USER MOD reduce.3.24.130724 H: found=0, std=0, add=1221, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1213 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 105 MET CE :methyl -151:sc= -0.992 (180deg=-2.73!) USER MOD Set 1.2: A 120 MET CE :methyl 153:sc= -0.419 (180deg=-1.49) USER MOD Set 1.3: B 7 THR OG1 : rot -82:sc= 0.519 USER MOD Set 2.1: A 103 HIS : no HD1:sc= 0.174 K(o=0.35,f=-0.85) USER MOD Set 2.2: A 107 ASN : amide:sc= 0.174 K(o=0.35,f=-0.85) USER MOD Set 3.1: A 56 ASN : amide:sc= 0.534 K(o=1,f=-2.3!) USER MOD Set 3.2: A 58 THR OG1 : rot 24:sc= 0.465 USER MOD Single : A 1 THR N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 68:sc= 1.03 USER MOD Single : A 17 LYS NZ :NH3+ -164:sc= 0.368 (180deg=0.269) USER MOD Single : A 22 THR OG1 : rot -35:sc= 1.26 USER MOD Single : A 24 THR OG1 : rot -61:sc= 0.52 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0.00102 USER MOD Single : A 26 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00579) USER MOD Single : A 30 THR OG1 : rot 82:sc= 1.21 USER MOD Single : A 32 MET CE :methyl 137:sc= -0.119 (180deg=-4.92!) USER MOD Single : A 34 SER OG : rot 90:sc= 1.24 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0.0302 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 MET CE :methyl -133:sc= -0.522 (180deg=-1.26) USER MOD Single : A 49 ASN : amide:sc= -0.367 X(o=-0.37,f=-0.49) USER MOD Single : A 66 THR OG1 : rot 98:sc= 0.84 USER MOD Single : A 67 MET CE :methyl -140:sc= -0.422 (180deg=-0.775) USER MOD Single : A 68 MET CE :methyl -158:sc= -0.293 (180deg=-1.36!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 155:sc= 1.16 (180deg=0.758) USER MOD Single : A 75 THR OG1 : rot 70:sc= 0.229 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 167:sc= -0.0274 (180deg=-0.198) USER MOD Single : A 93 ASN : amide:sc= 0.342 K(o=0.34,f=-2.3!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0.00477 USER MOD Single : A 106 THR OG1 : rot 96:sc= 1.16 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 GLN : amide:sc= 0.0785 X(o=0.079,f=0) USER MOD Single : A 133 ASN : amide:sc= -0.0315 K(o=-0.032,f=-1.9!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc=-0.00856 X(o=-0.0086,f=0) USER MOD Single : A 140 MET CE :methyl -157:sc= -0.256 (180deg=-1.33!) USER MOD Single : A 141 MET CE :methyl 170:sc= 0 (180deg=-0.152) USER MOD Single : A 142 THR OG1 : rot -73:sc= 1.02 USER MOD Single : B 1 ARG N :NH3+ -162:sc= 0 (180deg=-0.267) USER MOD Single : B 3 LYS NZ :NH3+ 153:sc=-0.00937 (180deg=-0.23) USER MOD Single : B 5 GLN : amide:sc= 0.189 X(o=0.19,f=0) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 HIS : no HE2:sc= 0.053 K(o=0.053,f=-6!) USER MOD Single : B 18 SER OG : rot 108:sc= 1.24 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 4.601 5.233 15.775 1.00 0.00 N ATOM 2 CA THR A 1 3.240 4.872 16.233 1.00 0.00 C ATOM 3 C THR A 1 3.021 3.407 16.079 1.00 0.00 C ATOM 4 O THR A 1 3.168 2.801 15.018 1.00 0.00 O ATOM 5 CB THR A 1 2.061 5.657 15.739 1.00 0.00 C ATOM 6 OG1 THR A 1 0.778 5.258 16.199 1.00 0.00 O ATOM 7 CG2 THR A 1 1.961 5.744 14.207 1.00 0.00 C ATOM 0 H1 THR A 1 4.745 6.257 15.886 1.00 0.00 H new ATOM 0 H2 THR A 1 5.306 4.721 16.343 1.00 0.00 H new ATOM 0 H3 THR A 1 4.710 4.975 14.773 1.00 0.00 H new ATOM 0 HA THR A 1 3.259 5.177 17.279 1.00 0.00 H new ATOM 0 HB THR A 1 2.297 6.624 16.183 1.00 0.00 H new ATOM 0 HG1 THR A 1 0.095 5.844 15.811 1.00 0.00 H new ATOM 0 HG21 THR A 1 1.082 6.328 13.932 1.00 0.00 H new ATOM 0 HG22 THR A 1 2.855 6.226 13.811 1.00 0.00 H new ATOM 0 HG23 THR A 1 1.875 4.740 13.790 1.00 0.00 H new ATOM 14 N GLU A 2 2.742 2.702 17.190 1.00 0.00 N ATOM 15 CA GLU A 2 2.692 1.298 17.456 1.00 0.00 C ATOM 16 C GLU A 2 1.873 0.441 16.553 1.00 0.00 C ATOM 17 O GLU A 2 2.214 -0.716 16.311 1.00 0.00 O ATOM 18 CB GLU A 2 2.194 0.939 18.866 1.00 0.00 C ATOM 19 CG GLU A 2 2.835 1.778 19.973 1.00 0.00 C ATOM 20 CD GLU A 2 4.319 1.458 20.087 1.00 0.00 C ATOM 21 OE1 GLU A 2 4.744 0.314 20.401 1.00 0.00 O ATOM 22 OE2 GLU A 2 5.105 2.407 19.825 1.00 0.00 O ATOM 0 H GLU A 2 2.514 3.213 18.043 1.00 0.00 H new ATOM 0 HA GLU A 2 3.748 1.080 17.299 1.00 0.00 H new ATOM 0 HB2 GLU A 2 1.112 1.068 18.904 1.00 0.00 H new ATOM 0 HB3 GLU A 2 2.397 -0.115 19.057 1.00 0.00 H new ATOM 0 HG2 GLU A 2 2.700 2.838 19.759 1.00 0.00 H new ATOM 0 HG3 GLU A 2 2.339 1.579 20.923 1.00 0.00 H new ATOM 29 N GLU A 3 0.742 0.976 16.059 1.00 0.00 N ATOM 30 CA GLU A 3 -0.143 0.450 15.067 1.00 0.00 C ATOM 31 C GLU A 3 0.480 0.273 13.725 1.00 0.00 C ATOM 32 O GLU A 3 0.538 -0.842 13.208 1.00 0.00 O ATOM 33 CB GLU A 3 -1.417 1.291 14.884 1.00 0.00 C ATOM 34 CG GLU A 3 -2.058 1.654 16.225 1.00 0.00 C ATOM 35 CD GLU A 3 -3.244 2.552 15.903 1.00 0.00 C ATOM 36 OE1 GLU A 3 -3.135 3.794 15.724 1.00 0.00 O ATOM 37 OE2 GLU A 3 -4.393 2.036 15.918 1.00 0.00 O ATOM 0 H GLU A 3 0.414 1.881 16.396 1.00 0.00 H new ATOM 0 HA GLU A 3 -0.400 -0.530 15.468 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -1.175 2.203 14.339 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -2.133 0.737 14.277 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -2.381 0.759 16.756 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -1.345 2.168 16.870 1.00 0.00 H new ATOM 44 N GLN A 4 1.211 1.348 13.379 1.00 0.00 N ATOM 45 CA GLN A 4 1.970 1.361 12.167 1.00 0.00 C ATOM 46 C GLN A 4 3.208 0.533 12.221 1.00 0.00 C ATOM 47 O GLN A 4 3.630 -0.017 11.205 1.00 0.00 O ATOM 48 CB GLN A 4 2.357 2.787 11.742 1.00 0.00 C ATOM 49 CG GLN A 4 3.215 2.863 10.478 1.00 0.00 C ATOM 50 CD GLN A 4 3.520 4.303 10.091 1.00 0.00 C ATOM 51 OE1 GLN A 4 4.535 4.854 10.514 1.00 0.00 O ATOM 52 NE2 GLN A 4 2.549 5.007 9.449 1.00 0.00 N ATOM 0 H GLN A 4 1.277 2.202 13.933 1.00 0.00 H new ATOM 0 HA GLN A 4 1.300 0.920 11.429 1.00 0.00 H new ATOM 0 HB2 GLN A 4 1.446 3.364 11.583 1.00 0.00 H new ATOM 0 HB3 GLN A 4 2.897 3.262 12.561 1.00 0.00 H new ATOM 0 HG2 GLN A 4 4.149 2.324 10.639 1.00 0.00 H new ATOM 0 HG3 GLN A 4 2.698 2.367 9.657 1.00 0.00 H new ATOM 0 HE21 GLN A 4 1.715 4.530 9.106 1.00 0.00 H new ATOM 0 HE22 GLN A 4 2.655 6.012 9.310 1.00 0.00 H new ATOM 61 N ILE A 5 3.823 0.443 13.413 1.00 0.00 N ATOM 62 CA ILE A 5 4.862 -0.487 13.730 1.00 0.00 C ATOM 63 C ILE A 5 4.475 -1.909 13.506 1.00 0.00 C ATOM 64 O ILE A 5 5.187 -2.583 12.764 1.00 0.00 O ATOM 65 CB ILE A 5 5.567 -0.178 15.017 1.00 0.00 C ATOM 66 CG1 ILE A 5 6.426 1.072 14.764 1.00 0.00 C ATOM 67 CG2 ILE A 5 6.269 -1.428 15.574 1.00 0.00 C ATOM 68 CD1 ILE A 5 7.646 0.786 13.890 1.00 0.00 C ATOM 0 H ILE A 5 3.583 1.051 14.196 1.00 0.00 H new ATOM 0 HA ILE A 5 5.648 -0.338 12.989 1.00 0.00 H new ATOM 0 HB ILE A 5 4.893 0.077 15.835 1.00 0.00 H new ATOM 0 HG12 ILE A 5 5.814 1.837 14.286 1.00 0.00 H new ATOM 0 HG13 ILE A 5 6.757 1.479 15.719 1.00 0.00 H new ATOM 0 HG21 ILE A 5 6.773 -1.177 16.507 1.00 0.00 H new ATOM 0 HG22 ILE A 5 5.531 -2.208 15.759 1.00 0.00 H new ATOM 0 HG23 ILE A 5 7.002 -1.786 14.851 1.00 0.00 H new ATOM 0 HD11 ILE A 5 8.214 1.705 13.746 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.277 0.043 14.378 1.00 0.00 H new ATOM 0 HD13 ILE A 5 7.319 0.406 12.922 1.00 0.00 H new ATOM 80 N ALA A 6 3.284 -2.370 13.927 1.00 0.00 N ATOM 81 CA ALA A 6 2.683 -3.635 13.638 1.00 0.00 C ATOM 82 C ALA A 6 2.320 -3.871 12.212 1.00 0.00 C ATOM 83 O ALA A 6 2.453 -5.009 11.765 1.00 0.00 O ATOM 84 CB ALA A 6 1.438 -3.772 14.531 1.00 0.00 C ATOM 0 H ALA A 6 2.687 -1.801 14.527 1.00 0.00 H new ATOM 0 HA ALA A 6 3.437 -4.394 13.846 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.954 -4.729 14.336 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.735 -3.723 15.579 1.00 0.00 H new ATOM 0 HB3 ALA A 6 0.742 -2.962 14.312 1.00 0.00 H new ATOM 90 N GLU A 7 1.784 -2.862 11.502 1.00 0.00 N ATOM 91 CA GLU A 7 1.600 -2.958 10.087 1.00 0.00 C ATOM 92 C GLU A 7 2.774 -3.166 9.193 1.00 0.00 C ATOM 93 O GLU A 7 2.686 -3.748 8.112 1.00 0.00 O ATOM 94 CB GLU A 7 0.962 -1.653 9.582 1.00 0.00 C ATOM 95 CG GLU A 7 0.396 -1.597 8.161 1.00 0.00 C ATOM 96 CD GLU A 7 -0.234 -0.244 7.862 1.00 0.00 C ATOM 97 OE1 GLU A 7 -1.189 0.118 8.600 1.00 0.00 O ATOM 98 OE2 GLU A 7 0.173 0.347 6.826 1.00 0.00 O ATOM 0 H GLU A 7 1.478 -1.978 11.909 1.00 0.00 H new ATOM 0 HA GLU A 7 1.010 -3.871 10.015 1.00 0.00 H new ATOM 0 HB2 GLU A 7 0.154 -1.397 10.267 1.00 0.00 H new ATOM 0 HB3 GLU A 7 1.713 -0.867 9.667 1.00 0.00 H new ATOM 0 HG2 GLU A 7 1.192 -1.795 7.443 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -0.349 -2.382 8.034 1.00 0.00 H new ATOM 105 N PHE A 8 3.935 -2.588 9.547 1.00 0.00 N ATOM 106 CA PHE A 8 5.236 -2.654 8.956 1.00 0.00 C ATOM 107 C PHE A 8 5.625 -4.077 9.169 1.00 0.00 C ATOM 108 O PHE A 8 6.090 -4.713 8.225 1.00 0.00 O ATOM 109 CB PHE A 8 6.213 -1.632 9.560 1.00 0.00 C ATOM 110 CG PHE A 8 6.263 -0.274 8.950 1.00 0.00 C ATOM 111 CD1 PHE A 8 6.442 -0.221 7.587 1.00 0.00 C ATOM 112 CD2 PHE A 8 6.298 0.869 9.713 1.00 0.00 C ATOM 113 CE1 PHE A 8 6.482 1.015 6.986 1.00 0.00 C ATOM 114 CE2 PHE A 8 6.497 2.097 9.127 1.00 0.00 C ATOM 115 CZ PHE A 8 6.517 2.156 7.753 1.00 0.00 C ATOM 0 H PHE A 8 3.958 -1.987 10.370 1.00 0.00 H new ATOM 0 HA PHE A 8 5.251 -2.383 7.900 1.00 0.00 H new ATOM 0 HB2 PHE A 8 5.966 -1.516 10.615 1.00 0.00 H new ATOM 0 HB3 PHE A 8 7.215 -2.058 9.512 1.00 0.00 H new ATOM 0 HD1 PHE A 8 6.548 -1.125 7.005 1.00 0.00 H new ATOM 0 HD2 PHE A 8 6.168 0.802 10.783 1.00 0.00 H new ATOM 0 HE1 PHE A 8 6.486 1.090 5.909 1.00 0.00 H new ATOM 0 HE2 PHE A 8 6.633 2.986 9.726 1.00 0.00 H new ATOM 0 HZ PHE A 8 6.561 3.119 7.266 1.00 0.00 H new ATOM 125 N LYS A 9 5.459 -4.659 10.370 1.00 0.00 N ATOM 126 CA LYS A 9 5.906 -5.955 10.778 1.00 0.00 C ATOM 127 C LYS A 9 5.050 -6.982 10.120 1.00 0.00 C ATOM 128 O LYS A 9 5.619 -7.868 9.484 1.00 0.00 O ATOM 129 CB LYS A 9 5.826 -6.063 12.310 1.00 0.00 C ATOM 130 CG LYS A 9 6.980 -5.328 12.996 1.00 0.00 C ATOM 131 CD LYS A 9 6.911 -5.363 14.524 1.00 0.00 C ATOM 132 CE LYS A 9 8.096 -4.698 15.228 1.00 0.00 C ATOM 133 NZ LYS A 9 7.988 -4.871 16.694 1.00 0.00 N ATOM 0 H LYS A 9 4.967 -4.177 11.122 1.00 0.00 H new ATOM 0 HA LYS A 9 6.942 -6.117 10.481 1.00 0.00 H new ATOM 0 HB2 LYS A 9 4.878 -5.650 12.654 1.00 0.00 H new ATOM 0 HB3 LYS A 9 5.841 -7.113 12.601 1.00 0.00 H new ATOM 0 HG2 LYS A 9 7.923 -5.770 12.674 1.00 0.00 H new ATOM 0 HG3 LYS A 9 6.985 -4.289 12.665 1.00 0.00 H new ATOM 0 HD2 LYS A 9 5.992 -4.872 14.845 1.00 0.00 H new ATOM 0 HD3 LYS A 9 6.848 -6.402 14.849 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.030 -5.133 14.872 1.00 0.00 H new ATOM 0 HE3 LYS A 9 8.125 -3.637 14.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 8.799 -4.415 17.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 7.106 -4.435 17.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 7.983 -5.885 16.924 1.00 0.00 H new ATOM 147 N GLU A 10 3.712 -6.867 10.049 1.00 0.00 N ATOM 148 CA GLU A 10 2.796 -7.669 9.299 1.00 0.00 C ATOM 149 C GLU A 10 3.206 -7.845 7.877 1.00 0.00 C ATOM 150 O GLU A 10 3.423 -8.925 7.332 1.00 0.00 O ATOM 151 CB GLU A 10 1.389 -7.059 9.410 1.00 0.00 C ATOM 152 CG GLU A 10 0.367 -8.137 9.044 1.00 0.00 C ATOM 153 CD GLU A 10 -0.181 -9.027 10.151 1.00 0.00 C ATOM 154 OE1 GLU A 10 -0.003 -8.720 11.360 1.00 0.00 O ATOM 155 OE2 GLU A 10 -0.774 -10.069 9.762 1.00 0.00 O ATOM 0 H GLU A 10 3.225 -6.138 10.570 1.00 0.00 H new ATOM 0 HA GLU A 10 2.795 -8.672 9.726 1.00 0.00 H new ATOM 0 HB2 GLU A 10 1.212 -6.696 10.422 1.00 0.00 H new ATOM 0 HB3 GLU A 10 1.293 -6.203 8.743 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -0.479 -7.643 8.567 1.00 0.00 H new ATOM 0 HG3 GLU A 10 0.822 -8.784 8.294 1.00 0.00 H new ATOM 162 N ALA A 11 3.389 -6.699 7.196 1.00 0.00 N ATOM 163 CA ALA A 11 3.806 -6.592 5.832 1.00 0.00 C ATOM 164 C ALA A 11 5.114 -7.284 5.658 1.00 0.00 C ATOM 165 O ALA A 11 5.216 -8.173 4.814 1.00 0.00 O ATOM 166 CB ALA A 11 4.006 -5.137 5.375 1.00 0.00 C ATOM 0 H ALA A 11 3.235 -5.788 7.628 1.00 0.00 H new ATOM 0 HA ALA A 11 3.013 -7.042 5.235 1.00 0.00 H new ATOM 0 HB1 ALA A 11 4.322 -5.123 4.332 1.00 0.00 H new ATOM 0 HB2 ALA A 11 3.068 -4.591 5.477 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.770 -4.664 5.992 1.00 0.00 H new ATOM 172 N PHE A 12 6.121 -6.979 6.497 1.00 0.00 N ATOM 173 CA PHE A 12 7.367 -7.677 6.425 1.00 0.00 C ATOM 174 C PHE A 12 7.328 -9.162 6.533 1.00 0.00 C ATOM 175 O PHE A 12 8.028 -9.883 5.824 1.00 0.00 O ATOM 176 CB PHE A 12 8.348 -7.021 7.411 1.00 0.00 C ATOM 177 CG PHE A 12 9.779 -7.063 6.996 1.00 0.00 C ATOM 178 CD1 PHE A 12 10.512 -8.218 7.135 1.00 0.00 C ATOM 179 CD2 PHE A 12 10.411 -5.988 6.417 1.00 0.00 C ATOM 180 CE1 PHE A 12 11.832 -8.264 6.754 1.00 0.00 C ATOM 181 CE2 PHE A 12 11.756 -5.947 6.139 1.00 0.00 C ATOM 182 CZ PHE A 12 12.410 -7.156 6.180 1.00 0.00 C ATOM 0 H PHE A 12 6.074 -6.258 7.217 1.00 0.00 H new ATOM 0 HA PHE A 12 7.716 -7.566 5.398 1.00 0.00 H new ATOM 0 HB2 PHE A 12 8.056 -5.980 7.552 1.00 0.00 H new ATOM 0 HB3 PHE A 12 8.251 -7.513 8.379 1.00 0.00 H new ATOM 0 HD1 PHE A 12 10.045 -9.100 7.548 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.814 -5.124 6.166 1.00 0.00 H new ATOM 0 HE1 PHE A 12 12.411 -9.163 6.904 1.00 0.00 H new ATOM 0 HE2 PHE A 12 12.267 -5.025 5.904 1.00 0.00 H new ATOM 0 HZ PHE A 12 13.398 -7.237 5.752 1.00 0.00 H new ATOM 192 N SER A 13 6.445 -9.625 7.436 1.00 0.00 N ATOM 193 CA SER A 13 6.204 -11.007 7.714 1.00 0.00 C ATOM 194 C SER A 13 5.511 -11.874 6.720 1.00 0.00 C ATOM 195 O SER A 13 5.586 -13.095 6.842 1.00 0.00 O ATOM 196 CB SER A 13 5.377 -11.188 8.999 1.00 0.00 C ATOM 197 OG SER A 13 5.902 -10.570 10.165 1.00 0.00 O ATOM 0 H SER A 13 5.869 -9.002 8.002 1.00 0.00 H new ATOM 0 HA SER A 13 7.242 -11.339 7.747 1.00 0.00 H new ATOM 0 HB2 SER A 13 4.376 -10.795 8.822 1.00 0.00 H new ATOM 0 HB3 SER A 13 5.271 -12.255 9.193 1.00 0.00 H new ATOM 0 HG SER A 13 5.851 -9.596 10.070 1.00 0.00 H new ATOM 203 N LEU A 14 4.823 -11.303 5.715 1.00 0.00 N ATOM 204 CA LEU A 14 4.281 -11.911 4.540 1.00 0.00 C ATOM 205 C LEU A 14 5.424 -12.047 3.593 1.00 0.00 C ATOM 206 O LEU A 14 5.329 -13.036 2.868 1.00 0.00 O ATOM 207 CB LEU A 14 3.078 -11.115 4.006 1.00 0.00 C ATOM 208 CG LEU A 14 1.914 -11.232 5.004 1.00 0.00 C ATOM 209 CD1 LEU A 14 0.936 -10.055 4.854 1.00 0.00 C ATOM 210 CD2 LEU A 14 1.152 -12.529 4.683 1.00 0.00 C ATOM 0 H LEU A 14 4.627 -10.302 5.731 1.00 0.00 H new ATOM 0 HA LEU A 14 3.859 -12.899 4.726 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.351 -10.069 3.868 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.777 -11.498 3.031 1.00 0.00 H new ATOM 0 HG LEU A 14 2.312 -11.230 6.019 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.123 -10.164 5.572 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.462 -9.119 5.041 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.529 -10.047 3.843 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.318 -12.642 5.375 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.773 -12.485 3.662 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.825 -13.381 4.784 1.00 0.00 H new ATOM 222 N PHE A 15 6.443 -11.172 3.542 1.00 0.00 N ATOM 223 CA PHE A 15 7.529 -11.435 2.649 1.00 0.00 C ATOM 224 C PHE A 15 8.492 -12.391 3.262 1.00 0.00 C ATOM 225 O PHE A 15 8.863 -13.378 2.628 1.00 0.00 O ATOM 226 CB PHE A 15 8.200 -10.110 2.250 1.00 0.00 C ATOM 227 CG PHE A 15 7.225 -9.255 1.515 1.00 0.00 C ATOM 228 CD1 PHE A 15 6.848 -9.555 0.227 1.00 0.00 C ATOM 229 CD2 PHE A 15 6.872 -8.039 2.051 1.00 0.00 C ATOM 230 CE1 PHE A 15 6.032 -8.686 -0.457 1.00 0.00 C ATOM 231 CE2 PHE A 15 6.035 -7.171 1.390 1.00 0.00 C ATOM 232 CZ PHE A 15 5.532 -7.571 0.174 1.00 0.00 C ATOM 0 H PHE A 15 6.518 -10.317 4.093 1.00 0.00 H new ATOM 0 HA PHE A 15 7.151 -11.906 1.742 1.00 0.00 H new ATOM 0 HB2 PHE A 15 8.557 -9.590 3.139 1.00 0.00 H new ATOM 0 HB3 PHE A 15 9.071 -10.306 1.624 1.00 0.00 H new ATOM 0 HD1 PHE A 15 7.190 -10.465 -0.243 1.00 0.00 H new ATOM 0 HD2 PHE A 15 7.263 -7.758 3.018 1.00 0.00 H new ATOM 0 HE1 PHE A 15 5.783 -8.879 -1.490 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.782 -6.209 1.811 1.00 0.00 H new ATOM 0 HZ PHE A 15 4.738 -7.005 -0.289 1.00 0.00 H new ATOM 242 N ASP A 16 9.005 -12.115 4.475 1.00 0.00 N ATOM 243 CA ASP A 16 10.110 -12.799 5.070 1.00 0.00 C ATOM 244 C ASP A 16 9.608 -14.123 5.534 1.00 0.00 C ATOM 245 O ASP A 16 8.947 -14.306 6.555 1.00 0.00 O ATOM 246 CB ASP A 16 10.728 -11.947 6.192 1.00 0.00 C ATOM 247 CG ASP A 16 11.948 -12.543 6.879 1.00 0.00 C ATOM 248 OD1 ASP A 16 12.467 -13.594 6.415 1.00 0.00 O ATOM 249 OD2 ASP A 16 12.492 -11.937 7.841 1.00 0.00 O ATOM 0 H ASP A 16 8.629 -11.377 5.070 1.00 0.00 H new ATOM 0 HA ASP A 16 10.918 -12.963 4.357 1.00 0.00 H new ATOM 0 HB2 ASP A 16 11.005 -10.978 5.776 1.00 0.00 H new ATOM 0 HB3 ASP A 16 9.963 -11.763 6.946 1.00 0.00 H new ATOM 254 N LYS A 17 9.958 -15.154 4.744 1.00 0.00 N ATOM 255 CA LYS A 17 9.480 -16.498 4.848 1.00 0.00 C ATOM 256 C LYS A 17 10.014 -17.251 6.018 1.00 0.00 C ATOM 257 O LYS A 17 9.358 -18.109 6.606 1.00 0.00 O ATOM 258 CB LYS A 17 9.518 -17.337 3.560 1.00 0.00 C ATOM 259 CG LYS A 17 8.742 -16.787 2.361 1.00 0.00 C ATOM 260 CD LYS A 17 7.268 -16.514 2.664 1.00 0.00 C ATOM 261 CE LYS A 17 6.501 -16.315 1.355 1.00 0.00 C ATOM 262 NZ LYS A 17 5.156 -15.972 1.867 1.00 0.00 N ATOM 0 H LYS A 17 10.622 -15.039 3.979 1.00 0.00 H new ATOM 0 HA LYS A 17 8.419 -16.333 5.033 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.560 -17.460 3.264 1.00 0.00 H new ATOM 0 HB3 LYS A 17 9.132 -18.330 3.789 1.00 0.00 H new ATOM 0 HG2 LYS A 17 9.213 -15.863 2.026 1.00 0.00 H new ATOM 0 HG3 LYS A 17 8.810 -17.497 1.537 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.842 -17.346 3.224 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.174 -15.627 3.291 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.926 -15.518 0.745 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.492 -17.216 0.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.458 -16.071 1.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.908 -16.613 2.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 5.156 -14.991 2.211 1.00 0.00 H new ATOM 276 N ASP A 18 11.266 -16.980 6.426 1.00 0.00 N ATOM 277 CA ASP A 18 11.874 -17.631 7.545 1.00 0.00 C ATOM 278 C ASP A 18 11.648 -16.812 8.768 1.00 0.00 C ATOM 279 O ASP A 18 11.202 -17.424 9.737 1.00 0.00 O ATOM 280 CB ASP A 18 13.331 -18.078 7.337 1.00 0.00 C ATOM 281 CG ASP A 18 14.208 -17.236 6.422 1.00 0.00 C ATOM 282 OD1 ASP A 18 14.280 -15.982 6.528 1.00 0.00 O ATOM 283 OD2 ASP A 18 14.764 -17.886 5.497 1.00 0.00 O ATOM 0 H ASP A 18 11.869 -16.295 5.970 1.00 0.00 H new ATOM 0 HA ASP A 18 11.376 -18.592 7.675 1.00 0.00 H new ATOM 0 HB2 ASP A 18 13.811 -18.121 8.315 1.00 0.00 H new ATOM 0 HB3 ASP A 18 13.317 -19.095 6.944 1.00 0.00 H new ATOM 288 N GLY A 19 11.819 -15.485 8.626 1.00 0.00 N ATOM 289 CA GLY A 19 11.611 -14.510 9.650 1.00 0.00 C ATOM 290 C GLY A 19 12.789 -14.087 10.459 1.00 0.00 C ATOM 291 O GLY A 19 12.687 -14.122 11.684 1.00 0.00 O ATOM 0 H GLY A 19 12.120 -15.070 7.744 1.00 0.00 H new ATOM 0 HA2 GLY A 19 11.189 -13.620 9.184 1.00 0.00 H new ATOM 0 HA3 GLY A 19 10.857 -14.899 10.335 1.00 0.00 H new ATOM 295 N ASP A 20 13.897 -13.666 9.823 1.00 0.00 N ATOM 296 CA ASP A 20 15.108 -13.143 10.376 1.00 0.00 C ATOM 297 C ASP A 20 14.914 -11.685 10.612 1.00 0.00 C ATOM 298 O ASP A 20 15.191 -11.121 11.670 1.00 0.00 O ATOM 299 CB ASP A 20 16.477 -13.439 9.742 1.00 0.00 C ATOM 300 CG ASP A 20 16.519 -12.910 8.315 1.00 0.00 C ATOM 301 OD1 ASP A 20 15.761 -13.462 7.475 1.00 0.00 O ATOM 302 OD2 ASP A 20 17.269 -11.946 8.002 1.00 0.00 O ATOM 0 H ASP A 20 13.946 -13.697 8.805 1.00 0.00 H new ATOM 0 HA ASP A 20 15.230 -13.737 11.281 1.00 0.00 H new ATOM 0 HB2 ASP A 20 17.268 -12.976 10.333 1.00 0.00 H new ATOM 0 HB3 ASP A 20 16.663 -14.513 9.745 1.00 0.00 H new ATOM 307 N GLY A 21 14.376 -11.031 9.567 1.00 0.00 N ATOM 308 CA GLY A 21 14.267 -9.606 9.509 1.00 0.00 C ATOM 309 C GLY A 21 14.787 -9.028 8.239 1.00 0.00 C ATOM 310 O GLY A 21 14.894 -7.803 8.192 1.00 0.00 O ATOM 0 H GLY A 21 14.008 -11.504 8.742 1.00 0.00 H new ATOM 0 HA2 GLY A 21 13.221 -9.323 9.628 1.00 0.00 H new ATOM 0 HA3 GLY A 21 14.812 -9.172 10.348 1.00 0.00 H new ATOM 314 N THR A 22 15.203 -9.819 7.234 1.00 0.00 N ATOM 315 CA THR A 22 15.615 -9.460 5.912 1.00 0.00 C ATOM 316 C THR A 22 14.750 -10.196 4.948 1.00 0.00 C ATOM 317 O THR A 22 14.270 -11.289 5.245 1.00 0.00 O ATOM 318 CB THR A 22 17.074 -9.529 5.572 1.00 0.00 C ATOM 319 OG1 THR A 22 17.657 -10.811 5.752 1.00 0.00 O ATOM 320 CG2 THR A 22 17.844 -8.563 6.489 1.00 0.00 C ATOM 0 H THR A 22 15.255 -10.829 7.368 1.00 0.00 H new ATOM 0 HA THR A 22 15.473 -8.381 5.843 1.00 0.00 H new ATOM 0 HB THR A 22 17.143 -9.274 4.515 1.00 0.00 H new ATOM 0 HG1 THR A 22 17.245 -11.252 6.524 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.907 -8.605 6.251 1.00 0.00 H new ATOM 0 HG22 THR A 22 17.478 -7.548 6.337 1.00 0.00 H new ATOM 0 HG23 THR A 22 17.694 -8.851 7.529 1.00 0.00 H new ATOM 328 N ILE A 23 14.539 -9.607 3.757 1.00 0.00 N ATOM 329 CA ILE A 23 13.846 -10.257 2.689 1.00 0.00 C ATOM 330 C ILE A 23 14.885 -10.569 1.667 1.00 0.00 C ATOM 331 O ILE A 23 15.565 -9.652 1.207 1.00 0.00 O ATOM 332 CB ILE A 23 12.669 -9.523 2.119 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.733 -9.001 3.222 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.794 -10.440 1.248 1.00 0.00 C ATOM 335 CD1 ILE A 23 10.871 -7.799 2.836 1.00 0.00 C ATOM 0 H ILE A 23 14.855 -8.664 3.532 1.00 0.00 H new ATOM 0 HA ILE A 23 13.362 -11.153 3.078 1.00 0.00 H new ATOM 0 HB ILE A 23 13.099 -8.707 1.538 1.00 0.00 H new ATOM 0 HG12 ILE A 23 11.076 -9.813 3.532 1.00 0.00 H new ATOM 0 HG13 ILE A 23 12.336 -8.731 4.089 1.00 0.00 H new ATOM 0 HG21 ILE A 23 10.952 -9.872 0.853 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.387 -10.831 0.421 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.422 -11.268 1.851 1.00 0.00 H new ATOM 0 HD11 ILE A 23 10.249 -7.511 3.683 1.00 0.00 H new ATOM 0 HD12 ILE A 23 11.514 -6.964 2.557 1.00 0.00 H new ATOM 0 HD13 ILE A 23 10.234 -8.064 1.992 1.00 0.00 H new ATOM 347 N THR A 24 15.063 -11.838 1.261 1.00 0.00 N ATOM 348 CA THR A 24 15.912 -12.125 0.147 1.00 0.00 C ATOM 349 C THR A 24 15.136 -11.937 -1.111 1.00 0.00 C ATOM 350 O THR A 24 13.909 -12.015 -1.142 1.00 0.00 O ATOM 351 CB THR A 24 16.509 -13.501 0.156 1.00 0.00 C ATOM 352 OG1 THR A 24 15.561 -14.501 0.499 1.00 0.00 O ATOM 353 CG2 THR A 24 17.629 -13.584 1.207 1.00 0.00 C ATOM 0 H THR A 24 14.628 -12.652 1.694 1.00 0.00 H new ATOM 0 HA THR A 24 16.752 -11.433 0.216 1.00 0.00 H new ATOM 0 HB THR A 24 16.880 -13.676 -0.854 1.00 0.00 H new ATOM 0 HG1 THR A 24 15.218 -14.331 1.401 1.00 0.00 H new ATOM 0 HG21 THR A 24 18.056 -14.587 1.205 1.00 0.00 H new ATOM 0 HG22 THR A 24 18.407 -12.858 0.968 1.00 0.00 H new ATOM 0 HG23 THR A 24 17.219 -13.366 2.193 1.00 0.00 H new ATOM 361 N THR A 25 15.733 -11.862 -2.314 1.00 0.00 N ATOM 362 CA THR A 25 15.058 -12.024 -3.564 1.00 0.00 C ATOM 363 C THR A 25 14.223 -13.238 -3.790 1.00 0.00 C ATOM 364 O THR A 25 13.133 -13.164 -4.355 1.00 0.00 O ATOM 365 CB THR A 25 15.932 -11.914 -4.778 1.00 0.00 C ATOM 366 OG1 THR A 25 17.136 -12.633 -4.551 1.00 0.00 O ATOM 367 CG2 THR A 25 16.236 -10.419 -4.972 1.00 0.00 C ATOM 0 H THR A 25 16.731 -11.680 -2.420 1.00 0.00 H new ATOM 0 HA THR A 25 14.387 -11.173 -3.446 1.00 0.00 H new ATOM 0 HB THR A 25 15.447 -12.326 -5.663 1.00 0.00 H new ATOM 0 HG1 THR A 25 17.711 -12.566 -5.342 1.00 0.00 H new ATOM 0 HG21 THR A 25 16.872 -10.288 -5.847 1.00 0.00 H new ATOM 0 HG22 THR A 25 15.303 -9.874 -5.116 1.00 0.00 H new ATOM 0 HG23 THR A 25 16.749 -10.035 -4.090 1.00 0.00 H new ATOM 375 N LYS A 26 14.654 -14.424 -3.325 1.00 0.00 N ATOM 376 CA LYS A 26 13.830 -15.589 -3.416 1.00 0.00 C ATOM 377 C LYS A 26 12.544 -15.614 -2.664 1.00 0.00 C ATOM 378 O LYS A 26 11.492 -15.919 -3.224 1.00 0.00 O ATOM 379 CB LYS A 26 14.637 -16.830 -2.996 1.00 0.00 C ATOM 380 CG LYS A 26 15.994 -17.036 -3.671 1.00 0.00 C ATOM 381 CD LYS A 26 16.072 -17.114 -5.197 1.00 0.00 C ATOM 382 CE LYS A 26 17.481 -17.508 -5.645 1.00 0.00 C ATOM 383 NZ LYS A 26 18.407 -16.362 -5.505 1.00 0.00 N ATOM 0 H LYS A 26 15.564 -14.576 -2.890 1.00 0.00 H new ATOM 0 HA LYS A 26 13.534 -15.578 -4.465 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.798 -16.781 -1.919 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.026 -17.712 -3.187 1.00 0.00 H new ATOM 0 HG2 LYS A 26 16.645 -16.222 -3.352 1.00 0.00 H new ATOM 0 HG3 LYS A 26 16.419 -17.958 -3.275 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.350 -17.842 -5.567 1.00 0.00 H new ATOM 0 HD3 LYS A 26 15.803 -16.151 -5.630 1.00 0.00 H new ATOM 0 HE2 LYS A 26 17.838 -18.347 -5.048 1.00 0.00 H new ATOM 0 HE3 LYS A 26 17.460 -17.842 -6.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 19.351 -16.635 -5.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 18.055 -15.561 -6.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 18.466 -16.084 -4.505 1.00 0.00 H new ATOM 397 N GLU A 27 12.519 -15.172 -1.394 1.00 0.00 N ATOM 398 CA GLU A 27 11.397 -14.954 -0.535 1.00 0.00 C ATOM 399 C GLU A 27 10.414 -13.953 -1.038 1.00 0.00 C ATOM 400 O GLU A 27 9.208 -14.188 -0.987 1.00 0.00 O ATOM 401 CB GLU A 27 11.834 -14.403 0.833 1.00 0.00 C ATOM 402 CG GLU A 27 12.669 -15.416 1.619 1.00 0.00 C ATOM 403 CD GLU A 27 13.280 -14.859 2.896 1.00 0.00 C ATOM 404 OE1 GLU A 27 14.163 -13.960 2.893 1.00 0.00 O ATOM 405 OE2 GLU A 27 12.982 -15.425 3.981 1.00 0.00 O ATOM 0 H GLU A 27 13.390 -14.941 -0.917 1.00 0.00 H new ATOM 0 HA GLU A 27 10.937 -15.941 -0.480 1.00 0.00 H new ATOM 0 HB2 GLU A 27 12.413 -13.491 0.688 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.952 -14.132 1.413 1.00 0.00 H new ATOM 0 HG2 GLU A 27 12.041 -16.270 1.872 1.00 0.00 H new ATOM 0 HG3 GLU A 27 13.469 -15.787 0.978 1.00 0.00 H new ATOM 412 N LEU A 28 10.922 -12.818 -1.551 1.00 0.00 N ATOM 413 CA LEU A 28 10.220 -11.746 -2.185 1.00 0.00 C ATOM 414 C LEU A 28 9.536 -12.214 -3.424 1.00 0.00 C ATOM 415 O LEU A 28 8.330 -12.064 -3.608 1.00 0.00 O ATOM 416 CB LEU A 28 11.142 -10.560 -2.513 1.00 0.00 C ATOM 417 CG LEU A 28 10.615 -9.308 -3.234 1.00 0.00 C ATOM 418 CD1 LEU A 28 9.317 -8.722 -2.653 1.00 0.00 C ATOM 419 CD2 LEU A 28 11.633 -8.162 -3.352 1.00 0.00 C ATOM 0 H LEU A 28 11.925 -12.636 -1.517 1.00 0.00 H new ATOM 0 HA LEU A 28 9.471 -11.399 -1.473 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.574 -10.224 -1.570 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.960 -10.952 -3.117 1.00 0.00 H new ATOM 0 HG LEU A 28 10.408 -9.710 -4.226 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.025 -7.843 -3.228 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.525 -9.469 -2.706 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.479 -8.438 -1.613 1.00 0.00 H new ATOM 0 HD21 LEU A 28 11.176 -7.321 -3.874 1.00 0.00 H new ATOM 0 HD22 LEU A 28 11.942 -7.846 -2.356 1.00 0.00 H new ATOM 0 HD23 LEU A 28 12.504 -8.505 -3.911 1.00 0.00 H new ATOM 431 N GLY A 29 10.288 -12.677 -4.438 1.00 0.00 N ATOM 432 CA GLY A 29 9.710 -13.140 -5.661 1.00 0.00 C ATOM 433 C GLY A 29 8.687 -14.223 -5.652 1.00 0.00 C ATOM 434 O GLY A 29 7.785 -14.161 -6.486 1.00 0.00 O ATOM 0 H GLY A 29 11.306 -12.731 -4.410 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.260 -12.277 -6.151 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.529 -13.476 -6.297 1.00 0.00 H new ATOM 438 N THR A 30 8.896 -15.153 -4.703 1.00 0.00 N ATOM 439 CA THR A 30 7.882 -16.045 -4.232 1.00 0.00 C ATOM 440 C THR A 30 6.569 -15.419 -3.909 1.00 0.00 C ATOM 441 O THR A 30 5.552 -15.900 -4.407 1.00 0.00 O ATOM 442 CB THR A 30 8.388 -17.222 -3.452 1.00 0.00 C ATOM 443 OG1 THR A 30 9.601 -17.774 -3.943 1.00 0.00 O ATOM 444 CG2 THR A 30 7.385 -18.388 -3.452 1.00 0.00 C ATOM 0 H THR A 30 9.799 -15.289 -4.249 1.00 0.00 H new ATOM 0 HA THR A 30 7.529 -16.598 -5.102 1.00 0.00 H new ATOM 0 HB THR A 30 8.544 -16.806 -2.457 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.358 -17.249 -3.610 1.00 0.00 H new ATOM 0 HG21 THR A 30 7.793 -19.219 -2.876 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.447 -18.061 -3.004 1.00 0.00 H new ATOM 0 HG23 THR A 30 7.204 -18.712 -4.477 1.00 0.00 H new ATOM 452 N VAL A 31 6.482 -14.330 -3.124 1.00 0.00 N ATOM 453 CA VAL A 31 5.264 -13.651 -2.806 1.00 0.00 C ATOM 454 C VAL A 31 4.584 -13.042 -3.984 1.00 0.00 C ATOM 455 O VAL A 31 3.398 -13.187 -4.273 1.00 0.00 O ATOM 456 CB VAL A 31 5.422 -12.521 -1.832 1.00 0.00 C ATOM 457 CG1 VAL A 31 4.090 -11.889 -1.395 1.00 0.00 C ATOM 458 CG2 VAL A 31 6.007 -13.107 -0.536 1.00 0.00 C ATOM 0 H VAL A 31 7.300 -13.903 -2.690 1.00 0.00 H new ATOM 0 HA VAL A 31 4.674 -14.461 -2.377 1.00 0.00 H new ATOM 0 HB VAL A 31 6.036 -11.770 -2.328 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.285 -11.080 -0.691 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.571 -11.494 -2.268 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.469 -12.645 -0.915 1.00 0.00 H new ATOM 0 HG21 VAL A 31 6.136 -12.311 0.197 1.00 0.00 H new ATOM 0 HG22 VAL A 31 5.327 -13.861 -0.138 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.973 -13.565 -0.748 1.00 0.00 H new ATOM 468 N MET A 32 5.343 -12.360 -4.861 1.00 0.00 N ATOM 469 CA MET A 32 4.798 -11.715 -6.015 1.00 0.00 C ATOM 470 C MET A 32 4.311 -12.697 -7.024 1.00 0.00 C ATOM 471 O MET A 32 3.231 -12.522 -7.585 1.00 0.00 O ATOM 472 CB MET A 32 5.987 -11.060 -6.739 1.00 0.00 C ATOM 473 CG MET A 32 6.591 -9.846 -6.031 1.00 0.00 C ATOM 474 SD MET A 32 8.071 -9.155 -6.828 1.00 0.00 S ATOM 475 CE MET A 32 8.077 -7.636 -5.833 1.00 0.00 C ATOM 0 H MET A 32 6.353 -12.255 -4.767 1.00 0.00 H new ATOM 0 HA MET A 32 3.998 -11.053 -5.685 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.768 -11.809 -6.872 1.00 0.00 H new ATOM 0 HB3 MET A 32 5.663 -10.756 -7.735 1.00 0.00 H new ATOM 0 HG2 MET A 32 5.832 -9.066 -5.967 1.00 0.00 H new ATOM 0 HG3 MET A 32 6.844 -10.128 -5.009 1.00 0.00 H new ATOM 0 HE1 MET A 32 9.096 -7.410 -5.519 1.00 0.00 H new ATOM 0 HE2 MET A 32 7.689 -6.809 -6.428 1.00 0.00 H new ATOM 0 HE3 MET A 32 7.449 -7.775 -4.953 1.00 0.00 H new ATOM 485 N ARG A 33 5.029 -13.799 -7.304 1.00 0.00 N ATOM 486 CA ARG A 33 4.650 -14.929 -8.094 1.00 0.00 C ATOM 487 C ARG A 33 3.465 -15.765 -7.750 1.00 0.00 C ATOM 488 O ARG A 33 2.789 -16.373 -8.579 1.00 0.00 O ATOM 489 CB ARG A 33 5.919 -15.773 -8.302 1.00 0.00 C ATOM 490 CG ARG A 33 7.021 -15.155 -9.166 1.00 0.00 C ATOM 491 CD ARG A 33 8.349 -15.905 -9.051 1.00 0.00 C ATOM 492 NE ARG A 33 9.340 -15.149 -9.867 1.00 0.00 N ATOM 493 CZ ARG A 33 10.549 -14.744 -9.377 1.00 0.00 C ATOM 494 NH1 ARG A 33 11.147 -15.294 -8.280 1.00 0.00 N ATOM 495 NH2 ARG A 33 11.343 -13.938 -10.140 1.00 0.00 N ATOM 0 H ARG A 33 5.974 -13.907 -6.937 1.00 0.00 H new ATOM 0 HA ARG A 33 4.238 -14.483 -8.999 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.341 -16.000 -7.323 1.00 0.00 H new ATOM 0 HB3 ARG A 33 5.627 -16.722 -8.751 1.00 0.00 H new ATOM 0 HG2 ARG A 33 6.700 -15.149 -10.208 1.00 0.00 H new ATOM 0 HG3 ARG A 33 7.168 -14.116 -8.872 1.00 0.00 H new ATOM 0 HD2 ARG A 33 8.670 -15.966 -8.011 1.00 0.00 H new ATOM 0 HD3 ARG A 33 8.248 -16.928 -9.414 1.00 0.00 H new ATOM 0 HE ARG A 33 9.105 -14.924 -10.834 1.00 0.00 H new ATOM 0 HH11 ARG A 33 10.689 -16.053 -7.776 1.00 0.00 H new ATOM 0 HH12 ARG A 33 12.052 -14.946 -7.964 1.00 0.00 H new ATOM 0 HH21 ARG A 33 11.032 -13.644 -11.066 1.00 0.00 H new ATOM 0 HH22 ARG A 33 12.248 -13.629 -9.784 1.00 0.00 H new ATOM 509 N SER A 34 3.201 -15.812 -6.432 1.00 0.00 N ATOM 510 CA SER A 34 2.041 -16.320 -5.769 1.00 0.00 C ATOM 511 C SER A 34 0.828 -15.515 -6.087 1.00 0.00 C ATOM 512 O SER A 34 -0.143 -16.070 -6.598 1.00 0.00 O ATOM 513 CB SER A 34 2.261 -16.278 -4.247 1.00 0.00 C ATOM 514 OG SER A 34 3.263 -17.214 -3.875 1.00 0.00 O ATOM 0 H SER A 34 3.878 -15.453 -5.759 1.00 0.00 H new ATOM 0 HA SER A 34 1.885 -17.342 -6.115 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.558 -15.275 -3.942 1.00 0.00 H new ATOM 0 HB3 SER A 34 1.329 -16.506 -3.730 1.00 0.00 H new ATOM 0 HG SER A 34 4.141 -16.779 -3.897 1.00 0.00 H new ATOM 520 N LEU A 35 0.907 -14.198 -5.824 1.00 0.00 N ATOM 521 CA LEU A 35 -0.023 -13.160 -6.143 1.00 0.00 C ATOM 522 C LEU A 35 -0.443 -13.071 -7.569 1.00 0.00 C ATOM 523 O LEU A 35 -1.616 -13.146 -7.934 1.00 0.00 O ATOM 524 CB LEU A 35 0.502 -11.840 -5.553 1.00 0.00 C ATOM 525 CG LEU A 35 -0.492 -10.667 -5.595 1.00 0.00 C ATOM 526 CD1 LEU A 35 -1.638 -10.845 -4.585 1.00 0.00 C ATOM 527 CD2 LEU A 35 0.302 -9.362 -5.416 1.00 0.00 C ATOM 0 H LEU A 35 1.717 -13.822 -5.331 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.973 -13.417 -5.674 1.00 0.00 H new ATOM 0 HB2 LEU A 35 0.793 -12.013 -4.517 1.00 0.00 H new ATOM 0 HB3 LEU A 35 1.404 -11.552 -6.093 1.00 0.00 H new ATOM 0 HG LEU A 35 -0.996 -10.631 -6.561 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.315 -9.994 -4.650 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -2.184 -11.761 -4.812 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -1.228 -10.907 -3.577 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -0.382 -8.514 -5.442 1.00 0.00 H new ATOM 0 HD22 LEU A 35 0.821 -9.380 -4.458 1.00 0.00 H new ATOM 0 HD23 LEU A 35 1.030 -9.266 -6.221 1.00 0.00 H new ATOM 539 N GLY A 36 0.613 -12.938 -8.391 1.00 0.00 N ATOM 540 CA GLY A 36 0.522 -13.039 -9.815 1.00 0.00 C ATOM 541 C GLY A 36 1.388 -12.083 -10.560 1.00 0.00 C ATOM 542 O GLY A 36 0.887 -11.178 -11.226 1.00 0.00 O ATOM 0 H GLY A 36 1.559 -12.755 -8.055 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.785 -14.054 -10.112 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.514 -12.878 -10.112 1.00 0.00 H new ATOM 546 N GLN A 37 2.712 -12.311 -10.513 1.00 0.00 N ATOM 547 CA GLN A 37 3.600 -11.553 -11.340 1.00 0.00 C ATOM 548 C GLN A 37 4.947 -12.185 -11.417 1.00 0.00 C ATOM 549 O GLN A 37 5.438 -12.708 -10.418 1.00 0.00 O ATOM 550 CB GLN A 37 3.758 -10.061 -11.000 1.00 0.00 C ATOM 551 CG GLN A 37 3.574 -9.657 -9.536 1.00 0.00 C ATOM 552 CD GLN A 37 3.927 -8.186 -9.369 1.00 0.00 C ATOM 553 OE1 GLN A 37 5.036 -7.829 -8.973 1.00 0.00 O ATOM 554 NE2 GLN A 37 2.941 -7.260 -9.504 1.00 0.00 N ATOM 0 H GLN A 37 3.162 -13.005 -9.916 1.00 0.00 H new ATOM 0 HA GLN A 37 3.100 -11.574 -12.308 1.00 0.00 H new ATOM 0 HB2 GLN A 37 4.752 -9.746 -11.316 1.00 0.00 H new ATOM 0 HB3 GLN A 37 3.041 -9.500 -11.599 1.00 0.00 H new ATOM 0 HG2 GLN A 37 2.544 -9.833 -9.226 1.00 0.00 H new ATOM 0 HG3 GLN A 37 4.209 -10.270 -8.896 1.00 0.00 H new ATOM 0 HE21 GLN A 37 2.017 -7.543 -9.831 1.00 0.00 H new ATOM 0 HE22 GLN A 37 3.125 -6.283 -9.278 1.00 0.00 H new ATOM 563 N ASN A 38 5.626 -12.278 -12.574 1.00 0.00 N ATOM 564 CA ASN A 38 6.801 -13.071 -12.760 1.00 0.00 C ATOM 565 C ASN A 38 7.933 -12.160 -13.090 1.00 0.00 C ATOM 566 O ASN A 38 8.085 -11.918 -14.286 1.00 0.00 O ATOM 567 CB ASN A 38 6.512 -14.051 -13.909 1.00 0.00 C ATOM 568 CG ASN A 38 5.555 -15.145 -13.456 1.00 0.00 C ATOM 569 OD1 ASN A 38 4.372 -14.856 -13.289 1.00 0.00 O ATOM 570 ND2 ASN A 38 6.127 -16.353 -13.202 1.00 0.00 N ATOM 0 H ASN A 38 5.343 -11.778 -13.417 1.00 0.00 H new ATOM 0 HA ASN A 38 7.068 -13.635 -11.866 1.00 0.00 H new ATOM 0 HB2 ASN A 38 6.083 -13.512 -14.754 1.00 0.00 H new ATOM 0 HB3 ASN A 38 7.444 -14.497 -14.256 1.00 0.00 H new ATOM 0 HD21 ASN A 38 5.560 -17.119 -12.839 1.00 0.00 H new ATOM 0 HD22 ASN A 38 7.122 -16.492 -13.375 1.00 0.00 H new ATOM 577 N PRO A 39 8.654 -11.566 -12.185 1.00 0.00 N ATOM 578 CA PRO A 39 9.776 -10.784 -12.616 1.00 0.00 C ATOM 579 C PRO A 39 11.000 -11.555 -12.970 1.00 0.00 C ATOM 580 O PRO A 39 11.031 -12.761 -12.727 1.00 0.00 O ATOM 581 CB PRO A 39 10.132 -10.041 -11.330 1.00 0.00 C ATOM 582 CG PRO A 39 9.596 -10.787 -10.098 1.00 0.00 C ATOM 583 CD PRO A 39 8.555 -11.716 -10.742 1.00 0.00 C ATOM 0 HA PRO A 39 9.508 -10.216 -13.507 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.214 -9.936 -11.254 1.00 0.00 H new ATOM 0 HB3 PRO A 39 9.715 -9.034 -11.360 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.378 -11.342 -9.580 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.149 -10.111 -9.369 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.737 -12.751 -10.453 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.552 -11.461 -10.400 1.00 0.00 H new ATOM 591 N THR A 40 12.016 -10.836 -13.481 1.00 0.00 N ATOM 592 CA THR A 40 13.307 -11.430 -13.636 1.00 0.00 C ATOM 593 C THR A 40 14.087 -11.214 -12.385 1.00 0.00 C ATOM 594 O THR A 40 13.790 -10.346 -11.566 1.00 0.00 O ATOM 595 CB THR A 40 14.010 -10.859 -14.832 1.00 0.00 C ATOM 596 OG1 THR A 40 13.795 -9.457 -14.881 1.00 0.00 O ATOM 597 CG2 THR A 40 13.523 -11.503 -16.141 1.00 0.00 C ATOM 0 H THR A 40 11.947 -9.864 -13.781 1.00 0.00 H new ATOM 0 HA THR A 40 13.206 -12.502 -13.808 1.00 0.00 H new ATOM 0 HB THR A 40 15.074 -11.073 -14.732 1.00 0.00 H new ATOM 0 HG1 THR A 40 14.255 -9.083 -15.661 1.00 0.00 H new ATOM 0 HG21 THR A 40 14.056 -11.062 -16.984 1.00 0.00 H new ATOM 0 HG22 THR A 40 13.714 -12.576 -16.112 1.00 0.00 H new ATOM 0 HG23 THR A 40 12.453 -11.328 -16.257 1.00 0.00 H new ATOM 605 N GLU A 41 15.214 -11.913 -12.160 1.00 0.00 N ATOM 606 CA GLU A 41 16.060 -11.931 -11.008 1.00 0.00 C ATOM 607 C GLU A 41 16.855 -10.673 -10.943 1.00 0.00 C ATOM 608 O GLU A 41 17.142 -10.142 -9.871 1.00 0.00 O ATOM 609 CB GLU A 41 17.073 -13.089 -11.025 1.00 0.00 C ATOM 610 CG GLU A 41 16.363 -14.431 -11.213 1.00 0.00 C ATOM 611 CD GLU A 41 15.349 -14.817 -10.145 1.00 0.00 C ATOM 612 OE1 GLU A 41 15.771 -14.943 -8.965 1.00 0.00 O ATOM 613 OE2 GLU A 41 14.120 -14.916 -10.404 1.00 0.00 O ATOM 0 H GLU A 41 15.572 -12.542 -12.878 1.00 0.00 H new ATOM 0 HA GLU A 41 15.395 -12.047 -10.152 1.00 0.00 H new ATOM 0 HB2 GLU A 41 17.792 -12.937 -11.830 1.00 0.00 H new ATOM 0 HB3 GLU A 41 17.637 -13.098 -10.092 1.00 0.00 H new ATOM 0 HG2 GLU A 41 15.855 -14.416 -12.177 1.00 0.00 H new ATOM 0 HG3 GLU A 41 17.120 -15.214 -11.264 1.00 0.00 H new ATOM 620 N ALA A 42 17.241 -10.155 -12.123 1.00 0.00 N ATOM 621 CA ALA A 42 17.792 -8.870 -12.418 1.00 0.00 C ATOM 622 C ALA A 42 17.027 -7.781 -11.749 1.00 0.00 C ATOM 623 O ALA A 42 17.581 -7.026 -10.950 1.00 0.00 O ATOM 624 CB ALA A 42 17.727 -8.678 -13.943 1.00 0.00 C ATOM 0 H ALA A 42 17.154 -10.711 -12.973 1.00 0.00 H new ATOM 0 HA ALA A 42 18.818 -8.823 -12.052 1.00 0.00 H new ATOM 0 HB1 ALA A 42 18.141 -7.704 -14.205 1.00 0.00 H new ATOM 0 HB2 ALA A 42 18.305 -9.462 -14.433 1.00 0.00 H new ATOM 0 HB3 ALA A 42 16.689 -8.732 -14.273 1.00 0.00 H new ATOM 630 N GLU A 43 15.707 -7.716 -12.000 1.00 0.00 N ATOM 631 CA GLU A 43 14.794 -6.693 -11.595 1.00 0.00 C ATOM 632 C GLU A 43 14.623 -6.717 -10.115 1.00 0.00 C ATOM 633 O GLU A 43 14.728 -5.712 -9.412 1.00 0.00 O ATOM 634 CB GLU A 43 13.490 -6.607 -12.405 1.00 0.00 C ATOM 635 CG GLU A 43 12.905 -5.203 -12.570 1.00 0.00 C ATOM 636 CD GLU A 43 13.482 -4.333 -13.677 1.00 0.00 C ATOM 637 OE1 GLU A 43 13.272 -4.714 -14.860 1.00 0.00 O ATOM 638 OE2 GLU A 43 14.182 -3.302 -13.494 1.00 0.00 O ATOM 0 H GLU A 43 15.239 -8.447 -12.535 1.00 0.00 H new ATOM 0 HA GLU A 43 15.252 -5.738 -11.854 1.00 0.00 H new ATOM 0 HB2 GLU A 43 13.671 -7.025 -13.396 1.00 0.00 H new ATOM 0 HB3 GLU A 43 12.743 -7.238 -11.924 1.00 0.00 H new ATOM 0 HG2 GLU A 43 11.833 -5.302 -12.743 1.00 0.00 H new ATOM 0 HG3 GLU A 43 13.028 -4.673 -11.626 1.00 0.00 H new ATOM 645 N LEU A 44 14.543 -7.938 -9.556 1.00 0.00 N ATOM 646 CA LEU A 44 14.453 -8.265 -8.167 1.00 0.00 C ATOM 647 C LEU A 44 15.675 -7.851 -7.422 1.00 0.00 C ATOM 648 O LEU A 44 15.530 -7.472 -6.261 1.00 0.00 O ATOM 649 CB LEU A 44 14.242 -9.750 -7.826 1.00 0.00 C ATOM 650 CG LEU A 44 12.879 -10.388 -8.140 1.00 0.00 C ATOM 651 CD1 LEU A 44 12.874 -11.904 -7.883 1.00 0.00 C ATOM 652 CD2 LEU A 44 11.803 -9.657 -7.319 1.00 0.00 C ATOM 0 H LEU A 44 14.541 -8.777 -10.136 1.00 0.00 H new ATOM 0 HA LEU A 44 13.560 -7.716 -7.868 1.00 0.00 H new ATOM 0 HB2 LEU A 44 15.005 -10.323 -8.353 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.429 -9.875 -6.759 1.00 0.00 H new ATOM 0 HG LEU A 44 12.663 -10.276 -9.202 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.890 -12.310 -8.119 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.624 -12.382 -8.513 1.00 0.00 H new ATOM 0 HD13 LEU A 44 13.104 -12.096 -6.835 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.827 -10.095 -7.527 1.00 0.00 H new ATOM 0 HD22 LEU A 44 12.026 -9.756 -6.257 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.793 -8.601 -7.591 1.00 0.00 H new ATOM 664 N GLN A 45 16.883 -7.902 -8.011 1.00 0.00 N ATOM 665 CA GLN A 45 18.145 -7.508 -7.465 1.00 0.00 C ATOM 666 C GLN A 45 18.295 -6.028 -7.537 1.00 0.00 C ATOM 667 O GLN A 45 18.825 -5.381 -6.635 1.00 0.00 O ATOM 668 CB GLN A 45 19.326 -8.310 -8.039 1.00 0.00 C ATOM 669 CG GLN A 45 20.735 -7.991 -7.536 1.00 0.00 C ATOM 670 CD GLN A 45 21.858 -8.647 -8.327 1.00 0.00 C ATOM 671 OE1 GLN A 45 22.652 -9.390 -7.751 1.00 0.00 O ATOM 672 NE2 GLN A 45 21.943 -8.478 -9.674 1.00 0.00 N ATOM 0 H GLN A 45 16.983 -8.254 -8.963 1.00 0.00 H new ATOM 0 HA GLN A 45 18.163 -7.768 -6.407 1.00 0.00 H new ATOM 0 HB2 GLN A 45 19.136 -9.366 -7.846 1.00 0.00 H new ATOM 0 HB3 GLN A 45 19.322 -8.178 -9.121 1.00 0.00 H new ATOM 0 HG2 GLN A 45 20.877 -6.911 -7.557 1.00 0.00 H new ATOM 0 HG3 GLN A 45 20.813 -8.302 -6.494 1.00 0.00 H new ATOM 0 HE21 GLN A 45 21.286 -7.863 -10.153 1.00 0.00 H new ATOM 0 HE22 GLN A 45 22.664 -8.967 -10.205 1.00 0.00 H new ATOM 681 N ASP A 46 17.702 -5.419 -8.580 1.00 0.00 N ATOM 682 CA ASP A 46 17.699 -4.013 -8.842 1.00 0.00 C ATOM 683 C ASP A 46 16.935 -3.207 -7.849 1.00 0.00 C ATOM 684 O ASP A 46 17.526 -2.323 -7.230 1.00 0.00 O ATOM 685 CB ASP A 46 17.253 -3.606 -10.256 1.00 0.00 C ATOM 686 CG ASP A 46 18.455 -3.339 -11.152 1.00 0.00 C ATOM 687 OD1 ASP A 46 19.590 -3.231 -10.616 1.00 0.00 O ATOM 688 OD2 ASP A 46 18.249 -3.337 -12.395 1.00 0.00 O ATOM 0 H ASP A 46 17.190 -5.946 -9.288 1.00 0.00 H new ATOM 0 HA ASP A 46 18.759 -3.778 -8.749 1.00 0.00 H new ATOM 0 HB2 ASP A 46 16.640 -4.396 -10.689 1.00 0.00 H new ATOM 0 HB3 ASP A 46 16.630 -2.713 -10.202 1.00 0.00 H new ATOM 693 N MET A 47 15.667 -3.614 -7.661 1.00 0.00 N ATOM 694 CA MET A 47 14.778 -2.999 -6.725 1.00 0.00 C ATOM 695 C MET A 47 15.235 -3.141 -5.314 1.00 0.00 C ATOM 696 O MET A 47 14.973 -2.313 -4.444 1.00 0.00 O ATOM 697 CB MET A 47 13.326 -3.478 -6.897 1.00 0.00 C ATOM 698 CG MET A 47 13.111 -4.954 -6.554 1.00 0.00 C ATOM 699 SD MET A 47 11.423 -5.501 -6.948 1.00 0.00 S ATOM 700 CE MET A 47 11.530 -5.530 -8.760 1.00 0.00 C ATOM 0 H MET A 47 15.249 -4.391 -8.173 1.00 0.00 H new ATOM 0 HA MET A 47 14.797 -1.934 -6.955 1.00 0.00 H new ATOM 0 HB2 MET A 47 12.677 -2.871 -6.266 1.00 0.00 H new ATOM 0 HB3 MET A 47 13.018 -3.307 -7.928 1.00 0.00 H new ATOM 0 HG2 MET A 47 13.828 -5.563 -7.105 1.00 0.00 H new ATOM 0 HG3 MET A 47 13.306 -5.113 -5.493 1.00 0.00 H new ATOM 0 HE1 MET A 47 10.658 -5.032 -9.184 1.00 0.00 H new ATOM 0 HE2 MET A 47 12.435 -5.013 -9.079 1.00 0.00 H new ATOM 0 HE3 MET A 47 11.561 -6.563 -9.106 1.00 0.00 H new ATOM 710 N ILE A 48 15.947 -4.222 -4.947 1.00 0.00 N ATOM 711 CA ILE A 48 16.646 -4.261 -3.700 1.00 0.00 C ATOM 712 C ILE A 48 17.815 -3.337 -3.677 1.00 0.00 C ATOM 713 O ILE A 48 17.857 -2.525 -2.755 1.00 0.00 O ATOM 714 CB ILE A 48 17.103 -5.634 -3.307 1.00 0.00 C ATOM 715 CG1 ILE A 48 15.820 -6.468 -3.149 1.00 0.00 C ATOM 716 CG2 ILE A 48 17.970 -5.625 -2.037 1.00 0.00 C ATOM 717 CD1 ILE A 48 15.014 -6.132 -1.894 1.00 0.00 C ATOM 0 H ILE A 48 16.038 -5.066 -5.512 1.00 0.00 H new ATOM 0 HA ILE A 48 15.908 -3.931 -2.969 1.00 0.00 H new ATOM 0 HB ILE A 48 17.757 -6.065 -4.065 1.00 0.00 H new ATOM 0 HG12 ILE A 48 15.190 -6.317 -4.025 1.00 0.00 H new ATOM 0 HG13 ILE A 48 16.086 -7.525 -3.126 1.00 0.00 H new ATOM 0 HG21 ILE A 48 18.274 -6.644 -1.797 1.00 0.00 H new ATOM 0 HG22 ILE A 48 18.856 -5.012 -2.205 1.00 0.00 H new ATOM 0 HG23 ILE A 48 17.396 -5.213 -1.207 1.00 0.00 H new ATOM 0 HD11 ILE A 48 14.125 -6.761 -1.853 1.00 0.00 H new ATOM 0 HD12 ILE A 48 15.626 -6.311 -1.010 1.00 0.00 H new ATOM 0 HD13 ILE A 48 14.716 -5.084 -1.923 1.00 0.00 H new ATOM 729 N ASN A 49 18.763 -3.455 -4.625 1.00 0.00 N ATOM 730 CA ASN A 49 19.908 -2.600 -4.663 1.00 0.00 C ATOM 731 C ASN A 49 19.783 -1.119 -4.772 1.00 0.00 C ATOM 732 O ASN A 49 20.725 -0.410 -4.423 1.00 0.00 O ATOM 733 CB ASN A 49 20.852 -3.053 -5.790 1.00 0.00 C ATOM 734 CG ASN A 49 21.503 -4.399 -5.510 1.00 0.00 C ATOM 735 OD1 ASN A 49 21.396 -5.021 -4.454 1.00 0.00 O ATOM 736 ND2 ASN A 49 22.145 -4.962 -6.569 1.00 0.00 N ATOM 0 H ASN A 49 18.735 -4.150 -5.371 1.00 0.00 H new ATOM 0 HA ASN A 49 20.264 -2.733 -3.641 1.00 0.00 H new ATOM 0 HB2 ASN A 49 20.293 -3.112 -6.724 1.00 0.00 H new ATOM 0 HB3 ASN A 49 21.629 -2.301 -5.931 1.00 0.00 H new ATOM 0 HD21 ASN A 49 22.538 -5.900 -6.487 1.00 0.00 H new ATOM 0 HD22 ASN A 49 22.234 -4.446 -7.445 1.00 0.00 H new ATOM 743 N GLU A 50 18.625 -0.678 -5.295 1.00 0.00 N ATOM 744 CA GLU A 50 18.150 0.670 -5.331 1.00 0.00 C ATOM 745 C GLU A 50 17.992 1.228 -3.958 1.00 0.00 C ATOM 746 O GLU A 50 18.497 2.277 -3.562 1.00 0.00 O ATOM 747 CB GLU A 50 16.795 0.731 -6.057 1.00 0.00 C ATOM 748 CG GLU A 50 16.089 2.076 -6.241 1.00 0.00 C ATOM 749 CD GLU A 50 16.970 3.232 -6.695 1.00 0.00 C ATOM 750 OE1 GLU A 50 17.487 3.188 -7.843 1.00 0.00 O ATOM 751 OE2 GLU A 50 17.114 4.250 -5.967 1.00 0.00 O ATOM 0 H GLU A 50 17.965 -1.323 -5.730 1.00 0.00 H new ATOM 0 HA GLU A 50 18.889 1.267 -5.866 1.00 0.00 H new ATOM 0 HB2 GLU A 50 16.938 0.301 -7.048 1.00 0.00 H new ATOM 0 HB3 GLU A 50 16.109 0.075 -5.521 1.00 0.00 H new ATOM 0 HG2 GLU A 50 15.288 1.947 -6.969 1.00 0.00 H new ATOM 0 HG3 GLU A 50 15.620 2.351 -5.296 1.00 0.00 H new ATOM 758 N VAL A 51 17.141 0.571 -3.149 1.00 0.00 N ATOM 759 CA VAL A 51 16.780 1.025 -1.842 1.00 0.00 C ATOM 760 C VAL A 51 17.695 0.571 -0.757 1.00 0.00 C ATOM 761 O VAL A 51 17.768 1.155 0.323 1.00 0.00 O ATOM 762 CB VAL A 51 15.340 0.818 -1.476 1.00 0.00 C ATOM 763 CG1 VAL A 51 14.460 1.402 -2.594 1.00 0.00 C ATOM 764 CG2 VAL A 51 15.059 -0.690 -1.361 1.00 0.00 C ATOM 0 H VAL A 51 16.690 -0.305 -3.413 1.00 0.00 H new ATOM 0 HA VAL A 51 16.913 2.104 -1.924 1.00 0.00 H new ATOM 0 HB VAL A 51 15.123 1.308 -0.527 1.00 0.00 H new ATOM 0 HG11 VAL A 51 13.409 1.259 -2.342 1.00 0.00 H new ATOM 0 HG12 VAL A 51 14.666 2.467 -2.700 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.680 0.894 -3.533 1.00 0.00 H new ATOM 0 HG21 VAL A 51 14.014 -0.846 -1.095 1.00 0.00 H new ATOM 0 HG22 VAL A 51 15.266 -1.173 -2.316 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.698 -1.121 -0.590 1.00 0.00 H new ATOM 774 N ASP A 52 18.504 -0.483 -0.965 1.00 0.00 N ATOM 775 CA ASP A 52 19.419 -1.096 -0.053 1.00 0.00 C ATOM 776 C ASP A 52 20.491 -0.197 0.461 1.00 0.00 C ATOM 777 O ASP A 52 21.423 0.244 -0.210 1.00 0.00 O ATOM 778 CB ASP A 52 20.112 -2.333 -0.648 1.00 0.00 C ATOM 779 CG ASP A 52 20.961 -3.177 0.292 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.794 -3.031 1.533 1.00 0.00 O ATOM 781 OD2 ASP A 52 21.766 -4.006 -0.207 1.00 0.00 O ATOM 0 H ASP A 52 18.516 -0.954 -1.870 1.00 0.00 H new ATOM 0 HA ASP A 52 18.771 -1.374 0.778 1.00 0.00 H new ATOM 0 HB2 ASP A 52 19.344 -2.976 -1.078 1.00 0.00 H new ATOM 0 HB3 ASP A 52 20.747 -2.002 -1.470 1.00 0.00 H new ATOM 786 N ALA A 53 20.381 0.246 1.726 1.00 0.00 N ATOM 787 CA ALA A 53 21.230 1.212 2.352 1.00 0.00 C ATOM 788 C ALA A 53 22.521 0.661 2.853 1.00 0.00 C ATOM 789 O ALA A 53 23.607 1.171 2.583 1.00 0.00 O ATOM 790 CB ALA A 53 20.401 1.888 3.457 1.00 0.00 C ATOM 0 H ALA A 53 19.651 -0.093 2.352 1.00 0.00 H new ATOM 0 HA ALA A 53 21.551 1.942 1.609 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.011 2.636 3.964 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.529 2.370 3.014 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.074 1.138 4.177 1.00 0.00 H new ATOM 796 N ASP A 54 22.435 -0.414 3.656 1.00 0.00 N ATOM 797 CA ASP A 54 23.625 -1.052 4.127 1.00 0.00 C ATOM 798 C ASP A 54 24.486 -1.707 3.102 1.00 0.00 C ATOM 799 O ASP A 54 25.708 -1.758 3.229 1.00 0.00 O ATOM 800 CB ASP A 54 23.308 -1.883 5.381 1.00 0.00 C ATOM 801 CG ASP A 54 22.263 -2.935 5.040 1.00 0.00 C ATOM 802 OD1 ASP A 54 22.530 -3.799 4.162 1.00 0.00 O ATOM 803 OD2 ASP A 54 21.101 -2.909 5.525 1.00 0.00 O ATOM 0 H ASP A 54 21.562 -0.835 3.974 1.00 0.00 H new ATOM 0 HA ASP A 54 24.310 -0.258 4.426 1.00 0.00 H new ATOM 0 HB2 ASP A 54 24.214 -2.362 5.752 1.00 0.00 H new ATOM 0 HB3 ASP A 54 22.941 -1.235 6.177 1.00 0.00 H new ATOM 808 N GLY A 55 23.872 -2.299 2.062 1.00 0.00 N ATOM 809 CA GLY A 55 24.581 -2.991 1.031 1.00 0.00 C ATOM 810 C GLY A 55 24.718 -4.472 1.125 1.00 0.00 C ATOM 811 O GLY A 55 25.523 -5.076 0.418 1.00 0.00 O ATOM 0 H GLY A 55 22.860 -2.297 1.935 1.00 0.00 H new ATOM 0 HA2 GLY A 55 24.091 -2.764 0.084 1.00 0.00 H new ATOM 0 HA3 GLY A 55 25.585 -2.569 0.980 1.00 0.00 H new ATOM 815 N ASN A 56 23.981 -5.141 2.029 1.00 0.00 N ATOM 816 CA ASN A 56 23.987 -6.565 2.164 1.00 0.00 C ATOM 817 C ASN A 56 23.293 -7.323 1.086 1.00 0.00 C ATOM 818 O ASN A 56 23.402 -8.544 0.979 1.00 0.00 O ATOM 819 CB ASN A 56 23.564 -7.073 3.552 1.00 0.00 C ATOM 820 CG ASN A 56 22.139 -6.750 3.979 1.00 0.00 C ATOM 821 OD1 ASN A 56 21.337 -6.192 3.232 1.00 0.00 O ATOM 822 ND2 ASN A 56 21.716 -7.338 5.130 1.00 0.00 N ATOM 0 H ASN A 56 23.359 -4.675 2.689 1.00 0.00 H new ATOM 0 HA ASN A 56 25.047 -6.787 2.044 1.00 0.00 H new ATOM 0 HB2 ASN A 56 23.692 -8.155 3.575 1.00 0.00 H new ATOM 0 HB3 ASN A 56 24.247 -6.656 4.292 1.00 0.00 H new ATOM 0 HD21 ASN A 56 20.727 -7.318 5.379 1.00 0.00 H new ATOM 0 HD22 ASN A 56 22.388 -7.799 5.744 1.00 0.00 H new ATOM 829 N GLY A 57 22.481 -6.687 0.223 1.00 0.00 N ATOM 830 CA GLY A 57 21.870 -7.234 -0.949 1.00 0.00 C ATOM 831 C GLY A 57 20.520 -7.717 -0.543 1.00 0.00 C ATOM 832 O GLY A 57 19.786 -8.366 -1.287 1.00 0.00 O ATOM 0 H GLY A 57 22.232 -5.707 0.358 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.792 -6.480 -1.732 1.00 0.00 H new ATOM 0 HA3 GLY A 57 22.468 -8.051 -1.352 1.00 0.00 H new ATOM 836 N THR A 58 20.045 -7.427 0.681 1.00 0.00 N ATOM 837 CA THR A 58 18.694 -7.693 1.067 1.00 0.00 C ATOM 838 C THR A 58 18.130 -6.373 1.467 1.00 0.00 C ATOM 839 O THR A 58 18.775 -5.424 1.911 1.00 0.00 O ATOM 840 CB THR A 58 18.564 -8.623 2.237 1.00 0.00 C ATOM 841 OG1 THR A 58 19.498 -8.402 3.283 1.00 0.00 O ATOM 842 CG2 THR A 58 18.821 -10.035 1.685 1.00 0.00 C ATOM 0 H THR A 58 20.609 -7.000 1.416 1.00 0.00 H new ATOM 0 HA THR A 58 18.181 -8.176 0.235 1.00 0.00 H new ATOM 0 HB THR A 58 17.577 -8.468 2.672 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.809 -7.473 3.253 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.740 -10.762 2.493 1.00 0.00 H new ATOM 0 HG22 THR A 58 18.084 -10.265 0.915 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.821 -10.081 1.255 1.00 0.00 H new ATOM 850 N ILE A 59 16.788 -6.294 1.457 1.00 0.00 N ATOM 851 CA ILE A 59 16.116 -5.293 2.227 1.00 0.00 C ATOM 852 C ILE A 59 15.962 -5.756 3.635 1.00 0.00 C ATOM 853 O ILE A 59 15.456 -6.825 3.975 1.00 0.00 O ATOM 854 CB ILE A 59 14.785 -4.907 1.652 1.00 0.00 C ATOM 855 CG1 ILE A 59 14.208 -3.662 2.346 1.00 0.00 C ATOM 856 CG2 ILE A 59 13.799 -6.078 1.501 1.00 0.00 C ATOM 857 CD1 ILE A 59 13.094 -2.954 1.576 1.00 0.00 C ATOM 0 H ILE A 59 16.175 -6.912 0.925 1.00 0.00 H new ATOM 0 HA ILE A 59 16.736 -4.397 2.199 1.00 0.00 H new ATOM 0 HB ILE A 59 14.966 -4.614 0.618 1.00 0.00 H new ATOM 0 HG12 ILE A 59 13.825 -3.954 3.324 1.00 0.00 H new ATOM 0 HG13 ILE A 59 15.017 -2.953 2.519 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.863 -5.713 1.079 1.00 0.00 H new ATOM 0 HG22 ILE A 59 14.227 -6.831 0.839 1.00 0.00 H new ATOM 0 HG23 ILE A 59 13.608 -6.521 2.478 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.752 -2.089 2.144 1.00 0.00 H new ATOM 0 HD12 ILE A 59 13.473 -2.625 0.608 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.262 -3.642 1.425 1.00 0.00 H new ATOM 869 N ASP A 60 16.285 -4.839 4.564 1.00 0.00 N ATOM 870 CA ASP A 60 16.256 -4.967 5.988 1.00 0.00 C ATOM 871 C ASP A 60 15.120 -4.132 6.470 1.00 0.00 C ATOM 872 O ASP A 60 14.428 -3.383 5.783 1.00 0.00 O ATOM 873 CB ASP A 60 17.564 -4.446 6.607 1.00 0.00 C ATOM 874 CG ASP A 60 18.747 -5.378 6.385 1.00 0.00 C ATOM 875 OD1 ASP A 60 19.168 -5.487 5.203 1.00 0.00 O ATOM 876 OD2 ASP A 60 19.375 -5.883 7.354 1.00 0.00 O ATOM 0 H ASP A 60 16.600 -3.910 4.285 1.00 0.00 H new ATOM 0 HA ASP A 60 16.141 -6.013 6.273 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.795 -3.469 6.182 1.00 0.00 H new ATOM 0 HB3 ASP A 60 17.419 -4.302 7.678 1.00 0.00 H new ATOM 881 N PHE A 61 14.929 -4.116 7.802 1.00 0.00 N ATOM 882 CA PHE A 61 13.858 -3.388 8.408 1.00 0.00 C ATOM 883 C PHE A 61 13.856 -1.898 8.389 1.00 0.00 C ATOM 884 O PHE A 61 12.780 -1.437 8.013 1.00 0.00 O ATOM 885 CB PHE A 61 13.567 -3.953 9.808 1.00 0.00 C ATOM 886 CG PHE A 61 12.187 -3.667 10.294 1.00 0.00 C ATOM 887 CD1 PHE A 61 11.069 -4.255 9.752 1.00 0.00 C ATOM 888 CD2 PHE A 61 12.031 -2.784 11.336 1.00 0.00 C ATOM 889 CE1 PHE A 61 9.830 -4.040 10.309 1.00 0.00 C ATOM 890 CE2 PHE A 61 10.778 -2.479 11.814 1.00 0.00 C ATOM 891 CZ PHE A 61 9.665 -3.100 11.299 1.00 0.00 C ATOM 0 H PHE A 61 15.524 -4.613 8.465 1.00 0.00 H new ATOM 0 HA PHE A 61 13.038 -3.569 7.712 1.00 0.00 H new ATOM 0 HB2 PHE A 61 13.722 -5.032 9.794 1.00 0.00 H new ATOM 0 HB3 PHE A 61 14.285 -3.537 10.515 1.00 0.00 H new ATOM 0 HD1 PHE A 61 11.164 -4.890 8.883 1.00 0.00 H new ATOM 0 HD2 PHE A 61 12.900 -2.326 11.783 1.00 0.00 H new ATOM 0 HE1 PHE A 61 8.981 -4.613 9.967 1.00 0.00 H new ATOM 0 HE2 PHE A 61 10.668 -1.746 12.600 1.00 0.00 H new ATOM 0 HZ PHE A 61 8.679 -2.854 11.665 1.00 0.00 H new ATOM 901 N PRO A 62 14.828 -1.078 8.656 1.00 0.00 N ATOM 902 CA PRO A 62 14.795 0.347 8.494 1.00 0.00 C ATOM 903 C PRO A 62 14.927 0.823 7.088 1.00 0.00 C ATOM 904 O PRO A 62 14.911 2.035 6.877 1.00 0.00 O ATOM 905 CB PRO A 62 15.949 0.868 9.348 1.00 0.00 C ATOM 906 CG PRO A 62 17.046 -0.196 9.190 1.00 0.00 C ATOM 907 CD PRO A 62 16.117 -1.419 9.239 1.00 0.00 C ATOM 0 HA PRO A 62 13.818 0.722 8.800 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.289 1.845 9.004 1.00 0.00 H new ATOM 0 HB3 PRO A 62 15.653 0.983 10.391 1.00 0.00 H new ATOM 0 HG2 PRO A 62 17.597 -0.111 8.254 1.00 0.00 H new ATOM 0 HG3 PRO A 62 17.781 -0.180 9.995 1.00 0.00 H new ATOM 0 HD2 PRO A 62 16.565 -2.250 8.695 1.00 0.00 H new ATOM 0 HD3 PRO A 62 15.986 -1.747 10.270 1.00 0.00 H new ATOM 915 N GLU A 63 15.084 -0.069 6.094 1.00 0.00 N ATOM 916 CA GLU A 63 14.942 0.039 4.675 1.00 0.00 C ATOM 917 C GLU A 63 13.505 0.080 4.283 1.00 0.00 C ATOM 918 O GLU A 63 13.013 1.037 3.688 1.00 0.00 O ATOM 919 CB GLU A 63 15.820 -1.023 3.992 1.00 0.00 C ATOM 920 CG GLU A 63 17.247 -0.535 4.248 1.00 0.00 C ATOM 921 CD GLU A 63 18.221 -1.587 3.735 1.00 0.00 C ATOM 922 OE1 GLU A 63 17.773 -2.753 3.572 1.00 0.00 O ATOM 923 OE2 GLU A 63 19.445 -1.298 3.668 1.00 0.00 O ATOM 0 H GLU A 63 15.356 -1.022 6.335 1.00 0.00 H new ATOM 0 HA GLU A 63 15.322 0.992 4.307 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.653 -2.013 4.416 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.606 -1.093 2.925 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.418 0.416 3.744 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.402 -0.363 5.313 1.00 0.00 H new ATOM 930 N PHE A 64 12.730 -0.967 4.618 1.00 0.00 N ATOM 931 CA PHE A 64 11.304 -0.944 4.506 1.00 0.00 C ATOM 932 C PHE A 64 10.475 0.106 5.163 1.00 0.00 C ATOM 933 O PHE A 64 9.551 0.640 4.552 1.00 0.00 O ATOM 934 CB PHE A 64 10.879 -2.341 4.989 1.00 0.00 C ATOM 935 CG PHE A 64 9.556 -2.844 4.522 1.00 0.00 C ATOM 936 CD1 PHE A 64 9.428 -3.375 3.260 1.00 0.00 C ATOM 937 CD2 PHE A 64 8.475 -2.629 5.343 1.00 0.00 C ATOM 938 CE1 PHE A 64 8.173 -3.688 2.796 1.00 0.00 C ATOM 939 CE2 PHE A 64 7.237 -2.996 4.869 1.00 0.00 C ATOM 940 CZ PHE A 64 7.076 -3.526 3.610 1.00 0.00 C ATOM 0 H PHE A 64 13.101 -1.848 4.974 1.00 0.00 H new ATOM 0 HA PHE A 64 11.100 -0.671 3.471 1.00 0.00 H new ATOM 0 HB2 PHE A 64 11.642 -3.054 4.677 1.00 0.00 H new ATOM 0 HB3 PHE A 64 10.874 -2.336 6.079 1.00 0.00 H new ATOM 0 HD1 PHE A 64 10.299 -3.543 2.644 1.00 0.00 H new ATOM 0 HD2 PHE A 64 8.593 -2.189 6.322 1.00 0.00 H new ATOM 0 HE1 PHE A 64 8.048 -4.062 1.791 1.00 0.00 H new ATOM 0 HE2 PHE A 64 6.371 -2.865 5.500 1.00 0.00 H new ATOM 0 HZ PHE A 64 6.094 -3.813 3.263 1.00 0.00 H new ATOM 950 N LEU A 65 10.878 0.609 6.343 1.00 0.00 N ATOM 951 CA LEU A 65 10.281 1.754 6.957 1.00 0.00 C ATOM 952 C LEU A 65 10.392 2.997 6.143 1.00 0.00 C ATOM 953 O LEU A 65 9.436 3.769 6.203 1.00 0.00 O ATOM 954 CB LEU A 65 10.925 2.118 8.306 1.00 0.00 C ATOM 955 CG LEU A 65 10.984 1.093 9.450 1.00 0.00 C ATOM 956 CD1 LEU A 65 11.544 1.849 10.667 1.00 0.00 C ATOM 957 CD2 LEU A 65 9.613 0.534 9.868 1.00 0.00 C ATOM 0 H LEU A 65 11.642 0.207 6.886 1.00 0.00 H new ATOM 0 HA LEU A 65 9.242 1.446 7.070 1.00 0.00 H new ATOM 0 HB2 LEU A 65 11.950 2.427 8.099 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.399 2.993 8.687 1.00 0.00 H new ATOM 0 HG LEU A 65 11.585 0.249 9.112 1.00 0.00 H new ATOM 0 HD11 LEU A 65 11.610 1.171 11.518 1.00 0.00 H new ATOM 0 HD12 LEU A 65 12.536 2.234 10.431 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.883 2.679 10.916 1.00 0.00 H new ATOM 0 HD21 LEU A 65 9.744 -0.182 10.680 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.974 1.351 10.204 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.148 0.036 9.017 1.00 0.00 H new ATOM 969 N THR A 66 11.578 3.190 5.540 1.00 0.00 N ATOM 970 CA THR A 66 11.940 4.294 4.706 1.00 0.00 C ATOM 971 C THR A 66 11.344 4.252 3.341 1.00 0.00 C ATOM 972 O THR A 66 10.810 5.209 2.783 1.00 0.00 O ATOM 973 CB THR A 66 13.435 4.360 4.605 1.00 0.00 C ATOM 974 OG1 THR A 66 14.042 4.582 5.869 1.00 0.00 O ATOM 975 CG2 THR A 66 13.965 5.501 3.719 1.00 0.00 C ATOM 0 H THR A 66 12.342 2.522 5.644 1.00 0.00 H new ATOM 0 HA THR A 66 11.534 5.188 5.179 1.00 0.00 H new ATOM 0 HB THR A 66 13.690 3.393 4.172 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.348 3.728 6.240 1.00 0.00 H new ATOM 0 HG21 THR A 66 15.055 5.473 3.703 1.00 0.00 H new ATOM 0 HG22 THR A 66 13.584 5.381 2.705 1.00 0.00 H new ATOM 0 HG23 THR A 66 13.632 6.458 4.121 1.00 0.00 H new ATOM 983 N MET A 67 11.289 3.084 2.678 1.00 0.00 N ATOM 984 CA MET A 67 10.742 3.027 1.358 1.00 0.00 C ATOM 985 C MET A 67 9.284 3.327 1.288 1.00 0.00 C ATOM 986 O MET A 67 8.840 4.232 0.584 1.00 0.00 O ATOM 987 CB MET A 67 10.964 1.658 0.691 1.00 0.00 C ATOM 988 CG MET A 67 10.126 1.466 -0.574 1.00 0.00 C ATOM 989 SD MET A 67 10.664 -0.033 -1.450 1.00 0.00 S ATOM 990 CE MET A 67 9.908 -1.315 -0.409 1.00 0.00 C ATOM 0 H MET A 67 11.617 2.192 3.048 1.00 0.00 H new ATOM 0 HA MET A 67 11.285 3.807 0.825 1.00 0.00 H new ATOM 0 HB2 MET A 67 12.019 1.549 0.441 1.00 0.00 H new ATOM 0 HB3 MET A 67 10.722 0.869 1.404 1.00 0.00 H new ATOM 0 HG2 MET A 67 9.071 1.386 -0.313 1.00 0.00 H new ATOM 0 HG3 MET A 67 10.229 2.335 -1.224 1.00 0.00 H new ATOM 0 HE1 MET A 67 10.600 -2.150 -0.299 1.00 0.00 H new ATOM 0 HE2 MET A 67 9.682 -0.900 0.573 1.00 0.00 H new ATOM 0 HE3 MET A 67 8.988 -1.666 -0.875 1.00 0.00 H new ATOM 1000 N MET A 68 8.467 2.704 2.156 1.00 0.00 N ATOM 1001 CA MET A 68 7.063 2.937 2.295 1.00 0.00 C ATOM 1002 C MET A 68 6.667 4.282 2.799 1.00 0.00 C ATOM 1003 O MET A 68 5.691 4.901 2.380 1.00 0.00 O ATOM 1004 CB MET A 68 6.367 1.821 3.093 1.00 0.00 C ATOM 1005 CG MET A 68 6.730 0.401 2.653 1.00 0.00 C ATOM 1006 SD MET A 68 6.293 -0.003 0.935 1.00 0.00 S ATOM 1007 CE MET A 68 4.508 0.205 1.195 1.00 0.00 C ATOM 0 H MET A 68 8.810 1.992 2.801 1.00 0.00 H new ATOM 0 HA MET A 68 6.706 2.918 1.265 1.00 0.00 H new ATOM 0 HB2 MET A 68 6.618 1.936 4.147 1.00 0.00 H new ATOM 0 HB3 MET A 68 5.288 1.949 3.006 1.00 0.00 H new ATOM 0 HG2 MET A 68 7.803 0.259 2.783 1.00 0.00 H new ATOM 0 HG3 MET A 68 6.232 -0.307 3.315 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.962 -0.346 0.429 1.00 0.00 H new ATOM 0 HE2 MET A 68 4.237 -0.177 2.179 1.00 0.00 H new ATOM 0 HE3 MET A 68 4.252 1.263 1.133 1.00 0.00 H new ATOM 1017 N ALA A 69 7.417 4.912 3.721 1.00 0.00 N ATOM 1018 CA ALA A 69 7.179 6.226 4.232 1.00 0.00 C ATOM 1019 C ALA A 69 7.443 7.410 3.367 1.00 0.00 C ATOM 1020 O ALA A 69 7.219 8.558 3.749 1.00 0.00 O ATOM 1021 CB ALA A 69 7.983 6.353 5.537 1.00 0.00 C ATOM 0 H ALA A 69 8.241 4.476 4.135 1.00 0.00 H new ATOM 0 HA ALA A 69 6.096 6.278 4.344 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.830 7.344 5.963 1.00 0.00 H new ATOM 0 HB2 ALA A 69 7.647 5.597 6.247 1.00 0.00 H new ATOM 0 HB3 ALA A 69 9.043 6.208 5.327 1.00 0.00 H new ATOM 1027 N ARG A 70 8.000 7.090 2.186 1.00 0.00 N ATOM 1028 CA ARG A 70 8.351 8.061 1.197 1.00 0.00 C ATOM 1029 C ARG A 70 7.215 8.706 0.480 1.00 0.00 C ATOM 1030 O ARG A 70 6.380 8.088 -0.179 1.00 0.00 O ATOM 1031 CB ARG A 70 9.371 7.408 0.250 1.00 0.00 C ATOM 1032 CG ARG A 70 10.268 8.402 -0.490 1.00 0.00 C ATOM 1033 CD ARG A 70 11.394 7.788 -1.324 1.00 0.00 C ATOM 1034 NE ARG A 70 12.095 8.849 -2.099 1.00 0.00 N ATOM 1035 CZ ARG A 70 11.868 9.169 -3.407 1.00 0.00 C ATOM 1036 NH1 ARG A 70 10.766 8.755 -4.098 1.00 0.00 N ATOM 1037 NH2 ARG A 70 12.676 10.050 -4.066 1.00 0.00 N ATOM 0 H ARG A 70 8.212 6.131 1.911 1.00 0.00 H new ATOM 0 HA ARG A 70 8.789 8.915 1.713 1.00 0.00 H new ATOM 0 HB2 ARG A 70 9.999 6.727 0.825 1.00 0.00 H new ATOM 0 HB3 ARG A 70 8.835 6.805 -0.483 1.00 0.00 H new ATOM 0 HG2 ARG A 70 9.643 9.007 -1.147 1.00 0.00 H new ATOM 0 HG3 ARG A 70 10.710 9.078 0.242 1.00 0.00 H new ATOM 0 HD2 ARG A 70 12.102 7.275 -0.672 1.00 0.00 H new ATOM 0 HD3 ARG A 70 10.987 7.039 -2.004 1.00 0.00 H new ATOM 0 HE ARG A 70 12.810 9.386 -1.608 1.00 0.00 H new ATOM 0 HH11 ARG A 70 10.063 8.177 -3.638 1.00 0.00 H new ATOM 0 HH12 ARG A 70 10.646 9.023 -5.075 1.00 0.00 H new ATOM 0 HH21 ARG A 70 13.464 10.480 -3.581 1.00 0.00 H new ATOM 0 HH22 ARG A 70 12.492 10.278 -5.043 1.00 0.00 H new ATOM 1051 N LYS A 71 7.124 10.046 0.554 1.00 0.00 N ATOM 1052 CA LYS A 71 6.085 10.754 -0.126 1.00 0.00 C ATOM 1053 C LYS A 71 6.410 10.924 -1.570 1.00 0.00 C ATOM 1054 O LYS A 71 7.548 11.209 -1.939 1.00 0.00 O ATOM 1055 CB LYS A 71 5.880 12.123 0.546 1.00 0.00 C ATOM 1056 CG LYS A 71 4.582 12.811 0.120 1.00 0.00 C ATOM 1057 CD LYS A 71 4.382 14.211 0.705 1.00 0.00 C ATOM 1058 CE LYS A 71 3.177 15.034 0.247 1.00 0.00 C ATOM 1059 NZ LYS A 71 1.996 14.641 1.049 1.00 0.00 N ATOM 0 H LYS A 71 7.767 10.636 1.082 1.00 0.00 H new ATOM 0 HA LYS A 71 5.163 10.176 -0.061 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.877 11.993 1.628 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.723 12.770 0.305 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.563 12.880 -0.968 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.740 12.184 0.415 1.00 0.00 H new ATOM 0 HD2 LYS A 71 4.321 14.111 1.789 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.279 14.791 0.489 1.00 0.00 H new ATOM 0 HE2 LYS A 71 3.379 16.098 0.369 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.986 14.866 -0.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 1.170 15.195 0.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.803 13.628 0.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.184 14.823 2.056 1.00 0.00 H new ATOM 1073 N MET A 72 5.403 10.735 -2.443 1.00 0.00 N ATOM 1074 CA MET A 72 5.535 10.810 -3.864 1.00 0.00 C ATOM 1075 C MET A 72 4.845 12.019 -4.397 1.00 0.00 C ATOM 1076 O MET A 72 3.924 12.554 -3.783 1.00 0.00 O ATOM 1077 CB MET A 72 4.991 9.500 -4.459 1.00 0.00 C ATOM 1078 CG MET A 72 5.651 8.183 -4.043 1.00 0.00 C ATOM 1079 SD MET A 72 7.460 8.239 -4.209 1.00 0.00 S ATOM 1080 CE MET A 72 7.642 7.928 -5.989 1.00 0.00 C ATOM 0 H MET A 72 4.452 10.520 -2.142 1.00 0.00 H new ATOM 0 HA MET A 72 6.581 10.917 -4.152 1.00 0.00 H new ATOM 0 HB2 MET A 72 3.933 9.435 -4.207 1.00 0.00 H new ATOM 0 HB3 MET A 72 5.056 9.576 -5.544 1.00 0.00 H new ATOM 0 HG2 MET A 72 5.390 7.958 -3.009 1.00 0.00 H new ATOM 0 HG3 MET A 72 5.257 7.372 -4.655 1.00 0.00 H new ATOM 0 HE1 MET A 72 8.700 7.931 -6.253 1.00 0.00 H new ATOM 0 HE2 MET A 72 7.209 6.958 -6.235 1.00 0.00 H new ATOM 0 HE3 MET A 72 7.126 8.708 -6.549 1.00 0.00 H new ATOM 1090 N LYS A 73 5.276 12.472 -5.588 1.00 0.00 N ATOM 1091 CA LYS A 73 4.714 13.577 -6.300 1.00 0.00 C ATOM 1092 C LYS A 73 3.345 13.353 -6.845 1.00 0.00 C ATOM 1093 O LYS A 73 2.848 12.235 -6.977 1.00 0.00 O ATOM 1094 CB LYS A 73 5.766 14.003 -7.338 1.00 0.00 C ATOM 1095 CG LYS A 73 5.970 12.941 -8.420 1.00 0.00 C ATOM 1096 CD LYS A 73 7.160 13.418 -9.255 1.00 0.00 C ATOM 1097 CE LYS A 73 7.513 12.436 -10.373 1.00 0.00 C ATOM 1098 NZ LYS A 73 6.378 12.062 -11.247 1.00 0.00 N ATOM 0 H LYS A 73 6.060 12.043 -6.080 1.00 0.00 H new ATOM 0 HA LYS A 73 4.513 14.397 -5.611 1.00 0.00 H new ATOM 0 HB2 LYS A 73 5.457 14.939 -7.803 1.00 0.00 H new ATOM 0 HB3 LYS A 73 6.714 14.194 -6.835 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.169 11.965 -7.977 1.00 0.00 H new ATOM 0 HG3 LYS A 73 5.077 12.835 -9.037 1.00 0.00 H new ATOM 0 HD2 LYS A 73 6.931 14.392 -9.688 1.00 0.00 H new ATOM 0 HD3 LYS A 73 8.025 13.554 -8.606 1.00 0.00 H new ATOM 0 HE2 LYS A 73 8.299 12.874 -10.988 1.00 0.00 H new ATOM 0 HE3 LYS A 73 7.924 11.531 -9.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 6.738 11.767 -12.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 5.851 11.276 -10.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 5.746 12.880 -11.364 1.00 0.00 H new ATOM 1112 N ASP A 74 2.673 14.471 -7.170 1.00 0.00 N ATOM 1113 CA ASP A 74 1.325 14.645 -7.614 1.00 0.00 C ATOM 1114 C ASP A 74 0.542 13.464 -8.076 1.00 0.00 C ATOM 1115 O ASP A 74 -0.230 12.852 -7.340 1.00 0.00 O ATOM 1116 CB ASP A 74 1.212 15.968 -8.389 1.00 0.00 C ATOM 1117 CG ASP A 74 2.053 16.047 -9.655 1.00 0.00 C ATOM 1118 OD1 ASP A 74 2.198 15.046 -10.407 1.00 0.00 O ATOM 1119 OD2 ASP A 74 2.392 17.231 -9.919 1.00 0.00 O ATOM 0 H ASP A 74 3.144 15.374 -7.112 1.00 0.00 H new ATOM 0 HA ASP A 74 0.713 14.740 -6.717 1.00 0.00 H new ATOM 0 HB2 ASP A 74 0.167 16.128 -8.655 1.00 0.00 H new ATOM 0 HB3 ASP A 74 1.501 16.785 -7.728 1.00 0.00 H new ATOM 1124 N THR A 75 0.703 13.117 -9.366 1.00 0.00 N ATOM 1125 CA THR A 75 0.116 12.067 -10.140 1.00 0.00 C ATOM 1126 C THR A 75 0.346 10.728 -9.529 1.00 0.00 C ATOM 1127 O THR A 75 -0.557 9.893 -9.560 1.00 0.00 O ATOM 1128 CB THR A 75 0.742 11.963 -11.498 1.00 0.00 C ATOM 1129 OG1 THR A 75 0.662 13.176 -12.232 1.00 0.00 O ATOM 1130 CG2 THR A 75 0.259 10.858 -12.453 1.00 0.00 C ATOM 0 H THR A 75 1.343 13.659 -9.947 1.00 0.00 H new ATOM 0 HA THR A 75 -0.943 12.320 -10.189 1.00 0.00 H new ATOM 0 HB THR A 75 1.757 11.699 -11.200 1.00 0.00 H new ATOM 0 HG1 THR A 75 1.257 13.842 -11.829 1.00 0.00 H new ATOM 0 HG21 THR A 75 0.811 10.920 -13.391 1.00 0.00 H new ATOM 0 HG22 THR A 75 0.428 9.883 -11.996 1.00 0.00 H new ATOM 0 HG23 THR A 75 -0.805 10.987 -12.650 1.00 0.00 H new ATOM 1138 N ASP A 76 1.570 10.494 -9.023 1.00 0.00 N ATOM 1139 CA ASP A 76 2.087 9.274 -8.485 1.00 0.00 C ATOM 1140 C ASP A 76 1.571 8.901 -7.138 1.00 0.00 C ATOM 1141 O ASP A 76 1.529 7.730 -6.765 1.00 0.00 O ATOM 1142 CB ASP A 76 3.622 9.180 -8.435 1.00 0.00 C ATOM 1143 CG ASP A 76 4.311 9.267 -9.789 1.00 0.00 C ATOM 1144 OD1 ASP A 76 3.761 8.553 -10.669 1.00 0.00 O ATOM 1145 OD2 ASP A 76 5.236 10.072 -10.079 1.00 0.00 O ATOM 0 H ASP A 76 2.267 11.238 -8.989 1.00 0.00 H new ATOM 0 HA ASP A 76 1.707 8.564 -9.220 1.00 0.00 H new ATOM 0 HB2 ASP A 76 4.000 9.980 -7.798 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.899 8.238 -7.962 1.00 0.00 H new ATOM 1150 N SER A 77 1.082 9.919 -6.407 1.00 0.00 N ATOM 1151 CA SER A 77 0.653 9.736 -5.055 1.00 0.00 C ATOM 1152 C SER A 77 -0.625 8.970 -5.073 1.00 0.00 C ATOM 1153 O SER A 77 -0.858 7.932 -4.456 1.00 0.00 O ATOM 1154 CB SER A 77 0.582 11.138 -4.428 1.00 0.00 C ATOM 1155 OG SER A 77 0.180 11.014 -3.071 1.00 0.00 O ATOM 0 H SER A 77 0.983 10.873 -6.754 1.00 0.00 H new ATOM 0 HA SER A 77 1.331 9.146 -4.438 1.00 0.00 H new ATOM 0 HB2 SER A 77 1.553 11.629 -4.490 1.00 0.00 H new ATOM 0 HB3 SER A 77 -0.125 11.761 -4.976 1.00 0.00 H new ATOM 0 HG SER A 77 0.133 11.903 -2.661 1.00 0.00 H new ATOM 1161 N GLU A 78 -1.580 9.557 -5.817 1.00 0.00 N ATOM 1162 CA GLU A 78 -2.890 9.040 -6.064 1.00 0.00 C ATOM 1163 C GLU A 78 -2.879 7.675 -6.660 1.00 0.00 C ATOM 1164 O GLU A 78 -3.624 6.785 -6.252 1.00 0.00 O ATOM 1165 CB GLU A 78 -3.786 9.959 -6.913 1.00 0.00 C ATOM 1166 CG GLU A 78 -3.090 10.984 -7.810 1.00 0.00 C ATOM 1167 CD GLU A 78 -3.985 11.998 -8.507 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -4.414 12.958 -7.813 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -4.222 11.839 -9.734 1.00 0.00 O ATOM 0 H GLU A 78 -1.425 10.454 -6.277 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.327 8.986 -5.067 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -4.413 9.329 -7.544 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -4.452 10.498 -6.239 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -2.364 11.529 -7.206 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -2.529 10.444 -8.573 1.00 0.00 H new ATOM 1176 N GLU A 79 -1.884 7.411 -7.526 1.00 0.00 N ATOM 1177 CA GLU A 79 -1.552 6.242 -8.280 1.00 0.00 C ATOM 1178 C GLU A 79 -1.403 5.039 -7.414 1.00 0.00 C ATOM 1179 O GLU A 79 -1.832 3.944 -7.775 1.00 0.00 O ATOM 1180 CB GLU A 79 -0.385 6.486 -9.251 1.00 0.00 C ATOM 1181 CG GLU A 79 -0.168 5.356 -10.259 1.00 0.00 C ATOM 1182 CD GLU A 79 -1.177 5.422 -11.397 1.00 0.00 C ATOM 1183 OE1 GLU A 79 -1.833 6.485 -11.561 1.00 0.00 O ATOM 1184 OE2 GLU A 79 -1.076 4.494 -12.243 1.00 0.00 O ATOM 0 H GLU A 79 -1.204 8.145 -7.724 1.00 0.00 H new ATOM 0 HA GLU A 79 -2.400 6.014 -8.925 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -0.565 7.414 -9.794 1.00 0.00 H new ATOM 0 HB3 GLU A 79 0.530 6.626 -8.675 1.00 0.00 H new ATOM 0 HG2 GLU A 79 0.842 5.417 -10.663 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -0.251 4.394 -9.753 1.00 0.00 H new ATOM 1191 N GLU A 80 -0.870 5.226 -6.193 1.00 0.00 N ATOM 1192 CA GLU A 80 -0.646 4.193 -5.230 1.00 0.00 C ATOM 1193 C GLU A 80 -1.844 3.444 -4.755 1.00 0.00 C ATOM 1194 O GLU A 80 -1.790 2.292 -4.327 1.00 0.00 O ATOM 1195 CB GLU A 80 0.081 4.849 -4.044 1.00 0.00 C ATOM 1196 CG GLU A 80 1.031 3.901 -3.309 1.00 0.00 C ATOM 1197 CD GLU A 80 0.995 4.164 -1.811 1.00 0.00 C ATOM 1198 OE1 GLU A 80 0.939 5.358 -1.411 1.00 0.00 O ATOM 1199 OE2 GLU A 80 1.245 3.137 -1.126 1.00 0.00 O ATOM 0 H GLU A 80 -0.580 6.146 -5.861 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.062 3.419 -5.728 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.646 5.708 -4.405 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.659 5.227 -3.339 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.749 2.867 -3.509 1.00 0.00 H new ATOM 0 HG3 GLU A 80 2.046 4.033 -3.683 1.00 0.00 H new ATOM 1206 N ILE A 81 -3.046 4.037 -4.864 1.00 0.00 N ATOM 1207 CA ILE A 81 -4.253 3.355 -4.513 1.00 0.00 C ATOM 1208 C ILE A 81 -4.857 2.627 -5.665 1.00 0.00 C ATOM 1209 O ILE A 81 -5.415 1.532 -5.622 1.00 0.00 O ATOM 1210 CB ILE A 81 -5.270 4.307 -3.956 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -4.821 5.016 -2.666 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -6.594 3.602 -3.619 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -4.459 4.177 -1.442 1.00 0.00 C ATOM 0 H ILE A 81 -3.182 4.992 -5.196 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.973 2.624 -3.754 1.00 0.00 H new ATOM 0 HB ILE A 81 -5.396 5.041 -4.752 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -3.953 5.628 -2.913 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -5.619 5.698 -2.372 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -7.301 4.328 -3.219 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -7.007 3.153 -4.522 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -6.414 2.824 -2.877 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.165 4.835 -0.624 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -5.322 3.584 -1.139 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -3.631 3.513 -1.688 1.00 0.00 H new ATOM 1225 N ARG A 82 -4.732 3.215 -6.868 1.00 0.00 N ATOM 1226 CA ARG A 82 -5.070 2.687 -8.153 1.00 0.00 C ATOM 1227 C ARG A 82 -4.280 1.439 -8.346 1.00 0.00 C ATOM 1228 O ARG A 82 -4.834 0.418 -8.751 1.00 0.00 O ATOM 1229 CB ARG A 82 -4.717 3.689 -9.265 1.00 0.00 C ATOM 1230 CG ARG A 82 -5.283 5.110 -9.224 1.00 0.00 C ATOM 1231 CD ARG A 82 -4.988 5.946 -10.471 1.00 0.00 C ATOM 1232 NE ARG A 82 -5.409 7.293 -9.994 1.00 0.00 N ATOM 1233 CZ ARG A 82 -4.783 8.435 -10.403 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -3.468 8.433 -10.770 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -5.456 9.608 -10.217 1.00 0.00 N ATOM 0 H ARG A 82 -4.354 4.159 -6.945 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.141 2.490 -8.203 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -3.631 3.774 -9.292 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -5.025 3.245 -10.211 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -6.363 5.054 -9.087 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -4.877 5.624 -8.353 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -3.935 5.915 -10.752 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -5.560 5.615 -11.338 1.00 0.00 H new ATOM 0 HE ARG A 82 -6.190 7.364 -9.341 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -2.932 7.566 -10.742 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -3.022 9.299 -11.072 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -6.382 9.602 -9.790 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -5.033 10.490 -10.505 1.00 0.00 H new ATOM 1249 N GLU A 83 -2.973 1.475 -8.031 1.00 0.00 N ATOM 1250 CA GLU A 83 -2.154 0.304 -8.087 1.00 0.00 C ATOM 1251 C GLU A 83 -2.662 -0.797 -7.222 1.00 0.00 C ATOM 1252 O GLU A 83 -2.899 -1.936 -7.623 1.00 0.00 O ATOM 1253 CB GLU A 83 -0.662 0.520 -7.781 1.00 0.00 C ATOM 1254 CG GLU A 83 0.140 1.166 -8.912 1.00 0.00 C ATOM 1255 CD GLU A 83 0.123 0.191 -10.081 1.00 0.00 C ATOM 1256 OE1 GLU A 83 0.802 -0.870 -10.105 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -0.527 0.543 -11.101 1.00 0.00 O ATOM 0 H GLU A 83 -2.482 2.319 -7.736 1.00 0.00 H new ATOM 0 HA GLU A 83 -2.226 0.022 -9.137 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.575 1.144 -6.891 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.212 -0.443 -7.540 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -0.299 2.121 -9.200 1.00 0.00 H new ATOM 0 HG3 GLU A 83 1.162 1.368 -8.593 1.00 0.00 H new ATOM 1264 N ALA A 84 -3.112 -0.473 -5.997 1.00 0.00 N ATOM 1265 CA ALA A 84 -3.677 -1.428 -5.095 1.00 0.00 C ATOM 1266 C ALA A 84 -4.904 -2.138 -5.553 1.00 0.00 C ATOM 1267 O ALA A 84 -5.040 -3.345 -5.358 1.00 0.00 O ATOM 1268 CB ALA A 84 -3.853 -0.784 -3.709 1.00 0.00 C ATOM 0 H ALA A 84 -3.082 0.476 -5.624 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.953 -2.241 -5.045 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -4.284 -1.512 -3.022 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.883 -0.459 -3.333 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -4.517 0.076 -3.789 1.00 0.00 H new ATOM 1274 N PHE A 85 -5.862 -1.427 -6.173 1.00 0.00 N ATOM 1275 CA PHE A 85 -7.044 -1.923 -6.806 1.00 0.00 C ATOM 1276 C PHE A 85 -6.786 -2.870 -7.927 1.00 0.00 C ATOM 1277 O PHE A 85 -7.434 -3.896 -8.124 1.00 0.00 O ATOM 1278 CB PHE A 85 -8.047 -0.837 -7.230 1.00 0.00 C ATOM 1279 CG PHE A 85 -9.504 -1.138 -7.146 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -10.108 -1.946 -8.080 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -10.298 -0.675 -6.123 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -11.433 -2.302 -7.983 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -11.636 -0.977 -6.026 1.00 0.00 C ATOM 1284 CZ PHE A 85 -12.221 -1.753 -6.999 1.00 0.00 C ATOM 0 H PHE A 85 -5.801 -0.411 -6.236 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.519 -2.493 -6.007 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -7.856 0.046 -6.620 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.824 -0.566 -8.262 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -9.526 -2.311 -8.913 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -9.852 -0.048 -5.365 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -11.854 -3.012 -8.679 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -12.220 -0.609 -5.196 1.00 0.00 H new ATOM 0 HZ PHE A 85 -13.287 -1.929 -6.990 1.00 0.00 H new ATOM 1294 N ARG A 86 -5.719 -2.710 -8.730 1.00 0.00 N ATOM 1295 CA ARG A 86 -5.320 -3.694 -9.688 1.00 0.00 C ATOM 1296 C ARG A 86 -4.914 -5.017 -9.135 1.00 0.00 C ATOM 1297 O ARG A 86 -5.230 -6.049 -9.725 1.00 0.00 O ATOM 1298 CB ARG A 86 -4.116 -3.268 -10.545 1.00 0.00 C ATOM 1299 CG ARG A 86 -4.442 -2.005 -11.345 1.00 0.00 C ATOM 1300 CD ARG A 86 -3.217 -1.342 -11.977 1.00 0.00 C ATOM 1301 NE ARG A 86 -2.919 -1.997 -13.282 1.00 0.00 N ATOM 1302 CZ ARG A 86 -1.717 -2.361 -13.817 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -0.558 -1.961 -13.217 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -1.658 -3.167 -14.917 1.00 0.00 N ATOM 0 H ARG A 86 -5.123 -1.883 -8.714 1.00 0.00 H new ATOM 0 HA ARG A 86 -6.242 -3.786 -10.262 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -3.253 -3.086 -9.904 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -3.843 -4.075 -11.225 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -5.153 -2.258 -12.131 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -4.934 -1.287 -10.689 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -3.401 -0.278 -12.125 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -2.359 -1.427 -11.310 1.00 0.00 H new ATOM 0 HE ARG A 86 -3.733 -2.204 -13.861 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -0.592 -1.392 -12.371 1.00 0.00 H new ATOM 0 HH12 ARG A 86 0.342 -2.231 -13.614 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -2.518 -3.504 -15.349 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -0.754 -3.432 -15.307 1.00 0.00 H new ATOM 1318 N VAL A 87 -4.253 -5.039 -7.964 1.00 0.00 N ATOM 1319 CA VAL A 87 -4.021 -6.286 -7.304 1.00 0.00 C ATOM 1320 C VAL A 87 -5.219 -6.993 -6.771 1.00 0.00 C ATOM 1321 O VAL A 87 -5.490 -8.142 -7.116 1.00 0.00 O ATOM 1322 CB VAL A 87 -2.968 -6.158 -6.243 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.830 -7.425 -5.382 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -1.654 -5.736 -6.921 1.00 0.00 C ATOM 0 H VAL A 87 -3.887 -4.217 -7.484 1.00 0.00 H new ATOM 0 HA VAL A 87 -3.668 -6.930 -8.109 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.262 -5.388 -5.529 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -2.054 -7.273 -4.632 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.778 -7.633 -4.886 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.561 -8.269 -6.017 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.872 -5.636 -6.168 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.362 -6.492 -7.650 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.796 -4.780 -7.426 1.00 0.00 H new ATOM 1334 N PHE A 88 -6.114 -6.266 -6.078 1.00 0.00 N ATOM 1335 CA PHE A 88 -7.264 -6.842 -5.454 1.00 0.00 C ATOM 1336 C PHE A 88 -8.251 -7.330 -6.458 1.00 0.00 C ATOM 1337 O PHE A 88 -8.840 -8.394 -6.273 1.00 0.00 O ATOM 1338 CB PHE A 88 -7.937 -5.867 -4.473 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.286 -5.789 -3.135 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -7.310 -6.872 -2.288 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -6.717 -4.579 -2.817 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -6.794 -6.711 -1.023 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -6.156 -4.454 -1.568 1.00 0.00 C ATOM 1344 CZ PHE A 88 -6.180 -5.523 -0.703 1.00 0.00 C ATOM 0 H PHE A 88 -6.037 -5.257 -5.949 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.907 -7.699 -4.883 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -7.945 -4.872 -4.918 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.977 -6.165 -4.340 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -7.721 -7.819 -2.606 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.711 -3.759 -3.520 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -6.870 -7.504 -0.294 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.699 -3.522 -1.268 1.00 0.00 H new ATOM 0 HZ PHE A 88 -5.701 -5.426 0.260 1.00 0.00 H new ATOM 1354 N ASP A 89 -8.432 -6.602 -7.575 1.00 0.00 N ATOM 1355 CA ASP A 89 -9.337 -6.901 -8.641 1.00 0.00 C ATOM 1356 C ASP A 89 -8.603 -7.556 -9.761 1.00 0.00 C ATOM 1357 O ASP A 89 -8.088 -6.872 -10.643 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.045 -5.629 -9.136 1.00 0.00 C ATOM 1359 CG ASP A 89 -11.264 -5.745 -10.040 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -11.647 -6.930 -10.231 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -11.816 -4.780 -10.632 1.00 0.00 O ATOM 0 H ASP A 89 -7.908 -5.743 -7.744 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.098 -7.585 -8.266 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -10.346 -5.061 -8.256 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.304 -5.029 -9.665 1.00 0.00 H new ATOM 1366 N LYS A 90 -8.472 -8.892 -9.684 1.00 0.00 N ATOM 1367 CA LYS A 90 -7.524 -9.624 -10.466 1.00 0.00 C ATOM 1368 C LYS A 90 -8.044 -9.690 -11.861 1.00 0.00 C ATOM 1369 O LYS A 90 -7.242 -9.584 -12.788 1.00 0.00 O ATOM 1370 CB LYS A 90 -7.310 -11.069 -9.987 1.00 0.00 C ATOM 1371 CG LYS A 90 -6.307 -11.980 -10.697 1.00 0.00 C ATOM 1372 CD LYS A 90 -4.898 -11.414 -10.886 1.00 0.00 C ATOM 1373 CE LYS A 90 -3.938 -12.400 -11.553 1.00 0.00 C ATOM 1374 NZ LYS A 90 -4.452 -12.812 -12.879 1.00 0.00 N ATOM 0 H LYS A 90 -9.036 -9.476 -9.066 1.00 0.00 H new ATOM 0 HA LYS A 90 -6.568 -9.107 -10.381 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -7.015 -11.020 -8.939 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -8.279 -11.567 -10.023 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -6.230 -12.910 -10.134 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -6.709 -12.234 -11.678 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -4.955 -10.508 -11.489 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -4.496 -11.126 -9.915 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -2.956 -11.941 -11.664 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -3.810 -13.277 -10.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -3.700 -13.298 -13.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -5.259 -13.456 -12.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -4.759 -11.971 -13.409 1.00 0.00 H new ATOM 1388 N ASP A 91 -9.370 -9.803 -12.055 1.00 0.00 N ATOM 1389 CA ASP A 91 -10.059 -9.661 -13.300 1.00 0.00 C ATOM 1390 C ASP A 91 -10.082 -8.325 -13.961 1.00 0.00 C ATOM 1391 O ASP A 91 -9.467 -8.089 -14.999 1.00 0.00 O ATOM 1392 CB ASP A 91 -11.500 -10.195 -13.252 1.00 0.00 C ATOM 1393 CG ASP A 91 -12.228 -9.681 -12.018 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -11.942 -10.048 -10.847 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -13.067 -8.759 -12.199 1.00 0.00 O ATOM 0 H ASP A 91 -10.006 -10.009 -11.285 1.00 0.00 H new ATOM 0 HA ASP A 91 -9.414 -10.276 -13.928 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.036 -9.888 -14.150 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.488 -11.285 -13.245 1.00 0.00 H new ATOM 1400 N GLY A 92 -10.613 -7.294 -13.280 1.00 0.00 N ATOM 1401 CA GLY A 92 -10.581 -5.887 -13.533 1.00 0.00 C ATOM 1402 C GLY A 92 -11.862 -5.339 -14.062 1.00 0.00 C ATOM 1403 O GLY A 92 -11.931 -4.493 -14.953 1.00 0.00 O ATOM 0 H GLY A 92 -11.141 -7.482 -12.428 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.329 -5.367 -12.609 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -9.784 -5.674 -14.246 1.00 0.00 H new ATOM 1407 N ASN A 93 -12.960 -5.739 -13.397 1.00 0.00 N ATOM 1408 CA ASN A 93 -14.306 -5.309 -13.620 1.00 0.00 C ATOM 1409 C ASN A 93 -14.734 -4.067 -12.916 1.00 0.00 C ATOM 1410 O ASN A 93 -15.678 -3.406 -13.347 1.00 0.00 O ATOM 1411 CB ASN A 93 -15.309 -6.447 -13.365 1.00 0.00 C ATOM 1412 CG ASN A 93 -15.848 -6.550 -11.945 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -15.023 -6.521 -11.033 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -17.179 -6.774 -11.781 1.00 0.00 N ATOM 0 H ASN A 93 -12.900 -6.420 -12.640 1.00 0.00 H new ATOM 0 HA ASN A 93 -14.308 -5.034 -14.675 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -16.152 -6.322 -14.045 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -14.830 -7.392 -13.621 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -17.558 -6.934 -10.848 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -17.798 -6.782 -12.591 1.00 0.00 H new ATOM 1421 N GLY A 94 -14.111 -3.794 -11.756 1.00 0.00 N ATOM 1422 CA GLY A 94 -14.298 -2.611 -10.975 1.00 0.00 C ATOM 1423 C GLY A 94 -14.643 -2.946 -9.565 1.00 0.00 C ATOM 1424 O GLY A 94 -14.815 -2.003 -8.795 1.00 0.00 O ATOM 0 H GLY A 94 -13.438 -4.437 -11.339 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.389 -2.010 -10.997 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -15.091 -2.005 -11.412 1.00 0.00 H new ATOM 1428 N TYR A 95 -14.782 -4.231 -9.193 1.00 0.00 N ATOM 1429 CA TYR A 95 -15.343 -4.675 -7.954 1.00 0.00 C ATOM 1430 C TYR A 95 -14.572 -5.831 -7.418 1.00 0.00 C ATOM 1431 O TYR A 95 -14.270 -6.767 -8.156 1.00 0.00 O ATOM 1432 CB TYR A 95 -16.794 -5.176 -8.057 1.00 0.00 C ATOM 1433 CG TYR A 95 -17.682 -4.083 -8.546 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -18.133 -3.105 -7.691 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -18.064 -3.985 -9.863 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -18.977 -2.108 -8.120 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -18.931 -3.017 -10.311 1.00 0.00 C ATOM 1438 CZ TYR A 95 -19.453 -2.118 -9.410 1.00 0.00 C ATOM 1439 OH TYR A 95 -20.482 -1.249 -9.828 1.00 0.00 O ATOM 0 H TYR A 95 -14.486 -5.003 -9.790 1.00 0.00 H new ATOM 0 HA TYR A 95 -15.306 -3.793 -7.315 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -16.845 -6.027 -8.736 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -17.136 -5.524 -7.083 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -17.817 -3.120 -6.658 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -17.668 -4.696 -10.573 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -19.266 -1.317 -7.444 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -19.199 -2.963 -11.356 1.00 0.00 H new ATOM 0 HH TYR A 95 -20.679 -1.407 -10.775 1.00 0.00 H new ATOM 1449 N ILE A 96 -14.246 -5.803 -6.113 1.00 0.00 N ATOM 1450 CA ILE A 96 -13.699 -6.920 -5.406 1.00 0.00 C ATOM 1451 C ILE A 96 -14.909 -7.519 -4.775 1.00 0.00 C ATOM 1452 O ILE A 96 -15.762 -6.839 -4.208 1.00 0.00 O ATOM 1453 CB ILE A 96 -12.590 -6.629 -4.439 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -11.807 -5.322 -4.652 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.668 -7.858 -4.512 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -11.099 -4.937 -3.354 1.00 0.00 C ATOM 0 H ILE A 96 -14.367 -4.975 -5.530 1.00 0.00 H new ATOM 0 HA ILE A 96 -13.166 -7.592 -6.079 1.00 0.00 H new ATOM 0 HB ILE A 96 -13.027 -6.459 -3.455 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -11.078 -5.448 -5.453 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -12.484 -4.525 -4.960 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.828 -7.724 -3.831 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -12.227 -8.750 -4.227 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -11.295 -7.973 -5.530 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -10.544 -4.011 -3.503 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -11.838 -4.794 -2.565 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -10.410 -5.731 -3.066 1.00 0.00 H new ATOM 1468 N SER A 97 -15.109 -8.846 -4.864 1.00 0.00 N ATOM 1469 CA SER A 97 -16.138 -9.544 -4.157 1.00 0.00 C ATOM 1470 C SER A 97 -15.606 -10.284 -2.979 1.00 0.00 C ATOM 1471 O SER A 97 -14.389 -10.344 -2.814 1.00 0.00 O ATOM 1472 CB SER A 97 -16.952 -10.533 -5.008 1.00 0.00 C ATOM 1473 OG SER A 97 -16.310 -11.741 -5.390 1.00 0.00 O ATOM 0 H SER A 97 -14.535 -9.454 -5.448 1.00 0.00 H new ATOM 0 HA SER A 97 -16.809 -8.745 -3.842 1.00 0.00 H new ATOM 0 HB2 SER A 97 -17.855 -10.791 -4.455 1.00 0.00 H new ATOM 0 HB3 SER A 97 -17.269 -10.017 -5.915 1.00 0.00 H new ATOM 0 HG SER A 97 -16.927 -12.285 -5.924 1.00 0.00 H new ATOM 1479 N ALA A 98 -16.447 -10.996 -2.208 1.00 0.00 N ATOM 1480 CA ALA A 98 -16.031 -12.064 -1.353 1.00 0.00 C ATOM 1481 C ALA A 98 -15.198 -13.188 -1.863 1.00 0.00 C ATOM 1482 O ALA A 98 -14.115 -13.378 -1.311 1.00 0.00 O ATOM 1483 CB ALA A 98 -17.314 -12.405 -0.576 1.00 0.00 C ATOM 0 H ALA A 98 -17.452 -10.822 -2.179 1.00 0.00 H new ATOM 0 HA ALA A 98 -15.209 -11.730 -0.720 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -17.113 -13.221 0.118 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -17.646 -11.528 -0.020 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -18.093 -12.708 -1.275 1.00 0.00 H new ATOM 1489 N ALA A 99 -15.634 -13.849 -2.951 1.00 0.00 N ATOM 1490 CA ALA A 99 -14.964 -14.904 -3.646 1.00 0.00 C ATOM 1491 C ALA A 99 -13.598 -14.511 -4.091 1.00 0.00 C ATOM 1492 O ALA A 99 -12.588 -15.107 -3.719 1.00 0.00 O ATOM 1493 CB ALA A 99 -15.747 -15.291 -4.912 1.00 0.00 C ATOM 0 H ALA A 99 -16.532 -13.624 -3.379 1.00 0.00 H new ATOM 0 HA ALA A 99 -14.897 -15.734 -2.942 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -15.225 -16.095 -5.431 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -16.746 -15.627 -4.634 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.826 -14.426 -5.570 1.00 0.00 H new ATOM 1499 N GLU A 100 -13.417 -13.333 -4.713 1.00 0.00 N ATOM 1500 CA GLU A 100 -12.205 -12.668 -5.080 1.00 0.00 C ATOM 1501 C GLU A 100 -11.325 -12.442 -3.898 1.00 0.00 C ATOM 1502 O GLU A 100 -10.126 -12.705 -3.964 1.00 0.00 O ATOM 1503 CB GLU A 100 -12.578 -11.263 -5.582 1.00 0.00 C ATOM 1504 CG GLU A 100 -13.176 -11.355 -6.987 1.00 0.00 C ATOM 1505 CD GLU A 100 -13.361 -9.950 -7.541 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -12.369 -9.219 -7.801 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -14.479 -9.631 -8.028 1.00 0.00 O ATOM 0 H GLU A 100 -14.227 -12.779 -4.993 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.693 -13.283 -5.820 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -13.294 -10.802 -4.902 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -11.694 -10.625 -5.594 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -12.520 -11.933 -7.638 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -14.133 -11.876 -6.955 1.00 0.00 H new ATOM 1514 N LEU A 101 -11.825 -12.010 -2.727 1.00 0.00 N ATOM 1515 CA LEU A 101 -11.015 -11.699 -1.589 1.00 0.00 C ATOM 1516 C LEU A 101 -10.429 -12.894 -0.919 1.00 0.00 C ATOM 1517 O LEU A 101 -9.240 -12.904 -0.607 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.833 -10.868 -0.585 1.00 0.00 C ATOM 1519 CG LEU A 101 -11.036 -10.301 0.602 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -10.107 -9.196 0.072 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -11.975 -9.809 1.717 1.00 0.00 C ATOM 0 H LEU A 101 -12.823 -11.873 -2.566 1.00 0.00 H new ATOM 0 HA LEU A 101 -10.167 -11.122 -1.958 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -12.298 -10.039 -1.118 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -12.640 -11.489 -0.196 1.00 0.00 H new ATOM 0 HG LEU A 101 -10.426 -11.081 1.058 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.531 -8.778 0.897 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -9.427 -9.617 -0.669 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -10.704 -8.409 -0.389 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.383 -9.414 2.543 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.623 -9.024 1.327 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.584 -10.640 2.072 1.00 0.00 H new ATOM 1533 N ARG A 102 -11.193 -13.997 -0.816 1.00 0.00 N ATOM 1534 CA ARG A 102 -10.770 -15.274 -0.333 1.00 0.00 C ATOM 1535 C ARG A 102 -9.661 -15.884 -1.119 1.00 0.00 C ATOM 1536 O ARG A 102 -8.716 -16.461 -0.583 1.00 0.00 O ATOM 1537 CB ARG A 102 -11.983 -16.219 -0.383 1.00 0.00 C ATOM 1538 CG ARG A 102 -11.941 -17.394 0.595 1.00 0.00 C ATOM 1539 CD ARG A 102 -12.713 -18.620 0.101 1.00 0.00 C ATOM 1540 NE ARG A 102 -13.150 -19.529 1.197 1.00 0.00 N ATOM 1541 CZ ARG A 102 -12.422 -20.519 1.790 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -11.099 -20.721 1.519 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -13.058 -21.355 2.663 1.00 0.00 N ATOM 0 H ARG A 102 -12.175 -13.994 -1.090 1.00 0.00 H new ATOM 0 HA ARG A 102 -10.387 -15.127 0.677 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -12.884 -15.637 -0.187 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -12.073 -16.614 -1.395 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -10.902 -17.674 0.772 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -12.353 -17.076 1.553 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -13.589 -18.288 -0.456 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -12.086 -19.178 -0.595 1.00 0.00 H new ATOM 0 HE ARG A 102 -14.100 -19.397 1.543 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -10.618 -20.119 0.850 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -10.592 -21.473 1.985 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -14.052 -21.230 2.857 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -12.539 -22.104 3.121 1.00 0.00 H new ATOM 1557 N HIS A 103 -9.654 -15.581 -2.430 1.00 0.00 N ATOM 1558 CA HIS A 103 -8.600 -15.994 -3.303 1.00 0.00 C ATOM 1559 C HIS A 103 -7.359 -15.175 -3.195 1.00 0.00 C ATOM 1560 O HIS A 103 -6.293 -15.781 -3.098 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.944 -15.771 -4.785 1.00 0.00 C ATOM 1562 CG HIS A 103 -8.006 -16.333 -5.811 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -7.613 -15.770 -7.008 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -7.423 -17.562 -5.785 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -6.957 -16.744 -7.694 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -6.811 -17.850 -6.988 1.00 0.00 N ATOM 0 H HIS A 103 -10.389 -15.043 -2.889 1.00 0.00 H new ATOM 0 HA HIS A 103 -8.464 -17.034 -3.006 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -9.932 -16.193 -4.967 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -9.021 -14.697 -4.953 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -7.437 -18.226 -4.933 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -6.595 -16.626 -8.705 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -6.352 -18.717 -7.267 1.00 0.00 H new ATOM 1574 N VAL A 104 -7.464 -13.840 -3.316 1.00 0.00 N ATOM 1575 CA VAL A 104 -6.322 -12.981 -3.386 1.00 0.00 C ATOM 1576 C VAL A 104 -5.505 -12.770 -2.158 1.00 0.00 C ATOM 1577 O VAL A 104 -4.298 -12.532 -2.162 1.00 0.00 O ATOM 1578 CB VAL A 104 -6.653 -11.712 -4.114 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -7.418 -11.993 -5.419 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -7.508 -10.728 -3.299 1.00 0.00 C ATOM 0 H VAL A 104 -8.356 -13.348 -3.366 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.612 -13.565 -3.971 1.00 0.00 H new ATOM 0 HB VAL A 104 -5.681 -11.258 -4.309 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.641 -11.051 -5.920 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -6.807 -12.615 -6.072 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -8.349 -12.512 -5.191 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -7.704 -9.836 -3.895 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -8.453 -11.201 -3.033 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -6.974 -10.448 -2.391 1.00 0.00 H new ATOM 1590 N MET A 105 -6.100 -12.949 -0.965 1.00 0.00 N ATOM 1591 CA MET A 105 -5.688 -12.965 0.404 1.00 0.00 C ATOM 1592 C MET A 105 -4.872 -14.180 0.686 1.00 0.00 C ATOM 1593 O MET A 105 -3.709 -14.103 1.079 1.00 0.00 O ATOM 1594 CB MET A 105 -6.833 -12.624 1.371 1.00 0.00 C ATOM 1595 CG MET A 105 -7.394 -11.209 1.217 1.00 0.00 C ATOM 1596 SD MET A 105 -6.179 -9.876 1.438 1.00 0.00 S ATOM 1597 CE MET A 105 -6.541 -9.804 3.216 1.00 0.00 C ATOM 0 H MET A 105 -7.105 -13.122 -0.982 1.00 0.00 H new ATOM 0 HA MET A 105 -5.001 -12.142 0.601 1.00 0.00 H new ATOM 0 HB2 MET A 105 -7.642 -13.340 1.223 1.00 0.00 H new ATOM 0 HB3 MET A 105 -6.478 -12.751 2.394 1.00 0.00 H new ATOM 0 HG2 MET A 105 -7.838 -11.116 0.226 1.00 0.00 H new ATOM 0 HG3 MET A 105 -8.198 -11.072 1.940 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.365 -8.793 3.582 1.00 0.00 H new ATOM 0 HE2 MET A 105 -7.583 -10.076 3.387 1.00 0.00 H new ATOM 0 HE3 MET A 105 -5.892 -10.500 3.748 1.00 0.00 H new ATOM 1607 N THR A 106 -5.393 -15.355 0.289 1.00 0.00 N ATOM 1608 CA THR A 106 -4.708 -16.609 0.348 1.00 0.00 C ATOM 1609 C THR A 106 -3.439 -16.590 -0.433 1.00 0.00 C ATOM 1610 O THR A 106 -2.411 -17.145 -0.049 1.00 0.00 O ATOM 1611 CB THR A 106 -5.645 -17.730 0.011 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.771 -17.786 0.874 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.940 -19.090 0.143 1.00 0.00 C ATOM 0 H THR A 106 -6.336 -15.434 -0.091 1.00 0.00 H new ATOM 0 HA THR A 106 -4.381 -16.793 1.371 1.00 0.00 H new ATOM 0 HB THR A 106 -5.968 -17.534 -1.011 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.527 -17.322 0.456 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.639 -19.888 -0.106 1.00 0.00 H new ATOM 0 HG22 THR A 106 -4.090 -19.127 -0.538 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.590 -19.221 1.167 1.00 0.00 H new ATOM 1621 N ASN A 107 -3.427 -15.977 -1.630 1.00 0.00 N ATOM 1622 CA ASN A 107 -2.304 -15.823 -2.502 1.00 0.00 C ATOM 1623 C ASN A 107 -1.205 -14.898 -2.106 1.00 0.00 C ATOM 1624 O ASN A 107 -0.041 -14.898 -2.504 1.00 0.00 O ATOM 1625 CB ASN A 107 -2.883 -15.450 -3.877 1.00 0.00 C ATOM 1626 CG ASN A 107 -3.569 -16.616 -4.576 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -3.317 -17.787 -4.297 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -4.406 -16.265 -5.588 1.00 0.00 N ATOM 0 H ASN A 107 -4.271 -15.556 -2.018 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.771 -16.773 -2.479 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.598 -14.637 -3.754 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.080 -15.075 -4.512 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.855 -16.987 -6.152 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -4.585 -15.280 -5.783 1.00 0.00 H new ATOM 1635 N LEU A 108 -1.615 -13.997 -1.196 1.00 0.00 N ATOM 1636 CA LEU A 108 -0.776 -13.086 -0.482 1.00 0.00 C ATOM 1637 C LEU A 108 -0.009 -13.752 0.609 1.00 0.00 C ATOM 1638 O LEU A 108 1.211 -13.659 0.735 1.00 0.00 O ATOM 1639 CB LEU A 108 -1.676 -11.918 -0.042 1.00 0.00 C ATOM 1640 CG LEU A 108 -0.956 -10.637 0.412 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -0.374 -9.847 -0.772 1.00 0.00 C ATOM 1642 CD2 LEU A 108 -2.037 -9.772 1.083 1.00 0.00 C ATOM 0 H LEU A 108 -2.598 -13.899 -0.943 1.00 0.00 H new ATOM 0 HA LEU A 108 0.022 -12.691 -1.111 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.336 -11.664 -0.871 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -2.309 -12.263 0.776 1.00 0.00 H new ATOM 0 HG LEU A 108 -0.126 -10.892 1.071 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.125 -8.951 -0.402 1.00 0.00 H new ATOM 0 HD12 LEU A 108 0.345 -10.468 -1.306 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -1.179 -9.561 -1.449 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -1.592 -8.840 1.432 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -2.825 -9.551 0.363 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -2.461 -10.311 1.930 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.756 -14.553 1.389 1.00 0.00 N ATOM 1655 CA GLY A 109 -0.171 -15.534 2.249 1.00 0.00 C ATOM 1656 C GLY A 109 -0.973 -15.790 3.479 1.00 0.00 C ATOM 1657 O GLY A 109 -0.581 -16.453 4.438 1.00 0.00 O ATOM 0 H GLY A 109 -1.775 -14.520 1.424 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -0.054 -16.467 1.698 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.828 -15.206 2.536 1.00 0.00 H new ATOM 1661 N GLU A 110 -2.203 -15.250 3.421 1.00 0.00 N ATOM 1662 CA GLU A 110 -3.186 -15.238 4.460 1.00 0.00 C ATOM 1663 C GLU A 110 -4.303 -16.168 4.131 1.00 0.00 C ATOM 1664 O GLU A 110 -5.208 -15.902 3.342 1.00 0.00 O ATOM 1665 CB GLU A 110 -3.804 -13.858 4.740 1.00 0.00 C ATOM 1666 CG GLU A 110 -2.810 -12.880 5.368 1.00 0.00 C ATOM 1667 CD GLU A 110 -2.367 -13.372 6.738 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -3.123 -13.025 7.685 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -1.249 -13.916 6.944 1.00 0.00 O ATOM 0 H GLU A 110 -2.536 -14.784 2.577 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.644 -15.547 5.354 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.180 -13.438 3.807 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.660 -13.976 5.405 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.942 -12.768 4.718 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.269 -11.896 5.460 1.00 0.00 H new ATOM 1676 N LYS A 111 -4.241 -17.366 4.739 1.00 0.00 N ATOM 1677 CA LYS A 111 -5.167 -18.409 4.426 1.00 0.00 C ATOM 1678 C LYS A 111 -6.448 -18.183 5.153 1.00 0.00 C ATOM 1679 O LYS A 111 -6.767 -18.720 6.213 1.00 0.00 O ATOM 1680 CB LYS A 111 -4.538 -19.692 4.993 1.00 0.00 C ATOM 1681 CG LYS A 111 -3.215 -20.108 4.347 1.00 0.00 C ATOM 1682 CD LYS A 111 -2.866 -21.554 4.704 1.00 0.00 C ATOM 1683 CE LYS A 111 -1.554 -22.172 4.215 1.00 0.00 C ATOM 1684 NZ LYS A 111 -1.508 -22.189 2.736 1.00 0.00 N ATOM 0 H LYS A 111 -3.550 -17.612 5.447 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.363 -18.456 3.355 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -4.375 -19.556 6.062 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -5.252 -20.508 4.880 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -3.285 -20.003 3.264 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -2.418 -19.444 4.681 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -2.873 -21.629 5.791 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -3.677 -22.183 4.335 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -0.710 -21.603 4.604 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -1.458 -23.187 4.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -0.611 -22.611 2.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -2.303 -22.751 2.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -1.578 -21.216 2.375 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.324 -17.373 4.532 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.580 -16.965 5.080 1.00 0.00 C ATOM 1700 C LEU A 112 -9.614 -18.023 4.907 1.00 0.00 C ATOM 1701 O LEU A 112 -9.690 -18.750 3.918 1.00 0.00 O ATOM 1702 CB LEU A 112 -9.107 -15.638 4.508 1.00 0.00 C ATOM 1703 CG LEU A 112 -8.198 -14.414 4.712 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -8.968 -13.093 4.544 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -7.602 -14.318 6.126 1.00 0.00 C ATOM 0 H LEU A 112 -7.148 -16.985 3.605 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.387 -16.803 6.141 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.277 -15.767 3.439 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.075 -15.428 4.962 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.419 -14.553 3.962 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.289 -12.254 4.696 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.388 -13.042 3.540 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.773 -13.046 5.277 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -6.972 -13.431 6.196 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.408 -14.250 6.857 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.002 -15.205 6.329 1.00 0.00 H new ATOM 1717 N THR A 113 -10.545 -18.075 5.877 1.00 0.00 N ATOM 1718 CA THR A 113 -11.781 -18.794 5.851 1.00 0.00 C ATOM 1719 C THR A 113 -12.845 -17.845 5.415 1.00 0.00 C ATOM 1720 O THR A 113 -12.545 -16.669 5.215 1.00 0.00 O ATOM 1721 CB THR A 113 -11.998 -19.452 7.181 1.00 0.00 C ATOM 1722 OG1 THR A 113 -12.161 -18.638 8.334 1.00 0.00 O ATOM 1723 CG2 THR A 113 -10.806 -20.402 7.391 1.00 0.00 C ATOM 0 H THR A 113 -10.420 -17.570 6.754 1.00 0.00 H new ATOM 0 HA THR A 113 -11.788 -19.614 5.133 1.00 0.00 H new ATOM 0 HB THR A 113 -12.975 -19.930 7.107 1.00 0.00 H new ATOM 0 HG1 THR A 113 -12.294 -19.208 9.120 1.00 0.00 H new ATOM 0 HG21 THR A 113 -10.911 -20.911 8.349 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.783 -21.139 6.589 1.00 0.00 H new ATOM 0 HG23 THR A 113 -9.879 -19.829 7.384 1.00 0.00 H new ATOM 1731 N ASP A 114 -14.112 -18.274 5.278 1.00 0.00 N ATOM 1732 CA ASP A 114 -15.217 -17.501 4.802 1.00 0.00 C ATOM 1733 C ASP A 114 -15.727 -16.501 5.782 1.00 0.00 C ATOM 1734 O ASP A 114 -15.918 -15.334 5.445 1.00 0.00 O ATOM 1735 CB ASP A 114 -16.397 -18.391 4.380 1.00 0.00 C ATOM 1736 CG ASP A 114 -15.937 -19.474 3.413 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -15.741 -19.128 2.217 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -15.687 -20.648 3.794 1.00 0.00 O ATOM 0 H ASP A 114 -14.382 -19.228 5.517 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.813 -16.964 3.944 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -16.846 -18.850 5.261 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -17.169 -17.781 3.910 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.775 -16.943 7.051 1.00 0.00 N ATOM 1744 CA GLU A 115 -15.968 -16.116 8.202 1.00 0.00 C ATOM 1745 C GLU A 115 -15.128 -14.887 8.272 1.00 0.00 C ATOM 1746 O GLU A 115 -15.611 -13.767 8.429 1.00 0.00 O ATOM 1747 CB GLU A 115 -15.553 -16.927 9.441 1.00 0.00 C ATOM 1748 CG GLU A 115 -15.763 -16.339 10.837 1.00 0.00 C ATOM 1749 CD GLU A 115 -15.449 -17.299 11.976 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -16.219 -18.291 12.079 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -14.596 -17.048 12.868 1.00 0.00 O ATOM 0 H GLU A 115 -15.674 -17.930 7.287 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.014 -15.813 8.150 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -16.088 -17.876 9.403 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -14.492 -17.156 9.340 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -15.138 -15.452 10.942 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -16.799 -16.012 10.928 1.00 0.00 H new ATOM 1758 N GLU A 116 -13.790 -14.946 8.150 1.00 0.00 N ATOM 1759 CA GLU A 116 -12.862 -13.863 8.048 1.00 0.00 C ATOM 1760 C GLU A 116 -13.144 -12.910 6.938 1.00 0.00 C ATOM 1761 O GLU A 116 -13.168 -11.687 7.069 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.481 -14.501 7.816 1.00 0.00 C ATOM 1763 CG GLU A 116 -11.149 -15.234 9.118 1.00 0.00 C ATOM 1764 CD GLU A 116 -9.726 -15.769 9.187 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -9.400 -16.674 8.373 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -8.910 -15.355 10.053 1.00 0.00 O ATOM 0 H GLU A 116 -13.312 -15.846 8.120 1.00 0.00 H new ATOM 0 HA GLU A 116 -12.928 -13.273 8.962 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.503 -15.190 6.972 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -10.731 -13.743 7.589 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.311 -14.555 9.955 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.844 -16.065 9.242 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.482 -13.483 5.769 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.833 -12.728 4.607 1.00 0.00 C ATOM 1775 C VAL A 117 -15.120 -11.991 4.751 1.00 0.00 C ATOM 1776 O VAL A 117 -15.157 -10.772 4.590 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.825 -13.578 3.371 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.539 -13.018 2.130 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -12.336 -13.777 3.040 1.00 0.00 C ATOM 0 H VAL A 117 -13.512 -14.493 5.628 1.00 0.00 H new ATOM 0 HA VAL A 117 -13.058 -11.969 4.499 1.00 0.00 H new ATOM 0 HB VAL A 117 -14.388 -14.484 3.595 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.457 -13.732 1.310 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.591 -12.849 2.361 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -14.076 -12.075 1.838 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.241 -14.391 2.144 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.869 -12.807 2.866 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -11.841 -14.274 3.875 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.176 -12.664 5.242 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.421 -12.047 5.581 1.00 0.00 C ATOM 1791 C ASP A 118 -17.389 -10.810 6.411 1.00 0.00 C ATOM 1792 O ASP A 118 -17.993 -9.819 6.005 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.276 -13.019 6.411 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.723 -12.671 6.729 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -19.857 -11.855 7.680 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.646 -13.232 6.081 1.00 0.00 O ATOM 0 H ASP A 118 -16.163 -13.670 5.409 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.806 -11.780 4.597 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -18.279 -13.976 5.890 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -17.763 -13.174 7.360 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.606 -10.721 7.501 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.358 -9.671 8.440 1.00 0.00 C ATOM 1803 C GLU A 119 -15.655 -8.519 7.809 1.00 0.00 C ATOM 1804 O GLU A 119 -16.023 -7.350 7.911 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.405 -10.179 9.535 1.00 0.00 C ATOM 1806 CG GLU A 119 -15.352 -9.280 10.772 1.00 0.00 C ATOM 1807 CD GLU A 119 -14.707 -9.874 12.015 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -13.452 -9.953 12.098 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -15.387 -10.507 12.866 1.00 0.00 O ATOM 0 H GLU A 119 -16.052 -11.537 7.762 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.329 -9.363 8.829 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -15.714 -11.180 9.837 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.402 -10.268 9.118 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.813 -8.370 10.510 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -16.371 -8.986 11.024 1.00 0.00 H new ATOM 1816 N MET A 120 -14.612 -8.900 7.050 1.00 0.00 N ATOM 1817 CA MET A 120 -13.761 -8.101 6.224 1.00 0.00 C ATOM 1818 C MET A 120 -14.422 -7.256 5.190 1.00 0.00 C ATOM 1819 O MET A 120 -14.336 -6.037 5.049 1.00 0.00 O ATOM 1820 CB MET A 120 -12.640 -8.942 5.591 1.00 0.00 C ATOM 1821 CG MET A 120 -11.582 -8.001 5.011 1.00 0.00 C ATOM 1822 SD MET A 120 -10.000 -8.870 4.793 1.00 0.00 S ATOM 1823 CE MET A 120 -8.907 -7.450 4.498 1.00 0.00 C ATOM 0 H MET A 120 -14.337 -9.881 7.014 1.00 0.00 H new ATOM 0 HA MET A 120 -13.347 -7.381 6.930 1.00 0.00 H new ATOM 0 HB2 MET A 120 -12.193 -9.597 6.338 1.00 0.00 H new ATOM 0 HB3 MET A 120 -13.046 -9.582 4.807 1.00 0.00 H new ATOM 0 HG2 MET A 120 -11.923 -7.609 4.053 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.445 -7.147 5.674 1.00 0.00 H new ATOM 0 HE1 MET A 120 -7.893 -7.700 4.811 1.00 0.00 H new ATOM 0 HE2 MET A 120 -8.908 -7.204 3.436 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.262 -6.592 5.069 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.335 -7.981 4.520 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.133 -7.478 3.446 1.00 0.00 C ATOM 1835 C ILE A 121 -17.104 -6.467 3.950 1.00 0.00 C ATOM 1836 O ILE A 121 -17.221 -5.310 3.550 1.00 0.00 O ATOM 1837 CB ILE A 121 -16.829 -8.463 2.554 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -15.735 -9.081 1.667 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -18.032 -7.843 1.824 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -15.299 -8.366 0.389 1.00 0.00 C ATOM 0 H ILE A 121 -15.525 -8.960 4.736 1.00 0.00 H new ATOM 0 HA ILE A 121 -15.388 -7.037 2.784 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.309 -9.267 3.112 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -14.848 -9.209 2.287 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.072 -10.078 1.383 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.501 -8.596 1.191 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -18.755 -7.482 2.556 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.694 -7.011 1.207 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.521 -8.947 -0.106 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -16.154 -8.261 -0.279 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -14.911 -7.379 0.639 1.00 0.00 H new ATOM 1852 N ARG A 122 -17.853 -6.891 4.983 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.880 -6.131 5.626 1.00 0.00 C ATOM 1854 C ARG A 122 -18.295 -4.927 6.279 1.00 0.00 C ATOM 1855 O ARG A 122 -19.016 -3.935 6.375 1.00 0.00 O ATOM 1856 CB ARG A 122 -19.642 -6.950 6.683 1.00 0.00 C ATOM 1857 CG ARG A 122 -21.113 -7.035 6.269 1.00 0.00 C ATOM 1858 CD ARG A 122 -21.427 -7.756 4.957 1.00 0.00 C ATOM 1859 NE ARG A 122 -21.413 -9.244 5.044 1.00 0.00 N ATOM 1860 CZ ARG A 122 -21.231 -10.078 3.979 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -21.443 -9.555 2.736 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -20.913 -11.404 4.041 1.00 0.00 N ATOM 0 H ARG A 122 -17.735 -7.818 5.393 1.00 0.00 H new ATOM 0 HA ARG A 122 -19.587 -5.838 4.850 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.215 -7.949 6.767 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -19.551 -6.481 7.663 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -21.661 -7.533 7.068 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -21.504 -6.020 6.199 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -22.409 -7.435 4.608 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -20.703 -7.443 4.204 1.00 0.00 H new ATOM 0 HE ARG A 122 -21.549 -9.668 5.962 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -21.725 -8.580 2.634 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -21.320 -10.139 1.909 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -20.790 -11.857 4.946 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -20.798 -11.942 3.182 1.00 0.00 H new ATOM 1876 N GLU A 123 -17.033 -4.892 6.744 1.00 0.00 N ATOM 1877 CA GLU A 123 -16.294 -3.755 7.198 1.00 0.00 C ATOM 1878 C GLU A 123 -16.112 -2.703 6.159 1.00 0.00 C ATOM 1879 O GLU A 123 -16.479 -1.545 6.350 1.00 0.00 O ATOM 1880 CB GLU A 123 -14.875 -4.013 7.732 1.00 0.00 C ATOM 1881 CG GLU A 123 -14.367 -3.020 8.781 1.00 0.00 C ATOM 1882 CD GLU A 123 -12.946 -3.416 9.154 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -12.875 -4.223 10.119 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -11.961 -2.832 8.629 1.00 0.00 O ATOM 0 H GLU A 123 -16.478 -5.745 6.807 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.941 -3.440 8.017 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -14.846 -5.014 8.162 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -14.184 -4.008 6.889 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -14.388 -2.004 8.386 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -15.010 -3.033 9.661 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.631 -3.074 4.959 1.00 0.00 N ATOM 1892 CA ALA A 124 -15.389 -2.302 3.779 1.00 0.00 C ATOM 1893 C ALA A 124 -16.629 -1.771 3.145 1.00 0.00 C ATOM 1894 O ALA A 124 -16.740 -0.584 2.841 1.00 0.00 O ATOM 1895 CB ALA A 124 -14.494 -3.128 2.840 1.00 0.00 C ATOM 0 H ALA A 124 -15.379 -4.050 4.800 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.858 -1.389 4.047 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -14.296 -2.558 1.932 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.552 -3.353 3.340 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -14.999 -4.059 2.582 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.595 -2.666 2.873 1.00 0.00 N ATOM 1902 CA ASP A 125 -18.877 -2.419 2.288 1.00 0.00 C ATOM 1903 C ASP A 125 -19.794 -1.565 3.093 1.00 0.00 C ATOM 1904 O ASP A 125 -20.193 -1.882 4.213 1.00 0.00 O ATOM 1905 CB ASP A 125 -19.582 -3.774 2.113 1.00 0.00 C ATOM 1906 CG ASP A 125 -20.865 -3.687 1.298 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.901 -3.082 0.193 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -21.823 -4.411 1.678 1.00 0.00 O ATOM 0 H ASP A 125 -17.464 -3.656 3.083 1.00 0.00 H new ATOM 0 HA ASP A 125 -18.679 -1.885 1.359 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -18.899 -4.471 1.628 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -19.812 -4.185 3.096 1.00 0.00 H new ATOM 1913 N ILE A 126 -20.111 -0.331 2.661 1.00 0.00 N ATOM 1914 CA ILE A 126 -20.966 0.567 3.372 1.00 0.00 C ATOM 1915 C ILE A 126 -22.360 0.422 2.865 1.00 0.00 C ATOM 1916 O ILE A 126 -23.240 0.226 3.701 1.00 0.00 O ATOM 1917 CB ILE A 126 -20.461 1.976 3.463 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -21.303 2.835 4.422 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -20.477 2.632 2.072 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -21.261 2.345 5.869 1.00 0.00 C ATOM 0 H ILE A 126 -19.759 0.055 1.785 1.00 0.00 H new ATOM 0 HA ILE A 126 -20.966 0.277 4.423 1.00 0.00 H new ATOM 0 HB ILE A 126 -19.444 1.925 3.852 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -20.947 3.864 4.384 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -22.337 2.843 4.078 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -20.109 3.655 2.148 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -19.838 2.065 1.395 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -21.496 2.641 1.686 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -21.876 2.995 6.491 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -21.645 1.326 5.919 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -20.233 2.364 6.230 1.00 0.00 H new ATOM 1932 N ASP A 127 -22.631 0.422 1.547 1.00 0.00 N ATOM 1933 CA ASP A 127 -23.907 0.298 0.913 1.00 0.00 C ATOM 1934 C ASP A 127 -24.681 -0.930 1.250 1.00 0.00 C ATOM 1935 O ASP A 127 -25.803 -0.857 1.748 1.00 0.00 O ATOM 1936 CB ASP A 127 -23.894 0.629 -0.589 1.00 0.00 C ATOM 1937 CG ASP A 127 -22.968 -0.254 -1.413 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -23.071 -1.505 -1.298 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -22.051 0.201 -2.148 1.00 0.00 O ATOM 0 H ASP A 127 -21.882 0.518 0.861 1.00 0.00 H new ATOM 0 HA ASP A 127 -24.488 1.093 1.381 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -24.908 0.537 -0.979 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -23.596 1.669 -0.718 1.00 0.00 H new ATOM 1944 N GLY A 128 -24.195 -2.149 0.955 1.00 0.00 N ATOM 1945 CA GLY A 128 -24.830 -3.368 1.348 1.00 0.00 C ATOM 1946 C GLY A 128 -24.519 -4.556 0.504 1.00 0.00 C ATOM 1947 O GLY A 128 -24.927 -5.646 0.902 1.00 0.00 O ATOM 0 H GLY A 128 -23.334 -2.291 0.427 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -24.545 -3.590 2.376 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -25.909 -3.213 1.343 1.00 0.00 H new ATOM 1951 N ASP A 129 -23.996 -4.376 -0.723 1.00 0.00 N ATOM 1952 CA ASP A 129 -24.149 -5.341 -1.768 1.00 0.00 C ATOM 1953 C ASP A 129 -23.171 -6.464 -1.713 1.00 0.00 C ATOM 1954 O ASP A 129 -23.367 -7.522 -2.309 1.00 0.00 O ATOM 1955 CB ASP A 129 -24.275 -4.726 -3.172 1.00 0.00 C ATOM 1956 CG ASP A 129 -23.098 -3.901 -3.672 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -22.098 -3.771 -2.916 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -23.065 -3.436 -4.842 1.00 0.00 O ATOM 0 H ASP A 129 -23.461 -3.551 -0.993 1.00 0.00 H new ATOM 0 HA ASP A 129 -25.117 -5.797 -1.561 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -24.448 -5.535 -3.882 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -25.163 -4.094 -3.187 1.00 0.00 H new ATOM 1963 N GLY A 130 -22.075 -6.258 -0.961 1.00 0.00 N ATOM 1964 CA GLY A 130 -21.072 -7.251 -0.734 1.00 0.00 C ATOM 1965 C GLY A 130 -20.000 -7.074 -1.754 1.00 0.00 C ATOM 1966 O GLY A 130 -18.981 -7.760 -1.798 1.00 0.00 O ATOM 0 H GLY A 130 -21.881 -5.371 -0.496 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -20.660 -7.153 0.271 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.503 -8.250 -0.805 1.00 0.00 H new ATOM 1970 N GLN A 131 -20.166 -6.090 -2.655 1.00 0.00 N ATOM 1971 CA GLN A 131 -19.100 -5.668 -3.510 1.00 0.00 C ATOM 1972 C GLN A 131 -18.399 -4.514 -2.879 1.00 0.00 C ATOM 1973 O GLN A 131 -18.998 -3.704 -2.173 1.00 0.00 O ATOM 1974 CB GLN A 131 -19.704 -5.115 -4.812 1.00 0.00 C ATOM 1975 CG GLN A 131 -20.287 -6.241 -5.667 1.00 0.00 C ATOM 1976 CD GLN A 131 -20.768 -5.702 -7.007 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -20.601 -6.423 -7.990 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -21.394 -4.500 -7.112 1.00 0.00 N ATOM 0 H GLN A 131 -21.041 -5.585 -2.792 1.00 0.00 H new ATOM 0 HA GLN A 131 -18.430 -6.510 -3.685 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -20.484 -4.391 -4.576 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -18.937 -4.585 -5.376 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -19.532 -7.011 -5.828 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -21.116 -6.713 -5.140 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -21.522 -3.918 -6.284 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -21.736 -4.180 -8.018 1.00 0.00 H new ATOM 1987 N VAL A 132 -17.101 -4.367 -3.198 1.00 0.00 N ATOM 1988 CA VAL A 132 -16.251 -3.275 -2.838 1.00 0.00 C ATOM 1989 C VAL A 132 -15.991 -2.426 -4.034 1.00 0.00 C ATOM 1990 O VAL A 132 -15.229 -2.850 -4.902 1.00 0.00 O ATOM 1991 CB VAL A 132 -14.993 -3.773 -2.190 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -14.023 -2.621 -1.879 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -15.202 -4.701 -0.982 1.00 0.00 C ATOM 0 H VAL A 132 -16.608 -5.068 -3.751 1.00 0.00 H new ATOM 0 HA VAL A 132 -16.749 -2.650 -2.097 1.00 0.00 H new ATOM 0 HB VAL A 132 -14.530 -4.416 -2.939 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -13.123 -3.019 -1.410 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -13.755 -2.111 -2.804 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -14.503 -1.914 -1.202 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -14.234 -5.006 -0.585 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -15.760 -4.172 -0.209 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -15.761 -5.584 -1.294 1.00 0.00 H new ATOM 2003 N ASN A 133 -16.546 -1.202 -4.079 1.00 0.00 N ATOM 2004 CA ASN A 133 -16.331 -0.352 -5.209 1.00 0.00 C ATOM 2005 C ASN A 133 -15.112 0.483 -5.018 1.00 0.00 C ATOM 2006 O ASN A 133 -14.464 0.396 -3.976 1.00 0.00 O ATOM 2007 CB ASN A 133 -17.597 0.397 -5.657 1.00 0.00 C ATOM 2008 CG ASN A 133 -18.290 1.362 -4.705 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -17.758 2.418 -4.368 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -19.494 0.989 -4.194 1.00 0.00 N ATOM 0 H ASN A 133 -17.134 -0.805 -3.346 1.00 0.00 H new ATOM 0 HA ASN A 133 -16.116 -0.978 -6.075 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -17.340 0.957 -6.556 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -18.331 -0.354 -5.948 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -19.970 1.589 -3.520 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -19.921 0.109 -4.485 1.00 0.00 H new ATOM 2017 N TYR A 134 -14.779 1.416 -5.927 1.00 0.00 N ATOM 2018 CA TYR A 134 -13.655 2.299 -5.883 1.00 0.00 C ATOM 2019 C TYR A 134 -13.711 3.219 -4.711 1.00 0.00 C ATOM 2020 O TYR A 134 -12.719 3.240 -3.986 1.00 0.00 O ATOM 2021 CB TYR A 134 -13.462 3.138 -7.158 1.00 0.00 C ATOM 2022 CG TYR A 134 -12.142 3.828 -7.188 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -11.027 3.169 -7.649 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -12.082 5.140 -6.782 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -9.923 3.945 -7.911 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -10.904 5.834 -6.929 1.00 0.00 C ATOM 2027 CZ TYR A 134 -9.788 5.241 -7.471 1.00 0.00 C ATOM 2028 OH TYR A 134 -8.559 5.884 -7.729 1.00 0.00 O ATOM 0 H TYR A 134 -15.345 1.564 -6.763 1.00 0.00 H new ATOM 0 HA TYR A 134 -12.799 1.631 -5.793 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -13.552 2.493 -8.032 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -14.258 3.879 -7.226 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -11.019 2.099 -7.797 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -12.949 5.620 -6.353 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -9.121 3.515 -8.492 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -10.854 6.865 -6.612 1.00 0.00 H new ATOM 0 HH TYR A 134 -8.585 6.796 -7.371 1.00 0.00 H new ATOM 2038 N GLU A 135 -14.857 3.841 -4.381 1.00 0.00 N ATOM 2039 CA GLU A 135 -14.903 4.725 -3.258 1.00 0.00 C ATOM 2040 C GLU A 135 -14.781 3.985 -1.970 1.00 0.00 C ATOM 2041 O GLU A 135 -14.034 4.453 -1.112 1.00 0.00 O ATOM 2042 CB GLU A 135 -16.276 5.416 -3.309 1.00 0.00 C ATOM 2043 CG GLU A 135 -16.622 6.301 -2.110 1.00 0.00 C ATOM 2044 CD GLU A 135 -18.080 6.731 -2.037 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -18.867 6.444 -2.979 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -18.516 7.357 -1.035 1.00 0.00 O ATOM 0 H GLU A 135 -15.739 3.735 -4.883 1.00 0.00 H new ATOM 0 HA GLU A 135 -14.075 5.432 -3.307 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -16.321 6.026 -4.211 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -17.044 4.649 -3.404 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -16.369 5.765 -1.195 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -15.995 7.192 -2.141 1.00 0.00 H new ATOM 2053 N GLU A 136 -15.464 2.857 -1.707 1.00 0.00 N ATOM 2054 CA GLU A 136 -15.448 2.065 -0.517 1.00 0.00 C ATOM 2055 C GLU A 136 -14.052 1.718 -0.125 1.00 0.00 C ATOM 2056 O GLU A 136 -13.670 1.891 1.031 1.00 0.00 O ATOM 2057 CB GLU A 136 -16.335 0.838 -0.786 1.00 0.00 C ATOM 2058 CG GLU A 136 -17.827 1.155 -0.674 1.00 0.00 C ATOM 2059 CD GLU A 136 -18.720 -0.050 -0.932 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -18.590 -0.694 -2.007 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -19.748 -0.288 -0.243 1.00 0.00 O ATOM 0 H GLU A 136 -16.094 2.460 -2.405 1.00 0.00 H new ATOM 0 HA GLU A 136 -15.848 2.612 0.337 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -16.123 0.453 -1.783 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -16.081 0.049 -0.079 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -18.034 1.545 0.322 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -18.078 1.943 -1.384 1.00 0.00 H new ATOM 2068 N PHE A 137 -13.309 1.330 -1.176 1.00 0.00 N ATOM 2069 CA PHE A 137 -11.897 1.101 -1.162 1.00 0.00 C ATOM 2070 C PHE A 137 -11.070 2.301 -0.848 1.00 0.00 C ATOM 2071 O PHE A 137 -10.274 2.181 0.082 1.00 0.00 O ATOM 2072 CB PHE A 137 -11.438 0.512 -2.506 1.00 0.00 C ATOM 2073 CG PHE A 137 -10.069 -0.075 -2.549 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -9.877 -1.362 -2.102 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -8.985 0.582 -3.081 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -8.626 -1.932 -2.119 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -7.715 0.056 -3.092 1.00 0.00 C ATOM 2078 CZ PHE A 137 -7.565 -1.239 -2.653 1.00 0.00 C ATOM 0 H PHE A 137 -13.721 1.166 -2.094 1.00 0.00 H new ATOM 0 HA PHE A 137 -11.735 0.396 -0.346 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -12.149 -0.261 -2.799 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -11.494 1.298 -3.259 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -10.718 -1.931 -1.734 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -9.139 1.560 -3.512 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -8.477 -2.922 -1.714 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -6.869 0.636 -3.431 1.00 0.00 H new ATOM 0 HZ PHE A 137 -6.600 -1.718 -2.729 1.00 0.00 H new ATOM 2088 N VAL A 138 -11.155 3.434 -1.567 1.00 0.00 N ATOM 2089 CA VAL A 138 -10.233 4.492 -1.295 1.00 0.00 C ATOM 2090 C VAL A 138 -10.417 5.067 0.067 1.00 0.00 C ATOM 2091 O VAL A 138 -9.444 5.322 0.775 1.00 0.00 O ATOM 2092 CB VAL A 138 -10.114 5.486 -2.412 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -9.021 6.542 -2.179 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -9.922 4.809 -3.780 1.00 0.00 C ATOM 0 H VAL A 138 -11.833 3.615 -2.308 1.00 0.00 H new ATOM 0 HA VAL A 138 -9.239 4.047 -1.265 1.00 0.00 H new ATOM 0 HB VAL A 138 -11.069 6.011 -2.421 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -8.991 7.228 -3.026 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -9.242 7.099 -1.269 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -8.054 6.049 -2.077 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -9.841 5.571 -4.555 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -9.012 4.209 -3.765 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -10.777 4.166 -3.991 1.00 0.00 H new ATOM 2104 N GLN A 139 -11.685 5.221 0.490 1.00 0.00 N ATOM 2105 CA GLN A 139 -12.012 5.922 1.693 1.00 0.00 C ATOM 2106 C GLN A 139 -11.909 5.061 2.905 1.00 0.00 C ATOM 2107 O GLN A 139 -11.960 5.449 4.071 1.00 0.00 O ATOM 2108 CB GLN A 139 -13.502 6.298 1.629 1.00 0.00 C ATOM 2109 CG GLN A 139 -14.037 7.200 0.515 1.00 0.00 C ATOM 2110 CD GLN A 139 -13.610 8.627 0.824 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -12.476 9.055 0.616 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -14.651 9.396 1.242 1.00 0.00 N ATOM 0 H GLN A 139 -12.495 4.854 -0.010 1.00 0.00 H new ATOM 0 HA GLN A 139 -11.325 6.765 1.764 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -14.065 5.366 1.584 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -13.752 6.777 2.576 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -13.645 6.885 -0.452 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -15.123 7.131 0.457 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -15.567 8.975 1.395 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -14.516 10.394 1.402 1.00 0.00 H new ATOM 2121 N MET A 140 -11.734 3.750 2.662 1.00 0.00 N ATOM 2122 CA MET A 140 -11.180 2.780 3.555 1.00 0.00 C ATOM 2123 C MET A 140 -9.728 2.974 3.824 1.00 0.00 C ATOM 2124 O MET A 140 -9.360 3.056 4.995 1.00 0.00 O ATOM 2125 CB MET A 140 -11.445 1.398 2.934 1.00 0.00 C ATOM 2126 CG MET A 140 -10.683 0.225 3.553 1.00 0.00 C ATOM 2127 SD MET A 140 -11.337 -1.345 2.912 1.00 0.00 S ATOM 2128 CE MET A 140 -10.276 -1.366 1.439 1.00 0.00 C ATOM 0 H MET A 140 -12.002 3.337 1.769 1.00 0.00 H new ATOM 0 HA MET A 140 -11.657 2.883 4.529 1.00 0.00 H new ATOM 0 HB2 MET A 140 -12.512 1.189 3.004 1.00 0.00 H new ATOM 0 HB3 MET A 140 -11.199 1.446 1.873 1.00 0.00 H new ATOM 0 HG2 MET A 140 -9.621 0.308 3.322 1.00 0.00 H new ATOM 0 HG3 MET A 140 -10.776 0.252 4.639 1.00 0.00 H new ATOM 0 HE1 MET A 140 -10.733 -1.988 0.670 1.00 0.00 H new ATOM 0 HE2 MET A 140 -10.158 -0.350 1.061 1.00 0.00 H new ATOM 0 HE3 MET A 140 -9.299 -1.772 1.700 1.00 0.00 H new ATOM 2138 N MET A 141 -8.912 3.086 2.761 1.00 0.00 N ATOM 2139 CA MET A 141 -7.483 3.031 2.782 1.00 0.00 C ATOM 2140 C MET A 141 -6.898 4.294 3.315 1.00 0.00 C ATOM 2141 O MET A 141 -6.009 4.306 4.164 1.00 0.00 O ATOM 2142 CB MET A 141 -6.802 2.889 1.410 1.00 0.00 C ATOM 2143 CG MET A 141 -6.912 1.530 0.717 1.00 0.00 C ATOM 2144 SD MET A 141 -5.933 0.301 1.632 1.00 0.00 S ATOM 2145 CE MET A 141 -5.767 -0.951 0.327 1.00 0.00 C ATOM 0 H MET A 141 -9.278 3.225 1.819 1.00 0.00 H new ATOM 0 HA MET A 141 -7.300 2.147 3.393 1.00 0.00 H new ATOM 0 HB2 MET A 141 -7.221 3.644 0.744 1.00 0.00 H new ATOM 0 HB3 MET A 141 -5.744 3.123 1.531 1.00 0.00 H new ATOM 0 HG2 MET A 141 -7.955 1.217 0.670 1.00 0.00 H new ATOM 0 HG3 MET A 141 -6.555 1.604 -0.310 1.00 0.00 H new ATOM 0 HE1 MET A 141 -5.046 -1.707 0.638 1.00 0.00 H new ATOM 0 HE2 MET A 141 -6.734 -1.422 0.150 1.00 0.00 H new ATOM 0 HE3 MET A 141 -5.421 -0.476 -0.591 1.00 0.00 H new ATOM 2155 N THR A 142 -7.442 5.423 2.827 1.00 0.00 N ATOM 2156 CA THR A 142 -6.937 6.750 2.993 1.00 0.00 C ATOM 2157 C THR A 142 -6.812 7.152 4.456 1.00 0.00 C ATOM 2158 O THR A 142 -5.653 7.396 4.886 1.00 0.00 O ATOM 2159 CB THR A 142 -7.632 7.826 2.212 1.00 0.00 C ATOM 2160 OG1 THR A 142 -9.043 7.670 2.160 1.00 0.00 O ATOM 2161 CG2 THR A 142 -7.083 8.031 0.790 1.00 0.00 C ATOM 0 H THR A 142 -8.300 5.405 2.275 1.00 0.00 H new ATOM 0 HA THR A 142 -5.942 6.678 2.554 1.00 0.00 H new ATOM 0 HB THR A 142 -7.407 8.726 2.784 1.00 0.00 H new ATOM 0 HG1 THR A 142 -9.268 6.931 1.557 1.00 0.00 H new ATOM 0 HG21 THR A 142 -7.641 8.826 0.296 1.00 0.00 H new ATOM 0 HG22 THR A 142 -6.030 8.306 0.843 1.00 0.00 H new ATOM 0 HG23 THR A 142 -7.189 7.107 0.222 1.00 0.00 H new TER 2169 THR A 142 ATOM 2170 N ARG B 1 -11.588 0.475 11.890 1.00 0.00 N ATOM 2171 CA ARG B 1 -11.037 -0.293 10.752 1.00 0.00 C ATOM 2172 C ARG B 1 -9.960 -1.281 11.043 1.00 0.00 C ATOM 2173 O ARG B 1 -8.903 -0.872 11.521 1.00 0.00 O ATOM 2174 CB ARG B 1 -10.615 0.661 9.621 1.00 0.00 C ATOM 2175 CG ARG B 1 -11.746 1.573 9.143 1.00 0.00 C ATOM 2176 CD ARG B 1 -11.554 2.241 7.780 1.00 0.00 C ATOM 2177 NE ARG B 1 -12.770 3.003 7.378 1.00 0.00 N ATOM 2178 CZ ARG B 1 -13.888 2.491 6.786 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -14.178 1.169 6.607 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -14.887 3.322 6.367 1.00 0.00 N ATOM 0 H1 ARG B 1 -12.505 0.885 11.621 1.00 0.00 H new ATOM 0 H2 ARG B 1 -11.717 -0.157 12.705 1.00 0.00 H new ATOM 0 H3 ARG B 1 -10.929 1.238 12.145 1.00 0.00 H new ATOM 0 HA ARG B 1 -11.869 -0.927 10.446 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -9.783 1.276 9.965 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -10.250 0.074 8.778 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -12.665 0.988 9.110 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -11.892 2.355 9.889 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -10.697 2.913 7.819 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -11.331 1.483 7.029 1.00 0.00 H new ATOM 0 HE ARG B 1 -12.766 4.006 7.564 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -13.525 0.455 6.931 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -15.047 0.895 6.149 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -14.800 4.330 6.496 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -15.721 2.935 5.925 1.00 0.00 H new ATOM 2193 N ARG B 2 -10.144 -2.605 10.893 1.00 0.00 N ATOM 2194 CA ARG B 2 -9.135 -3.518 11.334 1.00 0.00 C ATOM 2195 C ARG B 2 -8.214 -3.934 10.239 1.00 0.00 C ATOM 2196 O ARG B 2 -7.141 -3.350 10.092 1.00 0.00 O ATOM 2197 CB ARG B 2 -9.774 -4.768 11.961 1.00 0.00 C ATOM 2198 CG ARG B 2 -10.400 -4.306 13.278 1.00 0.00 C ATOM 2199 CD ARG B 2 -11.013 -5.326 14.240 1.00 0.00 C ATOM 2200 NE ARG B 2 -12.219 -5.890 13.572 1.00 0.00 N ATOM 2201 CZ ARG B 2 -13.233 -6.545 14.210 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -13.221 -6.852 15.540 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -14.332 -6.905 13.486 1.00 0.00 N ATOM 0 H ARG B 2 -10.970 -3.036 10.477 1.00 0.00 H new ATOM 0 HA ARG B 2 -8.545 -2.985 12.080 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -10.528 -5.195 11.299 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -9.027 -5.543 12.135 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -9.631 -3.764 13.829 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -11.180 -3.587 13.030 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -10.297 -6.115 14.472 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -11.282 -4.852 15.184 1.00 0.00 H new ATOM 0 HE ARG B 2 -12.293 -5.778 12.561 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -12.422 -6.590 16.117 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -14.011 -7.344 15.957 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -14.382 -6.684 12.492 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -15.103 -7.395 13.939 1.00 0.00 H new ATOM 2217 N LYS B 3 -8.612 -4.815 9.305 1.00 0.00 N ATOM 2218 CA LYS B 3 -7.797 -5.823 8.700 1.00 0.00 C ATOM 2219 C LYS B 3 -7.248 -5.403 7.380 1.00 0.00 C ATOM 2220 O LYS B 3 -6.239 -5.938 6.925 1.00 0.00 O ATOM 2221 CB LYS B 3 -8.579 -7.097 8.339 1.00 0.00 C ATOM 2222 CG LYS B 3 -9.039 -7.956 9.519 1.00 0.00 C ATOM 2223 CD LYS B 3 -9.922 -9.140 9.119 1.00 0.00 C ATOM 2224 CE LYS B 3 -9.228 -10.494 9.273 1.00 0.00 C ATOM 2225 NZ LYS B 3 -9.100 -10.713 10.731 1.00 0.00 N ATOM 0 H LYS B 3 -9.568 -4.823 8.949 1.00 0.00 H new ATOM 0 HA LYS B 3 -7.029 -5.994 9.455 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -9.457 -6.809 7.760 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -7.955 -7.711 7.689 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -8.162 -8.332 10.046 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -9.587 -7.328 10.221 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -10.826 -9.132 9.728 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -10.235 -9.016 8.082 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -9.811 -11.288 8.807 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -8.251 -10.491 8.790 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -9.076 -11.734 10.928 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -8.221 -10.274 11.072 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -9.913 -10.286 11.219 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.885 -4.450 6.676 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.437 -3.901 5.434 1.00 0.00 C ATOM 2241 C TRP B 4 -6.217 -3.059 5.579 1.00 0.00 C ATOM 2242 O TRP B 4 -5.405 -2.943 4.662 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.579 -3.094 4.795 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.772 -3.954 4.452 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.892 -4.253 5.173 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -10.016 -4.531 3.156 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.887 -4.732 4.363 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.344 -4.972 3.122 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -9.254 -4.589 2.021 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -11.849 -5.597 2.015 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -9.764 -5.247 0.926 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -11.033 -5.776 0.922 1.00 0.00 C ATOM 0 H TRP B 4 -8.763 -4.040 6.993 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.158 -4.732 4.786 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -8.889 -2.304 5.479 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.214 -2.607 3.891 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -10.982 -4.128 6.242 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.859 -4.884 4.632 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -8.277 -4.130 1.986 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -12.872 -5.944 1.999 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -9.150 -5.351 0.044 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -11.388 -6.329 0.065 1.00 0.00 H new ATOM 2263 N GLN B 5 -6.012 -2.424 6.747 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.795 -1.744 7.070 1.00 0.00 C ATOM 2265 C GLN B 5 -3.554 -2.568 7.027 1.00 0.00 C ATOM 2266 O GLN B 5 -2.557 -2.309 6.356 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.857 -1.021 8.426 1.00 0.00 C ATOM 2268 CG GLN B 5 -5.812 0.166 8.287 1.00 0.00 C ATOM 2269 CD GLN B 5 -5.761 1.006 9.555 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -4.854 1.782 9.853 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -6.678 0.605 10.475 1.00 0.00 N ATOM 0 H GLN B 5 -6.712 -2.382 7.488 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.720 -1.021 6.258 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -5.205 -1.700 9.204 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -3.865 -0.679 8.721 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -5.534 0.772 7.425 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -6.828 -0.189 8.113 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -7.422 -0.039 10.206 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -6.622 0.948 11.434 1.00 0.00 H new ATOM 2280 N LYS B 6 -3.606 -3.750 7.667 1.00 0.00 N ATOM 2281 CA LYS B 6 -2.461 -4.596 7.807 1.00 0.00 C ATOM 2282 C LYS B 6 -1.997 -5.350 6.608 1.00 0.00 C ATOM 2283 O LYS B 6 -0.821 -5.579 6.330 1.00 0.00 O ATOM 2284 CB LYS B 6 -2.739 -5.504 9.016 1.00 0.00 C ATOM 2285 CG LYS B 6 -2.940 -4.678 10.288 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.637 -4.058 10.795 1.00 0.00 C ATOM 2287 CE LYS B 6 -1.551 -3.804 12.301 1.00 0.00 C ATOM 2288 NZ LYS B 6 -2.582 -2.808 12.669 1.00 0.00 N ATOM 0 H LYS B 6 -4.454 -4.124 8.093 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.599 -3.946 7.956 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -3.627 -6.107 8.826 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -1.908 -6.195 9.155 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -3.664 -3.886 10.093 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -3.364 -5.313 11.066 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.813 -4.712 10.510 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -1.485 -3.110 10.278 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -1.707 -4.732 12.851 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -0.559 -3.439 12.567 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -2.537 -2.624 13.692 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -2.411 -1.923 12.150 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -3.523 -3.176 12.425 1.00 0.00 H new ATOM 2302 N THR B 7 -3.042 -5.756 5.866 1.00 0.00 N ATOM 2303 CA THR B 7 -2.890 -6.569 4.699 1.00 0.00 C ATOM 2304 C THR B 7 -2.585 -5.735 3.502 1.00 0.00 C ATOM 2305 O THR B 7 -1.722 -6.040 2.680 1.00 0.00 O ATOM 2306 CB THR B 7 -4.059 -7.472 4.441 1.00 0.00 C ATOM 2307 OG1 THR B 7 -5.215 -6.673 4.240 1.00 0.00 O ATOM 2308 CG2 THR B 7 -4.393 -8.332 5.672 1.00 0.00 C ATOM 0 H THR B 7 -4.010 -5.516 6.080 1.00 0.00 H new ATOM 0 HA THR B 7 -2.042 -7.224 4.897 1.00 0.00 H new ATOM 0 HB THR B 7 -3.800 -8.096 3.586 1.00 0.00 H new ATOM 0 HG1 THR B 7 -5.586 -6.410 5.108 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.245 -8.973 5.447 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.532 -8.949 5.929 1.00 0.00 H new ATOM 0 HG23 THR B 7 -4.639 -7.684 6.513 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.166 -4.534 3.332 1.00 0.00 N ATOM 2317 CA GLY B 8 -3.063 -3.703 2.173 1.00 0.00 C ATOM 2318 C GLY B 8 -1.683 -3.172 1.991 1.00 0.00 C ATOM 2319 O GLY B 8 -1.277 -2.618 0.970 1.00 0.00 O ATOM 0 H GLY B 8 -3.749 -4.115 4.057 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -3.352 -4.274 1.290 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -3.763 -2.872 2.259 1.00 0.00 H new ATOM 2323 N HIS B 9 -0.915 -3.135 3.095 1.00 0.00 N ATOM 2324 CA HIS B 9 0.452 -2.715 3.117 1.00 0.00 C ATOM 2325 C HIS B 9 1.284 -3.616 2.271 1.00 0.00 C ATOM 2326 O HIS B 9 1.901 -3.136 1.322 1.00 0.00 O ATOM 2327 CB HIS B 9 0.944 -2.598 4.570 1.00 0.00 C ATOM 2328 CG HIS B 9 2.186 -1.777 4.749 1.00 0.00 C ATOM 2329 ND1 HIS B 9 2.180 -0.530 5.340 1.00 0.00 N ATOM 2330 CD2 HIS B 9 3.498 -2.074 4.549 1.00 0.00 C ATOM 2331 CE1 HIS B 9 3.470 -0.104 5.390 1.00 0.00 C ATOM 2332 NE2 HIS B 9 4.302 -1.016 4.921 1.00 0.00 N ATOM 0 H HIS B 9 -1.263 -3.410 4.013 1.00 0.00 H new ATOM 0 HA HIS B 9 0.546 -1.721 2.680 1.00 0.00 H new ATOM 0 HB2 HIS B 9 0.148 -2.163 5.175 1.00 0.00 H new ATOM 0 HB3 HIS B 9 1.128 -3.600 4.958 1.00 0.00 H new ATOM 0 HD1 HIS B 9 1.361 -0.023 5.676 1.00 0.00 H new ATOM 0 HD2 HIS B 9 3.861 -3.011 4.153 1.00 0.00 H new ATOM 0 HE1 HIS B 9 3.776 0.861 5.767 1.00 0.00 H new ATOM 2340 N ALA B 10 1.235 -4.930 2.556 1.00 0.00 N ATOM 2341 CA ALA B 10 1.823 -5.908 1.694 1.00 0.00 C ATOM 2342 C ALA B 10 1.570 -5.842 0.227 1.00 0.00 C ATOM 2343 O ALA B 10 2.464 -5.986 -0.606 1.00 0.00 O ATOM 2344 CB ALA B 10 1.268 -7.260 2.173 1.00 0.00 C ATOM 0 H ALA B 10 0.786 -5.316 3.387 1.00 0.00 H new ATOM 0 HA ALA B 10 2.896 -5.736 1.774 1.00 0.00 H new ATOM 0 HB1 ALA B 10 1.677 -8.060 1.556 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.552 -7.422 3.213 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.181 -7.257 2.090 1.00 0.00 H new ATOM 2350 N VAL B 11 0.297 -5.587 -0.124 1.00 0.00 N ATOM 2351 CA VAL B 11 -0.232 -5.280 -1.417 1.00 0.00 C ATOM 2352 C VAL B 11 0.363 -4.094 -2.094 1.00 0.00 C ATOM 2353 O VAL B 11 0.980 -4.197 -3.153 1.00 0.00 O ATOM 2354 CB VAL B 11 -1.706 -5.004 -1.468 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -2.160 -4.848 -2.929 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -2.414 -6.231 -0.869 1.00 0.00 C ATOM 0 H VAL B 11 -0.442 -5.598 0.579 1.00 0.00 H new ATOM 0 HA VAL B 11 0.027 -6.211 -1.922 1.00 0.00 H new ATOM 0 HB VAL B 11 -1.941 -4.091 -0.922 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -3.231 -4.648 -2.958 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -1.623 -4.019 -3.390 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -1.948 -5.767 -3.476 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -3.492 -6.073 -0.886 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -2.167 -7.116 -1.456 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -2.085 -6.375 0.160 1.00 0.00 H new ATOM 2366 N ARG B 12 0.271 -2.896 -1.488 1.00 0.00 N ATOM 2367 CA ARG B 12 0.963 -1.726 -1.932 1.00 0.00 C ATOM 2368 C ARG B 12 2.433 -1.835 -2.154 1.00 0.00 C ATOM 2369 O ARG B 12 2.902 -1.387 -3.199 1.00 0.00 O ATOM 2370 CB ARG B 12 0.675 -0.574 -0.956 1.00 0.00 C ATOM 2371 CG ARG B 12 -0.769 -0.074 -1.046 1.00 0.00 C ATOM 2372 CD ARG B 12 -1.305 0.504 0.265 1.00 0.00 C ATOM 2373 NE ARG B 12 -0.736 1.880 0.329 1.00 0.00 N ATOM 2374 CZ ARG B 12 -1.365 2.952 0.893 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -2.342 2.778 1.831 1.00 0.00 N ATOM 2376 NH2 ARG B 12 -1.041 4.236 0.562 1.00 0.00 N ATOM 0 H ARG B 12 -0.305 -2.737 -0.661 1.00 0.00 H new ATOM 0 HA ARG B 12 0.568 -1.548 -2.932 1.00 0.00 H new ATOM 0 HB2 ARG B 12 0.878 -0.906 0.062 1.00 0.00 H new ATOM 0 HB3 ARG B 12 1.355 0.252 -1.164 1.00 0.00 H new ATOM 0 HG2 ARG B 12 -0.832 0.690 -1.821 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -1.410 -0.898 -1.358 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -2.395 0.525 0.273 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -0.991 -0.095 1.120 1.00 0.00 H new ATOM 0 HE ARG B 12 0.188 2.031 -0.077 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -2.611 1.837 2.119 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -2.803 3.589 2.244 1.00 0.00 H new ATOM 0 HH21 ARG B 12 -0.309 4.416 -0.125 1.00 0.00 H new ATOM 0 HH22 ARG B 12 -1.531 5.015 1.002 1.00 0.00 H new ATOM 2390 N ALA B 13 3.173 -2.465 -1.224 1.00 0.00 N ATOM 2391 CA ALA B 13 4.600 -2.551 -1.224 1.00 0.00 C ATOM 2392 C ALA B 13 5.202 -3.229 -2.407 1.00 0.00 C ATOM 2393 O ALA B 13 6.279 -2.815 -2.833 1.00 0.00 O ATOM 2394 CB ALA B 13 5.047 -3.363 0.003 1.00 0.00 C ATOM 0 H ALA B 13 2.750 -2.941 -0.427 1.00 0.00 H new ATOM 0 HA ALA B 13 4.941 -1.516 -1.229 1.00 0.00 H new ATOM 0 HB1 ALA B 13 6.134 -3.436 0.015 1.00 0.00 H new ATOM 0 HB2 ALA B 13 4.707 -2.866 0.912 1.00 0.00 H new ATOM 0 HB3 ALA B 13 4.617 -4.363 -0.046 1.00 0.00 H new ATOM 2400 N ILE B 14 4.505 -4.225 -2.983 1.00 0.00 N ATOM 2401 CA ILE B 14 4.855 -4.872 -4.209 1.00 0.00 C ATOM 2402 C ILE B 14 4.827 -3.895 -5.334 1.00 0.00 C ATOM 2403 O ILE B 14 5.588 -3.920 -6.300 1.00 0.00 O ATOM 2404 CB ILE B 14 3.997 -6.077 -4.453 1.00 0.00 C ATOM 2405 CG1 ILE B 14 4.075 -6.979 -3.210 1.00 0.00 C ATOM 2406 CG2 ILE B 14 4.302 -6.682 -5.834 1.00 0.00 C ATOM 2407 CD1 ILE B 14 3.693 -8.446 -3.398 1.00 0.00 C ATOM 0 H ILE B 14 3.651 -4.599 -2.570 1.00 0.00 H new ATOM 0 HA ILE B 14 5.877 -5.244 -4.135 1.00 0.00 H new ATOM 0 HB ILE B 14 2.935 -5.849 -4.548 1.00 0.00 H new ATOM 0 HG12 ILE B 14 5.094 -6.940 -2.826 1.00 0.00 H new ATOM 0 HG13 ILE B 14 3.428 -6.555 -2.442 1.00 0.00 H new ATOM 0 HG21 ILE B 14 3.671 -7.556 -5.996 1.00 0.00 H new ATOM 0 HG22 ILE B 14 4.101 -5.941 -6.608 1.00 0.00 H new ATOM 0 HG23 ILE B 14 5.350 -6.978 -5.878 1.00 0.00 H new ATOM 0 HD11 ILE B 14 3.790 -8.972 -2.448 1.00 0.00 H new ATOM 0 HD12 ILE B 14 2.662 -8.512 -3.745 1.00 0.00 H new ATOM 0 HD13 ILE B 14 4.354 -8.903 -4.135 1.00 0.00 H new ATOM 2419 N GLY B 15 3.872 -2.951 -5.261 1.00 0.00 N ATOM 2420 CA GLY B 15 3.705 -1.906 -6.224 1.00 0.00 C ATOM 2421 C GLY B 15 4.844 -0.946 -6.182 1.00 0.00 C ATOM 2422 O GLY B 15 5.581 -0.766 -7.150 1.00 0.00 O ATOM 0 H GLY B 15 3.190 -2.914 -4.503 1.00 0.00 H new ATOM 0 HA2 GLY B 15 3.626 -2.337 -7.222 1.00 0.00 H new ATOM 0 HA3 GLY B 15 2.772 -1.376 -6.031 1.00 0.00 H new ATOM 2426 N ARG B 16 5.101 -0.430 -4.967 1.00 0.00 N ATOM 2427 CA ARG B 16 6.135 0.531 -4.738 1.00 0.00 C ATOM 2428 C ARG B 16 7.554 0.088 -4.840 1.00 0.00 C ATOM 2429 O ARG B 16 8.385 0.898 -5.247 1.00 0.00 O ATOM 2430 CB ARG B 16 5.990 1.082 -3.309 1.00 0.00 C ATOM 2431 CG ARG B 16 4.681 1.858 -3.148 1.00 0.00 C ATOM 2432 CD ARG B 16 4.586 2.750 -1.909 1.00 0.00 C ATOM 2433 NE ARG B 16 5.572 3.831 -2.193 1.00 0.00 N ATOM 2434 CZ ARG B 16 5.572 4.934 -1.389 1.00 0.00 C ATOM 2435 NH1 ARG B 16 4.651 5.093 -0.394 1.00 0.00 N ATOM 2436 NH2 ARG B 16 6.335 6.009 -1.740 1.00 0.00 N ATOM 0 H ARG B 16 4.581 -0.685 -4.127 1.00 0.00 H new ATOM 0 HA ARG B 16 5.978 1.240 -5.551 1.00 0.00 H new ATOM 0 HB2 ARG B 16 6.019 0.260 -2.594 1.00 0.00 H new ATOM 0 HB3 ARG B 16 6.833 1.734 -3.080 1.00 0.00 H new ATOM 0 HG2 ARG B 16 4.537 2.479 -4.032 1.00 0.00 H new ATOM 0 HG3 ARG B 16 3.858 1.144 -3.123 1.00 0.00 H new ATOM 0 HD2 ARG B 16 3.580 3.147 -1.775 1.00 0.00 H new ATOM 0 HD3 ARG B 16 4.837 2.204 -0.999 1.00 0.00 H new ATOM 0 HE ARG B 16 6.230 3.749 -2.968 1.00 0.00 H new ATOM 0 HH11 ARG B 16 3.941 4.378 -0.237 1.00 0.00 H new ATOM 0 HH12 ARG B 16 4.673 5.927 0.193 1.00 0.00 H new ATOM 0 HH21 ARG B 16 6.894 5.981 -2.592 1.00 0.00 H new ATOM 0 HH22 ARG B 16 6.346 6.841 -1.150 1.00 0.00 H new ATOM 2450 N LEU B 17 7.821 -1.223 -4.703 1.00 0.00 N ATOM 2451 CA LEU B 17 9.073 -1.836 -5.022 1.00 0.00 C ATOM 2452 C LEU B 17 9.293 -1.869 -6.495 1.00 0.00 C ATOM 2453 O LEU B 17 10.432 -1.898 -6.959 1.00 0.00 O ATOM 2454 CB LEU B 17 8.951 -3.288 -4.530 1.00 0.00 C ATOM 2455 CG LEU B 17 9.788 -3.450 -3.249 1.00 0.00 C ATOM 2456 CD1 LEU B 17 9.240 -4.511 -2.281 1.00 0.00 C ATOM 2457 CD2 LEU B 17 11.291 -3.742 -3.388 1.00 0.00 C ATOM 0 H LEU B 17 7.131 -1.887 -4.353 1.00 0.00 H new ATOM 0 HA LEU B 17 9.897 -1.287 -4.567 1.00 0.00 H new ATOM 0 HB2 LEU B 17 7.907 -3.533 -4.332 1.00 0.00 H new ATOM 0 HB3 LEU B 17 9.300 -3.977 -5.299 1.00 0.00 H new ATOM 0 HG LEU B 17 9.687 -2.435 -2.865 1.00 0.00 H new ATOM 0 HD11 LEU B 17 9.882 -4.568 -1.402 1.00 0.00 H new ATOM 0 HD12 LEU B 17 8.230 -4.238 -1.975 1.00 0.00 H new ATOM 0 HD13 LEU B 17 9.219 -5.481 -2.778 1.00 0.00 H new ATOM 0 HD21 LEU B 17 11.738 -3.828 -2.398 1.00 0.00 H new ATOM 0 HD22 LEU B 17 11.431 -4.676 -3.932 1.00 0.00 H new ATOM 0 HD23 LEU B 17 11.771 -2.929 -3.933 1.00 0.00 H new ATOM 2469 N SER B 18 8.259 -2.007 -7.343 1.00 0.00 N ATOM 2470 CA SER B 18 8.334 -2.406 -8.714 1.00 0.00 C ATOM 2471 C SER B 18 8.275 -1.220 -9.614 1.00 0.00 C ATOM 2472 O SER B 18 9.086 -1.057 -10.524 1.00 0.00 O ATOM 2473 CB SER B 18 7.055 -3.174 -9.087 1.00 0.00 C ATOM 2474 OG SER B 18 7.106 -4.457 -8.479 1.00 0.00 O ATOM 0 H SER B 18 7.300 -1.826 -7.047 1.00 0.00 H new ATOM 0 HA SER B 18 9.254 -2.979 -8.826 1.00 0.00 H new ATOM 0 HB2 SER B 18 6.174 -2.629 -8.748 1.00 0.00 H new ATOM 0 HB3 SER B 18 6.973 -3.271 -10.170 1.00 0.00 H new ATOM 0 HG SER B 18 6.468 -4.493 -7.736 1.00 0.00 H new ATOM 2480 N SER B 19 7.298 -0.325 -9.381 1.00 0.00 N ATOM 2481 CA SER B 19 7.107 0.878 -10.130 1.00 0.00 C ATOM 2482 C SER B 19 8.238 1.889 -10.257 1.00 0.00 C ATOM 2483 O SER B 19 8.748 2.173 -11.374 1.00 0.00 O ATOM 2484 CB SER B 19 5.882 1.655 -9.620 1.00 0.00 C ATOM 2485 OG SER B 19 4.661 1.007 -9.941 1.00 0.00 O ATOM 2486 OXT SER B 19 8.632 2.419 -9.184 1.00 0.00 O ATOM 0 H SER B 19 6.611 -0.446 -8.637 1.00 0.00 H new ATOM 0 HA SER B 19 7.004 0.454 -11.129 1.00 0.00 H new ATOM 0 HB2 SER B 19 5.954 1.774 -8.539 1.00 0.00 H new ATOM 0 HB3 SER B 19 5.884 2.656 -10.052 1.00 0.00 H new ATOM 0 HG SER B 19 3.910 1.534 -9.597 1.00 0.00 H new TER 2492 SER B 19 HETATM 2493 CA CA A 151 14.590 -13.919 5.402 1.00 0.00 CA HETATM 2494 CA CA A 152 19.980 -3.903 3.471 1.00 0.00 CA HETATM 2495 CA CA A 153 -13.527 -8.397 -9.855 1.00 0.00 CA HETATM 2496 CA CA A 154 -20.690 -1.938 -1.842 1.00 0.00 CA