USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 936 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 89 SER OG : rot -106:sc= -0.946 USER MOD Set 1.2: A 137 LYS NZ :NH3+ -162:sc= -3.74! (180deg=-5.27!) USER MOD Set 1.3: A 142 THR OG1 : rot 74:sc= 0.0381 USER MOD Set 2.1: A 69 SER OG : rot 91:sc= 1.04 USER MOD Set 2.2: A 71 THR OG1 : rot 180:sc= 0.896 USER MOD Single : A 1 MET CE :methyl 143:sc= -0.408 (180deg=-5.31!) USER MOD Single : A 1 MET N :NH3+ 173:sc= 1.23 (180deg=1.18) USER MOD Single : A 5 TYR OH : rot 150:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN : amide:sc= -0.73 K(o=-0.73,f=0) USER MOD Single : A 13 THR OG1 : rot -164:sc= -2.01! USER MOD Single : A 16 GLN : amide:sc= -4.8! C(o=-4.8!,f=-12!) USER MOD Single : A 17 LYS NZ :NH3+ 166:sc= 1.22 (180deg=1.13) USER MOD Single : A 18 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 21 LYS NZ :NH3+ 158:sc= 0 (180deg=-0.141) USER MOD Single : A 35 SER OG : rot -51:sc= 0.574 USER MOD Single : A 37 SER OG : rot 180:sc= -0.077 USER MOD Single : A 38 THR OG1 : rot -160:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 170:sc=-0.000359 (180deg=-0.087) USER MOD Single : A 43 LYS NZ :NH3+ -131:sc= 1.78 (180deg=1.22) USER MOD Single : A 45 MET CE :methyl -138:sc= -5.65! (180deg=-8.24!) USER MOD Single : A 47 MET CE :methyl 180:sc= -2.25! (180deg=-2.25!) USER MOD Single : A 50 GLN : amide:sc= -2.84! K(o=-2.8!,f=-1.4) USER MOD Single : A 51 ASN : amide:sc= -0.368 X(o=-0.37,f=-0.78) USER MOD Single : A 53 THR OG1 : rot -72:sc= 0.0429 USER MOD Single : A 58 GLN : amide:sc=-0.00213 K(o=-0.0021,f=-0.88) USER MOD Single : A 60 MET CE :methyl 152:sc= -3.53! (180deg=-3.96!) USER MOD Single : A 80 MET CE :methyl 168:sc= 0 (180deg=-0.0427) USER MOD Single : A 81 MET CE :methyl -114:sc= -0.682 (180deg=-2.2) USER MOD Single : A 84 SER OG : rot 3:sc= -0.245 USER MOD Single : A 85 MET CE :methyl -165:sc= -5.07! (180deg=-5.28!) USER MOD Single : A 86 LYS NZ :NH3+ -172:sc= -0.0108 (180deg=-0.109) USER MOD Single : A 90 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.105) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 153 MET CE :methyl -116:sc= -9.1! (180deg=-18.4!) USER MOD Single : A 154 MET CE :methyl 151:sc= -2.25 (180deg=-4.83!) USER MOD Single : A 155 GLN : amide:sc= -2.37! C(o=-2.4!,f=-1.5!) USER MOD Single : A 163 LYS NZ :NH3+ -164:sc= -0.0355 (180deg=-0.287) USER MOD Single : A 165 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.095 -10.540 -9.618 1.00 0.00 N ATOM 2 CA MET A 1 -2.839 -10.016 -8.451 1.00 0.00 C ATOM 3 C MET A 1 -3.492 -11.158 -7.683 1.00 0.00 C ATOM 4 O MET A 1 -4.437 -11.778 -8.171 1.00 0.00 O ATOM 5 CB MET A 1 -3.901 -9.018 -8.916 1.00 0.00 C ATOM 6 CG MET A 1 -4.515 -8.216 -7.785 1.00 0.00 C ATOM 7 SD MET A 1 -6.224 -8.638 -7.453 1.00 0.00 S ATOM 8 CE MET A 1 -6.630 -7.341 -6.284 1.00 0.00 C ATOM 0 H1 MET A 1 -1.755 -9.746 -10.198 1.00 0.00 H new ATOM 0 H2 MET A 1 -1.283 -11.101 -9.289 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.723 -11.141 -10.189 1.00 0.00 H new ATOM 0 HA MET A 1 -2.140 -9.507 -7.788 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.453 -8.332 -9.635 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.691 -9.557 -9.439 1.00 0.00 H new ATOM 0 HG2 MET A 1 -3.928 -8.372 -6.880 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.452 -7.155 -8.027 1.00 0.00 H new ATOM 0 HE1 MET A 1 -7.655 -7.010 -6.449 1.00 0.00 H new ATOM 0 HE2 MET A 1 -6.531 -7.723 -5.268 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.951 -6.500 -6.423 1.00 0.00 H new ATOM 20 N ASP A 2 -2.979 -11.439 -6.488 1.00 0.00 N ATOM 21 CA ASP A 2 -3.501 -12.531 -5.671 1.00 0.00 C ATOM 22 C ASP A 2 -4.948 -12.270 -5.282 1.00 0.00 C ATOM 23 O ASP A 2 -5.254 -11.284 -4.601 1.00 0.00 O ATOM 24 CB ASP A 2 -2.648 -12.741 -4.419 1.00 0.00 C ATOM 25 CG ASP A 2 -1.240 -13.201 -4.739 1.00 0.00 C ATOM 26 OD1 ASP A 2 -0.318 -12.357 -4.756 1.00 0.00 O ATOM 27 OD2 ASP A 2 -1.043 -14.410 -4.971 1.00 0.00 O1- ATOM 0 H ASP A 2 -2.205 -10.927 -6.065 1.00 0.00 H new ATOM 0 HA ASP A 2 -3.459 -13.441 -6.270 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -2.602 -11.809 -3.856 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -3.129 -13.478 -3.776 1.00 0.00 H new ATOM 32 N ASP A 3 -5.835 -13.165 -5.703 1.00 0.00 N ATOM 33 CA ASP A 3 -7.270 -12.969 -5.525 1.00 0.00 C ATOM 34 C ASP A 3 -7.711 -13.120 -4.081 1.00 0.00 C ATOM 35 O ASP A 3 -8.864 -12.857 -3.767 1.00 0.00 O ATOM 36 CB ASP A 3 -8.090 -13.909 -6.410 1.00 0.00 C ATOM 37 CG ASP A 3 -7.760 -15.366 -6.179 1.00 0.00 C ATOM 38 OD1 ASP A 3 -8.465 -16.019 -5.381 1.00 0.00 O ATOM 39 OD2 ASP A 3 -6.790 -15.864 -6.785 1.00 0.00 O1- ATOM 0 H ASP A 3 -5.585 -14.036 -6.171 1.00 0.00 H new ATOM 0 HA ASP A 3 -7.460 -11.940 -5.830 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -9.151 -13.747 -6.220 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -7.913 -13.662 -7.457 1.00 0.00 H new ATOM 44 N ILE A 4 -6.821 -13.546 -3.201 1.00 0.00 N ATOM 45 CA ILE A 4 -7.121 -13.502 -1.776 1.00 0.00 C ATOM 46 C ILE A 4 -7.376 -12.055 -1.372 1.00 0.00 C ATOM 47 O ILE A 4 -8.330 -11.740 -0.662 1.00 0.00 O ATOM 48 CB ILE A 4 -5.983 -14.088 -0.907 1.00 0.00 C ATOM 49 CG1 ILE A 4 -6.255 -13.812 0.575 1.00 0.00 C ATOM 50 CG2 ILE A 4 -4.648 -13.507 -1.323 1.00 0.00 C ATOM 51 CD1 ILE A 4 -5.181 -14.330 1.508 1.00 0.00 C ATOM 0 H ILE A 4 -5.902 -13.920 -3.439 1.00 0.00 H new ATOM 0 HA ILE A 4 -8.003 -14.118 -1.604 1.00 0.00 H new ATOM 0 HB ILE A 4 -5.947 -15.167 -1.057 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -6.359 -12.737 0.720 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -7.208 -14.265 0.849 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -3.858 -13.929 -0.702 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -4.456 -13.748 -2.368 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -4.668 -12.424 -1.198 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -5.449 -14.094 2.538 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.091 -15.410 1.395 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -4.229 -13.859 1.264 1.00 0.00 H new ATOM 63 N TYR A 5 -6.527 -11.177 -1.878 1.00 0.00 N ATOM 64 CA TYR A 5 -6.614 -9.775 -1.598 1.00 0.00 C ATOM 65 C TYR A 5 -7.654 -9.120 -2.488 1.00 0.00 C ATOM 66 O TYR A 5 -8.299 -8.146 -2.108 1.00 0.00 O ATOM 67 CB TYR A 5 -5.242 -9.154 -1.799 1.00 0.00 C ATOM 68 CG TYR A 5 -4.177 -9.842 -0.976 1.00 0.00 C ATOM 69 CD1 TYR A 5 -3.005 -10.307 -1.554 1.00 0.00 C ATOM 70 CD2 TYR A 5 -4.370 -10.063 0.378 1.00 0.00 C ATOM 71 CE1 TYR A 5 -2.056 -10.973 -0.801 1.00 0.00 C ATOM 72 CE2 TYR A 5 -3.428 -10.715 1.137 1.00 0.00 C ATOM 73 CZ TYR A 5 -2.272 -11.173 0.546 1.00 0.00 C ATOM 74 OH TYR A 5 -1.335 -11.835 1.305 1.00 0.00 O ATOM 0 H TYR A 5 -5.757 -11.430 -2.497 1.00 0.00 H new ATOM 0 HA TYR A 5 -6.928 -9.619 -0.566 1.00 0.00 H new ATOM 0 HB2 TYR A 5 -4.973 -9.205 -2.854 1.00 0.00 H new ATOM 0 HB3 TYR A 5 -5.280 -8.098 -1.531 1.00 0.00 H new ATOM 0 HD1 TYR A 5 -2.831 -10.146 -2.608 1.00 0.00 H new ATOM 0 HD2 TYR A 5 -5.279 -9.716 0.846 1.00 0.00 H new ATOM 0 HE1 TYR A 5 -1.150 -11.335 -1.265 1.00 0.00 H new ATOM 0 HE2 TYR A 5 -3.594 -10.868 2.193 1.00 0.00 H new ATOM 0 HH TYR A 5 -1.367 -11.503 2.227 1.00 0.00 H new ATOM 84 N LYS A 6 -7.815 -9.666 -3.678 1.00 0.00 N ATOM 85 CA LYS A 6 -8.879 -9.233 -4.566 1.00 0.00 C ATOM 86 C LYS A 6 -10.235 -9.562 -3.965 1.00 0.00 C ATOM 87 O LYS A 6 -11.167 -8.792 -4.102 1.00 0.00 O ATOM 88 CB LYS A 6 -8.758 -9.877 -5.934 1.00 0.00 C ATOM 89 CG LYS A 6 -9.720 -9.285 -6.944 1.00 0.00 C ATOM 90 CD LYS A 6 -10.014 -10.250 -8.081 1.00 0.00 C ATOM 91 CE LYS A 6 -10.703 -11.513 -7.583 1.00 0.00 C ATOM 92 NZ LYS A 6 -11.249 -12.321 -8.701 1.00 0.00 N1+ ATOM 0 H LYS A 6 -7.225 -10.409 -4.052 1.00 0.00 H new ATOM 0 HA LYS A 6 -8.787 -8.154 -4.687 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -7.737 -9.759 -6.298 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.943 -10.947 -5.845 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -10.651 -9.018 -6.445 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -9.300 -8.364 -7.349 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -10.645 -9.759 -8.821 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -9.083 -10.516 -8.582 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -9.994 -12.113 -7.013 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -11.510 -11.242 -6.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -11.710 -13.172 -8.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -11.945 -11.757 -9.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -10.475 -12.601 -9.337 1.00 0.00 H new ATOM 106 N ALA A 7 -10.338 -10.706 -3.294 1.00 0.00 N ATOM 107 CA ALA A 7 -11.575 -11.088 -2.619 1.00 0.00 C ATOM 108 C ALA A 7 -11.887 -10.114 -1.492 1.00 0.00 C ATOM 109 O ALA A 7 -13.046 -9.909 -1.124 1.00 0.00 O ATOM 110 CB ALA A 7 -11.487 -12.508 -2.088 1.00 0.00 C ATOM 0 H ALA A 7 -9.581 -11.384 -3.203 1.00 0.00 H new ATOM 0 HA ALA A 7 -12.386 -11.049 -3.346 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -12.421 -12.769 -1.590 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -11.313 -13.196 -2.916 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -10.664 -12.580 -1.377 1.00 0.00 H new ATOM 116 N ALA A 8 -10.834 -9.528 -0.940 1.00 0.00 N ATOM 117 CA ALA A 8 -10.969 -8.436 0.007 1.00 0.00 C ATOM 118 C ALA A 8 -11.518 -7.209 -0.708 1.00 0.00 C ATOM 119 O ALA A 8 -12.441 -6.557 -0.224 1.00 0.00 O ATOM 120 CB ALA A 8 -9.626 -8.126 0.639 1.00 0.00 C ATOM 0 H ALA A 8 -9.869 -9.795 -1.136 1.00 0.00 H new ATOM 0 HA ALA A 8 -11.662 -8.725 0.797 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -9.738 -7.305 1.348 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -9.257 -9.009 1.161 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -8.916 -7.841 -0.137 1.00 0.00 H new ATOM 126 N VAL A 9 -10.942 -6.918 -1.875 1.00 0.00 N ATOM 127 CA VAL A 9 -11.431 -5.851 -2.745 1.00 0.00 C ATOM 128 C VAL A 9 -12.876 -6.124 -3.171 1.00 0.00 C ATOM 129 O VAL A 9 -13.660 -5.204 -3.377 1.00 0.00 O ATOM 130 CB VAL A 9 -10.547 -5.705 -4.015 1.00 0.00 C ATOM 131 CG1 VAL A 9 -11.197 -4.796 -5.059 1.00 0.00 C ATOM 132 CG2 VAL A 9 -9.166 -5.184 -3.652 1.00 0.00 C ATOM 0 H VAL A 9 -10.128 -7.413 -2.241 1.00 0.00 H new ATOM 0 HA VAL A 9 -11.385 -4.923 -2.175 1.00 0.00 H new ATOM 0 HB VAL A 9 -10.447 -6.697 -4.454 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -10.547 -4.720 -5.931 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -12.158 -5.214 -5.358 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -11.350 -3.804 -4.633 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -8.564 -5.089 -4.556 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -9.259 -4.209 -3.174 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -8.683 -5.880 -2.966 1.00 0.00 H new ATOM 142 N GLU A 10 -13.210 -7.398 -3.308 1.00 0.00 N ATOM 143 CA GLU A 10 -14.556 -7.811 -3.663 1.00 0.00 C ATOM 144 C GLU A 10 -15.545 -7.426 -2.568 1.00 0.00 C ATOM 145 O GLU A 10 -16.720 -7.183 -2.840 1.00 0.00 O ATOM 146 CB GLU A 10 -14.598 -9.306 -3.936 1.00 0.00 C ATOM 147 CG GLU A 10 -13.822 -9.695 -5.183 1.00 0.00 C ATOM 148 CD GLU A 10 -14.384 -9.054 -6.435 1.00 0.00 C ATOM 149 OE1 GLU A 10 -15.502 -9.429 -6.846 1.00 0.00 O ATOM 150 OE2 GLU A 10 -13.713 -8.182 -7.022 1.00 0.00 O1- ATOM 0 H GLU A 10 -12.557 -8.171 -3.177 1.00 0.00 H new ATOM 0 HA GLU A 10 -14.848 -7.291 -4.575 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -14.190 -9.840 -3.078 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -15.635 -9.623 -4.045 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.779 -9.402 -5.065 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -13.838 -10.779 -5.294 1.00 0.00 H new ATOM 157 N GLN A 11 -15.062 -7.379 -1.330 1.00 0.00 N ATOM 158 CA GLN A 11 -15.839 -6.832 -0.230 1.00 0.00 C ATOM 159 C GLN A 11 -15.732 -5.317 -0.214 1.00 0.00 C ATOM 160 O GLN A 11 -16.712 -4.621 0.069 1.00 0.00 O ATOM 161 CB GLN A 11 -15.378 -7.386 1.101 1.00 0.00 C ATOM 162 CG GLN A 11 -16.089 -6.729 2.238 1.00 0.00 C ATOM 163 CD GLN A 11 -15.576 -7.154 3.599 1.00 0.00 C ATOM 164 OE1 GLN A 11 -15.634 -6.391 4.564 1.00 0.00 O ATOM 165 NE2 GLN A 11 -15.054 -8.367 3.689 1.00 0.00 N ATOM 0 H GLN A 11 -14.135 -7.714 -1.066 1.00 0.00 H new ATOM 0 HA GLN A 11 -16.878 -7.124 -0.382 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -15.555 -8.461 1.131 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -14.303 -7.237 1.207 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -15.989 -5.648 2.142 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -17.153 -6.958 2.172 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -15.023 -8.971 2.868 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -14.683 -8.698 4.580 1.00 0.00 H new ATOM 174 N LEU A 12 -14.539 -4.813 -0.512 1.00 0.00 N ATOM 175 CA LEU A 12 -14.327 -3.392 -0.619 1.00 0.00 C ATOM 176 C LEU A 12 -15.281 -2.800 -1.621 1.00 0.00 C ATOM 177 O LEU A 12 -15.507 -3.341 -2.704 1.00 0.00 O ATOM 178 CB LEU A 12 -12.899 -3.078 -1.028 1.00 0.00 C ATOM 179 CG LEU A 12 -11.837 -3.374 0.010 1.00 0.00 C ATOM 180 CD1 LEU A 12 -10.466 -2.963 -0.493 1.00 0.00 C ATOM 181 CD2 LEU A 12 -12.184 -2.642 1.278 1.00 0.00 C ATOM 0 H LEU A 12 -13.707 -5.378 -0.683 1.00 0.00 H new ATOM 0 HA LEU A 12 -14.509 -2.952 0.362 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -12.666 -3.644 -1.930 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -12.840 -2.022 -1.290 1.00 0.00 H new ATOM 0 HG LEU A 12 -11.805 -4.446 0.206 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -9.718 -3.184 0.268 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -10.232 -3.515 -1.403 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -10.462 -1.894 -0.706 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -11.427 -2.846 2.035 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -12.220 -1.571 1.081 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -13.157 -2.978 1.638 1.00 0.00 H new ATOM 193 N THR A 13 -15.847 -1.693 -1.250 1.00 0.00 N ATOM 194 CA THR A 13 -16.770 -1.014 -2.106 1.00 0.00 C ATOM 195 C THR A 13 -15.971 -0.110 -3.022 1.00 0.00 C ATOM 196 O THR A 13 -14.841 0.229 -2.679 1.00 0.00 O ATOM 197 CB THR A 13 -17.787 -0.216 -1.262 1.00 0.00 C ATOM 198 OG1 THR A 13 -17.211 1.022 -0.818 1.00 0.00 O ATOM 199 CG2 THR A 13 -18.188 -1.030 -0.033 1.00 0.00 C ATOM 0 H THR A 13 -15.684 -1.237 -0.352 1.00 0.00 H new ATOM 0 HA THR A 13 -17.340 -1.723 -2.706 1.00 0.00 H new ATOM 0 HB THR A 13 -18.659 -0.011 -1.882 1.00 0.00 H new ATOM 0 HG1 THR A 13 -17.754 1.393 -0.092 1.00 0.00 H new ATOM 0 HG21 THR A 13 -18.906 -0.464 0.560 1.00 0.00 H new ATOM 0 HG22 THR A 13 -18.641 -1.969 -0.351 1.00 0.00 H new ATOM 0 HG23 THR A 13 -17.304 -1.239 0.569 1.00 0.00 H new ATOM 207 N GLU A 14 -16.494 0.232 -4.191 1.00 0.00 N ATOM 208 CA GLU A 14 -15.790 1.152 -5.086 1.00 0.00 C ATOM 209 C GLU A 14 -15.306 2.355 -4.294 1.00 0.00 C ATOM 210 O GLU A 14 -14.182 2.806 -4.458 1.00 0.00 O ATOM 211 CB GLU A 14 -16.709 1.626 -6.198 1.00 0.00 C ATOM 212 CG GLU A 14 -16.731 0.699 -7.392 1.00 0.00 C ATOM 213 CD GLU A 14 -17.122 -0.715 -7.037 1.00 0.00 C ATOM 214 OE1 GLU A 14 -18.248 -0.921 -6.549 1.00 0.00 O ATOM 215 OE2 GLU A 14 -16.305 -1.627 -7.253 1.00 0.00 O1- ATOM 0 H GLU A 14 -17.390 -0.106 -4.542 1.00 0.00 H new ATOM 0 HA GLU A 14 -14.943 0.627 -5.528 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -17.721 1.726 -5.806 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -16.394 2.618 -6.523 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -17.429 1.087 -8.133 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -15.745 0.691 -7.857 1.00 0.00 H new ATOM 222 N GLU A 15 -16.184 2.842 -3.428 1.00 0.00 N ATOM 223 CA GLU A 15 -15.864 3.907 -2.485 1.00 0.00 C ATOM 224 C GLU A 15 -14.638 3.554 -1.636 1.00 0.00 C ATOM 225 O GLU A 15 -13.670 4.309 -1.603 1.00 0.00 O ATOM 226 CB GLU A 15 -17.063 4.156 -1.578 1.00 0.00 C ATOM 227 CG GLU A 15 -16.863 5.288 -0.594 1.00 0.00 C ATOM 228 CD GLU A 15 -18.030 5.419 0.354 1.00 0.00 C ATOM 229 OE1 GLU A 15 -19.037 6.051 -0.020 1.00 0.00 O ATOM 230 OE2 GLU A 15 -17.954 4.877 1.473 1.00 0.00 O1- ATOM 0 H GLU A 15 -17.145 2.508 -3.359 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.631 4.808 -3.053 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -17.934 4.374 -2.196 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -17.284 3.243 -1.026 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -15.949 5.117 -0.024 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -16.730 6.223 -1.138 1.00 0.00 H new ATOM 237 N GLN A 16 -14.700 2.417 -0.934 1.00 0.00 N ATOM 238 CA GLN A 16 -13.583 1.925 -0.141 1.00 0.00 C ATOM 239 C GLN A 16 -12.299 1.851 -0.963 1.00 0.00 C ATOM 240 O GLN A 16 -11.267 2.404 -0.584 1.00 0.00 O ATOM 241 CB GLN A 16 -13.934 0.557 0.421 1.00 0.00 C ATOM 242 CG GLN A 16 -15.071 0.641 1.407 1.00 0.00 C ATOM 243 CD GLN A 16 -15.353 -0.647 2.155 1.00 0.00 C ATOM 244 OE1 GLN A 16 -15.166 -1.739 1.628 1.00 0.00 O ATOM 245 NE2 GLN A 16 -15.815 -0.528 3.390 1.00 0.00 N ATOM 0 H GLN A 16 -15.525 1.819 -0.904 1.00 0.00 H new ATOM 0 HA GLN A 16 -13.403 2.624 0.676 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -14.206 -0.114 -0.394 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -13.059 0.127 0.909 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -14.850 1.425 2.131 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -15.974 0.943 0.876 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -15.958 0.398 3.794 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -16.028 -1.362 3.937 1.00 0.00 H new ATOM 254 N LYS A 17 -12.389 1.156 -2.085 1.00 0.00 N ATOM 255 CA LYS A 17 -11.312 1.044 -3.049 1.00 0.00 C ATOM 256 C LYS A 17 -10.789 2.413 -3.474 1.00 0.00 C ATOM 257 O LYS A 17 -9.584 2.657 -3.470 1.00 0.00 O ATOM 258 CB LYS A 17 -11.861 0.292 -4.249 1.00 0.00 C ATOM 259 CG LYS A 17 -12.358 -1.097 -3.876 1.00 0.00 C ATOM 260 CD LYS A 17 -13.362 -1.652 -4.877 1.00 0.00 C ATOM 261 CE LYS A 17 -12.934 -1.395 -6.301 1.00 0.00 C ATOM 262 NZ LYS A 17 -13.750 -2.154 -7.284 1.00 0.00 N1+ ATOM 0 H LYS A 17 -13.230 0.645 -2.354 1.00 0.00 H new ATOM 0 HA LYS A 17 -10.470 0.514 -2.603 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -12.678 0.862 -4.691 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -11.084 0.207 -5.009 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -11.508 -1.776 -3.806 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -12.818 -1.060 -2.889 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -13.477 -2.724 -4.720 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -14.338 -1.198 -4.703 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -13.012 -0.329 -6.514 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -11.885 -1.667 -6.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -13.586 -1.774 -8.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -13.479 -3.158 -7.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -14.758 -2.062 -7.044 1.00 0.00 H new ATOM 276 N ASN A 18 -11.710 3.292 -3.830 1.00 0.00 N ATOM 277 CA ASN A 18 -11.390 4.652 -4.249 1.00 0.00 C ATOM 278 C ASN A 18 -10.685 5.400 -3.148 1.00 0.00 C ATOM 279 O ASN A 18 -9.821 6.240 -3.396 1.00 0.00 O ATOM 280 CB ASN A 18 -12.663 5.397 -4.581 1.00 0.00 C ATOM 281 CG ASN A 18 -12.413 6.786 -5.141 1.00 0.00 C ATOM 282 OD1 ASN A 18 -11.400 7.033 -5.796 1.00 0.00 O ATOM 283 ND2 ASN A 18 -13.340 7.700 -4.899 1.00 0.00 N ATOM 0 H ASN A 18 -12.708 3.084 -3.838 1.00 0.00 H new ATOM 0 HA ASN A 18 -10.741 4.590 -5.123 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -13.237 4.818 -5.305 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -13.274 5.479 -3.682 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -13.228 8.648 -5.260 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -14.166 7.457 -4.352 1.00 0.00 H new ATOM 290 N GLU A 19 -11.072 5.106 -1.924 1.00 0.00 N ATOM 291 CA GLU A 19 -10.489 5.767 -0.792 1.00 0.00 C ATOM 292 C GLU A 19 -9.027 5.364 -0.676 1.00 0.00 C ATOM 293 O GLU A 19 -8.173 6.159 -0.290 1.00 0.00 O ATOM 294 CB GLU A 19 -11.231 5.429 0.494 1.00 0.00 C ATOM 295 CG GLU A 19 -10.703 6.177 1.705 1.00 0.00 C ATOM 296 CD GLU A 19 -11.562 5.977 2.930 1.00 0.00 C ATOM 297 OE1 GLU A 19 -12.579 6.685 3.076 1.00 0.00 O ATOM 298 OE2 GLU A 19 -11.240 5.092 3.747 1.00 0.00 O1- ATOM 0 H GLU A 19 -11.786 4.415 -1.696 1.00 0.00 H new ATOM 0 HA GLU A 19 -10.566 6.844 -0.942 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -12.289 5.659 0.366 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -11.157 4.357 0.677 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -9.688 5.844 1.919 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -10.647 7.241 1.475 1.00 0.00 H new ATOM 305 N PHE A 20 -8.742 4.118 -1.025 1.00 0.00 N ATOM 306 CA PHE A 20 -7.373 3.655 -1.079 1.00 0.00 C ATOM 307 C PHE A 20 -6.674 4.260 -2.297 1.00 0.00 C ATOM 308 O PHE A 20 -5.484 4.520 -2.267 1.00 0.00 O ATOM 309 CB PHE A 20 -7.309 2.125 -1.114 1.00 0.00 C ATOM 310 CG PHE A 20 -7.828 1.464 0.137 1.00 0.00 C ATOM 311 CD1 PHE A 20 -7.273 1.756 1.372 1.00 0.00 C ATOM 312 CD2 PHE A 20 -8.863 0.544 0.079 1.00 0.00 C ATOM 313 CE1 PHE A 20 -7.737 1.143 2.519 1.00 0.00 C ATOM 314 CE2 PHE A 20 -9.331 -0.070 1.219 1.00 0.00 C ATOM 315 CZ PHE A 20 -8.768 0.228 2.443 1.00 0.00 C ATOM 0 H PHE A 20 -9.440 3.417 -1.273 1.00 0.00 H new ATOM 0 HA PHE A 20 -6.856 3.982 -0.177 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -7.884 1.766 -1.968 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -6.275 1.818 -1.274 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -6.467 2.472 1.439 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -9.309 0.305 -0.875 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -7.294 1.379 3.475 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -10.138 -0.785 1.155 1.00 0.00 H new ATOM 0 HZ PHE A 20 -9.133 -0.253 3.339 1.00 0.00 H new ATOM 325 N LYS A 21 -7.428 4.496 -3.365 1.00 0.00 N ATOM 326 CA LYS A 21 -6.902 5.212 -4.529 1.00 0.00 C ATOM 327 C LYS A 21 -6.474 6.611 -4.133 1.00 0.00 C ATOM 328 O LYS A 21 -5.483 7.144 -4.631 1.00 0.00 O ATOM 329 CB LYS A 21 -7.946 5.311 -5.624 1.00 0.00 C ATOM 330 CG LYS A 21 -7.444 6.018 -6.876 1.00 0.00 C ATOM 331 CD LYS A 21 -6.271 5.292 -7.500 1.00 0.00 C ATOM 332 CE LYS A 21 -5.883 5.894 -8.840 1.00 0.00 C ATOM 333 NZ LYS A 21 -5.438 7.308 -8.722 1.00 0.00 N1+ ATOM 0 H LYS A 21 -8.402 4.205 -3.452 1.00 0.00 H new ATOM 0 HA LYS A 21 -6.045 4.653 -4.903 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -8.278 4.308 -5.891 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -8.816 5.843 -5.239 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -8.254 6.091 -7.602 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -7.149 7.037 -6.624 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -5.418 5.331 -6.823 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -6.524 4.240 -7.634 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -5.083 5.301 -9.283 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -6.734 5.840 -9.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -4.850 7.556 -9.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -6.269 7.932 -8.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -4.883 7.426 -7.850 1.00 0.00 H new ATOM 347 N ALA A 22 -7.258 7.199 -3.255 1.00 0.00 N ATOM 348 CA ALA A 22 -6.926 8.485 -2.669 1.00 0.00 C ATOM 349 C ALA A 22 -5.629 8.391 -1.877 1.00 0.00 C ATOM 350 O ALA A 22 -4.806 9.302 -1.905 1.00 0.00 O ATOM 351 CB ALA A 22 -8.066 8.964 -1.791 1.00 0.00 C ATOM 0 H ALA A 22 -8.139 6.804 -2.927 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.778 9.211 -3.468 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -7.809 9.929 -1.355 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -8.970 9.066 -2.392 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -8.240 8.241 -0.994 1.00 0.00 H new ATOM 357 N ALA A 23 -5.441 7.275 -1.186 1.00 0.00 N ATOM 358 CA ALA A 23 -4.213 7.046 -0.445 1.00 0.00 C ATOM 359 C ALA A 23 -3.069 6.787 -1.409 1.00 0.00 C ATOM 360 O ALA A 23 -1.953 7.241 -1.186 1.00 0.00 O ATOM 361 CB ALA A 23 -4.384 5.902 0.531 1.00 0.00 C ATOM 0 H ALA A 23 -6.122 6.518 -1.124 1.00 0.00 H new ATOM 0 HA ALA A 23 -3.975 7.938 0.135 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -3.453 5.747 1.076 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -5.181 6.140 1.235 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -4.641 4.994 -0.014 1.00 0.00 H new ATOM 367 N PHE A 24 -3.368 6.058 -2.484 1.00 0.00 N ATOM 368 CA PHE A 24 -2.442 5.896 -3.602 1.00 0.00 C ATOM 369 C PHE A 24 -1.964 7.264 -4.052 1.00 0.00 C ATOM 370 O PHE A 24 -0.772 7.539 -4.133 1.00 0.00 O ATOM 371 CB PHE A 24 -3.140 5.221 -4.788 1.00 0.00 C ATOM 372 CG PHE A 24 -2.252 5.042 -5.994 1.00 0.00 C ATOM 373 CD1 PHE A 24 -1.002 4.440 -5.891 1.00 0.00 C ATOM 374 CD2 PHE A 24 -2.673 5.483 -7.237 1.00 0.00 C ATOM 375 CE1 PHE A 24 -0.202 4.290 -7.002 1.00 0.00 C ATOM 376 CE2 PHE A 24 -1.875 5.332 -8.349 1.00 0.00 C ATOM 377 CZ PHE A 24 -0.639 4.735 -8.231 1.00 0.00 C ATOM 0 H PHE A 24 -4.254 5.566 -2.603 1.00 0.00 H new ATOM 0 HA PHE A 24 -1.606 5.279 -3.273 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.510 4.245 -4.473 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -4.009 5.815 -5.073 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -0.656 4.087 -4.931 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -3.641 5.952 -7.336 1.00 0.00 H new ATOM 0 HE1 PHE A 24 0.768 3.824 -6.910 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -2.217 5.681 -9.312 1.00 0.00 H new ATOM 0 HZ PHE A 24 -0.012 4.616 -9.102 1.00 0.00 H new ATOM 387 N ASP A 25 -2.945 8.103 -4.329 1.00 0.00 N ATOM 388 CA ASP A 25 -2.733 9.458 -4.819 1.00 0.00 C ATOM 389 C ASP A 25 -1.767 10.242 -3.944 1.00 0.00 C ATOM 390 O ASP A 25 -0.786 10.799 -4.429 1.00 0.00 O ATOM 391 CB ASP A 25 -4.060 10.194 -4.861 1.00 0.00 C ATOM 392 CG ASP A 25 -4.045 11.365 -5.819 1.00 0.00 C ATOM 393 OD1 ASP A 25 -4.545 12.443 -5.443 1.00 0.00 O ATOM 394 OD2 ASP A 25 -3.538 11.213 -6.952 1.00 0.00 O1- ATOM 0 H ASP A 25 -3.930 7.860 -4.219 1.00 0.00 H new ATOM 0 HA ASP A 25 -2.299 9.379 -5.816 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -4.847 9.500 -5.154 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -4.305 10.551 -3.861 1.00 0.00 H new ATOM 399 N ILE A 26 -2.059 10.288 -2.653 1.00 0.00 N ATOM 400 CA ILE A 26 -1.249 11.046 -1.706 1.00 0.00 C ATOM 401 C ILE A 26 0.101 10.365 -1.499 1.00 0.00 C ATOM 402 O ILE A 26 1.126 11.027 -1.304 1.00 0.00 O ATOM 403 CB ILE A 26 -1.984 11.197 -0.361 1.00 0.00 C ATOM 404 CG1 ILE A 26 -3.400 11.714 -0.613 1.00 0.00 C ATOM 405 CG2 ILE A 26 -1.233 12.142 0.572 1.00 0.00 C ATOM 406 CD1 ILE A 26 -4.302 11.661 0.604 1.00 0.00 C ATOM 0 H ILE A 26 -2.855 9.807 -2.234 1.00 0.00 H new ATOM 0 HA ILE A 26 -1.079 12.041 -2.118 1.00 0.00 H new ATOM 0 HB ILE A 26 -2.033 10.222 0.123 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -3.342 12.744 -0.965 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -3.852 11.128 -1.413 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -1.775 12.230 1.514 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.235 11.748 0.763 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -1.152 13.124 0.107 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -5.288 12.045 0.343 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -4.393 10.630 0.945 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -3.875 12.270 1.400 1.00 0.00 H new ATOM 418 N PHE A 27 0.089 9.036 -1.567 1.00 0.00 N ATOM 419 CA PHE A 27 1.304 8.232 -1.489 1.00 0.00 C ATOM 420 C PHE A 27 2.299 8.718 -2.535 1.00 0.00 C ATOM 421 O PHE A 27 3.486 8.880 -2.263 1.00 0.00 O ATOM 422 CB PHE A 27 0.964 6.769 -1.767 1.00 0.00 C ATOM 423 CG PHE A 27 1.599 5.761 -0.858 1.00 0.00 C ATOM 424 CD1 PHE A 27 2.926 5.408 -1.000 1.00 0.00 C ATOM 425 CD2 PHE A 27 0.841 5.120 0.103 1.00 0.00 C ATOM 426 CE1 PHE A 27 3.484 4.439 -0.194 1.00 0.00 C ATOM 427 CE2 PHE A 27 1.397 4.157 0.920 1.00 0.00 C ATOM 428 CZ PHE A 27 2.721 3.813 0.768 1.00 0.00 C ATOM 0 H PHE A 27 -0.764 8.487 -1.678 1.00 0.00 H new ATOM 0 HA PHE A 27 1.738 8.327 -0.494 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -0.118 6.651 -1.708 1.00 0.00 H new ATOM 0 HB3 PHE A 27 1.254 6.538 -2.792 1.00 0.00 H new ATOM 0 HD1 PHE A 27 3.532 5.895 -1.749 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -0.202 5.376 0.216 1.00 0.00 H new ATOM 0 HE1 PHE A 27 4.523 4.169 -0.317 1.00 0.00 H new ATOM 0 HE2 PHE A 27 0.795 3.675 1.676 1.00 0.00 H new ATOM 0 HZ PHE A 27 3.160 3.055 1.400 1.00 0.00 H new ATOM 438 N VAL A 28 1.773 8.984 -3.726 1.00 0.00 N ATOM 439 CA VAL A 28 2.582 9.342 -4.880 1.00 0.00 C ATOM 440 C VAL A 28 2.396 10.797 -5.305 1.00 0.00 C ATOM 441 O VAL A 28 2.618 11.122 -6.472 1.00 0.00 O ATOM 442 CB VAL A 28 2.208 8.469 -6.090 1.00 0.00 C ATOM 443 CG1 VAL A 28 2.480 7.011 -5.812 1.00 0.00 C ATOM 444 CG2 VAL A 28 0.746 8.671 -6.453 1.00 0.00 C ATOM 0 H VAL A 28 0.771 8.957 -3.916 1.00 0.00 H new ATOM 0 HA VAL A 28 3.617 9.186 -4.575 1.00 0.00 H new ATOM 0 HB VAL A 28 2.828 8.775 -6.933 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.206 6.417 -6.684 1.00 0.00 H new ATOM 0 HG12 VAL A 28 3.540 6.873 -5.597 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.891 6.688 -4.954 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.495 8.047 -7.311 1.00 0.00 H new ATOM 0 HG22 VAL A 28 0.119 8.393 -5.606 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.574 9.718 -6.703 1.00 0.00 H new ATOM 454 N LEU A 29 1.957 11.674 -4.412 1.00 0.00 N ATOM 455 CA LEU A 29 1.836 13.075 -4.788 1.00 0.00 C ATOM 456 C LEU A 29 3.208 13.618 -5.153 1.00 0.00 C ATOM 457 O LEU A 29 4.117 13.645 -4.322 1.00 0.00 O ATOM 458 CB LEU A 29 1.209 13.896 -3.659 1.00 0.00 C ATOM 459 CG LEU A 29 -0.316 13.870 -3.603 1.00 0.00 C ATOM 460 CD1 LEU A 29 -0.806 14.462 -2.292 1.00 0.00 C ATOM 461 CD2 LEU A 29 -0.910 14.631 -4.779 1.00 0.00 C ATOM 0 H LEU A 29 1.687 11.451 -3.454 1.00 0.00 H new ATOM 0 HA LEU A 29 1.177 13.154 -5.653 1.00 0.00 H new ATOM 0 HB2 LEU A 29 1.597 13.531 -2.708 1.00 0.00 H new ATOM 0 HB3 LEU A 29 1.535 14.931 -3.761 1.00 0.00 H new ATOM 0 HG LEU A 29 -0.644 12.832 -3.664 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.895 14.437 -2.266 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -0.410 13.881 -1.460 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.465 15.494 -2.209 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -1.998 14.600 -4.720 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.574 15.668 -4.749 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -0.584 14.171 -5.712 1.00 0.00 H new ATOM 473 N GLY A 30 3.361 14.027 -6.403 1.00 0.00 N ATOM 474 CA GLY A 30 4.648 14.489 -6.874 1.00 0.00 C ATOM 475 C GLY A 30 5.532 13.358 -7.343 1.00 0.00 C ATOM 476 O GLY A 30 6.730 13.549 -7.543 1.00 0.00 O ATOM 0 H GLY A 30 2.616 14.047 -7.100 1.00 0.00 H new ATOM 0 HA2 GLY A 30 4.500 15.194 -7.692 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.151 15.031 -6.073 1.00 0.00 H new ATOM 480 N ALA A 31 4.960 12.178 -7.518 1.00 0.00 N ATOM 481 CA ALA A 31 5.740 11.040 -7.965 1.00 0.00 C ATOM 482 C ALA A 31 6.076 11.150 -9.440 1.00 0.00 C ATOM 483 O ALA A 31 5.357 11.789 -10.210 1.00 0.00 O ATOM 484 CB ALA A 31 5.027 9.727 -7.688 1.00 0.00 C ATOM 0 H ALA A 31 3.971 11.986 -7.359 1.00 0.00 H new ATOM 0 HA ALA A 31 6.669 11.048 -7.395 1.00 0.00 H new ATOM 0 HB1 ALA A 31 5.643 8.898 -8.037 1.00 0.00 H new ATOM 0 HB2 ALA A 31 4.855 9.625 -6.616 1.00 0.00 H new ATOM 0 HB3 ALA A 31 4.071 9.715 -8.212 1.00 0.00 H new ATOM 490 N GLU A 32 7.166 10.513 -9.827 1.00 0.00 N ATOM 491 CA GLU A 32 7.656 10.593 -11.190 1.00 0.00 C ATOM 492 C GLU A 32 6.722 9.866 -12.145 1.00 0.00 C ATOM 493 O GLU A 32 6.348 10.395 -13.190 1.00 0.00 O ATOM 494 CB GLU A 32 9.050 9.983 -11.261 1.00 0.00 C ATOM 495 CG GLU A 32 9.746 10.187 -12.592 1.00 0.00 C ATOM 496 CD GLU A 32 11.149 9.624 -12.588 1.00 0.00 C ATOM 497 OE1 GLU A 32 11.308 8.415 -12.846 1.00 0.00 O ATOM 498 OE2 GLU A 32 12.095 10.385 -12.313 1.00 0.00 O1- ATOM 0 H GLU A 32 7.732 9.930 -9.211 1.00 0.00 H new ATOM 0 HA GLU A 32 7.697 11.641 -11.487 1.00 0.00 H new ATOM 0 HB2 GLU A 32 9.665 10.415 -10.471 1.00 0.00 H new ATOM 0 HB3 GLU A 32 8.978 8.914 -11.060 1.00 0.00 H new ATOM 0 HG2 GLU A 32 9.166 9.710 -13.382 1.00 0.00 H new ATOM 0 HG3 GLU A 32 9.783 11.252 -12.823 1.00 0.00 H new ATOM 505 N ASP A 33 6.325 8.663 -11.761 1.00 0.00 N ATOM 506 CA ASP A 33 5.487 7.824 -12.601 1.00 0.00 C ATOM 507 C ASP A 33 4.042 7.867 -12.139 1.00 0.00 C ATOM 508 O ASP A 33 3.126 7.476 -12.864 1.00 0.00 O ATOM 509 CB ASP A 33 5.976 6.379 -12.565 1.00 0.00 C ATOM 510 CG ASP A 33 7.432 6.235 -12.940 1.00 0.00 C ATOM 511 OD1 ASP A 33 7.742 6.268 -14.149 1.00 0.00 O ATOM 512 OD2 ASP A 33 8.273 6.079 -12.027 1.00 0.00 O1- ATOM 0 H ASP A 33 6.573 8.244 -10.865 1.00 0.00 H new ATOM 0 HA ASP A 33 5.549 8.208 -13.619 1.00 0.00 H new ATOM 0 HB2 ASP A 33 5.823 5.975 -11.564 1.00 0.00 H new ATOM 0 HB3 ASP A 33 5.371 5.780 -13.246 1.00 0.00 H new ATOM 517 N GLY A 34 3.846 8.337 -10.918 1.00 0.00 N ATOM 518 CA GLY A 34 2.524 8.338 -10.324 1.00 0.00 C ATOM 519 C GLY A 34 2.233 7.029 -9.628 1.00 0.00 C ATOM 520 O GLY A 34 1.161 6.836 -9.070 1.00 0.00 O ATOM 0 H GLY A 34 4.582 8.720 -10.324 1.00 0.00 H new ATOM 0 HA2 GLY A 34 2.445 9.157 -9.610 1.00 0.00 H new ATOM 0 HA3 GLY A 34 1.776 8.515 -11.097 1.00 0.00 H new ATOM 524 N SER A 35 3.200 6.128 -9.688 1.00 0.00 N ATOM 525 CA SER A 35 3.139 4.865 -8.974 1.00 0.00 C ATOM 526 C SER A 35 4.131 4.917 -7.836 1.00 0.00 C ATOM 527 O SER A 35 5.142 5.615 -7.926 1.00 0.00 O ATOM 528 CB SER A 35 3.484 3.707 -9.904 1.00 0.00 C ATOM 529 OG SER A 35 2.580 3.641 -10.994 1.00 0.00 O ATOM 0 H SER A 35 4.052 6.253 -10.235 1.00 0.00 H new ATOM 0 HA SER A 35 2.130 4.707 -8.594 1.00 0.00 H new ATOM 0 HB2 SER A 35 4.501 3.827 -10.278 1.00 0.00 H new ATOM 0 HB3 SER A 35 3.457 2.770 -9.348 1.00 0.00 H new ATOM 0 HG SER A 35 1.660 3.649 -10.657 1.00 0.00 H new ATOM 535 N ILE A 36 3.845 4.190 -6.775 1.00 0.00 N ATOM 536 CA ILE A 36 4.663 4.240 -5.588 1.00 0.00 C ATOM 537 C ILE A 36 6.027 3.685 -5.872 1.00 0.00 C ATOM 538 O ILE A 36 6.197 2.479 -6.028 1.00 0.00 O ATOM 539 CB ILE A 36 4.038 3.436 -4.433 1.00 0.00 C ATOM 540 CG1 ILE A 36 2.617 3.919 -4.158 1.00 0.00 C ATOM 541 CG2 ILE A 36 4.889 3.543 -3.168 1.00 0.00 C ATOM 542 CD1 ILE A 36 1.919 3.110 -3.097 1.00 0.00 C ATOM 0 H ILE A 36 3.048 3.556 -6.714 1.00 0.00 H new ATOM 0 HA ILE A 36 4.735 5.287 -5.292 1.00 0.00 H new ATOM 0 HB ILE A 36 4.002 2.388 -4.730 1.00 0.00 H new ATOM 0 HG12 ILE A 36 2.647 4.964 -3.850 1.00 0.00 H new ATOM 0 HG13 ILE A 36 2.039 3.875 -5.081 1.00 0.00 H new ATOM 0 HG21 ILE A 36 4.425 2.966 -2.368 1.00 0.00 H new ATOM 0 HG22 ILE A 36 5.887 3.151 -3.366 1.00 0.00 H new ATOM 0 HG23 ILE A 36 4.963 4.588 -2.866 1.00 0.00 H new ATOM 0 HD11 ILE A 36 0.913 3.500 -2.945 1.00 0.00 H new ATOM 0 HD12 ILE A 36 1.860 2.069 -3.413 1.00 0.00 H new ATOM 0 HD13 ILE A 36 2.478 3.175 -2.164 1.00 0.00 H new ATOM 554 N SER A 37 6.992 4.568 -5.944 1.00 0.00 N ATOM 555 CA SER A 37 8.360 4.158 -6.001 1.00 0.00 C ATOM 556 C SER A 37 8.860 4.079 -4.577 1.00 0.00 C ATOM 557 O SER A 37 8.160 4.504 -3.656 1.00 0.00 O ATOM 558 CB SER A 37 9.192 5.138 -6.832 1.00 0.00 C ATOM 559 OG SER A 37 9.085 6.458 -6.321 1.00 0.00 O ATOM 0 H SER A 37 6.847 5.578 -5.964 1.00 0.00 H new ATOM 0 HA SER A 37 8.452 3.187 -6.488 1.00 0.00 H new ATOM 0 HB2 SER A 37 10.237 4.827 -6.829 1.00 0.00 H new ATOM 0 HB3 SER A 37 8.856 5.117 -7.869 1.00 0.00 H new ATOM 0 HG SER A 37 9.626 7.065 -6.867 1.00 0.00 H new ATOM 565 N THR A 38 10.033 3.545 -4.367 1.00 0.00 N ATOM 566 CA THR A 38 10.556 3.458 -3.027 1.00 0.00 C ATOM 567 C THR A 38 10.821 4.851 -2.470 1.00 0.00 C ATOM 568 O THR A 38 10.853 5.054 -1.257 1.00 0.00 O ATOM 569 CB THR A 38 11.805 2.582 -2.983 1.00 0.00 C ATOM 570 OG1 THR A 38 12.751 3.010 -3.968 1.00 0.00 O ATOM 571 CG2 THR A 38 11.408 1.148 -3.255 1.00 0.00 C ATOM 0 H THR A 38 10.639 3.167 -5.095 1.00 0.00 H new ATOM 0 HA THR A 38 9.809 2.982 -2.392 1.00 0.00 H new ATOM 0 HB THR A 38 12.266 2.664 -1.999 1.00 0.00 H new ATOM 0 HG1 THR A 38 13.382 2.283 -4.153 1.00 0.00 H new ATOM 0 HG21 THR A 38 12.294 0.513 -3.226 1.00 0.00 H new ATOM 0 HG22 THR A 38 10.699 0.817 -2.496 1.00 0.00 H new ATOM 0 HG23 THR A 38 10.945 1.079 -4.239 1.00 0.00 H new ATOM 579 N LYS A 39 10.976 5.809 -3.376 1.00 0.00 N ATOM 580 CA LYS A 39 11.065 7.208 -3.005 1.00 0.00 C ATOM 581 C LYS A 39 9.787 7.635 -2.287 1.00 0.00 C ATOM 582 O LYS A 39 9.839 8.123 -1.162 1.00 0.00 O ATOM 583 CB LYS A 39 11.295 8.069 -4.238 1.00 0.00 C ATOM 584 CG LYS A 39 11.526 9.546 -3.943 1.00 0.00 C ATOM 585 CD LYS A 39 11.683 10.343 -5.230 1.00 0.00 C ATOM 586 CE LYS A 39 11.980 11.812 -4.962 1.00 0.00 C ATOM 587 NZ LYS A 39 13.310 12.014 -4.327 1.00 0.00 N1+ ATOM 0 H LYS A 39 11.043 5.636 -4.379 1.00 0.00 H new ATOM 0 HA LYS A 39 11.911 7.343 -2.331 1.00 0.00 H new ATOM 0 HB2 LYS A 39 12.157 7.681 -4.781 1.00 0.00 H new ATOM 0 HB3 LYS A 39 10.433 7.974 -4.898 1.00 0.00 H new ATOM 0 HG2 LYS A 39 10.689 9.940 -3.367 1.00 0.00 H new ATOM 0 HG3 LYS A 39 12.419 9.662 -3.328 1.00 0.00 H new ATOM 0 HD2 LYS A 39 12.489 9.914 -5.826 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.771 10.260 -5.821 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.940 12.365 -5.900 1.00 0.00 H new ATOM 0 HE3 LYS A 39 11.205 12.225 -4.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 13.540 13.028 -4.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 13.287 11.656 -3.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 14.034 11.499 -4.867 1.00 0.00 H new ATOM 601 N GLU A 40 8.642 7.429 -2.941 1.00 0.00 N ATOM 602 CA GLU A 40 7.345 7.742 -2.362 1.00 0.00 C ATOM 603 C GLU A 40 7.014 6.868 -1.155 1.00 0.00 C ATOM 604 O GLU A 40 6.419 7.329 -0.182 1.00 0.00 O ATOM 605 CB GLU A 40 6.285 7.570 -3.418 1.00 0.00 C ATOM 606 CG GLU A 40 6.465 8.534 -4.561 1.00 0.00 C ATOM 607 CD GLU A 40 6.530 9.984 -4.113 1.00 0.00 C ATOM 608 OE1 GLU A 40 5.466 10.612 -3.943 1.00 0.00 O ATOM 609 OE2 GLU A 40 7.654 10.504 -3.937 1.00 0.00 O1- ATOM 0 H GLU A 40 8.593 7.042 -3.883 1.00 0.00 H new ATOM 0 HA GLU A 40 7.378 8.773 -2.009 1.00 0.00 H new ATOM 0 HB2 GLU A 40 6.314 6.549 -3.797 1.00 0.00 H new ATOM 0 HB3 GLU A 40 5.301 7.717 -2.972 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.380 8.285 -5.098 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.640 8.414 -5.263 1.00 0.00 H new ATOM 616 N LEU A 41 7.387 5.604 -1.229 1.00 0.00 N ATOM 617 CA LEU A 41 7.126 4.666 -0.143 1.00 0.00 C ATOM 618 C LEU A 41 7.913 5.050 1.101 1.00 0.00 C ATOM 619 O LEU A 41 7.361 5.134 2.195 1.00 0.00 O ATOM 620 CB LEU A 41 7.454 3.246 -0.596 1.00 0.00 C ATOM 621 CG LEU A 41 7.147 2.125 0.395 1.00 0.00 C ATOM 622 CD1 LEU A 41 5.896 2.408 1.167 1.00 0.00 C ATOM 623 CD2 LEU A 41 7.008 0.817 -0.335 1.00 0.00 C ATOM 0 H LEU A 41 7.873 5.199 -2.029 1.00 0.00 H new ATOM 0 HA LEU A 41 6.068 4.707 0.117 1.00 0.00 H new ATOM 0 HB2 LEU A 41 6.906 3.047 -1.517 1.00 0.00 H new ATOM 0 HB3 LEU A 41 8.515 3.203 -0.841 1.00 0.00 H new ATOM 0 HG LEU A 41 7.976 2.064 1.100 1.00 0.00 H new ATOM 0 HD11 LEU A 41 5.706 1.591 1.863 1.00 0.00 H new ATOM 0 HD12 LEU A 41 6.014 3.338 1.722 1.00 0.00 H new ATOM 0 HD13 LEU A 41 5.056 2.501 0.478 1.00 0.00 H new ATOM 0 HD21 LEU A 41 6.789 0.023 0.379 1.00 0.00 H new ATOM 0 HD22 LEU A 41 6.196 0.889 -1.058 1.00 0.00 H new ATOM 0 HD23 LEU A 41 7.938 0.590 -0.856 1.00 0.00 H new ATOM 635 N GLY A 42 9.196 5.280 0.926 1.00 0.00 N ATOM 636 CA GLY A 42 10.006 5.797 2.021 1.00 0.00 C ATOM 637 C GLY A 42 9.482 7.122 2.520 1.00 0.00 C ATOM 638 O GLY A 42 9.419 7.357 3.723 1.00 0.00 O ATOM 0 H GLY A 42 9.700 5.122 0.053 1.00 0.00 H new ATOM 0 HA2 GLY A 42 10.015 5.077 2.839 1.00 0.00 H new ATOM 0 HA3 GLY A 42 11.037 5.915 1.688 1.00 0.00 H new ATOM 642 N LYS A 43 9.105 7.978 1.578 1.00 0.00 N ATOM 643 CA LYS A 43 8.439 9.246 1.858 1.00 0.00 C ATOM 644 C LYS A 43 7.274 9.049 2.821 1.00 0.00 C ATOM 645 O LYS A 43 7.129 9.766 3.811 1.00 0.00 O ATOM 646 CB LYS A 43 7.943 9.807 0.533 1.00 0.00 C ATOM 647 CG LYS A 43 6.775 10.759 0.632 1.00 0.00 C ATOM 648 CD LYS A 43 5.959 10.716 -0.648 1.00 0.00 C ATOM 649 CE LYS A 43 4.915 11.810 -0.698 1.00 0.00 C ATOM 650 NZ LYS A 43 4.109 11.732 -1.941 1.00 0.00 N1+ ATOM 0 H LYS A 43 9.255 7.809 0.583 1.00 0.00 H new ATOM 0 HA LYS A 43 9.136 9.938 2.331 1.00 0.00 H new ATOM 0 HB2 LYS A 43 8.770 10.322 0.043 1.00 0.00 H new ATOM 0 HB3 LYS A 43 7.659 8.975 -0.111 1.00 0.00 H new ATOM 0 HG2 LYS A 43 6.148 10.491 1.482 1.00 0.00 H new ATOM 0 HG3 LYS A 43 7.135 11.772 0.809 1.00 0.00 H new ATOM 0 HD2 LYS A 43 6.625 10.813 -1.505 1.00 0.00 H new ATOM 0 HD3 LYS A 43 5.470 9.746 -0.733 1.00 0.00 H new ATOM 0 HE2 LYS A 43 4.259 11.729 0.169 1.00 0.00 H new ATOM 0 HE3 LYS A 43 5.402 12.783 -0.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 4.063 12.671 -2.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 4.551 11.059 -2.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 3.147 11.411 -1.711 1.00 0.00 H new ATOM 664 N VAL A 44 6.460 8.060 2.517 1.00 0.00 N ATOM 665 CA VAL A 44 5.283 7.748 3.301 1.00 0.00 C ATOM 666 C VAL A 44 5.639 7.062 4.617 1.00 0.00 C ATOM 667 O VAL A 44 4.985 7.272 5.628 1.00 0.00 O ATOM 668 CB VAL A 44 4.334 6.870 2.469 1.00 0.00 C ATOM 669 CG1 VAL A 44 3.716 5.775 3.310 1.00 0.00 C ATOM 670 CG2 VAL A 44 3.254 7.723 1.831 1.00 0.00 C ATOM 0 H VAL A 44 6.597 7.446 1.714 1.00 0.00 H new ATOM 0 HA VAL A 44 4.785 8.683 3.557 1.00 0.00 H new ATOM 0 HB VAL A 44 4.919 6.394 1.682 1.00 0.00 H new ATOM 0 HG11 VAL A 44 3.051 5.173 2.691 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.503 5.142 3.719 1.00 0.00 H new ATOM 0 HG13 VAL A 44 3.148 6.220 4.127 1.00 0.00 H new ATOM 0 HG21 VAL A 44 2.589 7.089 1.245 1.00 0.00 H new ATOM 0 HG22 VAL A 44 2.682 8.228 2.609 1.00 0.00 H new ATOM 0 HG23 VAL A 44 3.714 8.466 1.180 1.00 0.00 H new ATOM 680 N MET A 45 6.660 6.236 4.598 1.00 0.00 N ATOM 681 CA MET A 45 7.153 5.606 5.810 1.00 0.00 C ATOM 682 C MET A 45 7.682 6.657 6.765 1.00 0.00 C ATOM 683 O MET A 45 7.511 6.548 7.973 1.00 0.00 O ATOM 684 CB MET A 45 8.240 4.620 5.455 1.00 0.00 C ATOM 685 CG MET A 45 7.701 3.359 4.832 1.00 0.00 C ATOM 686 SD MET A 45 7.145 2.177 6.063 1.00 0.00 S ATOM 687 CE MET A 45 6.739 0.820 4.985 1.00 0.00 C ATOM 0 H MET A 45 7.171 5.981 3.753 1.00 0.00 H new ATOM 0 HA MET A 45 6.337 5.076 6.301 1.00 0.00 H new ATOM 0 HB2 MET A 45 8.940 5.091 4.765 1.00 0.00 H new ATOM 0 HB3 MET A 45 8.801 4.365 6.354 1.00 0.00 H new ATOM 0 HG2 MET A 45 6.872 3.609 4.170 1.00 0.00 H new ATOM 0 HG3 MET A 45 8.474 2.902 4.215 1.00 0.00 H new ATOM 0 HE1 MET A 45 5.803 0.366 5.309 1.00 0.00 H new ATOM 0 HE2 MET A 45 6.631 1.186 3.964 1.00 0.00 H new ATOM 0 HE3 MET A 45 7.535 0.076 5.021 1.00 0.00 H new ATOM 697 N ARG A 46 8.333 7.668 6.203 1.00 0.00 N ATOM 698 CA ARG A 46 8.707 8.859 6.933 1.00 0.00 C ATOM 699 C ARG A 46 7.482 9.489 7.572 1.00 0.00 C ATOM 700 O ARG A 46 7.470 9.796 8.763 1.00 0.00 O ATOM 701 CB ARG A 46 9.349 9.835 5.972 1.00 0.00 C ATOM 702 CG ARG A 46 10.677 9.346 5.438 1.00 0.00 C ATOM 703 CD ARG A 46 11.400 10.452 4.707 1.00 0.00 C ATOM 704 NE ARG A 46 11.645 11.607 5.567 1.00 0.00 N ATOM 705 CZ ARG A 46 12.382 12.654 5.208 1.00 0.00 C ATOM 706 NH1 ARG A 46 13.063 12.632 4.068 1.00 0.00 N1+ ATOM 707 NH2 ARG A 46 12.464 13.712 6.006 1.00 0.00 N ATOM 0 H ARG A 46 8.615 7.679 5.223 1.00 0.00 H new ATOM 0 HA ARG A 46 9.411 8.599 7.723 1.00 0.00 H new ATOM 0 HB2 ARG A 46 8.671 10.015 5.137 1.00 0.00 H new ATOM 0 HB3 ARG A 46 9.495 10.791 6.476 1.00 0.00 H new ATOM 0 HG2 ARG A 46 11.294 8.984 6.260 1.00 0.00 H new ATOM 0 HG3 ARG A 46 10.516 8.504 4.765 1.00 0.00 H new ATOM 0 HD2 ARG A 46 12.349 10.075 4.327 1.00 0.00 H new ATOM 0 HD3 ARG A 46 10.811 10.761 3.843 1.00 0.00 H new ATOM 0 HE ARG A 46 11.226 11.611 6.497 1.00 0.00 H new ATOM 0 HH11 ARG A 46 13.022 11.810 3.465 1.00 0.00 H new ATOM 0 HH12 ARG A 46 13.627 13.437 3.795 1.00 0.00 H new ATOM 0 HH21 ARG A 46 11.962 13.721 6.894 1.00 0.00 H new ATOM 0 HH22 ARG A 46 13.029 14.515 5.731 1.00 0.00 H new ATOM 721 N MET A 47 6.453 9.654 6.751 1.00 0.00 N ATOM 722 CA MET A 47 5.148 10.102 7.175 1.00 0.00 C ATOM 723 C MET A 47 4.600 9.246 8.301 1.00 0.00 C ATOM 724 O MET A 47 3.824 9.698 9.140 1.00 0.00 O ATOM 725 CB MET A 47 4.220 10.009 5.985 1.00 0.00 C ATOM 726 CG MET A 47 4.338 11.174 5.043 1.00 0.00 C ATOM 727 SD MET A 47 2.764 11.983 4.732 1.00 0.00 S ATOM 728 CE MET A 47 1.905 10.684 3.861 1.00 0.00 C ATOM 0 H MET A 47 6.512 9.474 5.749 1.00 0.00 H new ATOM 0 HA MET A 47 5.225 11.124 7.545 1.00 0.00 H new ATOM 0 HB2 MET A 47 4.431 9.088 5.441 1.00 0.00 H new ATOM 0 HB3 MET A 47 3.192 9.941 6.340 1.00 0.00 H new ATOM 0 HG2 MET A 47 5.038 11.900 5.456 1.00 0.00 H new ATOM 0 HG3 MET A 47 4.757 10.829 4.098 1.00 0.00 H new ATOM 0 HE1 MET A 47 0.905 11.025 3.594 1.00 0.00 H new ATOM 0 HE2 MET A 47 2.455 10.428 2.956 1.00 0.00 H new ATOM 0 HE3 MET A 47 1.830 9.805 4.501 1.00 0.00 H new ATOM 738 N LEU A 48 5.025 8.009 8.298 1.00 0.00 N ATOM 739 CA LEU A 48 4.500 7.000 9.160 1.00 0.00 C ATOM 740 C LEU A 48 5.360 6.804 10.404 1.00 0.00 C ATOM 741 O LEU A 48 5.014 6.022 11.287 1.00 0.00 O ATOM 742 CB LEU A 48 4.409 5.749 8.328 1.00 0.00 C ATOM 743 CG LEU A 48 3.064 5.545 7.638 1.00 0.00 C ATOM 744 CD1 LEU A 48 3.069 4.258 6.831 1.00 0.00 C ATOM 745 CD2 LEU A 48 1.931 5.530 8.653 1.00 0.00 C ATOM 0 H LEU A 48 5.763 7.675 7.679 1.00 0.00 H new ATOM 0 HA LEU A 48 3.520 7.284 9.544 1.00 0.00 H new ATOM 0 HB2 LEU A 48 5.192 5.774 7.570 1.00 0.00 H new ATOM 0 HB3 LEU A 48 4.610 4.888 8.966 1.00 0.00 H new ATOM 0 HG LEU A 48 2.902 6.381 6.958 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.101 4.129 6.346 1.00 0.00 H new ATOM 0 HD12 LEU A 48 3.851 4.307 6.073 1.00 0.00 H new ATOM 0 HD13 LEU A 48 3.258 3.414 7.494 1.00 0.00 H new ATOM 0 HD21 LEU A 48 0.982 5.383 8.137 1.00 0.00 H new ATOM 0 HD22 LEU A 48 2.088 4.717 9.362 1.00 0.00 H new ATOM 0 HD23 LEU A 48 1.910 6.479 9.189 1.00 0.00 H new ATOM 757 N GLY A 49 6.470 7.526 10.469 1.00 0.00 N ATOM 758 CA GLY A 49 7.315 7.489 11.638 1.00 0.00 C ATOM 759 C GLY A 49 8.593 6.700 11.433 1.00 0.00 C ATOM 760 O GLY A 49 9.536 6.817 12.219 1.00 0.00 O ATOM 0 H GLY A 49 6.799 8.141 9.725 1.00 0.00 H new ATOM 0 HA2 GLY A 49 7.569 8.509 11.926 1.00 0.00 H new ATOM 0 HA3 GLY A 49 6.757 7.053 12.467 1.00 0.00 H new ATOM 764 N GLN A 50 8.629 5.900 10.383 1.00 0.00 N ATOM 765 CA GLN A 50 9.794 5.105 10.065 1.00 0.00 C ATOM 766 C GLN A 50 10.704 5.885 9.126 1.00 0.00 C ATOM 767 O GLN A 50 10.434 7.042 8.807 1.00 0.00 O ATOM 768 CB GLN A 50 9.389 3.793 9.382 1.00 0.00 C ATOM 769 CG GLN A 50 8.515 2.848 10.214 1.00 0.00 C ATOM 770 CD GLN A 50 7.146 3.400 10.574 1.00 0.00 C ATOM 771 OE1 GLN A 50 6.965 3.987 11.638 1.00 0.00 O ATOM 772 NE2 GLN A 50 6.178 3.223 9.691 1.00 0.00 N ATOM 0 H GLN A 50 7.853 5.785 9.731 1.00 0.00 H new ATOM 0 HA GLN A 50 10.315 4.877 10.995 1.00 0.00 H new ATOM 0 HB2 GLN A 50 8.856 4.034 8.462 1.00 0.00 H new ATOM 0 HB3 GLN A 50 10.296 3.260 9.095 1.00 0.00 H new ATOM 0 HG2 GLN A 50 8.383 1.917 9.662 1.00 0.00 H new ATOM 0 HG3 GLN A 50 9.045 2.600 11.134 1.00 0.00 H new ATOM 0 HE21 GLN A 50 6.368 2.730 8.818 1.00 0.00 H new ATOM 0 HE22 GLN A 50 5.242 3.579 9.882 1.00 0.00 H new ATOM 781 N ASN A 51 11.787 5.252 8.691 1.00 0.00 N ATOM 782 CA ASN A 51 12.599 5.784 7.600 1.00 0.00 C ATOM 783 C ASN A 51 13.368 4.655 6.902 1.00 0.00 C ATOM 784 O ASN A 51 14.594 4.638 6.865 1.00 0.00 O ATOM 785 CB ASN A 51 13.543 6.893 8.091 1.00 0.00 C ATOM 786 CG ASN A 51 14.566 6.435 9.119 1.00 0.00 C ATOM 787 OD1 ASN A 51 15.702 6.096 8.784 1.00 0.00 O ATOM 788 ND2 ASN A 51 14.176 6.420 10.381 1.00 0.00 N ATOM 0 H ASN A 51 12.124 4.370 9.076 1.00 0.00 H new ATOM 0 HA ASN A 51 11.930 6.237 6.869 1.00 0.00 H new ATOM 0 HB2 ASN A 51 14.070 7.312 7.233 1.00 0.00 H new ATOM 0 HB3 ASN A 51 12.947 7.697 8.522 1.00 0.00 H new ATOM 0 HD21 ASN A 51 14.823 6.122 11.111 1.00 0.00 H new ATOM 0 HD22 ASN A 51 13.228 6.707 10.625 1.00 0.00 H new ATOM 795 N PRO A 52 12.625 3.683 6.343 1.00 0.00 N ATOM 796 CA PRO A 52 13.186 2.537 5.618 1.00 0.00 C ATOM 797 C PRO A 52 14.146 2.913 4.505 1.00 0.00 C ATOM 798 O PRO A 52 14.294 4.084 4.146 1.00 0.00 O ATOM 799 CB PRO A 52 11.975 1.897 4.977 1.00 0.00 C ATOM 800 CG PRO A 52 10.839 2.265 5.841 1.00 0.00 C ATOM 801 CD PRO A 52 11.162 3.614 6.393 1.00 0.00 C ATOM 0 HA PRO A 52 13.755 1.910 6.305 1.00 0.00 H new ATOM 0 HB2 PRO A 52 11.830 2.261 3.960 1.00 0.00 H new ATOM 0 HB3 PRO A 52 12.088 0.815 4.915 1.00 0.00 H new ATOM 0 HG2 PRO A 52 9.909 2.288 5.274 1.00 0.00 H new ATOM 0 HG3 PRO A 52 10.706 1.537 6.642 1.00 0.00 H new ATOM 0 HD2 PRO A 52 10.706 4.407 5.800 1.00 0.00 H new ATOM 0 HD3 PRO A 52 10.793 3.726 7.412 1.00 0.00 H new ATOM 809 N THR A 53 14.769 1.903 3.935 1.00 0.00 N ATOM 810 CA THR A 53 15.652 2.115 2.813 1.00 0.00 C ATOM 811 C THR A 53 15.019 1.569 1.548 1.00 0.00 C ATOM 812 O THR A 53 14.087 0.767 1.629 1.00 0.00 O ATOM 813 CB THR A 53 17.023 1.459 3.024 1.00 0.00 C ATOM 814 OG1 THR A 53 16.856 0.111 3.489 1.00 0.00 O ATOM 815 CG2 THR A 53 17.859 2.250 4.020 1.00 0.00 C ATOM 0 H THR A 53 14.679 0.931 4.231 1.00 0.00 H new ATOM 0 HA THR A 53 15.808 3.190 2.720 1.00 0.00 H new ATOM 0 HB THR A 53 17.547 1.450 2.068 1.00 0.00 H new ATOM 0 HG1 THR A 53 16.548 0.122 4.419 1.00 0.00 H new ATOM 0 HG21 THR A 53 18.825 1.763 4.151 1.00 0.00 H new ATOM 0 HG22 THR A 53 18.010 3.262 3.645 1.00 0.00 H new ATOM 0 HG23 THR A 53 17.341 2.292 4.978 1.00 0.00 H new ATOM 823 N PRO A 54 15.491 1.973 0.366 1.00 0.00 N ATOM 824 CA PRO A 54 14.932 1.490 -0.891 1.00 0.00 C ATOM 825 C PRO A 54 15.035 -0.022 -0.974 1.00 0.00 C ATOM 826 O PRO A 54 14.152 -0.693 -1.506 1.00 0.00 O ATOM 827 CB PRO A 54 15.785 2.164 -1.957 1.00 0.00 C ATOM 828 CG PRO A 54 16.403 3.327 -1.272 1.00 0.00 C ATOM 829 CD PRO A 54 16.596 2.914 0.150 1.00 0.00 C ATOM 0 HA PRO A 54 13.873 1.723 -1.003 1.00 0.00 H new ATOM 0 HB2 PRO A 54 16.544 1.484 -2.344 1.00 0.00 H new ATOM 0 HB3 PRO A 54 15.179 2.481 -2.806 1.00 0.00 H new ATOM 0 HG2 PRO A 54 17.354 3.591 -1.734 1.00 0.00 H new ATOM 0 HG3 PRO A 54 15.761 4.205 -1.339 1.00 0.00 H new ATOM 0 HD2 PRO A 54 17.566 2.442 0.306 1.00 0.00 H new ATOM 0 HD3 PRO A 54 16.542 3.765 0.829 1.00 0.00 H new ATOM 837 N GLU A 55 16.110 -0.537 -0.386 1.00 0.00 N ATOM 838 CA GLU A 55 16.326 -1.966 -0.220 1.00 0.00 C ATOM 839 C GLU A 55 15.082 -2.628 0.355 1.00 0.00 C ATOM 840 O GLU A 55 14.556 -3.604 -0.180 1.00 0.00 O ATOM 841 CB GLU A 55 17.463 -2.156 0.765 1.00 0.00 C ATOM 842 CG GLU A 55 18.002 -3.541 0.809 1.00 0.00 C ATOM 843 CD GLU A 55 18.938 -3.763 1.977 1.00 0.00 C ATOM 844 OE1 GLU A 55 20.005 -3.119 2.030 1.00 0.00 O ATOM 845 OE2 GLU A 55 18.612 -4.591 2.851 1.00 0.00 O1- ATOM 0 H GLU A 55 16.864 0.036 -0.007 1.00 0.00 H new ATOM 0 HA GLU A 55 16.555 -2.413 -1.187 1.00 0.00 H new ATOM 0 HB2 GLU A 55 18.271 -1.471 0.508 1.00 0.00 H new ATOM 0 HB3 GLU A 55 17.117 -1.880 1.761 1.00 0.00 H new ATOM 0 HG2 GLU A 55 17.174 -4.247 0.872 1.00 0.00 H new ATOM 0 HG3 GLU A 55 18.531 -3.751 -0.121 1.00 0.00 H new ATOM 852 N GLU A 56 14.634 -2.057 1.452 1.00 0.00 N ATOM 853 CA GLU A 56 13.496 -2.516 2.199 1.00 0.00 C ATOM 854 C GLU A 56 12.167 -2.219 1.501 1.00 0.00 C ATOM 855 O GLU A 56 11.286 -3.072 1.421 1.00 0.00 O ATOM 856 CB GLU A 56 13.568 -1.802 3.529 1.00 0.00 C ATOM 857 CG GLU A 56 14.857 -2.085 4.265 1.00 0.00 C ATOM 858 CD GLU A 56 14.956 -1.374 5.603 1.00 0.00 C ATOM 859 OE1 GLU A 56 14.765 -2.023 6.648 1.00 0.00 O ATOM 860 OE2 GLU A 56 15.227 -0.158 5.608 1.00 0.00 O1- ATOM 0 H GLU A 56 15.072 -1.230 1.858 1.00 0.00 H new ATOM 0 HA GLU A 56 13.528 -3.600 2.305 1.00 0.00 H new ATOM 0 HB2 GLU A 56 13.473 -0.728 3.368 1.00 0.00 H new ATOM 0 HB3 GLU A 56 12.725 -2.107 4.148 1.00 0.00 H new ATOM 0 HG2 GLU A 56 14.947 -3.159 4.425 1.00 0.00 H new ATOM 0 HG3 GLU A 56 15.697 -1.785 3.639 1.00 0.00 H new ATOM 867 N LEU A 57 12.031 -1.001 1.007 1.00 0.00 N ATOM 868 CA LEU A 57 10.808 -0.548 0.369 1.00 0.00 C ATOM 869 C LEU A 57 10.515 -1.329 -0.907 1.00 0.00 C ATOM 870 O LEU A 57 9.366 -1.655 -1.175 1.00 0.00 O ATOM 871 CB LEU A 57 10.943 0.947 0.117 1.00 0.00 C ATOM 872 CG LEU A 57 11.211 1.761 1.385 1.00 0.00 C ATOM 873 CD1 LEU A 57 11.768 3.124 1.042 1.00 0.00 C ATOM 874 CD2 LEU A 57 9.945 1.914 2.212 1.00 0.00 C ATOM 0 H LEU A 57 12.768 -0.296 1.037 1.00 0.00 H new ATOM 0 HA LEU A 57 9.953 -0.731 1.020 1.00 0.00 H new ATOM 0 HB2 LEU A 57 11.754 1.116 -0.591 1.00 0.00 H new ATOM 0 HB3 LEU A 57 10.029 1.312 -0.352 1.00 0.00 H new ATOM 0 HG LEU A 57 11.949 1.218 1.975 1.00 0.00 H new ATOM 0 HD11 LEU A 57 11.950 3.684 1.959 1.00 0.00 H new ATOM 0 HD12 LEU A 57 12.704 3.008 0.496 1.00 0.00 H new ATOM 0 HD13 LEU A 57 11.052 3.665 0.423 1.00 0.00 H new ATOM 0 HD21 LEU A 57 10.163 2.496 3.107 1.00 0.00 H new ATOM 0 HD22 LEU A 57 9.185 2.426 1.622 1.00 0.00 H new ATOM 0 HD23 LEU A 57 9.578 0.929 2.500 1.00 0.00 H new ATOM 886 N GLN A 58 11.553 -1.668 -1.664 1.00 0.00 N ATOM 887 CA GLN A 58 11.379 -2.451 -2.888 1.00 0.00 C ATOM 888 C GLN A 58 10.683 -3.776 -2.602 1.00 0.00 C ATOM 889 O GLN A 58 9.905 -4.258 -3.419 1.00 0.00 O ATOM 890 CB GLN A 58 12.718 -2.702 -3.578 1.00 0.00 C ATOM 891 CG GLN A 58 13.206 -1.527 -4.410 1.00 0.00 C ATOM 892 CD GLN A 58 14.457 -1.847 -5.198 1.00 0.00 C ATOM 893 OE1 GLN A 58 14.694 -2.993 -5.575 1.00 0.00 O ATOM 894 NE2 GLN A 58 15.261 -0.833 -5.463 1.00 0.00 N ATOM 0 H GLN A 58 12.519 -1.416 -1.456 1.00 0.00 H new ATOM 0 HA GLN A 58 10.748 -1.867 -3.558 1.00 0.00 H new ATOM 0 HB2 GLN A 58 13.468 -2.937 -2.822 1.00 0.00 H new ATOM 0 HB3 GLN A 58 12.627 -3.578 -4.220 1.00 0.00 H new ATOM 0 HG2 GLN A 58 12.417 -1.222 -5.097 1.00 0.00 H new ATOM 0 HG3 GLN A 58 13.402 -0.679 -3.754 1.00 0.00 H new ATOM 0 HE21 GLN A 58 15.028 0.103 -5.132 1.00 0.00 H new ATOM 0 HE22 GLN A 58 16.115 -0.986 -5.999 1.00 0.00 H new ATOM 903 N GLU A 59 10.945 -4.342 -1.430 1.00 0.00 N ATOM 904 CA GLU A 59 10.337 -5.607 -1.033 1.00 0.00 C ATOM 905 C GLU A 59 8.838 -5.444 -0.868 1.00 0.00 C ATOM 906 O GLU A 59 8.051 -6.224 -1.401 1.00 0.00 O ATOM 907 CB GLU A 59 10.942 -6.092 0.265 1.00 0.00 C ATOM 908 CG GLU A 59 12.459 -6.059 0.272 1.00 0.00 C ATOM 909 CD GLU A 59 13.068 -7.023 -0.719 1.00 0.00 C ATOM 910 OE1 GLU A 59 13.538 -8.098 -0.291 1.00 0.00 O ATOM 911 OE2 GLU A 59 13.094 -6.708 -1.924 1.00 0.00 O1- ATOM 0 H GLU A 59 11.577 -3.944 -0.735 1.00 0.00 H new ATOM 0 HA GLU A 59 10.530 -6.342 -1.814 1.00 0.00 H new ATOM 0 HB2 GLU A 59 10.569 -5.477 1.084 1.00 0.00 H new ATOM 0 HB3 GLU A 59 10.607 -7.112 0.455 1.00 0.00 H new ATOM 0 HG2 GLU A 59 12.797 -5.048 0.044 1.00 0.00 H new ATOM 0 HG3 GLU A 59 12.819 -6.298 1.273 1.00 0.00 H new ATOM 918 N MET A 60 8.458 -4.406 -0.138 1.00 0.00 N ATOM 919 CA MET A 60 7.081 -4.085 0.106 1.00 0.00 C ATOM 920 C MET A 60 6.373 -3.685 -1.180 1.00 0.00 C ATOM 921 O MET A 60 5.211 -4.028 -1.390 1.00 0.00 O ATOM 922 CB MET A 60 7.046 -2.974 1.121 1.00 0.00 C ATOM 923 CG MET A 60 6.939 -3.484 2.538 1.00 0.00 C ATOM 924 SD MET A 60 5.441 -4.444 2.840 1.00 0.00 S ATOM 925 CE MET A 60 4.244 -3.129 3.076 1.00 0.00 C ATOM 0 H MET A 60 9.115 -3.762 0.302 1.00 0.00 H new ATOM 0 HA MET A 60 6.552 -4.958 0.489 1.00 0.00 H new ATOM 0 HB2 MET A 60 7.948 -2.370 1.024 1.00 0.00 H new ATOM 0 HB3 MET A 60 6.200 -2.320 0.909 1.00 0.00 H new ATOM 0 HG2 MET A 60 7.809 -4.101 2.761 1.00 0.00 H new ATOM 0 HG3 MET A 60 6.964 -2.638 3.224 1.00 0.00 H new ATOM 0 HE1 MET A 60 3.255 -3.481 2.783 1.00 0.00 H new ATOM 0 HE2 MET A 60 4.228 -2.835 4.126 1.00 0.00 H new ATOM 0 HE3 MET A 60 4.521 -2.271 2.463 1.00 0.00 H new ATOM 935 N ILE A 61 7.089 -2.975 -2.046 1.00 0.00 N ATOM 936 CA ILE A 61 6.551 -2.605 -3.346 1.00 0.00 C ATOM 937 C ILE A 61 6.327 -3.854 -4.173 1.00 0.00 C ATOM 938 O ILE A 61 5.210 -4.142 -4.585 1.00 0.00 O ATOM 939 CB ILE A 61 7.487 -1.638 -4.113 1.00 0.00 C ATOM 940 CG1 ILE A 61 7.754 -0.401 -3.254 1.00 0.00 C ATOM 941 CG2 ILE A 61 6.890 -1.262 -5.460 1.00 0.00 C ATOM 942 CD1 ILE A 61 8.047 0.870 -4.021 1.00 0.00 C ATOM 0 H ILE A 61 8.039 -2.647 -1.870 1.00 0.00 H new ATOM 0 HA ILE A 61 5.608 -2.086 -3.178 1.00 0.00 H new ATOM 0 HB ILE A 61 8.436 -2.136 -4.310 1.00 0.00 H new ATOM 0 HG12 ILE A 61 6.887 -0.229 -2.616 1.00 0.00 H new ATOM 0 HG13 ILE A 61 8.597 -0.611 -2.596 1.00 0.00 H new ATOM 0 HG21 ILE A 61 7.565 -0.582 -5.980 1.00 0.00 H new ATOM 0 HG22 ILE A 61 6.748 -2.162 -6.059 1.00 0.00 H new ATOM 0 HG23 ILE A 61 5.928 -0.772 -5.308 1.00 0.00 H new ATOM 0 HD11 ILE A 61 8.222 1.686 -3.320 1.00 0.00 H new ATOM 0 HD12 ILE A 61 8.934 0.726 -4.638 1.00 0.00 H new ATOM 0 HD13 ILE A 61 7.197 1.115 -4.658 1.00 0.00 H new ATOM 954 N ASP A 62 7.391 -4.612 -4.355 1.00 0.00 N ATOM 955 CA ASP A 62 7.365 -5.811 -5.178 1.00 0.00 C ATOM 956 C ASP A 62 6.307 -6.796 -4.732 1.00 0.00 C ATOM 957 O ASP A 62 5.709 -7.473 -5.558 1.00 0.00 O ATOM 958 CB ASP A 62 8.704 -6.498 -5.133 1.00 0.00 C ATOM 959 CG ASP A 62 8.843 -7.569 -6.191 1.00 0.00 C ATOM 960 OD1 ASP A 62 8.798 -8.763 -5.835 1.00 0.00 O ATOM 961 OD2 ASP A 62 9.002 -7.223 -7.381 1.00 0.00 O1- ATOM 0 H ASP A 62 8.300 -4.416 -3.937 1.00 0.00 H new ATOM 0 HA ASP A 62 7.128 -5.489 -6.192 1.00 0.00 H new ATOM 0 HB2 ASP A 62 9.493 -5.757 -5.265 1.00 0.00 H new ATOM 0 HB3 ASP A 62 8.847 -6.944 -4.149 1.00 0.00 H new ATOM 966 N GLU A 63 6.096 -6.884 -3.429 1.00 0.00 N ATOM 967 CA GLU A 63 5.113 -7.797 -2.873 1.00 0.00 C ATOM 968 C GLU A 63 3.781 -7.702 -3.593 1.00 0.00 C ATOM 969 O GLU A 63 3.210 -8.709 -4.021 1.00 0.00 O ATOM 970 CB GLU A 63 4.908 -7.523 -1.400 1.00 0.00 C ATOM 971 CG GLU A 63 5.760 -8.416 -0.531 1.00 0.00 C ATOM 972 CD GLU A 63 5.286 -8.471 0.895 1.00 0.00 C ATOM 973 OE1 GLU A 63 6.089 -8.822 1.781 1.00 0.00 O ATOM 974 OE2 GLU A 63 4.103 -8.176 1.150 1.00 0.00 O1- ATOM 0 H GLU A 63 6.596 -6.330 -2.734 1.00 0.00 H new ATOM 0 HA GLU A 63 5.502 -8.806 -3.008 1.00 0.00 H new ATOM 0 HB2 GLU A 63 5.145 -6.480 -1.190 1.00 0.00 H new ATOM 0 HB3 GLU A 63 3.858 -7.668 -1.148 1.00 0.00 H new ATOM 0 HG2 GLU A 63 5.762 -9.424 -0.947 1.00 0.00 H new ATOM 0 HG3 GLU A 63 6.790 -8.060 -0.553 1.00 0.00 H new ATOM 981 N VAL A 64 3.299 -6.485 -3.736 1.00 0.00 N ATOM 982 CA VAL A 64 2.013 -6.246 -4.349 1.00 0.00 C ATOM 983 C VAL A 64 2.162 -5.816 -5.805 1.00 0.00 C ATOM 984 O VAL A 64 1.223 -5.925 -6.594 1.00 0.00 O ATOM 985 CB VAL A 64 1.220 -5.201 -3.553 1.00 0.00 C ATOM 986 CG1 VAL A 64 0.736 -5.813 -2.269 1.00 0.00 C ATOM 987 CG2 VAL A 64 2.066 -3.994 -3.214 1.00 0.00 C ATOM 0 H VAL A 64 3.785 -5.641 -3.433 1.00 0.00 H new ATOM 0 HA VAL A 64 1.459 -7.184 -4.336 1.00 0.00 H new ATOM 0 HB VAL A 64 0.384 -4.879 -4.174 1.00 0.00 H new ATOM 0 HG11 VAL A 64 0.172 -5.072 -1.702 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.094 -6.665 -2.491 1.00 0.00 H new ATOM 0 HG13 VAL A 64 1.590 -6.147 -1.680 1.00 0.00 H new ATOM 0 HG21 VAL A 64 1.468 -3.277 -2.650 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.920 -4.306 -2.613 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.420 -3.528 -4.134 1.00 0.00 H new ATOM 997 N ASP A 65 3.354 -5.338 -6.140 1.00 0.00 N ATOM 998 CA ASP A 65 3.709 -4.987 -7.515 1.00 0.00 C ATOM 999 C ASP A 65 3.583 -6.222 -8.399 1.00 0.00 C ATOM 1000 O ASP A 65 4.088 -7.290 -8.058 1.00 0.00 O ATOM 1001 CB ASP A 65 5.152 -4.457 -7.553 1.00 0.00 C ATOM 1002 CG ASP A 65 5.597 -3.932 -8.909 1.00 0.00 C ATOM 1003 OD1 ASP A 65 4.840 -4.059 -9.893 1.00 0.00 O ATOM 1004 OD2 ASP A 65 6.731 -3.405 -8.992 1.00 0.00 O1- ATOM 0 H ASP A 65 4.105 -5.182 -5.467 1.00 0.00 H new ATOM 0 HA ASP A 65 3.036 -4.212 -7.883 1.00 0.00 H new ATOM 0 HB2 ASP A 65 5.251 -3.658 -6.818 1.00 0.00 H new ATOM 0 HB3 ASP A 65 5.827 -5.257 -7.248 1.00 0.00 H new ATOM 1009 N GLU A 66 2.893 -6.085 -9.518 1.00 0.00 N ATOM 1010 CA GLU A 66 2.628 -7.222 -10.380 1.00 0.00 C ATOM 1011 C GLU A 66 3.721 -7.421 -11.420 1.00 0.00 C ATOM 1012 O GLU A 66 4.016 -8.553 -11.805 1.00 0.00 O ATOM 1013 CB GLU A 66 1.285 -7.073 -11.069 1.00 0.00 C ATOM 1014 CG GLU A 66 0.121 -7.174 -10.126 1.00 0.00 C ATOM 1015 CD GLU A 66 -1.205 -7.166 -10.849 1.00 0.00 C ATOM 1016 OE1 GLU A 66 -1.665 -6.077 -11.249 1.00 0.00 O ATOM 1017 OE2 GLU A 66 -1.789 -8.253 -11.031 1.00 0.00 O1- ATOM 0 H GLU A 66 2.508 -5.201 -9.850 1.00 0.00 H new ATOM 0 HA GLU A 66 2.610 -8.105 -9.741 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.250 -6.109 -11.577 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.190 -7.842 -11.836 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.208 -8.090 -9.542 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.153 -6.342 -9.422 1.00 0.00 H new ATOM 1024 N ASP A 67 4.322 -6.333 -11.877 1.00 0.00 N ATOM 1025 CA ASP A 67 5.301 -6.425 -12.952 1.00 0.00 C ATOM 1026 C ASP A 67 6.727 -6.256 -12.455 1.00 0.00 C ATOM 1027 O ASP A 67 7.679 -6.447 -13.214 1.00 0.00 O ATOM 1028 CB ASP A 67 5.006 -5.400 -14.042 1.00 0.00 C ATOM 1029 CG ASP A 67 4.068 -5.943 -15.098 1.00 0.00 C ATOM 1030 OD1 ASP A 67 4.529 -6.722 -15.959 1.00 0.00 O ATOM 1031 OD2 ASP A 67 2.869 -5.598 -15.077 1.00 0.00 O1- ATOM 0 H ASP A 67 4.154 -5.390 -11.528 1.00 0.00 H new ATOM 0 HA ASP A 67 5.214 -7.429 -13.367 1.00 0.00 H new ATOM 0 HB2 ASP A 67 4.567 -4.509 -13.592 1.00 0.00 H new ATOM 0 HB3 ASP A 67 5.940 -5.092 -14.512 1.00 0.00 H new ATOM 1036 N GLY A 68 6.883 -5.907 -11.190 1.00 0.00 N ATOM 1037 CA GLY A 68 8.208 -5.848 -10.613 1.00 0.00 C ATOM 1038 C GLY A 68 9.002 -4.644 -11.088 1.00 0.00 C ATOM 1039 O GLY A 68 10.232 -4.675 -11.101 1.00 0.00 O ATOM 0 H GLY A 68 6.122 -5.665 -10.555 1.00 0.00 H new ATOM 0 HA2 GLY A 68 8.125 -5.818 -9.527 1.00 0.00 H new ATOM 0 HA3 GLY A 68 8.751 -6.759 -10.866 1.00 0.00 H new ATOM 1043 N SER A 69 8.306 -3.585 -11.486 1.00 0.00 N ATOM 1044 CA SER A 69 8.960 -2.402 -12.034 1.00 0.00 C ATOM 1045 C SER A 69 9.547 -1.534 -10.930 1.00 0.00 C ATOM 1046 O SER A 69 10.165 -0.499 -11.191 1.00 0.00 O ATOM 1047 CB SER A 69 7.972 -1.595 -12.871 1.00 0.00 C ATOM 1048 OG SER A 69 6.853 -1.188 -12.099 1.00 0.00 O ATOM 0 H SER A 69 7.289 -3.521 -11.440 1.00 0.00 H new ATOM 0 HA SER A 69 9.779 -2.734 -12.671 1.00 0.00 H new ATOM 0 HB2 SER A 69 8.472 -0.718 -13.281 1.00 0.00 H new ATOM 0 HB3 SER A 69 7.634 -2.194 -13.717 1.00 0.00 H new ATOM 0 HG SER A 69 7.032 -0.311 -11.700 1.00 0.00 H new ATOM 1054 N GLY A 70 9.343 -1.968 -9.702 1.00 0.00 N ATOM 1055 CA GLY A 70 9.817 -1.225 -8.556 1.00 0.00 C ATOM 1056 C GLY A 70 8.879 -0.102 -8.204 1.00 0.00 C ATOM 1057 O GLY A 70 9.245 0.830 -7.485 1.00 0.00 O ATOM 0 H GLY A 70 8.852 -2.832 -9.474 1.00 0.00 H new ATOM 0 HA2 GLY A 70 9.920 -1.896 -7.703 1.00 0.00 H new ATOM 0 HA3 GLY A 70 10.808 -0.822 -8.766 1.00 0.00 H new ATOM 1061 N THR A 71 7.660 -0.193 -8.715 1.00 0.00 N ATOM 1062 CA THR A 71 6.641 0.798 -8.438 1.00 0.00 C ATOM 1063 C THR A 71 5.280 0.153 -8.262 1.00 0.00 C ATOM 1064 O THR A 71 4.861 -0.696 -9.045 1.00 0.00 O ATOM 1065 CB THR A 71 6.566 1.863 -9.538 1.00 0.00 C ATOM 1066 OG1 THR A 71 6.909 1.289 -10.811 1.00 0.00 O ATOM 1067 CG2 THR A 71 7.474 3.041 -9.214 1.00 0.00 C ATOM 0 H THR A 71 7.355 -0.950 -9.327 1.00 0.00 H new ATOM 0 HA THR A 71 6.926 1.286 -7.506 1.00 0.00 H new ATOM 0 HB THR A 71 5.542 2.234 -9.590 1.00 0.00 H new ATOM 0 HG1 THR A 71 6.856 1.978 -11.506 1.00 0.00 H new ATOM 0 HG21 THR A 71 7.404 3.784 -10.009 1.00 0.00 H new ATOM 0 HG22 THR A 71 7.165 3.490 -8.270 1.00 0.00 H new ATOM 0 HG23 THR A 71 8.504 2.694 -9.131 1.00 0.00 H new ATOM 1075 N VAL A 72 4.603 0.568 -7.214 1.00 0.00 N ATOM 1076 CA VAL A 72 3.297 0.062 -6.897 1.00 0.00 C ATOM 1077 C VAL A 72 2.242 1.057 -7.337 1.00 0.00 C ATOM 1078 O VAL A 72 2.216 2.199 -6.886 1.00 0.00 O ATOM 1079 CB VAL A 72 3.186 -0.252 -5.383 1.00 0.00 C ATOM 1080 CG1 VAL A 72 1.850 0.175 -4.807 1.00 0.00 C ATOM 1081 CG2 VAL A 72 3.362 -1.733 -5.171 1.00 0.00 C ATOM 0 H VAL A 72 4.949 1.269 -6.559 1.00 0.00 H new ATOM 0 HA VAL A 72 3.133 -0.871 -7.436 1.00 0.00 H new ATOM 0 HB VAL A 72 3.966 0.310 -4.869 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.819 -0.065 -3.744 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.723 1.249 -4.940 1.00 0.00 H new ATOM 0 HG13 VAL A 72 1.047 -0.352 -5.322 1.00 0.00 H new ATOM 0 HG21 VAL A 72 3.285 -1.960 -4.108 1.00 0.00 H new ATOM 0 HG22 VAL A 72 2.587 -2.273 -5.714 1.00 0.00 H new ATOM 0 HG23 VAL A 72 4.342 -2.039 -5.537 1.00 0.00 H new ATOM 1091 N ASP A 73 1.410 0.645 -8.262 1.00 0.00 N ATOM 1092 CA ASP A 73 0.350 1.503 -8.735 1.00 0.00 C ATOM 1093 C ASP A 73 -0.927 1.146 -7.981 1.00 0.00 C ATOM 1094 O ASP A 73 -0.861 0.451 -6.967 1.00 0.00 O ATOM 1095 CB ASP A 73 0.215 1.379 -10.257 1.00 0.00 C ATOM 1096 CG ASP A 73 -0.713 2.400 -10.883 1.00 0.00 C ATOM 1097 OD1 ASP A 73 -1.888 2.064 -11.129 1.00 0.00 O ATOM 1098 OD2 ASP A 73 -0.263 3.535 -11.141 1.00 0.00 O1- ATOM 0 H ASP A 73 1.445 -0.275 -8.701 1.00 0.00 H new ATOM 0 HA ASP A 73 0.570 2.552 -8.538 1.00 0.00 H new ATOM 0 HB2 ASP A 73 1.203 1.478 -10.707 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -0.147 0.380 -10.498 1.00 0.00 H new ATOM 1103 N PHE A 74 -2.069 1.609 -8.452 1.00 0.00 N ATOM 1104 CA PHE A 74 -3.303 1.544 -7.666 1.00 0.00 C ATOM 1105 C PHE A 74 -3.653 0.127 -7.213 1.00 0.00 C ATOM 1106 O PHE A 74 -3.736 -0.127 -6.016 1.00 0.00 O ATOM 1107 CB PHE A 74 -4.474 2.148 -8.436 1.00 0.00 C ATOM 1108 CG PHE A 74 -5.797 2.008 -7.730 1.00 0.00 C ATOM 1109 CD1 PHE A 74 -5.900 2.163 -6.350 1.00 0.00 C ATOM 1110 CD2 PHE A 74 -6.939 1.727 -8.453 1.00 0.00 C ATOM 1111 CE1 PHE A 74 -7.122 2.031 -5.721 1.00 0.00 C ATOM 1112 CE2 PHE A 74 -8.160 1.597 -7.828 1.00 0.00 C ATOM 1113 CZ PHE A 74 -8.253 1.750 -6.461 1.00 0.00 C ATOM 0 H PHE A 74 -2.176 2.035 -9.373 1.00 0.00 H new ATOM 0 HA PHE A 74 -3.117 2.132 -6.767 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -4.276 3.205 -8.612 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -4.541 1.670 -9.413 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -5.018 2.388 -5.768 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -6.874 1.607 -9.524 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -7.193 2.148 -4.650 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -9.043 1.375 -8.408 1.00 0.00 H new ATOM 0 HZ PHE A 74 -9.210 1.650 -5.970 1.00 0.00 H new ATOM 1123 N ASP A 75 -3.857 -0.784 -8.150 1.00 0.00 N ATOM 1124 CA ASP A 75 -4.335 -2.121 -7.809 1.00 0.00 C ATOM 1125 C ASP A 75 -3.318 -2.855 -6.935 1.00 0.00 C ATOM 1126 O ASP A 75 -3.691 -3.497 -5.954 1.00 0.00 O ATOM 1127 CB ASP A 75 -4.627 -2.918 -9.075 1.00 0.00 C ATOM 1128 CG ASP A 75 -5.428 -4.174 -8.808 1.00 0.00 C ATOM 1129 OD1 ASP A 75 -6.676 -4.098 -8.816 1.00 0.00 O ATOM 1130 OD2 ASP A 75 -4.821 -5.245 -8.624 1.00 0.00 O1- ATOM 0 H ASP A 75 -3.702 -0.628 -9.146 1.00 0.00 H new ATOM 0 HA ASP A 75 -5.260 -2.020 -7.241 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.172 -2.288 -9.777 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -3.686 -3.188 -9.554 1.00 0.00 H new ATOM 1135 N GLU A 76 -2.033 -2.753 -7.290 1.00 0.00 N ATOM 1136 CA GLU A 76 -0.953 -3.231 -6.447 1.00 0.00 C ATOM 1137 C GLU A 76 -1.079 -2.697 -5.024 1.00 0.00 C ATOM 1138 O GLU A 76 -1.098 -3.456 -4.054 1.00 0.00 O ATOM 1139 CB GLU A 76 0.344 -2.789 -7.055 1.00 0.00 C ATOM 1140 CG GLU A 76 0.482 -3.248 -8.482 1.00 0.00 C ATOM 1141 CD GLU A 76 0.130 -2.191 -9.502 1.00 0.00 C ATOM 1142 OE1 GLU A 76 1.061 -1.634 -10.123 1.00 0.00 O ATOM 1143 OE2 GLU A 76 -1.072 -1.912 -9.693 1.00 0.00 O1- ATOM 0 H GLU A 76 -1.722 -2.337 -8.168 1.00 0.00 H new ATOM 0 HA GLU A 76 -0.996 -4.319 -6.387 1.00 0.00 H new ATOM 0 HB2 GLU A 76 0.411 -1.702 -7.016 1.00 0.00 H new ATOM 0 HB3 GLU A 76 1.173 -3.181 -6.466 1.00 0.00 H new ATOM 0 HG2 GLU A 76 1.508 -3.574 -8.651 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -0.158 -4.116 -8.637 1.00 0.00 H new ATOM 1150 N PHE A 77 -1.184 -1.382 -4.923 1.00 0.00 N ATOM 1151 CA PHE A 77 -1.354 -0.697 -3.650 1.00 0.00 C ATOM 1152 C PHE A 77 -2.579 -1.211 -2.910 1.00 0.00 C ATOM 1153 O PHE A 77 -2.524 -1.489 -1.716 1.00 0.00 O ATOM 1154 CB PHE A 77 -1.502 0.799 -3.907 1.00 0.00 C ATOM 1155 CG PHE A 77 -1.853 1.593 -2.701 1.00 0.00 C ATOM 1156 CD1 PHE A 77 -3.161 1.888 -2.461 1.00 0.00 C ATOM 1157 CD2 PHE A 77 -0.888 2.036 -1.821 1.00 0.00 C ATOM 1158 CE1 PHE A 77 -3.529 2.630 -1.359 1.00 0.00 C ATOM 1159 CE2 PHE A 77 -1.238 2.781 -0.715 1.00 0.00 C ATOM 1160 CZ PHE A 77 -2.564 3.074 -0.479 1.00 0.00 C ATOM 0 H PHE A 77 -1.154 -0.755 -5.727 1.00 0.00 H new ATOM 0 HA PHE A 77 -0.478 -0.889 -3.030 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -0.567 1.180 -4.319 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -2.270 0.952 -4.665 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -3.920 1.536 -3.144 1.00 0.00 H new ATOM 0 HD2 PHE A 77 0.150 1.797 -2.000 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -4.569 2.863 -1.185 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -0.476 3.134 -0.036 1.00 0.00 H new ATOM 0 HZ PHE A 77 -2.846 3.649 0.391 1.00 0.00 H new ATOM 1170 N LEU A 78 -3.680 -1.316 -3.629 1.00 0.00 N ATOM 1171 CA LEU A 78 -4.937 -1.757 -3.063 1.00 0.00 C ATOM 1172 C LEU A 78 -4.802 -3.162 -2.507 1.00 0.00 C ATOM 1173 O LEU A 78 -5.325 -3.457 -1.438 1.00 0.00 O ATOM 1174 CB LEU A 78 -6.014 -1.680 -4.138 1.00 0.00 C ATOM 1175 CG LEU A 78 -7.450 -1.821 -3.661 1.00 0.00 C ATOM 1176 CD1 LEU A 78 -7.607 -1.272 -2.255 1.00 0.00 C ATOM 1177 CD2 LEU A 78 -8.344 -1.064 -4.609 1.00 0.00 C ATOM 0 H LEU A 78 -3.726 -1.097 -4.624 1.00 0.00 H new ATOM 0 HA LEU A 78 -5.222 -1.109 -2.234 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -5.916 -0.724 -4.653 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -5.819 -2.460 -4.874 1.00 0.00 H new ATOM 0 HG LEU A 78 -7.724 -2.876 -3.643 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -8.643 -1.383 -1.934 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -6.956 -1.821 -1.575 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -7.335 -0.216 -2.244 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -9.380 -1.154 -4.282 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -8.057 -0.013 -4.619 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -8.243 -1.477 -5.613 1.00 0.00 H new ATOM 1189 N VAL A 79 -4.080 -4.014 -3.217 1.00 0.00 N ATOM 1190 CA VAL A 79 -3.722 -5.322 -2.689 1.00 0.00 C ATOM 1191 C VAL A 79 -2.978 -5.161 -1.372 1.00 0.00 C ATOM 1192 O VAL A 79 -3.340 -5.772 -0.367 1.00 0.00 O ATOM 1193 CB VAL A 79 -2.825 -6.103 -3.670 1.00 0.00 C ATOM 1194 CG1 VAL A 79 -2.260 -7.344 -3.018 1.00 0.00 C ATOM 1195 CG2 VAL A 79 -3.590 -6.493 -4.907 1.00 0.00 C ATOM 0 H VAL A 79 -3.731 -3.825 -4.157 1.00 0.00 H new ATOM 0 HA VAL A 79 -4.646 -5.880 -2.540 1.00 0.00 H new ATOM 0 HB VAL A 79 -2.003 -5.445 -3.953 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.631 -7.876 -3.732 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -1.664 -7.060 -2.151 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -3.077 -7.992 -2.700 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -2.934 -7.043 -5.582 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -4.435 -7.123 -4.629 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -3.956 -5.596 -5.407 1.00 0.00 H new ATOM 1205 N MET A 80 -1.950 -4.313 -1.386 1.00 0.00 N ATOM 1206 CA MET A 80 -1.140 -4.055 -0.200 1.00 0.00 C ATOM 1207 C MET A 80 -2.008 -3.568 0.946 1.00 0.00 C ATOM 1208 O MET A 80 -1.774 -3.898 2.109 1.00 0.00 O ATOM 1209 CB MET A 80 -0.046 -3.035 -0.503 1.00 0.00 C ATOM 1210 CG MET A 80 0.873 -2.787 0.677 1.00 0.00 C ATOM 1211 SD MET A 80 2.447 -2.023 0.220 1.00 0.00 S ATOM 1212 CE MET A 80 1.928 -0.386 -0.286 1.00 0.00 C ATOM 0 H MET A 80 -1.659 -3.791 -2.212 1.00 0.00 H new ATOM 0 HA MET A 80 -0.667 -4.992 0.095 1.00 0.00 H new ATOM 0 HB2 MET A 80 0.545 -3.384 -1.350 1.00 0.00 H new ATOM 0 HB3 MET A 80 -0.507 -2.094 -0.802 1.00 0.00 H new ATOM 0 HG2 MET A 80 0.363 -2.146 1.396 1.00 0.00 H new ATOM 0 HG3 MET A 80 1.071 -3.734 1.179 1.00 0.00 H new ATOM 0 HE1 MET A 80 2.802 0.257 -0.388 1.00 0.00 H new ATOM 0 HE2 MET A 80 1.409 -0.448 -1.243 1.00 0.00 H new ATOM 0 HE3 MET A 80 1.256 0.031 0.464 1.00 0.00 H new ATOM 1222 N MET A 81 -3.023 -2.805 0.597 1.00 0.00 N ATOM 1223 CA MET A 81 -3.949 -2.268 1.544 1.00 0.00 C ATOM 1224 C MET A 81 -4.737 -3.357 2.258 1.00 0.00 C ATOM 1225 O MET A 81 -4.816 -3.349 3.482 1.00 0.00 O ATOM 1226 CB MET A 81 -4.852 -1.299 0.815 1.00 0.00 C ATOM 1227 CG MET A 81 -4.175 0.019 0.497 1.00 0.00 C ATOM 1228 SD MET A 81 -3.361 0.755 1.931 1.00 0.00 S ATOM 1229 CE MET A 81 -1.688 0.124 1.751 1.00 0.00 C ATOM 0 H MET A 81 -3.222 -2.543 -0.369 1.00 0.00 H new ATOM 0 HA MET A 81 -3.405 -1.744 2.330 1.00 0.00 H new ATOM 0 HB2 MET A 81 -5.194 -1.758 -0.112 1.00 0.00 H new ATOM 0 HB3 MET A 81 -5.737 -1.109 1.422 1.00 0.00 H new ATOM 0 HG2 MET A 81 -3.439 -0.137 -0.292 1.00 0.00 H new ATOM 0 HG3 MET A 81 -4.916 0.718 0.108 1.00 0.00 H new ATOM 0 HE1 MET A 81 -1.463 -0.552 2.576 1.00 0.00 H new ATOM 0 HE2 MET A 81 -1.602 -0.415 0.807 1.00 0.00 H new ATOM 0 HE3 MET A 81 -0.983 0.955 1.760 1.00 0.00 H new ATOM 1239 N VAL A 82 -5.299 -4.304 1.507 1.00 0.00 N ATOM 1240 CA VAL A 82 -6.024 -5.413 2.128 1.00 0.00 C ATOM 1241 C VAL A 82 -5.063 -6.306 2.922 1.00 0.00 C ATOM 1242 O VAL A 82 -5.438 -6.888 3.945 1.00 0.00 O ATOM 1243 CB VAL A 82 -6.832 -6.275 1.114 1.00 0.00 C ATOM 1244 CG1 VAL A 82 -6.665 -5.788 -0.311 1.00 0.00 C ATOM 1245 CG2 VAL A 82 -6.453 -7.736 1.212 1.00 0.00 C ATOM 0 H VAL A 82 -5.268 -4.327 0.488 1.00 0.00 H new ATOM 0 HA VAL A 82 -6.751 -4.957 2.800 1.00 0.00 H new ATOM 0 HB VAL A 82 -7.883 -6.166 1.382 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -7.247 -6.420 -0.982 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -7.015 -4.759 -0.387 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -5.612 -5.835 -0.590 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -7.034 -8.312 0.492 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -5.391 -7.852 0.997 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -6.661 -8.099 2.219 1.00 0.00 H new ATOM 1255 N ARG A 83 -3.821 -6.397 2.458 1.00 0.00 N ATOM 1256 CA ARG A 83 -2.819 -7.215 3.127 1.00 0.00 C ATOM 1257 C ARG A 83 -2.568 -6.697 4.539 1.00 0.00 C ATOM 1258 O ARG A 83 -2.558 -7.461 5.494 1.00 0.00 O ATOM 1259 CB ARG A 83 -1.524 -7.247 2.310 1.00 0.00 C ATOM 1260 CG ARG A 83 -1.705 -7.879 0.942 1.00 0.00 C ATOM 1261 CD ARG A 83 -0.482 -7.735 0.050 1.00 0.00 C ATOM 1262 NE ARG A 83 0.666 -8.497 0.525 1.00 0.00 N ATOM 1263 CZ ARG A 83 1.292 -9.423 -0.206 1.00 0.00 C ATOM 1264 NH1 ARG A 83 0.889 -9.697 -1.441 1.00 0.00 N1+ ATOM 1265 NH2 ARG A 83 2.338 -10.057 0.291 1.00 0.00 N ATOM 0 H ARG A 83 -3.486 -5.915 1.624 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.193 -8.236 3.205 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -1.152 -6.230 2.188 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -0.765 -7.800 2.863 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -1.934 -8.937 1.065 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.563 -7.422 0.448 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -0.735 -8.062 -0.959 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -0.209 -6.682 -0.015 1.00 0.00 H new ATOM 0 HE ARG A 83 1.010 -8.313 1.467 1.00 0.00 H new ATOM 0 HH11 ARG A 83 0.094 -9.198 -1.840 1.00 0.00 H new ATOM 0 HH12 ARG A 83 1.374 -10.406 -1.990 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.667 -9.839 1.232 1.00 0.00 H new ATOM 0 HH22 ARG A 83 2.817 -10.765 -0.266 1.00 0.00 H new ATOM 1279 N SER A 84 -2.397 -5.393 4.671 1.00 0.00 N ATOM 1280 CA SER A 84 -2.226 -4.782 5.980 1.00 0.00 C ATOM 1281 C SER A 84 -3.574 -4.622 6.693 1.00 0.00 C ATOM 1282 O SER A 84 -3.633 -4.221 7.853 1.00 0.00 O ATOM 1283 CB SER A 84 -1.530 -3.434 5.834 1.00 0.00 C ATOM 1284 OG SER A 84 -2.225 -2.593 4.926 1.00 0.00 O ATOM 0 H SER A 84 -2.373 -4.737 3.890 1.00 0.00 H new ATOM 0 HA SER A 84 -1.604 -5.437 6.591 1.00 0.00 H new ATOM 0 HB2 SER A 84 -1.465 -2.948 6.807 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.509 -3.585 5.485 1.00 0.00 H new ATOM 0 HG SER A 84 -3.039 -3.044 4.620 1.00 0.00 H new ATOM 1290 N MET A 85 -4.650 -4.925 5.979 1.00 0.00 N ATOM 1291 CA MET A 85 -5.996 -4.772 6.494 1.00 0.00 C ATOM 1292 C MET A 85 -6.402 -5.985 7.334 1.00 0.00 C ATOM 1293 O MET A 85 -6.939 -5.832 8.433 1.00 0.00 O ATOM 1294 CB MET A 85 -6.941 -4.585 5.312 1.00 0.00 C ATOM 1295 CG MET A 85 -7.476 -3.168 5.142 1.00 0.00 C ATOM 1296 SD MET A 85 -9.151 -3.108 4.476 1.00 0.00 S ATOM 1297 CE MET A 85 -8.886 -3.789 2.850 1.00 0.00 C ATOM 0 H MET A 85 -4.610 -5.284 5.025 1.00 0.00 H new ATOM 0 HA MET A 85 -6.045 -3.901 7.147 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.421 -4.874 4.399 1.00 0.00 H new ATOM 0 HB3 MET A 85 -7.784 -5.266 5.427 1.00 0.00 H new ATOM 0 HG2 MET A 85 -7.459 -2.663 6.108 1.00 0.00 H new ATOM 0 HG3 MET A 85 -6.810 -2.613 4.481 1.00 0.00 H new ATOM 0 HE1 MET A 85 -9.752 -3.578 2.222 1.00 0.00 H new ATOM 0 HE2 MET A 85 -7.998 -3.338 2.407 1.00 0.00 H new ATOM 0 HE3 MET A 85 -8.746 -4.867 2.926 1.00 0.00 H new ATOM 1307 N LYS A 86 -6.138 -7.189 6.817 1.00 0.00 N ATOM 1308 CA LYS A 86 -6.433 -8.417 7.553 1.00 0.00 C ATOM 1309 C LYS A 86 -5.644 -8.448 8.854 1.00 0.00 C ATOM 1310 O LYS A 86 -6.182 -8.738 9.923 1.00 0.00 O ATOM 1311 CB LYS A 86 -6.057 -9.657 6.730 1.00 0.00 C ATOM 1312 CG LYS A 86 -7.195 -10.643 6.527 1.00 0.00 C ATOM 1313 CD LYS A 86 -7.615 -11.293 7.835 1.00 0.00 C ATOM 1314 CE LYS A 86 -8.700 -12.338 7.620 1.00 0.00 C ATOM 1315 NZ LYS A 86 -9.947 -11.745 7.070 1.00 0.00 N1+ ATOM 0 H LYS A 86 -5.723 -7.337 5.897 1.00 0.00 H new ATOM 0 HA LYS A 86 -7.503 -8.430 7.758 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -5.693 -9.334 5.754 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.232 -10.170 7.224 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -8.048 -10.128 6.086 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -6.887 -11.413 5.820 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -6.749 -11.759 8.305 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -7.977 -10.528 8.522 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -8.333 -13.106 6.939 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -8.921 -12.831 8.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -10.700 -12.462 7.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -10.238 -10.940 7.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -9.776 -11.417 6.098 1.00 0.00 H new ATOM 1329 N ASP A 87 -4.366 -8.139 8.737 1.00 0.00 N ATOM 1330 CA ASP A 87 -3.439 -8.175 9.854 1.00 0.00 C ATOM 1331 C ASP A 87 -2.240 -7.308 9.503 1.00 0.00 C ATOM 1332 O ASP A 87 -2.066 -6.961 8.338 1.00 0.00 O ATOM 1333 CB ASP A 87 -3.012 -9.625 10.127 1.00 0.00 C ATOM 1334 CG ASP A 87 -1.991 -9.766 11.237 1.00 0.00 C ATOM 1335 OD1 ASP A 87 -0.808 -10.015 10.930 1.00 0.00 O ATOM 1336 OD2 ASP A 87 -2.366 -9.641 12.421 1.00 0.00 O1- ATOM 0 H ASP A 87 -3.938 -7.853 7.856 1.00 0.00 H new ATOM 0 HA ASP A 87 -3.910 -7.791 10.759 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -3.895 -10.211 10.382 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -2.600 -10.051 9.212 1.00 0.00 H new ATOM 1341 N ASP A 88 -1.427 -6.943 10.482 1.00 0.00 N ATOM 1342 CA ASP A 88 -0.244 -6.134 10.205 1.00 0.00 C ATOM 1343 C ASP A 88 0.738 -6.890 9.317 1.00 0.00 C ATOM 1344 O ASP A 88 1.497 -6.282 8.562 1.00 0.00 O ATOM 1345 CB ASP A 88 0.451 -5.695 11.495 1.00 0.00 C ATOM 1346 CG ASP A 88 0.824 -6.849 12.400 1.00 0.00 C ATOM 1347 OD1 ASP A 88 0.003 -7.209 13.272 1.00 0.00 O ATOM 1348 OD2 ASP A 88 1.942 -7.385 12.257 1.00 0.00 O1- ATOM 0 H ASP A 88 -1.559 -7.188 11.463 1.00 0.00 H new ATOM 0 HA ASP A 88 -0.581 -5.241 9.678 1.00 0.00 H new ATOM 0 HB2 ASP A 88 1.352 -5.136 11.241 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -0.204 -5.014 12.038 1.00 0.00 H new ATOM 1353 N SER A 89 0.726 -8.210 9.411 1.00 0.00 N ATOM 1354 CA SER A 89 1.586 -9.025 8.581 1.00 0.00 C ATOM 1355 C SER A 89 0.769 -9.868 7.601 1.00 0.00 C ATOM 1356 O SER A 89 1.196 -10.098 6.472 1.00 0.00 O ATOM 1357 CB SER A 89 2.473 -9.908 9.445 1.00 0.00 C ATOM 1358 OG SER A 89 3.353 -10.690 8.659 1.00 0.00 O ATOM 0 H SER A 89 0.131 -8.735 10.052 1.00 0.00 H new ATOM 0 HA SER A 89 2.223 -8.361 7.996 1.00 0.00 H new ATOM 0 HB2 SER A 89 3.050 -9.286 10.129 1.00 0.00 H new ATOM 0 HB3 SER A 89 1.851 -10.562 10.056 1.00 0.00 H new ATOM 0 HG SER A 89 3.047 -11.621 8.653 1.00 0.00 H new ATOM 1364 N LYS A 90 -0.400 -10.333 8.055 1.00 0.00 N ATOM 1365 CA LYS A 90 -1.351 -11.092 7.221 1.00 0.00 C ATOM 1366 C LYS A 90 -0.811 -12.471 6.850 1.00 0.00 C ATOM 1367 O LYS A 90 -1.333 -13.496 7.281 1.00 0.00 O ATOM 1368 CB LYS A 90 -1.690 -10.333 5.931 1.00 0.00 C ATOM 1369 CG LYS A 90 -3.158 -10.411 5.517 1.00 0.00 C ATOM 1370 CD LYS A 90 -3.683 -11.839 5.414 1.00 0.00 C ATOM 1371 CE LYS A 90 -3.094 -12.575 4.240 1.00 0.00 C ATOM 1372 NZ LYS A 90 -3.367 -14.034 4.301 1.00 0.00 N1+ ATOM 0 H LYS A 90 -0.718 -10.195 9.014 1.00 0.00 H new ATOM 0 HA LYS A 90 -2.252 -11.215 7.822 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -1.417 -9.286 6.058 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.076 -10.726 5.121 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.761 -9.861 6.239 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.283 -9.915 4.554 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -3.451 -12.378 6.333 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -4.769 -11.820 5.322 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -3.503 -12.168 3.315 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -2.017 -12.409 4.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -3.064 -14.481 3.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -2.842 -14.452 5.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -4.386 -14.191 4.438 1.00 0.00 H new ATOM 1386 N GLY A 136 0.227 -12.464 6.033 1.00 0.00 N ATOM 1387 CA GLY A 136 0.782 -13.671 5.466 1.00 0.00 C ATOM 1388 C GLY A 136 1.557 -13.331 4.216 1.00 0.00 C ATOM 1389 O GLY A 136 1.458 -14.012 3.196 1.00 0.00 O ATOM 0 H GLY A 136 0.709 -11.612 5.745 1.00 0.00 H new ATOM 0 HA2 GLY A 136 1.435 -14.159 6.190 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -0.016 -14.375 5.231 1.00 0.00 H new ATOM 1393 N LYS A 137 2.333 -12.257 4.317 1.00 0.00 N ATOM 1394 CA LYS A 137 3.003 -11.655 3.174 1.00 0.00 C ATOM 1395 C LYS A 137 4.196 -12.490 2.717 1.00 0.00 C ATOM 1396 O LYS A 137 4.459 -12.592 1.520 1.00 0.00 O ATOM 1397 CB LYS A 137 3.430 -10.225 3.535 1.00 0.00 C ATOM 1398 CG LYS A 137 2.245 -9.292 3.768 1.00 0.00 C ATOM 1399 CD LYS A 137 2.578 -8.106 4.675 1.00 0.00 C ATOM 1400 CE LYS A 137 3.336 -6.994 3.962 1.00 0.00 C ATOM 1401 NZ LYS A 137 4.714 -7.394 3.589 1.00 0.00 N1+ ATOM 0 H LYS A 137 2.515 -11.779 5.199 1.00 0.00 H new ATOM 0 HA LYS A 137 2.307 -11.621 2.336 1.00 0.00 H new ATOM 0 HB2 LYS A 137 4.047 -10.251 4.433 1.00 0.00 H new ATOM 0 HB3 LYS A 137 4.050 -9.823 2.734 1.00 0.00 H new ATOM 0 HG2 LYS A 137 1.892 -8.918 2.807 1.00 0.00 H new ATOM 0 HG3 LYS A 137 1.426 -9.860 4.210 1.00 0.00 H new ATOM 0 HD2 LYS A 137 1.653 -7.700 5.085 1.00 0.00 H new ATOM 0 HD3 LYS A 137 3.172 -8.458 5.518 1.00 0.00 H new ATOM 0 HE2 LYS A 137 2.790 -6.704 3.064 1.00 0.00 H new ATOM 0 HE3 LYS A 137 3.378 -6.116 4.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 5.281 -6.544 3.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 5.145 -7.925 4.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 4.684 -7.993 2.740 1.00 0.00 H new ATOM 1415 N PHE A 138 4.898 -13.105 3.658 1.00 0.00 N ATOM 1416 CA PHE A 138 6.052 -13.936 3.323 1.00 0.00 C ATOM 1417 C PHE A 138 6.486 -14.759 4.530 1.00 0.00 C ATOM 1418 O PHE A 138 6.666 -15.973 4.434 1.00 0.00 O ATOM 1419 CB PHE A 138 7.213 -13.072 2.821 1.00 0.00 C ATOM 1420 CG PHE A 138 8.389 -13.867 2.327 1.00 0.00 C ATOM 1421 CD1 PHE A 138 8.300 -14.609 1.159 1.00 0.00 C ATOM 1422 CD2 PHE A 138 9.585 -13.868 3.026 1.00 0.00 C ATOM 1423 CE1 PHE A 138 9.378 -15.339 0.701 1.00 0.00 C ATOM 1424 CE2 PHE A 138 10.667 -14.596 2.572 1.00 0.00 C ATOM 1425 CZ PHE A 138 10.564 -15.332 1.409 1.00 0.00 C ATOM 0 H PHE A 138 4.692 -13.047 4.655 1.00 0.00 H new ATOM 0 HA PHE A 138 5.761 -14.618 2.525 1.00 0.00 H new ATOM 0 HB2 PHE A 138 6.855 -12.431 2.015 1.00 0.00 H new ATOM 0 HB3 PHE A 138 7.542 -12.417 3.628 1.00 0.00 H new ATOM 0 HD1 PHE A 138 7.376 -14.616 0.601 1.00 0.00 H new ATOM 0 HD2 PHE A 138 9.672 -13.293 3.936 1.00 0.00 H new ATOM 0 HE1 PHE A 138 9.294 -15.915 -0.209 1.00 0.00 H new ATOM 0 HE2 PHE A 138 11.594 -14.589 3.127 1.00 0.00 H new ATOM 0 HZ PHE A 138 11.410 -15.902 1.053 1.00 0.00 H new ATOM 1435 N LYS A 139 6.659 -14.093 5.663 1.00 0.00 N ATOM 1436 CA LYS A 139 7.001 -14.770 6.909 1.00 0.00 C ATOM 1437 C LYS A 139 6.200 -14.192 8.063 1.00 0.00 C ATOM 1438 O LYS A 139 5.297 -14.841 8.594 1.00 0.00 O ATOM 1439 CB LYS A 139 8.498 -14.644 7.218 1.00 0.00 C ATOM 1440 CG LYS A 139 9.385 -15.546 6.372 1.00 0.00 C ATOM 1441 CD LYS A 139 10.843 -15.455 6.801 1.00 0.00 C ATOM 1442 CE LYS A 139 11.431 -14.093 6.478 1.00 0.00 C ATOM 1443 NZ LYS A 139 12.841 -13.973 6.930 1.00 0.00 N1+ ATOM 0 H LYS A 139 6.568 -13.080 5.746 1.00 0.00 H new ATOM 0 HA LYS A 139 6.757 -15.825 6.787 1.00 0.00 H new ATOM 0 HB2 LYS A 139 8.803 -13.608 7.068 1.00 0.00 H new ATOM 0 HB3 LYS A 139 8.662 -14.875 8.271 1.00 0.00 H new ATOM 0 HG2 LYS A 139 9.043 -16.578 6.457 1.00 0.00 H new ATOM 0 HG3 LYS A 139 9.295 -15.266 5.322 1.00 0.00 H new ATOM 0 HD2 LYS A 139 10.921 -15.642 7.872 1.00 0.00 H new ATOM 0 HD3 LYS A 139 11.421 -16.231 6.299 1.00 0.00 H new ATOM 0 HE2 LYS A 139 11.379 -13.922 5.403 1.00 0.00 H new ATOM 0 HE3 LYS A 139 10.831 -13.317 6.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 13.203 -13.028 6.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 12.888 -14.111 7.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 13.420 -14.696 6.457 1.00 0.00 H new ATOM 1457 N ARG A 140 6.525 -12.952 8.409 1.00 0.00 N ATOM 1458 CA ARG A 140 5.959 -12.274 9.574 1.00 0.00 C ATOM 1459 C ARG A 140 6.611 -10.899 9.778 1.00 0.00 C ATOM 1460 O ARG A 140 5.912 -9.892 9.864 1.00 0.00 O ATOM 1461 CB ARG A 140 6.122 -13.122 10.849 1.00 0.00 C ATOM 1462 CG ARG A 140 5.656 -12.412 12.109 1.00 0.00 C ATOM 1463 CD ARG A 140 4.236 -11.931 11.946 1.00 0.00 C ATOM 1464 NE ARG A 140 3.805 -11.050 13.029 1.00 0.00 N ATOM 1465 CZ ARG A 140 2.549 -10.624 13.181 1.00 0.00 C ATOM 1466 NH1 ARG A 140 1.593 -11.070 12.375 1.00 0.00 N1+ ATOM 1467 NH2 ARG A 140 2.247 -9.775 14.153 1.00 0.00 N ATOM 0 H ARG A 140 7.192 -12.383 7.888 1.00 0.00 H new ATOM 0 HA ARG A 140 4.895 -12.136 9.384 1.00 0.00 H new ATOM 0 HB2 ARG A 140 5.560 -14.049 10.734 1.00 0.00 H new ATOM 0 HB3 ARG A 140 7.171 -13.397 10.962 1.00 0.00 H new ATOM 0 HG2 ARG A 140 5.722 -13.089 12.961 1.00 0.00 H new ATOM 0 HG3 ARG A 140 6.311 -11.567 12.321 1.00 0.00 H new ATOM 0 HD2 ARG A 140 4.143 -11.403 10.997 1.00 0.00 H new ATOM 0 HD3 ARG A 140 3.569 -12.792 11.898 1.00 0.00 H new ATOM 0 HE ARG A 140 4.503 -10.743 13.707 1.00 0.00 H new ATOM 0 HH11 ARG A 140 1.818 -11.739 11.639 1.00 0.00 H new ATOM 0 HH12 ARG A 140 0.634 -10.744 12.492 1.00 0.00 H new ATOM 0 HH21 ARG A 140 2.975 -9.446 14.787 1.00 0.00 H new ATOM 0 HH22 ARG A 140 1.287 -9.451 14.267 1.00 0.00 H new ATOM 1481 N PRO A 141 7.959 -10.838 9.856 1.00 0.00 N ATOM 1482 CA PRO A 141 8.688 -9.596 10.123 1.00 0.00 C ATOM 1483 C PRO A 141 8.284 -8.456 9.198 1.00 0.00 C ATOM 1484 O PRO A 141 8.177 -7.313 9.644 1.00 0.00 O ATOM 1485 CB PRO A 141 10.161 -9.973 9.895 1.00 0.00 C ATOM 1486 CG PRO A 141 10.143 -11.307 9.240 1.00 0.00 C ATOM 1487 CD PRO A 141 8.879 -11.965 9.691 1.00 0.00 C ATOM 0 HA PRO A 141 8.479 -9.227 11.127 1.00 0.00 H new ATOM 0 HB2 PRO A 141 10.660 -9.236 9.266 1.00 0.00 H new ATOM 0 HB3 PRO A 141 10.706 -10.008 10.838 1.00 0.00 H new ATOM 0 HG2 PRO A 141 10.168 -11.210 8.155 1.00 0.00 H new ATOM 0 HG3 PRO A 141 11.014 -11.896 9.527 1.00 0.00 H new ATOM 0 HD2 PRO A 141 8.512 -12.681 8.955 1.00 0.00 H new ATOM 0 HD3 PRO A 141 9.019 -12.511 10.624 1.00 0.00 H new ATOM 1495 N THR A 142 8.042 -8.770 7.928 1.00 0.00 N ATOM 1496 CA THR A 142 7.706 -7.758 6.933 1.00 0.00 C ATOM 1497 C THR A 142 8.749 -6.644 6.944 1.00 0.00 C ATOM 1498 O THR A 142 8.474 -5.499 7.320 1.00 0.00 O ATOM 1499 CB THR A 142 6.288 -7.195 7.173 1.00 0.00 C ATOM 1500 OG1 THR A 142 5.333 -8.261 7.100 1.00 0.00 O ATOM 1501 CG2 THR A 142 5.922 -6.121 6.152 1.00 0.00 C ATOM 0 H THR A 142 8.073 -9.722 7.563 1.00 0.00 H new ATOM 0 HA THR A 142 7.711 -8.225 5.948 1.00 0.00 H new ATOM 0 HB THR A 142 6.274 -6.738 8.162 1.00 0.00 H new ATOM 0 HG1 THR A 142 5.395 -8.811 7.908 1.00 0.00 H new ATOM 0 HG21 THR A 142 4.917 -5.752 6.357 1.00 0.00 H new ATOM 0 HG22 THR A 142 6.632 -5.297 6.220 1.00 0.00 H new ATOM 0 HG23 THR A 142 5.955 -6.546 5.149 1.00 0.00 H new ATOM 1509 N LEU A 143 9.973 -7.019 6.575 1.00 0.00 N ATOM 1510 CA LEU A 143 11.097 -6.089 6.505 1.00 0.00 C ATOM 1511 C LEU A 143 11.360 -5.420 7.853 1.00 0.00 C ATOM 1512 O LEU A 143 12.058 -4.411 7.927 1.00 0.00 O ATOM 1513 CB LEU A 143 10.864 -5.052 5.402 1.00 0.00 C ATOM 1514 CG LEU A 143 10.828 -5.613 3.969 1.00 0.00 C ATOM 1515 CD1 LEU A 143 11.997 -6.566 3.742 1.00 0.00 C ATOM 1516 CD2 LEU A 143 9.499 -6.306 3.681 1.00 0.00 C ATOM 0 H LEU A 143 10.212 -7.976 6.316 1.00 0.00 H new ATOM 0 HA LEU A 143 11.991 -6.660 6.254 1.00 0.00 H new ATOM 0 HB2 LEU A 143 9.921 -4.542 5.599 1.00 0.00 H new ATOM 0 HB3 LEU A 143 11.651 -4.300 5.461 1.00 0.00 H new ATOM 0 HG LEU A 143 10.923 -4.778 3.275 1.00 0.00 H new ATOM 0 HD11 LEU A 143 11.958 -6.954 2.724 1.00 0.00 H new ATOM 0 HD12 LEU A 143 12.936 -6.032 3.891 1.00 0.00 H new ATOM 0 HD13 LEU A 143 11.934 -7.394 4.449 1.00 0.00 H new ATOM 0 HD21 LEU A 143 9.503 -6.692 2.662 1.00 0.00 H new ATOM 0 HD22 LEU A 143 9.359 -7.130 4.380 1.00 0.00 H new ATOM 0 HD23 LEU A 143 8.684 -5.591 3.795 1.00 0.00 H new ATOM 1528 N ARG A 144 10.787 -6.005 8.909 1.00 0.00 N ATOM 1529 CA ARG A 144 10.997 -5.570 10.288 1.00 0.00 C ATOM 1530 C ARG A 144 10.482 -4.146 10.531 1.00 0.00 C ATOM 1531 O ARG A 144 9.378 -3.951 11.038 1.00 0.00 O ATOM 1532 CB ARG A 144 12.483 -5.683 10.665 1.00 0.00 C ATOM 1533 CG ARG A 144 12.801 -5.361 12.122 1.00 0.00 C ATOM 1534 CD ARG A 144 12.081 -6.289 13.093 1.00 0.00 C ATOM 1535 NE ARG A 144 10.644 -6.021 13.156 1.00 0.00 N ATOM 1536 CZ ARG A 144 9.715 -6.958 13.343 1.00 0.00 C ATOM 1537 NH1 ARG A 144 10.064 -8.224 13.511 1.00 0.00 N1+ ATOM 1538 NH2 ARG A 144 8.434 -6.624 13.358 1.00 0.00 N ATOM 0 H ARG A 144 10.157 -6.803 8.826 1.00 0.00 H new ATOM 0 HA ARG A 144 10.417 -6.233 10.930 1.00 0.00 H new ATOM 0 HB2 ARG A 144 12.822 -6.696 10.450 1.00 0.00 H new ATOM 0 HB3 ARG A 144 13.057 -5.012 10.026 1.00 0.00 H new ATOM 0 HG2 ARG A 144 13.877 -5.437 12.281 1.00 0.00 H new ATOM 0 HG3 ARG A 144 12.519 -4.329 12.333 1.00 0.00 H new ATOM 0 HD2 ARG A 144 12.242 -7.324 12.790 1.00 0.00 H new ATOM 0 HD3 ARG A 144 12.513 -6.177 14.087 1.00 0.00 H new ATOM 0 HE ARG A 144 10.333 -5.055 13.050 1.00 0.00 H new ATOM 0 HH11 ARG A 144 11.049 -8.487 13.498 1.00 0.00 H new ATOM 0 HH12 ARG A 144 9.348 -8.936 13.654 1.00 0.00 H new ATOM 0 HH21 ARG A 144 8.159 -5.651 13.227 1.00 0.00 H new ATOM 0 HH22 ARG A 144 7.722 -7.340 13.501 1.00 0.00 H new ATOM 1552 N ARG A 145 11.282 -3.166 10.151 1.00 0.00 N ATOM 1553 CA ARG A 145 10.999 -1.762 10.422 1.00 0.00 C ATOM 1554 C ARG A 145 10.101 -1.172 9.337 1.00 0.00 C ATOM 1555 O ARG A 145 9.454 -0.141 9.528 1.00 0.00 O ATOM 1556 CB ARG A 145 12.335 -1.007 10.512 1.00 0.00 C ATOM 1557 CG ARG A 145 12.213 0.498 10.677 1.00 0.00 C ATOM 1558 CD ARG A 145 12.234 1.219 9.335 1.00 0.00 C ATOM 1559 NE ARG A 145 13.436 0.907 8.560 1.00 0.00 N ATOM 1560 CZ ARG A 145 14.559 1.631 8.592 1.00 0.00 C ATOM 1561 NH1 ARG A 145 14.679 2.655 9.432 1.00 0.00 N1+ ATOM 1562 NH2 ARG A 145 15.566 1.318 7.790 1.00 0.00 N ATOM 0 H ARG A 145 12.153 -3.320 9.642 1.00 0.00 H new ATOM 0 HA ARG A 145 10.463 -1.665 11.366 1.00 0.00 H new ATOM 0 HB2 ARG A 145 12.904 -1.404 11.353 1.00 0.00 H new ATOM 0 HB3 ARG A 145 12.913 -1.213 9.611 1.00 0.00 H new ATOM 0 HG2 ARG A 145 11.286 0.732 11.201 1.00 0.00 H new ATOM 0 HG3 ARG A 145 13.031 0.863 11.298 1.00 0.00 H new ATOM 0 HD2 ARG A 145 11.351 0.940 8.761 1.00 0.00 H new ATOM 0 HD3 ARG A 145 12.180 2.295 9.501 1.00 0.00 H new ATOM 0 HE ARG A 145 13.415 0.085 7.957 1.00 0.00 H new ATOM 0 HH11 ARG A 145 13.910 2.893 10.059 1.00 0.00 H new ATOM 0 HH12 ARG A 145 15.540 3.202 9.450 1.00 0.00 H new ATOM 0 HH21 ARG A 145 15.482 0.527 7.151 1.00 0.00 H new ATOM 0 HH22 ARG A 145 16.425 1.868 7.811 1.00 0.00 H new ATOM 1576 N VAL A 146 10.038 -1.854 8.214 1.00 0.00 N ATOM 1577 CA VAL A 146 9.385 -1.326 7.034 1.00 0.00 C ATOM 1578 C VAL A 146 7.951 -1.835 6.935 1.00 0.00 C ATOM 1579 O VAL A 146 7.629 -2.709 6.129 1.00 0.00 O ATOM 1580 CB VAL A 146 10.213 -1.691 5.792 1.00 0.00 C ATOM 1581 CG1 VAL A 146 9.712 -0.991 4.539 1.00 0.00 C ATOM 1582 CG2 VAL A 146 11.661 -1.369 6.073 1.00 0.00 C ATOM 0 H VAL A 146 10.435 -2.785 8.092 1.00 0.00 H new ATOM 0 HA VAL A 146 9.328 -0.240 7.102 1.00 0.00 H new ATOM 0 HB VAL A 146 10.107 -2.757 5.593 1.00 0.00 H new ATOM 0 HG11 VAL A 146 10.329 -1.281 3.689 1.00 0.00 H new ATOM 0 HG12 VAL A 146 8.677 -1.278 4.351 1.00 0.00 H new ATOM 0 HG13 VAL A 146 9.770 0.089 4.678 1.00 0.00 H new ATOM 0 HG21 VAL A 146 12.266 -1.622 5.202 1.00 0.00 H new ATOM 0 HG22 VAL A 146 11.762 -0.305 6.289 1.00 0.00 H new ATOM 0 HG23 VAL A 146 12.002 -1.947 6.932 1.00 0.00 H new ATOM 1592 N ARG A 147 7.097 -1.264 7.776 1.00 0.00 N ATOM 1593 CA ARG A 147 5.720 -1.704 7.899 1.00 0.00 C ATOM 1594 C ARG A 147 4.731 -0.701 7.334 1.00 0.00 C ATOM 1595 O ARG A 147 4.652 0.441 7.791 1.00 0.00 O ATOM 1596 CB ARG A 147 5.386 -1.940 9.365 1.00 0.00 C ATOM 1597 CG ARG A 147 6.021 -3.184 9.939 1.00 0.00 C ATOM 1598 CD ARG A 147 5.484 -4.422 9.255 1.00 0.00 C ATOM 1599 NE ARG A 147 5.863 -5.639 9.967 1.00 0.00 N ATOM 1600 CZ ARG A 147 5.012 -6.381 10.672 1.00 0.00 C ATOM 1601 NH1 ARG A 147 3.739 -6.022 10.780 1.00 0.00 N1+ ATOM 1602 NH2 ARG A 147 5.437 -7.480 11.277 1.00 0.00 N ATOM 0 H ARG A 147 7.342 -0.486 8.388 1.00 0.00 H new ATOM 0 HA ARG A 147 5.631 -2.625 7.323 1.00 0.00 H new ATOM 0 HB2 ARG A 147 5.710 -1.076 9.946 1.00 0.00 H new ATOM 0 HB3 ARG A 147 4.304 -2.011 9.475 1.00 0.00 H new ATOM 0 HG2 ARG A 147 7.103 -3.135 9.817 1.00 0.00 H new ATOM 0 HG3 ARG A 147 5.823 -3.239 11.009 1.00 0.00 H new ATOM 0 HD2 ARG A 147 4.398 -4.361 9.192 1.00 0.00 H new ATOM 0 HD3 ARG A 147 5.861 -4.466 8.233 1.00 0.00 H new ATOM 0 HE ARG A 147 6.837 -5.938 9.922 1.00 0.00 H new ATOM 0 HH11 ARG A 147 3.408 -5.173 10.321 1.00 0.00 H new ATOM 0 HH12 ARG A 147 3.092 -6.595 11.322 1.00 0.00 H new ATOM 0 HH21 ARG A 147 6.416 -7.757 11.202 1.00 0.00 H new ATOM 0 HH22 ARG A 147 4.785 -8.049 11.817 1.00 0.00 H new ATOM 1616 N ILE A 148 3.973 -1.141 6.348 1.00 0.00 N ATOM 1617 CA ILE A 148 2.841 -0.381 5.858 1.00 0.00 C ATOM 1618 C ILE A 148 1.574 -0.880 6.542 1.00 0.00 C ATOM 1619 O ILE A 148 1.247 -2.065 6.462 1.00 0.00 O ATOM 1620 CB ILE A 148 2.698 -0.489 4.326 1.00 0.00 C ATOM 1621 CG1 ILE A 148 3.718 0.401 3.614 1.00 0.00 C ATOM 1622 CG2 ILE A 148 1.299 -0.142 3.873 1.00 0.00 C ATOM 1623 CD1 ILE A 148 3.758 1.829 4.125 1.00 0.00 C ATOM 0 H ILE A 148 4.123 -2.028 5.868 1.00 0.00 H new ATOM 0 HA ILE A 148 3.004 0.671 6.093 1.00 0.00 H new ATOM 0 HB ILE A 148 2.894 -1.527 4.058 1.00 0.00 H new ATOM 0 HG12 ILE A 148 4.709 -0.041 3.724 1.00 0.00 H new ATOM 0 HG13 ILE A 148 3.491 0.414 2.548 1.00 0.00 H new ATOM 0 HG21 ILE A 148 1.236 -0.229 2.788 1.00 0.00 H new ATOM 0 HG22 ILE A 148 0.587 -0.826 4.334 1.00 0.00 H new ATOM 0 HG23 ILE A 148 1.064 0.880 4.169 1.00 0.00 H new ATOM 0 HD11 ILE A 148 4.506 2.394 3.569 1.00 0.00 H new ATOM 0 HD12 ILE A 148 2.780 2.291 3.990 1.00 0.00 H new ATOM 0 HD13 ILE A 148 4.016 1.829 5.184 1.00 0.00 H new ATOM 1635 N SER A 149 0.887 0.010 7.239 1.00 0.00 N ATOM 1636 CA SER A 149 -0.322 -0.358 7.957 1.00 0.00 C ATOM 1637 C SER A 149 -1.507 0.433 7.433 1.00 0.00 C ATOM 1638 O SER A 149 -1.531 1.645 7.578 1.00 0.00 O ATOM 1639 CB SER A 149 -0.136 -0.116 9.453 1.00 0.00 C ATOM 1640 OG SER A 149 0.979 -0.838 9.952 1.00 0.00 O ATOM 0 H SER A 149 1.146 0.993 7.323 1.00 0.00 H new ATOM 0 HA SER A 149 -0.519 -1.418 7.797 1.00 0.00 H new ATOM 0 HB2 SER A 149 0.004 0.949 9.638 1.00 0.00 H new ATOM 0 HB3 SER A 149 -1.037 -0.416 9.988 1.00 0.00 H new ATOM 0 HG SER A 149 1.078 -0.665 10.912 1.00 0.00 H new ATOM 1646 N ALA A 150 -2.465 -0.258 6.809 1.00 0.00 N ATOM 1647 CA ALA A 150 -3.585 0.388 6.116 1.00 0.00 C ATOM 1648 C ALA A 150 -4.183 1.522 6.927 1.00 0.00 C ATOM 1649 O ALA A 150 -4.166 2.660 6.475 1.00 0.00 O ATOM 1650 CB ALA A 150 -4.655 -0.636 5.771 1.00 0.00 C ATOM 0 H ALA A 150 -2.487 -1.277 6.769 1.00 0.00 H new ATOM 0 HA ALA A 150 -3.191 0.820 5.196 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -5.480 -0.142 5.257 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -4.230 -1.402 5.122 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -5.024 -1.100 6.686 1.00 0.00 H new ATOM 1656 N ASP A 151 -4.674 1.220 8.126 1.00 0.00 N ATOM 1657 CA ASP A 151 -5.257 2.240 8.996 1.00 0.00 C ATOM 1658 C ASP A 151 -4.315 3.421 9.146 1.00 0.00 C ATOM 1659 O ASP A 151 -4.687 4.558 8.875 1.00 0.00 O ATOM 1660 CB ASP A 151 -5.564 1.672 10.378 1.00 0.00 C ATOM 1661 CG ASP A 151 -6.617 0.592 10.343 1.00 0.00 C ATOM 1662 OD1 ASP A 151 -6.278 -0.560 9.999 1.00 0.00 O ATOM 1663 OD2 ASP A 151 -7.785 0.885 10.665 1.00 0.00 O1- ATOM 0 H ASP A 151 -4.680 0.278 8.518 1.00 0.00 H new ATOM 0 HA ASP A 151 -6.185 2.572 8.531 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -4.649 1.268 10.812 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -5.898 2.478 11.032 1.00 0.00 H new ATOM 1668 N ALA A 152 -3.084 3.132 9.544 1.00 0.00 N ATOM 1669 CA ALA A 152 -2.060 4.153 9.730 1.00 0.00 C ATOM 1670 C ALA A 152 -1.792 4.910 8.429 1.00 0.00 C ATOM 1671 O ALA A 152 -1.515 6.108 8.437 1.00 0.00 O ATOM 1672 CB ALA A 152 -0.780 3.495 10.231 1.00 0.00 C ATOM 0 H ALA A 152 -2.766 2.184 9.747 1.00 0.00 H new ATOM 0 HA ALA A 152 -2.414 4.875 10.466 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -0.011 4.255 10.372 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -0.975 2.996 11.180 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -0.437 2.763 9.500 1.00 0.00 H new ATOM 1678 N MET A 153 -1.889 4.195 7.322 1.00 0.00 N ATOM 1679 CA MET A 153 -1.670 4.758 6.002 1.00 0.00 C ATOM 1680 C MET A 153 -2.781 5.739 5.671 1.00 0.00 C ATOM 1681 O MET A 153 -2.558 6.778 5.047 1.00 0.00 O ATOM 1682 CB MET A 153 -1.624 3.632 4.965 1.00 0.00 C ATOM 1683 CG MET A 153 -0.835 3.969 3.716 1.00 0.00 C ATOM 1684 SD MET A 153 0.864 4.454 4.080 1.00 0.00 S ATOM 1685 CE MET A 153 0.658 6.193 4.458 1.00 0.00 C ATOM 0 H MET A 153 -2.123 3.202 7.314 1.00 0.00 H new ATOM 0 HA MET A 153 -0.719 5.290 5.986 1.00 0.00 H new ATOM 0 HB2 MET A 153 -1.190 2.745 5.427 1.00 0.00 H new ATOM 0 HB3 MET A 153 -2.644 3.375 4.679 1.00 0.00 H new ATOM 0 HG2 MET A 153 -0.828 3.106 3.051 1.00 0.00 H new ATOM 0 HG3 MET A 153 -1.334 4.778 3.183 1.00 0.00 H new ATOM 0 HE1 MET A 153 1.190 6.792 3.719 1.00 0.00 H new ATOM 0 HE2 MET A 153 -0.402 6.447 4.436 1.00 0.00 H new ATOM 0 HE3 MET A 153 1.060 6.400 5.450 1.00 0.00 H new ATOM 1695 N MET A 154 -3.974 5.398 6.123 1.00 0.00 N ATOM 1696 CA MET A 154 -5.148 6.234 5.936 1.00 0.00 C ATOM 1697 C MET A 154 -5.020 7.491 6.791 1.00 0.00 C ATOM 1698 O MET A 154 -5.544 8.548 6.448 1.00 0.00 O ATOM 1699 CB MET A 154 -6.409 5.445 6.313 1.00 0.00 C ATOM 1700 CG MET A 154 -6.494 4.055 5.683 1.00 0.00 C ATOM 1701 SD MET A 154 -6.855 4.072 3.925 1.00 0.00 S ATOM 1702 CE MET A 154 -5.204 4.292 3.298 1.00 0.00 C ATOM 0 H MET A 154 -4.157 4.533 6.631 1.00 0.00 H new ATOM 0 HA MET A 154 -5.226 6.531 4.890 1.00 0.00 H new ATOM 0 HB2 MET A 154 -6.448 5.342 7.397 1.00 0.00 H new ATOM 0 HB3 MET A 154 -7.286 6.020 6.015 1.00 0.00 H new ATOM 0 HG2 MET A 154 -5.549 3.536 5.845 1.00 0.00 H new ATOM 0 HG3 MET A 154 -7.265 3.481 6.196 1.00 0.00 H new ATOM 0 HE1 MET A 154 -5.125 3.833 2.312 1.00 0.00 H new ATOM 0 HE2 MET A 154 -4.983 5.357 3.222 1.00 0.00 H new ATOM 0 HE3 MET A 154 -4.492 3.821 3.975 1.00 0.00 H new ATOM 1712 N GLN A 155 -4.286 7.367 7.891 1.00 0.00 N ATOM 1713 CA GLN A 155 -4.024 8.485 8.782 1.00 0.00 C ATOM 1714 C GLN A 155 -3.043 9.453 8.137 1.00 0.00 C ATOM 1715 O GLN A 155 -3.337 10.635 7.950 1.00 0.00 O ATOM 1716 CB GLN A 155 -3.416 7.982 10.084 1.00 0.00 C ATOM 1717 CG GLN A 155 -4.095 6.758 10.657 1.00 0.00 C ATOM 1718 CD GLN A 155 -3.559 6.370 12.021 1.00 0.00 C ATOM 1719 OE1 GLN A 155 -4.277 5.805 12.844 1.00 0.00 O ATOM 1720 NE2 GLN A 155 -2.293 6.671 12.269 1.00 0.00 N ATOM 0 H GLN A 155 -3.858 6.490 8.187 1.00 0.00 H new ATOM 0 HA GLN A 155 -4.968 8.992 8.981 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -2.364 7.754 9.915 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -3.454 8.783 10.822 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -5.166 6.945 10.733 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -3.965 5.922 9.970 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -1.732 7.140 11.558 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -1.880 6.433 13.171 1.00 0.00 H new ATOM 1729 N ALA A 156 -1.873 8.924 7.796 1.00 0.00 N ATOM 1730 CA ALA A 156 -0.773 9.725 7.278 1.00 0.00 C ATOM 1731 C ALA A 156 -1.128 10.398 5.959 1.00 0.00 C ATOM 1732 O ALA A 156 -0.863 11.583 5.772 1.00 0.00 O ATOM 1733 CB ALA A 156 0.467 8.862 7.114 1.00 0.00 C ATOM 0 H ALA A 156 -1.662 7.929 7.871 1.00 0.00 H new ATOM 0 HA ALA A 156 -0.571 10.515 8.001 1.00 0.00 H new ATOM 0 HB1 ALA A 156 1.285 9.470 6.726 1.00 0.00 H new ATOM 0 HB2 ALA A 156 0.751 8.446 8.081 1.00 0.00 H new ATOM 0 HB3 ALA A 156 0.256 8.050 6.418 1.00 0.00 H new ATOM 1739 N LEU A 157 -1.729 9.648 5.047 1.00 0.00 N ATOM 1740 CA LEU A 157 -2.053 10.188 3.734 1.00 0.00 C ATOM 1741 C LEU A 157 -3.376 10.903 3.736 1.00 0.00 C ATOM 1742 O LEU A 157 -3.448 12.123 3.583 1.00 0.00 O ATOM 1743 CB LEU A 157 -2.152 9.085 2.710 1.00 0.00 C ATOM 1744 CG LEU A 157 -0.902 8.267 2.506 1.00 0.00 C ATOM 1745 CD1 LEU A 157 -1.244 6.945 1.866 1.00 0.00 C ATOM 1746 CD2 LEU A 157 0.055 9.022 1.627 1.00 0.00 C ATOM 0 H LEU A 157 -2.000 8.675 5.189 1.00 0.00 H new ATOM 0 HA LEU A 157 -1.251 10.883 3.485 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -2.959 8.414 3.003 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -2.435 9.526 1.754 1.00 0.00 H new ATOM 0 HG LEU A 157 -0.438 8.081 3.474 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -0.333 6.363 1.724 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -1.929 6.395 2.511 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -1.717 7.120 0.900 1.00 0.00 H new ATOM 0 HD21 LEU A 157 0.958 8.430 1.480 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -0.413 9.216 0.662 1.00 0.00 H new ATOM 0 HD23 LEU A 157 0.315 9.969 2.101 1.00 0.00 H new ATOM 1758 N LEU A 158 -4.419 10.127 3.937 1.00 0.00 N ATOM 1759 CA LEU A 158 -5.762 10.588 3.696 1.00 0.00 C ATOM 1760 C LEU A 158 -6.155 11.644 4.692 1.00 0.00 C ATOM 1761 O LEU A 158 -6.644 12.686 4.282 1.00 0.00 O ATOM 1762 CB LEU A 158 -6.728 9.418 3.730 1.00 0.00 C ATOM 1763 CG LEU A 158 -6.450 8.356 2.683 1.00 0.00 C ATOM 1764 CD1 LEU A 158 -7.327 7.143 2.899 1.00 0.00 C ATOM 1765 CD2 LEU A 158 -6.682 8.907 1.295 1.00 0.00 C ATOM 0 H LEU A 158 -4.357 9.165 4.270 1.00 0.00 H new ATOM 0 HA LEU A 158 -5.802 11.040 2.705 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -6.691 8.958 4.718 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -7.742 9.793 3.591 1.00 0.00 H new ATOM 0 HG LEU A 158 -5.406 8.057 2.780 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -7.109 6.396 2.136 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -7.130 6.723 3.885 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -8.375 7.435 2.832 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -6.478 8.131 0.557 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -7.718 9.233 1.201 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -6.018 9.754 1.124 1.00 0.00 H new ATOM 1777 N GLY A 159 -5.909 11.361 5.981 1.00 0.00 N ATOM 1778 CA GLY A 159 -6.124 12.320 7.061 1.00 0.00 C ATOM 1779 C GLY A 159 -7.338 13.199 6.857 1.00 0.00 C ATOM 1780 O GLY A 159 -8.443 12.856 7.280 1.00 0.00 O ATOM 0 H GLY A 159 -5.555 10.458 6.298 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -6.232 11.778 8.001 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -5.241 12.951 7.156 1.00 0.00 H new ATOM 1784 N ALA A 160 -7.103 14.332 6.201 1.00 0.00 N ATOM 1785 CA ALA A 160 -8.148 15.237 5.739 1.00 0.00 C ATOM 1786 C ALA A 160 -9.382 14.479 5.259 1.00 0.00 C ATOM 1787 O ALA A 160 -10.503 14.730 5.708 1.00 0.00 O ATOM 1788 CB ALA A 160 -7.592 16.068 4.592 1.00 0.00 C ATOM 0 H ALA A 160 -6.162 14.652 5.972 1.00 0.00 H new ATOM 0 HA ALA A 160 -8.451 15.871 6.572 1.00 0.00 H new ATOM 0 HB1 ALA A 160 -8.361 16.752 4.232 1.00 0.00 H new ATOM 0 HB2 ALA A 160 -6.732 16.639 4.940 1.00 0.00 H new ATOM 0 HB3 ALA A 160 -7.285 15.408 3.780 1.00 0.00 H new ATOM 1794 N ARG A 161 -9.152 13.536 4.363 1.00 0.00 N ATOM 1795 CA ARG A 161 -10.218 12.769 3.746 1.00 0.00 C ATOM 1796 C ARG A 161 -10.599 11.558 4.598 1.00 0.00 C ATOM 1797 O ARG A 161 -11.684 10.998 4.444 1.00 0.00 O ATOM 1798 CB ARG A 161 -9.773 12.317 2.357 1.00 0.00 C ATOM 1799 CG ARG A 161 -10.811 11.490 1.620 1.00 0.00 C ATOM 1800 CD ARG A 161 -10.333 11.108 0.231 1.00 0.00 C ATOM 1801 NE ARG A 161 -11.339 10.335 -0.491 1.00 0.00 N ATOM 1802 CZ ARG A 161 -11.509 10.371 -1.810 1.00 0.00 C ATOM 1803 NH1 ARG A 161 -10.738 11.142 -2.568 1.00 0.00 N1+ ATOM 1804 NH2 ARG A 161 -12.459 9.637 -2.371 1.00 0.00 N ATOM 0 H ARG A 161 -8.218 13.280 4.042 1.00 0.00 H new ATOM 0 HA ARG A 161 -11.100 13.404 3.663 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -9.531 13.196 1.759 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -8.857 11.734 2.451 1.00 0.00 H new ATOM 0 HG2 ARG A 161 -11.032 10.588 2.191 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -11.740 12.054 1.544 1.00 0.00 H new ATOM 0 HD2 ARG A 161 -10.093 12.010 -0.332 1.00 0.00 H new ATOM 0 HD3 ARG A 161 -9.414 10.527 0.309 1.00 0.00 H new ATOM 0 HE ARG A 161 -11.952 9.727 0.052 1.00 0.00 H new ATOM 0 HH11 ARG A 161 -10.009 11.712 -2.140 1.00 0.00 H new ATOM 0 HH12 ARG A 161 -10.875 11.164 -3.579 1.00 0.00 H new ATOM 0 HH21 ARG A 161 -13.057 9.047 -1.792 1.00 0.00 H new ATOM 0 HH22 ARG A 161 -12.593 9.662 -3.382 1.00 0.00 H new ATOM 1818 N ALA A 162 -9.722 11.172 5.518 1.00 0.00 N ATOM 1819 CA ALA A 162 -9.942 9.975 6.327 1.00 0.00 C ATOM 1820 C ALA A 162 -11.170 10.128 7.218 1.00 0.00 C ATOM 1821 O ALA A 162 -11.878 9.158 7.490 1.00 0.00 O ATOM 1822 CB ALA A 162 -8.711 9.649 7.160 1.00 0.00 C ATOM 0 H ALA A 162 -8.854 11.667 5.723 1.00 0.00 H new ATOM 0 HA ALA A 162 -10.124 9.144 5.646 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -8.900 8.754 7.753 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -7.861 9.474 6.500 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -8.489 10.484 7.824 1.00 0.00 H new ATOM 1828 N LYS A 163 -11.428 11.346 7.670 1.00 0.00 N ATOM 1829 CA LYS A 163 -12.612 11.613 8.479 1.00 0.00 C ATOM 1830 C LYS A 163 -13.551 12.571 7.751 1.00 0.00 C ATOM 1831 O LYS A 163 -14.553 13.020 8.305 1.00 0.00 O ATOM 1832 CB LYS A 163 -12.232 12.195 9.849 1.00 0.00 C ATOM 1833 CG LYS A 163 -11.957 13.695 9.841 1.00 0.00 C ATOM 1834 CD LYS A 163 -10.623 14.040 9.202 1.00 0.00 C ATOM 1835 CE LYS A 163 -9.452 13.602 10.067 1.00 0.00 C ATOM 1836 NZ LYS A 163 -9.406 14.344 11.356 1.00 0.00 N1+ ATOM 0 H LYS A 163 -10.840 12.161 7.493 1.00 0.00 H new ATOM 0 HA LYS A 163 -13.123 10.664 8.640 1.00 0.00 H new ATOM 0 HB2 LYS A 163 -13.038 11.989 10.554 1.00 0.00 H new ATOM 0 HB3 LYS A 163 -11.346 11.677 10.217 1.00 0.00 H new ATOM 0 HG2 LYS A 163 -12.756 14.204 9.303 1.00 0.00 H new ATOM 0 HG3 LYS A 163 -11.973 14.069 10.865 1.00 0.00 H new ATOM 0 HD2 LYS A 163 -10.553 13.560 8.226 1.00 0.00 H new ATOM 0 HD3 LYS A 163 -10.568 15.116 9.034 1.00 0.00 H new ATOM 0 HE2 LYS A 163 -9.528 12.533 10.266 1.00 0.00 H new ATOM 0 HE3 LYS A 163 -8.520 13.760 9.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 -8.469 14.225 11.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 -9.581 15.354 11.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 -10.136 13.972 11.997 1.00 0.00 H new ATOM 1850 N GLY A 164 -13.221 12.870 6.507 1.00 0.00 N ATOM 1851 CA GLY A 164 -13.997 13.828 5.751 1.00 0.00 C ATOM 1852 C GLY A 164 -14.485 13.264 4.439 1.00 0.00 C ATOM 1853 O GLY A 164 -14.028 13.674 3.375 1.00 0.00 O ATOM 0 H GLY A 164 -12.429 12.467 6.006 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -14.852 14.150 6.346 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -13.390 14.713 5.560 1.00 0.00 H new ATOM 1857 N HIS A 165 -15.397 12.310 4.515 1.00 0.00 N ATOM 1858 CA HIS A 165 -16.002 11.756 3.321 1.00 0.00 C ATOM 1859 C HIS A 165 -17.099 12.686 2.821 1.00 0.00 C ATOM 1860 O HIS A 165 -18.223 12.627 3.361 1.00 0.00 O ATOM 1861 CB HIS A 165 -16.569 10.356 3.582 1.00 0.00 C ATOM 1862 CG HIS A 165 -17.278 9.777 2.393 1.00 0.00 C ATOM 1863 ND1 HIS A 165 -16.621 9.180 1.341 1.00 0.00 N ATOM 1864 CD2 HIS A 165 -18.593 9.751 2.075 1.00 0.00 C ATOM 1865 CE1 HIS A 165 -17.499 8.819 0.427 1.00 0.00 C ATOM 1866 NE2 HIS A 165 -18.703 9.151 0.849 1.00 0.00 N ATOM 1867 OXT HIS A 165 -16.828 13.475 1.895 1.00 0.00 O ATOM 0 H HIS A 165 -15.733 11.905 5.389 1.00 0.00 H new ATOM 0 HA HIS A 165 -15.230 11.664 2.557 1.00 0.00 H new ATOM 0 HB2 HIS A 165 -15.757 9.690 3.873 1.00 0.00 H new ATOM 0 HB3 HIS A 165 -17.261 10.402 4.423 1.00 0.00 H new ATOM 0 HD2 HIS A 165 -19.405 10.133 2.676 1.00 0.00 H new ATOM 0 HE1 HIS A 165 -17.271 8.333 -0.510 1.00 0.00 H new ATOM 0 HE2 HIS A 165 -19.574 8.988 0.345 1.00 0.00 H new TER 1876 HIS A 165