USER MOD reduce.3.24.130724 H: found=0, std=0, add=838, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 837 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 7 SER OG : rot 180:sc= -0.182 USER MOD Single : A 8 LYS NZ :NH3+ 155:sc= 0.282 (180deg=0.131) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN :FLIP amide:sc= -0.287 F(o=-1.2,f=-0.29) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 157:sc= -0.118 (180deg=-0.76) USER MOD Single : A 37 MET CE :methyl -159:sc= -0.0999 (180deg=-0.544) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 44 SER OG : rot 88:sc= 0.412 USER MOD Single : A 46 SER OG : rot -36:sc= 1.12 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot -57:sc= 0.486 USER MOD Single : A 51 ASN : amide:sc= -0.193 K(o=-0.19,f=-1.3!) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 TYR OH : rot -58:sc= 0.838 USER MOD Single : A 76 THR OG1 : rot -98:sc= 0.928 USER MOD Single : A 81 LYS NZ :NH3+ -127:sc= 0 (180deg=-0.00386) USER MOD Single : A 82 ASN : amide:sc= 0.154 X(o=0.15,f=-0.31) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= 0.0269 K(o=0.027,f=-3.6) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.255 K(o=-0.26,f=-1.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.757 -4.335 -0.715 1.00 0.00 N ATOM 2 CA MET A 1 2.258 -5.486 -1.516 1.00 0.00 C ATOM 3 C MET A 1 0.766 -5.346 -1.809 1.00 0.00 C ATOM 4 O MET A 1 -0.036 -6.192 -1.419 1.00 0.00 O ATOM 5 CB MET A 1 2.532 -6.769 -0.728 1.00 0.00 C ATOM 6 CG MET A 1 2.871 -7.972 -1.596 1.00 0.00 C ATOM 7 SD MET A 1 4.649 -8.245 -1.742 1.00 0.00 S ATOM 8 CE MET A 1 4.790 -9.924 -1.138 1.00 0.00 C ATOM 0 H1 MET A 1 3.773 -4.455 -0.530 1.00 0.00 H new ATOM 0 H2 MET A 1 2.603 -3.452 -1.243 1.00 0.00 H new ATOM 0 H3 MET A 1 2.244 -4.292 0.188 1.00 0.00 H new ATOM 0 HA MET A 1 2.774 -5.516 -2.476 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.356 -6.589 -0.037 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.656 -7.006 -0.124 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.404 -8.862 -1.175 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.446 -7.829 -2.590 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.834 -10.235 -1.168 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.426 -9.973 -0.112 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.196 -10.588 -1.766 1.00 0.00 H new ATOM 20 N VAL A 2 0.404 -4.273 -2.504 1.00 0.00 N ATOM 21 CA VAL A 2 -0.990 -4.017 -2.853 1.00 0.00 C ATOM 22 C VAL A 2 -1.108 -3.558 -4.300 1.00 0.00 C ATOM 23 O VAL A 2 -0.225 -2.875 -4.817 1.00 0.00 O ATOM 24 CB VAL A 2 -1.609 -2.939 -1.932 1.00 0.00 C ATOM 25 CG1 VAL A 2 -3.097 -2.754 -2.212 1.00 0.00 C ATOM 26 CG2 VAL A 2 -1.378 -3.289 -0.471 1.00 0.00 C ATOM 0 H VAL A 2 1.058 -3.565 -2.838 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.533 -4.953 -2.721 1.00 0.00 H new ATOM 0 HB VAL A 2 -1.112 -1.993 -2.146 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -3.500 -1.990 -1.548 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -3.237 -2.445 -3.248 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -3.619 -3.695 -2.041 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -1.820 -2.520 0.162 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.841 -4.251 -0.250 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -0.307 -3.348 -0.276 1.00 0.00 H new ATOM 36 N LYS A 3 -2.198 -3.939 -4.953 1.00 0.00 N ATOM 37 CA LYS A 3 -2.420 -3.561 -6.336 1.00 0.00 C ATOM 38 C LYS A 3 -3.896 -3.311 -6.573 1.00 0.00 C ATOM 39 O LYS A 3 -4.732 -4.188 -6.359 1.00 0.00 O ATOM 40 CB LYS A 3 -1.919 -4.655 -7.286 1.00 0.00 C ATOM 41 CG LYS A 3 -2.315 -6.059 -6.859 1.00 0.00 C ATOM 42 CD LYS A 3 -1.789 -7.112 -7.822 1.00 0.00 C ATOM 43 CE LYS A 3 -0.339 -7.463 -7.527 1.00 0.00 C ATOM 44 NZ LYS A 3 0.002 -8.844 -7.972 1.00 0.00 N ATOM 0 H LYS A 3 -2.939 -4.509 -4.545 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.862 -2.647 -6.536 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -2.310 -4.464 -8.285 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -0.833 -4.597 -7.353 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -1.930 -6.257 -5.859 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -3.401 -6.129 -6.802 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -2.403 -8.010 -7.752 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -1.875 -6.746 -8.845 1.00 0.00 H new ATOM 0 HE2 LYS A 3 0.316 -6.749 -8.026 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -0.154 -7.371 -6.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 0.999 -9.043 -7.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.605 -9.528 -7.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -0.150 -8.926 -8.998 1.00 0.00 H new ATOM 58 N GLN A 4 -4.210 -2.100 -7.004 1.00 0.00 N ATOM 59 CA GLN A 4 -5.588 -1.729 -7.263 1.00 0.00 C ATOM 60 C GLN A 4 -6.058 -2.379 -8.562 1.00 0.00 C ATOM 61 O GLN A 4 -5.387 -2.291 -9.590 1.00 0.00 O ATOM 62 CB GLN A 4 -5.730 -0.208 -7.335 1.00 0.00 C ATOM 63 CG GLN A 4 -7.149 0.263 -7.626 1.00 0.00 C ATOM 64 CD GLN A 4 -7.614 1.353 -6.675 1.00 0.00 C ATOM 65 OE1 GLN A 4 -6.909 2.336 -6.445 1.00 0.00 O ATOM 66 NE2 GLN A 4 -8.811 1.187 -6.121 1.00 0.00 N ATOM 0 H GLN A 4 -3.530 -1.360 -7.181 1.00 0.00 H new ATOM 0 HA GLN A 4 -6.213 -2.085 -6.444 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -5.400 0.224 -6.390 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -5.064 0.174 -8.109 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -7.201 0.634 -8.650 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -7.830 -0.586 -7.559 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -9.363 0.357 -6.339 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -9.177 1.889 -5.478 1.00 0.00 H new ATOM 75 N ILE A 5 -7.205 -3.039 -8.501 1.00 0.00 N ATOM 76 CA ILE A 5 -7.763 -3.720 -9.664 1.00 0.00 C ATOM 77 C ILE A 5 -8.875 -2.877 -10.294 1.00 0.00 C ATOM 78 O ILE A 5 -9.959 -2.735 -9.730 1.00 0.00 O ATOM 79 CB ILE A 5 -8.264 -5.141 -9.268 1.00 0.00 C ATOM 80 CG1 ILE A 5 -7.179 -6.188 -9.551 1.00 0.00 C ATOM 81 CG2 ILE A 5 -9.551 -5.534 -9.987 1.00 0.00 C ATOM 82 CD1 ILE A 5 -5.786 -5.776 -9.118 1.00 0.00 C ATOM 0 H ILE A 5 -7.771 -3.119 -7.656 1.00 0.00 H new ATOM 0 HA ILE A 5 -6.983 -3.844 -10.415 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.481 -5.108 -8.200 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -7.445 -7.116 -9.044 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.166 -6.401 -10.620 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -9.853 -6.533 -9.672 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -10.338 -4.822 -9.739 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.382 -5.528 -11.064 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -5.081 -6.573 -9.355 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.496 -4.866 -9.644 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.778 -5.592 -8.044 1.00 0.00 H new ATOM 94 N GLU A 6 -8.581 -2.307 -11.462 1.00 0.00 N ATOM 95 CA GLU A 6 -9.541 -1.468 -12.170 1.00 0.00 C ATOM 96 C GLU A 6 -10.237 -2.225 -13.294 1.00 0.00 C ATOM 97 O GLU A 6 -10.813 -1.615 -14.196 1.00 0.00 O ATOM 98 CB GLU A 6 -8.850 -0.221 -12.729 1.00 0.00 C ATOM 99 CG GLU A 6 -8.846 0.958 -11.770 1.00 0.00 C ATOM 100 CD GLU A 6 -7.710 1.926 -12.040 1.00 0.00 C ATOM 101 OE1 GLU A 6 -6.598 1.459 -12.361 1.00 0.00 O ATOM 102 OE2 GLU A 6 -7.934 3.149 -11.934 1.00 0.00 O ATOM 0 H GLU A 6 -7.684 -2.412 -11.937 1.00 0.00 H new ATOM 0 HA GLU A 6 -10.302 -1.167 -11.450 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -7.821 -0.472 -12.987 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -9.347 0.075 -13.653 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -9.796 1.488 -11.847 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -8.769 0.589 -10.747 1.00 0.00 H new ATOM 109 N SER A 7 -10.185 -3.547 -13.248 1.00 0.00 N ATOM 110 CA SER A 7 -10.818 -4.362 -14.279 1.00 0.00 C ATOM 111 C SER A 7 -11.189 -5.738 -13.744 1.00 0.00 C ATOM 112 O SER A 7 -10.617 -6.208 -12.760 1.00 0.00 O ATOM 113 CB SER A 7 -9.894 -4.509 -15.491 1.00 0.00 C ATOM 114 OG SER A 7 -9.489 -3.244 -15.981 1.00 0.00 O ATOM 0 H SER A 7 -9.715 -4.078 -12.514 1.00 0.00 H new ATOM 0 HA SER A 7 -11.732 -3.854 -14.586 1.00 0.00 H new ATOM 0 HB2 SER A 7 -9.016 -5.093 -15.214 1.00 0.00 H new ATOM 0 HB3 SER A 7 -10.408 -5.060 -16.279 1.00 0.00 H new ATOM 0 HG SER A 7 -8.899 -3.366 -16.754 1.00 0.00 H new ATOM 120 N LYS A 8 -12.142 -6.385 -14.407 1.00 0.00 N ATOM 121 CA LYS A 8 -12.579 -7.714 -14.004 1.00 0.00 C ATOM 122 C LYS A 8 -11.507 -8.750 -14.324 1.00 0.00 C ATOM 123 O LYS A 8 -11.421 -9.790 -13.672 1.00 0.00 O ATOM 124 CB LYS A 8 -13.890 -8.081 -14.704 1.00 0.00 C ATOM 125 CG LYS A 8 -14.423 -9.448 -14.314 1.00 0.00 C ATOM 126 CD LYS A 8 -14.694 -10.316 -15.534 1.00 0.00 C ATOM 127 CE LYS A 8 -14.412 -11.781 -15.244 1.00 0.00 C ATOM 128 NZ LYS A 8 -12.952 -12.055 -15.182 1.00 0.00 N ATOM 0 H LYS A 8 -12.625 -6.010 -15.224 1.00 0.00 H new ATOM 0 HA LYS A 8 -12.747 -7.707 -12.927 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -14.641 -7.327 -14.470 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -13.737 -8.054 -15.783 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -13.704 -9.947 -13.665 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -15.342 -9.330 -13.740 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -15.732 -10.198 -15.843 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -14.074 -9.982 -16.366 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -14.876 -12.061 -14.298 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -14.866 -12.400 -16.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -12.781 -12.895 -14.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -12.590 -12.225 -16.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -12.462 -11.236 -14.767 1.00 0.00 H new ATOM 142 N THR A 9 -10.682 -8.454 -15.325 1.00 0.00 N ATOM 143 CA THR A 9 -9.608 -9.354 -15.725 1.00 0.00 C ATOM 144 C THR A 9 -8.417 -9.209 -14.782 1.00 0.00 C ATOM 145 O THR A 9 -7.677 -10.163 -14.542 1.00 0.00 O ATOM 146 CB THR A 9 -9.178 -9.059 -17.165 1.00 0.00 C ATOM 147 OG1 THR A 9 -10.302 -8.735 -17.963 1.00 0.00 O ATOM 148 CG2 THR A 9 -8.461 -10.212 -17.837 1.00 0.00 C ATOM 0 H THR A 9 -10.738 -7.596 -15.874 1.00 0.00 H new ATOM 0 HA THR A 9 -9.975 -10.379 -15.671 1.00 0.00 H new ATOM 0 HB THR A 9 -8.484 -8.222 -17.088 1.00 0.00 H new ATOM 0 HG1 THR A 9 -10.010 -8.548 -18.879 1.00 0.00 H new ATOM 0 HG21 THR A 9 -8.188 -9.928 -18.853 1.00 0.00 H new ATOM 0 HG22 THR A 9 -7.560 -10.458 -17.274 1.00 0.00 H new ATOM 0 HG23 THR A 9 -9.118 -11.081 -17.867 1.00 0.00 H new ATOM 156 N ALA A 10 -8.236 -7.999 -14.254 1.00 0.00 N ATOM 157 CA ALA A 10 -7.135 -7.722 -13.341 1.00 0.00 C ATOM 158 C ALA A 10 -7.309 -8.478 -12.027 1.00 0.00 C ATOM 159 O ALA A 10 -6.336 -8.961 -11.451 1.00 0.00 O ATOM 160 CB ALA A 10 -7.019 -6.224 -13.089 1.00 0.00 C ATOM 0 H ALA A 10 -8.838 -7.198 -14.444 1.00 0.00 H new ATOM 0 HA ALA A 10 -6.212 -8.068 -13.806 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -6.192 -6.033 -12.405 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -6.836 -5.709 -14.032 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -7.946 -5.856 -12.649 1.00 0.00 H new ATOM 166 N PHE A 11 -8.552 -8.611 -11.571 1.00 0.00 N ATOM 167 CA PHE A 11 -8.838 -9.333 -10.329 1.00 0.00 C ATOM 168 C PHE A 11 -8.361 -10.773 -10.447 1.00 0.00 C ATOM 169 O PHE A 11 -7.746 -11.315 -9.528 1.00 0.00 O ATOM 170 CB PHE A 11 -10.339 -9.293 -10.018 1.00 0.00 C ATOM 171 CG PHE A 11 -10.659 -9.570 -8.578 1.00 0.00 C ATOM 172 CD1 PHE A 11 -9.964 -8.929 -7.568 1.00 0.00 C ATOM 173 CD2 PHE A 11 -11.652 -10.476 -8.233 1.00 0.00 C ATOM 174 CE1 PHE A 11 -10.249 -9.181 -6.242 1.00 0.00 C ATOM 175 CE2 PHE A 11 -11.942 -10.732 -6.906 1.00 0.00 C ATOM 176 CZ PHE A 11 -11.239 -10.085 -5.911 1.00 0.00 C ATOM 0 H PHE A 11 -9.375 -8.231 -12.038 1.00 0.00 H new ATOM 0 HA PHE A 11 -8.305 -8.849 -9.510 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -10.732 -8.313 -10.287 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -10.851 -10.024 -10.643 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -9.188 -8.222 -7.821 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -12.204 -10.986 -9.009 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -9.699 -8.672 -5.464 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -12.718 -11.438 -6.649 1.00 0.00 H new ATOM 0 HZ PHE A 11 -11.463 -10.285 -4.874 1.00 0.00 H new ATOM 186 N GLN A 12 -8.628 -11.374 -11.596 1.00 0.00 N ATOM 187 CA GLN A 12 -8.205 -12.741 -11.854 1.00 0.00 C ATOM 188 C GLN A 12 -6.684 -12.800 -11.931 1.00 0.00 C ATOM 189 O GLN A 12 -6.054 -13.695 -11.364 1.00 0.00 O ATOM 190 CB GLN A 12 -8.819 -13.253 -13.158 1.00 0.00 C ATOM 191 CG GLN A 12 -10.339 -13.263 -13.154 1.00 0.00 C ATOM 192 CD GLN A 12 -10.926 -14.120 -12.045 1.00 0.00 C ATOM 193 OE1 GLN A 12 -10.939 -13.589 -10.830 1.00 0.00 O flip ATOM 194 NE2 GLN A 12 -11.361 -15.247 -12.280 1.00 0.00 N flip ATOM 0 H GLN A 12 -9.136 -10.936 -12.365 1.00 0.00 H new ATOM 0 HA GLN A 12 -8.548 -13.378 -11.039 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -8.471 -12.631 -13.982 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -8.458 -14.264 -13.347 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -10.703 -12.241 -13.047 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -10.697 -13.629 -14.116 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -11.332 -15.617 -13.230 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -11.751 -15.811 -11.525 1.00 0.00 H new ATOM 203 N GLU A 13 -6.101 -11.837 -12.646 1.00 0.00 N ATOM 204 CA GLU A 13 -4.655 -11.765 -12.819 1.00 0.00 C ATOM 205 C GLU A 13 -3.945 -11.668 -11.475 1.00 0.00 C ATOM 206 O GLU A 13 -2.964 -12.368 -11.224 1.00 0.00 O ATOM 207 CB GLU A 13 -4.287 -10.557 -13.685 1.00 0.00 C ATOM 208 CG GLU A 13 -4.028 -10.910 -15.140 1.00 0.00 C ATOM 209 CD GLU A 13 -3.069 -9.949 -15.818 1.00 0.00 C ATOM 210 OE1 GLU A 13 -1.878 -9.929 -15.442 1.00 0.00 O ATOM 211 OE2 GLU A 13 -3.511 -9.216 -16.728 1.00 0.00 O ATOM 0 H GLU A 13 -6.615 -11.092 -13.117 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.330 -12.680 -13.315 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -5.093 -9.825 -13.635 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -3.398 -10.081 -13.271 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -3.623 -11.920 -15.197 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -4.974 -10.914 -15.682 1.00 0.00 H new ATOM 218 N ALA A 14 -4.447 -10.792 -10.614 1.00 0.00 N ATOM 219 CA ALA A 14 -3.859 -10.599 -9.297 1.00 0.00 C ATOM 220 C ALA A 14 -4.037 -11.838 -8.429 1.00 0.00 C ATOM 221 O ALA A 14 -3.201 -12.133 -7.574 1.00 0.00 O ATOM 222 CB ALA A 14 -4.472 -9.382 -8.624 1.00 0.00 C ATOM 0 H ALA A 14 -5.259 -10.205 -10.805 1.00 0.00 H new ATOM 0 HA ALA A 14 -2.789 -10.431 -9.422 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -4.025 -9.247 -7.639 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -4.285 -8.497 -9.232 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.547 -9.528 -8.517 1.00 0.00 H new ATOM 228 N LEU A 15 -5.123 -12.565 -8.656 1.00 0.00 N ATOM 229 CA LEU A 15 -5.397 -13.774 -7.893 1.00 0.00 C ATOM 230 C LEU A 15 -4.396 -14.870 -8.263 1.00 0.00 C ATOM 231 O LEU A 15 -3.913 -15.612 -7.399 1.00 0.00 O ATOM 232 CB LEU A 15 -6.836 -14.240 -8.142 1.00 0.00 C ATOM 233 CG LEU A 15 -7.889 -13.591 -7.239 1.00 0.00 C ATOM 234 CD1 LEU A 15 -9.287 -14.020 -7.655 1.00 0.00 C ATOM 235 CD2 LEU A 15 -7.634 -13.946 -5.782 1.00 0.00 C ATOM 0 H LEU A 15 -5.826 -12.339 -9.360 1.00 0.00 H new ATOM 0 HA LEU A 15 -5.287 -13.557 -6.831 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -7.094 -14.036 -9.181 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -6.881 -15.321 -8.009 1.00 0.00 H new ATOM 0 HG LEU A 15 -7.815 -12.509 -7.348 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -10.022 -13.549 -7.002 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -9.469 -13.716 -8.686 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -9.374 -15.104 -7.576 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -8.392 -13.476 -5.155 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -7.680 -15.028 -5.658 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -6.647 -13.589 -5.488 1.00 0.00 H new ATOM 247 N ASP A 16 -4.066 -14.948 -9.553 1.00 0.00 N ATOM 248 CA ASP A 16 -3.108 -15.935 -10.040 1.00 0.00 C ATOM 249 C ASP A 16 -1.750 -15.717 -9.386 1.00 0.00 C ATOM 250 O ASP A 16 -1.010 -16.668 -9.131 1.00 0.00 O ATOM 251 CB ASP A 16 -2.969 -15.840 -11.561 1.00 0.00 C ATOM 252 CG ASP A 16 -2.691 -17.187 -12.199 1.00 0.00 C ATOM 253 OD1 ASP A 16 -3.535 -18.095 -12.057 1.00 0.00 O ATOM 254 OD2 ASP A 16 -1.627 -17.333 -12.838 1.00 0.00 O ATOM 0 H ASP A 16 -4.449 -14.339 -10.277 1.00 0.00 H new ATOM 0 HA ASP A 16 -3.475 -16.928 -9.780 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -3.884 -15.423 -11.982 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -2.162 -15.150 -11.807 1.00 0.00 H new ATOM 259 N ALA A 17 -1.434 -14.457 -9.110 1.00 0.00 N ATOM 260 CA ALA A 17 -0.174 -14.109 -8.467 1.00 0.00 C ATOM 261 C ALA A 17 -0.224 -14.412 -6.972 1.00 0.00 C ATOM 262 O ALA A 17 0.809 -14.614 -6.333 1.00 0.00 O ATOM 263 CB ALA A 17 0.154 -12.643 -8.708 1.00 0.00 C ATOM 0 H ALA A 17 -2.034 -13.660 -9.322 1.00 0.00 H new ATOM 0 HA ALA A 17 0.616 -14.718 -8.907 1.00 0.00 H new ATOM 0 HB1 ALA A 17 1.098 -12.397 -8.222 1.00 0.00 H new ATOM 0 HB2 ALA A 17 0.239 -12.461 -9.779 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.640 -12.020 -8.296 1.00 0.00 H new ATOM 269 N ALA A 18 -1.436 -14.448 -6.423 1.00 0.00 N ATOM 270 CA ALA A 18 -1.631 -14.725 -5.005 1.00 0.00 C ATOM 271 C ALA A 18 -1.244 -16.158 -4.663 1.00 0.00 C ATOM 272 O ALA A 18 -0.737 -16.423 -3.571 1.00 0.00 O ATOM 273 CB ALA A 18 -3.074 -14.437 -4.607 1.00 0.00 C ATOM 0 H ALA A 18 -2.299 -14.288 -6.942 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.976 -14.067 -4.434 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -3.208 -14.648 -3.546 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -3.303 -13.389 -4.801 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -3.745 -15.068 -5.189 1.00 0.00 H new ATOM 279 N GLY A 19 -1.455 -17.087 -5.598 1.00 0.00 N ATOM 280 CA GLY A 19 -1.092 -18.474 -5.352 1.00 0.00 C ATOM 281 C GLY A 19 -1.777 -19.062 -4.137 1.00 0.00 C ATOM 282 O GLY A 19 -3.007 -19.086 -4.058 1.00 0.00 O ATOM 0 H GLY A 19 -1.867 -16.905 -6.513 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -1.346 -19.070 -6.228 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -0.012 -18.543 -5.221 1.00 0.00 H new ATOM 286 N ASP A 20 -0.982 -19.539 -3.187 1.00 0.00 N ATOM 287 CA ASP A 20 -1.520 -20.131 -1.970 1.00 0.00 C ATOM 288 C ASP A 20 -1.569 -19.111 -0.836 1.00 0.00 C ATOM 289 O ASP A 20 -1.882 -19.455 0.303 1.00 0.00 O ATOM 290 CB ASP A 20 -0.680 -21.340 -1.548 1.00 0.00 C ATOM 291 CG ASP A 20 -1.315 -22.115 -0.410 1.00 0.00 C ATOM 292 OD1 ASP A 20 -2.561 -22.175 -0.357 1.00 0.00 O ATOM 293 OD2 ASP A 20 -0.567 -22.660 0.428 1.00 0.00 O ATOM 0 H ASP A 20 0.037 -19.527 -3.236 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.538 -20.459 -2.180 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.545 -22.002 -2.404 1.00 0.00 H new ATOM 0 HB3 ASP A 20 0.311 -21.003 -1.246 1.00 0.00 H new ATOM 298 N LYS A 21 -1.285 -17.850 -1.155 1.00 0.00 N ATOM 299 CA LYS A 21 -1.317 -16.785 -0.168 1.00 0.00 C ATOM 300 C LYS A 21 -2.753 -16.356 0.080 1.00 0.00 C ATOM 301 O LYS A 21 -3.581 -16.385 -0.830 1.00 0.00 O ATOM 302 CB LYS A 21 -0.492 -15.591 -0.657 1.00 0.00 C ATOM 303 CG LYS A 21 0.913 -15.977 -1.082 1.00 0.00 C ATOM 304 CD LYS A 21 1.720 -14.772 -1.540 1.00 0.00 C ATOM 305 CE LYS A 21 3.149 -15.170 -1.876 1.00 0.00 C ATOM 306 NZ LYS A 21 3.592 -14.596 -3.174 1.00 0.00 N ATOM 0 H LYS A 21 -1.030 -17.545 -2.094 1.00 0.00 H new ATOM 0 HA LYS A 21 -0.888 -17.152 0.764 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -1.004 -15.122 -1.497 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.434 -14.846 0.137 1.00 0.00 H new ATOM 0 HG2 LYS A 21 1.424 -16.460 -0.249 1.00 0.00 H new ATOM 0 HG3 LYS A 21 0.860 -16.706 -1.890 1.00 0.00 H new ATOM 0 HD2 LYS A 21 1.248 -14.325 -2.415 1.00 0.00 H new ATOM 0 HD3 LYS A 21 1.724 -14.014 -0.757 1.00 0.00 H new ATOM 0 HE2 LYS A 21 3.816 -14.833 -1.083 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.224 -16.257 -1.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 4.571 -14.890 -3.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 2.971 -14.938 -3.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 3.545 -13.558 -3.129 1.00 0.00 H new ATOM 320 N LEU A 22 -3.044 -15.933 1.299 1.00 0.00 N ATOM 321 CA LEU A 22 -4.383 -15.473 1.635 1.00 0.00 C ATOM 322 C LEU A 22 -4.575 -14.080 1.057 1.00 0.00 C ATOM 323 O LEU A 22 -3.681 -13.238 1.158 1.00 0.00 O ATOM 324 CB LEU A 22 -4.577 -15.460 3.156 1.00 0.00 C ATOM 325 CG LEU A 22 -5.859 -14.788 3.669 1.00 0.00 C ATOM 326 CD1 LEU A 22 -7.068 -15.176 2.822 1.00 0.00 C ATOM 327 CD2 LEU A 22 -6.086 -15.150 5.132 1.00 0.00 C ATOM 0 H LEU A 22 -2.376 -15.898 2.069 1.00 0.00 H new ATOM 0 HA LEU A 22 -5.125 -16.150 1.212 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.564 -16.490 3.512 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -3.722 -14.956 3.606 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.736 -13.708 3.587 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.959 -14.683 3.212 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.904 -14.866 1.790 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -7.206 -16.257 2.858 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.997 -14.670 5.489 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -6.184 -16.231 5.228 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.239 -14.808 5.727 1.00 0.00 H new ATOM 339 N VAL A 23 -5.713 -13.844 0.423 1.00 0.00 N ATOM 340 CA VAL A 23 -5.963 -12.550 -0.189 1.00 0.00 C ATOM 341 C VAL A 23 -7.141 -11.833 0.451 1.00 0.00 C ATOM 342 O VAL A 23 -8.301 -12.183 0.233 1.00 0.00 O ATOM 343 CB VAL A 23 -6.205 -12.677 -1.709 1.00 0.00 C ATOM 344 CG1 VAL A 23 -6.096 -11.314 -2.380 1.00 0.00 C ATOM 345 CG2 VAL A 23 -5.224 -13.660 -2.334 1.00 0.00 C ATOM 0 H VAL A 23 -6.468 -14.522 0.320 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.064 -11.957 -0.021 1.00 0.00 H new ATOM 0 HB VAL A 23 -7.214 -13.060 -1.863 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -6.269 -11.421 -3.451 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -6.841 -10.640 -1.957 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.100 -10.905 -2.213 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.414 -13.733 -3.405 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.205 -13.311 -2.169 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -5.350 -14.641 -1.876 1.00 0.00 H new ATOM 355 N VAL A 24 -6.825 -10.798 1.218 1.00 0.00 N ATOM 356 CA VAL A 24 -7.840 -9.988 1.862 1.00 0.00 C ATOM 357 C VAL A 24 -7.995 -8.713 1.057 1.00 0.00 C ATOM 358 O VAL A 24 -7.066 -7.916 0.938 1.00 0.00 O ATOM 359 CB VAL A 24 -7.476 -9.656 3.323 1.00 0.00 C ATOM 360 CG1 VAL A 24 -6.139 -8.934 3.392 1.00 0.00 C ATOM 361 CG2 VAL A 24 -8.576 -8.834 3.986 1.00 0.00 C ATOM 0 H VAL A 24 -5.868 -10.502 1.407 1.00 0.00 H new ATOM 0 HA VAL A 24 -8.776 -10.546 1.893 1.00 0.00 H new ATOM 0 HB VAL A 24 -7.384 -10.593 3.872 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -5.900 -8.709 4.431 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -5.360 -9.569 2.970 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -6.197 -8.006 2.824 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -8.295 -8.613 5.016 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -8.713 -7.901 3.439 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -9.508 -9.399 3.978 1.00 0.00 H new ATOM 371 N VAL A 25 -9.170 -8.548 0.473 1.00 0.00 N ATOM 372 CA VAL A 25 -9.445 -7.398 -0.365 1.00 0.00 C ATOM 373 C VAL A 25 -10.651 -6.613 0.146 1.00 0.00 C ATOM 374 O VAL A 25 -11.380 -7.074 1.025 1.00 0.00 O ATOM 375 CB VAL A 25 -9.656 -7.836 -1.829 1.00 0.00 C ATOM 376 CG1 VAL A 25 -8.326 -8.189 -2.469 1.00 0.00 C ATOM 377 CG2 VAL A 25 -10.581 -9.034 -1.909 1.00 0.00 C ATOM 0 H VAL A 25 -9.950 -9.199 0.566 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.580 -6.736 -0.323 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.110 -7.002 -2.364 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -8.489 -8.496 -3.502 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -7.670 -7.319 -2.449 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.862 -9.006 -1.916 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.713 -9.323 -2.952 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -10.147 -9.866 -1.354 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.549 -8.776 -1.479 1.00 0.00 H new ATOM 387 N ASP A 26 -10.843 -5.414 -0.397 1.00 0.00 N ATOM 388 CA ASP A 26 -11.949 -4.561 0.023 1.00 0.00 C ATOM 389 C ASP A 26 -12.671 -3.936 -1.167 1.00 0.00 C ATOM 390 O ASP A 26 -12.041 -3.385 -2.070 1.00 0.00 O ATOM 391 CB ASP A 26 -11.436 -3.462 0.959 1.00 0.00 C ATOM 392 CG ASP A 26 -12.559 -2.710 1.646 1.00 0.00 C ATOM 393 OD1 ASP A 26 -13.668 -2.641 1.074 1.00 0.00 O ATOM 394 OD2 ASP A 26 -12.330 -2.186 2.757 1.00 0.00 O ATOM 0 H ASP A 26 -10.251 -5.013 -1.124 1.00 0.00 H new ATOM 0 HA ASP A 26 -12.666 -5.188 0.552 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -10.787 -3.906 1.713 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -10.828 -2.759 0.389 1.00 0.00 H new ATOM 399 N PHE A 27 -14.001 -3.984 -1.131 1.00 0.00 N ATOM 400 CA PHE A 27 -14.830 -3.391 -2.180 1.00 0.00 C ATOM 401 C PHE A 27 -15.274 -1.997 -1.728 1.00 0.00 C ATOM 402 O PHE A 27 -16.051 -1.867 -0.781 1.00 0.00 O ATOM 403 CB PHE A 27 -16.053 -4.273 -2.465 1.00 0.00 C ATOM 404 CG PHE A 27 -15.826 -5.256 -3.580 1.00 0.00 C ATOM 405 CD1 PHE A 27 -15.069 -6.397 -3.364 1.00 0.00 C ATOM 406 CD2 PHE A 27 -16.347 -5.033 -4.847 1.00 0.00 C ATOM 407 CE1 PHE A 27 -14.841 -7.301 -4.387 1.00 0.00 C ATOM 408 CE2 PHE A 27 -16.124 -5.936 -5.873 1.00 0.00 C ATOM 409 CZ PHE A 27 -15.367 -7.070 -5.642 1.00 0.00 C ATOM 0 H PHE A 27 -14.531 -4.430 -0.382 1.00 0.00 H new ATOM 0 HA PHE A 27 -14.251 -3.313 -3.100 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -16.320 -4.816 -1.559 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -16.901 -3.637 -2.717 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -14.652 -6.583 -2.385 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -16.933 -4.145 -5.035 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -14.252 -8.187 -4.203 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -16.541 -5.755 -6.853 1.00 0.00 H new ATOM 0 HZ PHE A 27 -15.188 -7.773 -6.442 1.00 0.00 H new ATOM 419 N SER A 28 -14.753 -0.960 -2.377 1.00 0.00 N ATOM 420 CA SER A 28 -15.080 0.411 -2.001 1.00 0.00 C ATOM 421 C SER A 28 -15.746 1.175 -3.142 1.00 0.00 C ATOM 422 O SER A 28 -16.135 0.597 -4.158 1.00 0.00 O ATOM 423 CB SER A 28 -13.810 1.145 -1.554 1.00 0.00 C ATOM 424 OG SER A 28 -13.001 1.493 -2.664 1.00 0.00 O ATOM 0 H SER A 28 -14.106 -1.042 -3.161 1.00 0.00 H new ATOM 0 HA SER A 28 -15.791 0.365 -1.176 1.00 0.00 H new ATOM 0 HB2 SER A 28 -14.082 2.045 -1.003 1.00 0.00 H new ATOM 0 HB3 SER A 28 -13.243 0.512 -0.871 1.00 0.00 H new ATOM 0 HG SER A 28 -12.199 1.961 -2.350 1.00 0.00 H new ATOM 430 N ALA A 29 -15.853 2.487 -2.957 1.00 0.00 N ATOM 431 CA ALA A 29 -16.448 3.374 -3.949 1.00 0.00 C ATOM 432 C ALA A 29 -15.852 4.770 -3.825 1.00 0.00 C ATOM 433 O ALA A 29 -15.411 5.166 -2.747 1.00 0.00 O ATOM 434 CB ALA A 29 -17.962 3.424 -3.780 1.00 0.00 C ATOM 0 H ALA A 29 -15.530 2.964 -2.116 1.00 0.00 H new ATOM 0 HA ALA A 29 -16.227 2.986 -4.943 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -18.390 4.091 -4.529 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -18.375 2.423 -3.907 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -18.205 3.794 -2.784 1.00 0.00 H new ATOM 440 N THR A 30 -15.879 5.534 -4.912 1.00 0.00 N ATOM 441 CA THR A 30 -15.373 6.904 -4.882 1.00 0.00 C ATOM 442 C THR A 30 -16.330 7.776 -4.077 1.00 0.00 C ATOM 443 O THR A 30 -15.918 8.683 -3.354 1.00 0.00 O ATOM 444 CB THR A 30 -15.214 7.445 -6.306 1.00 0.00 C ATOM 445 OG1 THR A 30 -14.599 6.478 -7.138 1.00 0.00 O ATOM 446 CG2 THR A 30 -14.385 8.709 -6.389 1.00 0.00 C ATOM 0 H THR A 30 -16.242 5.233 -5.817 1.00 0.00 H new ATOM 0 HA THR A 30 -14.392 6.918 -4.406 1.00 0.00 H new ATOM 0 HB THR A 30 -16.226 7.677 -6.637 1.00 0.00 H new ATOM 0 HG1 THR A 30 -14.506 6.838 -8.045 1.00 0.00 H new ATOM 0 HG21 THR A 30 -14.317 9.032 -7.428 1.00 0.00 H new ATOM 0 HG22 THR A 30 -14.856 9.493 -5.796 1.00 0.00 H new ATOM 0 HG23 THR A 30 -13.384 8.514 -6.003 1.00 0.00 H new ATOM 454 N TRP A 31 -17.617 7.470 -4.211 1.00 0.00 N ATOM 455 CA TRP A 31 -18.672 8.200 -3.513 1.00 0.00 C ATOM 456 C TRP A 31 -18.912 7.630 -2.106 1.00 0.00 C ATOM 457 O TRP A 31 -19.898 7.978 -1.457 1.00 0.00 O ATOM 458 CB TRP A 31 -19.968 8.111 -4.328 1.00 0.00 C ATOM 459 CG TRP A 31 -20.486 6.708 -4.416 1.00 0.00 C ATOM 460 CD1 TRP A 31 -20.067 5.722 -5.267 1.00 0.00 C ATOM 461 CD2 TRP A 31 -21.508 6.130 -3.602 1.00 0.00 C ATOM 462 NE1 TRP A 31 -20.762 4.562 -5.012 1.00 0.00 N ATOM 463 CE2 TRP A 31 -21.650 4.792 -4.000 1.00 0.00 C ATOM 464 CE3 TRP A 31 -22.310 6.617 -2.568 1.00 0.00 C ATOM 465 CZ2 TRP A 31 -22.564 3.933 -3.403 1.00 0.00 C ATOM 466 CZ3 TRP A 31 -23.219 5.764 -1.977 1.00 0.00 C ATOM 467 CH2 TRP A 31 -23.337 4.433 -2.394 1.00 0.00 C ATOM 0 H TRP A 31 -17.958 6.713 -4.803 1.00 0.00 H new ATOM 0 HA TRP A 31 -18.360 9.239 -3.408 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -20.726 8.748 -3.873 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -19.790 8.495 -5.333 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -19.306 5.837 -6.024 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -20.635 3.675 -5.499 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -22.220 7.641 -2.237 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -22.660 2.907 -3.725 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -23.850 6.129 -1.180 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -24.054 3.788 -1.908 1.00 0.00 H new ATOM 478 N CYS A 32 -18.017 6.754 -1.635 1.00 0.00 N ATOM 479 CA CYS A 32 -18.163 6.161 -0.304 1.00 0.00 C ATOM 480 C CYS A 32 -17.494 7.018 0.764 1.00 0.00 C ATOM 481 O CYS A 32 -16.595 7.808 0.472 1.00 0.00 O ATOM 482 CB CYS A 32 -17.582 4.740 -0.270 1.00 0.00 C ATOM 483 SG CYS A 32 -18.097 3.760 1.180 1.00 0.00 S ATOM 0 H CYS A 32 -17.193 6.444 -2.150 1.00 0.00 H new ATOM 0 HA CYS A 32 -19.230 6.112 -0.088 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -17.883 4.214 -1.176 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -16.494 4.803 -0.285 1.00 0.00 H new ATOM 488 N GLY A 33 -17.936 6.847 2.008 1.00 0.00 N ATOM 489 CA GLY A 33 -17.373 7.602 3.110 1.00 0.00 C ATOM 490 C GLY A 33 -16.588 6.718 4.063 1.00 0.00 C ATOM 491 O GLY A 33 -15.377 6.877 4.199 1.00 0.00 O ATOM 0 H GLY A 33 -18.676 6.196 2.271 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.720 8.382 2.719 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -18.175 8.100 3.655 1.00 0.00 H new ATOM 495 N PRO A 34 -17.256 5.771 4.747 1.00 0.00 N ATOM 496 CA PRO A 34 -16.598 4.862 5.694 1.00 0.00 C ATOM 497 C PRO A 34 -15.582 3.944 5.014 1.00 0.00 C ATOM 498 O PRO A 34 -14.680 3.417 5.664 1.00 0.00 O ATOM 499 CB PRO A 34 -17.756 4.036 6.273 1.00 0.00 C ATOM 500 CG PRO A 34 -18.980 4.829 5.975 1.00 0.00 C ATOM 501 CD PRO A 34 -18.704 5.510 4.666 1.00 0.00 C ATOM 0 HA PRO A 34 -16.031 5.410 6.446 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -17.804 3.048 5.815 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -17.635 3.884 7.346 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -19.858 4.186 5.906 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -19.178 5.556 6.762 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -18.956 4.875 3.816 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -19.278 6.430 4.558 1.00 0.00 H new ATOM 509 N CYS A 35 -15.729 3.757 3.702 1.00 0.00 N ATOM 510 CA CYS A 35 -14.812 2.904 2.946 1.00 0.00 C ATOM 511 C CYS A 35 -13.388 3.428 3.075 1.00 0.00 C ATOM 512 O CYS A 35 -12.434 2.661 3.213 1.00 0.00 O ATOM 513 CB CYS A 35 -15.209 2.854 1.467 1.00 0.00 C ATOM 514 SG CYS A 35 -16.860 2.149 1.154 1.00 0.00 S ATOM 0 H CYS A 35 -16.469 4.182 3.144 1.00 0.00 H new ATOM 0 HA CYS A 35 -14.867 1.896 3.356 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -15.176 3.865 1.060 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -14.468 2.267 0.924 1.00 0.00 H new ATOM 519 N LYS A 36 -13.265 4.749 3.036 1.00 0.00 N ATOM 520 CA LYS A 36 -11.974 5.417 3.154 1.00 0.00 C ATOM 521 C LYS A 36 -11.390 5.268 4.561 1.00 0.00 C ATOM 522 O LYS A 36 -10.197 5.484 4.770 1.00 0.00 O ATOM 523 CB LYS A 36 -12.128 6.900 2.801 1.00 0.00 C ATOM 524 CG LYS A 36 -11.970 7.195 1.314 1.00 0.00 C ATOM 525 CD LYS A 36 -12.811 8.384 0.881 1.00 0.00 C ATOM 526 CE LYS A 36 -12.226 9.686 1.396 1.00 0.00 C ATOM 527 NZ LYS A 36 -10.837 9.888 0.907 1.00 0.00 N ATOM 0 H LYS A 36 -14.054 5.386 2.922 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.282 4.944 2.457 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -13.110 7.242 3.128 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.388 7.476 3.357 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -10.921 7.392 1.092 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -12.258 6.317 0.737 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -12.870 8.414 -0.207 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -13.829 8.267 1.253 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -12.851 10.519 1.075 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -12.233 9.684 2.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -10.605 10.901 0.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -10.175 9.367 1.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -10.758 9.537 -0.069 1.00 0.00 H new ATOM 541 N MET A 37 -12.233 4.896 5.523 1.00 0.00 N ATOM 542 CA MET A 37 -11.784 4.722 6.905 1.00 0.00 C ATOM 543 C MET A 37 -10.968 3.444 7.072 1.00 0.00 C ATOM 544 O MET A 37 -10.155 3.334 7.988 1.00 0.00 O ATOM 545 CB MET A 37 -12.974 4.702 7.869 1.00 0.00 C ATOM 546 CG MET A 37 -13.942 5.855 7.671 1.00 0.00 C ATOM 547 SD MET A 37 -13.280 7.429 8.249 1.00 0.00 S ATOM 548 CE MET A 37 -13.257 7.158 10.020 1.00 0.00 C ATOM 0 H MET A 37 -13.225 4.710 5.373 1.00 0.00 H new ATOM 0 HA MET A 37 -11.146 5.573 7.144 1.00 0.00 H new ATOM 0 HB2 MET A 37 -13.513 3.762 7.747 1.00 0.00 H new ATOM 0 HB3 MET A 37 -12.601 4.725 8.893 1.00 0.00 H new ATOM 0 HG2 MET A 37 -14.191 5.937 6.613 1.00 0.00 H new ATOM 0 HG3 MET A 37 -14.870 5.640 8.201 1.00 0.00 H new ATOM 0 HE1 MET A 37 -13.238 8.119 10.535 1.00 0.00 H new ATOM 0 HE2 MET A 37 -14.149 6.606 10.315 1.00 0.00 H new ATOM 0 HE3 MET A 37 -12.370 6.585 10.289 1.00 0.00 H new ATOM 558 N ILE A 38 -11.192 2.474 6.190 1.00 0.00 N ATOM 559 CA ILE A 38 -10.478 1.202 6.263 1.00 0.00 C ATOM 560 C ILE A 38 -9.133 1.266 5.530 1.00 0.00 C ATOM 561 O ILE A 38 -8.218 0.504 5.839 1.00 0.00 O ATOM 562 CB ILE A 38 -11.319 0.058 5.656 1.00 0.00 C ATOM 563 CG1 ILE A 38 -12.767 0.107 6.174 1.00 0.00 C ATOM 564 CG2 ILE A 38 -10.674 -1.288 5.960 1.00 0.00 C ATOM 565 CD1 ILE A 38 -12.945 -0.402 7.589 1.00 0.00 C ATOM 0 H ILE A 38 -11.858 2.543 5.421 1.00 0.00 H new ATOM 0 HA ILE A 38 -10.299 1.005 7.320 1.00 0.00 H new ATOM 0 HB ILE A 38 -11.350 0.187 4.574 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -13.123 1.136 6.124 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -13.398 -0.481 5.508 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.277 -2.086 5.527 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.672 -1.316 5.532 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -10.611 -1.426 7.039 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -13.995 -0.331 7.872 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -12.624 -1.442 7.645 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.344 0.200 8.271 1.00 0.00 H new ATOM 577 N LYS A 39 -9.022 2.173 4.556 1.00 0.00 N ATOM 578 CA LYS A 39 -7.791 2.327 3.772 1.00 0.00 C ATOM 579 C LYS A 39 -6.551 2.449 4.663 1.00 0.00 C ATOM 580 O LYS A 39 -5.564 1.739 4.461 1.00 0.00 O ATOM 581 CB LYS A 39 -7.891 3.546 2.844 1.00 0.00 C ATOM 582 CG LYS A 39 -7.587 3.232 1.384 1.00 0.00 C ATOM 583 CD LYS A 39 -8.076 4.336 0.458 1.00 0.00 C ATOM 584 CE LYS A 39 -9.509 4.098 0.013 1.00 0.00 C ATOM 585 NZ LYS A 39 -9.570 3.330 -1.260 1.00 0.00 N ATOM 0 H LYS A 39 -9.770 2.813 4.290 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.680 1.424 3.171 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -8.895 3.964 2.915 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -7.201 4.314 3.192 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.513 3.099 1.256 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -8.060 2.289 1.108 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -8.008 5.297 0.968 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -7.427 4.392 -0.416 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -10.046 3.556 0.791 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -10.014 5.055 -0.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -10.564 3.187 -1.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -9.079 3.859 -2.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -9.110 2.406 -1.130 1.00 0.00 H new ATOM 599 N PRO A 40 -6.571 3.355 5.654 1.00 0.00 N ATOM 600 CA PRO A 40 -5.429 3.556 6.550 1.00 0.00 C ATOM 601 C PRO A 40 -5.019 2.277 7.279 1.00 0.00 C ATOM 602 O PRO A 40 -3.838 1.943 7.334 1.00 0.00 O ATOM 603 CB PRO A 40 -5.922 4.612 7.545 1.00 0.00 C ATOM 604 CG PRO A 40 -7.061 5.291 6.861 1.00 0.00 C ATOM 605 CD PRO A 40 -7.691 4.258 5.968 1.00 0.00 C ATOM 0 HA PRO A 40 -4.539 3.861 6.000 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -6.241 4.153 8.481 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -5.131 5.321 7.791 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -7.781 5.669 7.587 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -6.713 6.146 6.282 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -8.503 3.733 6.471 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -8.111 4.706 5.068 1.00 0.00 H new ATOM 613 N PHE A 41 -5.991 1.579 7.864 1.00 0.00 N ATOM 614 CA PHE A 41 -5.701 0.361 8.622 1.00 0.00 C ATOM 615 C PHE A 41 -5.514 -0.857 7.717 1.00 0.00 C ATOM 616 O PHE A 41 -4.747 -1.762 8.045 1.00 0.00 O ATOM 617 CB PHE A 41 -6.826 0.076 9.621 1.00 0.00 C ATOM 618 CG PHE A 41 -7.368 1.307 10.298 1.00 0.00 C ATOM 619 CD1 PHE A 41 -6.585 2.030 11.185 1.00 0.00 C ATOM 620 CD2 PHE A 41 -8.658 1.743 10.043 1.00 0.00 C ATOM 621 CE1 PHE A 41 -7.078 3.163 11.801 1.00 0.00 C ATOM 622 CE2 PHE A 41 -9.157 2.876 10.657 1.00 0.00 C ATOM 623 CZ PHE A 41 -8.365 3.586 11.538 1.00 0.00 C ATOM 0 H PHE A 41 -6.978 1.832 7.829 1.00 0.00 H new ATOM 0 HA PHE A 41 -4.764 0.535 9.151 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -7.640 -0.429 9.102 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -6.457 -0.612 10.382 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -5.578 1.703 11.397 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -9.282 1.190 9.356 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -6.457 3.718 12.488 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -10.164 3.206 10.448 1.00 0.00 H new ATOM 0 HZ PHE A 41 -8.752 4.471 12.021 1.00 0.00 H new ATOM 633 N PHE A 42 -6.201 -0.885 6.578 1.00 0.00 N ATOM 634 CA PHE A 42 -6.073 -2.006 5.652 1.00 0.00 C ATOM 635 C PHE A 42 -4.675 -2.044 5.060 1.00 0.00 C ATOM 636 O PHE A 42 -4.051 -3.103 4.980 1.00 0.00 O ATOM 637 CB PHE A 42 -7.109 -1.909 4.529 1.00 0.00 C ATOM 638 CG PHE A 42 -7.468 -3.237 3.923 1.00 0.00 C ATOM 639 CD1 PHE A 42 -8.307 -4.111 4.594 1.00 0.00 C ATOM 640 CD2 PHE A 42 -6.973 -3.609 2.682 1.00 0.00 C ATOM 641 CE1 PHE A 42 -8.645 -5.333 4.042 1.00 0.00 C ATOM 642 CE2 PHE A 42 -7.306 -4.831 2.125 1.00 0.00 C ATOM 643 CZ PHE A 42 -8.146 -5.692 2.805 1.00 0.00 C ATOM 0 H PHE A 42 -6.845 -0.153 6.277 1.00 0.00 H new ATOM 0 HA PHE A 42 -6.251 -2.926 6.210 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -8.013 -1.441 4.920 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -6.724 -1.255 3.747 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -8.702 -3.835 5.560 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -6.320 -2.937 2.144 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -9.298 -6.006 4.577 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.910 -5.111 1.160 1.00 0.00 H new ATOM 0 HZ PHE A 42 -8.412 -6.644 2.370 1.00 0.00 H new ATOM 653 N HIS A 43 -4.192 -0.883 4.632 1.00 0.00 N ATOM 654 CA HIS A 43 -2.868 -0.787 4.029 1.00 0.00 C ATOM 655 C HIS A 43 -1.767 -1.086 5.043 1.00 0.00 C ATOM 656 O HIS A 43 -0.776 -1.738 4.716 1.00 0.00 O ATOM 657 CB HIS A 43 -2.654 0.596 3.406 1.00 0.00 C ATOM 658 CG HIS A 43 -2.166 0.531 1.990 1.00 0.00 C ATOM 659 ND1 HIS A 43 -2.964 0.768 0.891 1.00 0.00 N ATOM 660 CD2 HIS A 43 -0.936 0.227 1.500 1.00 0.00 C ATOM 661 CE1 HIS A 43 -2.212 0.598 -0.207 1.00 0.00 C ATOM 662 NE2 HIS A 43 -0.973 0.270 0.108 1.00 0.00 N ATOM 0 H HIS A 43 -4.696 0.002 4.691 1.00 0.00 H new ATOM 0 HA HIS A 43 -2.813 -1.539 3.242 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.592 1.151 3.436 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -1.935 1.152 4.007 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -0.067 -0.010 2.095 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -2.574 0.714 -1.218 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -0.202 0.086 -0.534 1.00 0.00 H new ATOM 670 N SER A 44 -1.937 -0.611 6.273 1.00 0.00 N ATOM 671 CA SER A 44 -0.939 -0.837 7.314 1.00 0.00 C ATOM 672 C SER A 44 -0.751 -2.327 7.578 1.00 0.00 C ATOM 673 O SER A 44 0.377 -2.806 7.728 1.00 0.00 O ATOM 674 CB SER A 44 -1.348 -0.128 8.606 1.00 0.00 C ATOM 675 OG SER A 44 -1.160 1.273 8.496 1.00 0.00 O ATOM 0 H SER A 44 -2.749 -0.071 6.572 1.00 0.00 H new ATOM 0 HA SER A 44 0.009 -0.426 6.965 1.00 0.00 H new ATOM 0 HB2 SER A 44 -2.393 -0.342 8.828 1.00 0.00 H new ATOM 0 HB3 SER A 44 -0.760 -0.514 9.439 1.00 0.00 H new ATOM 0 HG SER A 44 -1.966 1.682 8.117 1.00 0.00 H new ATOM 681 N LEU A 45 -1.856 -3.062 7.635 1.00 0.00 N ATOM 682 CA LEU A 45 -1.797 -4.497 7.885 1.00 0.00 C ATOM 683 C LEU A 45 -0.989 -5.191 6.792 1.00 0.00 C ATOM 684 O LEU A 45 -0.139 -6.037 7.077 1.00 0.00 O ATOM 685 CB LEU A 45 -3.212 -5.085 7.956 1.00 0.00 C ATOM 686 CG LEU A 45 -4.029 -4.677 9.187 1.00 0.00 C ATOM 687 CD1 LEU A 45 -5.520 -4.776 8.900 1.00 0.00 C ATOM 688 CD2 LEU A 45 -3.664 -5.543 10.383 1.00 0.00 C ATOM 0 H LEU A 45 -2.798 -2.691 7.512 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.304 -4.663 8.843 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -3.758 -4.784 7.062 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -3.138 -6.172 7.934 1.00 0.00 H new ATOM 0 HG LEU A 45 -3.791 -3.640 9.424 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.082 -4.482 9.787 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.776 -4.114 8.073 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -5.772 -5.803 8.635 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -4.255 -5.238 11.247 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.871 -6.588 10.152 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -2.604 -5.425 10.608 1.00 0.00 H new ATOM 700 N SER A 46 -1.244 -4.814 5.543 1.00 0.00 N ATOM 701 CA SER A 46 -0.525 -5.389 4.409 1.00 0.00 C ATOM 702 C SER A 46 0.986 -5.271 4.595 1.00 0.00 C ATOM 703 O SER A 46 1.748 -6.059 4.035 1.00 0.00 O ATOM 704 CB SER A 46 -0.936 -4.695 3.111 1.00 0.00 C ATOM 705 OG SER A 46 -0.287 -3.443 2.971 1.00 0.00 O ATOM 0 H SER A 46 -1.942 -4.114 5.290 1.00 0.00 H new ATOM 0 HA SER A 46 -0.786 -6.446 4.353 1.00 0.00 H new ATOM 0 HB2 SER A 46 -0.690 -5.332 2.261 1.00 0.00 H new ATOM 0 HB3 SER A 46 -2.016 -4.551 3.099 1.00 0.00 H new ATOM 0 HG SER A 46 -0.199 -3.020 3.851 1.00 0.00 H new ATOM 711 N GLU A 47 1.422 -4.286 5.386 1.00 0.00 N ATOM 712 CA GLU A 47 2.848 -4.083 5.630 1.00 0.00 C ATOM 713 C GLU A 47 3.334 -4.941 6.791 1.00 0.00 C ATOM 714 O GLU A 47 4.523 -5.242 6.893 1.00 0.00 O ATOM 715 CB GLU A 47 3.144 -2.608 5.914 1.00 0.00 C ATOM 716 CG GLU A 47 3.292 -1.770 4.657 1.00 0.00 C ATOM 717 CD GLU A 47 2.723 -0.375 4.814 1.00 0.00 C ATOM 718 OE1 GLU A 47 1.555 -0.255 5.239 1.00 0.00 O ATOM 719 OE2 GLU A 47 3.443 0.597 4.506 1.00 0.00 O ATOM 0 H GLU A 47 0.811 -3.623 5.864 1.00 0.00 H new ATOM 0 HA GLU A 47 3.383 -4.384 4.729 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.341 -2.195 6.525 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.060 -2.535 6.500 1.00 0.00 H new ATOM 0 HG2 GLU A 47 4.348 -1.700 4.394 1.00 0.00 H new ATOM 0 HG3 GLU A 47 2.790 -2.272 3.830 1.00 0.00 H new ATOM 726 N LYS A 48 2.411 -5.350 7.654 1.00 0.00 N ATOM 727 CA LYS A 48 2.764 -6.190 8.791 1.00 0.00 C ATOM 728 C LYS A 48 2.550 -7.659 8.443 1.00 0.00 C ATOM 729 O LYS A 48 3.100 -8.547 9.090 1.00 0.00 O ATOM 730 CB LYS A 48 1.921 -5.821 10.015 1.00 0.00 C ATOM 731 CG LYS A 48 2.318 -6.568 11.278 1.00 0.00 C ATOM 732 CD LYS A 48 1.144 -6.708 12.235 1.00 0.00 C ATOM 733 CE LYS A 48 0.184 -7.803 11.792 1.00 0.00 C ATOM 734 NZ LYS A 48 0.676 -9.163 12.151 1.00 0.00 N ATOM 0 H LYS A 48 1.420 -5.116 7.589 1.00 0.00 H new ATOM 0 HA LYS A 48 3.815 -6.026 9.027 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.007 -4.749 10.195 1.00 0.00 H new ATOM 0 HB3 LYS A 48 0.872 -6.024 9.798 1.00 0.00 H new ATOM 0 HG2 LYS A 48 2.694 -7.557 11.014 1.00 0.00 H new ATOM 0 HG3 LYS A 48 3.132 -6.039 11.774 1.00 0.00 H new ATOM 0 HD2 LYS A 48 1.515 -6.932 13.235 1.00 0.00 H new ATOM 0 HD3 LYS A 48 0.610 -5.760 12.298 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -0.790 -7.638 12.252 1.00 0.00 H new ATOM 0 HE3 LYS A 48 0.041 -7.743 10.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -0.010 -9.876 11.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 1.593 -9.333 11.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 0.788 -9.230 13.183 1.00 0.00 H new ATOM 748 N TYR A 49 1.751 -7.905 7.410 1.00 0.00 N ATOM 749 CA TYR A 49 1.462 -9.264 6.967 1.00 0.00 C ATOM 750 C TYR A 49 2.329 -9.651 5.772 1.00 0.00 C ATOM 751 O TYR A 49 1.961 -9.399 4.624 1.00 0.00 O ATOM 752 CB TYR A 49 -0.015 -9.386 6.593 1.00 0.00 C ATOM 753 CG TYR A 49 -0.913 -9.730 7.761 1.00 0.00 C ATOM 754 CD1 TYR A 49 -1.367 -8.746 8.633 1.00 0.00 C ATOM 755 CD2 TYR A 49 -1.301 -11.040 7.994 1.00 0.00 C ATOM 756 CE1 TYR A 49 -2.187 -9.062 9.702 1.00 0.00 C ATOM 757 CE2 TYR A 49 -2.120 -11.364 9.058 1.00 0.00 C ATOM 758 CZ TYR A 49 -2.559 -10.372 9.910 1.00 0.00 C ATOM 759 OH TYR A 49 -3.376 -10.694 10.971 1.00 0.00 O ATOM 0 H TYR A 49 1.291 -7.178 6.862 1.00 0.00 H new ATOM 0 HA TYR A 49 1.689 -9.943 7.789 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -0.348 -8.445 6.155 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -0.124 -10.152 5.825 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -1.075 -7.719 8.473 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -0.957 -11.821 7.332 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -2.533 -8.286 10.369 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -2.415 -12.390 9.222 1.00 0.00 H new ATOM 0 HH TYR A 49 -3.543 -11.660 10.974 1.00 0.00 H new ATOM 769 N SER A 50 3.474 -10.273 6.042 1.00 0.00 N ATOM 770 CA SER A 50 4.379 -10.696 4.977 1.00 0.00 C ATOM 771 C SER A 50 4.046 -12.114 4.518 1.00 0.00 C ATOM 772 O SER A 50 4.922 -12.975 4.427 1.00 0.00 O ATOM 773 CB SER A 50 5.835 -10.613 5.446 1.00 0.00 C ATOM 774 OG SER A 50 6.726 -10.944 4.394 1.00 0.00 O ATOM 0 H SER A 50 3.796 -10.494 6.984 1.00 0.00 H new ATOM 0 HA SER A 50 4.249 -10.022 4.130 1.00 0.00 H new ATOM 0 HB2 SER A 50 6.048 -9.606 5.805 1.00 0.00 H new ATOM 0 HB3 SER A 50 5.990 -11.291 6.286 1.00 0.00 H new ATOM 0 HG SER A 50 6.518 -11.841 4.059 1.00 0.00 H new ATOM 780 N ASN A 51 2.767 -12.343 4.218 1.00 0.00 N ATOM 781 CA ASN A 51 2.292 -13.646 3.754 1.00 0.00 C ATOM 782 C ASN A 51 1.042 -13.483 2.889 1.00 0.00 C ATOM 783 O ASN A 51 0.896 -14.138 1.856 1.00 0.00 O ATOM 784 CB ASN A 51 1.979 -14.560 4.943 1.00 0.00 C ATOM 785 CG ASN A 51 1.875 -16.022 4.545 1.00 0.00 C ATOM 786 OD1 ASN A 51 1.303 -16.354 3.508 1.00 0.00 O ATOM 787 ND2 ASN A 51 2.433 -16.906 5.367 1.00 0.00 N ATOM 0 H ASN A 51 2.036 -11.635 4.289 1.00 0.00 H new ATOM 0 HA ASN A 51 3.082 -14.100 3.156 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.757 -14.447 5.698 1.00 0.00 H new ATOM 0 HB3 ASN A 51 1.042 -14.245 5.402 1.00 0.00 H new ATOM 0 HD21 ASN A 51 2.396 -17.901 5.147 1.00 0.00 H new ATOM 0 HD22 ASN A 51 2.898 -16.589 6.218 1.00 0.00 H new ATOM 794 N VAL A 52 0.137 -12.614 3.336 1.00 0.00 N ATOM 795 CA VAL A 52 -1.116 -12.368 2.630 1.00 0.00 C ATOM 796 C VAL A 52 -1.000 -11.190 1.671 1.00 0.00 C ATOM 797 O VAL A 52 -0.172 -10.301 1.858 1.00 0.00 O ATOM 798 CB VAL A 52 -2.268 -12.105 3.628 1.00 0.00 C ATOM 799 CG1 VAL A 52 -2.296 -13.185 4.698 1.00 0.00 C ATOM 800 CG2 VAL A 52 -2.139 -10.733 4.275 1.00 0.00 C ATOM 0 H VAL A 52 0.251 -12.066 4.189 1.00 0.00 H new ATOM 0 HA VAL A 52 -1.336 -13.265 2.051 1.00 0.00 H new ATOM 0 HB VAL A 52 -3.204 -12.129 3.070 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -3.112 -12.987 5.393 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -2.447 -14.158 4.229 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -1.350 -13.186 5.239 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.964 -10.580 4.971 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.194 -10.672 4.814 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.167 -9.963 3.504 1.00 0.00 H new ATOM 810 N ILE A 53 -1.836 -11.199 0.635 1.00 0.00 N ATOM 811 CA ILE A 53 -1.826 -10.137 -0.359 1.00 0.00 C ATOM 812 C ILE A 53 -3.032 -9.219 -0.187 1.00 0.00 C ATOM 813 O ILE A 53 -4.178 -9.636 -0.344 1.00 0.00 O ATOM 814 CB ILE A 53 -1.776 -10.713 -1.802 1.00 0.00 C ATOM 815 CG1 ILE A 53 -1.218 -9.677 -2.776 1.00 0.00 C ATOM 816 CG2 ILE A 53 -3.139 -11.197 -2.282 1.00 0.00 C ATOM 817 CD1 ILE A 53 0.285 -9.535 -2.705 1.00 0.00 C ATOM 0 H ILE A 53 -2.527 -11.930 0.465 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.922 -9.548 -0.203 1.00 0.00 H new ATOM 0 HB ILE A 53 -1.113 -11.577 -1.773 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -1.502 -9.954 -3.791 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.677 -8.710 -2.569 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -3.050 -11.590 -3.295 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -3.500 -11.983 -1.619 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.843 -10.365 -2.276 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.614 -8.783 -3.423 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.574 -9.228 -1.700 1.00 0.00 H new ATOM 0 HD13 ILE A 53 0.752 -10.491 -2.941 1.00 0.00 H new ATOM 829 N PHE A 54 -2.756 -7.964 0.148 1.00 0.00 N ATOM 830 CA PHE A 54 -3.798 -6.967 0.351 1.00 0.00 C ATOM 831 C PHE A 54 -3.971 -6.143 -0.924 1.00 0.00 C ATOM 832 O PHE A 54 -3.054 -5.417 -1.310 1.00 0.00 O ATOM 833 CB PHE A 54 -3.378 -6.000 1.468 1.00 0.00 C ATOM 834 CG PHE A 54 -3.747 -6.384 2.879 1.00 0.00 C ATOM 835 CD1 PHE A 54 -3.373 -7.601 3.442 1.00 0.00 C ATOM 836 CD2 PHE A 54 -4.453 -5.484 3.657 1.00 0.00 C ATOM 837 CE1 PHE A 54 -3.700 -7.895 4.757 1.00 0.00 C ATOM 838 CE2 PHE A 54 -4.784 -5.776 4.963 1.00 0.00 C ATOM 839 CZ PHE A 54 -4.409 -6.983 5.514 1.00 0.00 C ATOM 0 H PHE A 54 -1.809 -7.611 0.286 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.724 -7.479 0.612 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -2.296 -5.878 1.422 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -3.818 -5.025 1.256 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -2.825 -8.320 2.851 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -4.750 -4.536 3.234 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -3.400 -8.838 5.190 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -5.336 -5.060 5.554 1.00 0.00 H new ATOM 0 HZ PHE A 54 -4.669 -7.215 6.536 1.00 0.00 H new ATOM 849 N LEU A 55 -5.134 -6.215 -1.570 1.00 0.00 N ATOM 850 CA LEU A 55 -5.350 -5.428 -2.777 1.00 0.00 C ATOM 851 C LEU A 55 -6.623 -4.607 -2.685 1.00 0.00 C ATOM 852 O LEU A 55 -7.429 -4.784 -1.771 1.00 0.00 O ATOM 853 CB LEU A 55 -5.308 -6.292 -4.048 1.00 0.00 C ATOM 854 CG LEU A 55 -6.641 -6.660 -4.713 1.00 0.00 C ATOM 855 CD1 LEU A 55 -6.881 -5.785 -5.936 1.00 0.00 C ATOM 856 CD2 LEU A 55 -6.631 -8.128 -5.126 1.00 0.00 C ATOM 0 H LEU A 55 -5.922 -6.796 -1.285 1.00 0.00 H new ATOM 0 HA LEU A 55 -4.520 -4.726 -2.855 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.699 -5.770 -4.786 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.789 -7.219 -3.805 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.445 -6.494 -3.996 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.830 -6.057 -6.398 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.911 -4.738 -5.634 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.073 -5.932 -6.653 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.581 -8.380 -5.597 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.819 -8.302 -5.832 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.486 -8.753 -4.245 1.00 0.00 H new ATOM 868 N GLU A 56 -6.764 -3.663 -3.602 1.00 0.00 N ATOM 869 CA GLU A 56 -7.896 -2.757 -3.587 1.00 0.00 C ATOM 870 C GLU A 56 -8.769 -2.872 -4.828 1.00 0.00 C ATOM 871 O GLU A 56 -8.320 -2.600 -5.942 1.00 0.00 O ATOM 872 CB GLU A 56 -7.349 -1.342 -3.502 1.00 0.00 C ATOM 873 CG GLU A 56 -8.105 -0.426 -2.551 1.00 0.00 C ATOM 874 CD GLU A 56 -7.666 -0.585 -1.106 1.00 0.00 C ATOM 875 OE1 GLU A 56 -6.607 -0.031 -0.744 1.00 0.00 O ATOM 876 OE2 GLU A 56 -8.384 -1.260 -0.340 1.00 0.00 O ATOM 0 H GLU A 56 -6.107 -3.506 -4.366 1.00 0.00 H new ATOM 0 HA GLU A 56 -8.524 -3.013 -2.734 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.306 -1.388 -3.189 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.363 -0.901 -4.499 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -7.959 0.609 -2.858 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -9.172 -0.633 -2.626 1.00 0.00 H new ATOM 883 N VAL A 57 -10.025 -3.240 -4.631 1.00 0.00 N ATOM 884 CA VAL A 57 -10.955 -3.345 -5.742 1.00 0.00 C ATOM 885 C VAL A 57 -12.086 -2.346 -5.595 1.00 0.00 C ATOM 886 O VAL A 57 -12.859 -2.386 -4.641 1.00 0.00 O ATOM 887 CB VAL A 57 -11.543 -4.757 -5.898 1.00 0.00 C ATOM 888 CG1 VAL A 57 -12.058 -4.931 -7.312 1.00 0.00 C ATOM 889 CG2 VAL A 57 -10.514 -5.829 -5.567 1.00 0.00 C ATOM 0 H VAL A 57 -10.421 -3.469 -3.719 1.00 0.00 H new ATOM 0 HA VAL A 57 -10.378 -3.124 -6.640 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.367 -4.871 -5.193 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -12.476 -5.931 -7.427 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -12.832 -4.190 -7.511 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -11.238 -4.798 -8.017 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -10.964 -6.815 -5.688 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.661 -5.734 -6.239 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.180 -5.707 -4.537 1.00 0.00 H new ATOM 899 N ASP A 58 -12.166 -1.449 -6.560 1.00 0.00 N ATOM 900 CA ASP A 58 -13.190 -0.426 -6.576 1.00 0.00 C ATOM 901 C ASP A 58 -14.314 -0.845 -7.512 1.00 0.00 C ATOM 902 O ASP A 58 -14.085 -1.088 -8.697 1.00 0.00 O ATOM 903 CB ASP A 58 -12.583 0.898 -7.024 1.00 0.00 C ATOM 904 CG ASP A 58 -11.928 0.800 -8.388 1.00 0.00 C ATOM 905 OD1 ASP A 58 -11.259 -0.221 -8.652 1.00 0.00 O ATOM 906 OD2 ASP A 58 -12.084 1.745 -9.190 1.00 0.00 O ATOM 0 H ASP A 58 -11.524 -1.410 -7.352 1.00 0.00 H new ATOM 0 HA ASP A 58 -13.600 -0.300 -5.574 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -13.361 1.661 -7.051 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -11.844 1.223 -6.291 1.00 0.00 H new ATOM 911 N VAL A 59 -15.518 -0.967 -6.971 1.00 0.00 N ATOM 912 CA VAL A 59 -16.663 -1.395 -7.761 1.00 0.00 C ATOM 913 C VAL A 59 -16.967 -0.431 -8.910 1.00 0.00 C ATOM 914 O VAL A 59 -17.655 -0.794 -9.865 1.00 0.00 O ATOM 915 CB VAL A 59 -17.915 -1.570 -6.882 1.00 0.00 C ATOM 916 CG1 VAL A 59 -18.354 -0.237 -6.296 1.00 0.00 C ATOM 917 CG2 VAL A 59 -19.042 -2.211 -7.677 1.00 0.00 C ATOM 0 H VAL A 59 -15.727 -0.776 -5.991 1.00 0.00 H new ATOM 0 HA VAL A 59 -16.395 -2.359 -8.193 1.00 0.00 H new ATOM 0 HB VAL A 59 -17.662 -2.234 -6.055 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -19.240 -0.385 -5.679 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -17.551 0.174 -5.685 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -18.586 0.457 -7.104 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -19.918 -2.326 -7.038 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -19.294 -1.577 -8.527 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -18.723 -3.190 -8.036 1.00 0.00 H new ATOM 927 N ASP A 60 -16.440 0.788 -8.830 1.00 0.00 N ATOM 928 CA ASP A 60 -16.652 1.767 -9.890 1.00 0.00 C ATOM 929 C ASP A 60 -16.022 1.263 -11.182 1.00 0.00 C ATOM 930 O ASP A 60 -16.593 1.395 -12.265 1.00 0.00 O ATOM 931 CB ASP A 60 -16.050 3.118 -9.509 1.00 0.00 C ATOM 932 CG ASP A 60 -16.546 4.241 -10.400 1.00 0.00 C ATOM 933 OD1 ASP A 60 -16.471 4.094 -11.639 1.00 0.00 O ATOM 934 OD2 ASP A 60 -17.012 5.267 -9.860 1.00 0.00 O ATOM 0 H ASP A 60 -15.870 1.118 -8.051 1.00 0.00 H new ATOM 0 HA ASP A 60 -17.724 1.899 -10.034 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -16.297 3.344 -8.472 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -14.963 3.060 -9.572 1.00 0.00 H new ATOM 939 N ASP A 61 -14.846 0.660 -11.044 1.00 0.00 N ATOM 940 CA ASP A 61 -14.125 0.095 -12.179 1.00 0.00 C ATOM 941 C ASP A 61 -14.375 -1.405 -12.260 1.00 0.00 C ATOM 942 O ASP A 61 -14.462 -1.979 -13.346 1.00 0.00 O ATOM 943 CB ASP A 61 -12.619 0.356 -12.057 1.00 0.00 C ATOM 944 CG ASP A 61 -12.224 1.747 -12.509 1.00 0.00 C ATOM 945 OD1 ASP A 61 -12.209 1.989 -13.733 1.00 0.00 O ATOM 946 OD2 ASP A 61 -11.921 2.591 -11.640 1.00 0.00 O ATOM 0 H ASP A 61 -14.369 0.550 -10.149 1.00 0.00 H new ATOM 0 HA ASP A 61 -14.490 0.577 -13.086 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -12.314 0.216 -11.020 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -12.078 -0.381 -12.651 1.00 0.00 H new ATOM 951 N ALA A 62 -14.471 -2.028 -11.092 1.00 0.00 N ATOM 952 CA ALA A 62 -14.693 -3.461 -10.995 1.00 0.00 C ATOM 953 C ALA A 62 -16.171 -3.794 -10.842 1.00 0.00 C ATOM 954 O ALA A 62 -16.545 -4.664 -10.054 1.00 0.00 O ATOM 955 CB ALA A 62 -13.898 -4.017 -9.825 1.00 0.00 C ATOM 0 H ALA A 62 -14.397 -1.555 -10.191 1.00 0.00 H new ATOM 0 HA ALA A 62 -14.353 -3.924 -11.921 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -14.063 -5.092 -9.751 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -12.837 -3.823 -9.981 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -14.223 -3.535 -8.903 1.00 0.00 H new ATOM 961 N GLN A 63 -17.009 -3.105 -11.603 1.00 0.00 N ATOM 962 CA GLN A 63 -18.447 -3.334 -11.546 1.00 0.00 C ATOM 963 C GLN A 63 -18.818 -4.693 -12.140 1.00 0.00 C ATOM 964 O GLN A 63 -19.953 -5.145 -11.995 1.00 0.00 O ATOM 965 CB GLN A 63 -19.193 -2.225 -12.286 1.00 0.00 C ATOM 966 CG GLN A 63 -20.673 -2.160 -11.940 1.00 0.00 C ATOM 967 CD GLN A 63 -21.527 -1.664 -13.091 1.00 0.00 C ATOM 968 OE1 GLN A 63 -21.358 -0.540 -13.566 1.00 0.00 O ATOM 969 NE2 GLN A 63 -22.457 -2.499 -13.543 1.00 0.00 N ATOM 0 H GLN A 63 -16.720 -2.385 -12.265 1.00 0.00 H new ATOM 0 HA GLN A 63 -18.741 -3.327 -10.497 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -18.730 -1.266 -12.052 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -19.084 -2.378 -13.360 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -21.015 -3.151 -11.641 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -20.812 -1.503 -11.082 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -22.563 -3.421 -13.121 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -23.065 -2.217 -14.312 1.00 0.00 H new ATOM 978 N ASP A 64 -17.868 -5.342 -12.807 1.00 0.00 N ATOM 979 CA ASP A 64 -18.128 -6.642 -13.417 1.00 0.00 C ATOM 980 C ASP A 64 -17.756 -7.784 -12.476 1.00 0.00 C ATOM 981 O ASP A 64 -18.264 -8.896 -12.615 1.00 0.00 O ATOM 982 CB ASP A 64 -17.358 -6.780 -14.732 1.00 0.00 C ATOM 983 CG ASP A 64 -18.115 -6.187 -15.904 1.00 0.00 C ATOM 984 OD1 ASP A 64 -18.863 -5.209 -15.693 1.00 0.00 O ATOM 985 OD2 ASP A 64 -17.961 -6.700 -17.033 1.00 0.00 O ATOM 0 H ASP A 64 -16.919 -4.993 -12.938 1.00 0.00 H new ATOM 0 HA ASP A 64 -19.197 -6.702 -13.620 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -16.391 -6.285 -14.639 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -17.159 -7.834 -14.926 1.00 0.00 H new ATOM 990 N VAL A 65 -16.880 -7.511 -11.508 1.00 0.00 N ATOM 991 CA VAL A 65 -16.473 -8.540 -10.558 1.00 0.00 C ATOM 992 C VAL A 65 -17.517 -8.716 -9.454 1.00 0.00 C ATOM 993 O VAL A 65 -17.880 -9.844 -9.117 1.00 0.00 O ATOM 994 CB VAL A 65 -15.087 -8.265 -9.932 1.00 0.00 C ATOM 995 CG1 VAL A 65 -13.978 -8.693 -10.880 1.00 0.00 C ATOM 996 CG2 VAL A 65 -14.930 -6.803 -9.559 1.00 0.00 C ATOM 0 H VAL A 65 -16.446 -6.599 -11.364 1.00 0.00 H new ATOM 0 HA VAL A 65 -16.395 -9.465 -11.130 1.00 0.00 H new ATOM 0 HB VAL A 65 -15.012 -8.854 -9.018 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -13.010 -8.492 -10.422 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -14.067 -9.760 -11.086 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -14.061 -8.135 -11.813 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -13.945 -6.643 -9.121 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -15.035 -6.186 -10.452 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -15.697 -6.528 -8.835 1.00 0.00 H new ATOM 1006 N ALA A 66 -17.997 -7.610 -8.878 1.00 0.00 N ATOM 1007 CA ALA A 66 -18.990 -7.675 -7.802 1.00 0.00 C ATOM 1008 C ALA A 66 -20.165 -8.574 -8.177 1.00 0.00 C ATOM 1009 O ALA A 66 -20.468 -9.532 -7.468 1.00 0.00 O ATOM 1010 CB ALA A 66 -19.490 -6.274 -7.474 1.00 0.00 C ATOM 0 H ALA A 66 -17.716 -6.664 -9.137 1.00 0.00 H new ATOM 0 HA ALA A 66 -18.507 -8.105 -6.925 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -20.228 -6.329 -6.674 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -18.652 -5.655 -7.153 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -19.948 -5.834 -8.360 1.00 0.00 H new ATOM 1016 N PRO A 67 -20.841 -8.282 -9.298 1.00 0.00 N ATOM 1017 CA PRO A 67 -21.980 -9.079 -9.762 1.00 0.00 C ATOM 1018 C PRO A 67 -21.647 -10.567 -9.826 1.00 0.00 C ATOM 1019 O PRO A 67 -22.516 -11.422 -9.650 1.00 0.00 O ATOM 1020 CB PRO A 67 -22.249 -8.514 -11.161 1.00 0.00 C ATOM 1021 CG PRO A 67 -21.771 -7.106 -11.075 1.00 0.00 C ATOM 1022 CD PRO A 67 -20.549 -7.155 -10.205 1.00 0.00 C ATOM 0 HA PRO A 67 -22.839 -9.014 -9.094 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -21.712 -9.072 -11.928 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -23.308 -8.562 -11.415 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -21.535 -6.710 -12.063 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -22.534 -6.457 -10.645 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -19.644 -7.328 -10.787 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -20.403 -6.223 -9.659 1.00 0.00 H new ATOM 1030 N LYS A 68 -20.370 -10.864 -10.045 1.00 0.00 N ATOM 1031 CA LYS A 68 -19.901 -12.241 -10.105 1.00 0.00 C ATOM 1032 C LYS A 68 -19.850 -12.847 -8.702 1.00 0.00 C ATOM 1033 O LYS A 68 -19.940 -14.065 -8.542 1.00 0.00 O ATOM 1034 CB LYS A 68 -18.516 -12.294 -10.760 1.00 0.00 C ATOM 1035 CG LYS A 68 -18.465 -13.164 -12.005 1.00 0.00 C ATOM 1036 CD LYS A 68 -17.479 -12.614 -13.025 1.00 0.00 C ATOM 1037 CE LYS A 68 -17.586 -13.339 -14.356 1.00 0.00 C ATOM 1038 NZ LYS A 68 -17.206 -14.775 -14.243 1.00 0.00 N ATOM 0 H LYS A 68 -19.640 -10.165 -10.184 1.00 0.00 H new ATOM 0 HA LYS A 68 -20.597 -12.824 -10.707 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -18.208 -11.282 -11.021 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -17.794 -12.670 -10.035 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -18.179 -14.179 -11.730 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -19.458 -13.223 -12.451 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -17.664 -11.550 -13.174 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -16.464 -12.710 -12.639 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -18.607 -13.263 -14.729 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -16.942 -12.850 -15.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -17.293 -15.231 -15.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -16.223 -14.849 -13.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -17.836 -15.249 -13.565 1.00 0.00 H new ATOM 1052 N TYR A 69 -19.718 -11.988 -7.689 1.00 0.00 N ATOM 1053 CA TYR A 69 -19.655 -12.427 -6.290 1.00 0.00 C ATOM 1054 C TYR A 69 -20.934 -12.069 -5.528 1.00 0.00 C ATOM 1055 O TYR A 69 -21.122 -12.479 -4.382 1.00 0.00 O ATOM 1056 CB TYR A 69 -18.470 -11.756 -5.605 1.00 0.00 C ATOM 1057 CG TYR A 69 -17.130 -12.242 -6.103 1.00 0.00 C ATOM 1058 CD1 TYR A 69 -16.706 -13.541 -5.859 1.00 0.00 C ATOM 1059 CD2 TYR A 69 -16.298 -11.404 -6.834 1.00 0.00 C ATOM 1060 CE1 TYR A 69 -15.485 -13.988 -6.323 1.00 0.00 C ATOM 1061 CE2 TYR A 69 -15.074 -11.844 -7.300 1.00 0.00 C ATOM 1062 CZ TYR A 69 -14.676 -13.138 -7.046 1.00 0.00 C ATOM 1063 OH TYR A 69 -13.457 -13.582 -7.509 1.00 0.00 O ATOM 0 H TYR A 69 -19.652 -10.977 -7.811 1.00 0.00 H new ATOM 0 HA TYR A 69 -19.543 -13.511 -6.283 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -18.536 -10.679 -5.757 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -18.535 -11.931 -4.531 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -17.340 -14.212 -5.298 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -16.613 -10.392 -7.042 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -15.165 -14.999 -6.120 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -14.434 -11.178 -7.859 1.00 0.00 H new ATOM 0 HH TYR A 69 -12.912 -13.887 -6.754 1.00 0.00 H new ATOM 1073 N GLY A 70 -21.814 -11.321 -6.180 1.00 0.00 N ATOM 1074 CA GLY A 70 -23.073 -10.930 -5.565 1.00 0.00 C ATOM 1075 C GLY A 70 -22.909 -9.991 -4.380 1.00 0.00 C ATOM 1076 O GLY A 70 -23.630 -10.106 -3.388 1.00 0.00 O ATOM 0 H GLY A 70 -21.679 -10.975 -7.130 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -23.699 -10.448 -6.315 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -23.601 -11.826 -5.237 1.00 0.00 H new ATOM 1080 N ILE A 71 -21.969 -9.056 -4.482 1.00 0.00 N ATOM 1081 CA ILE A 71 -21.739 -8.093 -3.410 1.00 0.00 C ATOM 1082 C ILE A 71 -22.822 -7.025 -3.416 1.00 0.00 C ATOM 1083 O ILE A 71 -23.160 -6.478 -4.466 1.00 0.00 O ATOM 1084 CB ILE A 71 -20.358 -7.414 -3.528 1.00 0.00 C ATOM 1085 CG1 ILE A 71 -19.254 -8.465 -3.522 1.00 0.00 C ATOM 1086 CG2 ILE A 71 -20.141 -6.427 -2.388 1.00 0.00 C ATOM 1087 CD1 ILE A 71 -17.883 -7.896 -3.805 1.00 0.00 C ATOM 0 H ILE A 71 -21.358 -8.945 -5.291 1.00 0.00 H new ATOM 0 HA ILE A 71 -21.768 -8.648 -2.472 1.00 0.00 H new ATOM 0 HB ILE A 71 -20.326 -6.867 -4.470 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -19.240 -8.961 -2.552 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -19.484 -9.227 -4.267 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -19.161 -5.961 -2.492 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -20.914 -5.659 -2.420 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -20.193 -6.954 -1.435 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -17.145 -8.698 -3.786 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -17.881 -7.424 -4.788 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -17.633 -7.155 -3.046 1.00 0.00 H new ATOM 1099 N ARG A 72 -23.370 -6.735 -2.245 1.00 0.00 N ATOM 1100 CA ARG A 72 -24.421 -5.736 -2.133 1.00 0.00 C ATOM 1101 C ARG A 72 -24.375 -5.049 -0.776 1.00 0.00 C ATOM 1102 O ARG A 72 -25.395 -4.922 -0.095 1.00 0.00 O ATOM 1103 CB ARG A 72 -25.789 -6.384 -2.352 1.00 0.00 C ATOM 1104 CG ARG A 72 -26.899 -5.381 -2.624 1.00 0.00 C ATOM 1105 CD ARG A 72 -26.817 -4.821 -4.034 1.00 0.00 C ATOM 1106 NE ARG A 72 -27.898 -3.878 -4.316 1.00 0.00 N ATOM 1107 CZ ARG A 72 -27.921 -2.620 -3.878 1.00 0.00 C ATOM 1108 NH1 ARG A 72 -26.955 -2.165 -3.090 1.00 0.00 N ATOM 1109 NH2 ARG A 72 -28.920 -1.818 -4.219 1.00 0.00 N ATOM 0 H ARG A 72 -23.106 -7.175 -1.364 1.00 0.00 H new ATOM 0 HA ARG A 72 -24.259 -4.981 -2.902 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -25.724 -7.078 -3.190 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -26.049 -6.972 -1.472 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -27.867 -5.861 -2.479 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -26.837 -4.565 -1.904 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -25.857 -4.323 -4.170 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -26.855 -5.641 -4.752 1.00 0.00 H new ATOM 0 HE ARG A 72 -28.682 -4.203 -4.882 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -26.188 -2.780 -2.816 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -26.979 -1.201 -2.758 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -29.671 -2.164 -4.817 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -28.938 -0.855 -3.884 1.00 0.00 H new ATOM 1123 N GLY A 73 -23.186 -4.601 -0.387 1.00 0.00 N ATOM 1124 CA GLY A 73 -23.030 -3.925 0.887 1.00 0.00 C ATOM 1125 C GLY A 73 -21.620 -3.412 1.109 1.00 0.00 C ATOM 1126 O GLY A 73 -20.721 -4.178 1.452 1.00 0.00 O ATOM 0 H GLY A 73 -22.328 -4.694 -0.931 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -23.728 -3.090 0.938 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -23.294 -4.611 1.692 1.00 0.00 H new ATOM 1130 N ILE A 74 -21.429 -2.109 0.916 1.00 0.00 N ATOM 1131 CA ILE A 74 -20.121 -1.485 1.101 1.00 0.00 C ATOM 1132 C ILE A 74 -20.062 -0.751 2.439 1.00 0.00 C ATOM 1133 O ILE A 74 -21.083 -0.265 2.926 1.00 0.00 O ATOM 1134 CB ILE A 74 -19.819 -0.484 -0.032 1.00 0.00 C ATOM 1135 CG1 ILE A 74 -20.997 0.473 -0.209 1.00 0.00 C ATOM 1136 CG2 ILE A 74 -19.521 -1.215 -1.332 1.00 0.00 C ATOM 1137 CD1 ILE A 74 -20.643 1.739 -0.957 1.00 0.00 C ATOM 0 H ILE A 74 -22.165 -1.463 0.631 1.00 0.00 H new ATOM 0 HA ILE A 74 -19.374 -2.279 1.085 1.00 0.00 H new ATOM 0 HB ILE A 74 -18.935 0.094 0.238 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -21.796 -0.042 -0.742 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -21.389 0.739 0.773 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -19.311 -0.489 -2.118 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -18.655 -1.863 -1.195 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -20.383 -1.818 -1.616 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -21.528 2.369 -1.044 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -19.866 2.277 -0.414 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -20.280 1.484 -1.952 1.00 0.00 H new ATOM 1149 N PRO A 75 -18.871 -0.654 3.062 1.00 0.00 N ATOM 1150 CA PRO A 75 -17.616 -1.207 2.538 1.00 0.00 C ATOM 1151 C PRO A 75 -17.501 -2.711 2.772 1.00 0.00 C ATOM 1152 O PRO A 75 -17.416 -3.163 3.914 1.00 0.00 O ATOM 1153 CB PRO A 75 -16.528 -0.463 3.339 1.00 0.00 C ATOM 1154 CG PRO A 75 -17.249 0.524 4.206 1.00 0.00 C ATOM 1155 CD PRO A 75 -18.654 0.016 4.344 1.00 0.00 C ATOM 0 HA PRO A 75 -17.538 -1.075 1.459 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -15.945 -1.158 3.943 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -15.830 0.042 2.671 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -16.769 0.609 5.181 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -17.237 1.517 3.757 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -18.757 -0.671 5.184 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -19.365 0.826 4.505 1.00 0.00 H new ATOM 1163 N THR A 76 -17.504 -3.485 1.689 1.00 0.00 N ATOM 1164 CA THR A 76 -17.405 -4.939 1.780 1.00 0.00 C ATOM 1165 C THR A 76 -15.957 -5.421 1.835 1.00 0.00 C ATOM 1166 O THR A 76 -15.118 -4.998 1.040 1.00 0.00 O ATOM 1167 CB THR A 76 -18.107 -5.598 0.588 1.00 0.00 C ATOM 1168 OG1 THR A 76 -18.885 -4.654 -0.128 1.00 0.00 O ATOM 1169 CG2 THR A 76 -19.017 -6.737 0.993 1.00 0.00 C ATOM 0 H THR A 76 -17.574 -3.128 0.736 1.00 0.00 H new ATOM 0 HA THR A 76 -17.894 -5.228 2.710 1.00 0.00 H new ATOM 0 HB THR A 76 -17.307 -5.995 -0.037 1.00 0.00 H new ATOM 0 HG1 THR A 76 -19.820 -4.717 0.158 1.00 0.00 H new ATOM 0 HG21 THR A 76 -19.485 -7.162 0.105 1.00 0.00 H new ATOM 0 HG22 THR A 76 -18.434 -7.506 1.500 1.00 0.00 H new ATOM 0 HG23 THR A 76 -19.789 -6.364 1.666 1.00 0.00 H new ATOM 1177 N LEU A 77 -15.688 -6.352 2.741 1.00 0.00 N ATOM 1178 CA LEU A 77 -14.366 -6.943 2.857 1.00 0.00 C ATOM 1179 C LEU A 77 -14.443 -8.365 2.328 1.00 0.00 C ATOM 1180 O LEU A 77 -15.297 -9.146 2.746 1.00 0.00 O ATOM 1181 CB LEU A 77 -13.869 -6.927 4.306 1.00 0.00 C ATOM 1182 CG LEU A 77 -12.706 -5.971 4.589 1.00 0.00 C ATOM 1183 CD1 LEU A 77 -13.105 -4.528 4.307 1.00 0.00 C ATOM 1184 CD2 LEU A 77 -12.237 -6.125 6.028 1.00 0.00 C ATOM 0 H LEU A 77 -16.371 -6.713 3.407 1.00 0.00 H new ATOM 0 HA LEU A 77 -13.651 -6.360 2.276 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -14.703 -6.661 4.956 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -13.562 -7.937 4.579 1.00 0.00 H new ATOM 0 HG LEU A 77 -11.882 -6.227 3.923 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -12.262 -3.870 4.516 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -13.393 -4.428 3.260 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -13.946 -4.252 4.943 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -11.410 -5.440 6.216 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -13.060 -5.896 6.705 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -11.905 -7.150 6.195 1.00 0.00 H new ATOM 1196 N LEU A 78 -13.574 -8.686 1.384 1.00 0.00 N ATOM 1197 CA LEU A 78 -13.584 -10.007 0.775 1.00 0.00 C ATOM 1198 C LEU A 78 -12.273 -10.749 1.019 1.00 0.00 C ATOM 1199 O LEU A 78 -11.185 -10.198 0.847 1.00 0.00 O ATOM 1200 CB LEU A 78 -13.829 -9.880 -0.737 1.00 0.00 C ATOM 1201 CG LEU A 78 -15.297 -9.805 -1.199 1.00 0.00 C ATOM 1202 CD1 LEU A 78 -15.399 -10.166 -2.672 1.00 0.00 C ATOM 1203 CD2 LEU A 78 -16.199 -10.717 -0.378 1.00 0.00 C ATOM 0 H LEU A 78 -12.857 -8.056 1.024 1.00 0.00 H new ATOM 0 HA LEU A 78 -14.388 -10.581 1.236 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.316 -8.986 -1.090 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.361 -10.732 -1.230 1.00 0.00 H new ATOM 0 HG LEU A 78 -15.637 -8.780 -1.048 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -16.440 -10.110 -2.989 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.803 -9.468 -3.260 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -15.027 -11.179 -2.825 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -17.225 -10.633 -0.737 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -15.862 -11.749 -0.479 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -16.156 -10.423 0.671 1.00 0.00 H new ATOM 1215 N LEU A 79 -12.395 -12.013 1.408 1.00 0.00 N ATOM 1216 CA LEU A 79 -11.238 -12.857 1.662 1.00 0.00 C ATOM 1217 C LEU A 79 -11.181 -13.971 0.631 1.00 0.00 C ATOM 1218 O LEU A 79 -12.154 -14.701 0.448 1.00 0.00 O ATOM 1219 CB LEU A 79 -11.313 -13.465 3.068 1.00 0.00 C ATOM 1220 CG LEU A 79 -10.538 -12.717 4.150 1.00 0.00 C ATOM 1221 CD1 LEU A 79 -9.043 -12.919 3.960 1.00 0.00 C ATOM 1222 CD2 LEU A 79 -10.888 -11.237 4.137 1.00 0.00 C ATOM 0 H LEU A 79 -13.292 -12.477 1.555 1.00 0.00 H new ATOM 0 HA LEU A 79 -10.339 -12.245 1.591 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -12.360 -13.518 3.367 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -10.942 -14.489 3.022 1.00 0.00 H new ATOM 0 HG LEU A 79 -10.821 -13.121 5.122 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -8.501 -12.381 4.738 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -8.808 -13.982 4.024 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -8.746 -12.540 2.982 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -10.325 -10.723 4.916 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -10.635 -10.812 3.166 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -11.955 -11.114 4.320 1.00 0.00 H new ATOM 1234 N PHE A 80 -10.046 -14.096 -0.046 1.00 0.00 N ATOM 1235 CA PHE A 80 -9.885 -15.120 -1.067 1.00 0.00 C ATOM 1236 C PHE A 80 -8.761 -16.080 -0.703 1.00 0.00 C ATOM 1237 O PHE A 80 -7.775 -15.692 -0.077 1.00 0.00 O ATOM 1238 CB PHE A 80 -9.610 -14.461 -2.422 1.00 0.00 C ATOM 1239 CG PHE A 80 -10.848 -13.913 -3.077 1.00 0.00 C ATOM 1240 CD1 PHE A 80 -11.623 -14.704 -3.912 1.00 0.00 C ATOM 1241 CD2 PHE A 80 -11.239 -12.602 -2.849 1.00 0.00 C ATOM 1242 CE1 PHE A 80 -12.766 -14.196 -4.506 1.00 0.00 C ATOM 1243 CE2 PHE A 80 -12.380 -12.090 -3.439 1.00 0.00 C ATOM 1244 CZ PHE A 80 -13.143 -12.886 -4.269 1.00 0.00 C ATOM 0 H PHE A 80 -9.228 -13.503 0.094 1.00 0.00 H new ATOM 0 HA PHE A 80 -10.808 -15.696 -1.131 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -8.891 -13.653 -2.286 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -9.148 -15.191 -3.087 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -11.332 -15.727 -4.101 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -10.645 -11.973 -2.203 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -13.363 -14.822 -5.154 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -12.674 -11.068 -3.250 1.00 0.00 H new ATOM 0 HZ PHE A 80 -14.033 -12.487 -4.733 1.00 0.00 H new ATOM 1254 N LYS A 81 -8.929 -17.335 -1.093 1.00 0.00 N ATOM 1255 CA LYS A 81 -7.945 -18.369 -0.811 1.00 0.00 C ATOM 1256 C LYS A 81 -7.883 -19.350 -1.969 1.00 0.00 C ATOM 1257 O LYS A 81 -8.828 -20.103 -2.201 1.00 0.00 O ATOM 1258 CB LYS A 81 -8.315 -19.106 0.477 1.00 0.00 C ATOM 1259 CG LYS A 81 -7.119 -19.476 1.336 1.00 0.00 C ATOM 1260 CD LYS A 81 -7.405 -19.243 2.814 1.00 0.00 C ATOM 1261 CE LYS A 81 -6.200 -19.588 3.676 1.00 0.00 C ATOM 1262 NZ LYS A 81 -5.972 -21.058 3.754 1.00 0.00 N ATOM 0 H LYS A 81 -9.745 -17.663 -1.610 1.00 0.00 H new ATOM 0 HA LYS A 81 -6.967 -17.904 -0.684 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -8.991 -18.481 1.061 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.862 -20.014 0.221 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -6.862 -20.523 1.174 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -6.255 -18.885 1.033 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -7.680 -18.200 2.972 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -8.258 -19.848 3.120 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.312 -19.105 3.268 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.347 -19.190 4.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -5.914 -21.348 4.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -6.760 -21.556 3.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.083 -21.297 3.271 1.00 0.00 H new ATOM 1276 N ASN A 82 -6.780 -19.334 -2.706 1.00 0.00 N ATOM 1277 CA ASN A 82 -6.634 -20.222 -3.847 1.00 0.00 C ATOM 1278 C ASN A 82 -7.731 -19.941 -4.874 1.00 0.00 C ATOM 1279 O ASN A 82 -8.346 -20.863 -5.411 1.00 0.00 O ATOM 1280 CB ASN A 82 -6.696 -21.685 -3.403 1.00 0.00 C ATOM 1281 CG ASN A 82 -5.911 -21.955 -2.130 1.00 0.00 C ATOM 1282 OD1 ASN A 82 -6.466 -22.408 -1.129 1.00 0.00 O ATOM 1283 ND2 ASN A 82 -4.611 -21.682 -2.163 1.00 0.00 N ATOM 0 H ASN A 82 -5.982 -18.722 -2.535 1.00 0.00 H new ATOM 0 HA ASN A 82 -5.661 -20.039 -4.304 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -7.737 -21.968 -3.248 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.310 -22.318 -4.202 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -4.034 -21.847 -1.338 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -4.190 -21.307 -3.013 1.00 0.00 H new ATOM 1290 N GLY A 83 -7.943 -18.658 -5.167 1.00 0.00 N ATOM 1291 CA GLY A 83 -8.939 -18.270 -6.149 1.00 0.00 C ATOM 1292 C GLY A 83 -10.377 -18.403 -5.664 1.00 0.00 C ATOM 1293 O GLY A 83 -11.311 -18.067 -6.394 1.00 0.00 O ATOM 0 H GLY A 83 -7.440 -17.880 -4.739 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -8.760 -17.236 -6.442 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -8.810 -18.881 -7.042 1.00 0.00 H new ATOM 1297 N GLU A 84 -10.567 -18.914 -4.449 1.00 0.00 N ATOM 1298 CA GLU A 84 -11.894 -19.108 -3.904 1.00 0.00 C ATOM 1299 C GLU A 84 -12.117 -18.266 -2.645 1.00 0.00 C ATOM 1300 O GLU A 84 -11.275 -18.228 -1.749 1.00 0.00 O ATOM 1301 CB GLU A 84 -12.079 -20.602 -3.625 1.00 0.00 C ATOM 1302 CG GLU A 84 -11.780 -21.045 -2.197 1.00 0.00 C ATOM 1303 CD GLU A 84 -13.009 -21.038 -1.312 1.00 0.00 C ATOM 1304 OE1 GLU A 84 -14.124 -21.215 -1.847 1.00 0.00 O ATOM 1305 OE2 GLU A 84 -12.858 -20.864 -0.084 1.00 0.00 O ATOM 0 H GLU A 84 -9.811 -19.200 -3.827 1.00 0.00 H new ATOM 0 HA GLU A 84 -12.640 -18.773 -4.625 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -13.107 -20.874 -3.863 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -11.436 -21.163 -4.303 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -11.356 -22.049 -2.214 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -11.025 -20.387 -1.768 1.00 0.00 H new ATOM 1312 N VAL A 85 -13.269 -17.601 -2.585 1.00 0.00 N ATOM 1313 CA VAL A 85 -13.611 -16.762 -1.439 1.00 0.00 C ATOM 1314 C VAL A 85 -13.840 -17.623 -0.196 1.00 0.00 C ATOM 1315 O VAL A 85 -14.760 -18.440 -0.168 1.00 0.00 O ATOM 1316 CB VAL A 85 -14.870 -15.912 -1.710 1.00 0.00 C ATOM 1317 CG1 VAL A 85 -16.075 -16.798 -1.984 1.00 0.00 C ATOM 1318 CG2 VAL A 85 -15.145 -14.975 -0.544 1.00 0.00 C ATOM 0 H VAL A 85 -13.980 -17.627 -3.316 1.00 0.00 H new ATOM 0 HA VAL A 85 -12.771 -16.088 -1.270 1.00 0.00 H new ATOM 0 HB VAL A 85 -14.686 -15.308 -2.599 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -16.949 -16.175 -2.172 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -15.878 -17.420 -2.857 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -16.262 -17.435 -1.120 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -16.037 -14.384 -0.754 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -15.302 -15.559 0.363 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -14.293 -14.309 -0.404 1.00 0.00 H new ATOM 1328 N ALA A 86 -13.005 -17.453 0.829 1.00 0.00 N ATOM 1329 CA ALA A 86 -13.140 -18.241 2.051 1.00 0.00 C ATOM 1330 C ALA A 86 -13.626 -17.401 3.228 1.00 0.00 C ATOM 1331 O ALA A 86 -13.613 -17.854 4.372 1.00 0.00 O ATOM 1332 CB ALA A 86 -11.827 -18.930 2.392 1.00 0.00 C ATOM 0 H ALA A 86 -12.236 -16.783 0.837 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.899 -19.000 1.862 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.948 -19.512 3.306 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.541 -19.592 1.575 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.050 -18.180 2.540 1.00 0.00 H new ATOM 1338 N ALA A 87 -14.065 -16.185 2.941 1.00 0.00 N ATOM 1339 CA ALA A 87 -14.569 -15.288 3.978 1.00 0.00 C ATOM 1340 C ALA A 87 -15.114 -13.998 3.376 1.00 0.00 C ATOM 1341 O ALA A 87 -14.503 -13.417 2.479 1.00 0.00 O ATOM 1342 CB ALA A 87 -13.488 -14.992 5.009 1.00 0.00 C ATOM 0 H ALA A 87 -14.084 -15.794 1.999 1.00 0.00 H new ATOM 0 HA ALA A 87 -15.393 -15.792 4.483 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -13.886 -14.322 5.771 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -13.166 -15.923 5.476 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -12.637 -14.519 4.519 1.00 0.00 H new ATOM 1348 N THR A 88 -16.259 -13.547 3.879 1.00 0.00 N ATOM 1349 CA THR A 88 -16.872 -12.322 3.386 1.00 0.00 C ATOM 1350 C THR A 88 -17.404 -11.475 4.535 1.00 0.00 C ATOM 1351 O THR A 88 -18.195 -11.947 5.351 1.00 0.00 O ATOM 1352 CB THR A 88 -18.001 -12.655 2.409 1.00 0.00 C ATOM 1353 OG1 THR A 88 -17.526 -13.480 1.361 1.00 0.00 O ATOM 1354 CG2 THR A 88 -18.633 -11.434 1.781 1.00 0.00 C ATOM 0 H THR A 88 -16.778 -14.010 4.625 1.00 0.00 H new ATOM 0 HA THR A 88 -16.108 -11.745 2.865 1.00 0.00 H new ATOM 0 HB THR A 88 -18.757 -13.166 3.005 1.00 0.00 H new ATOM 0 HG1 THR A 88 -18.262 -13.684 0.746 1.00 0.00 H new ATOM 0 HG21 THR A 88 -19.425 -11.744 1.100 1.00 0.00 H new ATOM 0 HG22 THR A 88 -19.053 -10.800 2.561 1.00 0.00 H new ATOM 0 HG23 THR A 88 -17.877 -10.876 1.228 1.00 0.00 H new ATOM 1362 N LYS A 89 -16.957 -10.223 4.595 1.00 0.00 N ATOM 1363 CA LYS A 89 -17.383 -9.309 5.645 1.00 0.00 C ATOM 1364 C LYS A 89 -18.018 -8.048 5.061 1.00 0.00 C ATOM 1365 O LYS A 89 -17.613 -7.565 4.005 1.00 0.00 O ATOM 1366 CB LYS A 89 -16.195 -8.938 6.530 1.00 0.00 C ATOM 1367 CG LYS A 89 -16.124 -9.756 7.806 1.00 0.00 C ATOM 1368 CD LYS A 89 -17.147 -9.283 8.825 1.00 0.00 C ATOM 1369 CE LYS A 89 -16.842 -9.838 10.207 1.00 0.00 C ATOM 1370 NZ LYS A 89 -17.667 -9.191 11.265 1.00 0.00 N ATOM 0 H LYS A 89 -16.299 -9.820 3.927 1.00 0.00 H new ATOM 0 HA LYS A 89 -18.137 -9.816 6.248 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -15.273 -9.075 5.966 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -16.257 -7.880 6.787 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -16.296 -10.807 7.576 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -15.123 -9.683 8.232 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -17.152 -8.194 8.861 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -18.144 -9.597 8.516 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -17.023 -10.913 10.214 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -15.785 -9.691 10.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -17.427 -9.599 12.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -17.476 -8.169 11.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -18.675 -9.353 11.067 1.00 0.00 H new ATOM 1384 N VAL A 90 -19.021 -7.529 5.763 1.00 0.00 N ATOM 1385 CA VAL A 90 -19.737 -6.331 5.334 1.00 0.00 C ATOM 1386 C VAL A 90 -19.619 -5.217 6.370 1.00 0.00 C ATOM 1387 O VAL A 90 -19.560 -5.481 7.571 1.00 0.00 O ATOM 1388 CB VAL A 90 -21.225 -6.625 5.075 1.00 0.00 C ATOM 1389 CG1 VAL A 90 -21.915 -5.420 4.453 1.00 0.00 C ATOM 1390 CG2 VAL A 90 -21.376 -7.848 4.187 1.00 0.00 C ATOM 0 H VAL A 90 -19.359 -7.924 6.640 1.00 0.00 H new ATOM 0 HA VAL A 90 -19.275 -6.005 4.402 1.00 0.00 H new ATOM 0 HB VAL A 90 -21.705 -6.831 6.032 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -22.966 -5.652 4.279 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -21.838 -4.568 5.129 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -21.436 -5.176 3.505 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -22.434 -8.043 4.013 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -20.878 -7.669 3.234 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -20.924 -8.711 4.676 1.00 0.00 H new ATOM 1400 N GLY A 91 -19.584 -3.970 5.903 1.00 0.00 N ATOM 1401 CA GLY A 91 -19.471 -2.843 6.808 1.00 0.00 C ATOM 1402 C GLY A 91 -18.063 -2.643 7.330 1.00 0.00 C ATOM 1403 O GLY A 91 -17.242 -3.559 7.308 1.00 0.00 O ATOM 0 H GLY A 91 -19.632 -3.723 4.915 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -19.794 -1.938 6.294 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -20.147 -2.991 7.650 1.00 0.00 H new ATOM 1407 N ALA A 92 -17.789 -1.429 7.796 1.00 0.00 N ATOM 1408 CA ALA A 92 -16.476 -1.086 8.323 1.00 0.00 C ATOM 1409 C ALA A 92 -16.212 -1.776 9.656 1.00 0.00 C ATOM 1410 O ALA A 92 -17.106 -1.900 10.494 1.00 0.00 O ATOM 1411 CB ALA A 92 -16.350 0.425 8.471 1.00 0.00 C ATOM 0 H ALA A 92 -18.463 -0.664 7.819 1.00 0.00 H new ATOM 0 HA ALA A 92 -15.726 -1.438 7.615 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -15.364 0.671 8.866 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -16.479 0.898 7.498 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -17.116 0.789 9.156 1.00 0.00 H new ATOM 1417 N LEU A 93 -14.975 -2.225 9.842 1.00 0.00 N ATOM 1418 CA LEU A 93 -14.573 -2.907 11.068 1.00 0.00 C ATOM 1419 C LEU A 93 -13.303 -2.277 11.630 1.00 0.00 C ATOM 1420 O LEU A 93 -12.484 -1.741 10.881 1.00 0.00 O ATOM 1421 CB LEU A 93 -14.337 -4.397 10.790 1.00 0.00 C ATOM 1422 CG LEU A 93 -13.714 -4.703 9.425 1.00 0.00 C ATOM 1423 CD1 LEU A 93 -12.933 -6.009 9.455 1.00 0.00 C ATOM 1424 CD2 LEU A 93 -14.791 -4.750 8.355 1.00 0.00 C ATOM 0 H LEU A 93 -14.228 -2.128 9.154 1.00 0.00 H new ATOM 0 HA LEU A 93 -15.372 -2.805 11.802 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -13.689 -4.800 11.568 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -15.289 -4.922 10.865 1.00 0.00 H new ATOM 0 HG LEU A 93 -13.014 -3.903 9.185 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -12.503 -6.198 8.472 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -12.134 -5.938 10.193 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -13.602 -6.827 9.722 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -14.335 -4.968 7.389 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -15.513 -5.529 8.600 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -15.299 -3.787 8.307 1.00 0.00 H new ATOM 1436 N SER A 94 -13.140 -2.339 12.947 1.00 0.00 N ATOM 1437 CA SER A 94 -11.963 -1.770 13.593 1.00 0.00 C ATOM 1438 C SER A 94 -10.701 -2.516 13.165 1.00 0.00 C ATOM 1439 O SER A 94 -10.767 -3.469 12.387 1.00 0.00 O ATOM 1440 CB SER A 94 -12.110 -1.823 15.114 1.00 0.00 C ATOM 1441 OG SER A 94 -11.473 -0.714 15.727 1.00 0.00 O ATOM 0 H SER A 94 -13.805 -2.775 13.586 1.00 0.00 H new ATOM 0 HA SER A 94 -11.875 -0.729 13.283 1.00 0.00 H new ATOM 0 HB2 SER A 94 -13.167 -1.832 15.380 1.00 0.00 H new ATOM 0 HB3 SER A 94 -11.678 -2.749 15.492 1.00 0.00 H new ATOM 0 HG SER A 94 -11.583 -0.770 16.699 1.00 0.00 H new ATOM 1447 N LYS A 95 -9.557 -2.077 13.674 1.00 0.00 N ATOM 1448 CA LYS A 95 -8.278 -2.698 13.341 1.00 0.00 C ATOM 1449 C LYS A 95 -8.136 -4.078 13.980 1.00 0.00 C ATOM 1450 O LYS A 95 -7.483 -4.962 13.423 1.00 0.00 O ATOM 1451 CB LYS A 95 -7.122 -1.806 13.789 1.00 0.00 C ATOM 1452 CG LYS A 95 -5.754 -2.356 13.424 1.00 0.00 C ATOM 1453 CD LYS A 95 -4.785 -1.241 13.064 1.00 0.00 C ATOM 1454 CE LYS A 95 -3.508 -1.787 12.443 1.00 0.00 C ATOM 1455 NZ LYS A 95 -2.734 -0.724 11.744 1.00 0.00 N ATOM 0 H LYS A 95 -9.487 -1.291 14.321 1.00 0.00 H new ATOM 0 HA LYS A 95 -8.248 -2.820 12.258 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -7.240 -0.820 13.340 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -7.174 -1.673 14.870 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -5.356 -2.930 14.261 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -5.849 -3.043 12.583 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -5.264 -0.553 12.367 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -4.539 -0.669 13.959 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -2.889 -2.236 13.220 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -3.757 -2.579 11.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -1.871 -1.135 11.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -3.315 -0.313 10.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -2.474 0.020 12.423 1.00 0.00 H new ATOM 1469 N GLY A 96 -8.725 -4.248 15.160 1.00 0.00 N ATOM 1470 CA GLY A 96 -8.631 -5.516 15.856 1.00 0.00 C ATOM 1471 C GLY A 96 -9.549 -6.574 15.281 1.00 0.00 C ATOM 1472 O GLY A 96 -9.229 -7.762 15.316 1.00 0.00 O ATOM 0 H GLY A 96 -9.264 -3.531 15.645 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -7.602 -5.873 15.813 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -8.872 -5.366 16.908 1.00 0.00 H new ATOM 1476 N GLN A 97 -10.687 -6.150 14.743 1.00 0.00 N ATOM 1477 CA GLN A 97 -11.641 -7.080 14.156 1.00 0.00 C ATOM 1478 C GLN A 97 -11.164 -7.542 12.784 1.00 0.00 C ATOM 1479 O GLN A 97 -11.428 -8.670 12.369 1.00 0.00 O ATOM 1480 CB GLN A 97 -13.019 -6.433 14.042 1.00 0.00 C ATOM 1481 CG GLN A 97 -13.461 -5.732 15.314 1.00 0.00 C ATOM 1482 CD GLN A 97 -14.562 -4.719 15.076 1.00 0.00 C ATOM 1483 OE1 GLN A 97 -15.009 -4.523 13.946 1.00 0.00 O ATOM 1484 NE2 GLN A 97 -15.004 -4.068 16.147 1.00 0.00 N ATOM 0 H GLN A 97 -10.970 -5.171 14.702 1.00 0.00 H new ATOM 0 HA GLN A 97 -11.716 -7.949 14.810 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -13.008 -5.713 13.224 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -13.751 -7.198 13.784 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -13.807 -6.476 16.031 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -12.604 -5.231 15.763 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -14.603 -4.264 17.064 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -15.744 -3.373 16.052 1.00 0.00 H new ATOM 1493 N LEU A 98 -10.452 -6.666 12.088 1.00 0.00 N ATOM 1494 CA LEU A 98 -9.925 -7.000 10.771 1.00 0.00 C ATOM 1495 C LEU A 98 -8.781 -7.996 10.913 1.00 0.00 C ATOM 1496 O LEU A 98 -8.761 -9.040 10.260 1.00 0.00 O ATOM 1497 CB LEU A 98 -9.445 -5.742 10.041 1.00 0.00 C ATOM 1498 CG LEU A 98 -9.815 -5.677 8.558 1.00 0.00 C ATOM 1499 CD1 LEU A 98 -10.159 -4.251 8.154 1.00 0.00 C ATOM 1500 CD2 LEU A 98 -8.680 -6.213 7.699 1.00 0.00 C ATOM 0 H LEU A 98 -10.227 -5.725 12.410 1.00 0.00 H new ATOM 0 HA LEU A 98 -10.723 -7.450 10.180 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -9.860 -4.868 10.543 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.361 -5.678 10.133 1.00 0.00 H new ATOM 0 HG LEU A 98 -10.693 -6.302 8.398 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -10.419 -4.225 7.096 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -11.005 -3.900 8.745 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -9.299 -3.605 8.332 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.962 -6.158 6.648 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.784 -5.615 7.866 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.479 -7.250 7.967 1.00 0.00 H new ATOM 1512 N LYS A 99 -7.827 -7.656 11.777 1.00 0.00 N ATOM 1513 CA LYS A 99 -6.665 -8.502 12.023 1.00 0.00 C ATOM 1514 C LYS A 99 -7.084 -9.865 12.573 1.00 0.00 C ATOM 1515 O LYS A 99 -6.550 -10.897 12.164 1.00 0.00 O ATOM 1516 CB LYS A 99 -5.716 -7.805 13.003 1.00 0.00 C ATOM 1517 CG LYS A 99 -4.315 -8.396 13.034 1.00 0.00 C ATOM 1518 CD LYS A 99 -3.445 -7.707 14.076 1.00 0.00 C ATOM 1519 CE LYS A 99 -3.352 -8.528 15.353 1.00 0.00 C ATOM 1520 NZ LYS A 99 -2.041 -8.354 16.038 1.00 0.00 N ATOM 0 H LYS A 99 -7.838 -6.793 12.321 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.150 -8.665 11.076 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -5.648 -6.750 12.739 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -6.143 -7.856 14.005 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.373 -9.462 13.253 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -3.855 -8.297 12.051 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -2.446 -7.548 13.670 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -3.857 -6.724 14.303 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -4.155 -8.237 16.030 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -3.500 -9.582 15.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -2.022 -8.931 16.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -1.275 -8.656 15.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -1.910 -7.353 16.287 1.00 0.00 H new ATOM 1534 N GLU A 100 -8.051 -9.870 13.491 1.00 0.00 N ATOM 1535 CA GLU A 100 -8.534 -11.120 14.073 1.00 0.00 C ATOM 1536 C GLU A 100 -9.138 -12.009 12.986 1.00 0.00 C ATOM 1537 O GLU A 100 -8.928 -13.222 12.972 1.00 0.00 O ATOM 1538 CB GLU A 100 -9.538 -10.849 15.211 1.00 0.00 C ATOM 1539 CG GLU A 100 -10.981 -10.649 14.765 1.00 0.00 C ATOM 1540 CD GLU A 100 -11.808 -11.917 14.866 1.00 0.00 C ATOM 1541 OE1 GLU A 100 -11.845 -12.685 13.881 1.00 0.00 O ATOM 1542 OE2 GLU A 100 -12.422 -12.144 15.931 1.00 0.00 O ATOM 0 H GLU A 100 -8.511 -9.031 13.844 1.00 0.00 H new ATOM 0 HA GLU A 100 -7.689 -11.651 14.511 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -9.503 -11.683 15.912 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -9.216 -9.961 15.755 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.441 -9.871 15.375 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -10.992 -10.294 13.734 1.00 0.00 H new ATOM 1549 N PHE A 101 -9.853 -11.387 12.049 1.00 0.00 N ATOM 1550 CA PHE A 101 -10.456 -12.106 10.932 1.00 0.00 C ATOM 1551 C PHE A 101 -9.372 -12.735 10.068 1.00 0.00 C ATOM 1552 O PHE A 101 -9.479 -13.885 9.635 1.00 0.00 O ATOM 1553 CB PHE A 101 -11.309 -11.155 10.090 1.00 0.00 C ATOM 1554 CG PHE A 101 -12.254 -11.849 9.151 1.00 0.00 C ATOM 1555 CD1 PHE A 101 -13.119 -12.832 9.611 1.00 0.00 C ATOM 1556 CD2 PHE A 101 -12.278 -11.517 7.807 1.00 0.00 C ATOM 1557 CE1 PHE A 101 -13.984 -13.471 8.744 1.00 0.00 C ATOM 1558 CE2 PHE A 101 -13.143 -12.150 6.938 1.00 0.00 C ATOM 1559 CZ PHE A 101 -13.997 -13.129 7.405 1.00 0.00 C ATOM 0 H PHE A 101 -10.028 -10.382 12.044 1.00 0.00 H new ATOM 0 HA PHE A 101 -11.095 -12.895 11.328 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -11.883 -10.512 10.757 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -10.650 -10.507 9.512 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -13.116 -13.100 10.657 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -11.612 -10.753 7.434 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -14.650 -14.237 9.112 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -13.152 -11.880 5.892 1.00 0.00 H new ATOM 0 HZ PHE A 101 -14.674 -13.626 6.726 1.00 0.00 H new ATOM 1569 N LEU A 102 -8.314 -11.969 9.833 1.00 0.00 N ATOM 1570 CA LEU A 102 -7.200 -12.440 9.031 1.00 0.00 C ATOM 1571 C LEU A 102 -6.483 -13.575 9.756 1.00 0.00 C ATOM 1572 O LEU A 102 -6.394 -14.686 9.244 1.00 0.00 O ATOM 1573 CB LEU A 102 -6.234 -11.291 8.736 1.00 0.00 C ATOM 1574 CG LEU A 102 -6.346 -10.709 7.327 1.00 0.00 C ATOM 1575 CD1 LEU A 102 -5.451 -9.487 7.181 1.00 0.00 C ATOM 1576 CD2 LEU A 102 -5.997 -11.766 6.286 1.00 0.00 C ATOM 0 H LEU A 102 -8.207 -11.019 10.188 1.00 0.00 H new ATOM 0 HA LEU A 102 -7.580 -12.817 8.081 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -6.408 -10.494 9.459 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -5.214 -11.643 8.889 1.00 0.00 H new ATOM 0 HG LEU A 102 -7.377 -10.395 7.162 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -5.544 -9.086 6.172 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -5.752 -8.727 7.902 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.415 -9.771 7.365 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -6.082 -11.336 5.288 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -4.976 -12.112 6.447 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -6.684 -12.608 6.378 1.00 0.00 H new ATOM 1588 N ASP A 103 -5.997 -13.294 10.963 1.00 0.00 N ATOM 1589 CA ASP A 103 -5.306 -14.305 11.762 1.00 0.00 C ATOM 1590 C ASP A 103 -6.119 -15.601 11.817 1.00 0.00 C ATOM 1591 O ASP A 103 -5.561 -16.697 11.841 1.00 0.00 O ATOM 1592 CB ASP A 103 -5.050 -13.776 13.179 1.00 0.00 C ATOM 1593 CG ASP A 103 -3.764 -14.313 13.781 1.00 0.00 C ATOM 1594 OD1 ASP A 103 -3.355 -15.433 13.407 1.00 0.00 O ATOM 1595 OD2 ASP A 103 -3.168 -13.616 14.629 1.00 0.00 O ATOM 0 H ASP A 103 -6.068 -12.379 11.408 1.00 0.00 H new ATOM 0 HA ASP A 103 -4.348 -14.522 11.289 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -5.008 -12.687 13.154 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -5.888 -14.048 13.821 1.00 0.00 H new ATOM 1600 N ALA A 104 -7.442 -15.461 11.841 1.00 0.00 N ATOM 1601 CA ALA A 104 -8.342 -16.609 11.896 1.00 0.00 C ATOM 1602 C ALA A 104 -8.431 -17.353 10.557 1.00 0.00 C ATOM 1603 O ALA A 104 -8.842 -18.513 10.518 1.00 0.00 O ATOM 1604 CB ALA A 104 -9.727 -16.164 12.350 1.00 0.00 C ATOM 0 H ALA A 104 -7.916 -14.558 11.823 1.00 0.00 H new ATOM 0 HA ALA A 104 -7.928 -17.311 12.620 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -10.392 -17.027 12.388 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -9.658 -15.715 13.341 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -10.123 -15.432 11.646 1.00 0.00 H new ATOM 1610 N ASN A 105 -8.070 -16.685 9.460 1.00 0.00 N ATOM 1611 CA ASN A 105 -8.145 -17.307 8.135 1.00 0.00 C ATOM 1612 C ASN A 105 -6.758 -17.610 7.567 1.00 0.00 C ATOM 1613 O ASN A 105 -6.574 -18.598 6.855 1.00 0.00 O ATOM 1614 CB ASN A 105 -8.908 -16.390 7.174 1.00 0.00 C ATOM 1615 CG ASN A 105 -9.812 -17.157 6.228 1.00 0.00 C ATOM 1616 OD1 ASN A 105 -10.239 -18.272 6.528 1.00 0.00 O ATOM 1617 ND2 ASN A 105 -10.107 -16.562 5.076 1.00 0.00 N ATOM 0 H ASN A 105 -7.727 -15.725 9.460 1.00 0.00 H new ATOM 0 HA ASN A 105 -8.673 -18.254 8.244 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -9.507 -15.684 7.750 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -8.195 -15.804 6.594 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -10.710 -17.031 4.400 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -9.731 -15.637 4.869 1.00 0.00 H new ATOM 1624 N LEU A 106 -5.789 -16.763 7.885 1.00 0.00 N ATOM 1625 CA LEU A 106 -4.419 -16.942 7.405 1.00 0.00 C ATOM 1626 C LEU A 106 -3.772 -18.157 8.063 1.00 0.00 C ATOM 1627 O LEU A 106 -3.548 -18.176 9.274 1.00 0.00 O ATOM 1628 CB LEU A 106 -3.604 -15.678 7.695 1.00 0.00 C ATOM 1629 CG LEU A 106 -2.158 -15.677 7.185 1.00 0.00 C ATOM 1630 CD1 LEU A 106 -1.271 -16.511 8.095 1.00 0.00 C ATOM 1631 CD2 LEU A 106 -2.085 -16.182 5.749 1.00 0.00 C ATOM 0 H LEU A 106 -5.923 -15.942 8.475 1.00 0.00 H new ATOM 0 HA LEU A 106 -4.441 -17.114 6.329 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.123 -14.826 7.256 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.588 -15.520 8.773 1.00 0.00 H new ATOM 0 HG LEU A 106 -1.794 -14.649 7.198 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -0.249 -16.499 7.717 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -1.291 -16.096 9.103 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -1.637 -17.538 8.118 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -1.049 -16.171 5.412 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.471 -17.200 5.701 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -2.683 -15.536 5.105 1.00 0.00 H new ATOM 1643 N VAL A 107 -3.478 -19.171 7.256 1.00 0.00 N ATOM 1644 CA VAL A 107 -2.862 -20.397 7.755 1.00 0.00 C ATOM 1645 C VAL A 107 -2.142 -21.146 6.639 1.00 0.00 C ATOM 1646 O VAL A 107 -1.040 -21.673 6.896 1.00 0.00 O ATOM 1647 CB VAL A 107 -3.909 -21.331 8.389 1.00 0.00 C ATOM 1648 CG1 VAL A 107 -4.331 -20.810 9.754 1.00 0.00 C ATOM 1649 CG2 VAL A 107 -5.114 -21.488 7.474 1.00 0.00 C ATOM 0 H VAL A 107 -3.656 -19.169 6.252 1.00 0.00 H new ATOM 0 HA VAL A 107 -2.139 -20.101 8.515 1.00 0.00 H new ATOM 0 HB VAL A 107 -3.457 -22.313 8.523 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -5.071 -21.483 10.187 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -3.461 -20.758 10.409 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -4.764 -19.815 9.646 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -5.841 -22.152 7.941 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -5.570 -20.513 7.302 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -4.795 -21.912 6.522 1.00 0.00 H new TER 1659 VAL A 107