USER MOD reduce.3.24.130724 H: found=0, std=0, add=919, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 919 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 25 LYS NZ :NH3+ -125:sc= 0.339 (180deg=0) USER MOD Set 1.2: A 45 THR OG1 : rot 80:sc= 1.38 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 GLN : amide:sc= -0.0463 X(o=-0.046,f=-0.39) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 18 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 20 THR OG1 : rot 180:sc= -1.06 USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.835 USER MOD Single : A 27 SER OG : rot -131:sc= 0.0142 USER MOD Single : A 35 CYS SG : rot -114:sc= 1.32 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 ASN : amide:sc= -0.63 K(o=-0.63,f=-0.0088) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0.0223 USER MOD Single : A 49 SER OG : rot -83:sc= 1.25 USER MOD Single : A 50 THR OG1 : rot -44:sc= 0.669 USER MOD Single : A 57 MET CE :methyl 170:sc= 0 (180deg=-0.179) USER MOD Single : A 59 GLN : amide:sc= -2.08 K(o=-2.1,f=-1) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 MET CE :methyl 164:sc=-0.00345 (180deg=-0.204) USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 81:sc= 0.0246 USER MOD Single : A 105 SER OG : rot -52:sc= 0.305 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= -0.0706 K(o=-0.071,f=-3!) USER MOD Single : A 115 MET CE :methyl -163:sc= 0 (180deg=-0.248) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl 162:sc= -0.148 (180deg=-0.691) USER MOD Single : A 130 ASN : amide:sc= -0.648 K(o=-0.65,f=0.29) USER MOD Single : A 131 TYR OH : rot 93:sc= 0.774 USER MOD Single : A 132 HIS : no HD1:sc= -0.51 K(o=-0.51,f=0) USER MOD Single : A 136 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 137 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 40 N ASP A 5 -21.611 12.992 -9.257 1.00 0.00 N ATOM 41 CA ASP A 5 -20.755 11.935 -8.718 1.00 0.00 C ATOM 42 C ASP A 5 -19.911 12.448 -7.557 1.00 0.00 C ATOM 43 O ASP A 5 -19.031 13.285 -7.740 1.00 0.00 O ATOM 44 CB ASP A 5 -19.854 11.364 -9.817 1.00 0.00 C ATOM 45 CG ASP A 5 -20.583 10.386 -10.720 1.00 0.00 C ATOM 46 OD1 ASP A 5 -20.864 9.255 -10.268 1.00 0.00 O ATOM 47 OD2 ASP A 5 -20.875 10.752 -11.879 1.00 0.00 O ATOM 0 HA ASP A 5 -21.400 11.140 -8.342 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -19.458 12.182 -10.419 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -19.001 10.863 -9.359 1.00 0.00 H new ATOM 52 N SER A 6 -20.189 11.936 -6.359 1.00 0.00 N ATOM 53 CA SER A 6 -19.455 12.337 -5.160 1.00 0.00 C ATOM 54 C SER A 6 -17.978 11.926 -5.237 1.00 0.00 C ATOM 55 O SER A 6 -17.098 12.729 -4.928 1.00 0.00 O ATOM 56 CB SER A 6 -20.104 11.735 -3.908 1.00 0.00 C ATOM 57 OG SER A 6 -19.784 12.494 -2.755 1.00 0.00 O ATOM 0 H SER A 6 -20.918 11.242 -6.193 1.00 0.00 H new ATOM 0 HA SER A 6 -19.498 13.424 -5.097 1.00 0.00 H new ATOM 0 HB2 SER A 6 -21.186 11.700 -4.036 1.00 0.00 H new ATOM 0 HB3 SER A 6 -19.765 10.707 -3.777 1.00 0.00 H new ATOM 0 HG SER A 6 -20.211 12.092 -1.970 1.00 0.00 H new ATOM 63 N PRO A 7 -17.681 10.668 -5.637 1.00 0.00 N ATOM 64 CA PRO A 7 -16.302 10.176 -5.733 1.00 0.00 C ATOM 65 C PRO A 7 -15.585 10.570 -7.034 1.00 0.00 C ATOM 66 O PRO A 7 -14.371 10.396 -7.142 1.00 0.00 O ATOM 67 CB PRO A 7 -16.484 8.663 -5.664 1.00 0.00 C ATOM 68 CG PRO A 7 -17.806 8.414 -6.304 1.00 0.00 C ATOM 69 CD PRO A 7 -18.658 9.622 -6.011 1.00 0.00 C ATOM 0 HA PRO A 7 -15.672 10.601 -4.951 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -15.684 8.143 -6.191 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -16.469 8.309 -4.633 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -17.695 8.269 -7.379 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -18.266 7.509 -5.906 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -19.245 9.917 -6.881 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -19.363 9.427 -5.203 1.00 0.00 H new ATOM 77 N TYR A 8 -16.329 11.089 -8.021 1.00 0.00 N ATOM 78 CA TYR A 8 -15.725 11.482 -9.299 1.00 0.00 C ATOM 79 C TYR A 8 -15.808 12.991 -9.525 1.00 0.00 C ATOM 80 O TYR A 8 -14.785 13.659 -9.669 1.00 0.00 O ATOM 81 CB TYR A 8 -16.400 10.748 -10.462 1.00 0.00 C ATOM 82 CG TYR A 8 -16.388 9.239 -10.325 1.00 0.00 C ATOM 83 CD1 TYR A 8 -15.218 8.515 -10.522 1.00 0.00 C ATOM 84 CD2 TYR A 8 -17.543 8.541 -9.999 1.00 0.00 C ATOM 85 CE1 TYR A 8 -15.202 7.139 -10.398 1.00 0.00 C ATOM 86 CE2 TYR A 8 -17.535 7.165 -9.873 1.00 0.00 C ATOM 87 CZ TYR A 8 -16.363 6.469 -10.073 1.00 0.00 C ATOM 88 OH TYR A 8 -16.350 5.098 -9.948 1.00 0.00 O ATOM 0 H TYR A 8 -17.335 11.244 -7.960 1.00 0.00 H new ATOM 0 HA TYR A 8 -14.672 11.203 -9.257 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -17.433 11.088 -10.543 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -15.901 11.023 -11.391 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -14.307 9.036 -10.776 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -18.464 9.083 -9.841 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -14.285 6.591 -10.555 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -18.443 6.638 -9.619 1.00 0.00 H new ATOM 0 HH TYR A 8 -17.248 4.782 -9.714 1.00 0.00 H new ATOM 98 N LYS A 9 -17.033 13.516 -9.565 1.00 0.00 N ATOM 99 CA LYS A 9 -17.265 14.944 -9.785 1.00 0.00 C ATOM 100 C LYS A 9 -16.878 15.765 -8.554 1.00 0.00 C ATOM 101 O LYS A 9 -15.987 16.613 -8.619 1.00 0.00 O ATOM 102 CB LYS A 9 -18.734 15.196 -10.145 1.00 0.00 C ATOM 103 CG LYS A 9 -18.941 15.724 -11.556 1.00 0.00 C ATOM 104 CD LYS A 9 -18.654 17.216 -11.644 1.00 0.00 C ATOM 105 CE LYS A 9 -19.710 18.032 -10.912 1.00 0.00 C ATOM 106 NZ LYS A 9 -20.111 19.242 -11.682 1.00 0.00 N ATOM 0 H LYS A 9 -17.886 12.969 -9.447 1.00 0.00 H new ATOM 0 HA LYS A 9 -16.635 15.261 -10.616 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -19.291 14.266 -10.030 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -19.155 15.909 -9.436 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -18.290 15.186 -12.245 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -19.967 15.531 -11.870 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -17.672 17.424 -11.219 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -18.619 17.520 -12.690 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -20.587 17.411 -10.730 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -19.325 18.333 -9.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -20.831 19.770 -11.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -19.280 19.848 -11.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -20.502 18.954 -12.602 1.00 0.00 H new ATOM 120 N GLN A 10 -17.555 15.502 -7.430 1.00 0.00 N ATOM 121 CA GLN A 10 -17.283 16.207 -6.178 1.00 0.00 C ATOM 122 C GLN A 10 -15.831 16.000 -5.749 1.00 0.00 C ATOM 123 O GLN A 10 -15.132 16.964 -5.431 1.00 0.00 O ATOM 124 CB GLN A 10 -18.234 15.728 -5.075 1.00 0.00 C ATOM 125 CG GLN A 10 -18.546 16.789 -4.029 1.00 0.00 C ATOM 126 CD GLN A 10 -20.004 16.781 -3.597 1.00 0.00 C ATOM 127 OE1 GLN A 10 -20.910 16.719 -4.430 1.00 0.00 O ATOM 128 NE2 GLN A 10 -20.240 16.846 -2.289 1.00 0.00 N ATOM 0 H GLN A 10 -18.296 14.804 -7.365 1.00 0.00 H new ATOM 0 HA GLN A 10 -17.448 17.272 -6.343 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -19.166 15.396 -5.531 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.795 14.862 -4.580 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -17.913 16.630 -3.156 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -18.296 17.772 -4.429 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -19.461 16.896 -1.632 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -21.200 16.846 -1.943 1.00 0.00 H new ATOM 137 N ALA A 11 -15.383 14.739 -5.762 1.00 0.00 N ATOM 138 CA ALA A 11 -14.010 14.399 -5.389 1.00 0.00 C ATOM 139 C ALA A 11 -13.003 15.153 -6.257 1.00 0.00 C ATOM 140 O ALA A 11 -11.982 15.631 -5.759 1.00 0.00 O ATOM 141 CB ALA A 11 -13.782 12.898 -5.499 1.00 0.00 C ATOM 0 H ALA A 11 -15.955 13.937 -6.028 1.00 0.00 H new ATOM 0 HA ALA A 11 -13.860 14.700 -4.352 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -12.755 12.664 -5.218 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -14.469 12.376 -4.833 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -13.959 12.577 -6.526 1.00 0.00 H new ATOM 147 N PHE A 12 -13.307 15.270 -7.556 1.00 0.00 N ATOM 148 CA PHE A 12 -12.438 15.985 -8.491 1.00 0.00 C ATOM 149 C PHE A 12 -12.261 17.440 -8.046 1.00 0.00 C ATOM 150 O PHE A 12 -11.146 17.968 -8.051 1.00 0.00 O ATOM 151 CB PHE A 12 -13.021 15.923 -9.907 1.00 0.00 C ATOM 152 CG PHE A 12 -12.325 16.805 -10.911 1.00 0.00 C ATOM 153 CD1 PHE A 12 -12.631 18.154 -11.003 1.00 0.00 C ATOM 154 CD2 PHE A 12 -11.368 16.280 -11.764 1.00 0.00 C ATOM 155 CE1 PHE A 12 -11.996 18.960 -11.926 1.00 0.00 C ATOM 156 CE2 PHE A 12 -10.730 17.082 -12.688 1.00 0.00 C ATOM 157 CZ PHE A 12 -11.044 18.423 -12.769 1.00 0.00 C ATOM 0 H PHE A 12 -14.148 14.878 -7.980 1.00 0.00 H new ATOM 0 HA PHE A 12 -11.459 15.505 -8.497 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -12.979 14.892 -10.258 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -14.074 16.203 -9.865 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -13.375 18.579 -10.345 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -11.118 15.231 -11.705 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -12.244 20.009 -11.989 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -9.986 16.660 -13.347 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.545 19.052 -13.491 1.00 0.00 H new ATOM 167 N SER A 13 -13.372 18.072 -7.656 1.00 0.00 N ATOM 168 CA SER A 13 -13.362 19.462 -7.195 1.00 0.00 C ATOM 169 C SER A 13 -12.517 19.634 -5.928 1.00 0.00 C ATOM 170 O SER A 13 -11.928 20.692 -5.717 1.00 0.00 O ATOM 171 CB SER A 13 -14.791 19.945 -6.933 1.00 0.00 C ATOM 172 OG SER A 13 -15.518 20.072 -8.142 1.00 0.00 O ATOM 0 H SER A 13 -14.295 17.639 -7.651 1.00 0.00 H new ATOM 0 HA SER A 13 -12.913 20.065 -7.984 1.00 0.00 H new ATOM 0 HB2 SER A 13 -15.299 19.243 -6.272 1.00 0.00 H new ATOM 0 HB3 SER A 13 -14.765 20.906 -6.419 1.00 0.00 H new ATOM 0 HG SER A 13 -16.427 20.380 -7.946 1.00 0.00 H new ATOM 178 N LEU A 14 -12.467 18.596 -5.084 1.00 0.00 N ATOM 179 CA LEU A 14 -11.694 18.649 -3.838 1.00 0.00 C ATOM 180 C LEU A 14 -10.191 18.753 -4.112 1.00 0.00 C ATOM 181 O LEU A 14 -9.471 19.438 -3.382 1.00 0.00 O ATOM 182 CB LEU A 14 -11.965 17.412 -2.968 1.00 0.00 C ATOM 183 CG LEU A 14 -13.404 16.892 -2.956 1.00 0.00 C ATOM 184 CD1 LEU A 14 -13.568 15.795 -1.914 1.00 0.00 C ATOM 185 CD2 LEU A 14 -14.388 18.022 -2.699 1.00 0.00 C ATOM 0 H LEU A 14 -12.951 17.712 -5.241 1.00 0.00 H new ATOM 0 HA LEU A 14 -12.016 19.543 -3.304 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -11.313 16.607 -3.307 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -11.677 17.645 -1.943 1.00 0.00 H new ATOM 0 HG LEU A 14 -13.619 16.471 -3.938 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -14.598 15.438 -1.921 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -12.896 14.969 -2.147 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -13.328 16.191 -0.927 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -15.404 17.626 -2.695 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -14.173 18.479 -1.733 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -14.294 18.772 -3.484 1.00 0.00 H new ATOM 197 N PHE A 15 -9.722 18.066 -5.159 1.00 0.00 N ATOM 198 CA PHE A 15 -8.302 18.076 -5.518 1.00 0.00 C ATOM 199 C PHE A 15 -8.010 19.127 -6.595 1.00 0.00 C ATOM 200 O PHE A 15 -7.201 18.900 -7.496 1.00 0.00 O ATOM 201 CB PHE A 15 -7.872 16.682 -6.000 1.00 0.00 C ATOM 202 CG PHE A 15 -7.709 15.665 -4.896 1.00 0.00 C ATOM 203 CD1 PHE A 15 -8.298 15.852 -3.652 1.00 0.00 C ATOM 204 CD2 PHE A 15 -6.964 14.516 -5.108 1.00 0.00 C ATOM 205 CE1 PHE A 15 -8.146 14.916 -2.648 1.00 0.00 C ATOM 206 CE2 PHE A 15 -6.810 13.577 -4.107 1.00 0.00 C ATOM 207 CZ PHE A 15 -7.401 13.777 -2.876 1.00 0.00 C ATOM 0 H PHE A 15 -10.306 17.497 -5.772 1.00 0.00 H new ATOM 0 HA PHE A 15 -7.727 18.339 -4.630 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -8.610 16.313 -6.712 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -6.928 16.772 -6.538 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -8.883 16.741 -3.467 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -6.498 14.353 -6.068 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -8.610 15.075 -1.686 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -6.227 12.686 -4.288 1.00 0.00 H new ATOM 0 HZ PHE A 15 -7.281 13.043 -2.093 1.00 0.00 H new ATOM 217 N ASP A 16 -8.672 20.282 -6.488 1.00 0.00 N ATOM 218 CA ASP A 16 -8.489 21.374 -7.444 1.00 0.00 C ATOM 219 C ASP A 16 -7.261 22.222 -7.090 1.00 0.00 C ATOM 220 O ASP A 16 -7.360 23.215 -6.365 1.00 0.00 O ATOM 221 CB ASP A 16 -9.758 22.248 -7.515 1.00 0.00 C ATOM 222 CG ASP A 16 -10.117 22.940 -6.199 1.00 0.00 C ATOM 223 OD1 ASP A 16 -9.796 22.398 -5.116 1.00 0.00 O ATOM 224 OD2 ASP A 16 -10.733 24.021 -6.255 1.00 0.00 O ATOM 0 H ASP A 16 -9.342 20.484 -5.746 1.00 0.00 H new ATOM 0 HA ASP A 16 -8.316 20.936 -8.427 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -9.621 23.006 -8.286 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -10.597 21.626 -7.826 1.00 0.00 H new ATOM 229 N ARG A 17 -6.098 21.822 -7.614 1.00 0.00 N ATOM 230 CA ARG A 17 -4.848 22.544 -7.358 1.00 0.00 C ATOM 231 C ARG A 17 -4.911 23.969 -7.912 1.00 0.00 C ATOM 232 O ARG A 17 -4.399 24.904 -7.293 1.00 0.00 O ATOM 233 CB ARG A 17 -3.657 21.797 -7.970 1.00 0.00 C ATOM 234 CG ARG A 17 -3.204 20.597 -7.150 1.00 0.00 C ATOM 235 CD ARG A 17 -2.453 21.018 -5.894 1.00 0.00 C ATOM 236 NE ARG A 17 -1.100 21.494 -6.192 1.00 0.00 N ATOM 237 CZ ARG A 17 -0.754 22.785 -6.284 1.00 0.00 C ATOM 238 NH1 ARG A 17 -1.659 23.750 -6.113 1.00 0.00 N ATOM 239 NH2 ARG A 17 0.506 23.112 -6.550 1.00 0.00 N ATOM 0 H ARG A 17 -5.996 21.005 -8.216 1.00 0.00 H new ATOM 0 HA ARG A 17 -4.713 22.600 -6.278 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -3.925 21.462 -8.972 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -2.822 22.489 -8.078 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -4.072 20.000 -6.871 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -2.563 19.961 -7.761 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -3.010 21.806 -5.387 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -2.396 20.174 -5.207 1.00 0.00 H new ATOM 0 HE ARG A 17 -0.372 20.795 -6.339 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -2.629 23.509 -5.909 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -1.381 24.729 -6.186 1.00 0.00 H new ATOM 0 HH21 ARG A 17 1.205 22.381 -6.683 1.00 0.00 H new ATOM 0 HH22 ARG A 17 0.774 24.094 -6.621 1.00 0.00 H new ATOM 253 N HIS A 18 -5.547 24.129 -9.074 1.00 0.00 N ATOM 254 CA HIS A 18 -5.687 25.439 -9.708 1.00 0.00 C ATOM 255 C HIS A 18 -6.919 26.175 -9.184 1.00 0.00 C ATOM 256 O HIS A 18 -6.902 27.398 -9.034 1.00 0.00 O ATOM 257 CB HIS A 18 -5.787 25.289 -11.227 1.00 0.00 C ATOM 258 CG HIS A 18 -4.460 25.259 -11.918 1.00 0.00 C ATOM 259 ND1 HIS A 18 -3.649 24.152 -11.864 1.00 0.00 N ATOM 260 CD2 HIS A 18 -3.857 26.215 -12.665 1.00 0.00 C ATOM 261 CE1 HIS A 18 -2.576 24.455 -12.573 1.00 0.00 C ATOM 262 NE2 HIS A 18 -2.657 25.696 -13.078 1.00 0.00 N ATOM 0 H HIS A 18 -5.974 23.364 -9.596 1.00 0.00 H new ATOM 0 HA HIS A 18 -4.801 26.024 -9.461 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -6.327 24.371 -11.458 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -6.376 26.115 -11.627 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -4.246 27.197 -12.891 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -1.740 23.789 -12.727 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -1.960 26.163 -13.658 1.00 0.00 H new ATOM 270 N GLY A 19 -7.992 25.424 -8.918 1.00 0.00 N ATOM 271 CA GLY A 19 -9.224 26.022 -8.428 1.00 0.00 C ATOM 272 C GLY A 19 -10.041 26.661 -9.539 1.00 0.00 C ATOM 273 O GLY A 19 -10.799 27.601 -9.292 1.00 0.00 O ATOM 0 H GLY A 19 -8.027 24.411 -9.034 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -9.824 25.258 -7.933 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -8.985 26.775 -7.677 1.00 0.00 H new ATOM 277 N THR A 20 -9.884 26.150 -10.764 1.00 0.00 N ATOM 278 CA THR A 20 -10.609 26.673 -11.922 1.00 0.00 C ATOM 279 C THR A 20 -11.309 25.556 -12.713 1.00 0.00 C ATOM 280 O THR A 20 -11.807 25.794 -13.816 1.00 0.00 O ATOM 281 CB THR A 20 -9.646 27.443 -12.836 1.00 0.00 C ATOM 282 OG1 THR A 20 -8.617 26.596 -13.313 1.00 0.00 O ATOM 283 CG2 THR A 20 -8.984 28.624 -12.158 1.00 0.00 C ATOM 0 H THR A 20 -9.259 25.373 -10.978 1.00 0.00 H new ATOM 0 HA THR A 20 -11.382 27.347 -11.553 1.00 0.00 H new ATOM 0 HB THR A 20 -10.266 27.813 -13.652 1.00 0.00 H new ATOM 0 HG1 THR A 20 -8.016 27.107 -13.895 1.00 0.00 H new ATOM 0 HG21 THR A 20 -8.317 29.121 -12.863 1.00 0.00 H new ATOM 0 HG22 THR A 20 -9.747 29.326 -11.823 1.00 0.00 H new ATOM 0 HG23 THR A 20 -8.410 28.276 -11.299 1.00 0.00 H new ATOM 291 N GLY A 21 -11.352 24.340 -12.148 1.00 0.00 N ATOM 292 CA GLY A 21 -11.999 23.220 -12.819 1.00 0.00 C ATOM 293 C GLY A 21 -11.023 22.267 -13.504 1.00 0.00 C ATOM 294 O GLY A 21 -11.450 21.372 -14.235 1.00 0.00 O ATOM 0 H GLY A 21 -10.949 24.116 -11.238 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -12.587 22.662 -12.090 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -12.697 23.607 -13.562 1.00 0.00 H new ATOM 298 N ARG A 22 -9.718 22.451 -13.271 1.00 0.00 N ATOM 299 CA ARG A 22 -8.695 21.595 -13.877 1.00 0.00 C ATOM 300 C ARG A 22 -7.727 21.066 -12.818 1.00 0.00 C ATOM 301 O ARG A 22 -7.666 21.592 -11.704 1.00 0.00 O ATOM 302 CB ARG A 22 -7.924 22.363 -14.950 1.00 0.00 C ATOM 303 CG ARG A 22 -8.809 23.127 -15.924 1.00 0.00 C ATOM 304 CD ARG A 22 -8.930 24.592 -15.534 1.00 0.00 C ATOM 305 NE ARG A 22 -8.159 25.464 -16.420 1.00 0.00 N ATOM 306 CZ ARG A 22 -8.583 25.887 -17.615 1.00 0.00 C ATOM 307 NH1 ARG A 22 -9.777 25.522 -18.082 1.00 0.00 N ATOM 308 NH2 ARG A 22 -7.808 26.679 -18.350 1.00 0.00 N ATOM 0 H ARG A 22 -9.347 23.185 -12.667 1.00 0.00 H new ATOM 0 HA ARG A 22 -9.198 20.746 -14.340 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -7.247 23.065 -14.463 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -7.306 21.661 -15.511 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -8.396 23.050 -16.930 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -9.800 22.673 -15.950 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -9.979 24.888 -15.558 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -8.586 24.723 -14.508 1.00 0.00 H new ATOM 0 HE ARG A 22 -7.238 25.769 -16.105 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -10.378 24.914 -17.526 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -10.090 25.851 -18.995 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -6.892 26.962 -18.002 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -8.129 27.003 -19.262 1.00 0.00 H new ATOM 322 N ILE A 23 -6.976 20.019 -13.171 1.00 0.00 N ATOM 323 CA ILE A 23 -6.017 19.416 -12.243 1.00 0.00 C ATOM 324 C ILE A 23 -4.788 18.861 -12.971 1.00 0.00 C ATOM 325 O ILE A 23 -4.910 18.247 -14.033 1.00 0.00 O ATOM 326 CB ILE A 23 -6.667 18.277 -11.426 1.00 0.00 C ATOM 327 CG1 ILE A 23 -7.369 17.282 -12.355 1.00 0.00 C ATOM 328 CG2 ILE A 23 -7.648 18.842 -10.409 1.00 0.00 C ATOM 329 CD1 ILE A 23 -7.458 15.882 -11.795 1.00 0.00 C ATOM 0 H ILE A 23 -7.013 19.574 -14.088 1.00 0.00 H new ATOM 0 HA ILE A 23 -5.700 20.213 -11.571 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.881 17.748 -10.888 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.376 17.644 -12.565 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -6.837 17.250 -13.306 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -8.096 18.025 -9.843 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -7.121 19.510 -9.727 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -8.431 19.396 -10.927 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -7.968 15.236 -12.510 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.454 15.499 -11.611 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -8.017 15.899 -10.859 1.00 0.00 H new ATOM 341 N PRO A 24 -3.583 19.068 -12.399 1.00 0.00 N ATOM 342 CA PRO A 24 -2.328 18.585 -12.979 1.00 0.00 C ATOM 343 C PRO A 24 -2.003 17.150 -12.557 1.00 0.00 C ATOM 344 O PRO A 24 -2.680 16.583 -11.698 1.00 0.00 O ATOM 345 CB PRO A 24 -1.305 19.555 -12.397 1.00 0.00 C ATOM 346 CG PRO A 24 -1.842 19.903 -11.047 1.00 0.00 C ATOM 347 CD PRO A 24 -3.347 19.793 -11.133 1.00 0.00 C ATOM 0 HA PRO A 24 -2.355 18.556 -14.068 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -0.319 19.096 -12.325 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -1.199 20.442 -13.022 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -1.448 19.227 -10.288 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -1.544 20.912 -10.761 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -3.757 19.251 -10.281 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -3.819 20.776 -11.142 1.00 0.00 H new ATOM 355 N LYS A 25 -0.959 16.574 -13.167 1.00 0.00 N ATOM 356 CA LYS A 25 -0.520 15.203 -12.867 1.00 0.00 C ATOM 357 C LYS A 25 -0.451 14.931 -11.356 1.00 0.00 C ATOM 358 O LYS A 25 -0.785 13.834 -10.909 1.00 0.00 O ATOM 359 CB LYS A 25 0.848 14.926 -13.508 1.00 0.00 C ATOM 360 CG LYS A 25 1.865 16.045 -13.316 1.00 0.00 C ATOM 361 CD LYS A 25 3.088 15.565 -12.551 1.00 0.00 C ATOM 362 CE LYS A 25 4.240 16.552 -12.660 1.00 0.00 C ATOM 363 NZ LYS A 25 5.064 16.317 -13.879 1.00 0.00 N ATOM 0 H LYS A 25 -0.397 17.041 -13.879 1.00 0.00 H new ATOM 0 HA LYS A 25 -1.266 14.530 -13.290 1.00 0.00 H new ATOM 0 HB2 LYS A 25 1.254 14.005 -13.089 1.00 0.00 H new ATOM 0 HB3 LYS A 25 0.709 14.756 -14.576 1.00 0.00 H new ATOM 0 HG2 LYS A 25 2.172 16.430 -14.289 1.00 0.00 H new ATOM 0 HG3 LYS A 25 1.400 16.872 -12.778 1.00 0.00 H new ATOM 0 HD2 LYS A 25 2.829 15.422 -11.502 1.00 0.00 H new ATOM 0 HD3 LYS A 25 3.402 14.595 -12.937 1.00 0.00 H new ATOM 0 HE2 LYS A 25 3.846 17.568 -12.679 1.00 0.00 H new ATOM 0 HE3 LYS A 25 4.871 16.472 -11.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 6.059 16.189 -13.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 4.726 15.463 -14.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 4.982 17.135 -14.516 1.00 0.00 H new ATOM 377 N THR A 26 -0.019 15.928 -10.577 1.00 0.00 N ATOM 378 CA THR A 26 0.087 15.779 -9.121 1.00 0.00 C ATOM 379 C THR A 26 -1.277 15.460 -8.497 1.00 0.00 C ATOM 380 O THR A 26 -1.375 14.614 -7.605 1.00 0.00 O ATOM 381 CB THR A 26 0.670 17.050 -8.487 1.00 0.00 C ATOM 382 OG1 THR A 26 -0.146 18.176 -8.765 1.00 0.00 O ATOM 383 CG2 THR A 26 2.071 17.372 -8.964 1.00 0.00 C ATOM 0 H THR A 26 0.262 16.844 -10.928 1.00 0.00 H new ATOM 0 HA THR A 26 0.760 14.945 -8.922 1.00 0.00 H new ATOM 0 HB THR A 26 0.705 16.843 -7.417 1.00 0.00 H new ATOM 0 HG1 THR A 26 0.244 18.973 -8.350 1.00 0.00 H new ATOM 0 HG21 THR A 26 2.421 18.282 -8.476 1.00 0.00 H new ATOM 0 HG22 THR A 26 2.739 16.547 -8.716 1.00 0.00 H new ATOM 0 HG23 THR A 26 2.063 17.520 -10.044 1.00 0.00 H new ATOM 391 N SER A 27 -2.323 16.139 -8.976 1.00 0.00 N ATOM 392 CA SER A 27 -3.683 15.930 -8.474 1.00 0.00 C ATOM 393 C SER A 27 -4.236 14.575 -8.912 1.00 0.00 C ATOM 394 O SER A 27 -4.671 13.783 -8.075 1.00 0.00 O ATOM 395 CB SER A 27 -4.608 17.047 -8.962 1.00 0.00 C ATOM 396 OG SER A 27 -4.544 18.172 -8.106 1.00 0.00 O ATOM 0 H SER A 27 -2.253 16.840 -9.713 1.00 0.00 H new ATOM 0 HA SER A 27 -3.639 15.946 -7.385 1.00 0.00 H new ATOM 0 HB2 SER A 27 -4.327 17.340 -9.974 1.00 0.00 H new ATOM 0 HB3 SER A 27 -5.633 16.680 -9.009 1.00 0.00 H new ATOM 0 HG SER A 27 -5.452 18.457 -7.872 1.00 0.00 H new ATOM 402 N ILE A 28 -4.223 14.320 -10.228 1.00 0.00 N ATOM 403 CA ILE A 28 -4.737 13.054 -10.781 1.00 0.00 C ATOM 404 C ILE A 28 -4.157 11.836 -10.060 1.00 0.00 C ATOM 405 O ILE A 28 -4.854 10.839 -9.878 1.00 0.00 O ATOM 406 CB ILE A 28 -4.491 12.872 -12.310 1.00 0.00 C ATOM 407 CG1 ILE A 28 -3.774 14.072 -12.952 1.00 0.00 C ATOM 408 CG2 ILE A 28 -5.809 12.592 -13.022 1.00 0.00 C ATOM 409 CD1 ILE A 28 -4.685 15.242 -13.271 1.00 0.00 C ATOM 0 H ILE A 28 -3.864 14.969 -10.928 1.00 0.00 H new ATOM 0 HA ILE A 28 -5.813 13.120 -10.618 1.00 0.00 H new ATOM 0 HB ILE A 28 -3.824 12.018 -12.425 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -2.986 14.412 -12.280 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -3.289 13.742 -13.871 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -5.626 12.466 -14.089 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -6.253 11.681 -12.620 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -6.491 13.428 -12.866 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -4.101 16.045 -13.721 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -5.459 14.921 -13.969 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -5.151 15.601 -12.353 1.00 0.00 H new ATOM 421 N GLY A 29 -2.885 11.918 -9.650 1.00 0.00 N ATOM 422 CA GLY A 29 -2.247 10.806 -8.953 1.00 0.00 C ATOM 423 C GLY A 29 -3.072 10.304 -7.779 1.00 0.00 C ATOM 424 O GLY A 29 -3.695 9.242 -7.859 1.00 0.00 O ATOM 0 H GLY A 29 -2.288 12.733 -9.789 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.084 9.988 -9.654 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.266 11.120 -8.596 1.00 0.00 H new ATOM 428 N ASP A 30 -3.078 11.075 -6.692 1.00 0.00 N ATOM 429 CA ASP A 30 -3.840 10.715 -5.487 1.00 0.00 C ATOM 430 C ASP A 30 -5.349 10.703 -5.764 1.00 0.00 C ATOM 431 O ASP A 30 -6.092 9.957 -5.123 1.00 0.00 O ATOM 432 CB ASP A 30 -3.532 11.670 -4.317 1.00 0.00 C ATOM 433 CG ASP A 30 -3.037 13.040 -4.758 1.00 0.00 C ATOM 434 OD1 ASP A 30 -3.875 13.883 -5.140 1.00 0.00 O ATOM 435 OD2 ASP A 30 -1.810 13.264 -4.725 1.00 0.00 O ATOM 0 H ASP A 30 -2.565 11.954 -6.617 1.00 0.00 H new ATOM 0 HA ASP A 30 -3.528 9.710 -5.204 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -4.432 11.795 -3.716 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -2.780 11.212 -3.674 1.00 0.00 H new ATOM 440 N LEU A 31 -5.795 11.522 -6.725 1.00 0.00 N ATOM 441 CA LEU A 31 -7.213 11.591 -7.086 1.00 0.00 C ATOM 442 C LEU A 31 -7.706 10.237 -7.599 1.00 0.00 C ATOM 443 O LEU A 31 -8.712 9.712 -7.116 1.00 0.00 O ATOM 444 CB LEU A 31 -7.444 12.674 -8.148 1.00 0.00 C ATOM 445 CG LEU A 31 -8.744 12.550 -8.953 1.00 0.00 C ATOM 446 CD1 LEU A 31 -9.958 12.712 -8.048 1.00 0.00 C ATOM 447 CD2 LEU A 31 -8.774 13.576 -10.076 1.00 0.00 C ATOM 0 H LEU A 31 -5.194 12.145 -7.265 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.780 11.850 -6.192 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -7.434 13.647 -7.656 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -6.605 12.660 -8.844 1.00 0.00 H new ATOM 0 HG LEU A 31 -8.779 11.554 -9.393 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -10.868 12.620 -8.640 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -9.945 11.938 -7.280 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -9.931 13.693 -7.575 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -9.703 13.474 -10.637 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -8.713 14.579 -9.654 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.928 13.411 -10.743 1.00 0.00 H new ATOM 459 N LEU A 32 -6.985 9.680 -8.575 1.00 0.00 N ATOM 460 CA LEU A 32 -7.334 8.383 -9.157 1.00 0.00 C ATOM 461 C LEU A 32 -7.303 7.275 -8.102 1.00 0.00 C ATOM 462 O LEU A 32 -8.043 6.297 -8.209 1.00 0.00 O ATOM 463 CB LEU A 32 -6.383 8.038 -10.306 1.00 0.00 C ATOM 464 CG LEU A 32 -6.521 8.924 -11.548 1.00 0.00 C ATOM 465 CD1 LEU A 32 -5.245 8.885 -12.377 1.00 0.00 C ATOM 466 CD2 LEU A 32 -7.718 8.492 -12.383 1.00 0.00 C ATOM 0 H LEU A 32 -6.153 10.109 -8.980 1.00 0.00 H new ATOM 0 HA LEU A 32 -8.350 8.456 -9.545 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.358 8.105 -9.942 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -6.550 7.001 -10.597 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.685 9.951 -11.221 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -5.362 9.520 -13.255 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -4.410 9.246 -11.777 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -5.048 7.861 -12.694 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -7.800 9.133 -13.261 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -7.586 7.458 -12.700 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -8.627 8.576 -11.787 1.00 0.00 H new ATOM 478 N ARG A 33 -6.451 7.438 -7.082 1.00 0.00 N ATOM 479 CA ARG A 33 -6.331 6.460 -6.003 1.00 0.00 C ATOM 480 C ARG A 33 -7.693 6.204 -5.343 1.00 0.00 C ATOM 481 O ARG A 33 -8.022 5.064 -5.008 1.00 0.00 O ATOM 482 CB ARG A 33 -5.303 6.956 -4.970 1.00 0.00 C ATOM 483 CG ARG A 33 -5.847 7.128 -3.557 1.00 0.00 C ATOM 484 CD ARG A 33 -4.743 7.461 -2.567 1.00 0.00 C ATOM 485 NE ARG A 33 -5.260 7.634 -1.208 1.00 0.00 N ATOM 486 CZ ARG A 33 -5.589 6.625 -0.392 1.00 0.00 C ATOM 487 NH1 ARG A 33 -5.453 5.360 -0.788 1.00 0.00 N ATOM 488 NH2 ARG A 33 -6.057 6.885 0.825 1.00 0.00 N ATOM 0 H ARG A 33 -5.833 8.244 -6.985 1.00 0.00 H new ATOM 0 HA ARG A 33 -5.985 5.514 -6.419 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -4.471 6.253 -4.940 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -4.901 7.911 -5.308 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -6.595 7.921 -3.549 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -6.350 6.212 -3.247 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -3.998 6.665 -2.573 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -4.237 8.374 -2.882 1.00 0.00 H new ATOM 0 HE ARG A 33 -5.377 8.586 -0.860 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -5.095 5.153 -1.721 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -5.707 4.598 -0.159 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -6.164 7.851 1.134 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -6.309 6.119 1.449 1.00 0.00 H new ATOM 502 N ALA A 34 -8.476 7.275 -5.164 1.00 0.00 N ATOM 503 CA ALA A 34 -9.802 7.180 -4.549 1.00 0.00 C ATOM 504 C ALA A 34 -10.750 6.301 -5.371 1.00 0.00 C ATOM 505 O ALA A 34 -11.654 5.673 -4.817 1.00 0.00 O ATOM 506 CB ALA A 34 -10.400 8.568 -4.366 1.00 0.00 C ATOM 0 H ALA A 34 -8.211 8.221 -5.438 1.00 0.00 H new ATOM 0 HA ALA A 34 -9.678 6.710 -3.573 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -11.385 8.482 -3.908 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -9.751 9.162 -3.722 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -10.492 9.055 -5.337 1.00 0.00 H new ATOM 512 N CYS A 35 -10.538 6.255 -6.690 1.00 0.00 N ATOM 513 CA CYS A 35 -11.371 5.447 -7.578 1.00 0.00 C ATOM 514 C CYS A 35 -10.793 4.042 -7.726 1.00 0.00 C ATOM 515 O CYS A 35 -11.527 3.054 -7.693 1.00 0.00 O ATOM 516 CB CYS A 35 -11.488 6.111 -8.954 1.00 0.00 C ATOM 517 SG CYS A 35 -12.108 7.809 -8.907 1.00 0.00 S ATOM 0 H CYS A 35 -9.795 6.769 -7.164 1.00 0.00 H new ATOM 0 HA CYS A 35 -12.365 5.372 -7.137 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -10.508 6.107 -9.431 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -12.150 5.512 -9.579 1.00 0.00 H new ATOM 0 HG CYS A 35 -13.272 7.862 -9.484 1.00 0.00 H new ATOM 523 N GLY A 36 -9.470 3.967 -7.888 1.00 0.00 N ATOM 524 CA GLY A 36 -8.802 2.689 -8.036 1.00 0.00 C ATOM 525 C GLY A 36 -7.449 2.658 -7.350 1.00 0.00 C ATOM 526 O GLY A 36 -7.349 2.262 -6.188 1.00 0.00 O ATOM 0 H GLY A 36 -8.850 4.776 -7.919 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -9.433 1.903 -7.623 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.673 2.470 -9.096 1.00 0.00 H new ATOM 530 N GLN A 37 -6.407 3.069 -8.076 1.00 0.00 N ATOM 531 CA GLN A 37 -5.047 3.082 -7.535 1.00 0.00 C ATOM 532 C GLN A 37 -4.328 4.402 -7.822 1.00 0.00 C ATOM 533 O GLN A 37 -4.828 5.248 -8.568 1.00 0.00 O ATOM 534 CB GLN A 37 -4.238 1.921 -8.115 1.00 0.00 C ATOM 535 CG GLN A 37 -3.808 0.898 -7.075 1.00 0.00 C ATOM 536 CD GLN A 37 -2.585 0.104 -7.502 1.00 0.00 C ATOM 537 OE1 GLN A 37 -2.534 -0.430 -8.611 1.00 0.00 O ATOM 538 NE2 GLN A 37 -1.592 0.019 -6.622 1.00 0.00 N ATOM 0 H GLN A 37 -6.479 3.397 -9.039 1.00 0.00 H new ATOM 0 HA GLN A 37 -5.128 2.973 -6.453 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -4.833 1.421 -8.880 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -3.352 2.318 -8.610 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -3.595 1.409 -6.136 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -4.633 0.212 -6.884 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -1.675 0.476 -5.714 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -0.748 -0.504 -6.855 1.00 0.00 H new ATOM 547 N ASN A 38 -3.139 4.554 -7.235 1.00 0.00 N ATOM 548 CA ASN A 38 -2.323 5.749 -7.428 1.00 0.00 C ATOM 549 C ASN A 38 -0.953 5.368 -7.996 1.00 0.00 C ATOM 550 O ASN A 38 -0.135 4.757 -7.304 1.00 0.00 O ATOM 551 CB ASN A 38 -2.168 6.512 -6.101 1.00 0.00 C ATOM 552 CG ASN A 38 -0.972 7.453 -6.077 1.00 0.00 C ATOM 553 OD1 ASN A 38 -0.167 7.421 -5.147 1.00 0.00 O ATOM 554 ND2 ASN A 38 -0.847 8.296 -7.099 1.00 0.00 N ATOM 0 H ASN A 38 -2.720 3.858 -6.618 1.00 0.00 H new ATOM 0 HA ASN A 38 -2.823 6.403 -8.142 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -3.075 7.086 -5.913 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -2.071 5.793 -5.287 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -0.062 8.947 -7.130 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -1.536 8.291 -7.851 1.00 0.00 H new ATOM 561 N PRO A 39 -0.687 5.718 -9.272 1.00 0.00 N ATOM 562 CA PRO A 39 0.582 5.406 -9.935 1.00 0.00 C ATOM 563 C PRO A 39 1.672 6.441 -9.634 1.00 0.00 C ATOM 564 O PRO A 39 1.555 7.222 -8.686 1.00 0.00 O ATOM 565 CB PRO A 39 0.187 5.440 -11.409 1.00 0.00 C ATOM 566 CG PRO A 39 -0.851 6.503 -11.483 1.00 0.00 C ATOM 567 CD PRO A 39 -1.608 6.441 -10.178 1.00 0.00 C ATOM 0 HA PRO A 39 1.012 4.460 -9.606 1.00 0.00 H new ATOM 0 HB2 PRO A 39 1.041 5.672 -12.045 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -0.204 4.478 -11.739 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -0.396 7.483 -11.623 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -1.518 6.338 -12.329 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -1.840 7.437 -9.802 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -2.556 5.914 -10.289 1.00 0.00 H new ATOM 575 N THR A 40 2.727 6.445 -10.451 1.00 0.00 N ATOM 576 CA THR A 40 3.835 7.386 -10.279 1.00 0.00 C ATOM 577 C THR A 40 3.623 8.641 -11.121 1.00 0.00 C ATOM 578 O THR A 40 2.775 8.663 -12.014 1.00 0.00 O ATOM 579 CB THR A 40 5.172 6.738 -10.662 1.00 0.00 C ATOM 580 OG1 THR A 40 5.033 5.903 -11.797 1.00 0.00 O ATOM 581 CG2 THR A 40 5.777 5.908 -9.551 1.00 0.00 C ATOM 0 H THR A 40 2.837 5.807 -11.239 1.00 0.00 H new ATOM 0 HA THR A 40 3.863 7.664 -9.226 1.00 0.00 H new ATOM 0 HB THR A 40 5.838 7.574 -10.875 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.901 5.505 -12.019 1.00 0.00 H new ATOM 0 HG21 THR A 40 6.720 5.479 -9.889 1.00 0.00 H new ATOM 0 HG22 THR A 40 5.957 6.540 -8.681 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.090 5.106 -9.281 1.00 0.00 H new ATOM 589 N LEU A 41 4.415 9.679 -10.837 1.00 0.00 N ATOM 590 CA LEU A 41 4.334 10.942 -11.571 1.00 0.00 C ATOM 591 C LEU A 41 4.487 10.707 -13.075 1.00 0.00 C ATOM 592 O LEU A 41 3.871 11.403 -13.882 1.00 0.00 O ATOM 593 CB LEU A 41 5.413 11.913 -11.076 1.00 0.00 C ATOM 594 CG LEU A 41 5.100 12.643 -9.761 1.00 0.00 C ATOM 595 CD1 LEU A 41 4.173 13.821 -10.011 1.00 0.00 C ATOM 596 CD2 LEU A 41 4.493 11.694 -8.735 1.00 0.00 C ATOM 0 H LEU A 41 5.121 9.668 -10.101 1.00 0.00 H new ATOM 0 HA LEU A 41 3.353 11.380 -11.390 1.00 0.00 H new ATOM 0 HB2 LEU A 41 6.344 11.360 -10.950 1.00 0.00 H new ATOM 0 HB3 LEU A 41 5.588 12.659 -11.851 1.00 0.00 H new ATOM 0 HG LEU A 41 6.039 13.020 -9.356 1.00 0.00 H new ATOM 0 HD11 LEU A 41 3.963 14.325 -9.068 1.00 0.00 H new ATOM 0 HD12 LEU A 41 4.650 14.520 -10.698 1.00 0.00 H new ATOM 0 HD13 LEU A 41 3.240 13.464 -10.447 1.00 0.00 H new ATOM 0 HD21 LEU A 41 4.282 12.239 -7.815 1.00 0.00 H new ATOM 0 HD22 LEU A 41 3.567 11.276 -9.129 1.00 0.00 H new ATOM 0 HD23 LEU A 41 5.195 10.887 -8.526 1.00 0.00 H new ATOM 608 N ALA A 42 5.299 9.709 -13.443 1.00 0.00 N ATOM 609 CA ALA A 42 5.513 9.370 -14.848 1.00 0.00 C ATOM 610 C ALA A 42 4.200 8.947 -15.512 1.00 0.00 C ATOM 611 O ALA A 42 3.948 9.290 -16.667 1.00 0.00 O ATOM 612 CB ALA A 42 6.552 8.263 -14.976 1.00 0.00 C ATOM 0 H ALA A 42 5.816 9.125 -12.786 1.00 0.00 H new ATOM 0 HA ALA A 42 5.884 10.258 -15.359 1.00 0.00 H new ATOM 0 HB1 ALA A 42 6.700 8.022 -16.029 1.00 0.00 H new ATOM 0 HB2 ALA A 42 7.495 8.598 -14.545 1.00 0.00 H new ATOM 0 HB3 ALA A 42 6.205 7.376 -14.446 1.00 0.00 H new ATOM 618 N GLU A 43 3.367 8.207 -14.769 1.00 0.00 N ATOM 619 CA GLU A 43 2.076 7.746 -15.285 1.00 0.00 C ATOM 620 C GLU A 43 1.131 8.924 -15.537 1.00 0.00 C ATOM 621 O GLU A 43 0.627 9.088 -16.650 1.00 0.00 O ATOM 622 CB GLU A 43 1.426 6.755 -14.313 1.00 0.00 C ATOM 623 CG GLU A 43 1.776 5.302 -14.599 1.00 0.00 C ATOM 624 CD GLU A 43 3.075 4.872 -13.948 1.00 0.00 C ATOM 625 OE1 GLU A 43 4.153 5.229 -14.477 1.00 0.00 O ATOM 626 OE2 GLU A 43 3.016 4.178 -12.910 1.00 0.00 O ATOM 0 H GLU A 43 3.565 7.916 -13.812 1.00 0.00 H new ATOM 0 HA GLU A 43 2.260 7.241 -16.233 1.00 0.00 H new ATOM 0 HB2 GLU A 43 1.734 7.001 -13.297 1.00 0.00 H new ATOM 0 HB3 GLU A 43 0.343 6.874 -14.356 1.00 0.00 H new ATOM 0 HG2 GLU A 43 0.968 4.662 -14.245 1.00 0.00 H new ATOM 0 HG3 GLU A 43 1.849 5.156 -15.677 1.00 0.00 H new ATOM 633 N ILE A 44 0.895 9.741 -14.502 1.00 0.00 N ATOM 634 CA ILE A 44 0.009 10.907 -14.628 1.00 0.00 C ATOM 635 C ILE A 44 0.469 11.828 -15.757 1.00 0.00 C ATOM 636 O ILE A 44 -0.344 12.268 -16.573 1.00 0.00 O ATOM 637 CB ILE A 44 -0.122 11.740 -13.322 1.00 0.00 C ATOM 638 CG1 ILE A 44 1.042 11.487 -12.344 1.00 0.00 C ATOM 639 CG2 ILE A 44 -1.461 11.456 -12.662 1.00 0.00 C ATOM 640 CD1 ILE A 44 0.735 10.476 -11.256 1.00 0.00 C ATOM 0 H ILE A 44 1.301 9.618 -13.575 1.00 0.00 H new ATOM 0 HA ILE A 44 -0.974 10.493 -14.852 1.00 0.00 H new ATOM 0 HB ILE A 44 -0.072 12.794 -13.594 1.00 0.00 H new ATOM 0 HG12 ILE A 44 1.908 11.143 -12.910 1.00 0.00 H new ATOM 0 HG13 ILE A 44 1.321 12.432 -11.877 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -1.547 12.042 -11.747 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -2.267 11.726 -13.344 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -1.530 10.395 -12.421 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.607 10.358 -10.613 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -0.109 10.826 -10.662 1.00 0.00 H new ATOM 0 HD13 ILE A 44 0.487 9.517 -11.710 1.00 0.00 H new ATOM 652 N THR A 45 1.776 12.099 -15.811 1.00 0.00 N ATOM 653 CA THR A 45 2.341 12.949 -16.860 1.00 0.00 C ATOM 654 C THR A 45 2.113 12.309 -18.232 1.00 0.00 C ATOM 655 O THR A 45 1.763 12.994 -19.196 1.00 0.00 O ATOM 656 CB THR A 45 3.839 13.182 -16.623 1.00 0.00 C ATOM 657 OG1 THR A 45 4.060 13.753 -15.345 1.00 0.00 O ATOM 658 CG2 THR A 45 4.478 14.098 -17.647 1.00 0.00 C ATOM 0 H THR A 45 2.460 11.743 -15.143 1.00 0.00 H new ATOM 0 HA THR A 45 1.837 13.915 -16.832 1.00 0.00 H new ATOM 0 HB THR A 45 4.298 12.197 -16.705 1.00 0.00 H new ATOM 0 HG1 THR A 45 4.028 13.050 -14.663 1.00 0.00 H new ATOM 0 HG21 THR A 45 5.537 14.218 -17.418 1.00 0.00 H new ATOM 0 HG22 THR A 45 4.369 13.665 -18.641 1.00 0.00 H new ATOM 0 HG23 THR A 45 3.989 15.072 -17.620 1.00 0.00 H new ATOM 666 N GLU A 46 2.294 10.983 -18.301 1.00 0.00 N ATOM 667 CA GLU A 46 2.088 10.233 -19.540 1.00 0.00 C ATOM 668 C GLU A 46 0.656 10.414 -20.044 1.00 0.00 C ATOM 669 O GLU A 46 0.425 10.537 -21.247 1.00 0.00 O ATOM 670 CB GLU A 46 2.386 8.745 -19.321 1.00 0.00 C ATOM 671 CG GLU A 46 2.427 7.925 -20.602 1.00 0.00 C ATOM 672 CD GLU A 46 3.363 8.506 -21.648 1.00 0.00 C ATOM 673 OE1 GLU A 46 4.561 8.147 -21.638 1.00 0.00 O ATOM 674 OE2 GLU A 46 2.897 9.317 -22.477 1.00 0.00 O ATOM 0 H GLU A 46 2.584 10.409 -17.509 1.00 0.00 H new ATOM 0 HA GLU A 46 2.774 10.620 -20.293 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.344 8.649 -18.810 1.00 0.00 H new ATOM 0 HB3 GLU A 46 1.628 8.327 -18.659 1.00 0.00 H new ATOM 0 HG2 GLU A 46 2.741 6.908 -20.366 1.00 0.00 H new ATOM 0 HG3 GLU A 46 1.422 7.860 -21.018 1.00 0.00 H new ATOM 681 N ILE A 47 -0.301 10.449 -19.111 1.00 0.00 N ATOM 682 CA ILE A 47 -1.706 10.643 -19.457 1.00 0.00 C ATOM 683 C ILE A 47 -1.906 12.033 -20.064 1.00 0.00 C ATOM 684 O ILE A 47 -2.496 12.172 -21.133 1.00 0.00 O ATOM 685 CB ILE A 47 -2.624 10.477 -18.221 1.00 0.00 C ATOM 686 CG1 ILE A 47 -2.514 9.055 -17.659 1.00 0.00 C ATOM 687 CG2 ILE A 47 -4.070 10.799 -18.575 1.00 0.00 C ATOM 688 CD1 ILE A 47 -2.684 8.982 -16.156 1.00 0.00 C ATOM 0 H ILE A 47 -0.125 10.345 -18.112 1.00 0.00 H new ATOM 0 HA ILE A 47 -1.979 9.880 -20.186 1.00 0.00 H new ATOM 0 HB ILE A 47 -2.295 11.180 -17.455 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.269 8.427 -18.132 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -1.542 8.642 -17.927 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -4.697 10.676 -17.692 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -4.138 11.828 -18.927 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -4.412 10.124 -19.360 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -2.594 7.946 -15.830 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -1.913 9.583 -15.673 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.667 9.365 -15.882 1.00 0.00 H new ATOM 700 N GLU A 48 -1.384 13.055 -19.375 1.00 0.00 N ATOM 701 CA GLU A 48 -1.478 14.440 -19.841 1.00 0.00 C ATOM 702 C GLU A 48 -0.891 14.611 -21.251 1.00 0.00 C ATOM 703 O GLU A 48 -1.276 15.527 -21.978 1.00 0.00 O ATOM 704 CB GLU A 48 -0.767 15.372 -18.861 1.00 0.00 C ATOM 705 CG GLU A 48 -1.615 15.700 -17.647 1.00 0.00 C ATOM 706 CD GLU A 48 -0.989 16.747 -16.743 1.00 0.00 C ATOM 707 OE1 GLU A 48 0.161 16.542 -16.297 1.00 0.00 O ATOM 708 OE2 GLU A 48 -1.651 17.773 -16.475 1.00 0.00 O ATOM 0 H GLU A 48 -0.890 12.946 -18.489 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.535 14.701 -19.890 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.164 14.908 -18.535 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -0.500 16.296 -19.373 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -2.591 16.053 -17.979 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -1.784 14.789 -17.073 1.00 0.00 H new ATOM 715 N SER A 49 0.041 13.723 -21.631 1.00 0.00 N ATOM 716 CA SER A 49 0.679 13.773 -22.951 1.00 0.00 C ATOM 717 C SER A 49 -0.316 13.531 -24.105 1.00 0.00 C ATOM 718 O SER A 49 0.054 13.668 -25.274 1.00 0.00 O ATOM 719 CB SER A 49 1.827 12.754 -23.027 1.00 0.00 C ATOM 720 OG SER A 49 1.394 11.519 -23.579 1.00 0.00 O ATOM 0 H SER A 49 0.369 12.960 -21.039 1.00 0.00 H new ATOM 0 HA SER A 49 1.072 14.782 -23.072 1.00 0.00 H new ATOM 0 HB2 SER A 49 2.636 13.161 -23.634 1.00 0.00 H new ATOM 0 HB3 SER A 49 2.231 12.585 -22.029 1.00 0.00 H new ATOM 0 HG SER A 49 0.975 10.977 -22.879 1.00 0.00 H new ATOM 726 N THR A 50 -1.566 13.167 -23.786 1.00 0.00 N ATOM 727 CA THR A 50 -2.578 12.908 -24.814 1.00 0.00 C ATOM 728 C THR A 50 -3.750 13.884 -24.695 1.00 0.00 C ATOM 729 O THR A 50 -4.179 14.461 -25.696 1.00 0.00 O ATOM 730 CB THR A 50 -3.084 11.463 -24.725 1.00 0.00 C ATOM 731 OG1 THR A 50 -3.441 11.126 -23.395 1.00 0.00 O ATOM 732 CG2 THR A 50 -2.069 10.442 -25.201 1.00 0.00 C ATOM 0 H THR A 50 -1.897 13.046 -22.829 1.00 0.00 H new ATOM 0 HA THR A 50 -2.107 13.056 -25.786 1.00 0.00 H new ATOM 0 HB THR A 50 -3.952 11.427 -25.383 1.00 0.00 H new ATOM 0 HG1 THR A 50 -2.750 11.449 -22.779 1.00 0.00 H new ATOM 0 HG21 THR A 50 -2.491 9.441 -25.111 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.817 10.638 -26.243 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.169 10.512 -24.591 1.00 0.00 H new ATOM 740 N LEU A 51 -4.254 14.080 -23.473 1.00 0.00 N ATOM 741 CA LEU A 51 -5.364 15.009 -23.247 1.00 0.00 C ATOM 742 C LEU A 51 -4.824 16.425 -23.036 1.00 0.00 C ATOM 743 O LEU A 51 -3.663 16.597 -22.665 1.00 0.00 O ATOM 744 CB LEU A 51 -6.215 14.601 -22.027 1.00 0.00 C ATOM 745 CG LEU A 51 -6.496 13.101 -21.846 1.00 0.00 C ATOM 746 CD1 LEU A 51 -6.650 12.392 -23.185 1.00 0.00 C ATOM 747 CD2 LEU A 51 -5.401 12.452 -21.013 1.00 0.00 C ATOM 0 H LEU A 51 -3.915 13.612 -22.632 1.00 0.00 H new ATOM 0 HA LEU A 51 -6.002 14.978 -24.131 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -5.716 14.963 -21.128 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -7.171 15.120 -22.092 1.00 0.00 H new ATOM 0 HG LEU A 51 -7.443 13.002 -21.315 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -6.848 11.334 -23.016 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -7.481 12.833 -23.737 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -5.732 12.502 -23.763 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -5.615 11.390 -20.894 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -4.441 12.575 -21.515 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -5.361 12.926 -20.032 1.00 0.00 H new ATOM 759 N PRO A 52 -5.663 17.456 -23.275 1.00 0.00 N ATOM 760 CA PRO A 52 -5.277 18.866 -23.110 1.00 0.00 C ATOM 761 C PRO A 52 -4.394 19.116 -21.880 1.00 0.00 C ATOM 762 O PRO A 52 -4.494 18.399 -20.880 1.00 0.00 O ATOM 763 CB PRO A 52 -6.624 19.559 -22.947 1.00 0.00 C ATOM 764 CG PRO A 52 -7.563 18.749 -23.775 1.00 0.00 C ATOM 765 CD PRO A 52 -7.060 17.329 -23.735 1.00 0.00 C ATOM 0 HA PRO A 52 -4.677 19.224 -23.947 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -6.935 19.582 -21.902 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -6.583 20.593 -23.290 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -8.578 18.811 -23.382 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -7.594 19.120 -24.799 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -7.650 16.716 -23.054 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -7.115 16.858 -24.717 1.00 0.00 H new ATOM 773 N ALA A 53 -3.527 20.135 -21.978 1.00 0.00 N ATOM 774 CA ALA A 53 -2.599 20.506 -20.897 1.00 0.00 C ATOM 775 C ALA A 53 -3.180 20.244 -19.505 1.00 0.00 C ATOM 776 O ALA A 53 -2.632 19.447 -18.740 1.00 0.00 O ATOM 777 CB ALA A 53 -2.192 21.968 -21.032 1.00 0.00 C ATOM 0 H ALA A 53 -3.449 20.724 -22.807 1.00 0.00 H new ATOM 0 HA ALA A 53 -1.719 19.871 -20.999 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -1.506 22.230 -20.227 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -1.700 22.122 -21.993 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -3.079 22.599 -20.973 1.00 0.00 H new ATOM 783 N GLU A 54 -4.291 20.911 -19.186 1.00 0.00 N ATOM 784 CA GLU A 54 -4.945 20.741 -17.890 1.00 0.00 C ATOM 785 C GLU A 54 -6.022 19.662 -17.967 1.00 0.00 C ATOM 786 O GLU A 54 -6.868 19.683 -18.864 1.00 0.00 O ATOM 787 CB GLU A 54 -5.551 22.064 -17.418 1.00 0.00 C ATOM 788 CG GLU A 54 -4.958 22.563 -16.108 1.00 0.00 C ATOM 789 CD GLU A 54 -5.173 24.053 -15.884 1.00 0.00 C ATOM 790 OE1 GLU A 54 -4.995 24.836 -16.841 1.00 0.00 O ATOM 791 OE2 GLU A 54 -5.512 24.437 -14.747 1.00 0.00 O ATOM 0 H GLU A 54 -4.755 21.573 -19.808 1.00 0.00 H new ATOM 0 HA GLU A 54 -4.193 20.426 -17.167 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -5.401 22.820 -18.189 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -6.627 21.941 -17.298 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -5.403 22.010 -15.281 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -3.889 22.350 -16.096 1.00 0.00 H new ATOM 798 N VAL A 55 -5.983 18.718 -17.024 1.00 0.00 N ATOM 799 CA VAL A 55 -6.952 17.628 -16.990 1.00 0.00 C ATOM 800 C VAL A 55 -8.203 18.029 -16.207 1.00 0.00 C ATOM 801 O VAL A 55 -8.310 17.774 -15.008 1.00 0.00 O ATOM 802 CB VAL A 55 -6.338 16.346 -16.375 1.00 0.00 C ATOM 803 CG1 VAL A 55 -7.349 15.208 -16.351 1.00 0.00 C ATOM 804 CG2 VAL A 55 -5.090 15.934 -17.145 1.00 0.00 C ATOM 0 H VAL A 55 -5.290 18.689 -16.276 1.00 0.00 H new ATOM 0 HA VAL A 55 -7.235 17.417 -18.021 1.00 0.00 H new ATOM 0 HB VAL A 55 -6.058 16.567 -15.345 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -6.889 14.322 -15.914 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -8.212 15.501 -15.753 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -7.671 14.986 -17.368 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -4.670 15.032 -16.701 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -5.352 15.739 -18.185 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -4.354 16.737 -17.101 1.00 0.00 H new ATOM 814 N ASP A 56 -9.151 18.655 -16.902 1.00 0.00 N ATOM 815 CA ASP A 56 -10.404 19.086 -16.279 1.00 0.00 C ATOM 816 C ASP A 56 -11.402 17.929 -16.217 1.00 0.00 C ATOM 817 O ASP A 56 -11.095 16.817 -16.647 1.00 0.00 O ATOM 818 CB ASP A 56 -11.015 20.274 -17.038 1.00 0.00 C ATOM 819 CG ASP A 56 -11.075 20.049 -18.538 1.00 0.00 C ATOM 820 OD1 ASP A 56 -12.015 19.367 -19.001 1.00 0.00 O ATOM 821 OD2 ASP A 56 -10.180 20.554 -19.248 1.00 0.00 O ATOM 0 H ASP A 56 -9.077 18.875 -17.895 1.00 0.00 H new ATOM 0 HA ASP A 56 -10.179 19.407 -15.262 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -12.022 20.459 -16.663 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -10.429 21.170 -16.833 1.00 0.00 H new ATOM 826 N MET A 57 -12.592 18.202 -15.675 1.00 0.00 N ATOM 827 CA MET A 57 -13.652 17.190 -15.549 1.00 0.00 C ATOM 828 C MET A 57 -13.758 16.312 -16.802 1.00 0.00 C ATOM 829 O MET A 57 -13.841 15.089 -16.703 1.00 0.00 O ATOM 830 CB MET A 57 -15.000 17.864 -15.271 1.00 0.00 C ATOM 831 CG MET A 57 -15.351 17.937 -13.793 1.00 0.00 C ATOM 832 SD MET A 57 -16.328 19.396 -13.383 1.00 0.00 S ATOM 833 CE MET A 57 -15.093 20.424 -12.591 1.00 0.00 C ATOM 0 H MET A 57 -12.849 19.120 -15.314 1.00 0.00 H new ATOM 0 HA MET A 57 -13.387 16.545 -14.711 1.00 0.00 H new ATOM 0 HB2 MET A 57 -14.984 18.873 -15.682 1.00 0.00 H new ATOM 0 HB3 MET A 57 -15.784 17.319 -15.796 1.00 0.00 H new ATOM 0 HG2 MET A 57 -15.905 17.042 -13.510 1.00 0.00 H new ATOM 0 HG3 MET A 57 -14.433 17.942 -13.205 1.00 0.00 H new ATOM 0 HE1 MET A 57 -15.495 21.426 -12.441 1.00 0.00 H new ATOM 0 HE2 MET A 57 -14.824 19.993 -11.627 1.00 0.00 H new ATOM 0 HE3 MET A 57 -14.207 20.480 -13.223 1.00 0.00 H new ATOM 843 N GLU A 58 -13.760 16.949 -17.977 1.00 0.00 N ATOM 844 CA GLU A 58 -13.864 16.237 -19.253 1.00 0.00 C ATOM 845 C GLU A 58 -12.608 15.415 -19.549 1.00 0.00 C ATOM 846 O GLU A 58 -12.698 14.230 -19.874 1.00 0.00 O ATOM 847 CB GLU A 58 -14.103 17.230 -20.391 1.00 0.00 C ATOM 848 CG GLU A 58 -14.710 16.602 -21.636 1.00 0.00 C ATOM 849 CD GLU A 58 -15.024 17.625 -22.710 1.00 0.00 C ATOM 850 OE1 GLU A 58 -14.099 17.988 -23.473 1.00 0.00 O ATOM 851 OE2 GLU A 58 -16.192 18.065 -22.788 1.00 0.00 O ATOM 0 H GLU A 58 -13.690 17.962 -18.070 1.00 0.00 H new ATOM 0 HA GLU A 58 -14.708 15.551 -19.177 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -14.762 18.022 -20.037 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -13.155 17.699 -20.657 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -14.020 15.859 -22.037 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -15.624 16.074 -21.364 1.00 0.00 H new ATOM 858 N GLN A 59 -11.442 16.057 -19.444 1.00 0.00 N ATOM 859 CA GLN A 59 -10.160 15.399 -19.709 1.00 0.00 C ATOM 860 C GLN A 59 -9.957 14.181 -18.807 1.00 0.00 C ATOM 861 O GLN A 59 -9.654 13.088 -19.292 1.00 0.00 O ATOM 862 CB GLN A 59 -9.010 16.392 -19.512 1.00 0.00 C ATOM 863 CG GLN A 59 -8.649 17.182 -20.763 1.00 0.00 C ATOM 864 CD GLN A 59 -9.858 17.566 -21.604 1.00 0.00 C ATOM 865 OE1 GLN A 59 -10.450 18.627 -21.411 1.00 0.00 O ATOM 866 NE2 GLN A 59 -10.230 16.703 -22.547 1.00 0.00 N ATOM 0 H GLN A 59 -11.359 17.038 -19.176 1.00 0.00 H new ATOM 0 HA GLN A 59 -10.170 15.053 -20.743 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -9.279 17.090 -18.719 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -8.129 15.848 -19.172 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -8.116 18.087 -20.471 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -7.965 16.591 -21.372 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -9.712 15.833 -22.675 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -11.033 16.911 -23.141 1.00 0.00 H new ATOM 875 N PHE A 60 -10.123 14.378 -17.498 1.00 0.00 N ATOM 876 CA PHE A 60 -9.958 13.301 -16.525 1.00 0.00 C ATOM 877 C PHE A 60 -10.937 12.157 -16.805 1.00 0.00 C ATOM 878 O PHE A 60 -10.538 10.994 -16.846 1.00 0.00 O ATOM 879 CB PHE A 60 -10.117 13.858 -15.097 1.00 0.00 C ATOM 880 CG PHE A 60 -11.229 13.244 -14.286 1.00 0.00 C ATOM 881 CD1 PHE A 60 -11.123 11.947 -13.816 1.00 0.00 C ATOM 882 CD2 PHE A 60 -12.372 13.969 -13.995 1.00 0.00 C ATOM 883 CE1 PHE A 60 -12.140 11.382 -13.068 1.00 0.00 C ATOM 884 CE2 PHE A 60 -13.391 13.412 -13.247 1.00 0.00 C ATOM 885 CZ PHE A 60 -13.275 12.116 -12.783 1.00 0.00 C ATOM 0 H PHE A 60 -10.373 15.278 -17.088 1.00 0.00 H new ATOM 0 HA PHE A 60 -8.953 12.888 -16.616 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -9.178 13.715 -14.562 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -10.287 14.933 -15.161 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -10.237 11.370 -14.035 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -12.468 14.982 -14.357 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -12.047 10.368 -12.707 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -14.277 13.989 -13.025 1.00 0.00 H new ATOM 0 HZ PHE A 60 -14.070 11.677 -12.198 1.00 0.00 H new ATOM 895 N LEU A 61 -12.214 12.497 -17.005 1.00 0.00 N ATOM 896 CA LEU A 61 -13.244 11.497 -17.292 1.00 0.00 C ATOM 897 C LEU A 61 -12.933 10.733 -18.583 1.00 0.00 C ATOM 898 O LEU A 61 -13.190 9.532 -18.676 1.00 0.00 O ATOM 899 CB LEU A 61 -14.623 12.160 -17.388 1.00 0.00 C ATOM 900 CG LEU A 61 -15.269 12.514 -16.042 1.00 0.00 C ATOM 901 CD1 LEU A 61 -16.627 13.168 -16.253 1.00 0.00 C ATOM 902 CD2 LEU A 61 -15.402 11.275 -15.169 1.00 0.00 C ATOM 0 H LEU A 61 -12.558 13.457 -16.973 1.00 0.00 H new ATOM 0 HA LEU A 61 -13.252 10.782 -16.470 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -14.531 13.071 -17.980 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -15.293 11.493 -17.931 1.00 0.00 H new ATOM 0 HG LEU A 61 -14.622 13.226 -15.530 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -17.068 13.411 -15.286 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -16.505 14.081 -16.836 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -17.282 12.481 -16.788 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -15.862 11.547 -14.219 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -16.025 10.538 -15.676 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -14.415 10.851 -14.986 1.00 0.00 H new ATOM 914 N GLN A 62 -12.373 11.438 -19.574 1.00 0.00 N ATOM 915 CA GLN A 62 -12.020 10.831 -20.859 1.00 0.00 C ATOM 916 C GLN A 62 -11.061 9.656 -20.670 1.00 0.00 C ATOM 917 O GLN A 62 -11.315 8.554 -21.160 1.00 0.00 O ATOM 918 CB GLN A 62 -11.387 11.877 -21.786 1.00 0.00 C ATOM 919 CG GLN A 62 -12.283 12.291 -22.942 1.00 0.00 C ATOM 920 CD GLN A 62 -11.914 11.600 -24.242 1.00 0.00 C ATOM 921 OE1 GLN A 62 -12.603 10.681 -24.686 1.00 0.00 O ATOM 922 NE2 GLN A 62 -10.821 12.038 -24.861 1.00 0.00 N ATOM 0 H GLN A 62 -12.155 12.432 -19.508 1.00 0.00 H new ATOM 0 HA GLN A 62 -12.936 10.455 -21.314 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -11.132 12.761 -21.201 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -10.454 11.479 -22.185 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -13.319 12.061 -22.694 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -12.219 13.371 -23.078 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -10.279 12.802 -24.458 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -10.525 11.610 -25.738 1.00 0.00 H new ATOM 931 N VAL A 63 -9.960 9.899 -19.954 1.00 0.00 N ATOM 932 CA VAL A 63 -8.961 8.854 -19.697 1.00 0.00 C ATOM 933 C VAL A 63 -9.477 7.828 -18.687 1.00 0.00 C ATOM 934 O VAL A 63 -9.227 6.629 -18.835 1.00 0.00 O ATOM 935 CB VAL A 63 -7.597 9.409 -19.199 1.00 0.00 C ATOM 936 CG1 VAL A 63 -6.519 9.158 -20.239 1.00 0.00 C ATOM 937 CG2 VAL A 63 -7.665 10.893 -18.858 1.00 0.00 C ATOM 0 H VAL A 63 -9.737 10.805 -19.543 1.00 0.00 H new ATOM 0 HA VAL A 63 -8.793 8.377 -20.663 1.00 0.00 H new ATOM 0 HB VAL A 63 -7.347 8.878 -18.280 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -5.568 9.551 -19.879 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -6.426 8.086 -20.415 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -6.789 9.656 -21.170 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -6.688 11.233 -18.515 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -7.955 11.457 -19.744 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -8.401 11.052 -18.070 1.00 0.00 H new ATOM 947 N LEU A 64 -10.201 8.302 -17.666 1.00 0.00 N ATOM 948 CA LEU A 64 -10.760 7.429 -16.634 1.00 0.00 C ATOM 949 C LEU A 64 -11.623 6.332 -17.253 1.00 0.00 C ATOM 950 O LEU A 64 -11.430 5.147 -16.970 1.00 0.00 O ATOM 951 CB LEU A 64 -11.600 8.244 -15.650 1.00 0.00 C ATOM 952 CG LEU A 64 -11.878 7.551 -14.317 1.00 0.00 C ATOM 953 CD1 LEU A 64 -10.954 8.083 -13.231 1.00 0.00 C ATOM 954 CD2 LEU A 64 -13.338 7.724 -13.917 1.00 0.00 C ATOM 0 H LEU A 64 -10.413 9.291 -17.535 1.00 0.00 H new ATOM 0 HA LEU A 64 -9.930 6.963 -16.104 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.090 9.187 -15.454 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -12.552 8.488 -16.122 1.00 0.00 H new ATOM 0 HG LEU A 64 -11.681 6.486 -14.437 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -11.169 7.576 -12.290 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.917 7.900 -13.513 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -11.113 9.155 -13.111 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -13.516 7.224 -12.965 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -13.564 8.785 -13.817 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -13.979 7.287 -14.682 1.00 0.00 H new ATOM 1165 N PHE A 79 -16.210 -4.561 -7.275 1.00 0.00 N ATOM 1166 CA PHE A 79 -15.208 -5.424 -6.649 1.00 0.00 C ATOM 1167 C PHE A 79 -15.660 -5.845 -5.244 1.00 0.00 C ATOM 1168 O PHE A 79 -15.491 -7.002 -4.849 1.00 0.00 O ATOM 1169 CB PHE A 79 -13.836 -4.718 -6.615 1.00 0.00 C ATOM 1170 CG PHE A 79 -13.376 -4.270 -5.249 1.00 0.00 C ATOM 1171 CD1 PHE A 79 -12.896 -5.188 -4.327 1.00 0.00 C ATOM 1172 CD2 PHE A 79 -13.422 -2.932 -4.894 1.00 0.00 C ATOM 1173 CE1 PHE A 79 -12.474 -4.779 -3.077 1.00 0.00 C ATOM 1174 CE2 PHE A 79 -13.000 -2.517 -3.645 1.00 0.00 C ATOM 1175 CZ PHE A 79 -12.526 -3.442 -2.735 1.00 0.00 C ATOM 0 HA PHE A 79 -15.102 -6.330 -7.246 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -13.088 -5.394 -7.029 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -13.877 -3.848 -7.270 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -12.852 -6.235 -4.589 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -13.792 -2.205 -5.601 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -12.104 -5.504 -2.368 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -13.041 -1.471 -3.381 1.00 0.00 H new ATOM 0 HZ PHE A 79 -12.197 -3.120 -1.758 1.00 0.00 H new ATOM 1185 N VAL A 80 -16.252 -4.899 -4.505 1.00 0.00 N ATOM 1186 CA VAL A 80 -16.746 -5.168 -3.156 1.00 0.00 C ATOM 1187 C VAL A 80 -17.848 -6.229 -3.185 1.00 0.00 C ATOM 1188 O VAL A 80 -17.906 -7.090 -2.311 1.00 0.00 O ATOM 1189 CB VAL A 80 -17.286 -3.883 -2.482 1.00 0.00 C ATOM 1190 CG1 VAL A 80 -17.950 -4.200 -1.147 1.00 0.00 C ATOM 1191 CG2 VAL A 80 -16.168 -2.865 -2.294 1.00 0.00 C ATOM 0 H VAL A 80 -16.399 -3.941 -4.822 1.00 0.00 H new ATOM 0 HA VAL A 80 -15.903 -5.538 -2.572 1.00 0.00 H new ATOM 0 HB VAL A 80 -18.041 -3.452 -3.140 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -18.320 -3.279 -0.697 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -18.783 -4.885 -1.308 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -17.223 -4.664 -0.480 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -16.568 -1.969 -1.819 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -15.388 -3.293 -1.664 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -15.747 -2.604 -3.265 1.00 0.00 H new ATOM 1201 N LYS A 81 -18.715 -6.161 -4.202 1.00 0.00 N ATOM 1202 CA LYS A 81 -19.812 -7.118 -4.353 1.00 0.00 C ATOM 1203 C LYS A 81 -19.290 -8.542 -4.562 1.00 0.00 C ATOM 1204 O LYS A 81 -19.855 -9.497 -4.027 1.00 0.00 O ATOM 1205 CB LYS A 81 -20.709 -6.718 -5.527 1.00 0.00 C ATOM 1206 CG LYS A 81 -22.195 -6.796 -5.213 1.00 0.00 C ATOM 1207 CD LYS A 81 -22.603 -5.788 -4.150 1.00 0.00 C ATOM 1208 CE LYS A 81 -22.539 -4.369 -4.682 1.00 0.00 C ATOM 1209 NZ LYS A 81 -23.516 -3.469 -4.006 1.00 0.00 N ATOM 0 H LYS A 81 -18.676 -5.451 -4.933 1.00 0.00 H new ATOM 0 HA LYS A 81 -20.393 -7.101 -3.431 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -20.463 -5.700 -5.831 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -20.491 -7.365 -6.377 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -22.768 -6.617 -6.123 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -22.442 -7.802 -4.874 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -23.615 -6.005 -3.809 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -21.948 -5.884 -3.284 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -21.531 -3.977 -4.545 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -22.735 -4.376 -5.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -23.436 -2.510 -4.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -24.481 -3.827 -4.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -23.314 -3.440 -2.986 1.00 0.00 H new ATOM 1223 N GLY A 82 -18.206 -8.675 -5.337 1.00 0.00 N ATOM 1224 CA GLY A 82 -17.623 -9.982 -5.600 1.00 0.00 C ATOM 1225 C GLY A 82 -17.110 -10.651 -4.338 1.00 0.00 C ATOM 1226 O GLY A 82 -17.391 -11.825 -4.096 1.00 0.00 O ATOM 0 H GLY A 82 -17.724 -7.896 -5.786 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -18.370 -10.622 -6.069 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -16.803 -9.875 -6.310 1.00 0.00 H new ATOM 1230 N PHE A 83 -16.364 -9.899 -3.528 1.00 0.00 N ATOM 1231 CA PHE A 83 -15.823 -10.429 -2.277 1.00 0.00 C ATOM 1232 C PHE A 83 -16.917 -10.547 -1.214 1.00 0.00 C ATOM 1233 O PHE A 83 -16.922 -11.494 -0.424 1.00 0.00 O ATOM 1234 CB PHE A 83 -14.686 -9.539 -1.763 1.00 0.00 C ATOM 1235 CG PHE A 83 -13.453 -9.574 -2.626 1.00 0.00 C ATOM 1236 CD1 PHE A 83 -12.892 -10.783 -3.014 1.00 0.00 C ATOM 1237 CD2 PHE A 83 -12.858 -8.398 -3.050 1.00 0.00 C ATOM 1238 CE1 PHE A 83 -11.762 -10.813 -3.807 1.00 0.00 C ATOM 1239 CE2 PHE A 83 -11.727 -8.424 -3.844 1.00 0.00 C ATOM 1240 CZ PHE A 83 -11.179 -9.632 -4.223 1.00 0.00 C ATOM 0 H PHE A 83 -16.122 -8.926 -3.715 1.00 0.00 H new ATOM 0 HA PHE A 83 -15.428 -11.425 -2.478 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -15.043 -8.511 -1.696 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -14.421 -9.851 -0.753 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -13.344 -11.710 -2.692 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -13.283 -7.449 -2.757 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -11.334 -11.760 -4.102 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -11.273 -7.499 -4.168 1.00 0.00 H new ATOM 0 HZ PHE A 83 -10.296 -9.654 -4.844 1.00 0.00 H new ATOM 1250 N GLN A 84 -17.842 -9.582 -1.203 1.00 0.00 N ATOM 1251 CA GLN A 84 -18.947 -9.572 -0.245 1.00 0.00 C ATOM 1252 C GLN A 84 -20.052 -10.544 -0.670 1.00 0.00 C ATOM 1253 O GLN A 84 -21.130 -10.127 -1.106 1.00 0.00 O ATOM 1254 CB GLN A 84 -19.508 -8.151 -0.099 1.00 0.00 C ATOM 1255 CG GLN A 84 -20.396 -7.961 1.121 1.00 0.00 C ATOM 1256 CD GLN A 84 -20.322 -6.553 1.683 1.00 0.00 C ATOM 1257 OE1 GLN A 84 -19.828 -6.342 2.790 1.00 0.00 O ATOM 1258 NE2 GLN A 84 -20.814 -5.578 0.922 1.00 0.00 N ATOM 0 H GLN A 84 -17.845 -8.795 -1.851 1.00 0.00 H new ATOM 0 HA GLN A 84 -18.565 -9.900 0.721 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -18.678 -7.447 -0.045 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -20.079 -7.903 -0.994 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -21.428 -8.188 0.853 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -20.103 -8.672 1.893 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -21.215 -5.796 0.010 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -20.790 -4.613 1.251 1.00 0.00 H new ATOM 1267 N VAL A 85 -19.778 -11.842 -0.536 1.00 0.00 N ATOM 1268 CA VAL A 85 -20.741 -12.880 -0.896 1.00 0.00 C ATOM 1269 C VAL A 85 -20.901 -13.882 0.245 1.00 0.00 C ATOM 1270 O VAL A 85 -21.987 -14.015 0.814 1.00 0.00 O ATOM 1271 CB VAL A 85 -20.323 -13.627 -2.185 1.00 0.00 C ATOM 1272 CG1 VAL A 85 -21.319 -14.728 -2.523 1.00 0.00 C ATOM 1273 CG2 VAL A 85 -20.188 -12.654 -3.348 1.00 0.00 C ATOM 0 H VAL A 85 -18.892 -12.200 -0.179 1.00 0.00 H new ATOM 0 HA VAL A 85 -21.694 -12.385 -1.082 1.00 0.00 H new ATOM 0 HB VAL A 85 -19.352 -14.090 -2.007 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -21.003 -15.238 -3.433 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -21.362 -15.444 -1.702 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -22.306 -14.291 -2.676 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -19.893 -13.198 -4.245 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -21.144 -12.159 -3.521 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -19.430 -11.907 -3.111 1.00 0.00 H new ATOM 1283 N PHE A 86 -19.812 -14.578 0.578 1.00 0.00 N ATOM 1284 CA PHE A 86 -19.828 -15.564 1.658 1.00 0.00 C ATOM 1285 C PHE A 86 -18.952 -15.119 2.840 1.00 0.00 C ATOM 1286 O PHE A 86 -18.493 -15.950 3.627 1.00 0.00 O ATOM 1287 CB PHE A 86 -19.355 -16.923 1.130 1.00 0.00 C ATOM 1288 CG PHE A 86 -20.004 -18.093 1.813 1.00 0.00 C ATOM 1289 CD1 PHE A 86 -21.350 -18.365 1.621 1.00 0.00 C ATOM 1290 CD2 PHE A 86 -19.270 -18.920 2.646 1.00 0.00 C ATOM 1291 CE1 PHE A 86 -21.950 -19.440 2.248 1.00 0.00 C ATOM 1292 CE2 PHE A 86 -19.864 -19.996 3.276 1.00 0.00 C ATOM 1293 CZ PHE A 86 -21.206 -20.256 3.076 1.00 0.00 C ATOM 0 H PHE A 86 -18.909 -14.476 0.115 1.00 0.00 H new ATOM 0 HA PHE A 86 -20.852 -15.653 2.020 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -19.559 -16.979 0.061 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -18.274 -16.995 1.253 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -21.936 -17.729 0.974 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -18.220 -18.721 2.805 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -22.999 -19.641 2.091 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -19.280 -20.633 3.924 1.00 0.00 H new ATOM 0 HZ PHE A 86 -21.673 -21.097 3.567 1.00 0.00 H new ATOM 1303 N ASP A 87 -18.726 -13.805 2.963 1.00 0.00 N ATOM 1304 CA ASP A 87 -17.911 -13.263 4.047 1.00 0.00 C ATOM 1305 C ASP A 87 -18.634 -12.111 4.749 1.00 0.00 C ATOM 1306 O ASP A 87 -18.281 -10.942 4.579 1.00 0.00 O ATOM 1307 CB ASP A 87 -16.548 -12.794 3.510 1.00 0.00 C ATOM 1308 CG ASP A 87 -15.373 -13.483 4.187 1.00 0.00 C ATOM 1309 OD1 ASP A 87 -15.449 -13.742 5.407 1.00 0.00 O ATOM 1310 OD2 ASP A 87 -14.371 -13.755 3.494 1.00 0.00 O ATOM 0 H ASP A 87 -19.097 -13.102 2.324 1.00 0.00 H new ATOM 0 HA ASP A 87 -17.744 -14.055 4.777 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -16.503 -12.981 2.437 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -16.460 -11.717 3.650 1.00 0.00 H new ATOM 1315 N LYS A 88 -19.649 -12.454 5.545 1.00 0.00 N ATOM 1316 CA LYS A 88 -20.422 -11.455 6.282 1.00 0.00 C ATOM 1317 C LYS A 88 -19.575 -10.827 7.390 1.00 0.00 C ATOM 1318 O LYS A 88 -19.595 -9.610 7.582 1.00 0.00 O ATOM 1319 CB LYS A 88 -21.687 -12.082 6.878 1.00 0.00 C ATOM 1320 CG LYS A 88 -22.786 -12.329 5.854 1.00 0.00 C ATOM 1321 CD LYS A 88 -24.139 -11.847 6.354 1.00 0.00 C ATOM 1322 CE LYS A 88 -24.268 -10.335 6.245 1.00 0.00 C ATOM 1323 NZ LYS A 88 -25.657 -9.870 6.516 1.00 0.00 N ATOM 0 H LYS A 88 -19.954 -13.416 5.695 1.00 0.00 H new ATOM 0 HA LYS A 88 -20.717 -10.673 5.583 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -21.425 -13.028 7.352 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -22.072 -11.429 7.661 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -22.538 -11.817 4.924 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -22.840 -13.394 5.628 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -24.932 -12.323 5.777 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -24.274 -12.151 7.392 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -23.584 -9.862 6.949 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -23.968 -10.017 5.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -25.699 -8.834 6.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -26.308 -10.301 5.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -25.935 -10.150 7.478 1.00 0.00 H new ATOM 1337 N ASP A 89 -18.828 -11.669 8.109 1.00 0.00 N ATOM 1338 CA ASP A 89 -17.967 -11.204 9.192 1.00 0.00 C ATOM 1339 C ASP A 89 -16.576 -10.845 8.663 1.00 0.00 C ATOM 1340 O ASP A 89 -16.163 -9.687 8.737 1.00 0.00 O ATOM 1341 CB ASP A 89 -17.862 -12.276 10.284 1.00 0.00 C ATOM 1342 CG ASP A 89 -16.762 -11.984 11.290 1.00 0.00 C ATOM 1343 OD1 ASP A 89 -16.969 -11.110 12.162 1.00 0.00 O ATOM 1344 OD2 ASP A 89 -15.692 -12.628 11.203 1.00 0.00 O ATOM 0 H ASP A 89 -18.804 -12.677 7.958 1.00 0.00 H new ATOM 0 HA ASP A 89 -18.411 -10.306 9.623 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -18.816 -12.351 10.806 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -17.676 -13.244 9.820 1.00 0.00 H new ATOM 1349 N ALA A 90 -15.863 -11.851 8.137 1.00 0.00 N ATOM 1350 CA ALA A 90 -14.513 -11.665 7.596 1.00 0.00 C ATOM 1351 C ALA A 90 -13.526 -11.251 8.693 1.00 0.00 C ATOM 1352 O ALA A 90 -12.836 -12.102 9.256 1.00 0.00 O ATOM 1353 CB ALA A 90 -14.519 -10.657 6.449 1.00 0.00 C ATOM 0 H ALA A 90 -16.205 -12.810 8.076 1.00 0.00 H new ATOM 0 HA ALA A 90 -14.178 -12.623 7.198 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -13.506 -10.537 6.065 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -15.169 -11.017 5.652 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -14.886 -9.697 6.811 1.00 0.00 H new ATOM 1359 N THR A 91 -13.470 -9.944 8.992 1.00 0.00 N ATOM 1360 CA THR A 91 -12.575 -9.402 10.022 1.00 0.00 C ATOM 1361 C THR A 91 -11.106 -9.492 9.589 1.00 0.00 C ATOM 1362 O THR A 91 -10.503 -8.480 9.227 1.00 0.00 O ATOM 1363 CB THR A 91 -12.790 -10.117 11.366 1.00 0.00 C ATOM 1364 OG1 THR A 91 -14.140 -10.004 11.780 1.00 0.00 O ATOM 1365 CG2 THR A 91 -11.922 -9.573 12.483 1.00 0.00 C ATOM 0 H THR A 91 -14.041 -9.238 8.528 1.00 0.00 H new ATOM 0 HA THR A 91 -12.821 -8.348 10.151 1.00 0.00 H new ATOM 0 HB THR A 91 -12.514 -11.156 11.188 1.00 0.00 H new ATOM 0 HG1 THR A 91 -14.259 -10.466 12.636 1.00 0.00 H new ATOM 0 HG21 THR A 91 -12.125 -10.123 13.402 1.00 0.00 H new ATOM 0 HG22 THR A 91 -10.871 -9.688 12.216 1.00 0.00 H new ATOM 0 HG23 THR A 91 -12.145 -8.517 12.635 1.00 0.00 H new ATOM 1373 N GLY A 92 -10.539 -10.700 9.629 1.00 0.00 N ATOM 1374 CA GLY A 92 -9.152 -10.889 9.238 1.00 0.00 C ATOM 1375 C GLY A 92 -8.893 -12.268 8.660 1.00 0.00 C ATOM 1376 O GLY A 92 -8.097 -13.034 9.206 1.00 0.00 O ATOM 0 H GLY A 92 -11.018 -11.550 9.926 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -8.879 -10.133 8.502 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -8.509 -10.736 10.105 1.00 0.00 H new ATOM 1380 N MET A 93 -9.567 -12.581 7.550 1.00 0.00 N ATOM 1381 CA MET A 93 -9.415 -13.875 6.885 1.00 0.00 C ATOM 1382 C MET A 93 -10.231 -13.922 5.595 1.00 0.00 C ATOM 1383 O MET A 93 -11.414 -13.569 5.585 1.00 0.00 O ATOM 1384 CB MET A 93 -9.840 -15.021 7.814 1.00 0.00 C ATOM 1385 CG MET A 93 -11.220 -14.840 8.433 1.00 0.00 C ATOM 1386 SD MET A 93 -11.459 -15.854 9.905 1.00 0.00 S ATOM 1387 CE MET A 93 -10.478 -14.951 11.101 1.00 0.00 C ATOM 0 H MET A 93 -10.226 -11.951 7.092 1.00 0.00 H new ATOM 0 HA MET A 93 -8.361 -13.999 6.637 1.00 0.00 H new ATOM 0 HB2 MET A 93 -9.825 -15.955 7.252 1.00 0.00 H new ATOM 0 HB3 MET A 93 -9.105 -15.118 8.613 1.00 0.00 H new ATOM 0 HG2 MET A 93 -11.363 -13.791 8.692 1.00 0.00 H new ATOM 0 HG3 MET A 93 -11.981 -15.093 7.695 1.00 0.00 H new ATOM 0 HE1 MET A 93 -10.743 -15.274 12.108 1.00 0.00 H new ATOM 0 HE2 MET A 93 -9.420 -15.145 10.924 1.00 0.00 H new ATOM 0 HE3 MET A 93 -10.673 -13.883 11.000 1.00 0.00 H new ATOM 1397 N ILE A 94 -9.593 -14.360 4.510 1.00 0.00 N ATOM 1398 CA ILE A 94 -10.260 -14.454 3.213 1.00 0.00 C ATOM 1399 C ILE A 94 -10.612 -15.905 2.881 1.00 0.00 C ATOM 1400 O ILE A 94 -9.877 -16.829 3.229 1.00 0.00 O ATOM 1401 CB ILE A 94 -9.389 -13.837 2.083 1.00 0.00 C ATOM 1402 CG1 ILE A 94 -10.253 -12.983 1.143 1.00 0.00 C ATOM 1403 CG2 ILE A 94 -8.631 -14.910 1.302 1.00 0.00 C ATOM 1404 CD1 ILE A 94 -11.118 -13.783 0.186 1.00 0.00 C ATOM 0 H ILE A 94 -8.617 -14.655 4.504 1.00 0.00 H new ATOM 0 HA ILE A 94 -11.185 -13.881 3.280 1.00 0.00 H new ATOM 0 HB ILE A 94 -8.646 -13.193 2.553 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -10.896 -12.340 1.744 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -9.601 -12.329 0.564 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -8.034 -14.438 0.521 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -7.976 -15.458 1.979 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -9.342 -15.600 0.848 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -11.694 -13.102 -0.440 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -10.483 -14.406 -0.444 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -11.799 -14.417 0.754 1.00 0.00 H new ATOM 1416 N GLY A 95 -11.739 -16.091 2.203 1.00 0.00 N ATOM 1417 CA GLY A 95 -12.176 -17.420 1.821 1.00 0.00 C ATOM 1418 C GLY A 95 -12.061 -17.645 0.327 1.00 0.00 C ATOM 1419 O GLY A 95 -13.041 -17.474 -0.397 1.00 0.00 O ATOM 0 H GLY A 95 -12.362 -15.338 1.909 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -11.578 -18.164 2.347 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -13.211 -17.565 2.131 1.00 0.00 H new ATOM 1423 N VAL A 96 -10.853 -18.001 -0.134 1.00 0.00 N ATOM 1424 CA VAL A 96 -10.584 -18.234 -1.562 1.00 0.00 C ATOM 1425 C VAL A 96 -11.757 -18.918 -2.277 1.00 0.00 C ATOM 1426 O VAL A 96 -12.069 -18.569 -3.414 1.00 0.00 O ATOM 1427 CB VAL A 96 -9.295 -19.069 -1.775 1.00 0.00 C ATOM 1428 CG1 VAL A 96 -9.152 -19.488 -3.233 1.00 0.00 C ATOM 1429 CG2 VAL A 96 -8.068 -18.284 -1.325 1.00 0.00 C ATOM 0 H VAL A 96 -10.040 -18.135 0.467 1.00 0.00 H new ATOM 0 HA VAL A 96 -10.445 -17.246 -2.001 1.00 0.00 H new ATOM 0 HB VAL A 96 -9.373 -19.971 -1.168 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.240 -20.072 -3.356 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -10.012 -20.091 -3.524 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -9.102 -18.600 -3.863 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -7.173 -18.886 -1.482 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.992 -17.364 -1.904 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -8.160 -18.040 -0.267 1.00 0.00 H new ATOM 1439 N GLY A 97 -12.406 -19.879 -1.607 1.00 0.00 N ATOM 1440 CA GLY A 97 -13.542 -20.574 -2.205 1.00 0.00 C ATOM 1441 C GLY A 97 -14.561 -19.617 -2.813 1.00 0.00 C ATOM 1442 O GLY A 97 -15.062 -19.852 -3.916 1.00 0.00 O ATOM 0 H GLY A 97 -12.165 -20.186 -0.665 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -13.182 -21.254 -2.977 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -14.030 -21.184 -1.445 1.00 0.00 H new ATOM 1446 N GLU A 98 -14.857 -18.528 -2.098 1.00 0.00 N ATOM 1447 CA GLU A 98 -15.807 -17.523 -2.575 1.00 0.00 C ATOM 1448 C GLU A 98 -15.142 -16.560 -3.565 1.00 0.00 C ATOM 1449 O GLU A 98 -15.766 -16.150 -4.544 1.00 0.00 O ATOM 1450 CB GLU A 98 -16.409 -16.744 -1.396 1.00 0.00 C ATOM 1451 CG GLU A 98 -15.567 -15.563 -0.932 1.00 0.00 C ATOM 1452 CD GLU A 98 -15.694 -15.300 0.552 1.00 0.00 C ATOM 1453 OE1 GLU A 98 -16.725 -14.734 0.965 1.00 0.00 O ATOM 1454 OE2 GLU A 98 -14.759 -15.657 1.301 1.00 0.00 O ATOM 0 H GLU A 98 -14.451 -18.321 -1.186 1.00 0.00 H new ATOM 0 HA GLU A 98 -16.610 -18.044 -3.095 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -17.397 -16.382 -1.681 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -16.550 -17.427 -0.558 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -14.521 -15.751 -1.175 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -15.867 -14.671 -1.482 1.00 0.00 H new ATOM 1461 N LEU A 99 -13.874 -16.205 -3.307 1.00 0.00 N ATOM 1462 CA LEU A 99 -13.138 -15.293 -4.186 1.00 0.00 C ATOM 1463 C LEU A 99 -13.024 -15.880 -5.595 1.00 0.00 C ATOM 1464 O LEU A 99 -13.167 -15.162 -6.586 1.00 0.00 O ATOM 1465 CB LEU A 99 -11.750 -14.965 -3.593 1.00 0.00 C ATOM 1466 CG LEU A 99 -10.540 -15.656 -4.243 1.00 0.00 C ATOM 1467 CD1 LEU A 99 -10.207 -15.023 -5.587 1.00 0.00 C ATOM 1468 CD2 LEU A 99 -9.331 -15.587 -3.318 1.00 0.00 C ATOM 0 H LEU A 99 -13.343 -16.535 -2.501 1.00 0.00 H new ATOM 0 HA LEU A 99 -13.693 -14.358 -4.261 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -11.600 -13.887 -3.655 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -11.762 -15.225 -2.535 1.00 0.00 H new ATOM 0 HG LEU A 99 -10.799 -16.701 -4.412 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -9.348 -15.530 -6.025 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -11.063 -15.116 -6.255 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -9.972 -13.968 -5.444 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -8.482 -16.080 -3.791 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -9.082 -14.544 -3.122 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -9.563 -16.087 -2.378 1.00 0.00 H new ATOM 1480 N ARG A 100 -12.788 -17.194 -5.673 1.00 0.00 N ATOM 1481 CA ARG A 100 -12.675 -17.883 -6.957 1.00 0.00 C ATOM 1482 C ARG A 100 -14.054 -18.074 -7.591 1.00 0.00 C ATOM 1483 O ARG A 100 -14.203 -17.938 -8.801 1.00 0.00 O ATOM 1484 CB ARG A 100 -11.968 -19.237 -6.797 1.00 0.00 C ATOM 1485 CG ARG A 100 -12.683 -20.218 -5.880 1.00 0.00 C ATOM 1486 CD ARG A 100 -13.590 -21.160 -6.662 1.00 0.00 C ATOM 1487 NE ARG A 100 -13.432 -22.553 -6.242 1.00 0.00 N ATOM 1488 CZ ARG A 100 -14.277 -23.535 -6.567 1.00 0.00 C ATOM 1489 NH1 ARG A 100 -15.341 -23.290 -7.331 1.00 0.00 N ATOM 1490 NH2 ARG A 100 -14.054 -24.770 -6.131 1.00 0.00 N ATOM 0 H ARG A 100 -12.672 -17.799 -4.860 1.00 0.00 H new ATOM 0 HA ARG A 100 -12.072 -17.261 -7.618 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -11.858 -19.693 -7.781 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -10.963 -19.065 -6.411 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -11.947 -20.799 -5.324 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -13.274 -19.668 -5.148 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -14.628 -20.857 -6.528 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -13.368 -21.075 -7.726 1.00 0.00 H new ATOM 0 HE ARG A 100 -12.625 -22.789 -5.664 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -15.516 -22.345 -7.673 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -15.980 -24.047 -7.573 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -13.239 -24.966 -5.550 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -14.698 -25.522 -6.378 1.00 0.00 H new ATOM 1504 N TYR A 101 -15.062 -18.384 -6.770 1.00 0.00 N ATOM 1505 CA TYR A 101 -16.425 -18.581 -7.268 1.00 0.00 C ATOM 1506 C TYR A 101 -16.934 -17.336 -8.010 1.00 0.00 C ATOM 1507 O TYR A 101 -17.659 -17.448 -9.000 1.00 0.00 O ATOM 1508 CB TYR A 101 -17.366 -18.921 -6.108 1.00 0.00 C ATOM 1509 CG TYR A 101 -18.799 -19.155 -6.534 1.00 0.00 C ATOM 1510 CD1 TYR A 101 -19.193 -20.373 -7.073 1.00 0.00 C ATOM 1511 CD2 TYR A 101 -19.756 -18.157 -6.398 1.00 0.00 C ATOM 1512 CE1 TYR A 101 -20.500 -20.589 -7.467 1.00 0.00 C ATOM 1513 CE2 TYR A 101 -21.065 -18.366 -6.788 1.00 0.00 C ATOM 1514 CZ TYR A 101 -21.432 -19.583 -7.322 1.00 0.00 C ATOM 1515 OH TYR A 101 -22.735 -19.795 -7.713 1.00 0.00 O ATOM 0 H TYR A 101 -14.960 -18.503 -5.762 1.00 0.00 H new ATOM 0 HA TYR A 101 -16.408 -19.412 -7.974 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -16.997 -19.813 -5.602 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -17.341 -18.109 -5.381 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -18.466 -21.164 -7.186 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -19.472 -17.202 -5.981 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -20.790 -21.541 -7.886 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -21.797 -17.580 -6.675 1.00 0.00 H new ATOM 0 HH TYR A 101 -23.263 -18.987 -7.543 1.00 0.00 H new ATOM 1525 N VAL A 102 -16.547 -16.156 -7.517 1.00 0.00 N ATOM 1526 CA VAL A 102 -16.957 -14.883 -8.116 1.00 0.00 C ATOM 1527 C VAL A 102 -16.073 -14.501 -9.308 1.00 0.00 C ATOM 1528 O VAL A 102 -16.561 -13.957 -10.301 1.00 0.00 O ATOM 1529 CB VAL A 102 -16.902 -13.742 -7.075 1.00 0.00 C ATOM 1530 CG1 VAL A 102 -17.479 -12.453 -7.650 1.00 0.00 C ATOM 1531 CG2 VAL A 102 -17.636 -14.138 -5.798 1.00 0.00 C ATOM 0 H VAL A 102 -15.946 -16.056 -6.699 1.00 0.00 H new ATOM 0 HA VAL A 102 -17.980 -15.019 -8.465 1.00 0.00 H new ATOM 0 HB VAL A 102 -15.856 -13.564 -6.826 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -17.429 -11.665 -6.899 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -16.903 -12.156 -8.526 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -18.518 -12.616 -7.937 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -17.584 -13.320 -5.080 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -18.679 -14.352 -6.030 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -17.170 -15.026 -5.371 1.00 0.00 H new ATOM 1541 N LEU A 103 -14.770 -14.763 -9.191 1.00 0.00 N ATOM 1542 CA LEU A 103 -13.812 -14.423 -10.244 1.00 0.00 C ATOM 1543 C LEU A 103 -13.815 -15.441 -11.390 1.00 0.00 C ATOM 1544 O LEU A 103 -13.877 -15.059 -12.557 1.00 0.00 O ATOM 1545 CB LEU A 103 -12.409 -14.297 -9.646 1.00 0.00 C ATOM 1546 CG LEU A 103 -12.003 -12.876 -9.249 1.00 0.00 C ATOM 1547 CD1 LEU A 103 -11.018 -12.905 -8.090 1.00 0.00 C ATOM 1548 CD2 LEU A 103 -11.409 -12.142 -10.442 1.00 0.00 C ATOM 0 H LEU A 103 -14.353 -15.211 -8.375 1.00 0.00 H new ATOM 0 HA LEU A 103 -14.118 -13.467 -10.670 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -12.346 -14.936 -8.766 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -11.687 -14.677 -10.368 1.00 0.00 H new ATOM 0 HG LEU A 103 -12.894 -12.339 -8.924 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -10.741 -11.885 -7.822 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -11.480 -13.393 -7.232 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -10.126 -13.458 -8.384 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -11.125 -11.133 -10.144 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -10.528 -12.677 -10.796 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -12.148 -12.090 -11.242 1.00 0.00 H new ATOM 1560 N THR A 104 -13.737 -16.731 -11.054 1.00 0.00 N ATOM 1561 CA THR A 104 -13.721 -17.800 -12.061 1.00 0.00 C ATOM 1562 C THR A 104 -14.910 -17.694 -13.022 1.00 0.00 C ATOM 1563 O THR A 104 -14.767 -17.945 -14.220 1.00 0.00 O ATOM 1564 CB THR A 104 -13.721 -19.178 -11.384 1.00 0.00 C ATOM 1565 OG1 THR A 104 -12.607 -19.311 -10.518 1.00 0.00 O ATOM 1566 CG2 THR A 104 -13.679 -20.332 -12.365 1.00 0.00 C ATOM 0 H THR A 104 -13.684 -17.063 -10.091 1.00 0.00 H new ATOM 0 HA THR A 104 -12.806 -17.683 -12.642 1.00 0.00 H new ATOM 0 HB THR A 104 -14.660 -19.227 -10.833 1.00 0.00 H new ATOM 0 HG1 THR A 104 -12.800 -18.867 -9.666 1.00 0.00 H new ATOM 0 HG21 THR A 104 -13.681 -21.275 -11.818 1.00 0.00 H new ATOM 0 HG22 THR A 104 -14.552 -20.288 -13.016 1.00 0.00 H new ATOM 0 HG23 THR A 104 -12.773 -20.264 -12.968 1.00 0.00 H new ATOM 1574 N SER A 105 -16.077 -17.327 -12.487 1.00 0.00 N ATOM 1575 CA SER A 105 -17.293 -17.190 -13.295 1.00 0.00 C ATOM 1576 C SER A 105 -17.137 -16.133 -14.400 1.00 0.00 C ATOM 1577 O SER A 105 -17.824 -16.198 -15.422 1.00 0.00 O ATOM 1578 CB SER A 105 -18.488 -16.842 -12.401 1.00 0.00 C ATOM 1579 OG SER A 105 -18.315 -15.581 -11.776 1.00 0.00 O ATOM 0 H SER A 105 -16.206 -17.119 -11.497 1.00 0.00 H new ATOM 0 HA SER A 105 -17.469 -18.150 -13.781 1.00 0.00 H new ATOM 0 HB2 SER A 105 -19.400 -16.832 -12.997 1.00 0.00 H new ATOM 0 HB3 SER A 105 -18.613 -17.613 -11.641 1.00 0.00 H new ATOM 0 HG SER A 105 -17.445 -15.556 -11.326 1.00 0.00 H new ATOM 1585 N LEU A 106 -16.241 -15.161 -14.189 1.00 0.00 N ATOM 1586 CA LEU A 106 -16.009 -14.097 -15.169 1.00 0.00 C ATOM 1587 C LEU A 106 -15.355 -14.638 -16.446 1.00 0.00 C ATOM 1588 O LEU A 106 -16.044 -14.910 -17.431 1.00 0.00 O ATOM 1589 CB LEU A 106 -15.141 -12.989 -14.561 1.00 0.00 C ATOM 1590 CG LEU A 106 -15.896 -11.946 -13.734 1.00 0.00 C ATOM 1591 CD1 LEU A 106 -14.925 -11.106 -12.916 1.00 0.00 C ATOM 1592 CD2 LEU A 106 -16.744 -11.060 -14.638 1.00 0.00 C ATOM 0 H LEU A 106 -15.666 -15.091 -13.349 1.00 0.00 H new ATOM 0 HA LEU A 106 -16.980 -13.682 -15.440 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -14.382 -13.450 -13.929 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -14.616 -12.478 -15.368 1.00 0.00 H new ATOM 0 HG LEU A 106 -16.560 -12.468 -13.045 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -15.481 -10.370 -12.335 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -14.364 -11.752 -12.241 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -14.234 -10.593 -13.585 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -17.274 -10.324 -14.033 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -16.100 -10.547 -15.352 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -17.466 -11.674 -15.176 1.00 0.00 H new ATOM 1604 N GLY A 107 -14.024 -14.784 -16.426 1.00 0.00 N ATOM 1605 CA GLY A 107 -13.308 -15.283 -17.591 1.00 0.00 C ATOM 1606 C GLY A 107 -12.303 -16.365 -17.242 1.00 0.00 C ATOM 1607 O GLY A 107 -11.162 -16.328 -17.707 1.00 0.00 O ATOM 0 H GLY A 107 -13.434 -14.565 -15.624 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -14.025 -15.677 -18.311 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -12.791 -14.455 -18.076 1.00 0.00 H new ATOM 1611 N GLU A 108 -12.731 -17.327 -16.423 1.00 0.00 N ATOM 1612 CA GLU A 108 -11.872 -18.436 -16.000 1.00 0.00 C ATOM 1613 C GLU A 108 -10.668 -17.929 -15.202 1.00 0.00 C ATOM 1614 O GLU A 108 -9.523 -18.285 -15.489 1.00 0.00 O ATOM 1615 CB GLU A 108 -11.406 -19.256 -17.207 1.00 0.00 C ATOM 1616 CG GLU A 108 -12.541 -19.771 -18.080 1.00 0.00 C ATOM 1617 CD GLU A 108 -12.766 -21.264 -17.927 1.00 0.00 C ATOM 1618 OE1 GLU A 108 -13.515 -21.660 -17.008 1.00 0.00 O ATOM 1619 OE2 GLU A 108 -12.195 -22.036 -18.726 1.00 0.00 O ATOM 0 H GLU A 108 -13.674 -17.361 -16.037 1.00 0.00 H new ATOM 0 HA GLU A 108 -12.462 -19.083 -15.350 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -10.742 -18.642 -17.816 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -10.820 -20.104 -16.853 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -13.459 -19.241 -17.825 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -12.322 -19.546 -19.124 1.00 0.00 H new ATOM 1626 N LYS A 109 -10.948 -17.102 -14.192 1.00 0.00 N ATOM 1627 CA LYS A 109 -9.911 -16.545 -13.326 1.00 0.00 C ATOM 1628 C LYS A 109 -9.278 -17.656 -12.469 1.00 0.00 C ATOM 1629 O LYS A 109 -9.007 -18.746 -12.977 1.00 0.00 O ATOM 1630 CB LYS A 109 -10.496 -15.421 -12.457 1.00 0.00 C ATOM 1631 CG LYS A 109 -11.128 -14.295 -13.262 1.00 0.00 C ATOM 1632 CD LYS A 109 -10.078 -13.443 -13.960 1.00 0.00 C ATOM 1633 CE LYS A 109 -10.534 -13.022 -15.350 1.00 0.00 C ATOM 1634 NZ LYS A 109 -11.438 -11.838 -15.309 1.00 0.00 N ATOM 0 H LYS A 109 -11.894 -16.802 -13.954 1.00 0.00 H new ATOM 0 HA LYS A 109 -9.122 -16.113 -13.942 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -11.246 -15.843 -11.788 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -9.705 -15.009 -11.830 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -11.807 -14.715 -14.004 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -11.726 -13.667 -12.602 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -9.870 -12.557 -13.360 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -9.146 -14.003 -14.036 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -9.662 -12.791 -15.962 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -11.049 -13.854 -15.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -11.724 -11.586 -16.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -12.283 -12.065 -14.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -10.939 -11.035 -14.875 1.00 0.00 H new ATOM 1648 N LEU A 110 -9.032 -17.389 -11.179 1.00 0.00 N ATOM 1649 CA LEU A 110 -8.432 -18.387 -10.290 1.00 0.00 C ATOM 1650 C LEU A 110 -9.400 -19.548 -10.034 1.00 0.00 C ATOM 1651 O LEU A 110 -10.013 -19.635 -8.969 1.00 0.00 O ATOM 1652 CB LEU A 110 -8.016 -17.743 -8.958 1.00 0.00 C ATOM 1653 CG LEU A 110 -7.107 -16.515 -9.075 1.00 0.00 C ATOM 1654 CD1 LEU A 110 -6.977 -15.815 -7.730 1.00 0.00 C ATOM 1655 CD2 LEU A 110 -5.737 -16.909 -9.607 1.00 0.00 C ATOM 0 H LEU A 110 -9.238 -16.496 -10.732 1.00 0.00 H new ATOM 0 HA LEU A 110 -7.544 -18.783 -10.782 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -8.917 -17.456 -8.416 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -7.507 -18.494 -8.355 1.00 0.00 H new ATOM 0 HG LEU A 110 -7.561 -15.820 -9.781 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -6.328 -14.946 -7.834 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -7.962 -15.494 -7.390 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -6.548 -16.503 -7.002 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -5.107 -16.023 -9.682 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -5.275 -17.625 -8.928 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -5.846 -17.362 -10.593 1.00 0.00 H new ATOM 1667 N SER A 111 -9.536 -20.432 -11.028 1.00 0.00 N ATOM 1668 CA SER A 111 -10.432 -21.588 -10.932 1.00 0.00 C ATOM 1669 C SER A 111 -9.932 -22.607 -9.902 1.00 0.00 C ATOM 1670 O SER A 111 -8.971 -22.349 -9.175 1.00 0.00 O ATOM 1671 CB SER A 111 -10.582 -22.252 -12.307 1.00 0.00 C ATOM 1672 OG SER A 111 -9.381 -22.893 -12.704 1.00 0.00 O ATOM 0 H SER A 111 -9.033 -20.368 -11.913 1.00 0.00 H new ATOM 0 HA SER A 111 -11.405 -21.230 -10.596 1.00 0.00 H new ATOM 0 HB2 SER A 111 -11.392 -22.981 -12.275 1.00 0.00 H new ATOM 0 HB3 SER A 111 -10.858 -21.501 -13.048 1.00 0.00 H new ATOM 0 HG SER A 111 -9.507 -23.308 -13.583 1.00 0.00 H new ATOM 1678 N ASN A 112 -10.600 -23.765 -9.851 1.00 0.00 N ATOM 1679 CA ASN A 112 -10.242 -24.836 -8.915 1.00 0.00 C ATOM 1680 C ASN A 112 -8.754 -25.180 -8.990 1.00 0.00 C ATOM 1681 O ASN A 112 -8.108 -25.369 -7.961 1.00 0.00 O ATOM 1682 CB ASN A 112 -11.071 -26.091 -9.193 1.00 0.00 C ATOM 1683 CG ASN A 112 -12.545 -25.911 -8.865 1.00 0.00 C ATOM 1684 OD1 ASN A 112 -13.130 -24.860 -9.127 1.00 0.00 O ATOM 1685 ND2 ASN A 112 -13.156 -26.943 -8.291 1.00 0.00 N ATOM 0 H ASN A 112 -11.395 -23.985 -10.450 1.00 0.00 H new ATOM 0 HA ASN A 112 -10.458 -24.472 -7.911 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -10.968 -26.363 -10.244 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -10.673 -26.920 -8.609 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -14.146 -26.881 -8.051 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -12.635 -27.797 -8.090 1.00 0.00 H new ATOM 1692 N GLU A 113 -8.217 -25.261 -10.211 1.00 0.00 N ATOM 1693 CA GLU A 113 -6.804 -25.586 -10.415 1.00 0.00 C ATOM 1694 C GLU A 113 -5.892 -24.502 -9.836 1.00 0.00 C ATOM 1695 O GLU A 113 -4.942 -24.806 -9.112 1.00 0.00 O ATOM 1696 CB GLU A 113 -6.512 -25.763 -11.904 1.00 0.00 C ATOM 1697 CG GLU A 113 -5.294 -26.627 -12.191 1.00 0.00 C ATOM 1698 CD GLU A 113 -5.233 -27.087 -13.635 1.00 0.00 C ATOM 1699 OE1 GLU A 113 -4.732 -26.314 -14.484 1.00 0.00 O ATOM 1700 OE2 GLU A 113 -5.685 -28.218 -13.917 1.00 0.00 O ATOM 0 H GLU A 113 -8.740 -25.106 -11.073 1.00 0.00 H new ATOM 0 HA GLU A 113 -6.600 -26.520 -9.891 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -7.383 -26.208 -12.385 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -6.365 -24.782 -12.355 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -4.391 -26.065 -11.954 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -5.309 -27.498 -11.536 1.00 0.00 H new ATOM 1707 N GLU A 114 -6.189 -23.240 -10.160 1.00 0.00 N ATOM 1708 CA GLU A 114 -5.396 -22.110 -9.670 1.00 0.00 C ATOM 1709 C GLU A 114 -5.360 -22.100 -8.142 1.00 0.00 C ATOM 1710 O GLU A 114 -4.284 -22.074 -7.539 1.00 0.00 O ATOM 1711 CB GLU A 114 -5.966 -20.789 -10.195 1.00 0.00 C ATOM 1712 CG GLU A 114 -5.812 -20.617 -11.700 1.00 0.00 C ATOM 1713 CD GLU A 114 -5.327 -19.233 -12.091 1.00 0.00 C ATOM 1714 OE1 GLU A 114 -4.188 -18.875 -11.723 1.00 0.00 O ATOM 1715 OE2 GLU A 114 -6.087 -18.507 -12.768 1.00 0.00 O ATOM 0 H GLU A 114 -6.972 -22.976 -10.759 1.00 0.00 H new ATOM 0 HA GLU A 114 -4.377 -22.222 -10.039 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -7.023 -20.731 -9.937 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -5.468 -19.961 -9.690 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -5.110 -21.362 -12.076 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -6.770 -20.810 -12.182 1.00 0.00 H new ATOM 1722 N MET A 115 -6.543 -22.137 -7.523 1.00 0.00 N ATOM 1723 CA MET A 115 -6.651 -22.149 -6.066 1.00 0.00 C ATOM 1724 C MET A 115 -6.094 -23.450 -5.477 1.00 0.00 C ATOM 1725 O MET A 115 -5.623 -23.461 -4.341 1.00 0.00 O ATOM 1726 CB MET A 115 -8.109 -21.948 -5.628 1.00 0.00 C ATOM 1727 CG MET A 115 -9.052 -23.054 -6.079 1.00 0.00 C ATOM 1728 SD MET A 115 -9.140 -24.421 -4.906 1.00 0.00 S ATOM 1729 CE MET A 115 -10.481 -23.879 -3.851 1.00 0.00 C ATOM 0 H MET A 115 -7.439 -22.159 -8.011 1.00 0.00 H new ATOM 0 HA MET A 115 -6.054 -21.321 -5.684 1.00 0.00 H new ATOM 0 HB2 MET A 115 -8.144 -21.877 -4.541 1.00 0.00 H new ATOM 0 HB3 MET A 115 -8.467 -20.997 -6.022 1.00 0.00 H new ATOM 0 HG2 MET A 115 -10.050 -22.639 -6.221 1.00 0.00 H new ATOM 0 HG3 MET A 115 -8.724 -23.433 -7.047 1.00 0.00 H new ATOM 0 HE1 MET A 115 -10.463 -24.445 -2.920 1.00 0.00 H new ATOM 0 HE2 MET A 115 -10.366 -22.817 -3.633 1.00 0.00 H new ATOM 0 HE3 MET A 115 -11.432 -24.044 -4.357 1.00 0.00 H new ATOM 1739 N ASP A 116 -6.141 -24.542 -6.257 1.00 0.00 N ATOM 1740 CA ASP A 116 -5.623 -25.837 -5.800 1.00 0.00 C ATOM 1741 C ASP A 116 -4.145 -25.722 -5.434 1.00 0.00 C ATOM 1742 O ASP A 116 -3.720 -26.201 -4.382 1.00 0.00 O ATOM 1743 CB ASP A 116 -5.808 -26.914 -6.879 1.00 0.00 C ATOM 1744 CG ASP A 116 -6.803 -27.984 -6.472 1.00 0.00 C ATOM 1745 OD1 ASP A 116 -6.547 -28.685 -5.468 1.00 0.00 O ATOM 1746 OD2 ASP A 116 -7.837 -28.126 -7.157 1.00 0.00 O ATOM 0 H ASP A 116 -6.530 -24.552 -7.200 1.00 0.00 H new ATOM 0 HA ASP A 116 -6.188 -26.130 -4.915 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -6.144 -26.443 -7.803 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -4.846 -27.380 -7.091 1.00 0.00 H new ATOM 1751 N GLU A 117 -3.374 -25.070 -6.309 1.00 0.00 N ATOM 1752 CA GLU A 117 -1.944 -24.872 -6.083 1.00 0.00 C ATOM 1753 C GLU A 117 -1.711 -23.898 -4.929 1.00 0.00 C ATOM 1754 O GLU A 117 -0.833 -24.116 -4.091 1.00 0.00 O ATOM 1755 CB GLU A 117 -1.268 -24.348 -7.355 1.00 0.00 C ATOM 1756 CG GLU A 117 -1.468 -25.245 -8.568 1.00 0.00 C ATOM 1757 CD GLU A 117 -0.370 -25.085 -9.601 1.00 0.00 C ATOM 1758 OE1 GLU A 117 -0.493 -24.191 -10.466 1.00 0.00 O ATOM 1759 OE2 GLU A 117 0.614 -25.854 -9.546 1.00 0.00 O ATOM 0 H GLU A 117 -3.720 -24.670 -7.182 1.00 0.00 H new ATOM 0 HA GLU A 117 -1.505 -25.835 -5.821 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -1.657 -23.355 -7.580 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -0.200 -24.237 -7.169 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -1.507 -26.285 -8.243 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -2.430 -25.018 -9.028 1.00 0.00 H new ATOM 1766 N LEU A 118 -2.507 -22.824 -4.891 1.00 0.00 N ATOM 1767 CA LEU A 118 -2.397 -21.814 -3.838 1.00 0.00 C ATOM 1768 C LEU A 118 -2.687 -22.423 -2.461 1.00 0.00 C ATOM 1769 O LEU A 118 -1.980 -22.143 -1.491 1.00 0.00 O ATOM 1770 CB LEU A 118 -3.344 -20.632 -4.131 1.00 0.00 C ATOM 1771 CG LEU A 118 -4.573 -20.495 -3.220 1.00 0.00 C ATOM 1772 CD1 LEU A 118 -4.187 -19.878 -1.882 1.00 0.00 C ATOM 1773 CD2 LEU A 118 -5.650 -19.663 -3.901 1.00 0.00 C ATOM 0 H LEU A 118 -3.235 -22.633 -5.580 1.00 0.00 H new ATOM 0 HA LEU A 118 -1.373 -21.440 -3.825 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.767 -19.709 -4.067 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -3.691 -20.720 -5.161 1.00 0.00 H new ATOM 0 HG LEU A 118 -4.973 -21.492 -3.033 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -5.073 -19.790 -1.253 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -3.452 -20.513 -1.387 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -3.760 -18.889 -2.047 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -6.514 -19.576 -3.242 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -5.259 -18.669 -4.119 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -5.950 -20.147 -4.830 1.00 0.00 H new ATOM 1785 N LEU A 119 -3.727 -23.258 -2.388 1.00 0.00 N ATOM 1786 CA LEU A 119 -4.112 -23.910 -1.138 1.00 0.00 C ATOM 1787 C LEU A 119 -3.086 -24.966 -0.724 1.00 0.00 C ATOM 1788 O LEU A 119 -2.860 -25.182 0.466 1.00 0.00 O ATOM 1789 CB LEU A 119 -5.498 -24.553 -1.274 1.00 0.00 C ATOM 1790 CG LEU A 119 -6.655 -23.731 -0.707 1.00 0.00 C ATOM 1791 CD1 LEU A 119 -7.976 -24.172 -1.321 1.00 0.00 C ATOM 1792 CD2 LEU A 119 -6.695 -23.859 0.806 1.00 0.00 C ATOM 0 H LEU A 119 -4.318 -23.498 -3.184 1.00 0.00 H new ATOM 0 HA LEU A 119 -4.147 -23.145 -0.362 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -5.691 -24.742 -2.330 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.482 -25.522 -0.774 1.00 0.00 H new ATOM 0 HG LEU A 119 -6.497 -22.683 -0.962 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -8.788 -23.575 -0.905 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -7.940 -24.032 -2.401 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.148 -25.225 -1.097 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -7.523 -23.269 1.199 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.833 -24.905 1.079 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.758 -23.494 1.227 1.00 0.00 H new ATOM 1804 N LYS A 120 -2.467 -25.617 -1.713 1.00 0.00 N ATOM 1805 CA LYS A 120 -1.459 -26.646 -1.446 1.00 0.00 C ATOM 1806 C LYS A 120 -0.243 -26.051 -0.734 1.00 0.00 C ATOM 1807 O LYS A 120 0.315 -26.672 0.173 1.00 0.00 O ATOM 1808 CB LYS A 120 -1.022 -27.319 -2.752 1.00 0.00 C ATOM 1809 CG LYS A 120 -1.618 -28.703 -2.955 1.00 0.00 C ATOM 1810 CD LYS A 120 -0.539 -29.753 -3.173 1.00 0.00 C ATOM 1811 CE LYS A 120 -0.921 -31.086 -2.547 1.00 0.00 C ATOM 1812 NZ LYS A 120 0.045 -32.163 -2.897 1.00 0.00 N ATOM 0 H LYS A 120 -2.646 -25.450 -2.703 1.00 0.00 H new ATOM 0 HA LYS A 120 -1.909 -27.394 -0.793 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -1.307 -26.684 -3.591 1.00 0.00 H new ATOM 0 HB3 LYS A 120 0.065 -27.396 -2.765 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -2.218 -28.972 -2.085 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -2.290 -28.688 -3.813 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -0.371 -29.887 -4.242 1.00 0.00 H new ATOM 0 HD3 LYS A 120 0.401 -29.405 -2.744 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -0.967 -30.978 -1.463 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -1.919 -31.371 -2.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -0.252 -33.054 -2.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 0.070 -32.285 -3.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 0.993 -31.904 -2.556 1.00 0.00 H new ATOM 1826 N GLY A 121 0.161 -24.848 -1.152 1.00 0.00 N ATOM 1827 CA GLY A 121 1.308 -24.186 -0.549 1.00 0.00 C ATOM 1828 C GLY A 121 1.034 -23.692 0.863 1.00 0.00 C ATOM 1829 O GLY A 121 1.829 -23.938 1.772 1.00 0.00 O ATOM 0 H GLY A 121 -0.289 -24.321 -1.900 1.00 0.00 H new ATOM 0 HA2 GLY A 121 2.151 -24.877 -0.529 1.00 0.00 H new ATOM 0 HA3 GLY A 121 1.603 -23.342 -1.173 1.00 0.00 H new ATOM 1833 N VAL A 122 -0.088 -22.992 1.046 1.00 0.00 N ATOM 1834 CA VAL A 122 -0.457 -22.459 2.357 1.00 0.00 C ATOM 1835 C VAL A 122 -1.139 -23.527 3.215 1.00 0.00 C ATOM 1836 O VAL A 122 -2.131 -24.124 2.796 1.00 0.00 O ATOM 1837 CB VAL A 122 -1.398 -21.239 2.232 1.00 0.00 C ATOM 1838 CG1 VAL A 122 -1.552 -20.543 3.575 1.00 0.00 C ATOM 1839 CG2 VAL A 122 -0.888 -20.263 1.179 1.00 0.00 C ATOM 0 H VAL A 122 -0.755 -22.782 0.303 1.00 0.00 H new ATOM 0 HA VAL A 122 0.469 -22.144 2.838 1.00 0.00 H new ATOM 0 HB VAL A 122 -2.377 -21.598 1.915 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -2.218 -19.687 3.467 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -1.972 -21.240 4.300 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -0.577 -20.202 3.922 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -1.568 -19.414 1.111 1.00 0.00 H new ATOM 0 HG22 VAL A 122 0.105 -19.911 1.459 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -0.836 -20.765 0.213 1.00 0.00 H new ATOM 1849 N PRO A 123 -0.618 -23.779 4.436 1.00 0.00 N ATOM 1850 CA PRO A 123 -1.187 -24.776 5.349 1.00 0.00 C ATOM 1851 C PRO A 123 -2.427 -24.253 6.087 1.00 0.00 C ATOM 1852 O PRO A 123 -2.462 -24.206 7.319 1.00 0.00 O ATOM 1853 CB PRO A 123 -0.038 -25.038 6.318 1.00 0.00 C ATOM 1854 CG PRO A 123 0.710 -23.751 6.377 1.00 0.00 C ATOM 1855 CD PRO A 123 0.564 -23.111 5.019 1.00 0.00 C ATOM 0 HA PRO A 123 -1.537 -25.668 4.830 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -0.408 -25.326 7.302 1.00 0.00 H new ATOM 0 HB3 PRO A 123 0.599 -25.850 5.967 1.00 0.00 H new ATOM 0 HG2 PRO A 123 0.308 -23.104 7.157 1.00 0.00 H new ATOM 0 HG3 PRO A 123 1.760 -23.922 6.615 1.00 0.00 H new ATOM 0 HD2 PRO A 123 0.415 -22.034 5.099 1.00 0.00 H new ATOM 0 HD3 PRO A 123 1.453 -23.266 4.407 1.00 0.00 H new ATOM 1863 N VAL A 124 -3.441 -23.856 5.315 1.00 0.00 N ATOM 1864 CA VAL A 124 -4.686 -23.330 5.873 1.00 0.00 C ATOM 1865 C VAL A 124 -5.904 -24.005 5.238 1.00 0.00 C ATOM 1866 O VAL A 124 -5.765 -24.886 4.385 1.00 0.00 O ATOM 1867 CB VAL A 124 -4.790 -21.799 5.671 1.00 0.00 C ATOM 1868 CG1 VAL A 124 -3.734 -21.071 6.492 1.00 0.00 C ATOM 1869 CG2 VAL A 124 -4.673 -21.434 4.195 1.00 0.00 C ATOM 0 H VAL A 124 -3.422 -23.890 4.296 1.00 0.00 H new ATOM 0 HA VAL A 124 -4.673 -23.547 6.941 1.00 0.00 H new ATOM 0 HB VAL A 124 -5.772 -21.480 6.021 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -3.827 -19.997 6.334 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -3.876 -21.296 7.549 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -2.742 -21.399 6.182 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -4.749 -20.353 4.080 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -3.710 -21.773 3.812 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -5.476 -21.916 3.636 1.00 0.00 H new ATOM 1879 N LYS A 125 -7.099 -23.580 5.655 1.00 0.00 N ATOM 1880 CA LYS A 125 -8.344 -24.132 5.126 1.00 0.00 C ATOM 1881 C LYS A 125 -9.168 -23.040 4.450 1.00 0.00 C ATOM 1882 O LYS A 125 -9.295 -21.932 4.978 1.00 0.00 O ATOM 1883 CB LYS A 125 -9.157 -24.789 6.242 1.00 0.00 C ATOM 1884 CG LYS A 125 -9.101 -26.309 6.223 1.00 0.00 C ATOM 1885 CD LYS A 125 -8.767 -26.875 7.594 1.00 0.00 C ATOM 1886 CE LYS A 125 -8.312 -28.324 7.505 1.00 0.00 C ATOM 1887 NZ LYS A 125 -6.843 -28.435 7.282 1.00 0.00 N ATOM 0 H LYS A 125 -7.229 -22.854 6.359 1.00 0.00 H new ATOM 0 HA LYS A 125 -8.093 -24.890 4.384 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -8.791 -24.432 7.205 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -10.196 -24.471 6.158 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -10.060 -26.705 5.889 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -8.353 -26.637 5.501 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -7.983 -26.274 8.055 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -9.642 -26.807 8.240 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -8.580 -28.845 8.424 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -8.841 -28.821 6.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -6.575 -29.438 7.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -6.590 -27.960 6.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -6.337 -27.984 8.071 1.00 0.00 H new ATOM 1901 N ASP A 126 -9.714 -23.361 3.273 1.00 0.00 N ATOM 1902 CA ASP A 126 -10.524 -22.416 2.496 1.00 0.00 C ATOM 1903 C ASP A 126 -9.681 -21.246 1.961 1.00 0.00 C ATOM 1904 O ASP A 126 -10.231 -20.236 1.517 1.00 0.00 O ATOM 1905 CB ASP A 126 -11.691 -21.880 3.339 1.00 0.00 C ATOM 1906 CG ASP A 126 -12.531 -22.989 3.947 1.00 0.00 C ATOM 1907 OD1 ASP A 126 -13.349 -23.586 3.213 1.00 0.00 O ATOM 1908 OD2 ASP A 126 -12.370 -23.261 5.157 1.00 0.00 O ATOM 0 H ASP A 126 -9.609 -24.276 2.834 1.00 0.00 H new ATOM 0 HA ASP A 126 -10.923 -22.961 1.640 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -11.298 -21.248 4.136 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -12.325 -21.249 2.716 1.00 0.00 H new ATOM 1913 N GLY A 127 -8.348 -21.390 1.996 1.00 0.00 N ATOM 1914 CA GLY A 127 -7.462 -20.345 1.507 1.00 0.00 C ATOM 1915 C GLY A 127 -7.560 -19.065 2.316 1.00 0.00 C ATOM 1916 O GLY A 127 -7.824 -17.998 1.760 1.00 0.00 O ATOM 0 H GLY A 127 -7.871 -22.216 2.356 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -6.434 -20.706 1.530 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -7.701 -20.130 0.465 1.00 0.00 H new ATOM 1920 N MET A 128 -7.350 -19.168 3.629 1.00 0.00 N ATOM 1921 CA MET A 128 -7.423 -18.007 4.511 1.00 0.00 C ATOM 1922 C MET A 128 -6.028 -17.529 4.907 1.00 0.00 C ATOM 1923 O MET A 128 -5.291 -18.221 5.614 1.00 0.00 O ATOM 1924 CB MET A 128 -8.286 -18.330 5.746 1.00 0.00 C ATOM 1925 CG MET A 128 -7.689 -17.903 7.084 1.00 0.00 C ATOM 1926 SD MET A 128 -8.826 -18.149 8.462 1.00 0.00 S ATOM 1927 CE MET A 128 -9.189 -19.897 8.301 1.00 0.00 C ATOM 0 H MET A 128 -7.128 -20.044 4.103 1.00 0.00 H new ATOM 0 HA MET A 128 -7.900 -17.189 3.971 1.00 0.00 H new ATOM 0 HB2 MET A 128 -9.256 -17.847 5.628 1.00 0.00 H new ATOM 0 HB3 MET A 128 -8.466 -19.405 5.773 1.00 0.00 H new ATOM 0 HG2 MET A 128 -6.775 -18.468 7.267 1.00 0.00 H new ATOM 0 HG3 MET A 128 -7.408 -16.851 7.033 1.00 0.00 H new ATOM 0 HE1 MET A 128 -9.607 -20.270 9.236 1.00 0.00 H new ATOM 0 HE2 MET A 128 -9.909 -20.046 7.497 1.00 0.00 H new ATOM 0 HE3 MET A 128 -8.272 -20.439 8.072 1.00 0.00 H new ATOM 1937 N VAL A 129 -5.680 -16.336 4.431 1.00 0.00 N ATOM 1938 CA VAL A 129 -4.381 -15.729 4.713 1.00 0.00 C ATOM 1939 C VAL A 129 -4.514 -14.206 4.899 1.00 0.00 C ATOM 1940 O VAL A 129 -3.565 -13.453 4.662 1.00 0.00 O ATOM 1941 CB VAL A 129 -3.378 -16.034 3.575 1.00 0.00 C ATOM 1942 CG1 VAL A 129 -1.997 -15.483 3.899 1.00 0.00 C ATOM 1943 CG2 VAL A 129 -3.303 -17.531 3.304 1.00 0.00 C ATOM 0 H VAL A 129 -6.286 -15.765 3.842 1.00 0.00 H new ATOM 0 HA VAL A 129 -4.005 -16.161 5.640 1.00 0.00 H new ATOM 0 HB VAL A 129 -3.739 -15.538 2.674 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -1.313 -15.712 3.082 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -2.058 -14.403 4.029 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -1.630 -15.939 4.818 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -2.592 -17.720 2.500 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -2.977 -18.048 4.206 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -4.287 -17.898 3.011 1.00 0.00 H new ATOM 1953 N ASN A 130 -5.703 -13.755 5.324 1.00 0.00 N ATOM 1954 CA ASN A 130 -5.965 -12.328 5.536 1.00 0.00 C ATOM 1955 C ASN A 130 -5.759 -11.519 4.246 1.00 0.00 C ATOM 1956 O ASN A 130 -5.528 -10.307 4.300 1.00 0.00 O ATOM 1957 CB ASN A 130 -5.037 -11.795 6.635 1.00 0.00 C ATOM 1958 CG ASN A 130 -5.598 -10.580 7.355 1.00 0.00 C ATOM 1959 OD1 ASN A 130 -5.529 -9.458 6.854 1.00 0.00 O ATOM 1960 ND2 ASN A 130 -6.153 -10.795 8.544 1.00 0.00 N ATOM 0 H ASN A 130 -6.498 -14.361 5.527 1.00 0.00 H new ATOM 0 HA ASN A 130 -7.006 -12.215 5.840 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -4.853 -12.587 7.361 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -4.074 -11.536 6.195 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -6.541 -10.015 9.074 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -6.191 -11.740 8.926 1.00 0.00 H new ATOM 1967 N TYR A 131 -5.822 -12.192 3.088 1.00 0.00 N ATOM 1968 CA TYR A 131 -5.613 -11.532 1.798 1.00 0.00 C ATOM 1969 C TYR A 131 -4.273 -10.787 1.788 1.00 0.00 C ATOM 1970 O TYR A 131 -3.433 -11.015 2.663 1.00 0.00 O ATOM 1971 CB TYR A 131 -6.771 -10.580 1.475 1.00 0.00 C ATOM 1972 CG TYR A 131 -7.182 -10.628 0.021 1.00 0.00 C ATOM 1973 CD1 TYR A 131 -7.459 -11.840 -0.595 1.00 0.00 C ATOM 1974 CD2 TYR A 131 -7.278 -9.468 -0.740 1.00 0.00 C ATOM 1975 CE1 TYR A 131 -7.820 -11.901 -1.924 1.00 0.00 C ATOM 1976 CE2 TYR A 131 -7.643 -9.519 -2.071 1.00 0.00 C ATOM 1977 CZ TYR A 131 -7.912 -10.737 -2.660 1.00 0.00 C ATOM 1978 OH TYR A 131 -8.270 -10.791 -3.988 1.00 0.00 O ATOM 0 H TYR A 131 -6.016 -13.191 3.022 1.00 0.00 H new ATOM 0 HA TYR A 131 -5.585 -12.298 1.023 1.00 0.00 H new ATOM 0 HB2 TYR A 131 -7.628 -10.834 2.099 1.00 0.00 H new ATOM 0 HB3 TYR A 131 -6.480 -9.561 1.732 1.00 0.00 H new ATOM 0 HD1 TYR A 131 -7.390 -12.753 -0.022 1.00 0.00 H new ATOM 0 HD2 TYR A 131 -7.064 -8.513 -0.283 1.00 0.00 H new ATOM 0 HE1 TYR A 131 -8.030 -12.854 -2.387 1.00 0.00 H new ATOM 0 HE2 TYR A 131 -7.717 -8.609 -2.648 1.00 0.00 H new ATOM 0 HH TYR A 131 -9.240 -10.675 -4.070 1.00 0.00 H new ATOM 1988 N HIS A 132 -4.072 -9.907 0.796 1.00 0.00 N ATOM 1989 CA HIS A 132 -2.832 -9.132 0.666 1.00 0.00 C ATOM 1990 C HIS A 132 -1.666 -10.021 0.230 1.00 0.00 C ATOM 1991 O HIS A 132 -1.049 -9.767 -0.802 1.00 0.00 O ATOM 1992 CB HIS A 132 -2.487 -8.406 1.976 1.00 0.00 C ATOM 1993 CG HIS A 132 -3.417 -7.277 2.304 1.00 0.00 C ATOM 1994 ND1 HIS A 132 -2.959 -6.121 2.889 1.00 0.00 N ATOM 1995 CD2 HIS A 132 -4.756 -7.175 2.116 1.00 0.00 C ATOM 1996 CE1 HIS A 132 -4.019 -5.348 3.043 1.00 0.00 C ATOM 1997 NE2 HIS A 132 -5.131 -5.945 2.589 1.00 0.00 N ATOM 0 H HIS A 132 -4.759 -9.714 0.067 1.00 0.00 H new ATOM 0 HA HIS A 132 -2.999 -8.382 -0.107 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -2.501 -9.126 2.794 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -1.470 -8.019 1.909 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -5.403 -7.920 1.677 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -3.994 -4.360 3.479 1.00 0.00 H new ATOM 0 HE2 HIS A 132 -6.075 -5.558 2.595 1.00 0.00 H new ATOM 2005 N ASP A 133 -1.374 -11.065 1.015 1.00 0.00 N ATOM 2006 CA ASP A 133 -0.286 -11.996 0.702 1.00 0.00 C ATOM 2007 C ASP A 133 -0.408 -12.545 -0.723 1.00 0.00 C ATOM 2008 O ASP A 133 0.595 -12.699 -1.423 1.00 0.00 O ATOM 2009 CB ASP A 133 -0.286 -13.158 1.699 1.00 0.00 C ATOM 2010 CG ASP A 133 1.091 -13.767 1.883 1.00 0.00 C ATOM 2011 OD1 ASP A 133 1.453 -14.667 1.096 1.00 0.00 O ATOM 2012 OD2 ASP A 133 1.807 -13.343 2.816 1.00 0.00 O ATOM 0 H ASP A 133 -1.878 -11.286 1.874 1.00 0.00 H new ATOM 0 HA ASP A 133 0.652 -11.446 0.777 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -0.655 -12.806 2.662 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -0.977 -13.928 1.355 1.00 0.00 H new ATOM 2017 N PHE A 134 -1.643 -12.835 -1.146 1.00 0.00 N ATOM 2018 CA PHE A 134 -1.898 -13.362 -2.489 1.00 0.00 C ATOM 2019 C PHE A 134 -1.606 -12.301 -3.546 1.00 0.00 C ATOM 2020 O PHE A 134 -0.778 -12.510 -4.433 1.00 0.00 O ATOM 2021 CB PHE A 134 -3.351 -13.840 -2.630 1.00 0.00 C ATOM 2022 CG PHE A 134 -3.858 -14.648 -1.467 1.00 0.00 C ATOM 2023 CD1 PHE A 134 -3.440 -15.956 -1.277 1.00 0.00 C ATOM 2024 CD2 PHE A 134 -4.760 -14.101 -0.569 1.00 0.00 C ATOM 2025 CE1 PHE A 134 -3.915 -16.701 -0.215 1.00 0.00 C ATOM 2026 CE2 PHE A 134 -5.236 -14.840 0.495 1.00 0.00 C ATOM 2027 CZ PHE A 134 -4.814 -16.142 0.671 1.00 0.00 C ATOM 0 H PHE A 134 -2.481 -12.713 -0.577 1.00 0.00 H new ATOM 0 HA PHE A 134 -1.234 -14.213 -2.640 1.00 0.00 H new ATOM 0 HB2 PHE A 134 -3.995 -12.970 -2.760 1.00 0.00 H new ATOM 0 HB3 PHE A 134 -3.437 -14.439 -3.537 1.00 0.00 H new ATOM 0 HD1 PHE A 134 -2.736 -16.397 -1.967 1.00 0.00 H new ATOM 0 HD2 PHE A 134 -5.095 -13.083 -0.703 1.00 0.00 H new ATOM 0 HE1 PHE A 134 -3.583 -17.720 -0.078 1.00 0.00 H new ATOM 0 HE2 PHE A 134 -5.937 -14.400 1.189 1.00 0.00 H new ATOM 0 HZ PHE A 134 -5.187 -16.723 1.501 1.00 0.00 H new ATOM 2037 N VAL A 135 -2.294 -11.161 -3.438 1.00 0.00 N ATOM 2038 CA VAL A 135 -2.120 -10.051 -4.377 1.00 0.00 C ATOM 2039 C VAL A 135 -0.674 -9.546 -4.384 1.00 0.00 C ATOM 2040 O VAL A 135 -0.173 -9.096 -5.417 1.00 0.00 O ATOM 2041 CB VAL A 135 -3.067 -8.871 -4.045 1.00 0.00 C ATOM 2042 CG1 VAL A 135 -3.040 -7.830 -5.156 1.00 0.00 C ATOM 2043 CG2 VAL A 135 -4.491 -9.365 -3.808 1.00 0.00 C ATOM 0 H VAL A 135 -2.980 -10.983 -2.705 1.00 0.00 H new ATOM 0 HA VAL A 135 -2.368 -10.438 -5.365 1.00 0.00 H new ATOM 0 HB VAL A 135 -2.713 -8.403 -3.127 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -3.712 -7.010 -4.903 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -2.026 -7.446 -5.270 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -3.362 -8.288 -6.091 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -5.136 -8.518 -3.577 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -4.857 -9.865 -4.705 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -4.499 -10.066 -2.973 1.00 0.00 H new ATOM 2053 N GLN A 136 -0.007 -9.628 -3.228 1.00 0.00 N ATOM 2054 CA GLN A 136 1.381 -9.187 -3.099 1.00 0.00 C ATOM 2055 C GLN A 136 2.292 -9.994 -4.023 1.00 0.00 C ATOM 2056 O GLN A 136 3.015 -9.425 -4.842 1.00 0.00 O ATOM 2057 CB GLN A 136 1.846 -9.324 -1.644 1.00 0.00 C ATOM 2058 CG GLN A 136 3.233 -8.757 -1.386 1.00 0.00 C ATOM 2059 CD GLN A 136 3.406 -8.244 0.035 1.00 0.00 C ATOM 2060 OE1 GLN A 136 2.785 -8.748 0.971 1.00 0.00 O ATOM 2061 NE2 GLN A 136 4.257 -7.236 0.202 1.00 0.00 N ATOM 0 H GLN A 136 -0.410 -9.997 -2.367 1.00 0.00 H new ATOM 0 HA GLN A 136 1.438 -8.138 -3.391 1.00 0.00 H new ATOM 0 HB2 GLN A 136 1.131 -8.819 -0.995 1.00 0.00 H new ATOM 0 HB3 GLN A 136 1.838 -10.378 -1.368 1.00 0.00 H new ATOM 0 HG2 GLN A 136 3.978 -9.528 -1.582 1.00 0.00 H new ATOM 0 HG3 GLN A 136 3.424 -7.944 -2.086 1.00 0.00 H new ATOM 0 HE21 GLN A 136 4.751 -6.848 -0.601 1.00 0.00 H new ATOM 0 HE22 GLN A 136 4.415 -6.851 1.133 1.00 0.00 H new ATOM 2070 N MET A 137 2.238 -11.322 -3.893 1.00 0.00 N ATOM 2071 CA MET A 137 3.045 -12.215 -4.721 1.00 0.00 C ATOM 2072 C MET A 137 2.611 -12.149 -6.190 1.00 0.00 C ATOM 2073 O MET A 137 3.430 -12.331 -7.092 1.00 0.00 O ATOM 2074 CB MET A 137 2.934 -13.652 -4.204 1.00 0.00 C ATOM 2075 CG MET A 137 3.839 -14.635 -4.926 1.00 0.00 C ATOM 2076 SD MET A 137 5.587 -14.220 -4.770 1.00 0.00 S ATOM 2077 CE MET A 137 6.023 -15.129 -3.290 1.00 0.00 C ATOM 0 H MET A 137 1.641 -11.802 -3.219 1.00 0.00 H new ATOM 0 HA MET A 137 4.084 -11.890 -4.660 1.00 0.00 H new ATOM 0 HB2 MET A 137 3.174 -13.665 -3.141 1.00 0.00 H new ATOM 0 HB3 MET A 137 1.901 -13.985 -4.302 1.00 0.00 H new ATOM 0 HG2 MET A 137 3.671 -15.636 -4.528 1.00 0.00 H new ATOM 0 HG3 MET A 137 3.569 -14.662 -5.982 1.00 0.00 H new ATOM 0 HE1 MET A 137 7.078 -14.972 -3.064 1.00 0.00 H new ATOM 0 HE2 MET A 137 5.416 -14.778 -2.455 1.00 0.00 H new ATOM 0 HE3 MET A 137 5.841 -16.192 -3.449 1.00 0.00 H new