400 9.657 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -5.372 11.895 11.194 1.00 0.00 H new ATOM 0 HE ARG A 143 -2.405 11.994 10.988 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -5.359 13.581 12.128 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -4.494 14.589 13.293 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -1.326 13.298 12.475 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -2.227 14.430 13.488 1.00 0.00 H new ATOM 2060 N LEU A 144 -6.424 7.441 7.263 1.00 0.00 N ATOM 2061 CA LEU A 144 -7.552 6.932 6.519 1.00 0.00 C ATOM 2062 C LEU A 144 -7.932 5.520 6.949 1.00 0.00 C ATOM 2063 O LEU A 144 -9.125 5.205 7.085 1.00 0.00 O ATOM 2064 CB LEU A 144 -7.318 7.020 4.999 1.00 0.00 C ATOM 2065 CG LEU A 144 -7.445 8.411 4.318 1.00 0.00 C ATOM 2066 CD1 LEU A 144 -8.837 8.993 4.511 1.00 0.00 C ATOM 2067 CD2 LEU A 144 -6.382 9.389 4.797 1.00 0.00 C ATOM 0 H LEU A 144 -5.620 7.674 6.681 1.00 0.00 H new ATOM 0 HA LEU A 144 -8.401 7.574 6.754 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -6.318 6.638 4.793 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -8.023 6.345 4.514 1.00 0.00 H new ATOM 0 HG LEU A 144 -7.282 8.253 3.252 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -8.895 9.966 4.024 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -9.576 8.323 4.072 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -9.039 9.108 5.576 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -6.514 10.346 4.292 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -6.477 9.531 5.874 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -5.393 8.992 4.569 1.00 0.00 H new ATOM 2079 N ALA A 145 -6.936 4.681 7.125 1.00 0.00 N ATOM 2080 CA ALA A 145 -7.109 3.340 7.641 1.00 0.00 C ATOM 2081 C ALA A 145 -5.770 2.742 7.906 1.00 0.00 C ATOM 2082 O ALA A 145 -5.007 2.485 6.987 1.00 0.00 O ATOM 2083 CB ALA A 145 -7.901 2.462 6.713 1.00 0.00 C ATOM 0 H ALA A 145 -5.967 4.914 6.910 1.00 0.00 H new ATOM 0 HA ALA A 145 -7.680 3.408 8.567 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -8.000 1.468 7.149 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -8.891 2.892 6.561 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -7.387 2.388 5.755 1.00 0.00 H new ATOM 2089 N CYS A 146 -5.481 2.532 9.136 1.00 0.00 N ATOM 2090 CA CYS A 146 -4.214 2.018 9.509 1.00 0.00 C ATOM 2091 C CYS A 146 -4.250 0.558 9.667 1.00 0.00 C ATOM 2092 O CYS A 146 -5.251 -0.007 10.131 1.00 0.00 O ATOM 2093 CB CYS A 146 -3.749 2.647 10.770 1.00 0.00 C ATOM 2094 SG CYS A 146 -3.392 4.405 10.579 1.00 0.00 S ATOM 0 H CYS A 146 -6.115 2.711 9.914 1.00 0.00 H new ATOM 0 HA CYS A 146 -3.515 2.257 8.707 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -4.510 2.516 11.539 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -2.853 2.134 11.118 1.00 0.00 H new ATOM 2099 N GLY A 147 -3.205 -0.058 9.221 1.00 0.00 N ATOM 2100 CA GLY A 147 -3.073 -1.432 9.375 1.00 0.00 C ATOM 2101 C GLY A 147 -1.735 -1.898 8.967 1.00 0.00 C ATOM 2102 O GLY A 147 -1.093 -1.264 8.135 1.00 0.00 O ATOM 0 H GLY A 147 -2.428 0.397 8.741 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -3.251 -1.701 10.416 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -3.833 -1.940 8.781 1.00 0.00 H new ATOM 2106 N VAL A 148 -1.286 -2.950 9.569 1.00 0.00 N ATOM 2107 CA VAL A 148 -0.098 -3.609 9.151 1.00 0.00 C ATOM 2108 C VAL A 148 -0.442 -4.382 7.906 1.00 0.00 C ATOM 2109 O VAL A 148 -1.347 -5.230 7.912 1.00 0.00 O ATOM 2110 CB VAL A 148 0.455 -4.569 10.248 1.00 0.00 C ATOM 2111 CG1 VAL A 148 1.541 -5.481 9.687 1.00 0.00 C ATOM 2112 CG2 VAL A 148 1.023 -3.769 11.411 1.00 0.00 C ATOM 0 H VAL A 148 -1.741 -3.379 10.375 1.00 0.00 H new ATOM 0 HA VAL A 148 0.685 -2.875 8.963 1.00 0.00 H new ATOM 0 HB VAL A 148 -0.374 -5.185 10.596 1.00 0.00 H new ATOM 0 HG11 VAL A 148 1.907 -6.139 10.475 1.00 0.00 H new ATOM 0 HG12 VAL A 148 1.129 -6.081 8.876 1.00 0.00 H new ATOM 0 HG13 VAL A 148 2.365 -4.876 9.308 1.00 0.00 H new ATOM 0 HG21 VAL A 148 1.406 -4.452 12.170 1.00 0.00 H new ATOM 0 HG22 VAL A 148 1.833 -3.133 11.054 1.00 0.00 H new ATOM 0 HG23 VAL A 148 0.238 -3.149 11.844 1.00 0.00 H new ATOM 2122 N ILE A 149 0.208 -4.065 6.848 1.00 0.00 N ATOM 2123 CA ILE A 149 -0.014 -4.736 5.616 1.00 0.00 C ATOM 2124 C ILE A 149 1.292 -5.365 5.271 1.00 0.00 C ATOM 2125 O ILE A 149 2.225 -4.686 4.866 1.00 0.00 O ATOM 2126 CB ILE A 149 -0.410 -3.759 4.482 1.00 0.00 C ATOM 2127 CG1 ILE A 149 -1.507 -2.764 4.929 1.00 0.00 C ATOM 2128 CG2 ILE A 149 -0.846 -4.526 3.231 1.00 0.00 C ATOM 2129 CD1 ILE A 149 -2.829 -3.372 5.339 1.00 0.00 C ATOM 0 H ILE A 149 0.913 -3.329 6.809 1.00 0.00 H new ATOM 0 HA ILE A 149 -0.830 -5.452 5.717 1.00 0.00 H new ATOM 0 HB ILE A 149 0.476 -3.173 4.237 1.00 0.00 H new ATOM 0 HG12 ILE A 149 -1.122 -2.183 5.767 1.00 0.00 H new ATOM 0 HG13 ILE A 149 -1.689 -2.065 4.113 1.00 0.00 H new ATOM 0 HG21 ILE A 149 -1.120 -3.819 2.448 1.00 0.00 H new ATOM 0 HG22 ILE A 149 -0.025 -5.153 2.884 1.00 0.00 H new ATOM 0 HG23 ILE A 149 -1.705 -5.153 3.470 1.00 0.00 H new ATOM 0 HD11 ILE A 149 -3.518 -2.580 5.632 1.00 0.00 H new ATOM 0 HD12 ILE A 149 -3.249 -3.928 4.501 1.00 0.00 H new ATOM 0 HD13 ILE A 149 -2.674 -4.047 6.180 1.00 0.00 H new ATOM 2141 N GLY A 150 1.393 -6.617 5.495 1.00 0.00 N ATOM 2142 CA GLY A 150 2.617 -7.265 5.249 1.00 0.00 C ATOM 2143 C GLY A 150 2.527 -8.666 5.618 1.00 0.00 C ATOM 2144 O GLY A 150 1.449 -9.126 5.938 1.00 0.00 O ATOM 0 H GLY A 150 0.644 -7.213 5.848 1.00 0.00 H new ATOM 0 HA2 GLY A 150 2.878 -7.175 4.195 1.00 0.00 H new ATOM 0 HA3 GLY A 150 3.413 -6.782 5.817 1.00 0.00 H new ATOM 2148 N ILE A 151 3.627 -9.375 5.591 1.00 0.00 N ATOM 2149 CA ILE A 151 3.574 -10.771 5.928 1.00 0.00 C ATOM 2150 C ILE A 151 3.320 -10.954 7.398 1.00 0.00 C ATOM 2151 O ILE A 151 4.187 -10.738 8.243 1.00 0.00 O ATOM 2152 CB ILE A 151 4.813 -11.577 5.439 1.00 0.00 C ATOM 2153 CG1 ILE A 151 4.691 -13.051 5.864 1.00 0.00 C ATOM 2154 CG2 ILE A 151 6.128 -10.956 5.914 1.00 0.00 C ATOM 2155 CD1 ILE A 151 5.749 -13.951 5.284 1.00 0.00 C ATOM 0 H ILE A 151 4.550 -9.017 5.345 1.00 0.00 H new ATOM 0 HA ILE A 151 2.730 -11.193 5.382 1.00 0.00 H new ATOM 0 HB ILE A 151 4.832 -11.536 4.350 1.00 0.00 H new ATOM 0 HG12 ILE A 151 4.737 -13.109 6.951 1.00 0.00 H new ATOM 0 HG13 ILE A 151 3.711 -13.423 5.567 1.00 0.00 H new ATOM 0 HG21 ILE A 151 6.965 -11.552 5.549 1.00 0.00 H new ATOM 0 HG22 ILE A 151 6.211 -9.940 5.528 1.00 0.00 H new ATOM 0 HG23 ILE A 151 6.147 -10.933 7.004 1.00 0.00 H new ATOM 0 HD11 ILE A 151 5.590 -14.971 5.633 1.00 0.00 H new ATOM 0 HD12 ILE A 151 5.691 -13.927 4.196 1.00 0.00 H new ATOM 0 HD13 ILE A 151 6.733 -13.608 5.602 1.00 0.00 H new ATOM 2167 N ALA A 152 2.103 -11.295 7.679 1.00 0.00 N ATOM 2168 CA ALA A 152 1.673 -11.495 9.041 1.00 0.00 C ATOM 2169 C ALA A 152 0.562 -12.512 9.120 1.00 0.00 C ATOM 2170 O ALA A 152 -0.521 -12.289 8.589 1.00 0.00 O ATOM 2171 CB ALA A 152 1.231 -10.174 9.655 1.00 0.00 C ATOM 0 H ALA A 152 1.376 -11.444 6.980 1.00 0.00 H new ATOM 0 HA ALA A 152 2.520 -11.881 9.609 1.00 0.00 H new ATOM 0 HB1 ALA A 152 0.909 -10.340 10.683 1.00 0.00 H new ATOM 0 HB2 ALA A 152 2.064 -9.471 9.645 1.00 0.00 H new ATOM 0 HB3 ALA A 152 0.403 -9.763 9.077 1.00 0.00 H new ATOM 2177 N GLN A 153 0.819 -13.613 9.753 1.00 0.00 N ATOM 2178 CA GLN A 153 -0.194 -14.611 9.965 1.00 0.00 C ATOM 2179 C GLN A 153 -0.276 -14.936 11.444 1.00 0.00 C ATOM 2180 O GLN A 153 -1.297 -14.626 12.088 1.00 0.00 O ATOM 2181 CB GLN A 153 0.010 -15.867 9.078 1.00 0.00 C ATOM 2182 CG GLN A 153 1.382 -16.523 9.160 1.00 0.00 C ATOM 2183 CD GLN A 153 1.468 -17.787 8.330 1.00 0.00 C ATOM 2184 OE1 GLN A 153 1.823 -17.754 7.154 1.00 0.00 O ATOM 2185 NE2 GLN A 153 1.150 -18.898 8.926 1.00 0.00 N ATOM 2186 OXT GLN A 153 0.733 -15.383 12.013 1.00 0.00 O ATOM 0 H GLN A 153 1.733 -13.850 10.139 1.00 0.00 H new ATOM 0 HA GLN A 153 -1.156 -14.205 9.650 1.00 0.00 H new ATOM 0 HB2 GLN A 153 -0.742 -16.607 9.351 1.00 0.00 H new ATOM 0 HB3 GLN A 153 -0.178 -15.590 8.041 1.00 0.00 H new ATOM 0 HG2 GLN A 153 2.140 -15.817 8.821 1.00 0.00 H new ATOM 0 HG3 GLN A 153 1.608 -16.758 10.200 1.00 0.00 H new ATOM 0 HE21 GLN A 153 0.860 -18.887 9.904 1.00 0.00 H new ATOM 0 HE22 GLN A 153 1.191 -19.780 8.416 1.00 0.00 H new TER 2195 GLN A 153 HETATM 2196 CU CU A 201 -0.460 6.956 0.453 1.00 0.00 CU