USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1123 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 14 GLN : amide:sc= -0.47 X(o=-0.47,f=-0.9) USER MOD Set 1.2: A 135 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 91 THR OG1 : rot 121:sc= 1.06 USER MOD Set 2.2: A 116 THR OG1 : rot 176:sc= 1.08 USER MOD Set 3.1: A 35 CYS SG : rot 180:sc= 0.437 USER MOD Set 3.2: A 96 GLN :FLIP amide:sc= 0.957 F(o=0.75,f=1.4) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 160:sc= 1.46 (180deg=0.98) USER MOD Single : A 3 HIS : no HE2:sc= -0.744 K(o=-0.74,f=-1.8!) USER MOD Single : A 7 TYR OH : rot 126:sc= 1.33 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.104 USER MOD Single : A 11 LYS NZ :NH3+ -152:sc= 2.4 (180deg=0.744) USER MOD Single : A 16 ASN :FLIP amide:sc= -1.31 F(o=-2.5!,f=-1.3) USER MOD Single : A 17 HIS : no HD1:sc= -0.193 X(o=-0.19,f=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl -149:sc= -2.1 (180deg=-3.92) USER MOD Single : A 23 HIS : no HD1:sc= -0.0048 X(o=-0.0048,f=-0.15) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HE2:sc= 0.609 K(o=0.61,f=-4.4!) USER MOD Single : A 36 THR OG1 : rot 95:sc= 0.818 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0721 USER MOD Single : A 48 HIS : no HE2:sc= 0.441 K(o=0.44,f=-1.9!) USER MOD Single : A 49 ASN : amide:sc= -0.155 X(o=-0.15,f=0) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 HIS : no HE2:sc= -0.278 K(o=-0.28,f=-1.6) USER MOD Single : A 62 CYS SG : rot -73:sc= 0.0965 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 135:sc= 1.16 USER MOD Single : A 73 GLN : amide:sc= -0.526 X(o=-0.53,f=-0.44) USER MOD Single : A 74 MET CE :methyl 156:sc= -0.616 (180deg=-1.62) USER MOD Single : A 84 CYS SG : rot -176:sc= 0.0246 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 MET CE :methyl 173:sc= -0.817 (180deg=-1.01) USER MOD Single : A 88 TYR OH : rot -164:sc= 1.25 USER MOD Single : A 89 GLN : amide:sc= 0.918 K(o=0.92,f=-1.6!) USER MOD Single : A 94 GLN : amide:sc= 0.605 K(o=0.6,f=0) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 GLN :FLIP amide:sc= -0.281 F(o=-1.5,f=-0.28) USER MOD Single : A 112 CYS SG : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot -8:sc= 1.2 USER MOD Single : A 117 THR OG1 : rot 180:sc=0.000628 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 HIS :FLIP no HE2:sc= -1.1 F(o=-2.8!,f=-1.1) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 64:sc= 1.25 USER MOD Single : A 139 HIS : no HD1:sc=-0.00304 X(o=-0.003,f=-0.003) USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= 0.502 K(o=0.5,f=0) USER MOD Single : A 148 ASN : amide:sc= -0.397 X(o=-0.4,f=-0.0059) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.059 -6.096 6.183 1.00 0.00 N ATOM 2 CA MET A 1 -16.553 -4.779 5.764 1.00 0.00 C ATOM 3 C MET A 1 -15.749 -3.681 6.456 1.00 0.00 C ATOM 4 O MET A 1 -16.112 -3.246 7.551 1.00 0.00 O ATOM 5 CB MET A 1 -18.053 -4.613 6.054 1.00 0.00 C ATOM 6 CG MET A 1 -18.955 -5.360 5.069 1.00 0.00 C ATOM 7 SD MET A 1 -18.997 -7.157 5.274 1.00 0.00 S ATOM 8 CE MET A 1 -20.248 -7.565 4.029 1.00 0.00 C ATOM 0 H1 MET A 1 -16.787 -6.815 5.998 1.00 0.00 H new ATOM 0 H2 MET A 1 -15.198 -6.330 5.648 1.00 0.00 H new ATOM 0 H3 MET A 1 -15.841 -6.078 7.200 1.00 0.00 H new ATOM 0 HA MET A 1 -16.422 -4.697 4.685 1.00 0.00 H new ATOM 0 HB2 MET A 1 -18.260 -4.967 7.064 1.00 0.00 H new ATOM 0 HB3 MET A 1 -18.304 -3.552 6.030 1.00 0.00 H new ATOM 0 HG2 MET A 1 -19.970 -4.975 5.167 1.00 0.00 H new ATOM 0 HG3 MET A 1 -18.625 -5.134 4.055 1.00 0.00 H new ATOM 0 HE1 MET A 1 -20.407 -8.643 4.013 1.00 0.00 H new ATOM 0 HE2 MET A 1 -21.184 -7.064 4.276 1.00 0.00 H new ATOM 0 HE3 MET A 1 -19.907 -7.234 3.048 1.00 0.00 H new ATOM 18 N ALA A 2 -14.649 -3.240 5.845 1.00 0.00 N ATOM 19 CA ALA A 2 -13.876 -2.057 6.208 1.00 0.00 C ATOM 20 C ALA A 2 -12.948 -1.782 5.027 1.00 0.00 C ATOM 21 O ALA A 2 -12.199 -2.681 4.632 1.00 0.00 O ATOM 22 CB ALA A 2 -13.077 -2.308 7.492 1.00 0.00 C ATOM 0 H ALA A 2 -14.254 -3.727 5.040 1.00 0.00 H new ATOM 0 HA ALA A 2 -14.521 -1.201 6.407 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -12.507 -1.414 7.746 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -13.762 -2.546 8.306 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -12.393 -3.143 7.338 1.00 0.00 H new ATOM 28 N HIS A 3 -13.029 -0.601 4.417 1.00 0.00 N ATOM 29 CA HIS A 3 -12.251 -0.281 3.224 1.00 0.00 C ATOM 30 C HIS A 3 -10.820 0.117 3.587 1.00 0.00 C ATOM 31 O HIS A 3 -10.581 0.818 4.576 1.00 0.00 O ATOM 32 CB HIS A 3 -12.946 0.831 2.434 1.00 0.00 C ATOM 33 CG HIS A 3 -14.301 0.404 1.933 1.00 0.00 C ATOM 34 ND1 HIS A 3 -15.512 0.703 2.513 1.00 0.00 N ATOM 35 CD2 HIS A 3 -14.540 -0.459 0.901 1.00 0.00 C ATOM 36 CE1 HIS A 3 -16.465 0.028 1.850 1.00 0.00 C ATOM 37 NE2 HIS A 3 -15.916 -0.697 0.865 1.00 0.00 N ATOM 0 H HIS A 3 -13.633 0.157 4.735 1.00 0.00 H new ATOM 0 HA HIS A 3 -12.192 -1.172 2.599 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -13.054 1.712 3.067 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -12.321 1.120 1.589 1.00 0.00 H new ATOM 0 HD1 HIS A 3 -15.660 1.327 3.306 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -13.801 -0.880 0.235 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -17.520 0.064 2.077 1.00 0.00 H new ATOM 45 N ILE A 4 -9.861 -0.298 2.757 1.00 0.00 N ATOM 46 CA ILE A 4 -8.440 0.002 2.921 1.00 0.00 C ATOM 47 C ILE A 4 -7.845 0.462 1.583 1.00 0.00 C ATOM 48 O ILE A 4 -8.565 0.630 0.593 1.00 0.00 O ATOM 49 CB ILE A 4 -7.688 -1.200 3.536 1.00 0.00 C ATOM 50 CG1 ILE A 4 -7.776 -2.473 2.673 1.00 0.00 C ATOM 51 CG2 ILE A 4 -8.226 -1.484 4.942 1.00 0.00 C ATOM 52 CD1 ILE A 4 -6.666 -3.465 3.035 1.00 0.00 C ATOM 0 H ILE A 4 -10.057 -0.866 1.933 1.00 0.00 H new ATOM 0 HA ILE A 4 -8.322 0.825 3.626 1.00 0.00 H new ATOM 0 HB ILE A 4 -6.634 -0.925 3.584 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -8.749 -2.944 2.814 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -7.700 -2.207 1.619 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -7.693 -2.332 5.371 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -8.079 -0.607 5.572 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -9.290 -1.716 4.885 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -6.754 -4.353 2.410 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.694 -3.000 2.870 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -6.759 -3.749 4.083 1.00 0.00 H new ATOM 64 N PHE A 5 -6.533 0.697 1.555 1.00 0.00 N ATOM 65 CA PHE A 5 -5.752 0.981 0.353 1.00 0.00 C ATOM 66 C PHE A 5 -4.656 -0.083 0.206 1.00 0.00 C ATOM 67 O PHE A 5 -4.360 -0.777 1.186 1.00 0.00 O ATOM 68 CB PHE A 5 -5.131 2.369 0.530 1.00 0.00 C ATOM 69 CG PHE A 5 -4.696 3.087 -0.730 1.00 0.00 C ATOM 70 CD1 PHE A 5 -5.662 3.427 -1.693 1.00 0.00 C ATOM 71 CD2 PHE A 5 -3.356 3.494 -0.908 1.00 0.00 C ATOM 72 CE1 PHE A 5 -5.290 4.140 -2.841 1.00 0.00 C ATOM 73 CE2 PHE A 5 -2.991 4.230 -2.049 1.00 0.00 C ATOM 74 CZ PHE A 5 -3.959 4.553 -3.014 1.00 0.00 C ATOM 0 H PHE A 5 -5.964 0.694 2.402 1.00 0.00 H new ATOM 0 HA PHE A 5 -6.374 0.961 -0.542 1.00 0.00 H new ATOM 0 HB2 PHE A 5 -5.852 3.000 1.049 1.00 0.00 H new ATOM 0 HB3 PHE A 5 -4.264 2.273 1.183 1.00 0.00 H new ATOM 0 HD1 PHE A 5 -6.693 3.138 -1.548 1.00 0.00 H new ATOM 0 HD2 PHE A 5 -2.611 3.240 -0.168 1.00 0.00 H new ATOM 0 HE1 PHE A 5 -6.029 4.372 -3.594 1.00 0.00 H new ATOM 0 HE2 PHE A 5 -1.967 4.547 -2.183 1.00 0.00 H new ATOM 0 HZ PHE A 5 -3.679 5.120 -3.890 1.00 0.00 H new ATOM 84 N VAL A 6 -4.029 -0.202 -0.968 1.00 0.00 N ATOM 85 CA VAL A 6 -3.032 -1.244 -1.261 1.00 0.00 C ATOM 86 C VAL A 6 -1.619 -0.668 -1.428 1.00 0.00 C ATOM 87 O VAL A 6 -1.456 0.438 -1.952 1.00 0.00 O ATOM 88 CB VAL A 6 -3.515 -2.080 -2.466 1.00 0.00 C ATOM 89 CG1 VAL A 6 -3.793 -1.297 -3.755 1.00 0.00 C ATOM 90 CG2 VAL A 6 -2.528 -3.181 -2.856 1.00 0.00 C ATOM 0 H VAL A 6 -4.199 0.428 -1.752 1.00 0.00 H new ATOM 0 HA VAL A 6 -2.946 -1.915 -0.406 1.00 0.00 H new ATOM 0 HB VAL A 6 -4.454 -2.481 -2.085 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -4.126 -1.984 -4.533 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -4.569 -0.555 -3.570 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -2.882 -0.795 -4.080 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -2.920 -3.736 -3.708 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -1.571 -2.733 -3.123 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -2.389 -3.860 -2.014 1.00 0.00 H new ATOM 100 N TYR A 7 -0.581 -1.437 -1.069 1.00 0.00 N ATOM 101 CA TYR A 7 0.801 -0.969 -0.926 1.00 0.00 C ATOM 102 C TYR A 7 1.661 -1.116 -2.190 1.00 0.00 C ATOM 103 O TYR A 7 2.876 -0.949 -2.122 1.00 0.00 O ATOM 104 CB TYR A 7 1.473 -1.713 0.245 1.00 0.00 C ATOM 105 CG TYR A 7 2.159 -0.790 1.242 1.00 0.00 C ATOM 106 CD1 TYR A 7 3.056 0.223 0.823 1.00 0.00 C ATOM 107 CD2 TYR A 7 1.880 -0.938 2.612 1.00 0.00 C ATOM 108 CE1 TYR A 7 3.574 1.145 1.745 1.00 0.00 C ATOM 109 CE2 TYR A 7 2.398 -0.019 3.532 1.00 0.00 C ATOM 110 CZ TYR A 7 3.184 1.056 3.090 1.00 0.00 C ATOM 111 OH TYR A 7 3.523 2.027 3.966 1.00 0.00 O ATOM 0 H TYR A 7 -0.685 -2.431 -0.865 1.00 0.00 H new ATOM 0 HA TYR A 7 0.737 0.102 -0.734 1.00 0.00 H new ATOM 0 HB2 TYR A 7 0.721 -2.304 0.768 1.00 0.00 H new ATOM 0 HB3 TYR A 7 2.207 -2.413 -0.154 1.00 0.00 H new ATOM 0 HD1 TYR A 7 3.344 0.286 -0.216 1.00 0.00 H new ATOM 0 HD2 TYR A 7 1.267 -1.759 2.954 1.00 0.00 H new ATOM 0 HE1 TYR A 7 4.263 1.912 1.424 1.00 0.00 H new ATOM 0 HE2 TYR A 7 2.192 -0.138 4.586 1.00 0.00 H new ATOM 0 HH TYR A 7 2.717 2.360 4.413 1.00 0.00 H new ATOM 121 N GLY A 8 1.093 -1.504 -3.333 1.00 0.00 N ATOM 122 CA GLY A 8 1.889 -1.983 -4.468 1.00 0.00 C ATOM 123 C GLY A 8 1.737 -3.493 -4.613 1.00 0.00 C ATOM 124 O GLY A 8 1.719 -4.019 -5.729 1.00 0.00 O ATOM 0 H GLY A 8 0.087 -1.497 -3.499 1.00 0.00 H new ATOM 0 HA2 GLY A 8 1.566 -1.487 -5.384 1.00 0.00 H new ATOM 0 HA3 GLY A 8 2.938 -1.728 -4.320 1.00 0.00 H new ATOM 128 N THR A 9 1.580 -4.167 -3.479 1.00 0.00 N ATOM 129 CA THR A 9 1.598 -5.597 -3.239 1.00 0.00 C ATOM 130 C THR A 9 0.440 -6.367 -3.872 1.00 0.00 C ATOM 131 O THR A 9 0.614 -7.548 -4.171 1.00 0.00 O ATOM 132 CB THR A 9 1.722 -5.798 -1.711 1.00 0.00 C ATOM 133 OG1 THR A 9 1.042 -4.753 -1.027 1.00 0.00 O ATOM 134 CG2 THR A 9 3.195 -5.788 -1.287 1.00 0.00 C ATOM 0 H THR A 9 1.419 -3.661 -2.608 1.00 0.00 H new ATOM 0 HA THR A 9 2.457 -6.035 -3.747 1.00 0.00 H new ATOM 0 HB THR A 9 1.277 -6.760 -1.456 1.00 0.00 H new ATOM 0 HG1 THR A 9 1.123 -4.888 -0.060 1.00 0.00 H new ATOM 0 HG21 THR A 9 3.264 -5.931 -0.209 1.00 0.00 H new ATOM 0 HG22 THR A 9 3.725 -6.594 -1.794 1.00 0.00 H new ATOM 0 HG23 THR A 9 3.645 -4.832 -1.556 1.00 0.00 H new ATOM 142 N LEU A 10 -0.699 -5.730 -4.147 1.00 0.00 N ATOM 143 CA LEU A 10 -1.913 -6.391 -4.632 1.00 0.00 C ATOM 144 C LEU A 10 -2.654 -5.448 -5.594 1.00 0.00 C ATOM 145 O LEU A 10 -3.829 -5.161 -5.419 1.00 0.00 O ATOM 146 CB LEU A 10 -2.791 -6.820 -3.441 1.00 0.00 C ATOM 147 CG LEU A 10 -2.130 -7.797 -2.454 1.00 0.00 C ATOM 148 CD1 LEU A 10 -1.567 -7.100 -1.211 1.00 0.00 C ATOM 149 CD2 LEU A 10 -3.130 -8.831 -1.987 1.00 0.00 C ATOM 0 H LEU A 10 -0.806 -4.722 -4.037 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.656 -7.296 -5.183 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -3.094 -5.927 -2.894 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -3.700 -7.280 -3.828 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.307 -8.259 -2.998 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -1.114 -7.841 -0.552 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -0.813 -6.372 -1.512 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.373 -6.590 -0.683 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.647 -9.515 -1.289 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -3.963 -8.333 -1.490 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -3.502 -9.391 -2.845 1.00 0.00 H new ATOM 161 N LYS A 11 -1.950 -4.849 -6.564 1.00 0.00 N ATOM 162 CA LYS A 11 -2.583 -3.998 -7.579 1.00 0.00 C ATOM 163 C LYS A 11 -2.136 -4.375 -8.983 1.00 0.00 C ATOM 164 O LYS A 11 -2.813 -5.194 -9.596 1.00 0.00 O ATOM 165 CB LYS A 11 -2.477 -2.500 -7.237 1.00 0.00 C ATOM 166 CG LYS A 11 -1.087 -1.989 -6.823 1.00 0.00 C ATOM 167 CD LYS A 11 -0.578 -0.818 -7.673 1.00 0.00 C ATOM 168 CE LYS A 11 -1.330 0.481 -7.395 1.00 0.00 C ATOM 169 NZ LYS A 11 -0.688 1.623 -8.075 1.00 0.00 N ATOM 0 H LYS A 11 -0.939 -4.939 -6.667 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.655 -4.194 -7.566 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -2.807 -1.928 -8.104 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -3.175 -2.284 -6.428 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -1.121 -1.680 -5.778 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -0.374 -2.811 -6.889 1.00 0.00 H new ATOM 0 HD2 LYS A 11 0.484 -0.667 -7.478 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -0.676 -1.071 -8.729 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -2.362 0.387 -7.732 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -1.361 0.664 -6.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -0.876 2.495 -7.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 0.338 1.464 -8.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -1.073 1.716 -9.037 1.00 0.00 H new ATOM 183 N ARG A 12 -1.005 -3.856 -9.487 1.00 0.00 N ATOM 184 CA ARG A 12 -0.550 -4.157 -10.849 1.00 0.00 C ATOM 185 C ARG A 12 -0.374 -5.654 -11.001 1.00 0.00 C ATOM 186 O ARG A 12 -1.141 -6.303 -11.705 1.00 0.00 O ATOM 187 CB ARG A 12 0.736 -3.388 -11.227 1.00 0.00 C ATOM 188 CG ARG A 12 0.536 -2.392 -12.370 1.00 0.00 C ATOM 189 CD ARG A 12 -0.354 -1.223 -11.975 1.00 0.00 C ATOM 190 NE ARG A 12 -0.245 -0.126 -12.945 1.00 0.00 N ATOM 191 CZ ARG A 12 -1.036 0.081 -14.001 1.00 0.00 C ATOM 192 NH1 ARG A 12 -1.930 -0.827 -14.365 1.00 0.00 N ATOM 193 NH2 ARG A 12 -0.939 1.220 -14.669 1.00 0.00 N ATOM 0 H ARG A 12 -0.391 -3.227 -8.970 1.00 0.00 H new ATOM 0 HA ARG A 12 -1.314 -3.815 -11.547 1.00 0.00 H new ATOM 0 HB2 ARG A 12 1.102 -2.854 -10.350 1.00 0.00 H new ATOM 0 HB3 ARG A 12 1.508 -4.104 -11.510 1.00 0.00 H new ATOM 0 HG2 ARG A 12 1.506 -2.013 -12.692 1.00 0.00 H new ATOM 0 HG3 ARG A 12 0.096 -2.907 -13.224 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -1.390 -1.556 -11.912 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -0.073 -0.866 -10.984 1.00 0.00 H new ATOM 0 HE ARG A 12 0.510 0.544 -12.798 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -2.019 -1.695 -13.837 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -2.529 -0.658 -15.173 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -0.266 1.928 -14.375 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -1.538 1.390 -15.477 1.00 0.00 H new ATOM 207 N GLY A 13 0.599 -6.200 -10.286 1.00 0.00 N ATOM 208 CA GLY A 13 0.902 -7.596 -10.364 1.00 0.00 C ATOM 209 C GLY A 13 2.131 -7.775 -9.513 1.00 0.00 C ATOM 210 O GLY A 13 3.247 -7.586 -9.994 1.00 0.00 O ATOM 0 H GLY A 13 1.192 -5.677 -9.641 1.00 0.00 H new ATOM 0 HA2 GLY A 13 0.074 -8.201 -9.994 1.00 0.00 H new ATOM 0 HA3 GLY A 13 1.086 -7.903 -11.393 1.00 0.00 H new ATOM 214 N GLN A 14 1.922 -7.971 -8.212 1.00 0.00 N ATOM 215 CA GLN A 14 2.983 -8.280 -7.281 1.00 0.00 C ATOM 216 C GLN A 14 2.844 -9.756 -6.888 1.00 0.00 C ATOM 217 O GLN A 14 1.737 -10.300 -6.958 1.00 0.00 O ATOM 218 CB GLN A 14 2.898 -7.341 -6.072 1.00 0.00 C ATOM 219 CG GLN A 14 4.127 -6.458 -5.844 1.00 0.00 C ATOM 220 CD GLN A 14 4.599 -5.782 -7.107 1.00 0.00 C ATOM 221 OE1 GLN A 14 5.608 -6.166 -7.678 1.00 0.00 O ATOM 222 NE2 GLN A 14 3.856 -4.820 -7.605 1.00 0.00 N ATOM 0 H GLN A 14 1.000 -7.917 -7.780 1.00 0.00 H new ATOM 0 HA GLN A 14 3.965 -8.128 -7.728 1.00 0.00 H new ATOM 0 HB2 GLN A 14 2.026 -6.698 -6.192 1.00 0.00 H new ATOM 0 HB3 GLN A 14 2.731 -7.941 -5.177 1.00 0.00 H new ATOM 0 HG2 GLN A 14 3.891 -5.700 -5.097 1.00 0.00 H new ATOM 0 HG3 GLN A 14 4.936 -7.065 -5.438 1.00 0.00 H new ATOM 0 HE21 GLN A 14 3.017 -4.515 -7.111 1.00 0.00 H new ATOM 0 HE22 GLN A 14 4.118 -4.378 -8.486 1.00 0.00 H new ATOM 231 N PRO A 15 3.905 -10.390 -6.367 1.00 0.00 N ATOM 232 CA PRO A 15 3.908 -11.817 -6.069 1.00 0.00 C ATOM 233 C PRO A 15 2.853 -12.196 -5.027 1.00 0.00 C ATOM 234 O PRO A 15 2.319 -13.306 -5.043 1.00 0.00 O ATOM 235 CB PRO A 15 5.328 -12.140 -5.590 1.00 0.00 C ATOM 236 CG PRO A 15 5.979 -10.803 -5.270 1.00 0.00 C ATOM 237 CD PRO A 15 5.128 -9.745 -5.931 1.00 0.00 C ATOM 0 HA PRO A 15 3.645 -12.400 -6.952 1.00 0.00 H new ATOM 0 HB2 PRO A 15 5.306 -12.783 -4.710 1.00 0.00 H new ATOM 0 HB3 PRO A 15 5.888 -12.672 -6.360 1.00 0.00 H new ATOM 0 HG2 PRO A 15 6.030 -10.644 -4.193 1.00 0.00 H new ATOM 0 HG3 PRO A 15 7.002 -10.769 -5.646 1.00 0.00 H new ATOM 0 HD2 PRO A 15 4.909 -8.936 -5.234 1.00 0.00 H new ATOM 0 HD3 PRO A 15 5.653 -9.303 -6.778 1.00 0.00 H new ATOM 245 N ASN A 16 2.501 -11.250 -4.155 1.00 0.00 N ATOM 246 CA ASN A 16 1.625 -11.447 -3.018 1.00 0.00 C ATOM 247 C ASN A 16 0.182 -11.595 -3.467 1.00 0.00 C ATOM 248 O ASN A 16 -0.643 -11.993 -2.666 1.00 0.00 O ATOM 249 CB ASN A 16 1.710 -10.234 -2.069 1.00 0.00 C ATOM 250 CG ASN A 16 3.125 -9.702 -1.940 1.00 0.00 C ATOM 251 OD1 ASN A 16 3.417 -8.677 -2.720 1.00 0.00 O flip ATOM 252 ND2 ASN A 16 3.972 -10.252 -1.250 1.00 0.00 N flip ATOM 0 H ASN A 16 2.836 -10.290 -4.232 1.00 0.00 H new ATOM 0 HA ASN A 16 1.945 -12.355 -2.506 1.00 0.00 H new ATOM 0 HB2 ASN A 16 1.058 -9.441 -2.437 1.00 0.00 H new ATOM 0 HB3 ASN A 16 1.340 -10.519 -1.084 1.00 0.00 H new ATOM 0 HD21 ASN A 16 3.714 -11.042 -0.658 1.00 0.00 H new ATOM 0 HD22 ASN A 16 4.937 -9.921 -1.266 1.00 0.00 H new ATOM 259 N HIS A 17 -0.178 -11.221 -4.694 1.00 0.00 N ATOM 260 CA HIS A 17 -1.565 -10.918 -5.021 1.00 0.00 C ATOM 261 C HIS A 17 -2.469 -12.143 -4.889 1.00 0.00 C ATOM 262 O HIS A 17 -3.605 -12.015 -4.427 1.00 0.00 O ATOM 263 CB HIS A 17 -1.543 -10.282 -6.436 1.00 0.00 C ATOM 264 CG HIS A 17 -2.804 -9.764 -7.106 1.00 0.00 C ATOM 265 ND1 HIS A 17 -2.825 -8.741 -8.034 1.00 0.00 N ATOM 266 CD2 HIS A 17 -4.069 -10.294 -7.068 1.00 0.00 C ATOM 267 CE1 HIS A 17 -4.076 -8.631 -8.507 1.00 0.00 C ATOM 268 NE2 HIS A 17 -4.867 -9.574 -7.967 1.00 0.00 N ATOM 0 H HIS A 17 0.472 -11.122 -5.474 1.00 0.00 H new ATOM 0 HA HIS A 17 -2.005 -10.214 -4.315 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -0.844 -9.447 -6.394 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -1.113 -11.025 -7.108 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -4.393 -11.121 -6.453 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -4.401 -7.889 -9.221 1.00 0.00 H new ATOM 0 HE2 HIS A 17 -5.853 -9.734 -8.171 1.00 0.00 H new ATOM 276 N LYS A 18 -1.962 -13.349 -5.169 1.00 0.00 N ATOM 277 CA LYS A 18 -2.749 -14.568 -4.991 1.00 0.00 C ATOM 278 C LYS A 18 -3.230 -14.764 -3.557 1.00 0.00 C ATOM 279 O LYS A 18 -4.217 -15.458 -3.353 1.00 0.00 O ATOM 280 CB LYS A 18 -2.008 -15.795 -5.538 1.00 0.00 C ATOM 281 CG LYS A 18 -0.652 -16.154 -4.918 1.00 0.00 C ATOM 282 CD LYS A 18 -0.694 -16.762 -3.510 1.00 0.00 C ATOM 283 CE LYS A 18 0.673 -17.391 -3.231 1.00 0.00 C ATOM 284 NZ LYS A 18 0.910 -17.684 -1.806 1.00 0.00 N ATOM 0 H LYS A 18 -1.016 -13.504 -5.517 1.00 0.00 H new ATOM 0 HA LYS A 18 -3.655 -14.447 -5.584 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -2.665 -16.658 -5.427 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -1.857 -15.644 -6.607 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -0.147 -16.857 -5.580 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -0.040 -15.252 -4.884 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -0.920 -15.995 -2.769 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -1.481 -17.513 -3.441 1.00 0.00 H new ATOM 0 HE2 LYS A 18 0.762 -18.315 -3.803 1.00 0.00 H new ATOM 0 HE3 LYS A 18 1.453 -16.719 -3.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 1.853 -18.108 -1.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 0.857 -16.802 -1.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 0.188 -18.349 -1.464 1.00 0.00 H new ATOM 298 N VAL A 19 -2.609 -14.117 -2.568 1.00 0.00 N ATOM 299 CA VAL A 19 -2.999 -14.227 -1.181 1.00 0.00 C ATOM 300 C VAL A 19 -4.471 -13.858 -0.996 1.00 0.00 C ATOM 301 O VAL A 19 -5.158 -14.482 -0.189 1.00 0.00 O ATOM 302 CB VAL A 19 -2.044 -13.349 -0.348 1.00 0.00 C ATOM 303 CG1 VAL A 19 -2.421 -11.871 -0.233 1.00 0.00 C ATOM 304 CG2 VAL A 19 -1.695 -14.031 0.934 1.00 0.00 C ATOM 0 H VAL A 19 -1.813 -13.498 -2.721 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.914 -15.257 -0.834 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.121 -13.262 -0.922 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -1.679 -11.352 0.374 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -2.452 -11.425 -1.227 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.401 -11.781 0.236 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -1.020 -13.398 1.511 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -2.603 -14.212 1.509 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -1.207 -14.981 0.719 1.00 0.00 H new ATOM 314 N MET A 20 -4.976 -12.885 -1.759 1.00 0.00 N ATOM 315 CA MET A 20 -6.340 -12.417 -1.598 1.00 0.00 C ATOM 316 C MET A 20 -7.340 -13.220 -2.429 1.00 0.00 C ATOM 317 O MET A 20 -8.540 -12.968 -2.342 1.00 0.00 O ATOM 318 CB MET A 20 -6.406 -10.915 -1.880 1.00 0.00 C ATOM 319 CG MET A 20 -6.398 -10.482 -3.357 1.00 0.00 C ATOM 320 SD MET A 20 -7.456 -9.046 -3.671 1.00 0.00 S ATOM 321 CE MET A 20 -6.617 -7.824 -2.625 1.00 0.00 C ATOM 0 H MET A 20 -4.453 -12.410 -2.494 1.00 0.00 H new ATOM 0 HA MET A 20 -6.639 -12.582 -0.563 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.311 -10.522 -1.416 1.00 0.00 H new ATOM 0 HB3 MET A 20 -5.561 -10.439 -1.383 1.00 0.00 H new ATOM 0 HG2 MET A 20 -5.377 -10.248 -3.657 1.00 0.00 H new ATOM 0 HG3 MET A 20 -6.730 -11.315 -3.977 1.00 0.00 H new ATOM 0 HE1 MET A 20 -7.346 -7.107 -2.247 1.00 0.00 H new ATOM 0 HE2 MET A 20 -6.137 -8.330 -1.787 1.00 0.00 H new ATOM 0 HE3 MET A 20 -5.863 -7.299 -3.212 1.00 0.00 H new ATOM 331 N LEU A 21 -6.858 -14.153 -3.254 1.00 0.00 N ATOM 332 CA LEU A 21 -7.678 -15.005 -4.106 1.00 0.00 C ATOM 333 C LEU A 21 -8.055 -16.299 -3.375 1.00 0.00 C ATOM 334 O LEU A 21 -8.847 -17.086 -3.888 1.00 0.00 O ATOM 335 CB LEU A 21 -6.916 -15.340 -5.405 1.00 0.00 C ATOM 336 CG LEU A 21 -6.432 -14.128 -6.227 1.00 0.00 C ATOM 337 CD1 LEU A 21 -5.707 -14.626 -7.484 1.00 0.00 C ATOM 338 CD2 LEU A 21 -7.572 -13.187 -6.629 1.00 0.00 C ATOM 0 H LEU A 21 -5.859 -14.338 -3.347 1.00 0.00 H new ATOM 0 HA LEU A 21 -8.593 -14.467 -4.354 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -6.051 -15.952 -5.150 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -7.562 -15.950 -6.037 1.00 0.00 H new ATOM 0 HG LEU A 21 -5.756 -13.555 -5.593 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -5.363 -13.772 -8.068 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -4.851 -15.235 -7.193 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -6.391 -15.225 -8.085 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -7.170 -12.354 -7.205 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -8.296 -13.731 -7.235 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -8.062 -12.806 -5.733 1.00 0.00 H new ATOM 350 N ASP A 22 -7.508 -16.533 -2.178 1.00 0.00 N ATOM 351 CA ASP A 22 -7.878 -17.624 -1.286 1.00 0.00 C ATOM 352 C ASP A 22 -8.675 -16.994 -0.154 1.00 0.00 C ATOM 353 O ASP A 22 -8.105 -16.420 0.775 1.00 0.00 O ATOM 354 CB ASP A 22 -6.647 -18.323 -0.703 1.00 0.00 C ATOM 355 CG ASP A 22 -5.924 -19.244 -1.676 1.00 0.00 C ATOM 356 OD1 ASP A 22 -6.346 -20.413 -1.815 1.00 0.00 O ATOM 357 OD2 ASP A 22 -4.887 -18.835 -2.248 1.00 0.00 O ATOM 0 H ASP A 22 -6.769 -15.944 -1.795 1.00 0.00 H new ATOM 0 HA ASP A 22 -8.447 -18.376 -1.832 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -5.947 -17.565 -0.351 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -6.953 -18.903 0.168 1.00 0.00 H new ATOM 362 N HIS A 23 -9.998 -17.089 -0.226 1.00 0.00 N ATOM 363 CA HIS A 23 -10.932 -16.491 0.728 1.00 0.00 C ATOM 364 C HIS A 23 -10.724 -16.984 2.177 1.00 0.00 C ATOM 365 O HIS A 23 -11.121 -16.316 3.136 1.00 0.00 O ATOM 366 CB HIS A 23 -12.346 -16.779 0.214 1.00 0.00 C ATOM 367 CG HIS A 23 -13.452 -16.226 1.070 1.00 0.00 C ATOM 368 ND1 HIS A 23 -14.433 -16.966 1.685 1.00 0.00 N ATOM 369 CD2 HIS A 23 -13.664 -14.909 1.368 1.00 0.00 C ATOM 370 CE1 HIS A 23 -15.248 -16.113 2.322 1.00 0.00 C ATOM 371 NE2 HIS A 23 -14.824 -14.843 2.154 1.00 0.00 N ATOM 0 H HIS A 23 -10.468 -17.600 -0.973 1.00 0.00 H new ATOM 0 HA HIS A 23 -10.756 -15.417 0.786 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -12.443 -16.368 -0.791 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -12.475 -17.858 0.131 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -13.053 -14.075 1.057 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -16.120 -16.402 2.889 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -15.261 -14.000 2.526 1.00 0.00 H new ATOM 379 N SER A 24 -10.046 -18.120 2.364 1.00 0.00 N ATOM 380 CA SER A 24 -9.573 -18.594 3.667 1.00 0.00 C ATOM 381 C SER A 24 -8.575 -17.653 4.336 1.00 0.00 C ATOM 382 O SER A 24 -8.531 -17.608 5.565 1.00 0.00 O ATOM 383 CB SER A 24 -8.973 -19.983 3.558 1.00 0.00 C ATOM 384 OG SER A 24 -9.999 -20.947 3.480 1.00 0.00 O ATOM 0 H SER A 24 -9.806 -18.749 1.597 1.00 0.00 H new ATOM 0 HA SER A 24 -10.457 -18.624 4.303 1.00 0.00 H new ATOM 0 HB2 SER A 24 -8.337 -20.045 2.675 1.00 0.00 H new ATOM 0 HB3 SER A 24 -8.340 -20.183 4.422 1.00 0.00 H new ATOM 0 HG SER A 24 -9.603 -21.841 3.408 1.00 0.00 H new ATOM 390 N HIS A 25 -7.800 -16.878 3.576 1.00 0.00 N ATOM 391 CA HIS A 25 -6.934 -15.861 4.156 1.00 0.00 C ATOM 392 C HIS A 25 -7.719 -14.593 4.541 1.00 0.00 C ATOM 393 O HIS A 25 -7.108 -13.654 5.050 1.00 0.00 O ATOM 394 CB HIS A 25 -5.808 -15.503 3.182 1.00 0.00 C ATOM 395 CG HIS A 25 -4.946 -16.633 2.666 1.00 0.00 C ATOM 396 ND1 HIS A 25 -4.405 -16.665 1.408 1.00 0.00 N ATOM 397 CD2 HIS A 25 -4.533 -17.765 3.317 1.00 0.00 C ATOM 398 CE1 HIS A 25 -3.699 -17.796 1.281 1.00 0.00 C ATOM 399 NE2 HIS A 25 -3.728 -18.499 2.429 1.00 0.00 N ATOM 0 H HIS A 25 -7.757 -16.938 2.559 1.00 0.00 H new ATOM 0 HA HIS A 25 -6.505 -16.278 5.067 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -6.253 -15.000 2.323 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -5.156 -14.780 3.672 1.00 0.00 H new ATOM 0 HD1 HIS A 25 -4.520 -15.949 0.690 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -4.781 -18.044 4.330 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -3.180 -18.101 0.384 1.00 0.00 H new ATOM 407 N GLY A 26 -9.031 -14.550 4.278 1.00 0.00 N ATOM 408 CA GLY A 26 -9.933 -13.429 4.498 1.00 0.00 C ATOM 409 C GLY A 26 -10.437 -12.874 3.163 1.00 0.00 C ATOM 410 O GLY A 26 -10.055 -13.348 2.091 1.00 0.00 O ATOM 0 H GLY A 26 -9.516 -15.354 3.880 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.778 -13.749 5.107 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -9.419 -12.645 5.053 1.00 0.00 H new ATOM 414 N LEU A 27 -11.326 -11.887 3.233 1.00 0.00 N ATOM 415 CA LEU A 27 -12.059 -11.324 2.103 1.00 0.00 C ATOM 416 C LEU A 27 -11.324 -10.109 1.553 1.00 0.00 C ATOM 417 O LEU A 27 -10.908 -9.249 2.331 1.00 0.00 O ATOM 418 CB LEU A 27 -13.449 -10.911 2.607 1.00 0.00 C ATOM 419 CG LEU A 27 -14.512 -10.466 1.587 1.00 0.00 C ATOM 420 CD1 LEU A 27 -14.315 -9.073 0.996 1.00 0.00 C ATOM 421 CD2 LEU A 27 -14.677 -11.465 0.446 1.00 0.00 C ATOM 0 H LEU A 27 -11.566 -11.438 4.117 1.00 0.00 H new ATOM 0 HA LEU A 27 -12.145 -12.059 1.303 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.860 -11.753 3.164 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -13.312 -10.095 3.317 1.00 0.00 H new ATOM 0 HG LEU A 27 -15.419 -10.426 2.189 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -15.118 -8.860 0.291 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -14.329 -8.333 1.796 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.357 -9.029 0.479 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -15.438 -11.105 -0.246 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -13.730 -11.574 -0.082 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -14.981 -12.431 0.849 1.00 0.00 H new ATOM 433 N ALA A 28 -11.232 -9.993 0.230 1.00 0.00 N ATOM 434 CA ALA A 28 -10.849 -8.772 -0.466 1.00 0.00 C ATOM 435 C ALA A 28 -11.642 -8.620 -1.766 1.00 0.00 C ATOM 436 O ALA A 28 -11.595 -9.513 -2.617 1.00 0.00 O ATOM 437 CB ALA A 28 -9.362 -8.821 -0.783 1.00 0.00 C ATOM 0 H ALA A 28 -11.428 -10.769 -0.403 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.066 -7.918 0.176 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -9.071 -7.909 -1.304 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.795 -8.906 0.144 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -9.153 -9.683 -1.416 1.00 0.00 H new ATOM 443 N ALA A 29 -12.323 -7.486 -1.943 1.00 0.00 N ATOM 444 CA ALA A 29 -13.189 -7.194 -3.078 1.00 0.00 C ATOM 445 C ALA A 29 -12.886 -5.795 -3.617 1.00 0.00 C ATOM 446 O ALA A 29 -12.882 -4.822 -2.862 1.00 0.00 O ATOM 447 CB ALA A 29 -14.655 -7.329 -2.661 1.00 0.00 C ATOM 0 H ALA A 29 -12.282 -6.719 -1.272 1.00 0.00 H new ATOM 0 HA ALA A 29 -12.999 -7.910 -3.878 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -15.298 -7.109 -3.514 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -14.843 -8.346 -2.317 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -14.870 -6.628 -1.855 1.00 0.00 H new ATOM 453 N PHE A 30 -12.604 -5.715 -4.917 1.00 0.00 N ATOM 454 CA PHE A 30 -12.259 -4.498 -5.649 1.00 0.00 C ATOM 455 C PHE A 30 -13.418 -3.493 -5.549 1.00 0.00 C ATOM 456 O PHE A 30 -14.457 -3.685 -6.187 1.00 0.00 O ATOM 457 CB PHE A 30 -11.962 -4.901 -7.107 1.00 0.00 C ATOM 458 CG PHE A 30 -11.227 -3.881 -7.954 1.00 0.00 C ATOM 459 CD1 PHE A 30 -11.749 -2.588 -8.147 1.00 0.00 C ATOM 460 CD2 PHE A 30 -9.992 -4.222 -8.540 1.00 0.00 C ATOM 461 CE1 PHE A 30 -11.010 -1.627 -8.852 1.00 0.00 C ATOM 462 CE2 PHE A 30 -9.270 -3.266 -9.274 1.00 0.00 C ATOM 463 CZ PHE A 30 -9.768 -1.961 -9.419 1.00 0.00 C ATOM 0 H PHE A 30 -12.610 -6.539 -5.518 1.00 0.00 H new ATOM 0 HA PHE A 30 -11.378 -4.012 -5.229 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -11.376 -5.820 -7.094 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -12.908 -5.133 -7.596 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -12.721 -2.335 -7.751 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -9.599 -5.221 -8.425 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -11.397 -0.625 -8.960 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -8.328 -3.536 -9.729 1.00 0.00 H new ATOM 0 HZ PHE A 30 -9.201 -1.220 -9.962 1.00 0.00 H new ATOM 473 N ARG A 31 -13.255 -2.404 -4.790 1.00 0.00 N ATOM 474 CA ARG A 31 -14.298 -1.419 -4.506 1.00 0.00 C ATOM 475 C ARG A 31 -13.854 -0.040 -4.984 1.00 0.00 C ATOM 476 O ARG A 31 -13.715 0.901 -4.207 1.00 0.00 O ATOM 477 CB ARG A 31 -14.639 -1.456 -3.005 1.00 0.00 C ATOM 478 CG ARG A 31 -15.873 -0.608 -2.644 1.00 0.00 C ATOM 479 CD ARG A 31 -17.184 -1.280 -3.033 1.00 0.00 C ATOM 480 NE ARG A 31 -17.499 -2.435 -2.178 1.00 0.00 N ATOM 481 CZ ARG A 31 -18.450 -3.337 -2.445 1.00 0.00 C ATOM 482 NH1 ARG A 31 -19.174 -3.229 -3.554 1.00 0.00 N ATOM 483 NH2 ARG A 31 -18.677 -4.347 -1.614 1.00 0.00 N ATOM 0 H ARG A 31 -12.366 -2.179 -4.344 1.00 0.00 H new ATOM 0 HA ARG A 31 -15.211 -1.660 -5.051 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -14.815 -2.489 -2.704 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -13.781 -1.099 -2.435 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -15.874 -0.414 -1.571 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -15.803 0.358 -3.143 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -17.994 -0.553 -2.970 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -17.128 -1.605 -4.072 1.00 0.00 H new ATOM 0 HE ARG A 31 -16.955 -2.556 -1.324 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -19.004 -2.459 -4.201 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -19.899 -3.916 -3.758 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -18.124 -4.441 -0.762 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -19.405 -5.029 -1.827 1.00 0.00 H new ATOM 497 N GLY A 32 -13.721 0.106 -6.294 1.00 0.00 N ATOM 498 CA GLY A 32 -13.372 1.379 -6.887 1.00 0.00 C ATOM 499 C GLY A 32 -11.887 1.660 -6.720 1.00 0.00 C ATOM 500 O GLY A 32 -11.094 0.793 -6.329 1.00 0.00 O ATOM 0 H GLY A 32 -13.851 -0.650 -6.967 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -13.630 1.375 -7.946 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -13.953 2.175 -6.420 1.00 0.00 H new ATOM 504 N ARG A 33 -11.482 2.879 -7.071 1.00 0.00 N ATOM 505 CA ARG A 33 -10.078 3.266 -7.080 1.00 0.00 C ATOM 506 C ARG A 33 -9.818 4.471 -6.206 1.00 0.00 C ATOM 507 O ARG A 33 -10.757 5.141 -5.790 1.00 0.00 O ATOM 508 CB ARG A 33 -9.602 3.454 -8.521 1.00 0.00 C ATOM 509 CG ARG A 33 -9.281 2.094 -9.152 1.00 0.00 C ATOM 510 CD ARG A 33 -9.120 2.192 -10.671 1.00 0.00 C ATOM 511 NE ARG A 33 -8.272 3.316 -11.111 1.00 0.00 N ATOM 512 CZ ARG A 33 -6.967 3.460 -10.869 1.00 0.00 C ATOM 513 NH1 ARG A 33 -6.309 2.571 -10.139 1.00 0.00 N ATOM 514 NH2 ARG A 33 -6.300 4.491 -11.354 1.00 0.00 N ATOM 0 H ARG A 33 -12.119 3.623 -7.356 1.00 0.00 H new ATOM 0 HA ARG A 33 -9.488 2.462 -6.641 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -10.372 3.961 -9.103 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -8.717 4.090 -8.540 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -8.364 1.699 -8.715 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -10.077 1.388 -8.916 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -8.693 1.260 -11.042 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -10.106 2.294 -11.125 1.00 0.00 H new ATOM 0 HE ARG A 33 -8.726 4.053 -11.651 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -6.800 1.764 -9.754 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -5.312 2.694 -9.962 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -6.782 5.189 -11.921 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -5.303 4.590 -11.162 1.00 0.00 H new ATOM 528 N GLY A 34 -8.544 4.783 -5.959 1.00 0.00 N ATOM 529 CA GLY A 34 -8.209 5.980 -5.216 1.00 0.00 C ATOM 530 C GLY A 34 -6.753 6.355 -5.295 1.00 0.00 C ATOM 531 O GLY A 34 -5.919 5.621 -5.823 1.00 0.00 O ATOM 0 H GLY A 34 -7.744 4.227 -6.261 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -8.809 6.809 -5.591 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -8.482 5.836 -4.171 1.00 0.00 H new ATOM 535 N CYS A 35 -6.443 7.516 -4.738 1.00 0.00 N ATOM 536 CA CYS A 35 -5.079 7.962 -4.552 1.00 0.00 C ATOM 537 C CYS A 35 -4.963 8.710 -3.231 1.00 0.00 C ATOM 538 O CYS A 35 -5.974 9.171 -2.708 1.00 0.00 O ATOM 539 CB CYS A 35 -4.666 8.823 -5.746 1.00 0.00 C ATOM 540 SG CYS A 35 -5.560 10.388 -5.842 1.00 0.00 S ATOM 0 H CYS A 35 -7.141 8.178 -4.401 1.00 0.00 H new ATOM 0 HA CYS A 35 -4.399 7.111 -4.504 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -3.597 9.027 -5.686 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -4.832 8.261 -6.665 1.00 0.00 H new ATOM 0 HG CYS A 35 -5.151 11.058 -6.878 1.00 0.00 H new ATOM 546 N THR A 36 -3.765 8.874 -2.678 1.00 0.00 N ATOM 547 CA THR A 36 -3.587 9.848 -1.612 1.00 0.00 C ATOM 548 C THR A 36 -3.555 11.223 -2.286 1.00 0.00 C ATOM 549 O THR A 36 -2.566 11.552 -2.933 1.00 0.00 O ATOM 550 CB THR A 36 -2.340 9.532 -0.767 1.00 0.00 C ATOM 551 OG1 THR A 36 -1.137 9.632 -1.497 1.00 0.00 O ATOM 552 CG2 THR A 36 -2.411 8.127 -0.151 1.00 0.00 C ATOM 0 H THR A 36 -2.925 8.359 -2.942 1.00 0.00 H new ATOM 0 HA THR A 36 -4.405 9.822 -0.892 1.00 0.00 H new ATOM 0 HB THR A 36 -2.336 10.287 0.019 1.00 0.00 H new ATOM 0 HG1 THR A 36 -0.746 10.521 -1.364 1.00 0.00 H new ATOM 0 HG21 THR A 36 -1.513 7.942 0.438 1.00 0.00 H new ATOM 0 HG22 THR A 36 -3.288 8.056 0.493 1.00 0.00 H new ATOM 0 HG23 THR A 36 -2.483 7.385 -0.946 1.00 0.00 H new ATOM 560 N VAL A 37 -4.626 12.015 -2.214 1.00 0.00 N ATOM 561 CA VAL A 37 -4.547 13.403 -2.679 1.00 0.00 C ATOM 562 C VAL A 37 -3.530 14.187 -1.849 1.00 0.00 C ATOM 563 O VAL A 37 -2.849 15.064 -2.376 1.00 0.00 O ATOM 564 CB VAL A 37 -5.924 14.092 -2.686 1.00 0.00 C ATOM 565 CG1 VAL A 37 -6.589 13.793 -4.033 1.00 0.00 C ATOM 566 CG2 VAL A 37 -6.822 13.698 -1.496 1.00 0.00 C ATOM 0 H VAL A 37 -5.535 11.731 -1.849 1.00 0.00 H new ATOM 0 HA VAL A 37 -4.205 13.387 -3.714 1.00 0.00 H new ATOM 0 HB VAL A 37 -5.778 15.165 -2.563 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -7.569 14.269 -4.069 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -5.967 14.181 -4.840 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -6.704 12.716 -4.151 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -7.774 14.223 -1.569 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -6.998 12.622 -1.514 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -6.329 13.970 -0.563 1.00 0.00 H new ATOM 576 N GLU A 38 -3.395 13.833 -0.570 1.00 0.00 N ATOM 577 CA GLU A 38 -2.303 14.292 0.263 1.00 0.00 C ATOM 578 C GLU A 38 -1.007 13.693 -0.285 1.00 0.00 C ATOM 579 O GLU A 38 -0.895 12.476 -0.481 1.00 0.00 O ATOM 580 CB GLU A 38 -2.577 13.923 1.735 1.00 0.00 C ATOM 581 CG GLU A 38 -2.527 15.142 2.666 1.00 0.00 C ATOM 582 CD GLU A 38 -3.556 15.081 3.798 1.00 0.00 C ATOM 583 OE1 GLU A 38 -3.376 14.247 4.718 1.00 0.00 O ATOM 584 OE2 GLU A 38 -4.509 15.904 3.792 1.00 0.00 O ATOM 0 H GLU A 38 -4.049 13.216 -0.088 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.206 15.377 0.239 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -3.557 13.451 1.812 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.843 13.188 2.065 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.528 15.222 3.096 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -2.695 16.046 2.080 1.00 0.00 H new ATOM 591 N SER A 39 -0.054 14.570 -0.581 1.00 0.00 N ATOM 592 CA SER A 39 1.247 14.245 -1.122 1.00 0.00 C ATOM 593 C SER A 39 2.045 13.525 -0.035 1.00 0.00 C ATOM 594 O SER A 39 2.112 14.041 1.083 1.00 0.00 O ATOM 595 CB SER A 39 1.957 15.547 -1.531 1.00 0.00 C ATOM 596 OG SER A 39 1.071 16.620 -1.828 1.00 0.00 O ATOM 0 H SER A 39 -0.180 15.572 -0.441 1.00 0.00 H new ATOM 0 HA SER A 39 1.157 13.603 -1.998 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.625 15.853 -0.726 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.579 15.351 -2.404 1.00 0.00 H new ATOM 0 HG SER A 39 1.590 17.413 -2.078 1.00 0.00 H new ATOM 602 N PHE A 40 2.676 12.387 -0.329 1.00 0.00 N ATOM 603 CA PHE A 40 3.406 11.646 0.695 1.00 0.00 C ATOM 604 C PHE A 40 4.703 11.103 0.070 1.00 0.00 C ATOM 605 O PHE A 40 4.794 10.918 -1.148 1.00 0.00 O ATOM 606 CB PHE A 40 2.553 10.460 1.148 1.00 0.00 C ATOM 607 CG PHE A 40 1.451 10.692 2.169 1.00 0.00 C ATOM 608 CD1 PHE A 40 1.703 11.049 3.502 1.00 0.00 C ATOM 609 CD2 PHE A 40 0.125 10.467 1.773 1.00 0.00 C ATOM 610 CE1 PHE A 40 0.644 11.147 4.429 1.00 0.00 C ATOM 611 CE2 PHE A 40 -0.933 10.544 2.688 1.00 0.00 C ATOM 612 CZ PHE A 40 -0.671 10.852 4.027 1.00 0.00 C ATOM 0 H PHE A 40 2.696 11.964 -1.257 1.00 0.00 H new ATOM 0 HA PHE A 40 3.630 12.294 1.542 1.00 0.00 H new ATOM 0 HB2 PHE A 40 2.093 10.027 0.260 1.00 0.00 H new ATOM 0 HB3 PHE A 40 3.227 9.707 1.557 1.00 0.00 H new ATOM 0 HD1 PHE A 40 2.715 11.250 3.821 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -0.085 10.229 0.741 1.00 0.00 H new ATOM 0 HE1 PHE A 40 0.843 11.448 5.447 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -1.947 10.366 2.361 1.00 0.00 H new ATOM 0 HZ PHE A 40 -1.475 10.863 4.749 1.00 0.00 H new ATOM 622 N PRO A 41 5.720 10.813 0.897 1.00 0.00 N ATOM 623 CA PRO A 41 6.947 10.131 0.520 1.00 0.00 C ATOM 624 C PRO A 41 6.618 8.684 0.221 1.00 0.00 C ATOM 625 O PRO A 41 6.366 7.888 1.130 1.00 0.00 O ATOM 626 CB PRO A 41 7.888 10.173 1.722 1.00 0.00 C ATOM 627 CG PRO A 41 6.904 10.379 2.862 1.00 0.00 C ATOM 628 CD PRO A 41 5.738 11.136 2.301 1.00 0.00 C ATOM 0 HA PRO A 41 7.404 10.602 -0.351 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.457 9.250 1.831 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.611 10.986 1.650 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.582 9.422 3.271 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.368 10.934 3.677 1.00 0.00 H new ATOM 0 HD2 PRO A 41 4.807 10.841 2.785 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.853 12.209 2.457 1.00 0.00 H new ATOM 636 N LEU A 42 6.665 8.345 -1.053 1.00 0.00 N ATOM 637 CA LEU A 42 6.524 6.987 -1.498 1.00 0.00 C ATOM 638 C LEU A 42 7.847 6.680 -2.173 1.00 0.00 C ATOM 639 O LEU A 42 8.132 7.173 -3.264 1.00 0.00 O ATOM 640 CB LEU A 42 5.232 6.907 -2.316 1.00 0.00 C ATOM 641 CG LEU A 42 4.708 5.513 -2.669 1.00 0.00 C ATOM 642 CD1 LEU A 42 5.572 4.818 -3.717 1.00 0.00 C ATOM 643 CD2 LEU A 42 4.404 4.654 -1.423 1.00 0.00 C ATOM 0 H LEU A 42 6.804 9.016 -1.809 1.00 0.00 H new ATOM 0 HA LEU A 42 6.382 6.211 -0.746 1.00 0.00 H new ATOM 0 HB2 LEU A 42 4.451 7.431 -1.765 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.387 7.454 -3.246 1.00 0.00 H new ATOM 0 HG LEU A 42 3.738 5.651 -3.147 1.00 0.00 H new ATOM 0 HD11 LEU A 42 5.159 3.833 -3.934 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.587 5.414 -4.630 1.00 0.00 H new ATOM 0 HD13 LEU A 42 6.588 4.710 -3.338 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.036 3.677 -1.736 1.00 0.00 H new ATOM 0 HD22 LEU A 42 5.314 4.528 -0.837 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.647 5.150 -0.815 1.00 0.00 H new ATOM 655 N VAL A 43 8.700 5.999 -1.412 1.00 0.00 N ATOM 656 CA VAL A 43 10.106 5.786 -1.678 1.00 0.00 C ATOM 657 C VAL A 43 10.426 4.319 -1.476 1.00 0.00 C ATOM 658 O VAL A 43 9.913 3.664 -0.566 1.00 0.00 O ATOM 659 CB VAL A 43 10.959 6.678 -0.735 1.00 0.00 C ATOM 660 CG1 VAL A 43 10.887 8.161 -1.118 1.00 0.00 C ATOM 661 CG2 VAL A 43 10.564 6.572 0.758 1.00 0.00 C ATOM 0 H VAL A 43 8.402 5.557 -0.542 1.00 0.00 H new ATOM 0 HA VAL A 43 10.341 6.061 -2.706 1.00 0.00 H new ATOM 0 HB VAL A 43 11.971 6.293 -0.863 1.00 0.00 H new ATOM 0 HG11 VAL A 43 11.499 8.745 -0.430 1.00 0.00 H new ATOM 0 HG12 VAL A 43 11.258 8.293 -2.135 1.00 0.00 H new ATOM 0 HG13 VAL A 43 9.853 8.502 -1.062 1.00 0.00 H new ATOM 0 HG21 VAL A 43 11.205 7.224 1.351 1.00 0.00 H new ATOM 0 HG22 VAL A 43 9.524 6.875 0.882 1.00 0.00 H new ATOM 0 HG23 VAL A 43 10.684 5.542 1.094 1.00 0.00 H new ATOM 671 N ILE A 44 11.286 3.807 -2.347 1.00 0.00 N ATOM 672 CA ILE A 44 11.574 2.396 -2.426 1.00 0.00 C ATOM 673 C ILE A 44 12.991 2.199 -1.909 1.00 0.00 C ATOM 674 O ILE A 44 13.953 2.793 -2.405 1.00 0.00 O ATOM 675 CB ILE A 44 11.284 1.878 -3.846 1.00 0.00 C ATOM 676 CG1 ILE A 44 9.776 1.996 -4.189 1.00 0.00 C ATOM 677 CG2 ILE A 44 11.680 0.388 -3.899 1.00 0.00 C ATOM 678 CD1 ILE A 44 9.194 3.297 -4.748 1.00 0.00 C ATOM 0 H ILE A 44 11.804 4.371 -3.021 1.00 0.00 H new ATOM 0 HA ILE A 44 10.926 1.785 -1.797 1.00 0.00 H new ATOM 0 HB ILE A 44 11.850 2.472 -4.563 1.00 0.00 H new ATOM 0 HG12 ILE A 44 9.550 1.210 -4.909 1.00 0.00 H new ATOM 0 HG13 ILE A 44 9.223 1.764 -3.279 1.00 0.00 H new ATOM 0 HG21 ILE A 44 11.484 -0.005 -4.897 1.00 0.00 H new ATOM 0 HG22 ILE A 44 12.741 0.285 -3.670 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.095 -0.170 -3.168 1.00 0.00 H new ATOM 0 HD11 ILE A 44 8.125 3.173 -4.921 1.00 0.00 H new ATOM 0 HD12 ILE A 44 9.355 4.104 -4.033 1.00 0.00 H new ATOM 0 HD13 ILE A 44 9.687 3.542 -5.689 1.00 0.00 H new ATOM 690 N ALA A 45 13.093 1.384 -0.866 1.00 0.00 N ATOM 691 CA ALA A 45 14.301 1.146 -0.106 1.00 0.00 C ATOM 692 C ALA A 45 14.363 -0.333 0.264 1.00 0.00 C ATOM 693 O ALA A 45 13.581 -1.145 -0.239 1.00 0.00 O ATOM 694 CB ALA A 45 14.282 2.072 1.111 1.00 0.00 C ATOM 0 H ALA A 45 12.297 0.850 -0.516 1.00 0.00 H new ATOM 0 HA ALA A 45 15.201 1.368 -0.679 1.00 0.00 H new ATOM 0 HB1 ALA A 45 15.183 1.913 1.703 1.00 0.00 H new ATOM 0 HB2 ALA A 45 14.244 3.109 0.778 1.00 0.00 H new ATOM 0 HB3 ALA A 45 13.405 1.854 1.720 1.00 0.00 H new ATOM 700 N GLY A 46 15.304 -0.680 1.134 1.00 0.00 N ATOM 701 CA GLY A 46 15.599 -2.045 1.517 1.00 0.00 C ATOM 702 C GLY A 46 16.248 -2.816 0.361 1.00 0.00 C ATOM 703 O GLY A 46 16.177 -2.431 -0.808 1.00 0.00 O ATOM 0 H GLY A 46 15.897 0.005 1.603 1.00 0.00 H new ATOM 0 HA2 GLY A 46 16.266 -2.048 2.379 1.00 0.00 H new ATOM 0 HA3 GLY A 46 14.681 -2.547 1.822 1.00 0.00 H new ATOM 707 N GLU A 47 16.852 -3.956 0.677 1.00 0.00 N ATOM 708 CA GLU A 47 17.663 -4.750 -0.246 1.00 0.00 C ATOM 709 C GLU A 47 16.827 -5.593 -1.215 1.00 0.00 C ATOM 710 O GLU A 47 17.377 -6.360 -2.013 1.00 0.00 O ATOM 711 CB GLU A 47 18.585 -5.606 0.630 1.00 0.00 C ATOM 712 CG GLU A 47 19.845 -6.133 -0.053 1.00 0.00 C ATOM 713 CD GLU A 47 20.755 -6.808 0.974 1.00 0.00 C ATOM 714 OE1 GLU A 47 21.191 -6.145 1.944 1.00 0.00 O ATOM 715 OE2 GLU A 47 20.970 -8.035 0.850 1.00 0.00 O ATOM 0 H GLU A 47 16.791 -4.367 1.608 1.00 0.00 H new ATOM 0 HA GLU A 47 18.238 -4.098 -0.903 1.00 0.00 H new ATOM 0 HB2 GLU A 47 18.883 -5.016 1.497 1.00 0.00 H new ATOM 0 HB3 GLU A 47 18.014 -6.456 1.004 1.00 0.00 H new ATOM 0 HG2 GLU A 47 19.575 -6.844 -0.834 1.00 0.00 H new ATOM 0 HG3 GLU A 47 20.375 -5.313 -0.538 1.00 0.00 H new ATOM 722 N HIS A 48 15.502 -5.462 -1.142 1.00 0.00 N ATOM 723 CA HIS A 48 14.546 -6.296 -1.848 1.00 0.00 C ATOM 724 C HIS A 48 13.460 -5.469 -2.565 1.00 0.00 C ATOM 725 O HIS A 48 12.428 -6.021 -2.944 1.00 0.00 O ATOM 726 CB HIS A 48 13.986 -7.328 -0.849 1.00 0.00 C ATOM 727 CG HIS A 48 14.835 -8.566 -0.735 1.00 0.00 C ATOM 728 ND1 HIS A 48 14.914 -9.569 -1.671 1.00 0.00 N ATOM 729 CD2 HIS A 48 15.616 -8.931 0.326 1.00 0.00 C ATOM 730 CE1 HIS A 48 15.753 -10.503 -1.207 1.00 0.00 C ATOM 731 NE2 HIS A 48 16.196 -10.172 0.020 1.00 0.00 N ATOM 0 H HIS A 48 15.056 -4.746 -0.568 1.00 0.00 H new ATOM 0 HA HIS A 48 15.041 -6.831 -2.659 1.00 0.00 H new ATOM 0 HB2 HIS A 48 13.900 -6.863 0.133 1.00 0.00 H new ATOM 0 HB3 HIS A 48 12.980 -7.613 -1.157 1.00 0.00 H new ATOM 0 HD1 HIS A 48 14.420 -9.597 -2.563 1.00 0.00 H new ATOM 0 HD2 HIS A 48 15.761 -8.366 1.235 1.00 0.00 H new ATOM 0 HE1 HIS A 48 16.035 -11.397 -1.743 1.00 0.00 H new ATOM 739 N ASN A 49 13.685 -4.160 -2.769 1.00 0.00 N ATOM 740 CA ASN A 49 12.756 -3.201 -3.391 1.00 0.00 C ATOM 741 C ASN A 49 11.424 -3.168 -2.651 1.00 0.00 C ATOM 742 O ASN A 49 10.393 -3.632 -3.139 1.00 0.00 O ATOM 743 CB ASN A 49 12.566 -3.463 -4.894 1.00 0.00 C ATOM 744 CG ASN A 49 13.768 -3.050 -5.717 1.00 0.00 C ATOM 745 OD1 ASN A 49 14.472 -3.880 -6.273 1.00 0.00 O ATOM 746 ND2 ASN A 49 14.035 -1.762 -5.804 1.00 0.00 N ATOM 0 H ASN A 49 14.562 -3.720 -2.491 1.00 0.00 H new ATOM 0 HA ASN A 49 13.209 -2.213 -3.305 1.00 0.00 H new ATOM 0 HB2 ASN A 49 12.370 -4.524 -5.052 1.00 0.00 H new ATOM 0 HB3 ASN A 49 11.688 -2.921 -5.245 1.00 0.00 H new ATOM 0 HD21 ASN A 49 14.841 -1.443 -6.342 1.00 0.00 H new ATOM 0 HD22 ASN A 49 13.436 -1.084 -5.333 1.00 0.00 H new ATOM 753 N ILE A 50 11.468 -2.567 -1.472 1.00 0.00 N ATOM 754 CA ILE A 50 10.467 -2.530 -0.422 1.00 0.00 C ATOM 755 C ILE A 50 9.918 -1.097 -0.358 1.00 0.00 C ATOM 756 O ILE A 50 10.621 -0.236 0.170 1.00 0.00 O ATOM 757 CB ILE A 50 11.030 -3.084 0.909 1.00 0.00 C ATOM 758 CG1 ILE A 50 11.448 -4.563 0.724 1.00 0.00 C ATOM 759 CG2 ILE A 50 9.949 -2.999 1.996 1.00 0.00 C ATOM 760 CD1 ILE A 50 12.202 -5.166 1.912 1.00 0.00 C ATOM 0 H ILE A 50 12.296 -2.037 -1.201 1.00 0.00 H new ATOM 0 HA ILE A 50 9.628 -3.192 -0.637 1.00 0.00 H new ATOM 0 HB ILE A 50 11.898 -2.494 1.204 1.00 0.00 H new ATOM 0 HG12 ILE A 50 10.554 -5.159 0.538 1.00 0.00 H new ATOM 0 HG13 ILE A 50 12.074 -4.641 -0.165 1.00 0.00 H new ATOM 0 HG21 ILE A 50 10.345 -3.389 2.934 1.00 0.00 H new ATOM 0 HG22 ILE A 50 9.651 -1.959 2.132 1.00 0.00 H new ATOM 0 HG23 ILE A 50 9.083 -3.588 1.695 1.00 0.00 H new ATOM 0 HD11 ILE A 50 12.454 -6.204 1.694 1.00 0.00 H new ATOM 0 HD12 ILE A 50 13.116 -4.599 2.088 1.00 0.00 H new ATOM 0 HD13 ILE A 50 11.573 -5.125 2.801 1.00 0.00 H new ATOM 772 N PRO A 51 8.860 -0.728 -1.106 1.00 0.00 N ATOM 773 CA PRO A 51 8.221 0.573 -0.926 1.00 0.00 C ATOM 774 C PRO A 51 7.835 0.824 0.537 1.00 0.00 C ATOM 775 O PRO A 51 7.205 -0.015 1.186 1.00 0.00 O ATOM 776 CB PRO A 51 6.987 0.583 -1.839 1.00 0.00 C ATOM 777 CG PRO A 51 6.693 -0.885 -2.074 1.00 0.00 C ATOM 778 CD PRO A 51 8.052 -1.571 -1.974 1.00 0.00 C ATOM 0 HA PRO A 51 8.910 1.376 -1.189 1.00 0.00 H new ATOM 0 HB2 PRO A 51 6.145 1.088 -1.366 1.00 0.00 H new ATOM 0 HB3 PRO A 51 7.187 1.105 -2.775 1.00 0.00 H new ATOM 0 HG2 PRO A 51 5.997 -1.274 -1.331 1.00 0.00 H new ATOM 0 HG3 PRO A 51 6.238 -1.047 -3.051 1.00 0.00 H new ATOM 0 HD2 PRO A 51 7.953 -2.575 -1.562 1.00 0.00 H new ATOM 0 HD3 PRO A 51 8.511 -1.673 -2.957 1.00 0.00 H new ATOM 786 N TRP A 52 8.146 2.020 1.030 1.00 0.00 N ATOM 787 CA TRP A 52 7.713 2.532 2.317 1.00 0.00 C ATOM 788 C TRP A 52 6.878 3.773 2.052 1.00 0.00 C ATOM 789 O TRP A 52 7.211 4.598 1.193 1.00 0.00 O ATOM 790 CB TRP A 52 8.908 2.839 3.220 1.00 0.00 C ATOM 791 CG TRP A 52 9.808 1.675 3.461 1.00 0.00 C ATOM 792 CD1 TRP A 52 10.804 1.286 2.640 1.00 0.00 C ATOM 793 CD2 TRP A 52 9.770 0.694 4.536 1.00 0.00 C ATOM 794 NE1 TRP A 52 11.373 0.125 3.118 1.00 0.00 N ATOM 795 CE2 TRP A 52 10.767 -0.290 4.282 1.00 0.00 C ATOM 796 CE3 TRP A 52 8.993 0.534 5.700 1.00 0.00 C ATOM 797 CZ2 TRP A 52 10.969 -1.382 5.132 1.00 0.00 C ATOM 798 CZ3 TRP A 52 9.178 -0.566 6.553 1.00 0.00 C ATOM 799 CH2 TRP A 52 10.163 -1.532 6.268 1.00 0.00 C ATOM 0 H TRP A 52 8.730 2.682 0.519 1.00 0.00 H new ATOM 0 HA TRP A 52 7.118 1.786 2.845 1.00 0.00 H new ATOM 0 HB2 TRP A 52 9.489 3.646 2.773 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.540 3.204 4.179 1.00 0.00 H new ATOM 0 HD1 TRP A 52 11.110 1.805 1.744 1.00 0.00 H new ATOM 0 HE1 TRP A 52 12.145 -0.365 2.666 1.00 0.00 H new ATOM 0 HE3 TRP A 52 8.241 1.271 5.941 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 11.741 -2.105 4.914 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 8.561 -0.672 7.433 1.00 0.00 H new ATOM 0 HH2 TRP A 52 10.296 -2.382 6.921 1.00 0.00 H new ATOM 810 N LEU A 53 5.773 3.897 2.777 1.00 0.00 N ATOM 811 CA LEU A 53 4.939 5.078 2.801 1.00 0.00 C ATOM 812 C LEU A 53 5.162 5.729 4.142 1.00 0.00 C ATOM 813 O LEU A 53 4.607 5.329 5.166 1.00 0.00 O ATOM 814 CB LEU A 53 3.465 4.749 2.525 1.00 0.00 C ATOM 815 CG LEU A 53 2.639 5.834 1.826 1.00 0.00 C ATOM 816 CD1 LEU A 53 1.180 5.673 2.235 1.00 0.00 C ATOM 817 CD2 LEU A 53 3.031 7.275 2.045 1.00 0.00 C ATOM 0 H LEU A 53 5.427 3.151 3.381 1.00 0.00 H new ATOM 0 HA LEU A 53 5.210 5.768 2.002 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.426 3.846 1.916 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.985 4.514 3.475 1.00 0.00 H new ATOM 0 HG LEU A 53 2.832 5.662 0.767 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.578 6.439 1.745 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.825 4.687 1.936 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.091 5.778 3.316 1.00 0.00 H new ATOM 0 HD21 LEU A 53 2.356 7.924 1.487 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.968 7.512 3.107 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.053 7.431 1.699 1.00 0.00 H new ATOM 829 N LEU A 54 6.080 6.679 4.140 1.00 0.00 N ATOM 830 CA LEU A 54 6.457 7.343 5.373 1.00 0.00 C ATOM 831 C LEU A 54 5.317 8.316 5.689 1.00 0.00 C ATOM 832 O LEU A 54 4.726 8.902 4.775 1.00 0.00 O ATOM 833 CB LEU A 54 7.808 8.062 5.249 1.00 0.00 C ATOM 834 CG LEU A 54 8.864 7.513 4.270 1.00 0.00 C ATOM 835 CD1 LEU A 54 10.109 8.410 4.297 1.00 0.00 C ATOM 836 CD2 LEU A 54 9.268 6.078 4.576 1.00 0.00 C ATOM 0 H LEU A 54 6.573 7.005 3.308 1.00 0.00 H new ATOM 0 HA LEU A 54 6.595 6.624 6.180 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.605 9.095 4.967 1.00 0.00 H new ATOM 0 HB3 LEU A 54 8.260 8.085 6.241 1.00 0.00 H new ATOM 0 HG LEU A 54 8.410 7.516 3.279 1.00 0.00 H new ATOM 0 HD11 LEU A 54 10.854 8.019 3.604 1.00 0.00 H new ATOM 0 HD12 LEU A 54 9.834 9.423 4.002 1.00 0.00 H new ATOM 0 HD13 LEU A 54 10.524 8.426 5.305 1.00 0.00 H new ATOM 0 HD21 LEU A 54 10.014 5.748 3.853 1.00 0.00 H new ATOM 0 HD22 LEU A 54 9.688 6.025 5.580 1.00 0.00 H new ATOM 0 HD23 LEU A 54 8.392 5.432 4.514 1.00 0.00 H new ATOM 848 N TYR A 55 4.989 8.498 6.964 1.00 0.00 N ATOM 849 CA TYR A 55 3.848 9.329 7.338 1.00 0.00 C ATOM 850 C TYR A 55 4.225 10.818 7.281 1.00 0.00 C ATOM 851 O TYR A 55 4.460 11.450 8.313 1.00 0.00 O ATOM 852 CB TYR A 55 3.289 8.876 8.696 1.00 0.00 C ATOM 853 CG TYR A 55 1.886 9.393 8.984 1.00 0.00 C ATOM 854 CD1 TYR A 55 0.817 9.055 8.131 1.00 0.00 C ATOM 855 CD2 TYR A 55 1.626 10.170 10.125 1.00 0.00 C ATOM 856 CE1 TYR A 55 -0.508 9.391 8.465 1.00 0.00 C ATOM 857 CE2 TYR A 55 0.308 10.542 10.451 1.00 0.00 C ATOM 858 CZ TYR A 55 -0.774 10.101 9.656 1.00 0.00 C ATOM 859 OH TYR A 55 -2.065 10.368 10.000 1.00 0.00 O ATOM 0 H TYR A 55 5.491 8.086 7.750 1.00 0.00 H new ATOM 0 HA TYR A 55 3.040 9.201 6.618 1.00 0.00 H new ATOM 0 HB2 TYR A 55 3.279 7.787 8.730 1.00 0.00 H new ATOM 0 HB3 TYR A 55 3.960 9.213 9.486 1.00 0.00 H new ATOM 0 HD1 TYR A 55 1.017 8.531 7.208 1.00 0.00 H new ATOM 0 HD2 TYR A 55 2.443 10.484 10.757 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -1.320 9.106 7.812 1.00 0.00 H new ATOM 0 HE2 TYR A 55 0.123 11.167 11.312 1.00 0.00 H new ATOM 0 HH TYR A 55 -2.083 10.862 10.846 1.00 0.00 H new ATOM 869 N LEU A 56 4.315 11.390 6.073 1.00 0.00 N ATOM 870 CA LEU A 56 4.731 12.781 5.859 1.00 0.00 C ATOM 871 C LEU A 56 3.764 13.471 4.894 1.00 0.00 C ATOM 872 O LEU A 56 4.035 13.498 3.692 1.00 0.00 O ATOM 873 CB LEU A 56 6.200 12.867 5.383 1.00 0.00 C ATOM 874 CG LEU A 56 7.043 13.985 6.006 1.00 0.00 C ATOM 875 CD1 LEU A 56 6.324 15.332 6.033 1.00 0.00 C ATOM 876 CD2 LEU A 56 7.501 13.590 7.405 1.00 0.00 C ATOM 0 H LEU A 56 4.099 10.894 5.208 1.00 0.00 H new ATOM 0 HA LEU A 56 4.690 13.311 6.811 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.685 11.914 5.592 1.00 0.00 H new ATOM 0 HB3 LEU A 56 6.204 12.996 4.301 1.00 0.00 H new ATOM 0 HG LEU A 56 7.915 14.114 5.365 1.00 0.00 H new ATOM 0 HD11 LEU A 56 6.973 16.082 6.486 1.00 0.00 H new ATOM 0 HD12 LEU A 56 6.077 15.633 5.015 1.00 0.00 H new ATOM 0 HD13 LEU A 56 5.408 15.244 6.618 1.00 0.00 H new ATOM 0 HD21 LEU A 56 8.098 14.395 7.833 1.00 0.00 H new ATOM 0 HD22 LEU A 56 6.630 13.410 8.035 1.00 0.00 H new ATOM 0 HD23 LEU A 56 8.102 12.683 7.348 1.00 0.00 H new ATOM 888 N PRO A 57 2.621 13.986 5.368 1.00 0.00 N ATOM 889 CA PRO A 57 1.686 14.681 4.498 1.00 0.00 C ATOM 890 C PRO A 57 2.366 15.937 3.945 1.00 0.00 C ATOM 891 O PRO A 57 3.228 16.548 4.592 1.00 0.00 O ATOM 892 CB PRO A 57 0.467 14.986 5.372 1.00 0.00 C ATOM 893 CG PRO A 57 1.057 15.087 6.777 1.00 0.00 C ATOM 894 CD PRO A 57 2.202 14.075 6.757 1.00 0.00 C ATOM 0 HA PRO A 57 1.374 14.100 3.630 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -0.020 15.914 5.073 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -0.282 14.197 5.306 1.00 0.00 H new ATOM 0 HG2 PRO A 57 1.415 16.094 6.990 1.00 0.00 H new ATOM 0 HG3 PRO A 57 0.319 14.843 7.541 1.00 0.00 H new ATOM 0 HD2 PRO A 57 3.024 14.401 7.394 1.00 0.00 H new ATOM 0 HD3 PRO A 57 1.874 13.105 7.130 1.00 0.00 H new ATOM 902 N GLY A 58 1.985 16.326 2.734 1.00 0.00 N ATOM 903 CA GLY A 58 2.508 17.509 2.078 1.00 0.00 C ATOM 904 C GLY A 58 3.935 17.377 1.559 1.00 0.00 C ATOM 905 O GLY A 58 4.445 18.366 1.033 1.00 0.00 O ATOM 0 H GLY A 58 1.296 15.820 2.177 1.00 0.00 H new ATOM 0 HA2 GLY A 58 1.855 17.762 1.243 1.00 0.00 H new ATOM 0 HA3 GLY A 58 2.467 18.343 2.779 1.00 0.00 H new ATOM 909 N LYS A 59 4.621 16.231 1.666 1.00 0.00 N ATOM 910 CA LYS A 59 5.956 16.084 1.120 1.00 0.00 C ATOM 911 C LYS A 59 5.909 14.880 0.200 1.00 0.00 C ATOM 912 O LYS A 59 5.625 13.793 0.680 1.00 0.00 O ATOM 913 CB LYS A 59 6.917 15.896 2.301 1.00 0.00 C ATOM 914 CG LYS A 59 8.377 15.976 1.851 1.00 0.00 C ATOM 915 CD LYS A 59 8.992 17.374 1.913 1.00 0.00 C ATOM 916 CE LYS A 59 9.158 17.762 3.383 1.00 0.00 C ATOM 917 NZ LYS A 59 9.696 19.121 3.539 1.00 0.00 N ATOM 0 H LYS A 59 4.263 15.396 2.129 1.00 0.00 H new ATOM 0 HA LYS A 59 6.300 16.946 0.549 1.00 0.00 H new ATOM 0 HB2 LYS A 59 6.724 16.660 3.054 1.00 0.00 H new ATOM 0 HB3 LYS A 59 6.732 14.931 2.772 1.00 0.00 H new ATOM 0 HG2 LYS A 59 8.971 15.305 2.472 1.00 0.00 H new ATOM 0 HG3 LYS A 59 8.447 15.609 0.827 1.00 0.00 H new ATOM 0 HD2 LYS A 59 9.957 17.387 1.406 1.00 0.00 H new ATOM 0 HD3 LYS A 59 8.353 18.093 1.401 1.00 0.00 H new ATOM 0 HE2 LYS A 59 8.194 17.694 3.886 1.00 0.00 H new ATOM 0 HE3 LYS A 59 9.823 17.051 3.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 9.792 19.342 4.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 10.628 19.180 3.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 9.049 19.804 3.095 1.00 0.00 H new ATOM 931 N GLY A 60 6.229 14.997 -1.083 1.00 0.00 N ATOM 932 CA GLY A 60 6.133 13.889 -2.028 1.00 0.00 C ATOM 933 C GLY A 60 4.976 14.097 -2.984 1.00 0.00 C ATOM 934 O GLY A 60 4.724 15.239 -3.370 1.00 0.00 O ATOM 0 H GLY A 60 6.564 15.866 -1.500 1.00 0.00 H new ATOM 0 HA2 GLY A 60 7.063 13.802 -2.589 1.00 0.00 H new ATOM 0 HA3 GLY A 60 5.999 12.953 -1.486 1.00 0.00 H new ATOM 938 N HIS A 61 4.329 13.016 -3.421 1.00 0.00 N ATOM 939 CA HIS A 61 3.359 13.032 -4.514 1.00 0.00 C ATOM 940 C HIS A 61 2.143 12.175 -4.154 1.00 0.00 C ATOM 941 O HIS A 61 2.128 11.525 -3.106 1.00 0.00 O ATOM 942 CB HIS A 61 4.022 12.524 -5.805 1.00 0.00 C ATOM 943 CG HIS A 61 5.324 13.195 -6.175 1.00 0.00 C ATOM 944 ND1 HIS A 61 5.629 14.538 -6.072 1.00 0.00 N ATOM 945 CD2 HIS A 61 6.422 12.563 -6.688 1.00 0.00 C ATOM 946 CE1 HIS A 61 6.885 14.710 -6.506 1.00 0.00 C ATOM 947 NE2 HIS A 61 7.400 13.537 -6.914 1.00 0.00 N ATOM 0 H HIS A 61 4.467 12.089 -3.018 1.00 0.00 H new ATOM 0 HA HIS A 61 3.018 14.054 -4.677 1.00 0.00 H new ATOM 0 HB2 HIS A 61 4.201 11.454 -5.704 1.00 0.00 H new ATOM 0 HB3 HIS A 61 3.320 12.653 -6.629 1.00 0.00 H new ATOM 0 HD1 HIS A 61 5.008 15.270 -5.727 1.00 0.00 H new ATOM 0 HD2 HIS A 61 6.517 11.505 -6.883 1.00 0.00 H new ATOM 0 HE1 HIS A 61 7.408 15.655 -6.525 1.00 0.00 H new ATOM 955 N CYS A 62 1.116 12.193 -5.006 1.00 0.00 N ATOM 956 CA CYS A 62 -0.117 11.451 -4.793 1.00 0.00 C ATOM 957 C CYS A 62 0.086 9.979 -5.139 1.00 0.00 C ATOM 958 O CYS A 62 0.307 9.641 -6.299 1.00 0.00 O ATOM 959 CB CYS A 62 -1.247 12.040 -5.648 1.00 0.00 C ATOM 960 SG CYS A 62 -1.456 13.807 -5.281 1.00 0.00 S ATOM 0 H CYS A 62 1.123 12.731 -5.872 1.00 0.00 H new ATOM 0 HA CYS A 62 -0.393 11.531 -3.742 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -1.021 11.905 -6.706 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -2.177 11.508 -5.451 1.00 0.00 H new ATOM 0 HG CYS A 62 -2.011 13.945 -4.113 1.00 0.00 H new ATOM 966 N VAL A 63 0.013 9.105 -4.143 1.00 0.00 N ATOM 967 CA VAL A 63 0.223 7.679 -4.294 1.00 0.00 C ATOM 968 C VAL A 63 -1.048 7.065 -4.889 1.00 0.00 C ATOM 969 O VAL A 63 -2.086 7.066 -4.229 1.00 0.00 O ATOM 970 CB VAL A 63 0.614 7.090 -2.927 1.00 0.00 C ATOM 971 CG1 VAL A 63 0.979 5.611 -3.058 1.00 0.00 C ATOM 972 CG2 VAL A 63 1.804 7.844 -2.309 1.00 0.00 C ATOM 0 H VAL A 63 -0.200 9.380 -3.184 1.00 0.00 H new ATOM 0 HA VAL A 63 1.040 7.452 -4.979 1.00 0.00 H new ATOM 0 HB VAL A 63 -0.252 7.198 -2.274 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.252 5.216 -2.080 1.00 0.00 H new ATOM 0 HG12 VAL A 63 0.124 5.058 -3.447 1.00 0.00 H new ATOM 0 HG13 VAL A 63 1.822 5.503 -3.741 1.00 0.00 H new ATOM 0 HG21 VAL A 63 2.054 7.402 -1.344 1.00 0.00 H new ATOM 0 HG22 VAL A 63 2.665 7.773 -2.974 1.00 0.00 H new ATOM 0 HG23 VAL A 63 1.538 8.892 -2.170 1.00 0.00 H new ATOM 982 N THR A 64 -1.018 6.587 -6.136 1.00 0.00 N ATOM 983 CA THR A 64 -2.207 6.117 -6.845 1.00 0.00 C ATOM 984 C THR A 64 -2.413 4.609 -6.671 1.00 0.00 C ATOM 985 O THR A 64 -1.451 3.844 -6.526 1.00 0.00 O ATOM 986 CB THR A 64 -2.157 6.556 -8.321 1.00 0.00 C ATOM 987 OG1 THR A 64 -1.114 5.968 -9.079 1.00 0.00 O ATOM 988 CG2 THR A 64 -1.947 8.058 -8.437 1.00 0.00 C ATOM 0 H THR A 64 -0.161 6.516 -6.684 1.00 0.00 H new ATOM 0 HA THR A 64 -3.086 6.584 -6.401 1.00 0.00 H new ATOM 0 HB THR A 64 -3.118 6.228 -8.717 1.00 0.00 H new ATOM 0 HG1 THR A 64 -1.154 6.297 -10.001 1.00 0.00 H new ATOM 0 HG21 THR A 64 -1.916 8.341 -9.489 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.768 8.579 -7.946 1.00 0.00 H new ATOM 0 HG23 THR A 64 -1.006 8.332 -7.959 1.00 0.00 H new ATOM 996 N GLY A 65 -3.666 4.146 -6.725 1.00 0.00 N ATOM 997 CA GLY A 65 -4.030 2.829 -6.237 1.00 0.00 C ATOM 998 C GLY A 65 -5.493 2.500 -6.419 1.00 0.00 C ATOM 999 O GLY A 65 -6.208 3.135 -7.198 1.00 0.00 O ATOM 0 H GLY A 65 -4.447 4.678 -7.108 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -3.431 2.080 -6.755 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -3.780 2.761 -5.178 1.00 0.00 H new ATOM 1003 N GLU A 66 -5.921 1.472 -5.696 1.00 0.00 N ATOM 1004 CA GLU A 66 -7.287 0.997 -5.731 1.00 0.00 C ATOM 1005 C GLU A 66 -7.851 1.096 -4.309 1.00 0.00 C ATOM 1006 O GLU A 66 -7.105 1.423 -3.385 1.00 0.00 O ATOM 1007 CB GLU A 66 -7.342 -0.405 -6.342 1.00 0.00 C ATOM 1008 CG GLU A 66 -7.381 -1.602 -5.414 1.00 0.00 C ATOM 1009 CD GLU A 66 -7.776 -2.795 -6.262 1.00 0.00 C ATOM 1010 OE1 GLU A 66 -6.916 -3.254 -7.060 1.00 0.00 O ATOM 1011 OE2 GLU A 66 -8.910 -3.269 -6.063 1.00 0.00 O ATOM 0 H GLU A 66 -5.319 0.944 -5.065 1.00 0.00 H new ATOM 0 HA GLU A 66 -7.918 1.608 -6.376 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -8.224 -0.453 -6.980 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -6.473 -0.517 -6.990 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.409 -1.763 -4.948 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -8.098 -1.445 -4.609 1.00 0.00 H new ATOM 1018 N ILE A 67 -9.118 0.767 -4.076 1.00 0.00 N ATOM 1019 CA ILE A 67 -9.685 0.614 -2.741 1.00 0.00 C ATOM 1020 C ILE A 67 -10.224 -0.820 -2.665 1.00 0.00 C ATOM 1021 O ILE A 67 -11.138 -1.157 -3.411 1.00 0.00 O ATOM 1022 CB ILE A 67 -10.785 1.680 -2.542 1.00 0.00 C ATOM 1023 CG1 ILE A 67 -10.211 3.108 -2.676 1.00 0.00 C ATOM 1024 CG2 ILE A 67 -11.497 1.465 -1.192 1.00 0.00 C ATOM 1025 CD1 ILE A 67 -11.292 4.192 -2.713 1.00 0.00 C ATOM 0 H ILE A 67 -9.791 0.596 -4.823 1.00 0.00 H new ATOM 0 HA ILE A 67 -8.956 0.765 -1.945 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.528 1.567 -3.331 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -9.539 3.302 -1.840 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -9.614 3.169 -3.586 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -12.270 2.223 -1.064 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -11.953 0.475 -1.175 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -10.772 1.545 -0.382 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -10.822 5.171 -2.808 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -11.950 4.021 -3.565 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -11.874 4.157 -1.792 1.00 0.00 H new ATOM 1037 N TYR A 68 -9.670 -1.678 -1.799 1.00 0.00 N ATOM 1038 CA TYR A 68 -10.308 -2.961 -1.504 1.00 0.00 C ATOM 1039 C TYR A 68 -11.263 -2.770 -0.329 1.00 0.00 C ATOM 1040 O TYR A 68 -10.884 -2.215 0.707 1.00 0.00 O ATOM 1041 CB TYR A 68 -9.296 -4.082 -1.216 1.00 0.00 C ATOM 1042 CG TYR A 68 -8.585 -4.585 -2.455 1.00 0.00 C ATOM 1043 CD1 TYR A 68 -9.239 -5.504 -3.296 1.00 0.00 C ATOM 1044 CD2 TYR A 68 -7.318 -4.085 -2.811 1.00 0.00 C ATOM 1045 CE1 TYR A 68 -8.632 -5.924 -4.490 1.00 0.00 C ATOM 1046 CE2 TYR A 68 -6.728 -4.464 -4.030 1.00 0.00 C ATOM 1047 CZ TYR A 68 -7.372 -5.415 -4.859 1.00 0.00 C ATOM 1048 OH TYR A 68 -6.866 -5.714 -6.085 1.00 0.00 O ATOM 0 H TYR A 68 -8.797 -1.509 -1.300 1.00 0.00 H new ATOM 0 HA TYR A 68 -10.857 -3.281 -2.390 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -8.555 -3.718 -0.504 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -9.814 -4.915 -0.740 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -10.211 -5.887 -3.022 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -6.799 -3.410 -2.147 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -9.132 -6.639 -5.127 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -5.786 -4.031 -4.333 1.00 0.00 H new ATOM 0 HH TYR A 68 -6.502 -4.902 -6.496 1.00 0.00 H new ATOM 1058 N GLU A 69 -12.496 -3.248 -0.476 1.00 0.00 N ATOM 1059 CA GLU A 69 -13.313 -3.683 0.644 1.00 0.00 C ATOM 1060 C GLU A 69 -12.693 -4.977 1.168 1.00 0.00 C ATOM 1061 O GLU A 69 -12.406 -5.875 0.374 1.00 0.00 O ATOM 1062 CB GLU A 69 -14.750 -3.920 0.155 1.00 0.00 C ATOM 1063 CG GLU A 69 -15.726 -4.194 1.310 1.00 0.00 C ATOM 1064 CD GLU A 69 -16.406 -5.559 1.212 1.00 0.00 C ATOM 1065 OE1 GLU A 69 -17.219 -5.757 0.277 1.00 0.00 O ATOM 1066 OE2 GLU A 69 -16.169 -6.436 2.078 1.00 0.00 O ATOM 0 H GLU A 69 -12.955 -3.343 -1.382 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.348 -2.936 1.437 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -15.089 -3.048 -0.404 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -14.761 -4.764 -0.534 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -15.187 -4.131 2.255 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -16.489 -3.415 1.325 1.00 0.00 H new ATOM 1073 N VAL A 70 -12.459 -5.080 2.475 1.00 0.00 N ATOM 1074 CA VAL A 70 -11.917 -6.290 3.085 1.00 0.00 C ATOM 1075 C VAL A 70 -12.707 -6.650 4.348 1.00 0.00 C ATOM 1076 O VAL A 70 -13.523 -5.855 4.844 1.00 0.00 O ATOM 1077 CB VAL A 70 -10.389 -6.161 3.293 1.00 0.00 C ATOM 1078 CG1 VAL A 70 -9.611 -5.784 2.023 1.00 0.00 C ATOM 1079 CG2 VAL A 70 -9.978 -5.192 4.400 1.00 0.00 C ATOM 0 H VAL A 70 -12.640 -4.327 3.139 1.00 0.00 H new ATOM 0 HA VAL A 70 -12.043 -7.136 2.410 1.00 0.00 H new ATOM 0 HB VAL A 70 -10.120 -7.174 3.593 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.548 -5.714 2.255 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.767 -6.548 1.261 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -9.965 -4.823 1.651 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -8.891 -5.165 4.475 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -10.350 -4.194 4.167 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -10.399 -5.524 5.349 1.00 0.00 H new ATOM 1089 N ASP A 71 -12.488 -7.858 4.869 1.00 0.00 N ATOM 1090 CA ASP A 71 -12.940 -8.251 6.200 1.00 0.00 C ATOM 1091 C ASP A 71 -11.811 -8.142 7.215 1.00 0.00 C ATOM 1092 O ASP A 71 -10.690 -7.717 6.916 1.00 0.00 O ATOM 1093 CB ASP A 71 -13.595 -9.639 6.229 1.00 0.00 C ATOM 1094 CG ASP A 71 -12.614 -10.767 6.527 1.00 0.00 C ATOM 1095 OD1 ASP A 71 -11.579 -10.862 5.833 1.00 0.00 O ATOM 1096 OD2 ASP A 71 -12.871 -11.483 7.521 1.00 0.00 O ATOM 0 H ASP A 71 -11.988 -8.596 4.373 1.00 0.00 H new ATOM 0 HA ASP A 71 -13.722 -7.546 6.483 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -14.383 -9.645 6.982 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -14.072 -9.827 5.267 1.00 0.00 H new ATOM 1101 N GLU A 72 -12.150 -8.497 8.449 1.00 0.00 N ATOM 1102 CA GLU A 72 -11.199 -8.514 9.535 1.00 0.00 C ATOM 1103 C GLU A 72 -10.109 -9.539 9.303 1.00 0.00 C ATOM 1104 O GLU A 72 -8.969 -9.172 9.555 1.00 0.00 O ATOM 1105 CB GLU A 72 -11.875 -8.786 10.866 1.00 0.00 C ATOM 1106 CG GLU A 72 -12.610 -7.596 11.439 1.00 0.00 C ATOM 1107 CD GLU A 72 -14.093 -7.916 11.620 1.00 0.00 C ATOM 1108 OE1 GLU A 72 -14.410 -8.799 12.458 1.00 0.00 O ATOM 1109 OE2 GLU A 72 -14.928 -7.378 10.862 1.00 0.00 O ATOM 0 H GLU A 72 -13.093 -8.780 8.716 1.00 0.00 H new ATOM 0 HA GLU A 72 -10.748 -7.522 9.568 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -12.579 -9.609 10.742 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -11.123 -9.115 11.583 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -12.173 -7.319 12.398 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -12.496 -6.738 10.777 1.00 0.00 H new ATOM 1116 N GLN A 73 -10.409 -10.756 8.831 1.00 0.00 N ATOM 1117 CA GLN A 73 -9.387 -11.756 8.551 1.00 0.00 C ATOM 1118 C GLN A 73 -8.340 -11.204 7.598 1.00 0.00 C ATOM 1119 O GLN A 73 -7.147 -11.391 7.839 1.00 0.00 O ATOM 1120 CB GLN A 73 -9.954 -13.048 8.006 1.00 0.00 C ATOM 1121 CG GLN A 73 -10.660 -13.859 9.087 1.00 0.00 C ATOM 1122 CD GLN A 73 -9.935 -14.083 10.420 1.00 0.00 C ATOM 1123 OE1 GLN A 73 -10.546 -14.012 11.490 1.00 0.00 O ATOM 1124 NE2 GLN A 73 -8.648 -14.383 10.404 1.00 0.00 N ATOM 0 H GLN A 73 -11.361 -11.067 8.636 1.00 0.00 H new ATOM 0 HA GLN A 73 -8.921 -11.991 9.508 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.656 -12.826 7.202 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.150 -13.643 7.572 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -11.609 -13.369 9.303 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -10.895 -14.837 8.668 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -8.149 -14.440 9.516 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -8.154 -14.557 11.279 1.00 0.00 H new ATOM 1133 N MET A 74 -8.768 -10.493 6.552 1.00 0.00 N ATOM 1134 CA MET A 74 -7.832 -9.900 5.623 1.00 0.00 C ATOM 1135 C MET A 74 -7.014 -8.811 6.315 1.00 0.00 C ATOM 1136 O MET A 74 -5.786 -8.862 6.264 1.00 0.00 O ATOM 1137 CB MET A 74 -8.631 -9.368 4.445 1.00 0.00 C ATOM 1138 CG MET A 74 -7.742 -8.773 3.350 1.00 0.00 C ATOM 1139 SD MET A 74 -6.532 -9.930 2.667 1.00 0.00 S ATOM 1140 CE MET A 74 -7.655 -11.245 2.157 1.00 0.00 C ATOM 0 H MET A 74 -9.750 -10.321 6.337 1.00 0.00 H new ATOM 0 HA MET A 74 -7.113 -10.636 5.262 1.00 0.00 H new ATOM 0 HB2 MET A 74 -9.230 -10.175 4.023 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.326 -8.606 4.797 1.00 0.00 H new ATOM 0 HG2 MET A 74 -8.376 -8.408 2.542 1.00 0.00 H new ATOM 0 HG3 MET A 74 -7.214 -7.910 3.755 1.00 0.00 H new ATOM 0 HE1 MET A 74 -7.193 -11.830 1.362 1.00 0.00 H new ATOM 0 HE2 MET A 74 -7.867 -11.892 3.008 1.00 0.00 H new ATOM 0 HE3 MET A 74 -8.585 -10.808 1.792 1.00 0.00 H new ATOM 1150 N LEU A 75 -7.660 -7.850 6.997 1.00 0.00 N ATOM 1151 CA LEU A 75 -6.905 -6.824 7.729 1.00 0.00 C ATOM 1152 C LEU A 75 -5.983 -7.437 8.794 1.00 0.00 C ATOM 1153 O LEU A 75 -4.982 -6.827 9.148 1.00 0.00 O ATOM 1154 CB LEU A 75 -7.837 -5.791 8.401 1.00 0.00 C ATOM 1155 CG LEU A 75 -7.540 -4.311 8.070 1.00 0.00 C ATOM 1156 CD1 LEU A 75 -8.331 -3.429 9.046 1.00 0.00 C ATOM 1157 CD2 LEU A 75 -6.078 -3.851 8.136 1.00 0.00 C ATOM 0 H LEU A 75 -8.675 -7.763 7.056 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.293 -6.316 6.983 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -8.864 -6.011 8.110 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -7.777 -5.922 9.481 1.00 0.00 H new ATOM 0 HG LEU A 75 -7.828 -4.213 7.023 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -8.135 -2.379 8.829 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -9.397 -3.629 8.936 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -8.024 -3.651 10.068 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -6.018 -2.793 7.881 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -5.694 -4.003 9.145 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -5.482 -4.429 7.430 1.00 0.00 H new ATOM 1169 N ARG A 76 -6.325 -8.605 9.348 1.00 0.00 N ATOM 1170 CA ARG A 76 -5.555 -9.325 10.356 1.00 0.00 C ATOM 1171 C ARG A 76 -4.339 -10.002 9.735 1.00 0.00 C ATOM 1172 O ARG A 76 -3.274 -9.951 10.346 1.00 0.00 O ATOM 1173 CB ARG A 76 -6.420 -10.381 11.068 1.00 0.00 C ATOM 1174 CG ARG A 76 -7.289 -9.803 12.199 1.00 0.00 C ATOM 1175 CD ARG A 76 -7.617 -10.938 13.167 1.00 0.00 C ATOM 1176 NE ARG A 76 -8.808 -10.636 13.968 1.00 0.00 N ATOM 1177 CZ ARG A 76 -9.434 -11.513 14.754 1.00 0.00 C ATOM 1178 NH1 ARG A 76 -8.838 -12.636 15.131 1.00 0.00 N ATOM 1179 NH2 ARG A 76 -10.666 -11.249 15.166 1.00 0.00 N ATOM 0 H ARG A 76 -7.184 -9.092 9.092 1.00 0.00 H new ATOM 0 HA ARG A 76 -5.219 -8.592 11.089 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -7.066 -10.864 10.335 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -5.771 -11.154 11.479 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -6.760 -9.002 12.715 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -8.204 -9.371 11.794 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -7.778 -11.859 12.607 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -6.767 -11.111 13.828 1.00 0.00 H new ATOM 0 HE ARG A 76 -9.184 -9.689 13.921 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -7.888 -12.839 14.820 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -9.329 -13.297 15.732 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -11.124 -10.383 14.882 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -11.156 -11.912 15.767 1.00 0.00 H new ATOM 1193 N PHE A 77 -4.492 -10.649 8.577 1.00 0.00 N ATOM 1194 CA PHE A 77 -3.393 -11.256 7.845 1.00 0.00 C ATOM 1195 C PHE A 77 -2.356 -10.196 7.526 1.00 0.00 C ATOM 1196 O PHE A 77 -1.189 -10.344 7.868 1.00 0.00 O ATOM 1197 CB PHE A 77 -3.902 -11.882 6.541 1.00 0.00 C ATOM 1198 CG PHE A 77 -2.774 -12.263 5.596 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -1.655 -12.974 6.072 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -2.775 -11.783 4.273 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -0.547 -13.186 5.240 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -1.691 -12.049 3.415 1.00 0.00 C ATOM 1203 CZ PHE A 77 -0.571 -12.739 3.909 1.00 0.00 C ATOM 0 H PHE A 77 -5.397 -10.764 8.121 1.00 0.00 H new ATOM 0 HA PHE A 77 -2.947 -12.038 8.460 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.491 -12.769 6.774 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -4.568 -11.179 6.041 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.651 -13.357 7.082 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -3.614 -11.206 3.913 1.00 0.00 H new ATOM 0 HE1 PHE A 77 0.326 -13.694 5.623 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -1.720 -11.725 2.385 1.00 0.00 H new ATOM 0 HZ PHE A 77 0.274 -12.926 3.263 1.00 0.00 H new ATOM 1213 N LEU A 78 -2.805 -9.123 6.879 1.00 0.00 N ATOM 1214 CA LEU A 78 -1.980 -7.984 6.521 1.00 0.00 C ATOM 1215 C LEU A 78 -1.177 -7.493 7.738 1.00 0.00 C ATOM 1216 O LEU A 78 0.023 -7.246 7.623 1.00 0.00 O ATOM 1217 CB LEU A 78 -2.901 -6.897 5.937 1.00 0.00 C ATOM 1218 CG LEU A 78 -3.106 -6.982 4.407 1.00 0.00 C ATOM 1219 CD1 LEU A 78 -3.331 -8.390 3.840 1.00 0.00 C ATOM 1220 CD2 LEU A 78 -4.307 -6.124 3.987 1.00 0.00 C ATOM 0 H LEU A 78 -3.777 -9.024 6.584 1.00 0.00 H new ATOM 0 HA LEU A 78 -1.242 -8.259 5.767 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.873 -6.962 6.425 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -2.487 -5.919 6.181 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.162 -6.623 3.997 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -3.463 -8.330 2.760 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.468 -9.016 4.066 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -4.223 -8.826 4.291 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -4.442 -6.191 2.908 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -5.205 -6.485 4.488 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -4.128 -5.086 4.266 1.00 0.00 H new ATOM 1232 N ASP A 79 -1.808 -7.456 8.919 1.00 0.00 N ATOM 1233 CA ASP A 79 -1.216 -7.058 10.206 1.00 0.00 C ATOM 1234 C ASP A 79 -0.124 -8.006 10.718 1.00 0.00 C ATOM 1235 O ASP A 79 0.441 -7.795 11.792 1.00 0.00 O ATOM 1236 CB ASP A 79 -2.310 -6.964 11.278 1.00 0.00 C ATOM 1237 CG ASP A 79 -2.210 -5.774 12.234 1.00 0.00 C ATOM 1238 OD1 ASP A 79 -1.614 -4.723 11.914 1.00 0.00 O ATOM 1239 OD2 ASP A 79 -3.018 -5.778 13.192 1.00 0.00 O ATOM 0 H ASP A 79 -2.791 -7.714 9.009 1.00 0.00 H new ATOM 0 HA ASP A 79 -0.745 -6.092 10.022 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -3.278 -6.923 10.779 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -2.294 -7.881 11.867 1.00 0.00 H new ATOM 1244 N ASP A 80 0.169 -9.082 9.996 1.00 0.00 N ATOM 1245 CA ASP A 80 1.188 -10.093 10.285 1.00 0.00 C ATOM 1246 C ASP A 80 2.081 -10.344 9.062 1.00 0.00 C ATOM 1247 O ASP A 80 2.965 -11.205 9.086 1.00 0.00 O ATOM 1248 CB ASP A 80 0.473 -11.364 10.752 1.00 0.00 C ATOM 1249 CG ASP A 80 1.415 -12.296 11.503 1.00 0.00 C ATOM 1250 OD1 ASP A 80 1.662 -12.037 12.706 1.00 0.00 O ATOM 1251 OD2 ASP A 80 1.842 -13.325 10.928 1.00 0.00 O ATOM 0 H ASP A 80 -0.333 -9.288 9.132 1.00 0.00 H new ATOM 0 HA ASP A 80 1.854 -9.746 11.075 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -0.364 -11.095 11.397 1.00 0.00 H new ATOM 0 HB3 ASP A 80 0.056 -11.885 9.890 1.00 0.00 H new ATOM 1256 N PHE A 81 1.861 -9.579 7.988 1.00 0.00 N ATOM 1257 CA PHE A 81 2.593 -9.670 6.740 1.00 0.00 C ATOM 1258 C PHE A 81 3.612 -8.538 6.644 1.00 0.00 C ATOM 1259 O PHE A 81 4.778 -8.789 6.333 1.00 0.00 O ATOM 1260 CB PHE A 81 1.607 -9.644 5.566 1.00 0.00 C ATOM 1261 CG PHE A 81 2.241 -10.112 4.277 1.00 0.00 C ATOM 1262 CD1 PHE A 81 2.495 -11.484 4.102 1.00 0.00 C ATOM 1263 CD2 PHE A 81 2.621 -9.193 3.279 1.00 0.00 C ATOM 1264 CE1 PHE A 81 3.097 -11.944 2.922 1.00 0.00 C ATOM 1265 CE2 PHE A 81 3.237 -9.656 2.102 1.00 0.00 C ATOM 1266 CZ PHE A 81 3.471 -11.031 1.923 1.00 0.00 C ATOM 0 H PHE A 81 1.141 -8.857 7.973 1.00 0.00 H new ATOM 0 HA PHE A 81 3.143 -10.610 6.703 1.00 0.00 H new ATOM 0 HB2 PHE A 81 0.751 -10.277 5.799 1.00 0.00 H new ATOM 0 HB3 PHE A 81 1.227 -8.631 5.435 1.00 0.00 H new ATOM 0 HD1 PHE A 81 2.226 -12.185 4.878 1.00 0.00 H new ATOM 0 HD2 PHE A 81 2.440 -8.137 3.417 1.00 0.00 H new ATOM 0 HE1 PHE A 81 3.273 -13.000 2.782 1.00 0.00 H new ATOM 0 HE2 PHE A 81 3.531 -8.955 1.335 1.00 0.00 H new ATOM 0 HZ PHE A 81 3.939 -11.385 1.016 1.00 0.00 H new ATOM 1276 N GLU A 82 3.200 -7.297 6.940 1.00 0.00 N ATOM 1277 CA GLU A 82 4.076 -6.133 6.792 1.00 0.00 C ATOM 1278 C GLU A 82 5.128 -6.056 7.914 1.00 0.00 C ATOM 1279 O GLU A 82 5.879 -5.093 7.966 1.00 0.00 O ATOM 1280 CB GLU A 82 3.294 -4.801 6.735 1.00 0.00 C ATOM 1281 CG GLU A 82 1.960 -4.760 5.972 1.00 0.00 C ATOM 1282 CD GLU A 82 1.989 -5.210 4.508 1.00 0.00 C ATOM 1283 OE1 GLU A 82 3.058 -5.548 3.958 1.00 0.00 O ATOM 1284 OE2 GLU A 82 0.913 -5.166 3.855 1.00 0.00 O ATOM 0 H GLU A 82 2.265 -7.077 7.283 1.00 0.00 H new ATOM 0 HA GLU A 82 4.583 -6.274 5.837 1.00 0.00 H new ATOM 0 HB2 GLU A 82 3.098 -4.489 7.761 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.950 -4.051 6.294 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.244 -5.385 6.506 1.00 0.00 H new ATOM 0 HG3 GLU A 82 1.580 -3.739 6.006 1.00 0.00 H new ATOM 1291 N ASP A 83 5.174 -7.009 8.849 1.00 0.00 N ATOM 1292 CA ASP A 83 5.910 -6.919 10.118 1.00 0.00 C ATOM 1293 C ASP A 83 5.537 -5.668 10.929 1.00 0.00 C ATOM 1294 O ASP A 83 6.314 -5.138 11.722 1.00 0.00 O ATOM 1295 CB ASP A 83 7.436 -6.993 9.948 1.00 0.00 C ATOM 1296 CG ASP A 83 8.068 -7.513 11.233 1.00 0.00 C ATOM 1297 OD1 ASP A 83 7.846 -8.706 11.537 1.00 0.00 O ATOM 1298 OD2 ASP A 83 8.708 -6.744 11.987 1.00 0.00 O ATOM 0 H ASP A 83 4.683 -7.897 8.742 1.00 0.00 H new ATOM 0 HA ASP A 83 5.598 -7.801 10.677 1.00 0.00 H new ATOM 0 HB2 ASP A 83 7.688 -7.650 9.115 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.834 -6.007 9.708 1.00 0.00 H new ATOM 1303 N CYS A 84 4.334 -5.139 10.743 1.00 0.00 N ATOM 1304 CA CYS A 84 3.792 -4.152 11.658 1.00 0.00 C ATOM 1305 C CYS A 84 3.604 -4.798 13.046 1.00 0.00 C ATOM 1306 O CYS A 84 3.540 -6.029 13.148 1.00 0.00 O ATOM 1307 CB CYS A 84 2.497 -3.569 11.080 1.00 0.00 C ATOM 1308 SG CYS A 84 1.499 -4.828 10.238 1.00 0.00 S ATOM 0 H CYS A 84 3.718 -5.379 9.966 1.00 0.00 H new ATOM 0 HA CYS A 84 4.481 -3.317 11.783 1.00 0.00 H new ATOM 0 HB2 CYS A 84 1.912 -3.120 11.883 1.00 0.00 H new ATOM 0 HB3 CYS A 84 2.740 -2.771 10.379 1.00 0.00 H new ATOM 0 HG CYS A 84 0.455 -4.268 9.702 1.00 0.00 H new ATOM 1314 N PRO A 85 3.523 -4.013 14.134 1.00 0.00 N ATOM 1315 CA PRO A 85 3.810 -2.579 14.221 1.00 0.00 C ATOM 1316 C PRO A 85 5.318 -2.245 14.156 1.00 0.00 C ATOM 1317 O PRO A 85 5.700 -1.075 14.222 1.00 0.00 O ATOM 1318 CB PRO A 85 3.226 -2.160 15.564 1.00 0.00 C ATOM 1319 CG PRO A 85 3.478 -3.388 16.428 1.00 0.00 C ATOM 1320 CD PRO A 85 3.204 -4.535 15.458 1.00 0.00 C ATOM 0 HA PRO A 85 3.379 -2.048 13.372 1.00 0.00 H new ATOM 0 HB2 PRO A 85 3.720 -1.274 15.963 1.00 0.00 H new ATOM 0 HB3 PRO A 85 2.164 -1.926 15.490 1.00 0.00 H new ATOM 0 HG2 PRO A 85 4.499 -3.414 16.809 1.00 0.00 H new ATOM 0 HG3 PRO A 85 2.814 -3.420 17.292 1.00 0.00 H new ATOM 0 HD2 PRO A 85 3.818 -5.404 15.695 1.00 0.00 H new ATOM 0 HD3 PRO A 85 2.163 -4.855 15.513 1.00 0.00 H new ATOM 1328 N SER A 86 6.181 -3.262 14.115 1.00 0.00 N ATOM 1329 CA SER A 86 7.626 -3.134 14.095 1.00 0.00 C ATOM 1330 C SER A 86 8.135 -2.322 12.909 1.00 0.00 C ATOM 1331 O SER A 86 8.777 -1.285 13.115 1.00 0.00 O ATOM 1332 CB SER A 86 8.241 -4.536 14.133 1.00 0.00 C ATOM 1333 OG SER A 86 8.598 -4.803 15.479 1.00 0.00 O ATOM 0 H SER A 86 5.872 -4.234 14.094 1.00 0.00 H new ATOM 0 HA SER A 86 7.937 -2.572 14.976 1.00 0.00 H new ATOM 0 HB2 SER A 86 7.530 -5.278 13.770 1.00 0.00 H new ATOM 0 HB3 SER A 86 9.116 -4.590 13.485 1.00 0.00 H new ATOM 0 HG SER A 86 8.995 -5.697 15.541 1.00 0.00 H new ATOM 1339 N MET A 87 7.915 -2.806 11.688 1.00 0.00 N ATOM 1340 CA MET A 87 8.478 -2.207 10.492 1.00 0.00 C ATOM 1341 C MET A 87 7.620 -1.026 10.034 1.00 0.00 C ATOM 1342 O MET A 87 8.138 0.082 9.878 1.00 0.00 O ATOM 1343 CB MET A 87 8.601 -3.254 9.384 1.00 0.00 C ATOM 1344 CG MET A 87 9.723 -4.276 9.592 1.00 0.00 C ATOM 1345 SD MET A 87 10.296 -5.226 8.142 1.00 0.00 S ATOM 1346 CE MET A 87 8.894 -5.188 6.994 1.00 0.00 C ATOM 0 H MET A 87 7.339 -3.628 11.506 1.00 0.00 H new ATOM 0 HA MET A 87 9.476 -1.833 10.722 1.00 0.00 H new ATOM 0 HB2 MET A 87 7.654 -3.787 9.299 1.00 0.00 H new ATOM 0 HB3 MET A 87 8.765 -2.742 8.436 1.00 0.00 H new ATOM 0 HG2 MET A 87 10.582 -3.749 10.007 1.00 0.00 H new ATOM 0 HG3 MET A 87 9.391 -4.988 10.348 1.00 0.00 H new ATOM 0 HE1 MET A 87 9.191 -5.629 6.042 1.00 0.00 H new ATOM 0 HE2 MET A 87 8.064 -5.757 7.414 1.00 0.00 H new ATOM 0 HE3 MET A 87 8.582 -4.156 6.834 1.00 0.00 H new ATOM 1356 N TYR A 88 6.329 -1.271 9.809 1.00 0.00 N ATOM 1357 CA TYR A 88 5.288 -0.309 9.433 1.00 0.00 C ATOM 1358 C TYR A 88 4.350 -0.156 10.656 1.00 0.00 C ATOM 1359 O TYR A 88 4.441 -0.964 11.576 1.00 0.00 O ATOM 1360 CB TYR A 88 4.479 -0.890 8.248 1.00 0.00 C ATOM 1361 CG TYR A 88 5.216 -1.059 6.924 1.00 0.00 C ATOM 1362 CD1 TYR A 88 6.062 -2.159 6.729 1.00 0.00 C ATOM 1363 CD2 TYR A 88 5.012 -0.166 5.857 1.00 0.00 C ATOM 1364 CE1 TYR A 88 6.699 -2.374 5.498 1.00 0.00 C ATOM 1365 CE2 TYR A 88 5.689 -0.333 4.625 1.00 0.00 C ATOM 1366 CZ TYR A 88 6.518 -1.464 4.436 1.00 0.00 C ATOM 1367 OH TYR A 88 7.126 -1.711 3.244 1.00 0.00 O ATOM 0 H TYR A 88 5.954 -2.216 9.890 1.00 0.00 H new ATOM 0 HA TYR A 88 5.718 0.650 9.145 1.00 0.00 H new ATOM 0 HB2 TYR A 88 4.092 -1.864 8.547 1.00 0.00 H new ATOM 0 HB3 TYR A 88 3.618 -0.244 8.076 1.00 0.00 H new ATOM 0 HD1 TYR A 88 6.226 -2.853 7.540 1.00 0.00 H new ATOM 0 HD2 TYR A 88 4.328 0.661 5.979 1.00 0.00 H new ATOM 0 HE1 TYR A 88 7.330 -3.240 5.363 1.00 0.00 H new ATOM 0 HE2 TYR A 88 5.574 0.396 3.837 1.00 0.00 H new ATOM 0 HH TYR A 88 7.128 -0.894 2.702 1.00 0.00 H new ATOM 1377 N GLN A 89 3.379 0.763 10.665 1.00 0.00 N ATOM 1378 CA GLN A 89 2.201 0.732 11.547 1.00 0.00 C ATOM 1379 C GLN A 89 0.958 0.989 10.694 1.00 0.00 C ATOM 1380 O GLN A 89 1.071 1.593 9.626 1.00 0.00 O ATOM 1381 CB GLN A 89 2.255 1.797 12.658 1.00 0.00 C ATOM 1382 CG GLN A 89 3.434 1.692 13.632 1.00 0.00 C ATOM 1383 CD GLN A 89 4.721 2.288 13.075 1.00 0.00 C ATOM 1384 OE1 GLN A 89 4.765 3.425 12.607 1.00 0.00 O ATOM 1385 NE2 GLN A 89 5.827 1.584 13.183 1.00 0.00 N ATOM 0 H GLN A 89 3.388 1.572 10.044 1.00 0.00 H new ATOM 0 HA GLN A 89 2.176 -0.245 12.030 1.00 0.00 H new ATOM 0 HB2 GLN A 89 2.283 2.781 12.190 1.00 0.00 H new ATOM 0 HB3 GLN A 89 1.330 1.743 13.231 1.00 0.00 H new ATOM 0 HG2 GLN A 89 3.177 2.201 14.561 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.602 0.644 13.878 1.00 0.00 H new ATOM 0 HE21 GLN A 89 5.795 0.641 13.570 1.00 0.00 H new ATOM 0 HE22 GLN A 89 6.716 1.981 12.879 1.00 0.00 H new ATOM 1394 N ARG A 90 -0.230 0.577 11.144 1.00 0.00 N ATOM 1395 CA ARG A 90 -1.476 0.930 10.461 1.00 0.00 C ATOM 1396 C ARG A 90 -1.882 2.339 10.863 1.00 0.00 C ATOM 1397 O ARG A 90 -1.771 2.695 12.039 1.00 0.00 O ATOM 1398 CB ARG A 90 -2.583 -0.053 10.839 1.00 0.00 C ATOM 1399 CG ARG A 90 -3.849 0.131 9.972 1.00 0.00 C ATOM 1400 CD ARG A 90 -5.028 0.645 10.791 1.00 0.00 C ATOM 1401 NE ARG A 90 -5.291 -0.294 11.889 1.00 0.00 N ATOM 1402 CZ ARG A 90 -6.104 -0.118 12.922 1.00 0.00 C ATOM 1403 NH1 ARG A 90 -6.828 0.994 12.997 1.00 0.00 N ATOM 1404 NH2 ARG A 90 -6.154 -1.064 13.851 1.00 0.00 N ATOM 0 H ARG A 90 -0.355 0.000 11.976 1.00 0.00 H new ATOM 0 HA ARG A 90 -1.321 0.883 9.383 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -2.214 -1.073 10.728 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -2.842 0.080 11.889 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -3.637 0.830 9.163 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -4.115 -0.820 9.510 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.808 1.636 11.187 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -5.911 0.743 10.160 1.00 0.00 H new ATOM 0 HE ARG A 90 -4.792 -1.183 11.853 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -6.755 1.701 12.265 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -7.457 1.141 13.787 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -5.576 -1.900 13.760 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -6.770 -0.956 14.657 1.00 0.00 H new ATOM 1418 N THR A 91 -2.431 3.111 9.927 1.00 0.00 N ATOM 1419 CA THR A 91 -2.830 4.485 10.189 1.00 0.00 C ATOM 1420 C THR A 91 -4.119 4.795 9.417 1.00 0.00 C ATOM 1421 O THR A 91 -4.491 4.097 8.472 1.00 0.00 O ATOM 1422 CB THR A 91 -1.645 5.391 9.797 1.00 0.00 C ATOM 1423 OG1 THR A 91 -0.459 4.898 10.386 1.00 0.00 O ATOM 1424 CG2 THR A 91 -1.759 6.832 10.291 1.00 0.00 C ATOM 0 H THR A 91 -2.609 2.800 8.972 1.00 0.00 H new ATOM 0 HA THR A 91 -3.057 4.659 11.241 1.00 0.00 H new ATOM 0 HB THR A 91 -1.641 5.383 8.707 1.00 0.00 H new ATOM 0 HG1 THR A 91 0.193 4.690 9.684 1.00 0.00 H new ATOM 0 HG21 THR A 91 -0.884 7.397 9.970 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.658 7.289 9.876 1.00 0.00 H new ATOM 0 HG23 THR A 91 -1.817 6.840 11.379 1.00 0.00 H new ATOM 1432 N ALA A 92 -4.814 5.850 9.833 1.00 0.00 N ATOM 1433 CA ALA A 92 -5.962 6.450 9.170 1.00 0.00 C ATOM 1434 C ALA A 92 -5.573 7.848 8.712 1.00 0.00 C ATOM 1435 O ALA A 92 -5.110 8.672 9.506 1.00 0.00 O ATOM 1436 CB ALA A 92 -7.160 6.444 10.110 1.00 0.00 C ATOM 0 H ALA A 92 -4.573 6.337 10.696 1.00 0.00 H new ATOM 0 HA ALA A 92 -6.256 5.877 8.290 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -8.017 6.894 9.610 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -7.400 5.418 10.388 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.922 7.016 11.007 1.00 0.00 H new ATOM 1442 N LEU A 93 -5.765 8.062 7.416 1.00 0.00 N ATOM 1443 CA LEU A 93 -5.292 9.149 6.567 1.00 0.00 C ATOM 1444 C LEU A 93 -6.390 9.493 5.551 1.00 0.00 C ATOM 1445 O LEU A 93 -7.514 9.003 5.714 1.00 0.00 O ATOM 1446 CB LEU A 93 -3.993 8.688 5.877 1.00 0.00 C ATOM 1447 CG LEU A 93 -4.098 7.730 4.703 1.00 0.00 C ATOM 1448 CD1 LEU A 93 -2.684 7.559 4.169 1.00 0.00 C ATOM 1449 CD2 LEU A 93 -5.106 6.585 4.926 1.00 0.00 C ATOM 0 H LEU A 93 -6.320 7.401 6.872 1.00 0.00 H new ATOM 0 HA LEU A 93 -5.076 10.048 7.145 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -3.466 9.578 5.533 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.364 8.218 6.633 1.00 0.00 H new ATOM 0 HG LEU A 93 -4.635 8.079 3.821 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.696 6.877 3.319 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -2.295 8.527 3.852 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -2.046 7.151 4.953 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -5.127 5.942 4.046 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -4.806 6.000 5.796 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -6.099 7.002 5.094 1.00 0.00 H new ATOM 1461 N GLN A 94 -6.082 10.273 4.511 1.00 0.00 N ATOM 1462 CA GLN A 94 -7.024 10.614 3.457 1.00 0.00 C ATOM 1463 C GLN A 94 -6.702 9.890 2.147 1.00 0.00 C ATOM 1464 O GLN A 94 -5.543 9.811 1.739 1.00 0.00 O ATOM 1465 CB GLN A 94 -7.005 12.143 3.259 1.00 0.00 C ATOM 1466 CG GLN A 94 -8.194 12.719 2.474 1.00 0.00 C ATOM 1467 CD GLN A 94 -9.435 12.854 3.351 1.00 0.00 C ATOM 1468 OE1 GLN A 94 -9.594 13.823 4.092 1.00 0.00 O ATOM 1469 NE2 GLN A 94 -10.321 11.877 3.356 1.00 0.00 N ATOM 0 H GLN A 94 -5.159 10.687 4.382 1.00 0.00 H new ATOM 0 HA GLN A 94 -8.021 10.288 3.754 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -6.973 12.619 4.239 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -6.084 12.414 2.743 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -7.925 13.695 2.070 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -8.417 12.073 1.625 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -10.195 11.071 2.744 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -11.132 11.928 3.972 1.00 0.00 H new ATOM 1478 N VAL A 95 -7.739 9.407 1.455 1.00 0.00 N ATOM 1479 CA VAL A 95 -7.648 8.833 0.114 1.00 0.00 C ATOM 1480 C VAL A 95 -8.791 9.442 -0.723 1.00 0.00 C ATOM 1481 O VAL A 95 -9.907 9.572 -0.228 1.00 0.00 O ATOM 1482 CB VAL A 95 -7.695 7.289 0.236 1.00 0.00 C ATOM 1483 CG1 VAL A 95 -7.693 6.566 -1.117 1.00 0.00 C ATOM 1484 CG2 VAL A 95 -6.503 6.742 1.044 1.00 0.00 C ATOM 0 H VAL A 95 -8.690 9.406 1.825 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.713 9.067 -0.395 1.00 0.00 H new ATOM 0 HB VAL A 95 -8.637 7.090 0.746 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.727 5.489 -0.954 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -8.565 6.873 -1.695 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.786 6.821 -1.665 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -6.573 5.656 1.106 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -5.571 7.018 0.550 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.520 7.165 2.049 1.00 0.00 H new ATOM 1494 N GLN A 96 -8.526 9.853 -1.963 1.00 0.00 N ATOM 1495 CA GLN A 96 -9.520 10.252 -2.956 1.00 0.00 C ATOM 1496 C GLN A 96 -10.194 9.007 -3.539 1.00 0.00 C ATOM 1497 O GLN A 96 -9.577 7.950 -3.626 1.00 0.00 O ATOM 1498 CB GLN A 96 -8.810 11.067 -4.054 1.00 0.00 C ATOM 1499 CG GLN A 96 -9.676 11.302 -5.301 1.00 0.00 C ATOM 1500 CD GLN A 96 -9.150 12.341 -6.285 1.00 0.00 C ATOM 1501 OE1 GLN A 96 -9.964 13.333 -6.601 1.00 0.00 O flip ATOM 1502 NE2 GLN A 96 -8.072 12.210 -6.858 1.00 0.00 N flip ATOM 0 H GLN A 96 -7.572 9.919 -2.317 1.00 0.00 H new ATOM 0 HA GLN A 96 -10.295 10.868 -2.499 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -8.510 12.031 -3.643 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -7.898 10.548 -4.348 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -9.788 10.354 -5.827 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -10.671 11.606 -4.977 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -7.451 11.441 -6.607 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -7.798 12.870 -7.585 1.00 0.00 H new ATOM 1511 N VAL A 97 -11.428 9.152 -4.008 1.00 0.00 N ATOM 1512 CA VAL A 97 -12.165 8.235 -4.859 1.00 0.00 C ATOM 1513 C VAL A 97 -11.818 8.573 -6.314 1.00 0.00 C ATOM 1514 O VAL A 97 -12.127 9.654 -6.817 1.00 0.00 O ATOM 1515 CB VAL A 97 -13.669 8.379 -4.555 1.00 0.00 C ATOM 1516 CG1 VAL A 97 -14.534 7.465 -5.421 1.00 0.00 C ATOM 1517 CG2 VAL A 97 -13.948 8.032 -3.086 1.00 0.00 C ATOM 0 H VAL A 97 -11.979 9.980 -3.783 1.00 0.00 H new ATOM 0 HA VAL A 97 -11.898 7.194 -4.677 1.00 0.00 H new ATOM 0 HB VAL A 97 -13.926 9.416 -4.773 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -15.584 7.608 -5.165 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -14.381 7.708 -6.472 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -14.255 6.426 -5.245 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -15.014 8.137 -2.883 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -13.641 7.005 -2.890 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -13.387 8.707 -2.440 1.00 0.00 H new ATOM 1527 N LEU A 98 -11.122 7.660 -6.985 1.00 0.00 N ATOM 1528 CA LEU A 98 -10.845 7.697 -8.422 1.00 0.00 C ATOM 1529 C LEU A 98 -11.944 6.964 -9.204 1.00 0.00 C ATOM 1530 O LEU A 98 -12.032 7.128 -10.421 1.00 0.00 O ATOM 1531 CB LEU A 98 -9.479 7.030 -8.688 1.00 0.00 C ATOM 1532 CG LEU A 98 -8.315 7.982 -8.993 1.00 0.00 C ATOM 1533 CD1 LEU A 98 -8.133 9.040 -7.910 1.00 0.00 C ATOM 1534 CD2 LEU A 98 -7.019 7.164 -9.059 1.00 0.00 C ATOM 0 H LEU A 98 -10.719 6.842 -6.528 1.00 0.00 H new ATOM 0 HA LEU A 98 -10.823 8.735 -8.755 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -9.214 6.431 -7.817 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -9.590 6.342 -9.527 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.539 8.482 -9.935 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.297 9.689 -8.172 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.042 9.635 -7.826 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.929 8.553 -6.956 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -6.181 7.827 -9.275 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -6.852 6.669 -8.103 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -7.101 6.415 -9.846 1.00 0.00 H new ATOM 1546 N GLU A 99 -12.738 6.123 -8.538 1.00 0.00 N ATOM 1547 CA GLU A 99 -13.919 5.408 -9.008 1.00 0.00 C ATOM 1548 C GLU A 99 -14.531 4.753 -7.761 1.00 0.00 C ATOM 1549 O GLU A 99 -13.814 4.553 -6.779 1.00 0.00 O ATOM 1550 CB GLU A 99 -13.510 4.333 -10.034 1.00 0.00 C ATOM 1551 CG GLU A 99 -14.135 4.601 -11.408 1.00 0.00 C ATOM 1552 CD GLU A 99 -13.620 3.666 -12.522 1.00 0.00 C ATOM 1553 OE1 GLU A 99 -12.787 2.770 -12.240 1.00 0.00 O ATOM 1554 OE2 GLU A 99 -13.935 3.847 -13.720 1.00 0.00 O ATOM 0 H GLU A 99 -12.548 5.907 -7.559 1.00 0.00 H new ATOM 0 HA GLU A 99 -14.629 6.073 -9.500 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -12.424 4.310 -10.125 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -13.821 3.351 -9.677 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -15.217 4.496 -11.331 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -13.934 5.634 -11.692 1.00 0.00 H new ATOM 1561 N TRP A 100 -15.810 4.376 -7.782 1.00 0.00 N ATOM 1562 CA TRP A 100 -16.499 3.764 -6.645 1.00 0.00 C ATOM 1563 C TRP A 100 -17.446 2.677 -7.142 1.00 0.00 C ATOM 1564 O TRP A 100 -18.376 2.985 -7.889 1.00 0.00 O ATOM 1565 CB TRP A 100 -17.275 4.817 -5.838 1.00 0.00 C ATOM 1566 CG TRP A 100 -17.747 4.289 -4.519 1.00 0.00 C ATOM 1567 CD1 TRP A 100 -19.015 3.946 -4.185 1.00 0.00 C ATOM 1568 CD2 TRP A 100 -16.913 3.901 -3.384 1.00 0.00 C ATOM 1569 NE1 TRP A 100 -19.003 3.384 -2.931 1.00 0.00 N ATOM 1570 CE2 TRP A 100 -17.741 3.293 -2.400 1.00 0.00 C ATOM 1571 CE3 TRP A 100 -15.529 3.935 -3.114 1.00 0.00 C ATOM 1572 CZ2 TRP A 100 -17.236 2.728 -1.220 1.00 0.00 C ATOM 1573 CZ3 TRP A 100 -15.008 3.375 -1.932 1.00 0.00 C ATOM 1574 CH2 TRP A 100 -15.852 2.757 -0.992 1.00 0.00 C ATOM 0 H TRP A 100 -16.406 4.489 -8.602 1.00 0.00 H new ATOM 0 HA TRP A 100 -15.753 3.319 -5.987 1.00 0.00 H new ATOM 0 HB2 TRP A 100 -16.638 5.686 -5.672 1.00 0.00 H new ATOM 0 HB3 TRP A 100 -18.133 5.157 -6.419 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -19.890 4.090 -4.802 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -19.843 3.068 -2.446 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -14.859 4.397 -3.824 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -17.902 2.278 -0.498 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -13.945 3.421 -1.745 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -15.438 2.308 -0.101 1.00 0.00 H new ATOM 1585 N GLU A 101 -17.232 1.417 -6.744 1.00 0.00 N ATOM 1586 CA GLU A 101 -17.956 0.274 -7.293 1.00 0.00 C ATOM 1587 C GLU A 101 -18.781 -0.466 -6.235 1.00 0.00 C ATOM 1588 O GLU A 101 -18.587 -1.659 -5.971 1.00 0.00 O ATOM 1589 CB GLU A 101 -16.992 -0.668 -8.043 1.00 0.00 C ATOM 1590 CG GLU A 101 -16.235 -0.050 -9.229 1.00 0.00 C ATOM 1591 CD GLU A 101 -17.166 0.684 -10.205 1.00 0.00 C ATOM 1592 OE1 GLU A 101 -18.273 0.163 -10.482 1.00 0.00 O ATOM 1593 OE2 GLU A 101 -16.831 1.814 -10.625 1.00 0.00 O ATOM 0 H GLU A 101 -16.549 1.165 -6.030 1.00 0.00 H new ATOM 0 HA GLU A 101 -18.678 0.660 -8.013 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -16.261 -1.050 -7.330 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -17.561 -1.524 -8.407 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -15.486 0.647 -8.854 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -15.701 -0.835 -9.763 1.00 0.00 H new ATOM 1600 N GLY A 102 -19.751 0.232 -5.651 1.00 0.00 N ATOM 1601 CA GLY A 102 -20.889 -0.385 -4.991 1.00 0.00 C ATOM 1602 C GLY A 102 -21.403 0.478 -3.859 1.00 0.00 C ATOM 1603 O GLY A 102 -20.648 1.252 -3.277 1.00 0.00 O ATOM 0 H GLY A 102 -19.766 1.252 -5.624 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -21.686 -0.551 -5.716 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -20.602 -1.363 -4.604 1.00 0.00 H new ATOM 1607 N ASP A 103 -22.679 0.309 -3.528 1.00 0.00 N ATOM 1608 CA ASP A 103 -23.461 1.252 -2.739 1.00 0.00 C ATOM 1609 C ASP A 103 -22.793 1.580 -1.414 1.00 0.00 C ATOM 1610 O ASP A 103 -22.144 0.736 -0.785 1.00 0.00 O ATOM 1611 CB ASP A 103 -24.837 0.676 -2.414 1.00 0.00 C ATOM 1612 CG ASP A 103 -25.833 1.730 -1.952 1.00 0.00 C ATOM 1613 OD1 ASP A 103 -25.872 2.835 -2.536 1.00 0.00 O ATOM 1614 OD2 ASP A 103 -26.573 1.469 -0.972 1.00 0.00 O ATOM 0 H ASP A 103 -23.213 -0.513 -3.810 1.00 0.00 H new ATOM 0 HA ASP A 103 -23.545 2.154 -3.345 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -25.232 0.174 -3.297 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -24.733 -0.082 -1.637 1.00 0.00 H new ATOM 1619 N GLY A 104 -23.025 2.791 -0.940 1.00 0.00 N ATOM 1620 CA GLY A 104 -22.248 3.384 0.126 1.00 0.00 C ATOM 1621 C GLY A 104 -21.190 4.309 -0.461 1.00 0.00 C ATOM 1622 O GLY A 104 -20.009 4.115 -0.202 1.00 0.00 O ATOM 0 H GLY A 104 -23.768 3.395 -1.291 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -22.901 3.942 0.797 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -21.773 2.603 0.720 1.00 0.00 H new ATOM 1626 N ASP A 105 -21.642 5.393 -1.087 1.00 0.00 N ATOM 1627 CA ASP A 105 -21.024 6.313 -2.039 1.00 0.00 C ATOM 1628 C ASP A 105 -20.599 7.573 -1.278 1.00 0.00 C ATOM 1629 O ASP A 105 -21.439 8.419 -0.937 1.00 0.00 O ATOM 1630 CB ASP A 105 -21.994 6.701 -3.161 1.00 0.00 C ATOM 1631 CG ASP A 105 -21.493 7.945 -3.908 1.00 0.00 C ATOM 1632 OD1 ASP A 105 -20.265 8.099 -4.093 1.00 0.00 O ATOM 1633 OD2 ASP A 105 -22.348 8.813 -4.200 1.00 0.00 O ATOM 0 H ASP A 105 -22.601 5.690 -0.908 1.00 0.00 H new ATOM 0 HA ASP A 105 -20.166 5.822 -2.498 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -22.101 5.871 -3.859 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -22.982 6.895 -2.743 1.00 0.00 H new ATOM 1638 N PRO A 106 -19.367 7.561 -0.747 1.00 0.00 N ATOM 1639 CA PRO A 106 -18.902 8.474 0.277 1.00 0.00 C ATOM 1640 C PRO A 106 -18.655 9.905 -0.223 1.00 0.00 C ATOM 1641 O PRO A 106 -18.367 10.768 0.613 1.00 0.00 O ATOM 1642 CB PRO A 106 -17.629 7.815 0.822 1.00 0.00 C ATOM 1643 CG PRO A 106 -17.043 7.131 -0.411 1.00 0.00 C ATOM 1644 CD PRO A 106 -18.259 6.750 -1.234 1.00 0.00 C ATOM 0 HA PRO A 106 -19.662 8.619 1.045 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -16.942 8.550 1.241 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -17.852 7.099 1.613 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -16.382 7.800 -0.962 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -16.455 6.255 -0.139 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -18.082 6.934 -2.294 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -18.481 5.688 -1.127 1.00 0.00 H new ATOM 1652 N GLY A 107 -18.770 10.190 -1.522 1.00 0.00 N ATOM 1653 CA GLY A 107 -18.289 11.422 -2.125 1.00 0.00 C ATOM 1654 C GLY A 107 -16.834 11.238 -2.555 1.00 0.00 C ATOM 1655 O GLY A 107 -16.276 10.151 -2.430 1.00 0.00 O ATOM 0 H GLY A 107 -19.208 9.556 -2.190 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -18.904 11.684 -2.986 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -18.369 12.244 -1.414 1.00 0.00 H new ATOM 1659 N ASP A 108 -16.224 12.302 -3.077 1.00 0.00 N ATOM 1660 CA ASP A 108 -14.930 12.246 -3.767 1.00 0.00 C ATOM 1661 C ASP A 108 -13.756 11.823 -2.877 1.00 0.00 C ATOM 1662 O ASP A 108 -12.700 11.506 -3.409 1.00 0.00 O ATOM 1663 CB ASP A 108 -14.603 13.592 -4.427 1.00 0.00 C ATOM 1664 CG ASP A 108 -13.482 13.451 -5.468 1.00 0.00 C ATOM 1665 OD1 ASP A 108 -13.776 13.039 -6.615 1.00 0.00 O ATOM 1666 OD2 ASP A 108 -12.319 13.811 -5.183 1.00 0.00 O ATOM 0 H ASP A 108 -16.618 13.242 -3.033 1.00 0.00 H new ATOM 0 HA ASP A 108 -15.048 11.468 -4.522 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -15.497 13.991 -4.906 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -14.304 14.310 -3.663 1.00 0.00 H new ATOM 1671 N SER A 109 -13.891 11.770 -1.546 1.00 0.00 N ATOM 1672 CA SER A 109 -12.810 11.316 -0.675 1.00 0.00 C ATOM 1673 C SER A 109 -13.305 10.391 0.436 1.00 0.00 C ATOM 1674 O SER A 109 -14.495 10.354 0.754 1.00 0.00 O ATOM 1675 CB SER A 109 -12.048 12.526 -0.130 1.00 0.00 C ATOM 1676 OG SER A 109 -12.916 13.490 0.439 1.00 0.00 O ATOM 0 H SER A 109 -14.742 12.038 -1.052 1.00 0.00 H new ATOM 0 HA SER A 109 -12.122 10.713 -1.267 1.00 0.00 H new ATOM 0 HB2 SER A 109 -11.332 12.194 0.622 1.00 0.00 H new ATOM 0 HB3 SER A 109 -11.475 12.985 -0.935 1.00 0.00 H new ATOM 0 HG SER A 109 -12.390 14.245 0.776 1.00 0.00 H new ATOM 1682 N VAL A 110 -12.384 9.641 1.035 1.00 0.00 N ATOM 1683 CA VAL A 110 -12.641 8.678 2.089 1.00 0.00 C ATOM 1684 C VAL A 110 -11.489 8.723 3.093 1.00 0.00 C ATOM 1685 O VAL A 110 -10.357 9.103 2.759 1.00 0.00 O ATOM 1686 CB VAL A 110 -12.831 7.260 1.493 1.00 0.00 C ATOM 1687 CG1 VAL A 110 -13.976 7.223 0.494 1.00 0.00 C ATOM 1688 CG2 VAL A 110 -11.588 6.667 0.809 1.00 0.00 C ATOM 0 H VAL A 110 -11.397 9.694 0.784 1.00 0.00 H new ATOM 0 HA VAL A 110 -13.565 8.931 2.609 1.00 0.00 H new ATOM 0 HB VAL A 110 -13.047 6.645 2.367 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -14.080 6.213 0.097 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -14.902 7.515 0.990 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -13.769 7.915 -0.323 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -11.823 5.674 0.425 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -11.284 7.312 -0.015 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -10.775 6.594 1.532 1.00 0.00 H new ATOM 1698 N GLN A 111 -11.762 8.291 4.322 1.00 0.00 N ATOM 1699 CA GLN A 111 -10.751 7.871 5.272 1.00 0.00 C ATOM 1700 C GLN A 111 -10.692 6.347 5.195 1.00 0.00 C ATOM 1701 O GLN A 111 -11.526 5.662 5.789 1.00 0.00 O ATOM 1702 CB GLN A 111 -11.067 8.400 6.680 1.00 0.00 C ATOM 1703 CG GLN A 111 -10.077 7.835 7.712 1.00 0.00 C ATOM 1704 CD GLN A 111 -9.555 8.905 8.660 1.00 0.00 C ATOM 1705 OE1 GLN A 111 -8.306 9.277 8.479 1.00 0.00 O flip ATOM 1706 NE2 GLN A 111 -10.244 9.389 9.552 1.00 0.00 N flip ATOM 0 H GLN A 111 -12.712 8.224 4.686 1.00 0.00 H new ATOM 0 HA GLN A 111 -9.771 8.284 5.034 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -11.020 9.489 6.683 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -12.085 8.124 6.957 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -10.566 7.050 8.288 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -9.238 7.373 7.192 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -11.210 9.084 9.672 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -9.851 10.096 10.173 1.00 0.00 H new ATOM 1715 N CYS A 112 -9.717 5.830 4.447 1.00 0.00 N ATOM 1716 CA CYS A 112 -9.373 4.415 4.476 1.00 0.00 C ATOM 1717 C CYS A 112 -8.271 4.231 5.520 1.00 0.00 C ATOM 1718 O CYS A 112 -7.708 5.208 6.027 1.00 0.00 O ATOM 1719 CB CYS A 112 -8.891 3.954 3.088 1.00 0.00 C ATOM 1720 SG CYS A 112 -10.309 3.616 2.004 1.00 0.00 S ATOM 0 H CYS A 112 -9.147 6.382 3.806 1.00 0.00 H new ATOM 0 HA CYS A 112 -10.243 3.813 4.736 1.00 0.00 H new ATOM 0 HB2 CYS A 112 -8.259 4.722 2.642 1.00 0.00 H new ATOM 0 HB3 CYS A 112 -8.280 3.057 3.188 1.00 0.00 H new ATOM 0 HG CYS A 112 -9.882 3.231 0.838 1.00 0.00 H new ATOM 1726 N PHE A 113 -7.930 2.977 5.806 1.00 0.00 N ATOM 1727 CA PHE A 113 -6.680 2.662 6.477 1.00 0.00 C ATOM 1728 C PHE A 113 -5.582 2.551 5.422 1.00 0.00 C ATOM 1729 O PHE A 113 -5.827 2.053 4.318 1.00 0.00 O ATOM 1730 CB PHE A 113 -6.843 1.404 7.337 1.00 0.00 C ATOM 1731 CG PHE A 113 -7.965 1.567 8.345 1.00 0.00 C ATOM 1732 CD1 PHE A 113 -7.784 2.446 9.430 1.00 0.00 C ATOM 1733 CD2 PHE A 113 -9.223 0.971 8.124 1.00 0.00 C ATOM 1734 CE1 PHE A 113 -8.870 2.765 10.264 1.00 0.00 C ATOM 1735 CE2 PHE A 113 -10.307 1.296 8.959 1.00 0.00 C ATOM 1736 CZ PHE A 113 -10.135 2.204 10.018 1.00 0.00 C ATOM 0 H PHE A 113 -8.505 2.165 5.582 1.00 0.00 H new ATOM 0 HA PHE A 113 -6.391 3.453 7.169 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -7.049 0.547 6.696 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -5.910 1.194 7.859 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -6.811 2.875 9.621 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -9.354 0.267 7.316 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -8.732 3.442 11.094 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -11.274 0.847 8.786 1.00 0.00 H new ATOM 0 HZ PHE A 113 -10.975 2.471 10.643 1.00 0.00 H new ATOM 1746 N VAL A 114 -4.403 3.068 5.764 1.00 0.00 N ATOM 1747 CA VAL A 114 -3.154 2.985 5.026 1.00 0.00 C ATOM 1748 C VAL A 114 -2.078 2.627 6.054 1.00 0.00 C ATOM 1749 O VAL A 114 -1.955 3.301 7.079 1.00 0.00 O ATOM 1750 CB VAL A 114 -2.873 4.283 4.217 1.00 0.00 C ATOM 1751 CG1 VAL A 114 -1.417 4.369 3.753 1.00 0.00 C ATOM 1752 CG2 VAL A 114 -3.694 4.321 2.936 1.00 0.00 C ATOM 0 H VAL A 114 -4.293 3.595 6.631 1.00 0.00 H new ATOM 0 HA VAL A 114 -3.182 2.215 4.255 1.00 0.00 H new ATOM 0 HB VAL A 114 -3.124 5.100 4.894 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -1.268 5.292 3.192 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -0.757 4.361 4.621 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -1.187 3.516 3.115 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -3.476 5.240 2.392 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -3.439 3.462 2.315 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -4.755 4.288 3.183 1.00 0.00 H new ATOM 1762 N TYR A 115 -1.327 1.546 5.829 1.00 0.00 N ATOM 1763 CA TYR A 115 -0.129 1.268 6.619 1.00 0.00 C ATOM 1764 C TYR A 115 0.978 2.247 6.220 1.00 0.00 C ATOM 1765 O TYR A 115 1.155 2.553 5.039 1.00 0.00 O ATOM 1766 CB TYR A 115 0.340 -0.188 6.452 1.00 0.00 C ATOM 1767 CG TYR A 115 -0.393 -1.208 7.295 1.00 0.00 C ATOM 1768 CD1 TYR A 115 0.068 -1.553 8.577 1.00 0.00 C ATOM 1769 CD2 TYR A 115 -1.525 -1.847 6.772 1.00 0.00 C ATOM 1770 CE1 TYR A 115 -0.637 -2.491 9.354 1.00 0.00 C ATOM 1771 CE2 TYR A 115 -2.238 -2.784 7.542 1.00 0.00 C ATOM 1772 CZ TYR A 115 -1.800 -3.103 8.842 1.00 0.00 C ATOM 1773 OH TYR A 115 -2.534 -3.959 9.598 1.00 0.00 O ATOM 0 H TYR A 115 -1.528 0.852 5.109 1.00 0.00 H new ATOM 0 HA TYR A 115 -0.371 1.403 7.673 1.00 0.00 H new ATOM 0 HB2 TYR A 115 0.236 -0.467 5.403 1.00 0.00 H new ATOM 0 HB3 TYR A 115 1.402 -0.239 6.692 1.00 0.00 H new ATOM 0 HD1 TYR A 115 0.966 -1.097 8.967 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -1.853 -1.618 5.769 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -0.287 -2.743 10.344 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -3.120 -3.258 7.137 1.00 0.00 H new ATOM 0 HH TYR A 115 -2.057 -4.150 10.432 1.00 0.00 H new ATOM 1783 N THR A 116 1.755 2.725 7.186 1.00 0.00 N ATOM 1784 CA THR A 116 2.772 3.757 7.040 1.00 0.00 C ATOM 1785 C THR A 116 4.019 3.371 7.846 1.00 0.00 C ATOM 1786 O THR A 116 4.076 2.268 8.385 1.00 0.00 O ATOM 1787 CB THR A 116 2.176 5.117 7.458 1.00 0.00 C ATOM 1788 OG1 THR A 116 1.656 5.089 8.773 1.00 0.00 O ATOM 1789 CG2 THR A 116 1.011 5.513 6.549 1.00 0.00 C ATOM 0 H THR A 116 1.687 2.383 8.145 1.00 0.00 H new ATOM 0 HA THR A 116 3.087 3.848 6.001 1.00 0.00 H new ATOM 0 HB THR A 116 2.999 5.829 7.386 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.348 5.985 9.022 1.00 0.00 H new ATOM 0 HG21 THR A 116 0.611 6.476 6.868 1.00 0.00 H new ATOM 0 HG22 THR A 116 1.362 5.589 5.520 1.00 0.00 H new ATOM 0 HG23 THR A 116 0.228 4.757 6.610 1.00 0.00 H new ATOM 1797 N THR A 117 5.014 4.250 7.954 1.00 0.00 N ATOM 1798 CA THR A 117 6.096 4.132 8.924 1.00 0.00 C ATOM 1799 C THR A 117 6.301 5.499 9.565 1.00 0.00 C ATOM 1800 O THR A 117 6.181 6.539 8.903 1.00 0.00 O ATOM 1801 CB THR A 117 7.382 3.534 8.296 1.00 0.00 C ATOM 1802 OG1 THR A 117 8.510 3.685 9.148 1.00 0.00 O ATOM 1803 CG2 THR A 117 7.798 4.171 6.984 1.00 0.00 C ATOM 0 H THR A 117 5.090 5.076 7.360 1.00 0.00 H new ATOM 0 HA THR A 117 5.830 3.420 9.705 1.00 0.00 H new ATOM 0 HB THR A 117 7.109 2.491 8.137 1.00 0.00 H new ATOM 0 HG1 THR A 117 9.299 3.295 8.718 1.00 0.00 H new ATOM 0 HG21 THR A 117 8.706 3.691 6.618 1.00 0.00 H new ATOM 0 HG22 THR A 117 7.001 4.047 6.251 1.00 0.00 H new ATOM 0 HG23 THR A 117 7.987 5.233 7.139 1.00 0.00 H new ATOM 1811 N ALA A 118 6.648 5.478 10.855 1.00 0.00 N ATOM 1812 CA ALA A 118 7.100 6.619 11.634 1.00 0.00 C ATOM 1813 C ALA A 118 8.573 6.478 12.067 1.00 0.00 C ATOM 1814 O ALA A 118 9.142 7.460 12.554 1.00 0.00 O ATOM 1815 CB ALA A 118 6.171 6.808 12.839 1.00 0.00 C ATOM 0 H ALA A 118 6.617 4.620 11.405 1.00 0.00 H new ATOM 0 HA ALA A 118 7.054 7.509 11.007 1.00 0.00 H new ATOM 0 HB1 ALA A 118 6.506 7.663 13.426 1.00 0.00 H new ATOM 0 HB2 ALA A 118 5.154 6.984 12.490 1.00 0.00 H new ATOM 0 HB3 ALA A 118 6.192 5.912 13.459 1.00 0.00 H new ATOM 1821 N THR A 119 9.212 5.315 11.870 1.00 0.00 N ATOM 1822 CA THR A 119 10.559 5.005 12.373 1.00 0.00 C ATOM 1823 C THR A 119 11.636 5.021 11.269 1.00 0.00 C ATOM 1824 O THR A 119 12.736 4.493 11.440 1.00 0.00 O ATOM 1825 CB THR A 119 10.510 3.666 13.135 1.00 0.00 C ATOM 1826 OG1 THR A 119 10.292 2.590 12.248 1.00 0.00 O ATOM 1827 CG2 THR A 119 9.379 3.638 14.177 1.00 0.00 C ATOM 0 H THR A 119 8.797 4.546 11.344 1.00 0.00 H new ATOM 0 HA THR A 119 10.863 5.795 13.060 1.00 0.00 H new ATOM 0 HB THR A 119 11.473 3.567 13.635 1.00 0.00 H new ATOM 0 HG1 THR A 119 10.266 1.750 12.753 1.00 0.00 H new ATOM 0 HG21 THR A 119 9.381 2.676 14.690 1.00 0.00 H new ATOM 0 HG22 THR A 119 9.533 4.437 14.902 1.00 0.00 H new ATOM 0 HG23 THR A 119 8.421 3.781 13.678 1.00 0.00 H new ATOM 1835 N TYR A 120 11.315 5.600 10.114 1.00 0.00 N ATOM 1836 CA TYR A 120 12.105 5.558 8.890 1.00 0.00 C ATOM 1837 C TYR A 120 13.515 6.132 9.045 1.00 0.00 C ATOM 1838 O TYR A 120 13.750 7.049 9.843 1.00 0.00 O ATOM 1839 CB TYR A 120 11.322 6.269 7.785 1.00 0.00 C ATOM 1840 CG TYR A 120 10.697 7.590 8.203 1.00 0.00 C ATOM 1841 CD1 TYR A 120 11.444 8.781 8.157 1.00 0.00 C ATOM 1842 CD2 TYR A 120 9.382 7.608 8.706 1.00 0.00 C ATOM 1843 CE1 TYR A 120 10.888 9.983 8.639 1.00 0.00 C ATOM 1844 CE2 TYR A 120 8.814 8.808 9.163 1.00 0.00 C ATOM 1845 CZ TYR A 120 9.575 9.995 9.159 1.00 0.00 C ATOM 1846 OH TYR A 120 9.056 11.125 9.713 1.00 0.00 O ATOM 0 H TYR A 120 10.455 6.137 10.003 1.00 0.00 H new ATOM 0 HA TYR A 120 12.265 4.512 8.627 1.00 0.00 H new ATOM 0 HB2 TYR A 120 11.990 6.448 6.942 1.00 0.00 H new ATOM 0 HB3 TYR A 120 10.534 5.605 7.431 1.00 0.00 H new ATOM 0 HD1 TYR A 120 12.445 8.774 7.752 1.00 0.00 H new ATOM 0 HD2 TYR A 120 8.807 6.694 8.740 1.00 0.00 H new ATOM 0 HE1 TYR A 120 11.466 10.895 8.611 1.00 0.00 H new ATOM 0 HE2 TYR A 120 7.794 8.822 9.518 1.00 0.00 H new ATOM 0 HH TYR A 120 8.141 10.950 10.017 1.00 0.00 H new ATOM 1856 N ALA A 121 14.436 5.582 8.247 1.00 0.00 N ATOM 1857 CA ALA A 121 15.845 5.949 8.205 1.00 0.00 C ATOM 1858 C ALA A 121 16.023 7.383 7.695 1.00 0.00 C ATOM 1859 O ALA A 121 15.206 7.842 6.895 1.00 0.00 O ATOM 1860 CB ALA A 121 16.564 4.999 7.242 1.00 0.00 C ATOM 0 H ALA A 121 14.205 4.839 7.588 1.00 0.00 H new ATOM 0 HA ALA A 121 16.257 5.880 9.212 1.00 0.00 H new ATOM 0 HB1 ALA A 121 17.622 5.258 7.197 1.00 0.00 H new ATOM 0 HB2 ALA A 121 16.457 3.973 7.595 1.00 0.00 H new ATOM 0 HB3 ALA A 121 16.126 5.088 6.248 1.00 0.00 H new ATOM 1866 N PRO A 122 17.119 8.075 8.051 1.00 0.00 N ATOM 1867 CA PRO A 122 17.368 9.426 7.572 1.00 0.00 C ATOM 1868 C PRO A 122 17.708 9.487 6.090 1.00 0.00 C ATOM 1869 O PRO A 122 17.371 10.469 5.435 1.00 0.00 O ATOM 1870 CB PRO A 122 18.503 9.975 8.438 1.00 0.00 C ATOM 1871 CG PRO A 122 19.248 8.719 8.881 1.00 0.00 C ATOM 1872 CD PRO A 122 18.138 7.678 9.009 1.00 0.00 C ATOM 0 HA PRO A 122 16.464 10.029 7.661 1.00 0.00 H new ATOM 0 HB2 PRO A 122 19.149 10.648 7.874 1.00 0.00 H new ATOM 0 HB3 PRO A 122 18.122 10.538 9.290 1.00 0.00 H new ATOM 0 HG2 PRO A 122 19.999 8.418 8.151 1.00 0.00 H new ATOM 0 HG3 PRO A 122 19.767 8.872 9.827 1.00 0.00 H new ATOM 0 HD2 PRO A 122 18.512 6.677 8.792 1.00 0.00 H new ATOM 0 HD3 PRO A 122 17.736 7.655 10.022 1.00 0.00 H new ATOM 1880 N GLU A 123 18.342 8.446 5.550 1.00 0.00 N ATOM 1881 CA GLU A 123 18.597 8.349 4.117 1.00 0.00 C ATOM 1882 C GLU A 123 17.303 8.333 3.293 1.00 0.00 C ATOM 1883 O GLU A 123 17.287 8.837 2.174 1.00 0.00 O ATOM 1884 CB GLU A 123 19.472 7.119 3.820 1.00 0.00 C ATOM 1885 CG GLU A 123 18.816 5.802 4.276 1.00 0.00 C ATOM 1886 CD GLU A 123 18.959 4.645 3.275 1.00 0.00 C ATOM 1887 OE1 GLU A 123 18.682 4.829 2.070 1.00 0.00 O ATOM 1888 OE2 GLU A 123 19.297 3.516 3.696 1.00 0.00 O ATOM 0 H GLU A 123 18.690 7.654 6.090 1.00 0.00 H new ATOM 0 HA GLU A 123 19.139 9.245 3.813 1.00 0.00 H new ATOM 0 HB2 GLU A 123 19.672 7.070 2.750 1.00 0.00 H new ATOM 0 HB3 GLU A 123 20.434 7.233 4.319 1.00 0.00 H new ATOM 0 HG2 GLU A 123 19.256 5.501 5.227 1.00 0.00 H new ATOM 0 HG3 GLU A 123 17.756 5.981 4.457 1.00 0.00 H new ATOM 1895 N TRP A 124 16.202 7.806 3.836 1.00 0.00 N ATOM 1896 CA TRP A 124 14.991 7.594 3.057 1.00 0.00 C ATOM 1897 C TRP A 124 14.291 8.916 2.741 1.00 0.00 C ATOM 1898 O TRP A 124 13.490 8.982 1.810 1.00 0.00 O ATOM 1899 CB TRP A 124 14.068 6.608 3.783 1.00 0.00 C ATOM 1900 CG TRP A 124 14.569 5.196 3.954 1.00 0.00 C ATOM 1901 CD1 TRP A 124 15.763 4.692 3.565 1.00 0.00 C ATOM 1902 CD2 TRP A 124 13.873 4.074 4.568 1.00 0.00 C ATOM 1903 NE1 TRP A 124 15.850 3.354 3.889 1.00 0.00 N ATOM 1904 CE2 TRP A 124 14.721 2.926 4.543 1.00 0.00 C ATOM 1905 CE3 TRP A 124 12.569 3.906 5.071 1.00 0.00 C ATOM 1906 CZ2 TRP A 124 14.326 1.685 5.057 1.00 0.00 C ATOM 1907 CZ3 TRP A 124 12.172 2.675 5.625 1.00 0.00 C ATOM 1908 CH2 TRP A 124 13.056 1.577 5.644 1.00 0.00 C ATOM 0 H TRP A 124 16.130 7.520 4.812 1.00 0.00 H new ATOM 0 HA TRP A 124 15.263 7.155 2.097 1.00 0.00 H new ATOM 0 HB2 TRP A 124 13.852 7.012 4.772 1.00 0.00 H new ATOM 0 HB3 TRP A 124 13.123 6.568 3.242 1.00 0.00 H new ATOM 0 HD1 TRP A 124 16.539 5.258 3.070 1.00 0.00 H new ATOM 0 HE1 TRP A 124 16.650 2.759 3.671 1.00 0.00 H new ATOM 0 HE3 TRP A 124 11.869 4.727 5.031 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 14.984 0.830 5.003 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 11.180 2.570 6.040 1.00 0.00 H new ATOM 0 HH2 TRP A 124 12.755 0.651 6.111 1.00 0.00 H new ATOM 1919 N LEU A 125 14.621 9.992 3.464 1.00 0.00 N ATOM 1920 CA LEU A 125 14.128 11.323 3.138 1.00 0.00 C ATOM 1921 C LEU A 125 14.860 11.896 1.920 1.00 0.00 C ATOM 1922 O LEU A 125 14.329 12.813 1.294 1.00 0.00 O ATOM 1923 CB LEU A 125 14.299 12.287 4.326 1.00 0.00 C ATOM 1924 CG LEU A 125 13.415 12.072 5.570 1.00 0.00 C ATOM 1925 CD1 LEU A 125 11.913 12.076 5.269 1.00 0.00 C ATOM 1926 CD2 LEU A 125 13.793 10.810 6.341 1.00 0.00 C ATOM 0 H LEU A 125 15.231 9.960 4.281 1.00 0.00 H new ATOM 0 HA LEU A 125 13.067 11.224 2.908 1.00 0.00 H new ATOM 0 HB2 LEU A 125 15.340 12.241 4.645 1.00 0.00 H new ATOM 0 HB3 LEU A 125 14.122 13.299 3.962 1.00 0.00 H new ATOM 0 HG LEU A 125 13.616 12.938 6.201 1.00 0.00 H new ATOM 0 HD11 LEU A 125 11.356 11.919 6.193 1.00 0.00 H new ATOM 0 HD12 LEU A 125 11.632 13.035 4.834 1.00 0.00 H new ATOM 0 HD13 LEU A 125 11.681 11.277 4.565 1.00 0.00 H new ATOM 0 HD21 LEU A 125 13.141 10.704 7.208 1.00 0.00 H new ATOM 0 HD22 LEU A 125 13.680 9.940 5.694 1.00 0.00 H new ATOM 0 HD23 LEU A 125 14.829 10.883 6.673 1.00 0.00 H new ATOM 1938 N PHE A 126 16.056 11.402 1.587 1.00 0.00 N ATOM 1939 CA PHE A 126 16.859 11.906 0.477 1.00 0.00 C ATOM 1940 C PHE A 126 16.475 11.238 -0.847 1.00 0.00 C ATOM 1941 O PHE A 126 16.805 11.770 -1.909 1.00 0.00 O ATOM 1942 CB PHE A 126 18.355 11.670 0.756 1.00 0.00 C ATOM 1943 CG PHE A 126 18.901 12.136 2.100 1.00 0.00 C ATOM 1944 CD1 PHE A 126 18.336 13.223 2.799 1.00 0.00 C ATOM 1945 CD2 PHE A 126 20.010 11.469 2.654 1.00 0.00 C ATOM 1946 CE1 PHE A 126 18.855 13.620 4.043 1.00 0.00 C ATOM 1947 CE2 PHE A 126 20.525 11.860 3.902 1.00 0.00 C ATOM 1948 CZ PHE A 126 19.947 12.934 4.600 1.00 0.00 C ATOM 0 H PHE A 126 16.496 10.631 2.089 1.00 0.00 H new ATOM 0 HA PHE A 126 16.664 12.975 0.389 1.00 0.00 H new ATOM 0 HB2 PHE A 126 18.550 10.601 0.666 1.00 0.00 H new ATOM 0 HB3 PHE A 126 18.926 12.165 -0.029 1.00 0.00 H new ATOM 0 HD1 PHE A 126 17.497 13.755 2.374 1.00 0.00 H new ATOM 0 HD2 PHE A 126 20.468 10.652 2.117 1.00 0.00 H new ATOM 0 HE1 PHE A 126 18.414 14.453 4.571 1.00 0.00 H new ATOM 0 HE2 PHE A 126 21.367 11.333 4.326 1.00 0.00 H new ATOM 0 HZ PHE A 126 20.341 13.231 5.561 1.00 0.00 H new ATOM 1958 N LEU A 127 15.810 10.078 -0.797 1.00 0.00 N ATOM 1959 CA LEU A 127 15.467 9.285 -1.976 1.00 0.00 C ATOM 1960 C LEU A 127 14.466 10.043 -2.857 1.00 0.00 C ATOM 1961 O LEU A 127 13.663 10.823 -2.331 1.00 0.00 O ATOM 1962 CB LEU A 127 14.859 7.933 -1.559 1.00 0.00 C ATOM 1963 CG LEU A 127 15.790 7.008 -0.754 1.00 0.00 C ATOM 1964 CD1 LEU A 127 15.019 5.758 -0.317 1.00 0.00 C ATOM 1965 CD2 LEU A 127 17.031 6.583 -1.545 1.00 0.00 C ATOM 0 H LEU A 127 15.492 9.661 0.078 1.00 0.00 H new ATOM 0 HA LEU A 127 16.381 9.106 -2.542 1.00 0.00 H new ATOM 0 HB2 LEU A 127 13.964 8.124 -0.966 1.00 0.00 H new ATOM 0 HB3 LEU A 127 14.540 7.405 -2.458 1.00 0.00 H new ATOM 0 HG LEU A 127 16.132 7.574 0.113 1.00 0.00 H new ATOM 0 HD11 LEU A 127 15.679 5.104 0.253 1.00 0.00 H new ATOM 0 HD12 LEU A 127 14.173 6.051 0.305 1.00 0.00 H new ATOM 0 HD13 LEU A 127 14.655 5.228 -1.198 1.00 0.00 H new ATOM 0 HD21 LEU A 127 17.651 5.932 -0.928 1.00 0.00 H new ATOM 0 HD22 LEU A 127 16.724 6.047 -2.443 1.00 0.00 H new ATOM 0 HD23 LEU A 127 17.603 7.467 -1.828 1.00 0.00 H new ATOM 1977 N PRO A 128 14.473 9.810 -4.180 1.00 0.00 N ATOM 1978 CA PRO A 128 13.527 10.428 -5.094 1.00 0.00 C ATOM 1979 C PRO A 128 12.139 9.826 -4.864 1.00 0.00 C ATOM 1980 O PRO A 128 12.005 8.651 -4.511 1.00 0.00 O ATOM 1981 CB PRO A 128 14.069 10.146 -6.497 1.00 0.00 C ATOM 1982 CG PRO A 128 14.822 8.826 -6.331 1.00 0.00 C ATOM 1983 CD PRO A 128 15.333 8.879 -4.890 1.00 0.00 C ATOM 0 HA PRO A 128 13.422 11.503 -4.946 1.00 0.00 H new ATOM 0 HB2 PRO A 128 13.265 10.060 -7.228 1.00 0.00 H new ATOM 0 HB3 PRO A 128 14.728 10.943 -6.840 1.00 0.00 H new ATOM 0 HG2 PRO A 128 14.168 7.969 -6.493 1.00 0.00 H new ATOM 0 HG3 PRO A 128 15.642 8.740 -7.044 1.00 0.00 H new ATOM 0 HD2 PRO A 128 15.299 7.891 -4.430 1.00 0.00 H new ATOM 0 HD3 PRO A 128 16.371 9.209 -4.859 1.00 0.00 H new ATOM 1991 N TYR A 129 11.103 10.642 -5.031 1.00 0.00 N ATOM 1992 CA TYR A 129 9.731 10.239 -4.763 1.00 0.00 C ATOM 1993 C TYR A 129 9.110 9.575 -5.991 1.00 0.00 C ATOM 1994 O TYR A 129 9.584 9.715 -7.122 1.00 0.00 O ATOM 1995 CB TYR A 129 8.910 11.472 -4.368 1.00 0.00 C ATOM 1996 CG TYR A 129 9.482 12.340 -3.264 1.00 0.00 C ATOM 1997 CD1 TYR A 129 10.192 11.779 -2.186 1.00 0.00 C ATOM 1998 CD2 TYR A 129 9.316 13.733 -3.340 1.00 0.00 C ATOM 1999 CE1 TYR A 129 10.727 12.609 -1.184 1.00 0.00 C ATOM 2000 CE2 TYR A 129 9.821 14.567 -2.333 1.00 0.00 C ATOM 2001 CZ TYR A 129 10.536 14.011 -1.253 1.00 0.00 C ATOM 2002 OH TYR A 129 10.981 14.841 -0.274 1.00 0.00 O ATOM 0 H TYR A 129 11.194 11.604 -5.357 1.00 0.00 H new ATOM 0 HA TYR A 129 9.730 9.516 -3.947 1.00 0.00 H new ATOM 0 HB2 TYR A 129 8.777 12.092 -5.255 1.00 0.00 H new ATOM 0 HB3 TYR A 129 7.919 11.138 -4.061 1.00 0.00 H new ATOM 0 HD1 TYR A 129 10.326 10.709 -2.128 1.00 0.00 H new ATOM 0 HD2 TYR A 129 8.795 14.165 -4.182 1.00 0.00 H new ATOM 0 HE1 TYR A 129 11.282 12.178 -0.364 1.00 0.00 H new ATOM 0 HE2 TYR A 129 9.663 15.634 -2.385 1.00 0.00 H new ATOM 0 HH TYR A 129 10.756 15.767 -0.503 1.00 0.00 H new ATOM 2012 N HIS A 130 8.002 8.874 -5.767 1.00 0.00 N ATOM 2013 CA HIS A 130 7.210 8.193 -6.773 1.00 0.00 C ATOM 2014 C HIS A 130 5.738 8.459 -6.475 1.00 0.00 C ATOM 2015 O HIS A 130 5.364 8.819 -5.360 1.00 0.00 O ATOM 2016 CB HIS A 130 7.529 6.685 -6.746 1.00 0.00 C ATOM 2017 CG HIS A 130 8.952 6.310 -7.095 1.00 0.00 C ATOM 2018 ND1 HIS A 130 10.082 6.591 -6.366 1.00 0.00 N flip ATOM 2019 CD2 HIS A 130 9.333 5.557 -8.187 1.00 0.00 C flip ATOM 2020 CE1 HIS A 130 11.165 6.047 -7.063 1.00 0.00 C flip ATOM 2021 NE2 HIS A 130 10.670 5.433 -8.148 1.00 0.00 N flip ATOM 0 H HIS A 130 7.617 8.763 -4.829 1.00 0.00 H new ATOM 0 HA HIS A 130 7.444 8.561 -7.772 1.00 0.00 H new ATOM 0 HB2 HIS A 130 7.306 6.303 -5.750 1.00 0.00 H new ATOM 0 HB3 HIS A 130 6.858 6.178 -7.440 1.00 0.00 H new ATOM 0 HD1 HIS A 130 10.123 7.100 -5.483 1.00 0.00 H new ATOM 0 HD2 HIS A 130 8.675 5.143 -8.937 1.00 0.00 H new ATOM 0 HE1 HIS A 130 12.206 6.109 -6.781 1.00 0.00 H new ATOM 2029 N GLU A 131 4.902 8.270 -7.489 1.00 0.00 N ATOM 2030 CA GLU A 131 3.446 8.355 -7.402 1.00 0.00 C ATOM 2031 C GLU A 131 2.819 6.967 -7.242 1.00 0.00 C ATOM 2032 O GLU A 131 1.604 6.835 -7.135 1.00 0.00 O ATOM 2033 CB GLU A 131 2.949 8.984 -8.708 1.00 0.00 C ATOM 2034 CG GLU A 131 2.833 10.500 -8.601 1.00 0.00 C ATOM 2035 CD GLU A 131 2.308 11.067 -9.920 1.00 0.00 C ATOM 2036 OE1 GLU A 131 3.104 11.084 -10.886 1.00 0.00 O ATOM 2037 OE2 GLU A 131 1.116 11.453 -10.019 1.00 0.00 O ATOM 0 H GLU A 131 5.229 8.045 -8.429 1.00 0.00 H new ATOM 0 HA GLU A 131 3.163 8.951 -6.534 1.00 0.00 H new ATOM 0 HB2 GLU A 131 3.633 8.729 -9.517 1.00 0.00 H new ATOM 0 HB3 GLU A 131 1.978 8.563 -8.967 1.00 0.00 H new ATOM 0 HG2 GLU A 131 2.161 10.767 -7.785 1.00 0.00 H new ATOM 0 HG3 GLU A 131 3.805 10.934 -8.368 1.00 0.00 H new ATOM 2044 N SER A 132 3.617 5.909 -7.315 1.00 0.00 N ATOM 2045 CA SER A 132 3.152 4.535 -7.412 1.00 0.00 C ATOM 2046 C SER A 132 4.330 3.572 -7.210 1.00 0.00 C ATOM 2047 O SER A 132 5.433 4.002 -6.868 1.00 0.00 O ATOM 2048 CB SER A 132 2.406 4.391 -8.755 1.00 0.00 C ATOM 2049 OG SER A 132 3.244 4.673 -9.862 1.00 0.00 O ATOM 0 H SER A 132 4.634 5.988 -7.308 1.00 0.00 H new ATOM 0 HA SER A 132 2.445 4.272 -6.625 1.00 0.00 H new ATOM 0 HB2 SER A 132 2.015 3.378 -8.845 1.00 0.00 H new ATOM 0 HB3 SER A 132 1.550 5.065 -8.768 1.00 0.00 H new ATOM 0 HG SER A 132 2.735 4.569 -10.693 1.00 0.00 H new ATOM 2055 N TYR A 133 4.096 2.270 -7.362 1.00 0.00 N ATOM 2056 CA TYR A 133 4.981 1.174 -6.982 1.00 0.00 C ATOM 2057 C TYR A 133 4.567 -0.024 -7.818 1.00 0.00 C ATOM 2058 O TYR A 133 4.023 -1.026 -7.333 1.00 0.00 O ATOM 2059 CB TYR A 133 4.872 0.887 -5.480 1.00 0.00 C ATOM 2060 CG TYR A 133 3.570 1.203 -4.779 1.00 0.00 C ATOM 2061 CD1 TYR A 133 2.315 1.018 -5.391 1.00 0.00 C ATOM 2062 CD2 TYR A 133 3.657 1.751 -3.491 1.00 0.00 C ATOM 2063 CE1 TYR A 133 1.154 1.439 -4.717 1.00 0.00 C ATOM 2064 CE2 TYR A 133 2.500 2.136 -2.800 1.00 0.00 C ATOM 2065 CZ TYR A 133 1.244 1.994 -3.418 1.00 0.00 C ATOM 2066 OH TYR A 133 0.133 2.395 -2.742 1.00 0.00 O ATOM 0 H TYR A 133 3.229 1.933 -7.780 1.00 0.00 H new ATOM 0 HA TYR A 133 6.026 1.421 -7.168 1.00 0.00 H new ATOM 0 HB2 TYR A 133 5.082 -0.172 -5.328 1.00 0.00 H new ATOM 0 HB3 TYR A 133 5.663 1.444 -4.978 1.00 0.00 H new ATOM 0 HD1 TYR A 133 2.245 0.559 -6.366 1.00 0.00 H new ATOM 0 HD2 TYR A 133 4.624 1.877 -3.027 1.00 0.00 H new ATOM 0 HE1 TYR A 133 0.190 1.338 -5.193 1.00 0.00 H new ATOM 0 HE2 TYR A 133 2.572 2.539 -1.800 1.00 0.00 H new ATOM 0 HH TYR A 133 -0.436 1.619 -2.559 1.00 0.00 H new ATOM 2076 N ASP A 134 4.697 0.145 -9.122 1.00 0.00 N ATOM 2077 CA ASP A 134 3.947 -0.637 -10.074 1.00 0.00 C ATOM 2078 C ASP A 134 4.964 -1.517 -10.780 1.00 0.00 C ATOM 2079 O ASP A 134 5.974 -1.026 -11.289 1.00 0.00 O ATOM 2080 CB ASP A 134 3.111 0.297 -10.955 1.00 0.00 C ATOM 2081 CG ASP A 134 1.920 0.938 -10.214 1.00 0.00 C ATOM 2082 OD1 ASP A 134 1.852 0.971 -8.961 1.00 0.00 O ATOM 2083 OD2 ASP A 134 0.981 1.396 -10.903 1.00 0.00 O ATOM 0 H ASP A 134 5.326 0.828 -9.545 1.00 0.00 H new ATOM 0 HA ASP A 134 3.202 -1.300 -9.634 1.00 0.00 H new ATOM 0 HB2 ASP A 134 3.753 1.086 -11.346 1.00 0.00 H new ATOM 0 HB3 ASP A 134 2.737 -0.263 -11.812 1.00 0.00 H new ATOM 2088 N SER A 135 4.746 -2.834 -10.719 1.00 0.00 N ATOM 2089 CA SER A 135 5.742 -3.823 -11.127 1.00 0.00 C ATOM 2090 C SER A 135 6.145 -3.649 -12.587 1.00 0.00 C ATOM 2091 O SER A 135 7.285 -3.928 -12.937 1.00 0.00 O ATOM 2092 CB SER A 135 5.199 -5.240 -10.946 1.00 0.00 C ATOM 2093 OG SER A 135 6.276 -6.156 -10.910 1.00 0.00 O ATOM 0 H SER A 135 3.873 -3.242 -10.385 1.00 0.00 H new ATOM 0 HA SER A 135 6.616 -3.669 -10.494 1.00 0.00 H new ATOM 0 HB2 SER A 135 4.621 -5.305 -10.024 1.00 0.00 H new ATOM 0 HB3 SER A 135 4.523 -5.489 -11.764 1.00 0.00 H new ATOM 0 HG SER A 135 5.929 -7.065 -10.792 1.00 0.00 H new ATOM 2099 N GLU A 136 5.224 -3.196 -13.440 1.00 0.00 N ATOM 2100 CA GLU A 136 5.501 -2.992 -14.852 1.00 0.00 C ATOM 2101 C GLU A 136 5.976 -1.556 -15.137 1.00 0.00 C ATOM 2102 O GLU A 136 6.015 -1.131 -16.292 1.00 0.00 O ATOM 2103 CB GLU A 136 4.298 -3.432 -15.705 1.00 0.00 C ATOM 2104 CG GLU A 136 3.005 -2.672 -15.374 1.00 0.00 C ATOM 2105 CD GLU A 136 1.811 -3.130 -16.221 1.00 0.00 C ATOM 2106 OE1 GLU A 136 1.926 -3.349 -17.450 1.00 0.00 O ATOM 2107 OE2 GLU A 136 0.728 -3.337 -15.632 1.00 0.00 O ATOM 0 H GLU A 136 4.269 -2.963 -13.166 1.00 0.00 H new ATOM 0 HA GLU A 136 6.336 -3.629 -15.144 1.00 0.00 H new ATOM 0 HB2 GLU A 136 4.537 -3.287 -16.759 1.00 0.00 H new ATOM 0 HB3 GLU A 136 4.130 -4.499 -15.560 1.00 0.00 H new ATOM 0 HG2 GLU A 136 2.769 -2.808 -14.319 1.00 0.00 H new ATOM 0 HG3 GLU A 136 3.166 -1.605 -15.529 1.00 0.00 H new ATOM 2114 N GLY A 137 6.304 -0.779 -14.104 1.00 0.00 N ATOM 2115 CA GLY A 137 6.673 0.622 -14.213 1.00 0.00 C ATOM 2116 C GLY A 137 8.015 0.840 -14.912 1.00 0.00 C ATOM 2117 O GLY A 137 8.815 -0.091 -15.062 1.00 0.00 O ATOM 0 H GLY A 137 6.319 -1.122 -13.144 1.00 0.00 H new ATOM 0 HA2 GLY A 137 5.895 1.154 -14.761 1.00 0.00 H new ATOM 0 HA3 GLY A 137 6.716 1.058 -13.215 1.00 0.00 H new ATOM 2121 N PRO A 138 8.314 2.091 -15.296 1.00 0.00 N ATOM 2122 CA PRO A 138 9.563 2.455 -15.952 1.00 0.00 C ATOM 2123 C PRO A 138 10.750 2.450 -14.981 1.00 0.00 C ATOM 2124 O PRO A 138 11.896 2.564 -15.423 1.00 0.00 O ATOM 2125 CB PRO A 138 9.314 3.859 -16.507 1.00 0.00 C ATOM 2126 CG PRO A 138 8.348 4.467 -15.494 1.00 0.00 C ATOM 2127 CD PRO A 138 7.483 3.272 -15.106 1.00 0.00 C ATOM 0 HA PRO A 138 9.828 1.738 -16.729 1.00 0.00 H new ATOM 0 HB2 PRO A 138 10.237 4.434 -16.578 1.00 0.00 H new ATOM 0 HB3 PRO A 138 8.881 3.826 -17.507 1.00 0.00 H new ATOM 0 HG2 PRO A 138 8.871 4.885 -14.634 1.00 0.00 H new ATOM 0 HG3 PRO A 138 7.756 5.272 -15.930 1.00 0.00 H new ATOM 0 HD2 PRO A 138 7.150 3.352 -14.071 1.00 0.00 H new ATOM 0 HD3 PRO A 138 6.588 3.222 -15.726 1.00 0.00 H new ATOM 2135 N HIS A 139 10.498 2.321 -13.675 1.00 0.00 N ATOM 2136 CA HIS A 139 11.484 2.640 -12.658 1.00 0.00 C ATOM 2137 C HIS A 139 12.522 1.549 -12.425 1.00 0.00 C ATOM 2138 O HIS A 139 13.565 1.837 -11.846 1.00 0.00 O ATOM 2139 CB HIS A 139 10.795 2.987 -11.335 1.00 0.00 C ATOM 2140 CG HIS A 139 9.553 3.834 -11.447 1.00 0.00 C ATOM 2141 ND1 HIS A 139 9.479 5.187 -11.687 1.00 0.00 N ATOM 2142 CD2 HIS A 139 8.279 3.375 -11.276 1.00 0.00 C ATOM 2143 CE1 HIS A 139 8.180 5.535 -11.662 1.00 0.00 C ATOM 2144 NE2 HIS A 139 7.407 4.462 -11.417 1.00 0.00 N ATOM 0 H HIS A 139 9.607 1.994 -13.302 1.00 0.00 H new ATOM 0 HA HIS A 139 12.029 3.502 -13.043 1.00 0.00 H new ATOM 0 HB2 HIS A 139 10.534 2.058 -10.828 1.00 0.00 H new ATOM 0 HB3 HIS A 139 11.511 3.507 -10.699 1.00 0.00 H new ATOM 0 HD2 HIS A 139 7.994 2.354 -11.069 1.00 0.00 H new ATOM 0 HE1 HIS A 139 7.809 6.537 -11.817 1.00 0.00 H new ATOM 0 HE2 HIS A 139 6.390 4.444 -11.348 1.00 0.00 H new ATOM 2152 N GLY A 140 12.255 0.311 -12.843 1.00 0.00 N ATOM 2153 CA GLY A 140 13.180 -0.809 -12.684 1.00 0.00 C ATOM 2154 C GLY A 140 13.225 -1.393 -11.266 1.00 0.00 C ATOM 2155 O GLY A 140 13.628 -2.547 -11.124 1.00 0.00 O ATOM 0 H GLY A 140 11.382 0.056 -13.306 1.00 0.00 H new ATOM 0 HA2 GLY A 140 12.899 -1.599 -13.381 1.00 0.00 H new ATOM 0 HA3 GLY A 140 14.182 -0.480 -12.961 1.00 0.00 H new ATOM 2159 N LEU A 141 12.777 -0.650 -10.247 1.00 0.00 N ATOM 2160 CA LEU A 141 12.661 -1.088 -8.858 1.00 0.00 C ATOM 2161 C LEU A 141 11.495 -2.064 -8.707 1.00 0.00 C ATOM 2162 O LEU A 141 10.331 -1.647 -8.702 1.00 0.00 O ATOM 2163 CB LEU A 141 12.583 0.103 -7.869 1.00 0.00 C ATOM 2164 CG LEU A 141 11.942 1.450 -8.260 1.00 0.00 C ATOM 2165 CD1 LEU A 141 10.411 1.417 -8.196 1.00 0.00 C ATOM 2166 CD2 LEU A 141 12.471 2.567 -7.341 1.00 0.00 C ATOM 0 H LEU A 141 12.473 0.315 -10.378 1.00 0.00 H new ATOM 0 HA LEU A 141 13.573 -1.622 -8.592 1.00 0.00 H new ATOM 0 HB2 LEU A 141 12.050 -0.255 -6.988 1.00 0.00 H new ATOM 0 HB3 LEU A 141 13.605 0.320 -7.557 1.00 0.00 H new ATOM 0 HG LEU A 141 12.220 1.647 -9.295 1.00 0.00 H new ATOM 0 HD11 LEU A 141 10.014 2.391 -8.481 1.00 0.00 H new ATOM 0 HD12 LEU A 141 10.035 0.657 -8.881 1.00 0.00 H new ATOM 0 HD13 LEU A 141 10.094 1.179 -7.180 1.00 0.00 H new ATOM 0 HD21 LEU A 141 12.015 3.516 -7.622 1.00 0.00 H new ATOM 0 HD22 LEU A 141 12.220 2.336 -6.306 1.00 0.00 H new ATOM 0 HD23 LEU A 141 13.554 2.641 -7.444 1.00 0.00 H new ATOM 2178 N ARG A 142 11.778 -3.371 -8.634 1.00 0.00 N ATOM 2179 CA ARG A 142 10.745 -4.409 -8.615 1.00 0.00 C ATOM 2180 C ARG A 142 10.917 -5.310 -7.400 1.00 0.00 C ATOM 2181 O ARG A 142 12.061 -5.657 -7.099 1.00 0.00 O ATOM 2182 CB ARG A 142 10.779 -5.286 -9.885 1.00 0.00 C ATOM 2183 CG ARG A 142 11.057 -4.641 -11.251 1.00 0.00 C ATOM 2184 CD ARG A 142 10.194 -3.424 -11.632 1.00 0.00 C ATOM 2185 NE ARG A 142 10.519 -2.893 -12.978 1.00 0.00 N ATOM 2186 CZ ARG A 142 10.391 -3.585 -14.123 1.00 0.00 C ATOM 2187 NH1 ARG A 142 9.614 -4.660 -14.188 1.00 0.00 N ATOM 2188 NH2 ARG A 142 11.051 -3.211 -15.208 1.00 0.00 N ATOM 0 H ARG A 142 12.729 -3.736 -8.587 1.00 0.00 H new ATOM 0 HA ARG A 142 9.785 -3.894 -8.572 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.535 -6.055 -9.729 1.00 0.00 H new ATOM 0 HB3 ARG A 142 9.817 -5.794 -9.955 1.00 0.00 H new ATOM 0 HG2 ARG A 142 12.103 -4.337 -11.277 1.00 0.00 H new ATOM 0 HG3 ARG A 142 10.928 -5.403 -12.019 1.00 0.00 H new ATOM 0 HD2 ARG A 142 9.141 -3.706 -11.601 1.00 0.00 H new ATOM 0 HD3 ARG A 142 10.335 -2.637 -10.891 1.00 0.00 H new ATOM 0 HE ARG A 142 10.864 -1.935 -13.039 1.00 0.00 H new ATOM 0 HH11 ARG A 142 9.104 -4.971 -13.361 1.00 0.00 H new ATOM 0 HH12 ARG A 142 9.527 -5.174 -15.065 1.00 0.00 H new ATOM 0 HH21 ARG A 142 11.661 -2.394 -15.178 1.00 0.00 H new ATOM 0 HH22 ARG A 142 10.950 -3.740 -16.074 1.00 0.00 H new ATOM 2202 N TYR A 143 9.826 -5.688 -6.719 1.00 0.00 N ATOM 2203 CA TYR A 143 9.948 -6.546 -5.527 1.00 0.00 C ATOM 2204 C TYR A 143 10.652 -7.841 -5.919 1.00 0.00 C ATOM 2205 O TYR A 143 10.505 -8.321 -7.046 1.00 0.00 O ATOM 2206 CB TYR A 143 8.610 -6.895 -4.846 1.00 0.00 C ATOM 2207 CG TYR A 143 8.758 -7.578 -3.483 1.00 0.00 C ATOM 2208 CD1 TYR A 143 9.387 -6.930 -2.397 1.00 0.00 C ATOM 2209 CD2 TYR A 143 8.231 -8.869 -3.280 1.00 0.00 C ATOM 2210 CE1 TYR A 143 9.546 -7.590 -1.165 1.00 0.00 C ATOM 2211 CE2 TYR A 143 8.318 -9.505 -2.030 1.00 0.00 C ATOM 2212 CZ TYR A 143 9.003 -8.878 -0.970 1.00 0.00 C ATOM 2213 OH TYR A 143 9.117 -9.490 0.243 1.00 0.00 O ATOM 0 H TYR A 143 8.872 -5.423 -6.963 1.00 0.00 H new ATOM 0 HA TYR A 143 10.519 -5.970 -4.799 1.00 0.00 H new ATOM 0 HB2 TYR A 143 8.030 -5.981 -4.721 1.00 0.00 H new ATOM 0 HB3 TYR A 143 8.038 -7.547 -5.506 1.00 0.00 H new ATOM 0 HD1 TYR A 143 9.749 -5.919 -2.513 1.00 0.00 H new ATOM 0 HD2 TYR A 143 7.751 -9.380 -4.101 1.00 0.00 H new ATOM 0 HE1 TYR A 143 10.087 -7.108 -0.364 1.00 0.00 H new ATOM 0 HE2 TYR A 143 7.861 -10.472 -1.882 1.00 0.00 H new ATOM 0 HH TYR A 143 8.688 -10.370 0.207 1.00 0.00 H new ATOM 2223 N ASN A 144 11.411 -8.412 -4.989 1.00 0.00 N ATOM 2224 CA ASN A 144 12.196 -9.613 -5.229 1.00 0.00 C ATOM 2225 C ASN A 144 11.967 -10.582 -4.065 1.00 0.00 C ATOM 2226 O ASN A 144 12.755 -10.569 -3.123 1.00 0.00 O ATOM 2227 CB ASN A 144 13.678 -9.247 -5.433 1.00 0.00 C ATOM 2228 CG ASN A 144 14.024 -9.129 -6.911 1.00 0.00 C ATOM 2229 OD1 ASN A 144 14.547 -10.080 -7.489 1.00 0.00 O ATOM 2230 ND2 ASN A 144 13.754 -8.006 -7.555 1.00 0.00 N ATOM 0 H ASN A 144 11.498 -8.049 -4.040 1.00 0.00 H new ATOM 0 HA ASN A 144 11.880 -10.111 -6.146 1.00 0.00 H new ATOM 0 HB2 ASN A 144 13.894 -8.304 -4.931 1.00 0.00 H new ATOM 0 HB3 ASN A 144 14.309 -10.006 -4.970 1.00 0.00 H new ATOM 0 HD21 ASN A 144 13.980 -7.919 -8.546 1.00 0.00 H new ATOM 0 HD22 ASN A 144 13.320 -7.226 -7.061 1.00 0.00 H new ATOM 2237 N PRO A 145 10.914 -11.416 -4.087 1.00 0.00 N ATOM 2238 CA PRO A 145 10.632 -12.427 -3.061 1.00 0.00 C ATOM 2239 C PRO A 145 11.615 -13.615 -3.070 1.00 0.00 C ATOM 2240 O PRO A 145 11.410 -14.574 -2.321 1.00 0.00 O ATOM 2241 CB PRO A 145 9.203 -12.901 -3.330 1.00 0.00 C ATOM 2242 CG PRO A 145 9.093 -12.735 -4.837 1.00 0.00 C ATOM 2243 CD PRO A 145 9.889 -11.469 -5.122 1.00 0.00 C ATOM 0 HA PRO A 145 10.750 -11.987 -2.071 1.00 0.00 H new ATOM 0 HB2 PRO A 145 9.051 -13.935 -3.021 1.00 0.00 H new ATOM 0 HB3 PRO A 145 8.466 -12.299 -2.798 1.00 0.00 H new ATOM 0 HG2 PRO A 145 9.506 -13.594 -5.365 1.00 0.00 H new ATOM 0 HG3 PRO A 145 8.055 -12.635 -5.154 1.00 0.00 H new ATOM 0 HD2 PRO A 145 10.335 -11.501 -6.116 1.00 0.00 H new ATOM 0 HD3 PRO A 145 9.250 -10.587 -5.088 1.00 0.00 H new ATOM 2251 N ARG A 146 12.657 -13.584 -3.916 1.00 0.00 N ATOM 2252 CA ARG A 146 13.709 -14.590 -4.016 1.00 0.00 C ATOM 2253 C ARG A 146 13.136 -15.951 -4.419 1.00 0.00 C ATOM 2254 O ARG A 146 13.549 -16.988 -3.903 1.00 0.00 O ATOM 2255 CB ARG A 146 14.498 -14.591 -2.700 1.00 0.00 C ATOM 2256 CG ARG A 146 15.740 -15.482 -2.741 1.00 0.00 C ATOM 2257 CD ARG A 146 16.879 -14.883 -1.915 1.00 0.00 C ATOM 2258 NE ARG A 146 18.046 -15.761 -2.005 1.00 0.00 N ATOM 2259 CZ ARG A 146 19.293 -15.503 -1.611 1.00 0.00 C ATOM 2260 NH1 ARG A 146 19.624 -14.404 -0.944 1.00 0.00 N ATOM 2261 NH2 ARG A 146 20.241 -16.369 -1.912 1.00 0.00 N ATOM 0 H ARG A 146 12.789 -12.818 -4.577 1.00 0.00 H new ATOM 0 HA ARG A 146 14.410 -14.349 -4.815 1.00 0.00 H new ATOM 0 HB2 ARG A 146 14.799 -13.570 -2.464 1.00 0.00 H new ATOM 0 HB3 ARG A 146 13.846 -14.926 -1.893 1.00 0.00 H new ATOM 0 HG2 ARG A 146 15.493 -16.473 -2.359 1.00 0.00 H new ATOM 0 HG3 ARG A 146 16.065 -15.610 -3.774 1.00 0.00 H new ATOM 0 HD2 ARG A 146 17.128 -13.888 -2.283 1.00 0.00 H new ATOM 0 HD3 ARG A 146 16.571 -14.771 -0.875 1.00 0.00 H new ATOM 0 HE ARG A 146 17.886 -16.680 -2.418 1.00 0.00 H new ATOM 0 HH11 ARG A 146 18.910 -13.714 -0.712 1.00 0.00 H new ATOM 0 HH12 ARG A 146 20.592 -14.250 -0.663 1.00 0.00 H new ATOM 0 HH21 ARG A 146 20.012 -17.214 -2.435 1.00 0.00 H new ATOM 0 HH22 ARG A 146 21.203 -16.194 -1.621 1.00 0.00 H new ATOM 2275 N GLU A 147 12.222 -15.973 -5.387 1.00 0.00 N ATOM 2276 CA GLU A 147 11.586 -17.190 -5.854 1.00 0.00 C ATOM 2277 C GLU A 147 12.617 -18.217 -6.315 1.00 0.00 C ATOM 2278 O GLU A 147 12.547 -19.390 -5.951 1.00 0.00 O ATOM 2279 CB GLU A 147 10.621 -16.903 -7.006 1.00 0.00 C ATOM 2280 CG GLU A 147 9.541 -15.869 -6.702 1.00 0.00 C ATOM 2281 CD GLU A 147 8.291 -16.014 -7.577 1.00 0.00 C ATOM 2282 OE1 GLU A 147 8.400 -16.311 -8.790 1.00 0.00 O ATOM 2283 OE2 GLU A 147 7.178 -15.839 -7.033 1.00 0.00 O ATOM 0 H GLU A 147 11.903 -15.134 -5.871 1.00 0.00 H new ATOM 0 HA GLU A 147 11.030 -17.598 -5.010 1.00 0.00 H new ATOM 0 HB2 GLU A 147 11.197 -16.562 -7.866 1.00 0.00 H new ATOM 0 HB3 GLU A 147 10.138 -17.836 -7.296 1.00 0.00 H new ATOM 0 HG2 GLU A 147 9.253 -15.954 -5.654 1.00 0.00 H new ATOM 0 HG3 GLU A 147 9.956 -14.871 -6.839 1.00 0.00 H new ATOM 2290 N ASN A 148 13.579 -17.770 -7.117 1.00 0.00 N ATOM 2291 CA ASN A 148 14.523 -18.623 -7.832 1.00 0.00 C ATOM 2292 C ASN A 148 15.906 -17.969 -7.887 1.00 0.00 C ATOM 2293 O ASN A 148 16.611 -18.125 -8.882 1.00 0.00 O ATOM 2294 CB ASN A 148 13.958 -18.964 -9.229 1.00 0.00 C ATOM 2295 CG ASN A 148 13.819 -17.762 -10.163 1.00 0.00 C ATOM 2296 OD1 ASN A 148 14.684 -17.466 -10.976 1.00 0.00 O ATOM 2297 ND2 ASN A 148 12.692 -17.077 -10.158 1.00 0.00 N ATOM 0 H ASN A 148 13.727 -16.776 -7.292 1.00 0.00 H new ATOM 0 HA ASN A 148 14.653 -19.564 -7.297 1.00 0.00 H new ATOM 0 HB2 ASN A 148 14.607 -19.702 -9.700 1.00 0.00 H new ATOM 0 HB3 ASN A 148 12.980 -19.430 -9.108 1.00 0.00 H new ATOM 0 HD21 ASN A 148 12.554 -16.317 -10.824 1.00 0.00 H new ATOM 0 HD22 ASN A 148 11.958 -17.308 -9.488 1.00 0.00 H new ATOM 2304 N ARG A 149 16.271 -17.180 -6.862 1.00 0.00 N ATOM 2305 CA ARG A 149 17.470 -16.339 -6.936 1.00 0.00 C ATOM 2306 C ARG A 149 18.704 -17.144 -7.312 1.00 0.00 C ATOM 2307 O ARG A 149 19.458 -16.705 -8.201 1.00 0.00 O ATOM 2308 CB ARG A 149 17.722 -15.476 -5.705 1.00 0.00 C ATOM 2309 CG ARG A 149 18.858 -14.491 -6.003 1.00 0.00 C ATOM 2310 CD ARG A 149 18.980 -13.392 -4.944 1.00 0.00 C ATOM 2311 NE ARG A 149 19.343 -12.106 -5.561 1.00 0.00 N ATOM 2312 CZ ARG A 149 20.417 -11.818 -6.304 1.00 0.00 C ATOM 2313 NH1 ARG A 149 21.420 -12.675 -6.471 1.00 0.00 N ATOM 2314 NH2 ARG A 149 20.474 -10.632 -6.897 1.00 0.00 N ATOM 0 H ARG A 149 15.757 -17.109 -5.984 1.00 0.00 H new ATOM 0 HA ARG A 149 17.261 -15.633 -7.739 1.00 0.00 H new ATOM 0 HB2 ARG A 149 16.816 -14.934 -5.435 1.00 0.00 H new ATOM 0 HB3 ARG A 149 17.983 -16.104 -4.853 1.00 0.00 H new ATOM 0 HG2 ARG A 149 19.800 -15.037 -6.065 1.00 0.00 H new ATOM 0 HG3 ARG A 149 18.690 -14.033 -6.978 1.00 0.00 H new ATOM 0 HD2 ARG A 149 18.035 -13.290 -4.410 1.00 0.00 H new ATOM 0 HD3 ARG A 149 19.734 -13.672 -4.208 1.00 0.00 H new ATOM 0 HE ARG A 149 18.693 -11.337 -5.402 1.00 0.00 H new ATOM 0 HH11 ARG A 149 21.388 -13.591 -6.024 1.00 0.00 H new ATOM 0 HH12 ARG A 149 22.222 -12.416 -7.046 1.00 0.00 H new ATOM 0 HH21 ARG A 149 19.710 -9.966 -6.780 1.00 0.00 H new ATOM 0 HH22 ARG A 149 21.282 -10.386 -7.469 1.00 0.00 H new TER 2328 ARG A 149