USER MOD reduce.3.24.130724 H: found=0, std=0, add=983, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 982 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 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 44:sc= 0.215 USER MOD Single : A 3 HIS : no HD1:sc= -2.32 X(o=-2.3,f=-2.7) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= -6.08! USER MOD Single : A 9 CYS SG : rot 28:sc= 0.112 USER MOD Single : A 13 GLN : amide:sc= -0.24 X(o=-0.24,f=0) USER MOD Single : A 14 ASN : amide:sc= -3.88 K(o=-3.9,f=-12!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= -0.293 K(o=-0.29,f=-0.88) USER MOD Single : A 32 ASN : amide:sc= -0.176 K(o=-0.18,f=-1.7!) USER MOD Single : A 33 SER OG : rot 180:sc= 0.0466 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0.0504 USER MOD Single : A 41 GLN : amide:sc= -9.88! C(o=-9.9!,f=-8.3!) USER MOD Single : A 44 GLN : amide:sc= -0.148 X(o=-0.15,f=-0.16) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= 0.0988 X(o=0.099,f=0) USER MOD Single : A 56 THR OG1 : rot 43:sc= 0.647 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= -0.308 K(o=-0.31,f=-2.4!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= -0.0133 USER MOD Single : A 77 GLN : amide:sc= -0.334 X(o=-0.33,f=-0.71) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= -0.047 K(o=-0.047,f=-1.7!) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.074 USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.53 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 158:sc= -2.07 (180deg=-3.1!) USER MOD Single : A 100 GLN : amide:sc= -0.931 X(o=-0.93,f=-0.48) USER MOD Single : A 102 THR OG1 : rot -92:sc= 1.31 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.11 USER MOD Single : A 109 LYS NZ :NH3+ 155:sc= -0.18 (180deg=-0.881) USER MOD Single : A 110 GLN : amide:sc= -0.345 K(o=-0.35,f=-2.9!) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0.0944 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.00338) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 15.381 -7.909 26.140 1.00 0.00 N ATOM 2 CA GLY A 1 15.055 -6.567 26.699 1.00 0.00 C ATOM 3 C GLY A 1 16.202 -5.585 26.556 1.00 0.00 C ATOM 4 O GLY A 1 16.902 -5.293 27.525 1.00 0.00 O ATOM 0 H1 GLY A 1 14.566 -8.543 26.262 1.00 0.00 H new ATOM 0 H2 GLY A 1 15.601 -7.819 25.128 1.00 0.00 H new ATOM 0 H3 GLY A 1 16.204 -8.303 26.640 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.175 -6.170 26.193 1.00 0.00 H new ATOM 0 HA3 GLY A 1 14.797 -6.669 27.753 1.00 0.00 H new ATOM 10 N SER A 2 16.393 -5.074 25.344 1.00 0.00 N ATOM 11 CA SER A 2 17.462 -4.120 25.075 1.00 0.00 C ATOM 12 C SER A 2 17.427 -3.664 23.620 1.00 0.00 C ATOM 13 O SER A 2 17.759 -4.427 22.713 1.00 0.00 O ATOM 14 CB SER A 2 18.823 -4.742 25.394 1.00 0.00 C ATOM 15 OG SER A 2 18.945 -6.029 24.813 1.00 0.00 O ATOM 0 H SER A 2 15.821 -5.305 24.532 1.00 0.00 H new ATOM 0 HA SER A 2 17.310 -3.251 25.715 1.00 0.00 H new ATOM 0 HB2 SER A 2 19.618 -4.095 25.023 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.949 -4.814 26.474 1.00 0.00 H new ATOM 0 HG SER A 2 18.601 -6.008 23.895 1.00 0.00 H new ATOM 21 N HIS A 3 17.023 -2.417 23.403 1.00 0.00 N ATOM 22 CA HIS A 3 16.945 -1.866 22.055 1.00 0.00 C ATOM 23 C HIS A 3 17.018 -0.341 22.078 1.00 0.00 C ATOM 24 O HIS A 3 15.994 0.337 22.148 1.00 0.00 O ATOM 25 CB HIS A 3 15.650 -2.313 21.376 1.00 0.00 C ATOM 26 CG HIS A 3 15.485 -3.799 21.316 1.00 0.00 C ATOM 27 ND1 HIS A 3 16.175 -4.598 20.428 1.00 0.00 N ATOM 28 CD2 HIS A 3 14.703 -4.635 22.039 1.00 0.00 C ATOM 29 CE1 HIS A 3 15.823 -5.859 20.607 1.00 0.00 C ATOM 30 NE2 HIS A 3 14.931 -5.908 21.579 1.00 0.00 N ATOM 0 H HIS A 3 16.745 -1.770 24.141 1.00 0.00 H new ATOM 0 HA HIS A 3 17.797 -2.242 21.489 1.00 0.00 H new ATOM 0 HB2 HIS A 3 14.803 -1.883 21.911 1.00 0.00 H new ATOM 0 HB3 HIS A 3 15.624 -1.912 20.363 1.00 0.00 H new ATOM 0 HD2 HIS A 3 14.025 -4.353 22.831 1.00 0.00 H new ATOM 0 HE1 HIS A 3 16.201 -6.705 20.053 1.00 0.00 H new ATOM 0 HE2 HIS A 3 14.484 -6.754 21.931 1.00 0.00 H new ATOM 39 N MET A 4 18.235 0.192 22.011 1.00 0.00 N ATOM 40 CA MET A 4 18.435 1.637 22.015 1.00 0.00 C ATOM 41 C MET A 4 18.010 2.238 20.679 1.00 0.00 C ATOM 42 O MET A 4 16.956 2.866 20.576 1.00 0.00 O ATOM 43 CB MET A 4 19.900 1.972 22.299 1.00 0.00 C ATOM 44 CG MET A 4 20.204 2.167 23.776 1.00 0.00 C ATOM 45 SD MET A 4 21.815 1.508 24.247 1.00 0.00 S ATOM 46 CE MET A 4 21.416 -0.221 24.490 1.00 0.00 C ATOM 0 H MET A 4 19.095 -0.354 21.953 1.00 0.00 H new ATOM 0 HA MET A 4 17.818 2.067 22.804 1.00 0.00 H new ATOM 0 HB2 MET A 4 20.529 1.172 21.910 1.00 0.00 H new ATOM 0 HB3 MET A 4 20.168 2.880 21.758 1.00 0.00 H new ATOM 0 HG2 MET A 4 20.167 3.230 24.013 1.00 0.00 H new ATOM 0 HG3 MET A 4 19.430 1.681 24.370 1.00 0.00 H new ATOM 0 HE1 MET A 4 22.314 -0.764 24.786 1.00 0.00 H new ATOM 0 HE2 MET A 4 20.662 -0.314 25.271 1.00 0.00 H new ATOM 0 HE3 MET A 4 21.029 -0.639 23.561 1.00 0.00 H new ATOM 56 N ASP A 5 18.833 2.031 19.656 1.00 0.00 N ATOM 57 CA ASP A 5 18.537 2.542 18.322 1.00 0.00 C ATOM 58 C ASP A 5 17.648 1.559 17.568 1.00 0.00 C ATOM 59 O ASP A 5 17.335 0.483 18.077 1.00 0.00 O ATOM 60 CB ASP A 5 19.832 2.783 17.544 1.00 0.00 C ATOM 61 CG ASP A 5 20.802 3.673 18.295 1.00 0.00 C ATOM 62 OD1 ASP A 5 21.001 3.445 19.507 1.00 0.00 O ATOM 63 OD2 ASP A 5 21.363 4.599 17.673 1.00 0.00 O ATOM 0 H ASP A 5 19.709 1.514 19.725 1.00 0.00 H new ATOM 0 HA ASP A 5 18.009 3.490 18.422 1.00 0.00 H new ATOM 0 HB2 ASP A 5 20.310 1.826 17.334 1.00 0.00 H new ATOM 0 HB3 ASP A 5 19.595 3.239 16.583 1.00 0.00 H new ATOM 68 N LYS A 6 17.238 1.927 16.358 1.00 0.00 N ATOM 69 CA LYS A 6 16.381 1.058 15.559 1.00 0.00 C ATOM 70 C LYS A 6 16.092 1.658 14.185 1.00 0.00 C ATOM 71 O LYS A 6 15.353 2.636 14.067 1.00 0.00 O ATOM 72 CB LYS A 6 15.065 0.794 16.297 1.00 0.00 C ATOM 73 CG LYS A 6 14.759 -0.683 16.494 1.00 0.00 C ATOM 74 CD LYS A 6 13.277 -0.914 16.744 1.00 0.00 C ATOM 75 CE LYS A 6 13.011 -2.311 17.281 1.00 0.00 C ATOM 76 NZ LYS A 6 12.007 -2.300 18.382 1.00 0.00 N ATOM 0 H LYS A 6 17.482 2.812 15.913 1.00 0.00 H new ATOM 0 HA LYS A 6 16.912 0.118 15.410 1.00 0.00 H new ATOM 0 HB2 LYS A 6 15.101 1.281 17.271 1.00 0.00 H new ATOM 0 HB3 LYS A 6 14.248 1.254 15.741 1.00 0.00 H new ATOM 0 HG2 LYS A 6 15.072 -1.242 15.612 1.00 0.00 H new ATOM 0 HG3 LYS A 6 15.336 -1.066 17.336 1.00 0.00 H new ATOM 0 HD2 LYS A 6 12.908 -0.174 17.454 1.00 0.00 H new ATOM 0 HD3 LYS A 6 12.724 -0.769 15.816 1.00 0.00 H new ATOM 0 HE2 LYS A 6 12.656 -2.950 16.472 1.00 0.00 H new ATOM 0 HE3 LYS A 6 13.943 -2.744 17.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 11.853 -3.271 18.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 12.357 -1.711 19.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 11.110 -1.910 18.030 1.00 0.00 H new ATOM 90 N THR A 7 16.662 1.051 13.148 1.00 0.00 N ATOM 91 CA THR A 7 16.446 1.509 11.780 1.00 0.00 C ATOM 92 C THR A 7 16.612 0.353 10.805 1.00 0.00 C ATOM 93 O THR A 7 17.606 -0.373 10.849 1.00 0.00 O ATOM 94 CB THR A 7 17.434 2.614 11.438 1.00 0.00 C ATOM 95 OG1 THR A 7 17.274 3.038 10.098 1.00 0.00 O ATOM 96 CG2 THR A 7 18.872 2.188 11.622 1.00 0.00 C ATOM 0 H THR A 7 17.277 0.241 13.229 1.00 0.00 H new ATOM 0 HA THR A 7 15.431 1.898 11.699 1.00 0.00 H new ATOM 0 HB THR A 7 17.217 3.429 12.129 1.00 0.00 H new ATOM 0 HG1 THR A 7 17.918 3.750 9.901 1.00 0.00 H new ATOM 0 HG21 THR A 7 19.533 3.016 11.364 1.00 0.00 H new ATOM 0 HG22 THR A 7 19.037 1.903 12.661 1.00 0.00 H new ATOM 0 HG23 THR A 7 19.085 1.338 10.974 1.00 0.00 H new ATOM 104 N PHE A 8 15.631 0.180 9.933 1.00 0.00 N ATOM 105 CA PHE A 8 15.669 -0.901 8.952 1.00 0.00 C ATOM 106 C PHE A 8 14.982 -0.524 7.648 1.00 0.00 C ATOM 107 O PHE A 8 14.046 0.276 7.635 1.00 0.00 O ATOM 108 CB PHE A 8 15.007 -2.150 9.525 1.00 0.00 C ATOM 109 CG PHE A 8 14.037 -1.849 10.625 1.00 0.00 C ATOM 110 CD1 PHE A 8 14.479 -1.699 11.929 1.00 0.00 C ATOM 111 CD2 PHE A 8 12.685 -1.718 10.353 1.00 0.00 C ATOM 112 CE1 PHE A 8 13.588 -1.424 12.948 1.00 0.00 C ATOM 113 CE2 PHE A 8 11.790 -1.444 11.371 1.00 0.00 C ATOM 114 CZ PHE A 8 12.241 -1.298 12.668 1.00 0.00 C ATOM 0 H PHE A 8 14.801 0.770 9.882 1.00 0.00 H new ATOM 0 HA PHE A 8 16.719 -1.096 8.733 1.00 0.00 H new ATOM 0 HB2 PHE A 8 14.488 -2.678 8.725 1.00 0.00 H new ATOM 0 HB3 PHE A 8 15.778 -2.822 9.902 1.00 0.00 H new ATOM 0 HD1 PHE A 8 15.531 -1.798 12.151 1.00 0.00 H new ATOM 0 HD2 PHE A 8 12.328 -1.831 9.340 1.00 0.00 H new ATOM 0 HE1 PHE A 8 13.943 -1.308 13.961 1.00 0.00 H new ATOM 0 HE2 PHE A 8 10.737 -1.344 11.151 1.00 0.00 H new ATOM 0 HZ PHE A 8 11.541 -1.085 13.463 1.00 0.00 H new ATOM 124 N CYS A 9 15.407 -1.158 6.565 1.00 0.00 N ATOM 125 CA CYS A 9 14.791 -0.942 5.267 1.00 0.00 C ATOM 126 C CYS A 9 13.693 -1.985 5.076 1.00 0.00 C ATOM 127 O CYS A 9 13.943 -3.183 5.206 1.00 0.00 O ATOM 128 CB CYS A 9 15.832 -1.054 4.151 1.00 0.00 C ATOM 129 SG CYS A 9 16.767 -2.601 4.165 1.00 0.00 S ATOM 0 H CYS A 9 16.177 -1.827 6.561 1.00 0.00 H new ATOM 0 HA CYS A 9 14.365 0.060 5.224 1.00 0.00 H new ATOM 0 HB2 CYS A 9 15.329 -0.955 3.189 1.00 0.00 H new ATOM 0 HB3 CYS A 9 16.529 -0.220 4.234 1.00 0.00 H new ATOM 0 HG CYS A 9 16.040 -3.542 4.690 1.00 0.00 H new ATOM 135 N VAL A 10 12.476 -1.534 4.798 1.00 0.00 N ATOM 136 CA VAL A 10 11.353 -2.452 4.628 1.00 0.00 C ATOM 137 C VAL A 10 10.903 -2.512 3.179 1.00 0.00 C ATOM 138 O VAL A 10 11.104 -1.574 2.415 1.00 0.00 O ATOM 139 CB VAL A 10 10.158 -2.051 5.531 1.00 0.00 C ATOM 140 CG1 VAL A 10 9.002 -1.462 4.727 1.00 0.00 C ATOM 141 CG2 VAL A 10 9.683 -3.242 6.345 1.00 0.00 C ATOM 0 H VAL A 10 12.241 -0.548 4.686 1.00 0.00 H new ATOM 0 HA VAL A 10 11.701 -3.441 4.926 1.00 0.00 H new ATOM 0 HB VAL A 10 10.512 -1.274 6.209 1.00 0.00 H new ATOM 0 HG11 VAL A 10 8.188 -1.196 5.401 1.00 0.00 H new ATOM 0 HG12 VAL A 10 9.342 -0.571 4.200 1.00 0.00 H new ATOM 0 HG13 VAL A 10 8.649 -2.198 4.005 1.00 0.00 H new ATOM 0 HG21 VAL A 10 8.844 -2.942 6.973 1.00 0.00 H new ATOM 0 HG22 VAL A 10 9.366 -4.039 5.673 1.00 0.00 H new ATOM 0 HG23 VAL A 10 10.497 -3.600 6.975 1.00 0.00 H new ATOM 151 N VAL A 11 10.301 -3.627 2.801 1.00 0.00 N ATOM 152 CA VAL A 11 9.840 -3.794 1.440 1.00 0.00 C ATOM 153 C VAL A 11 8.465 -4.454 1.378 1.00 0.00 C ATOM 154 O VAL A 11 8.237 -5.505 1.976 1.00 0.00 O ATOM 155 CB VAL A 11 10.862 -4.596 0.624 1.00 0.00 C ATOM 156 CG1 VAL A 11 11.281 -5.847 1.374 1.00 0.00 C ATOM 157 CG2 VAL A 11 10.327 -4.937 -0.761 1.00 0.00 C ATOM 0 H VAL A 11 10.123 -4.422 3.414 1.00 0.00 H new ATOM 0 HA VAL A 11 9.740 -2.800 1.004 1.00 0.00 H new ATOM 0 HB VAL A 11 11.744 -3.971 0.485 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.006 -6.402 0.779 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.732 -5.567 2.326 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.407 -6.472 1.556 1.00 0.00 H new ATOM 0 HG21 VAL A 11 11.077 -5.505 -1.311 1.00 0.00 H new ATOM 0 HG22 VAL A 11 9.420 -5.533 -0.664 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.101 -4.017 -1.300 1.00 0.00 H new ATOM 167 N VAL A 12 7.558 -3.819 0.642 1.00 0.00 N ATOM 168 CA VAL A 12 6.199 -4.324 0.482 1.00 0.00 C ATOM 169 C VAL A 12 6.065 -5.112 -0.813 1.00 0.00 C ATOM 170 O VAL A 12 6.000 -4.535 -1.897 1.00 0.00 O ATOM 171 CB VAL A 12 5.166 -3.178 0.478 1.00 0.00 C ATOM 172 CG1 VAL A 12 4.840 -2.756 1.898 1.00 0.00 C ATOM 173 CG2 VAL A 12 5.671 -1.993 -0.334 1.00 0.00 C ATOM 0 H VAL A 12 7.742 -2.948 0.144 1.00 0.00 H new ATOM 0 HA VAL A 12 6.000 -4.977 1.332 1.00 0.00 H new ATOM 0 HB VAL A 12 4.253 -3.542 0.007 1.00 0.00 H new ATOM 0 HG11 VAL A 12 4.110 -1.947 1.879 1.00 0.00 H new ATOM 0 HG12 VAL A 12 4.427 -3.604 2.444 1.00 0.00 H new ATOM 0 HG13 VAL A 12 5.748 -2.413 2.393 1.00 0.00 H new ATOM 0 HG21 VAL A 12 4.925 -1.199 -0.321 1.00 0.00 H new ATOM 0 HG22 VAL A 12 6.601 -1.624 0.100 1.00 0.00 H new ATOM 0 HG23 VAL A 12 5.850 -2.306 -1.363 1.00 0.00 H new ATOM 183 N GLN A 13 6.019 -6.432 -0.693 1.00 0.00 N ATOM 184 CA GLN A 13 5.889 -7.297 -1.861 1.00 0.00 C ATOM 185 C GLN A 13 4.496 -7.912 -1.921 1.00 0.00 C ATOM 186 O GLN A 13 4.171 -8.811 -1.144 1.00 0.00 O ATOM 187 CB GLN A 13 6.946 -8.408 -1.831 1.00 0.00 C ATOM 188 CG GLN A 13 8.197 -8.052 -1.042 1.00 0.00 C ATOM 189 CD GLN A 13 9.201 -9.186 -0.994 1.00 0.00 C ATOM 190 OE1 GLN A 13 10.381 -9.000 -1.290 1.00 0.00 O ATOM 191 NE2 GLN A 13 8.736 -10.372 -0.617 1.00 0.00 N ATOM 0 H GLN A 13 6.069 -6.927 0.197 1.00 0.00 H new ATOM 0 HA GLN A 13 6.044 -6.687 -2.751 1.00 0.00 H new ATOM 0 HB2 GLN A 13 6.502 -9.306 -1.402 1.00 0.00 H new ATOM 0 HB3 GLN A 13 7.232 -8.651 -2.854 1.00 0.00 H new ATOM 0 HG2 GLN A 13 8.666 -7.176 -1.489 1.00 0.00 H new ATOM 0 HG3 GLN A 13 7.915 -7.779 -0.025 1.00 0.00 H new ATOM 0 HE21 GLN A 13 7.750 -10.481 -0.380 1.00 0.00 H new ATOM 0 HE22 GLN A 13 9.365 -11.173 -0.564 1.00 0.00 H new ATOM 200 N ASN A 14 3.677 -7.426 -2.846 1.00 0.00 N ATOM 201 CA ASN A 14 2.321 -7.936 -3.000 1.00 0.00 C ATOM 202 C ASN A 14 1.975 -8.126 -4.470 1.00 0.00 C ATOM 203 O ASN A 14 2.433 -7.376 -5.331 1.00 0.00 O ATOM 204 CB ASN A 14 1.313 -6.998 -2.331 1.00 0.00 C ATOM 205 CG ASN A 14 0.818 -7.548 -1.007 1.00 0.00 C ATOM 206 OD1 ASN A 14 1.504 -7.458 0.011 1.00 0.00 O ATOM 207 ND2 ASN A 14 -0.377 -8.129 -1.016 1.00 0.00 N ATOM 0 H ASN A 14 3.927 -6.683 -3.498 1.00 0.00 H new ATOM 0 HA ASN A 14 2.269 -8.908 -2.509 1.00 0.00 H new ATOM 0 HB2 ASN A 14 1.776 -6.024 -2.169 1.00 0.00 H new ATOM 0 HB3 ASN A 14 0.465 -6.841 -2.998 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -0.759 -8.522 -0.156 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -0.912 -8.182 -1.883 1.00 0.00 H new ATOM 214 N ARG A 15 1.166 -9.139 -4.748 1.00 0.00 N ATOM 215 CA ARG A 15 0.755 -9.438 -6.114 1.00 0.00 C ATOM 216 C ARG A 15 -0.745 -9.695 -6.181 1.00 0.00 C ATOM 217 O ARG A 15 -1.196 -10.836 -6.071 1.00 0.00 O ATOM 218 CB ARG A 15 1.521 -10.653 -6.642 1.00 0.00 C ATOM 219 CG ARG A 15 2.141 -10.434 -8.013 1.00 0.00 C ATOM 220 CD ARG A 15 3.284 -11.404 -8.271 1.00 0.00 C ATOM 221 NE ARG A 15 4.579 -10.728 -8.304 1.00 0.00 N ATOM 222 CZ ARG A 15 5.744 -11.350 -8.140 1.00 0.00 C ATOM 223 NH1 ARG A 15 5.783 -12.660 -7.931 1.00 0.00 N ATOM 224 NH2 ARG A 15 6.876 -10.659 -8.185 1.00 0.00 N ATOM 0 H ARG A 15 0.780 -9.769 -4.045 1.00 0.00 H new ATOM 0 HA ARG A 15 0.985 -8.575 -6.739 1.00 0.00 H new ATOM 0 HB2 ARG A 15 2.308 -10.911 -5.934 1.00 0.00 H new ATOM 0 HB3 ARG A 15 0.844 -11.506 -6.691 1.00 0.00 H new ATOM 0 HG2 ARG A 15 1.378 -10.557 -8.782 1.00 0.00 H new ATOM 0 HG3 ARG A 15 2.508 -9.410 -8.088 1.00 0.00 H new ATOM 0 HD2 ARG A 15 3.294 -12.168 -7.494 1.00 0.00 H new ATOM 0 HD3 ARG A 15 3.118 -11.916 -9.219 1.00 0.00 H new ATOM 0 HE ARG A 15 4.591 -9.720 -8.462 1.00 0.00 H new ATOM 0 HH11 ARG A 15 4.916 -13.197 -7.895 1.00 0.00 H new ATOM 0 HH12 ARG A 15 6.680 -13.130 -7.806 1.00 0.00 H new ATOM 0 HH21 ARG A 15 6.853 -9.652 -8.345 1.00 0.00 H new ATOM 0 HH22 ARG A 15 7.769 -11.135 -8.059 1.00 0.00 H new ATOM 238 N ILE A 16 -1.517 -8.628 -6.359 1.00 0.00 N ATOM 239 CA ILE A 16 -2.967 -8.744 -6.437 1.00 0.00 C ATOM 240 C ILE A 16 -3.518 -8.045 -7.678 1.00 0.00 C ATOM 241 O ILE A 16 -4.164 -8.674 -8.516 1.00 0.00 O ATOM 242 CB ILE A 16 -3.646 -8.168 -5.176 1.00 0.00 C ATOM 243 CG1 ILE A 16 -3.008 -8.756 -3.916 1.00 0.00 C ATOM 244 CG2 ILE A 16 -5.140 -8.453 -5.201 1.00 0.00 C ATOM 245 CD1 ILE A 16 -3.384 -8.020 -2.648 1.00 0.00 C ATOM 0 H ILE A 16 -1.163 -7.676 -6.452 1.00 0.00 H new ATOM 0 HA ILE A 16 -3.195 -9.808 -6.505 1.00 0.00 H new ATOM 0 HB ILE A 16 -3.503 -7.088 -5.165 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -3.305 -9.801 -3.822 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -1.924 -8.742 -4.027 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -5.604 -8.041 -4.305 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -5.583 -7.993 -6.084 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -5.304 -9.530 -5.232 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -2.896 -8.492 -1.795 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -3.062 -6.981 -2.721 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -4.465 -8.057 -2.513 1.00 0.00 H new ATOM 257 N LYS A 17 -3.267 -6.742 -7.793 1.00 0.00 N ATOM 258 CA LYS A 17 -3.751 -5.973 -8.939 1.00 0.00 C ATOM 259 C LYS A 17 -2.722 -4.940 -9.406 1.00 0.00 C ATOM 260 O LYS A 17 -3.013 -4.124 -10.281 1.00 0.00 O ATOM 261 CB LYS A 17 -5.061 -5.263 -8.588 1.00 0.00 C ATOM 262 CG LYS A 17 -6.086 -6.155 -7.903 1.00 0.00 C ATOM 263 CD LYS A 17 -7.440 -6.089 -8.592 1.00 0.00 C ATOM 264 CE LYS A 17 -7.725 -7.353 -9.390 1.00 0.00 C ATOM 265 NZ LYS A 17 -8.177 -7.049 -10.777 1.00 0.00 N ATOM 0 H LYS A 17 -2.735 -6.199 -7.112 1.00 0.00 H new ATOM 0 HA LYS A 17 -3.920 -6.678 -9.753 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.840 -4.416 -7.938 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -5.499 -4.859 -9.501 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -5.729 -7.185 -7.901 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -6.193 -5.853 -6.861 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -8.222 -5.945 -7.846 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -7.469 -5.225 -9.256 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -6.826 -7.968 -9.429 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -8.490 -7.939 -8.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -8.360 -7.938 -11.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -9.050 -6.484 -10.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -7.437 -6.512 -11.273 1.00 0.00 H new ATOM 279 N GLU A 18 -1.525 -4.967 -8.822 1.00 0.00 N ATOM 280 CA GLU A 18 -0.474 -4.020 -9.190 1.00 0.00 C ATOM 281 C GLU A 18 -0.998 -2.585 -9.162 1.00 0.00 C ATOM 282 O GLU A 18 -0.490 -1.712 -9.866 1.00 0.00 O ATOM 283 CB GLU A 18 0.076 -4.346 -10.579 1.00 0.00 C ATOM 284 CG GLU A 18 0.843 -5.656 -10.638 1.00 0.00 C ATOM 285 CD GLU A 18 2.344 -5.455 -10.580 1.00 0.00 C ATOM 286 OE1 GLU A 18 2.867 -4.650 -11.380 1.00 0.00 O ATOM 287 OE2 GLU A 18 2.998 -6.103 -9.735 1.00 0.00 O ATOM 0 H GLU A 18 -1.260 -5.631 -8.095 1.00 0.00 H new ATOM 0 HA GLU A 18 0.330 -4.109 -8.459 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -0.751 -4.387 -11.288 1.00 0.00 H new ATOM 0 HB3 GLU A 18 0.731 -3.536 -10.900 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.533 -6.292 -9.809 1.00 0.00 H new ATOM 0 HG3 GLU A 18 0.586 -6.182 -11.557 1.00 0.00 H new ATOM 294 N GLY A 19 -2.020 -2.351 -8.343 1.00 0.00 N ATOM 295 CA GLY A 19 -2.605 -1.028 -8.232 1.00 0.00 C ATOM 296 C GLY A 19 -3.810 -1.018 -7.313 1.00 0.00 C ATOM 297 O GLY A 19 -4.940 -0.823 -7.758 1.00 0.00 O ATOM 0 H GLY A 19 -2.455 -3.059 -7.752 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -1.856 -0.330 -7.857 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -2.900 -0.677 -9.221 1.00 0.00 H new ATOM 301 N TYR A 20 -3.564 -1.238 -6.026 1.00 0.00 N ATOM 302 CA TYR A 20 -4.632 -1.266 -5.033 1.00 0.00 C ATOM 303 C TYR A 20 -4.655 0.020 -4.217 1.00 0.00 C ATOM 304 O TYR A 20 -5.081 0.027 -3.062 1.00 0.00 O ATOM 305 CB TYR A 20 -4.460 -2.477 -4.113 1.00 0.00 C ATOM 306 CG TYR A 20 -5.632 -2.734 -3.187 1.00 0.00 C ATOM 307 CD1 TYR A 20 -6.838 -2.056 -3.335 1.00 0.00 C ATOM 308 CD2 TYR A 20 -5.527 -3.666 -2.161 1.00 0.00 C ATOM 309 CE1 TYR A 20 -7.902 -2.300 -2.487 1.00 0.00 C ATOM 310 CE2 TYR A 20 -6.586 -3.913 -1.311 1.00 0.00 C ATOM 311 CZ TYR A 20 -7.772 -3.229 -1.477 1.00 0.00 C ATOM 312 OH TYR A 20 -8.829 -3.474 -0.632 1.00 0.00 O ATOM 0 H TYR A 20 -2.632 -1.400 -5.645 1.00 0.00 H new ATOM 0 HA TYR A 20 -5.584 -1.349 -5.557 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -4.297 -3.363 -4.726 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -3.562 -2.336 -3.511 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -6.944 -1.327 -4.125 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -4.601 -4.206 -2.027 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -8.831 -1.765 -2.615 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -6.486 -4.640 -0.518 1.00 0.00 H new ATOM 0 HH TYR A 20 -8.573 -4.156 0.023 1.00 0.00 H new ATOM 322 N ARG A 21 -4.205 1.108 -4.830 1.00 0.00 N ATOM 323 CA ARG A 21 -4.187 2.403 -4.165 1.00 0.00 C ATOM 324 C ARG A 21 -3.345 2.367 -2.897 1.00 0.00 C ATOM 325 O ARG A 21 -2.844 1.317 -2.499 1.00 0.00 O ATOM 326 CB ARG A 21 -5.612 2.826 -3.814 1.00 0.00 C ATOM 327 CG ARG A 21 -6.542 2.946 -5.011 1.00 0.00 C ATOM 328 CD ARG A 21 -5.796 3.311 -6.287 1.00 0.00 C ATOM 329 NE ARG A 21 -6.696 3.437 -7.431 1.00 0.00 N ATOM 330 CZ ARG A 21 -7.567 4.432 -7.583 1.00 0.00 C ATOM 331 NH1 ARG A 21 -7.656 5.392 -6.670 1.00 0.00 N ATOM 332 NH2 ARG A 21 -8.350 4.470 -8.652 1.00 0.00 N ATOM 0 H ARG A 21 -3.848 1.118 -5.786 1.00 0.00 H new ATOM 0 HA ARG A 21 -3.743 3.124 -4.851 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -6.031 2.103 -3.114 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -5.577 3.786 -3.298 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -7.067 2.002 -5.157 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -7.299 3.703 -4.806 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -5.264 4.251 -6.139 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -5.045 2.549 -6.498 1.00 0.00 H new ATOM 0 HE ARG A 21 -6.654 2.720 -8.156 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -7.055 5.370 -5.846 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -8.326 6.152 -6.792 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -8.285 3.737 -9.358 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -9.017 5.232 -8.768 1.00 0.00 H new ATOM 346 N ARG A 22 -3.208 3.525 -2.264 1.00 0.00 N ATOM 347 CA ARG A 22 -2.442 3.635 -1.033 1.00 0.00 C ATOM 348 C ARG A 22 -2.492 5.065 -0.490 1.00 0.00 C ATOM 349 O ARG A 22 -3.374 5.406 0.298 1.00 0.00 O ATOM 350 CB ARG A 22 -0.991 3.187 -1.265 1.00 0.00 C ATOM 351 CG ARG A 22 -0.064 3.445 -0.085 1.00 0.00 C ATOM 352 CD ARG A 22 0.148 2.188 0.742 1.00 0.00 C ATOM 353 NE ARG A 22 0.744 2.488 2.042 1.00 0.00 N ATOM 354 CZ ARG A 22 2.001 2.891 2.205 1.00 0.00 C ATOM 355 NH1 ARG A 22 2.805 3.026 1.158 1.00 0.00 N ATOM 356 NH2 ARG A 22 2.459 3.157 3.421 1.00 0.00 N ATOM 0 H ARG A 22 -3.619 4.402 -2.585 1.00 0.00 H new ATOM 0 HA ARG A 22 -2.889 2.977 -0.287 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -0.983 2.121 -1.493 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -0.598 3.703 -2.141 1.00 0.00 H new ATOM 0 HG2 ARG A 22 0.897 3.809 -0.449 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -0.484 4.229 0.544 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -0.807 1.683 0.888 1.00 0.00 H new ATOM 0 HD3 ARG A 22 0.793 1.499 0.197 1.00 0.00 H new ATOM 0 HE ARG A 22 0.162 2.382 2.873 1.00 0.00 H new ATOM 0 HH11 ARG A 22 2.460 2.820 0.220 1.00 0.00 H new ATOM 0 HH12 ARG A 22 3.768 3.336 1.291 1.00 0.00 H new ATOM 0 HH21 ARG A 22 1.847 3.052 4.231 1.00 0.00 H new ATOM 0 HH22 ARG A 22 3.423 3.466 3.547 1.00 0.00 H new ATOM 370 N ALA A 23 -1.548 5.900 -0.918 1.00 0.00 N ATOM 371 CA ALA A 23 -1.498 7.288 -0.476 1.00 0.00 C ATOM 372 C ALA A 23 -2.355 8.166 -1.377 1.00 0.00 C ATOM 373 O ALA A 23 -2.966 9.136 -0.929 1.00 0.00 O ATOM 374 CB ALA A 23 -0.061 7.786 -0.469 1.00 0.00 C ATOM 0 H ALA A 23 -0.809 5.638 -1.570 1.00 0.00 H new ATOM 0 HA ALA A 23 -1.894 7.343 0.538 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -0.037 8.824 -0.137 1.00 0.00 H new ATOM 0 HB2 ALA A 23 0.533 7.174 0.210 1.00 0.00 H new ATOM 0 HB3 ALA A 23 0.353 7.717 -1.475 1.00 0.00 H new ATOM 380 N GLY A 24 -2.386 7.811 -2.654 1.00 0.00 N ATOM 381 CA GLY A 24 -3.158 8.558 -3.626 1.00 0.00 C ATOM 382 C GLY A 24 -2.674 8.285 -5.032 1.00 0.00 C ATOM 383 O GLY A 24 -2.557 9.198 -5.850 1.00 0.00 O ATOM 0 H GLY A 24 -1.884 7.010 -3.037 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -4.211 8.290 -3.542 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -3.083 9.624 -3.413 1.00 0.00 H new ATOM 387 N PHE A 25 -2.377 7.020 -5.300 1.00 0.00 N ATOM 388 CA PHE A 25 -1.881 6.605 -6.601 1.00 0.00 C ATOM 389 C PHE A 25 -1.941 5.087 -6.737 1.00 0.00 C ATOM 390 O PHE A 25 -2.172 4.377 -5.759 1.00 0.00 O ATOM 391 CB PHE A 25 -0.442 7.099 -6.786 1.00 0.00 C ATOM 392 CG PHE A 25 0.586 6.292 -6.037 1.00 0.00 C ATOM 393 CD1 PHE A 25 0.379 5.926 -4.712 1.00 0.00 C ATOM 394 CD2 PHE A 25 1.761 5.901 -6.657 1.00 0.00 C ATOM 395 CE1 PHE A 25 1.325 5.186 -4.028 1.00 0.00 C ATOM 396 CE2 PHE A 25 2.710 5.161 -5.978 1.00 0.00 C ATOM 397 CZ PHE A 25 2.491 4.804 -4.661 1.00 0.00 C ATOM 0 H PHE A 25 -2.473 6.260 -4.626 1.00 0.00 H new ATOM 0 HA PHE A 25 -2.511 7.042 -7.375 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -0.197 7.083 -7.848 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -0.381 8.137 -6.460 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -0.531 6.223 -4.212 1.00 0.00 H new ATOM 0 HD2 PHE A 25 1.938 6.178 -7.686 1.00 0.00 H new ATOM 0 HE1 PHE A 25 1.152 4.907 -2.999 1.00 0.00 H new ATOM 0 HE2 PHE A 25 3.621 4.862 -6.475 1.00 0.00 H new ATOM 0 HZ PHE A 25 3.231 4.227 -4.127 1.00 0.00 H new ATOM 407 N SER A 26 -1.727 4.595 -7.950 1.00 0.00 N ATOM 408 CA SER A 26 -1.753 3.160 -8.201 1.00 0.00 C ATOM 409 C SER A 26 -0.435 2.516 -7.780 1.00 0.00 C ATOM 410 O SER A 26 0.303 1.987 -8.612 1.00 0.00 O ATOM 411 CB SER A 26 -2.024 2.884 -9.682 1.00 0.00 C ATOM 412 OG SER A 26 -2.855 3.885 -10.245 1.00 0.00 O ATOM 0 H SER A 26 -1.534 5.166 -8.773 1.00 0.00 H new ATOM 0 HA SER A 26 -2.557 2.723 -7.608 1.00 0.00 H new ATOM 0 HB2 SER A 26 -1.080 2.843 -10.226 1.00 0.00 H new ATOM 0 HB3 SER A 26 -2.499 1.909 -9.792 1.00 0.00 H new ATOM 0 HG SER A 26 -3.011 3.686 -11.192 1.00 0.00 H new ATOM 418 N PHE A 27 -0.143 2.566 -6.481 1.00 0.00 N ATOM 419 CA PHE A 27 1.090 1.987 -5.953 1.00 0.00 C ATOM 420 C PHE A 27 1.237 0.533 -6.395 1.00 0.00 C ATOM 421 O PHE A 27 0.327 -0.275 -6.208 1.00 0.00 O ATOM 422 CB PHE A 27 1.115 2.083 -4.417 1.00 0.00 C ATOM 423 CG PHE A 27 0.727 0.808 -3.714 1.00 0.00 C ATOM 424 CD1 PHE A 27 -0.590 0.377 -3.719 1.00 0.00 C ATOM 425 CD2 PHE A 27 1.678 0.036 -3.060 1.00 0.00 C ATOM 426 CE1 PHE A 27 -0.952 -0.796 -3.086 1.00 0.00 C ATOM 427 CE2 PHE A 27 1.320 -1.136 -2.423 1.00 0.00 C ATOM 428 CZ PHE A 27 0.003 -1.553 -2.438 1.00 0.00 C ATOM 0 H PHE A 27 -0.741 3.000 -5.778 1.00 0.00 H new ATOM 0 HA PHE A 27 1.931 2.554 -6.352 1.00 0.00 H new ATOM 0 HB2 PHE A 27 2.117 2.371 -4.098 1.00 0.00 H new ATOM 0 HB3 PHE A 27 0.440 2.879 -4.102 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -1.342 0.965 -4.224 1.00 0.00 H new ATOM 0 HD2 PHE A 27 2.710 0.356 -3.049 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -1.982 -1.121 -3.098 1.00 0.00 H new ATOM 0 HE2 PHE A 27 2.068 -1.725 -1.914 1.00 0.00 H new ATOM 0 HZ PHE A 27 -0.279 -2.471 -1.943 1.00 0.00 H new ATOM 438 N HIS A 28 2.383 0.199 -6.975 1.00 0.00 N ATOM 439 CA HIS A 28 2.627 -1.165 -7.424 1.00 0.00 C ATOM 440 C HIS A 28 2.812 -2.093 -6.232 1.00 0.00 C ATOM 441 O HIS A 28 3.827 -2.035 -5.537 1.00 0.00 O ATOM 442 CB HIS A 28 3.857 -1.228 -8.328 1.00 0.00 C ATOM 443 CG HIS A 28 3.754 -0.359 -9.543 1.00 0.00 C ATOM 444 ND1 HIS A 28 2.624 0.370 -9.854 1.00 0.00 N ATOM 445 CD2 HIS A 28 4.647 -0.102 -10.529 1.00 0.00 C ATOM 446 CE1 HIS A 28 2.827 1.035 -10.976 1.00 0.00 C ATOM 447 NE2 HIS A 28 4.046 0.767 -11.406 1.00 0.00 N ATOM 0 H HIS A 28 3.152 0.848 -7.144 1.00 0.00 H new ATOM 0 HA HIS A 28 1.758 -1.492 -7.996 1.00 0.00 H new ATOM 0 HB2 HIS A 28 4.735 -0.932 -7.754 1.00 0.00 H new ATOM 0 HB3 HIS A 28 4.014 -2.260 -8.642 1.00 0.00 H new ATOM 0 HD2 HIS A 28 5.646 -0.505 -10.610 1.00 0.00 H new ATOM 0 HE1 HIS A 28 2.116 1.688 -11.460 1.00 0.00 H new ATOM 0 HE2 HIS A 28 4.472 1.144 -12.252 1.00 0.00 H new ATOM 456 N LEU A 29 1.822 -2.947 -6.002 1.00 0.00 N ATOM 457 CA LEU A 29 1.862 -3.895 -4.893 1.00 0.00 C ATOM 458 C LEU A 29 3.207 -4.609 -4.828 1.00 0.00 C ATOM 459 O LEU A 29 3.658 -5.010 -3.754 1.00 0.00 O ATOM 460 CB LEU A 29 0.738 -4.913 -5.045 1.00 0.00 C ATOM 461 CG LEU A 29 -0.590 -4.495 -4.418 1.00 0.00 C ATOM 462 CD1 LEU A 29 -1.276 -3.442 -5.273 1.00 0.00 C ATOM 463 CD2 LEU A 29 -1.494 -5.702 -4.225 1.00 0.00 C ATOM 0 H LEU A 29 0.977 -3.003 -6.571 1.00 0.00 H new ATOM 0 HA LEU A 29 1.728 -3.341 -3.964 1.00 0.00 H new ATOM 0 HB2 LEU A 29 0.579 -5.103 -6.107 1.00 0.00 H new ATOM 0 HB3 LEU A 29 1.056 -5.854 -4.597 1.00 0.00 H new ATOM 0 HG LEU A 29 -0.386 -4.061 -3.439 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.221 -3.157 -4.810 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -0.633 -2.566 -5.356 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.467 -3.848 -6.267 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.435 -5.384 -3.777 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.691 -6.167 -5.191 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.005 -6.422 -3.568 1.00 0.00 H new ATOM 475 N GLY A 30 3.839 -4.763 -5.985 1.00 0.00 N ATOM 476 CA GLY A 30 5.127 -5.424 -6.060 1.00 0.00 C ATOM 477 C GLY A 30 6.088 -4.958 -4.986 1.00 0.00 C ATOM 478 O GLY A 30 5.828 -3.981 -4.285 1.00 0.00 O ATOM 0 H GLY A 30 3.477 -4.438 -6.882 1.00 0.00 H new ATOM 0 HA2 GLY A 30 4.984 -6.501 -5.971 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.568 -5.241 -7.040 1.00 0.00 H new ATOM 482 N ASP A 31 7.197 -5.670 -4.855 1.00 0.00 N ATOM 483 CA ASP A 31 8.207 -5.347 -3.853 1.00 0.00 C ATOM 484 C ASP A 31 8.680 -3.901 -3.964 1.00 0.00 C ATOM 485 O ASP A 31 9.242 -3.490 -4.980 1.00 0.00 O ATOM 486 CB ASP A 31 9.403 -6.293 -3.972 1.00 0.00 C ATOM 487 CG ASP A 31 9.798 -6.560 -5.412 1.00 0.00 C ATOM 488 OD1 ASP A 31 9.025 -7.236 -6.123 1.00 0.00 O ATOM 489 OD2 ASP A 31 10.879 -6.094 -5.828 1.00 0.00 O ATOM 0 H ASP A 31 7.423 -6.480 -5.432 1.00 0.00 H new ATOM 0 HA ASP A 31 7.741 -5.473 -2.876 1.00 0.00 H new ATOM 0 HB2 ASP A 31 10.253 -5.866 -3.440 1.00 0.00 H new ATOM 0 HB3 ASP A 31 9.163 -7.238 -3.484 1.00 0.00 H new ATOM 494 N ASN A 32 8.468 -3.147 -2.892 1.00 0.00 N ATOM 495 CA ASN A 32 8.887 -1.751 -2.825 1.00 0.00 C ATOM 496 C ASN A 32 9.824 -1.573 -1.638 1.00 0.00 C ATOM 497 O ASN A 32 9.497 -1.987 -0.534 1.00 0.00 O ATOM 498 CB ASN A 32 7.669 -0.832 -2.685 1.00 0.00 C ATOM 499 CG ASN A 32 7.734 0.361 -3.618 1.00 0.00 C ATOM 500 OD1 ASN A 32 8.794 0.691 -4.150 1.00 0.00 O ATOM 501 ND2 ASN A 32 6.596 1.015 -3.821 1.00 0.00 N ATOM 0 H ASN A 32 8.003 -3.483 -2.048 1.00 0.00 H new ATOM 0 HA ASN A 32 9.407 -1.483 -3.745 1.00 0.00 H new ATOM 0 HB2 ASN A 32 6.762 -1.401 -2.890 1.00 0.00 H new ATOM 0 HB3 ASN A 32 7.599 -0.481 -1.655 1.00 0.00 H new ATOM 0 HD21 ASN A 32 6.577 1.826 -4.439 1.00 0.00 H new ATOM 0 HD22 ASN A 32 5.741 0.706 -3.359 1.00 0.00 H new ATOM 508 N SER A 33 10.998 -0.990 -1.863 1.00 0.00 N ATOM 509 CA SER A 33 11.967 -0.819 -0.783 1.00 0.00 C ATOM 510 C SER A 33 11.740 0.456 0.010 1.00 0.00 C ATOM 511 O SER A 33 11.332 1.487 -0.525 1.00 0.00 O ATOM 512 CB SER A 33 13.395 -0.821 -1.318 1.00 0.00 C ATOM 513 OG SER A 33 13.457 -0.265 -2.620 1.00 0.00 O ATOM 0 H SER A 33 11.299 -0.632 -2.769 1.00 0.00 H new ATOM 0 HA SER A 33 11.821 -1.668 -0.115 1.00 0.00 H new ATOM 0 HB2 SER A 33 14.038 -0.252 -0.646 1.00 0.00 H new ATOM 0 HB3 SER A 33 13.777 -1.842 -1.337 1.00 0.00 H new ATOM 0 HG SER A 33 14.384 -0.277 -2.937 1.00 0.00 H new ATOM 519 N LEU A 34 12.019 0.357 1.301 1.00 0.00 N ATOM 520 CA LEU A 34 11.868 1.472 2.223 1.00 0.00 C ATOM 521 C LEU A 34 13.205 1.774 2.910 1.00 0.00 C ATOM 522 O LEU A 34 13.954 0.860 3.252 1.00 0.00 O ATOM 523 CB LEU A 34 10.780 1.129 3.257 1.00 0.00 C ATOM 524 CG LEU A 34 10.664 2.053 4.458 1.00 0.00 C ATOM 525 CD1 LEU A 34 11.643 1.599 5.522 1.00 0.00 C ATOM 526 CD2 LEU A 34 10.893 3.510 4.080 1.00 0.00 C ATOM 0 H LEU A 34 12.357 -0.500 1.739 1.00 0.00 H new ATOM 0 HA LEU A 34 11.565 2.365 1.676 1.00 0.00 H new ATOM 0 HB2 LEU A 34 9.818 1.113 2.746 1.00 0.00 H new ATOM 0 HB3 LEU A 34 10.964 0.118 3.622 1.00 0.00 H new ATOM 0 HG LEU A 34 9.648 1.996 4.850 1.00 0.00 H new ATOM 0 HD11 LEU A 34 11.568 2.255 6.389 1.00 0.00 H new ATOM 0 HD12 LEU A 34 11.409 0.577 5.819 1.00 0.00 H new ATOM 0 HD13 LEU A 34 12.657 1.638 5.124 1.00 0.00 H new ATOM 0 HD21 LEU A 34 10.801 4.135 4.968 1.00 0.00 H new ATOM 0 HD22 LEU A 34 11.892 3.624 3.658 1.00 0.00 H new ATOM 0 HD23 LEU A 34 10.151 3.816 3.343 1.00 0.00 H new ATOM 538 N ALA A 35 13.498 3.058 3.106 1.00 0.00 N ATOM 539 CA ALA A 35 14.734 3.484 3.747 1.00 0.00 C ATOM 540 C ALA A 35 14.715 3.160 5.232 1.00 0.00 C ATOM 541 O ALA A 35 13.660 3.017 5.835 1.00 0.00 O ATOM 542 CB ALA A 35 14.951 4.969 3.539 1.00 0.00 C ATOM 0 H ALA A 35 12.888 3.826 2.826 1.00 0.00 H new ATOM 0 HA ALA A 35 15.559 2.939 3.288 1.00 0.00 H new ATOM 0 HB1 ALA A 35 15.879 5.273 4.024 1.00 0.00 H new ATOM 0 HB2 ALA A 35 15.013 5.182 2.472 1.00 0.00 H new ATOM 0 HB3 ALA A 35 14.118 5.523 3.972 1.00 0.00 H new ATOM 548 N ALA A 36 15.888 3.031 5.814 1.00 0.00 N ATOM 549 CA ALA A 36 15.994 2.687 7.225 1.00 0.00 C ATOM 550 C ALA A 36 15.564 3.841 8.124 1.00 0.00 C ATOM 551 O ALA A 36 16.244 4.862 8.227 1.00 0.00 O ATOM 552 CB ALA A 36 17.418 2.261 7.551 1.00 0.00 C ATOM 0 H ALA A 36 16.781 3.158 5.338 1.00 0.00 H new ATOM 0 HA ALA A 36 15.316 1.855 7.418 1.00 0.00 H new ATOM 0 HB1 ALA A 36 17.488 2.006 8.608 1.00 0.00 H new ATOM 0 HB2 ALA A 36 17.685 1.392 6.949 1.00 0.00 H new ATOM 0 HB3 ALA A 36 18.103 3.080 7.329 1.00 0.00 H new ATOM 558 N VAL A 37 14.414 3.653 8.776 1.00 0.00 N ATOM 559 CA VAL A 37 13.854 4.655 9.677 1.00 0.00 C ATOM 560 C VAL A 37 13.500 4.034 11.026 1.00 0.00 C ATOM 561 O VAL A 37 13.676 2.834 11.232 1.00 0.00 O ATOM 562 CB VAL A 37 12.594 5.339 9.075 1.00 0.00 C ATOM 563 CG1 VAL A 37 12.564 5.196 7.560 1.00 0.00 C ATOM 564 CG2 VAL A 37 11.305 4.783 9.674 1.00 0.00 C ATOM 0 H VAL A 37 13.850 2.807 8.693 1.00 0.00 H new ATOM 0 HA VAL A 37 14.621 5.416 9.818 1.00 0.00 H new ATOM 0 HB VAL A 37 12.658 6.397 9.329 1.00 0.00 H new ATOM 0 HG11 VAL A 37 11.672 5.684 7.166 1.00 0.00 H new ATOM 0 HG12 VAL A 37 13.451 5.663 7.133 1.00 0.00 H new ATOM 0 HG13 VAL A 37 12.547 4.139 7.295 1.00 0.00 H new ATOM 0 HG21 VAL A 37 10.449 5.288 9.227 1.00 0.00 H new ATOM 0 HG22 VAL A 37 11.242 3.714 9.473 1.00 0.00 H new ATOM 0 HG23 VAL A 37 11.303 4.950 10.751 1.00 0.00 H new ATOM 574 N SER A 38 12.991 4.856 11.936 1.00 0.00 N ATOM 575 CA SER A 38 12.607 4.387 13.263 1.00 0.00 C ATOM 576 C SER A 38 11.694 3.161 13.177 1.00 0.00 C ATOM 577 O SER A 38 12.157 2.026 13.286 1.00 0.00 O ATOM 578 CB SER A 38 11.916 5.507 14.043 1.00 0.00 C ATOM 579 OG SER A 38 12.833 6.182 14.887 1.00 0.00 O ATOM 0 H SER A 38 12.834 5.852 11.780 1.00 0.00 H new ATOM 0 HA SER A 38 13.515 4.095 13.790 1.00 0.00 H new ATOM 0 HB2 SER A 38 11.468 6.216 13.347 1.00 0.00 H new ATOM 0 HB3 SER A 38 11.105 5.091 14.641 1.00 0.00 H new ATOM 0 HG SER A 38 12.367 6.894 15.373 1.00 0.00 H new ATOM 585 N GLU A 39 10.397 3.396 12.987 1.00 0.00 N ATOM 586 CA GLU A 39 9.427 2.305 12.896 1.00 0.00 C ATOM 587 C GLU A 39 8.262 2.648 11.959 1.00 0.00 C ATOM 588 O GLU A 39 7.516 1.763 11.540 1.00 0.00 O ATOM 589 CB GLU A 39 8.888 1.957 14.283 1.00 0.00 C ATOM 590 CG GLU A 39 8.092 0.664 14.316 1.00 0.00 C ATOM 591 CD GLU A 39 6.890 0.742 15.238 1.00 0.00 C ATOM 592 OE1 GLU A 39 6.143 1.741 15.156 1.00 0.00 O ATOM 593 OE2 GLU A 39 6.698 -0.193 16.041 1.00 0.00 O ATOM 0 H GLU A 39 9.994 4.328 12.893 1.00 0.00 H new ATOM 0 HA GLU A 39 9.949 1.443 12.479 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.723 1.878 14.979 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.256 2.773 14.634 1.00 0.00 H new ATOM 0 HG2 GLU A 39 7.756 0.422 13.307 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.741 -0.150 14.639 1.00 0.00 H new ATOM 600 N SER A 40 8.100 3.934 11.649 1.00 0.00 N ATOM 601 CA SER A 40 7.017 4.398 10.781 1.00 0.00 C ATOM 602 C SER A 40 6.803 3.495 9.563 1.00 0.00 C ATOM 603 O SER A 40 5.671 3.141 9.243 1.00 0.00 O ATOM 604 CB SER A 40 7.299 5.828 10.316 1.00 0.00 C ATOM 605 OG SER A 40 7.907 6.590 11.345 1.00 0.00 O ATOM 0 H SER A 40 8.710 4.678 11.989 1.00 0.00 H new ATOM 0 HA SER A 40 6.102 4.365 11.372 1.00 0.00 H new ATOM 0 HB2 SER A 40 7.950 5.807 9.442 1.00 0.00 H new ATOM 0 HB3 SER A 40 6.368 6.304 10.009 1.00 0.00 H new ATOM 0 HG SER A 40 8.078 7.499 11.021 1.00 0.00 H new ATOM 611 N GLN A 41 7.885 3.140 8.875 1.00 0.00 N ATOM 612 CA GLN A 41 7.785 2.296 7.681 1.00 0.00 C ATOM 613 C GLN A 41 6.994 1.024 7.942 1.00 0.00 C ATOM 614 O GLN A 41 6.392 0.459 7.028 1.00 0.00 O ATOM 615 CB GLN A 41 9.166 1.928 7.152 1.00 0.00 C ATOM 616 CG GLN A 41 10.174 1.534 8.220 1.00 0.00 C ATOM 617 CD GLN A 41 9.699 0.390 9.086 1.00 0.00 C ATOM 618 OE1 GLN A 41 9.316 -0.669 8.588 1.00 0.00 O ATOM 619 NE2 GLN A 41 9.722 0.604 10.391 1.00 0.00 N ATOM 0 H GLN A 41 8.835 3.419 9.119 1.00 0.00 H new ATOM 0 HA GLN A 41 7.253 2.884 6.933 1.00 0.00 H new ATOM 0 HB2 GLN A 41 9.062 1.102 6.448 1.00 0.00 H new ATOM 0 HB3 GLN A 41 9.563 2.775 6.593 1.00 0.00 H new ATOM 0 HG2 GLN A 41 11.112 1.255 7.741 1.00 0.00 H new ATOM 0 HG3 GLN A 41 10.383 2.398 8.851 1.00 0.00 H new ATOM 0 HE21 GLN A 41 10.048 1.499 10.755 1.00 0.00 H new ATOM 0 HE22 GLN A 41 9.413 -0.126 11.033 1.00 0.00 H new ATOM 628 N LEU A 42 7.006 0.567 9.182 1.00 0.00 N ATOM 629 CA LEU A 42 6.296 -0.651 9.540 1.00 0.00 C ATOM 630 C LEU A 42 4.821 -0.369 9.771 1.00 0.00 C ATOM 631 O LEU A 42 3.961 -1.154 9.380 1.00 0.00 O ATOM 632 CB LEU A 42 6.913 -1.283 10.789 1.00 0.00 C ATOM 633 CG LEU A 42 6.319 -2.635 11.187 1.00 0.00 C ATOM 634 CD1 LEU A 42 7.105 -3.770 10.550 1.00 0.00 C ATOM 635 CD2 LEU A 42 6.296 -2.783 12.701 1.00 0.00 C ATOM 0 H LEU A 42 7.496 1.017 9.955 1.00 0.00 H new ATOM 0 HA LEU A 42 6.387 -1.352 8.710 1.00 0.00 H new ATOM 0 HB2 LEU A 42 7.983 -1.407 10.625 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.797 -0.592 11.624 1.00 0.00 H new ATOM 0 HG LEU A 42 5.293 -2.681 10.823 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.669 -4.725 10.844 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.069 -3.673 9.465 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.142 -3.727 10.884 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.870 -3.751 12.966 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.313 -2.716 13.089 1.00 0.00 H new ATOM 0 HD23 LEU A 42 5.689 -1.989 13.135 1.00 0.00 H new ATOM 647 N ALA A 43 4.537 0.757 10.408 1.00 0.00 N ATOM 648 CA ALA A 43 3.165 1.144 10.691 1.00 0.00 C ATOM 649 C ALA A 43 2.523 1.836 9.493 1.00 0.00 C ATOM 650 O ALA A 43 1.298 1.882 9.379 1.00 0.00 O ATOM 651 CB ALA A 43 3.118 2.045 11.912 1.00 0.00 C ATOM 0 H ALA A 43 5.240 1.419 10.739 1.00 0.00 H new ATOM 0 HA ALA A 43 2.594 0.238 10.895 1.00 0.00 H new ATOM 0 HB1 ALA A 43 2.085 2.329 12.115 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.524 1.513 12.772 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.711 2.941 11.726 1.00 0.00 H new ATOM 657 N GLN A 44 3.349 2.373 8.598 1.00 0.00 N ATOM 658 CA GLN A 44 2.842 3.055 7.415 1.00 0.00 C ATOM 659 C GLN A 44 2.229 2.054 6.441 1.00 0.00 C ATOM 660 O GLN A 44 1.106 2.236 5.971 1.00 0.00 O ATOM 661 CB GLN A 44 3.963 3.834 6.726 1.00 0.00 C ATOM 662 CG GLN A 44 3.469 5.009 5.898 1.00 0.00 C ATOM 663 CD GLN A 44 2.891 6.121 6.752 1.00 0.00 C ATOM 664 OE1 GLN A 44 1.674 6.260 6.870 1.00 0.00 O ATOM 665 NE2 GLN A 44 3.765 6.921 7.351 1.00 0.00 N ATOM 0 H GLN A 44 4.366 2.348 8.670 1.00 0.00 H new ATOM 0 HA GLN A 44 2.069 3.755 7.730 1.00 0.00 H new ATOM 0 HB2 GLN A 44 4.657 4.200 7.482 1.00 0.00 H new ATOM 0 HB3 GLN A 44 4.522 3.156 6.081 1.00 0.00 H new ATOM 0 HG2 GLN A 44 4.294 5.403 5.304 1.00 0.00 H new ATOM 0 HG3 GLN A 44 2.710 4.662 5.197 1.00 0.00 H new ATOM 0 HE21 GLN A 44 4.766 6.769 7.225 1.00 0.00 H new ATOM 0 HE22 GLN A 44 3.436 7.688 7.937 1.00 0.00 H new ATOM 674 N LEU A 45 2.978 0.998 6.146 1.00 0.00 N ATOM 675 CA LEU A 45 2.518 -0.038 5.231 1.00 0.00 C ATOM 676 C LEU A 45 1.547 -0.986 5.925 1.00 0.00 C ATOM 677 O LEU A 45 0.580 -1.453 5.322 1.00 0.00 O ATOM 678 CB LEU A 45 3.714 -0.813 4.683 1.00 0.00 C ATOM 679 CG LEU A 45 4.818 0.064 4.093 1.00 0.00 C ATOM 680 CD1 LEU A 45 6.052 -0.759 3.759 1.00 0.00 C ATOM 681 CD2 LEU A 45 4.309 0.803 2.867 1.00 0.00 C ATOM 0 H LEU A 45 3.910 0.837 6.529 1.00 0.00 H new ATOM 0 HA LEU A 45 1.991 0.439 4.405 1.00 0.00 H new ATOM 0 HB2 LEU A 45 4.137 -1.419 5.484 1.00 0.00 H new ATOM 0 HB3 LEU A 45 3.364 -1.502 3.914 1.00 0.00 H new ATOM 0 HG LEU A 45 5.106 0.800 4.843 1.00 0.00 H new ATOM 0 HD11 LEU A 45 6.821 -0.109 3.341 1.00 0.00 H new ATOM 0 HD12 LEU A 45 6.430 -1.232 4.665 1.00 0.00 H new ATOM 0 HD13 LEU A 45 5.791 -1.527 3.031 1.00 0.00 H new ATOM 0 HD21 LEU A 45 5.107 1.423 2.459 1.00 0.00 H new ATOM 0 HD22 LEU A 45 3.988 0.082 2.115 1.00 0.00 H new ATOM 0 HD23 LEU A 45 3.466 1.435 3.147 1.00 0.00 H new ATOM 692 N LYS A 46 1.809 -1.263 7.196 1.00 0.00 N ATOM 693 CA LYS A 46 0.958 -2.153 7.978 1.00 0.00 C ATOM 694 C LYS A 46 -0.414 -1.529 8.208 1.00 0.00 C ATOM 695 O LYS A 46 -1.411 -2.236 8.355 1.00 0.00 O ATOM 696 CB LYS A 46 1.613 -2.474 9.323 1.00 0.00 C ATOM 697 CG LYS A 46 0.813 -3.450 10.170 1.00 0.00 C ATOM 698 CD LYS A 46 1.719 -4.436 10.889 1.00 0.00 C ATOM 699 CE LYS A 46 1.118 -5.831 10.909 1.00 0.00 C ATOM 700 NZ LYS A 46 0.155 -6.006 12.032 1.00 0.00 N ATOM 0 H LYS A 46 2.605 -0.884 7.709 1.00 0.00 H new ATOM 0 HA LYS A 46 0.831 -3.077 7.414 1.00 0.00 H new ATOM 0 HB2 LYS A 46 2.605 -2.888 9.145 1.00 0.00 H new ATOM 0 HB3 LYS A 46 1.750 -1.548 9.882 1.00 0.00 H new ATOM 0 HG2 LYS A 46 0.221 -2.899 10.901 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.112 -3.994 9.536 1.00 0.00 H new ATOM 0 HD2 LYS A 46 2.691 -4.464 10.397 1.00 0.00 H new ATOM 0 HD3 LYS A 46 1.889 -4.097 11.911 1.00 0.00 H new ATOM 0 HE2 LYS A 46 0.611 -6.021 9.963 1.00 0.00 H new ATOM 0 HE3 LYS A 46 1.916 -6.569 10.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -0.232 -6.971 12.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 0.644 -5.850 12.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -0.620 -5.320 11.935 1.00 0.00 H new ATOM 714 N ALA A 47 -0.459 -0.199 8.237 1.00 0.00 N ATOM 715 CA ALA A 47 -1.711 0.521 8.449 1.00 0.00 C ATOM 716 C ALA A 47 -2.812 -0.004 7.533 1.00 0.00 C ATOM 717 O ALA A 47 -3.995 0.058 7.868 1.00 0.00 O ATOM 718 CB ALA A 47 -1.504 2.011 8.223 1.00 0.00 C ATOM 0 H ALA A 47 0.357 0.401 8.116 1.00 0.00 H new ATOM 0 HA ALA A 47 -2.025 0.357 9.480 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.445 2.538 8.384 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -0.755 2.384 8.921 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.164 2.180 7.201 1.00 0.00 H new ATOM 724 N ASP A 48 -2.414 -0.526 6.377 1.00 0.00 N ATOM 725 CA ASP A 48 -3.365 -1.066 5.414 1.00 0.00 C ATOM 726 C ASP A 48 -3.392 -2.590 5.477 1.00 0.00 C ATOM 727 O ASP A 48 -2.480 -3.255 4.985 1.00 0.00 O ATOM 728 CB ASP A 48 -3.006 -0.604 3.999 1.00 0.00 C ATOM 729 CG ASP A 48 -4.215 -0.123 3.219 1.00 0.00 C ATOM 730 OD1 ASP A 48 -5.342 -0.219 3.748 1.00 0.00 O ATOM 731 OD2 ASP A 48 -4.033 0.348 2.077 1.00 0.00 O ATOM 0 H ASP A 48 -1.439 -0.586 6.085 1.00 0.00 H new ATOM 0 HA ASP A 48 -4.357 -0.693 5.667 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.273 0.200 4.058 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -2.534 -1.426 3.461 1.00 0.00 H new ATOM 736 N PRO A 49 -4.442 -3.165 6.085 1.00 0.00 N ATOM 737 CA PRO A 49 -4.581 -4.617 6.208 1.00 0.00 C ATOM 738 C PRO A 49 -4.958 -5.275 4.885 1.00 0.00 C ATOM 739 O PRO A 49 -6.054 -5.816 4.737 1.00 0.00 O ATOM 740 CB PRO A 49 -5.707 -4.771 7.229 1.00 0.00 C ATOM 741 CG PRO A 49 -6.537 -3.549 7.054 1.00 0.00 C ATOM 742 CD PRO A 49 -5.577 -2.447 6.702 1.00 0.00 C ATOM 0 HA PRO A 49 -3.649 -5.099 6.505 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -6.288 -5.675 7.046 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -5.316 -4.843 8.244 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -7.277 -3.689 6.266 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -7.084 -3.314 7.967 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -6.023 -1.731 6.011 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -5.267 -1.888 7.584 1.00 0.00 H new ATOM 750 N ARG A 50 -4.042 -5.222 3.924 1.00 0.00 N ATOM 751 CA ARG A 50 -4.279 -5.808 2.610 1.00 0.00 C ATOM 752 C ARG A 50 -2.994 -6.386 2.020 1.00 0.00 C ATOM 753 O ARG A 50 -3.012 -7.446 1.394 1.00 0.00 O ATOM 754 CB ARG A 50 -4.862 -4.760 1.661 1.00 0.00 C ATOM 755 CG ARG A 50 -6.174 -4.164 2.147 1.00 0.00 C ATOM 756 CD ARG A 50 -5.947 -2.874 2.917 1.00 0.00 C ATOM 757 NE ARG A 50 -6.990 -1.887 2.649 1.00 0.00 N ATOM 758 CZ ARG A 50 -7.053 -1.158 1.538 1.00 0.00 C ATOM 759 NH1 ARG A 50 -6.136 -1.302 0.589 1.00 0.00 N ATOM 760 NH2 ARG A 50 -8.036 -0.284 1.373 1.00 0.00 N ATOM 0 H ARG A 50 -3.129 -4.780 4.030 1.00 0.00 H new ATOM 0 HA ARG A 50 -4.994 -6.622 2.731 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -4.136 -3.958 1.527 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -5.019 -5.215 0.683 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -6.825 -3.971 1.294 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -6.688 -4.884 2.784 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -5.917 -3.090 3.985 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -4.976 -2.458 2.649 1.00 0.00 H new ATOM 0 HE ARG A 50 -7.713 -1.749 3.355 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -5.378 -1.974 0.710 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -6.189 -0.741 -0.261 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -8.744 -0.170 2.098 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -8.084 0.275 0.521 1.00 0.00 H new ATOM 774 N LEU A 51 -1.880 -5.687 2.223 1.00 0.00 N ATOM 775 CA LEU A 51 -0.592 -6.141 1.708 1.00 0.00 C ATOM 776 C LEU A 51 0.249 -6.755 2.825 1.00 0.00 C ATOM 777 O LEU A 51 -0.259 -7.041 3.909 1.00 0.00 O ATOM 778 CB LEU A 51 0.165 -4.983 1.043 1.00 0.00 C ATOM 779 CG LEU A 51 -0.710 -3.908 0.390 1.00 0.00 C ATOM 780 CD1 LEU A 51 -1.839 -4.543 -0.409 1.00 0.00 C ATOM 781 CD2 LEU A 51 -1.261 -2.953 1.438 1.00 0.00 C ATOM 0 H LEU A 51 -1.843 -4.808 2.738 1.00 0.00 H new ATOM 0 HA LEU A 51 -0.778 -6.907 0.956 1.00 0.00 H new ATOM 0 HB2 LEU A 51 0.795 -4.506 1.794 1.00 0.00 H new ATOM 0 HB3 LEU A 51 0.830 -5.396 0.284 1.00 0.00 H new ATOM 0 HG LEU A 51 -0.088 -3.335 -0.298 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.447 -3.761 -0.864 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.420 -5.177 -1.190 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.459 -5.146 0.254 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -1.879 -2.198 0.953 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.864 -3.509 2.156 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -0.435 -2.467 1.957 1.00 0.00 H new ATOM 793 N VAL A 52 1.534 -6.969 2.553 1.00 0.00 N ATOM 794 CA VAL A 52 2.431 -7.567 3.537 1.00 0.00 C ATOM 795 C VAL A 52 3.691 -6.733 3.738 1.00 0.00 C ATOM 796 O VAL A 52 4.586 -6.725 2.892 1.00 0.00 O ATOM 797 CB VAL A 52 2.857 -8.981 3.113 1.00 0.00 C ATOM 798 CG1 VAL A 52 3.552 -9.708 4.254 1.00 0.00 C ATOM 799 CG2 VAL A 52 1.662 -9.778 2.609 1.00 0.00 C ATOM 0 H VAL A 52 1.976 -6.738 1.663 1.00 0.00 H new ATOM 0 HA VAL A 52 1.872 -7.609 4.472 1.00 0.00 H new ATOM 0 HB VAL A 52 3.570 -8.885 2.294 1.00 0.00 H new ATOM 0 HG11 VAL A 52 3.843 -10.706 3.926 1.00 0.00 H new ATOM 0 HG12 VAL A 52 4.440 -9.151 4.553 1.00 0.00 H new ATOM 0 HG13 VAL A 52 2.872 -9.788 5.102 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.988 -10.776 2.315 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.918 -9.859 3.402 1.00 0.00 H new ATOM 0 HG23 VAL A 52 1.223 -9.271 1.749 1.00 0.00 H new ATOM 809 N VAL A 53 3.765 -6.057 4.875 1.00 0.00 N ATOM 810 CA VAL A 53 4.929 -5.242 5.209 1.00 0.00 C ATOM 811 C VAL A 53 5.801 -5.966 6.228 1.00 0.00 C ATOM 812 O VAL A 53 5.404 -6.163 7.376 1.00 0.00 O ATOM 813 CB VAL A 53 4.520 -3.856 5.753 1.00 0.00 C ATOM 814 CG1 VAL A 53 3.378 -3.980 6.750 1.00 0.00 C ATOM 815 CG2 VAL A 53 5.705 -3.129 6.380 1.00 0.00 C ATOM 0 H VAL A 53 3.032 -6.055 5.585 1.00 0.00 H new ATOM 0 HA VAL A 53 5.497 -5.085 4.292 1.00 0.00 H new ATOM 0 HB VAL A 53 4.175 -3.261 4.907 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.108 -2.990 7.119 1.00 0.00 H new ATOM 0 HG12 VAL A 53 2.516 -4.433 6.261 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.691 -4.606 7.586 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.380 -2.157 6.752 1.00 0.00 H new ATOM 0 HG22 VAL A 53 6.099 -3.721 7.206 1.00 0.00 H new ATOM 0 HG23 VAL A 53 6.484 -2.989 5.630 1.00 0.00 H new ATOM 825 N GLN A 54 6.983 -6.375 5.788 1.00 0.00 N ATOM 826 CA GLN A 54 7.914 -7.101 6.650 1.00 0.00 C ATOM 827 C GLN A 54 9.293 -6.449 6.659 1.00 0.00 C ATOM 828 O GLN A 54 9.750 -5.921 5.646 1.00 0.00 O ATOM 829 CB GLN A 54 8.030 -8.558 6.193 1.00 0.00 C ATOM 830 CG GLN A 54 7.931 -9.561 7.330 1.00 0.00 C ATOM 831 CD GLN A 54 6.525 -10.099 7.512 1.00 0.00 C ATOM 832 OE1 GLN A 54 6.291 -11.303 7.414 1.00 0.00 O ATOM 833 NE2 GLN A 54 5.579 -9.205 7.778 1.00 0.00 N ATOM 0 H GLN A 54 7.323 -6.218 4.839 1.00 0.00 H new ATOM 0 HA GLN A 54 7.519 -7.070 7.666 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.244 -8.766 5.467 1.00 0.00 H new ATOM 0 HB3 GLN A 54 8.982 -8.695 5.681 1.00 0.00 H new ATOM 0 HG2 GLN A 54 8.611 -10.391 7.138 1.00 0.00 H new ATOM 0 HG3 GLN A 54 8.258 -9.088 8.256 1.00 0.00 H new ATOM 0 HE21 GLN A 54 5.818 -8.216 7.850 1.00 0.00 H new ATOM 0 HE22 GLN A 54 4.614 -9.508 7.910 1.00 0.00 H new ATOM 842 N ILE A 55 9.953 -6.495 7.815 1.00 0.00 N ATOM 843 CA ILE A 55 11.284 -5.913 7.961 1.00 0.00 C ATOM 844 C ILE A 55 12.362 -6.996 7.972 1.00 0.00 C ATOM 845 O ILE A 55 12.279 -7.962 8.730 1.00 0.00 O ATOM 846 CB ILE A 55 11.398 -5.043 9.242 1.00 0.00 C ATOM 847 CG1 ILE A 55 11.641 -5.904 10.487 1.00 0.00 C ATOM 848 CG2 ILE A 55 10.146 -4.193 9.429 1.00 0.00 C ATOM 849 CD1 ILE A 55 10.518 -6.870 10.791 1.00 0.00 C ATOM 0 H ILE A 55 9.587 -6.929 8.663 1.00 0.00 H new ATOM 0 HA ILE A 55 11.441 -5.267 7.097 1.00 0.00 H new ATOM 0 HB ILE A 55 12.257 -4.384 9.114 1.00 0.00 H new ATOM 0 HG12 ILE A 55 12.565 -6.466 10.353 1.00 0.00 H new ATOM 0 HG13 ILE A 55 11.787 -5.250 11.347 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.246 -3.591 10.332 1.00 0.00 H new ATOM 0 HG22 ILE A 55 10.020 -3.537 8.568 1.00 0.00 H new ATOM 0 HG23 ILE A 55 9.276 -4.843 9.521 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.763 -7.443 11.685 1.00 0.00 H new ATOM 0 HD12 ILE A 55 9.595 -6.314 10.958 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.385 -7.550 9.949 1.00 0.00 H new ATOM 861 N THR A 56 13.373 -6.825 7.126 1.00 0.00 N ATOM 862 CA THR A 56 14.467 -7.784 7.038 1.00 0.00 C ATOM 863 C THR A 56 15.805 -7.104 7.306 1.00 0.00 C ATOM 864 O THR A 56 16.331 -6.389 6.454 1.00 0.00 O ATOM 865 CB THR A 56 14.485 -8.447 5.660 1.00 0.00 C ATOM 866 OG1 THR A 56 14.583 -7.473 4.636 1.00 0.00 O ATOM 867 CG2 THR A 56 13.255 -9.283 5.383 1.00 0.00 C ATOM 0 H THR A 56 13.457 -6.031 6.492 1.00 0.00 H new ATOM 0 HA THR A 56 14.309 -8.550 7.797 1.00 0.00 H new ATOM 0 HB THR A 56 15.356 -9.102 5.666 1.00 0.00 H new ATOM 0 HG1 THR A 56 15.247 -6.798 4.889 1.00 0.00 H new ATOM 0 HG21 THR A 56 13.332 -9.725 4.389 1.00 0.00 H new ATOM 0 HG22 THR A 56 13.178 -10.075 6.128 1.00 0.00 H new ATOM 0 HG23 THR A 56 12.368 -8.652 5.432 1.00 0.00 H new ATOM 875 N GLU A 57 16.350 -7.334 8.494 1.00 0.00 N ATOM 876 CA GLU A 57 17.628 -6.745 8.877 1.00 0.00 C ATOM 877 C GLU A 57 18.775 -7.711 8.597 1.00 0.00 C ATOM 878 O GLU A 57 19.281 -8.368 9.507 1.00 0.00 O ATOM 879 CB GLU A 57 17.614 -6.363 10.357 1.00 0.00 C ATOM 880 CG GLU A 57 16.965 -5.016 10.631 1.00 0.00 C ATOM 881 CD GLU A 57 17.549 -4.325 11.848 1.00 0.00 C ATOM 882 OE1 GLU A 57 17.248 -4.762 12.979 1.00 0.00 O ATOM 883 OE2 GLU A 57 18.304 -3.347 11.671 1.00 0.00 O ATOM 0 H GLU A 57 15.927 -7.925 9.210 1.00 0.00 H new ATOM 0 HA GLU A 57 17.781 -5.846 8.280 1.00 0.00 H new ATOM 0 HB2 GLU A 57 17.084 -7.133 10.918 1.00 0.00 H new ATOM 0 HB3 GLU A 57 18.638 -6.346 10.729 1.00 0.00 H new ATOM 0 HG2 GLU A 57 17.088 -4.374 9.759 1.00 0.00 H new ATOM 0 HG3 GLU A 57 15.894 -5.156 10.776 1.00 0.00 H new ATOM 890 N THR A 58 19.178 -7.792 7.335 1.00 0.00 N ATOM 891 CA THR A 58 20.266 -8.678 6.935 1.00 0.00 C ATOM 892 C THR A 58 21.485 -7.878 6.490 1.00 0.00 C ATOM 893 O THR A 58 21.470 -6.647 6.501 1.00 0.00 O ATOM 894 CB THR A 58 19.809 -9.607 5.807 1.00 0.00 C ATOM 895 OG1 THR A 58 18.396 -9.603 5.693 1.00 0.00 O ATOM 896 CG2 THR A 58 20.248 -11.041 5.999 1.00 0.00 C ATOM 0 H THR A 58 18.768 -7.255 6.570 1.00 0.00 H new ATOM 0 HA THR A 58 20.546 -9.280 7.799 1.00 0.00 H new ATOM 0 HB THR A 58 20.279 -9.217 4.904 1.00 0.00 H new ATOM 0 HG1 THR A 58 18.125 -10.201 4.966 1.00 0.00 H new ATOM 0 HG21 THR A 58 19.891 -11.645 5.165 1.00 0.00 H new ATOM 0 HG22 THR A 58 21.336 -11.086 6.040 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.833 -11.427 6.930 1.00 0.00 H new ATOM 904 N GLY A 59 22.540 -8.587 6.099 1.00 0.00 N ATOM 905 CA GLY A 59 23.753 -7.926 5.657 1.00 0.00 C ATOM 906 C GLY A 59 25.000 -8.719 5.999 1.00 0.00 C ATOM 907 O GLY A 59 25.021 -9.943 5.865 1.00 0.00 O ATOM 0 H GLY A 59 22.576 -9.606 6.081 1.00 0.00 H new ATOM 0 HA2 GLY A 59 23.708 -7.772 4.579 1.00 0.00 H new ATOM 0 HA3 GLY A 59 23.815 -6.940 6.117 1.00 0.00 H new ATOM 911 N SER A 60 26.040 -8.020 6.439 1.00 0.00 N ATOM 912 CA SER A 60 27.297 -8.665 6.802 1.00 0.00 C ATOM 913 C SER A 60 27.270 -9.130 8.255 1.00 0.00 C ATOM 914 O SER A 60 26.537 -8.581 9.079 1.00 0.00 O ATOM 915 CB SER A 60 28.468 -7.707 6.581 1.00 0.00 C ATOM 916 OG SER A 60 29.018 -7.864 5.285 1.00 0.00 O ATOM 0 H SER A 60 26.038 -7.006 6.553 1.00 0.00 H new ATOM 0 HA SER A 60 27.427 -9.538 6.163 1.00 0.00 H new ATOM 0 HB2 SER A 60 28.131 -6.679 6.714 1.00 0.00 H new ATOM 0 HB3 SER A 60 29.238 -7.890 7.331 1.00 0.00 H new ATOM 0 HG SER A 60 29.764 -7.239 5.168 1.00 0.00 H new ATOM 922 N GLN A 61 28.073 -10.144 8.562 1.00 0.00 N ATOM 923 CA GLN A 61 28.141 -10.682 9.915 1.00 0.00 C ATOM 924 C GLN A 61 28.811 -9.692 10.862 1.00 0.00 C ATOM 925 O GLN A 61 29.987 -9.839 11.201 1.00 0.00 O ATOM 926 CB GLN A 61 28.904 -12.009 9.922 1.00 0.00 C ATOM 927 CG GLN A 61 28.217 -13.109 9.128 1.00 0.00 C ATOM 928 CD GLN A 61 28.880 -13.360 7.787 1.00 0.00 C ATOM 929 OE1 GLN A 61 30.038 -12.998 7.576 1.00 0.00 O ATOM 930 NE2 GLN A 61 28.146 -13.983 6.872 1.00 0.00 N ATOM 0 H GLN A 61 28.685 -10.609 7.892 1.00 0.00 H new ATOM 0 HA GLN A 61 27.122 -10.855 10.261 1.00 0.00 H new ATOM 0 HB2 GLN A 61 29.902 -11.847 9.515 1.00 0.00 H new ATOM 0 HB3 GLN A 61 29.030 -12.341 10.953 1.00 0.00 H new ATOM 0 HG2 GLN A 61 28.223 -14.030 9.710 1.00 0.00 H new ATOM 0 HG3 GLN A 61 27.173 -12.839 8.968 1.00 0.00 H new ATOM 0 HE21 GLN A 61 27.190 -14.265 7.090 1.00 0.00 H new ATOM 0 HE22 GLN A 61 28.538 -14.179 5.951 1.00 0.00 H new ATOM 939 N GLU A 62 28.058 -8.683 11.286 1.00 0.00 N ATOM 940 CA GLU A 62 28.580 -7.668 12.194 1.00 0.00 C ATOM 941 C GLU A 62 28.578 -8.171 13.634 1.00 0.00 C ATOM 942 O GLU A 62 27.706 -8.945 14.031 1.00 0.00 O ATOM 943 CB GLU A 62 27.751 -6.386 12.089 1.00 0.00 C ATOM 944 CG GLU A 62 28.391 -5.191 12.776 1.00 0.00 C ATOM 945 CD GLU A 62 27.614 -4.734 13.995 1.00 0.00 C ATOM 946 OE1 GLU A 62 26.377 -4.594 13.894 1.00 0.00 O ATOM 947 OE2 GLU A 62 28.243 -4.516 15.053 1.00 0.00 O ATOM 0 H GLU A 62 27.084 -8.546 11.016 1.00 0.00 H new ATOM 0 HA GLU A 62 29.609 -7.453 11.905 1.00 0.00 H new ATOM 0 HB2 GLU A 62 27.595 -6.149 11.037 1.00 0.00 H new ATOM 0 HB3 GLU A 62 26.768 -6.562 12.525 1.00 0.00 H new ATOM 0 HG2 GLU A 62 29.407 -5.449 13.073 1.00 0.00 H new ATOM 0 HG3 GLU A 62 28.466 -4.366 12.067 1.00 0.00 H new ATOM 954 N GLY A 63 29.559 -7.727 14.413 1.00 0.00 N ATOM 955 CA GLY A 63 29.652 -8.143 15.800 1.00 0.00 C ATOM 956 C GLY A 63 30.339 -9.485 15.958 1.00 0.00 C ATOM 957 O GLY A 63 31.179 -9.861 15.140 1.00 0.00 O ATOM 0 H GLY A 63 30.292 -7.086 14.108 1.00 0.00 H new ATOM 0 HA2 GLY A 63 30.199 -7.389 16.366 1.00 0.00 H new ATOM 0 HA3 GLY A 63 28.651 -8.198 16.227 1.00 0.00 H new ATOM 961 N GLY A 64 29.981 -10.210 17.013 1.00 0.00 N ATOM 962 CA GLY A 64 30.578 -11.509 17.257 1.00 0.00 C ATOM 963 C GLY A 64 29.657 -12.435 18.027 1.00 0.00 C ATOM 964 O GLY A 64 29.221 -13.462 17.505 1.00 0.00 O ATOM 0 H GLY A 64 29.288 -9.920 17.703 1.00 0.00 H new ATOM 0 HA2 GLY A 64 30.839 -11.970 16.304 1.00 0.00 H new ATOM 0 HA3 GLY A 64 31.506 -11.380 17.813 1.00 0.00 H new ATOM 968 N GLU A 65 29.361 -12.072 19.270 1.00 0.00 N ATOM 969 CA GLU A 65 28.485 -12.876 20.114 1.00 0.00 C ATOM 970 C GLU A 65 27.301 -12.053 20.610 1.00 0.00 C ATOM 971 O GLU A 65 27.475 -11.040 21.284 1.00 0.00 O ATOM 972 CB GLU A 65 29.266 -13.436 21.304 1.00 0.00 C ATOM 973 CG GLU A 65 30.211 -14.566 20.934 1.00 0.00 C ATOM 974 CD GLU A 65 29.490 -15.885 20.732 1.00 0.00 C ATOM 975 OE1 GLU A 65 28.766 -16.019 19.724 1.00 0.00 O ATOM 976 OE2 GLU A 65 29.651 -16.785 21.584 1.00 0.00 O ATOM 0 H GLU A 65 29.715 -11.226 19.716 1.00 0.00 H new ATOM 0 HA GLU A 65 28.103 -13.703 19.516 1.00 0.00 H new ATOM 0 HB2 GLU A 65 29.839 -12.630 21.763 1.00 0.00 H new ATOM 0 HB3 GLU A 65 28.561 -13.794 22.054 1.00 0.00 H new ATOM 0 HG2 GLU A 65 30.745 -14.304 20.021 1.00 0.00 H new ATOM 0 HG3 GLU A 65 30.959 -14.681 21.718 1.00 0.00 H new ATOM 983 N GLY A 66 26.095 -12.498 20.270 1.00 0.00 N ATOM 984 CA GLY A 66 24.899 -11.790 20.689 1.00 0.00 C ATOM 985 C GLY A 66 23.737 -12.006 19.740 1.00 0.00 C ATOM 986 O GLY A 66 22.807 -12.753 20.045 1.00 0.00 O ATOM 0 H GLY A 66 25.925 -13.335 19.713 1.00 0.00 H new ATOM 0 HA2 GLY A 66 24.615 -12.121 21.688 1.00 0.00 H new ATOM 0 HA3 GLY A 66 25.116 -10.724 20.756 1.00 0.00 H new ATOM 990 N LEU A 67 23.789 -11.349 18.585 1.00 0.00 N ATOM 991 CA LEU A 67 22.732 -11.471 17.588 1.00 0.00 C ATOM 992 C LEU A 67 22.917 -12.733 16.753 1.00 0.00 C ATOM 993 O LEU A 67 23.953 -12.920 16.114 1.00 0.00 O ATOM 994 CB LEU A 67 22.714 -10.241 16.679 1.00 0.00 C ATOM 995 CG LEU A 67 22.145 -8.972 17.318 1.00 0.00 C ATOM 996 CD1 LEU A 67 23.268 -8.072 17.809 1.00 0.00 C ATOM 997 CD2 LEU A 67 21.258 -8.228 16.331 1.00 0.00 C ATOM 0 H LEU A 67 24.552 -10.727 18.317 1.00 0.00 H new ATOM 0 HA LEU A 67 21.778 -11.540 18.112 1.00 0.00 H new ATOM 0 HB2 LEU A 67 23.732 -10.038 16.348 1.00 0.00 H new ATOM 0 HB3 LEU A 67 22.130 -10.474 15.789 1.00 0.00 H new ATOM 0 HG LEU A 67 21.537 -9.262 18.175 1.00 0.00 H new ATOM 0 HD11 LEU A 67 22.844 -7.175 18.260 1.00 0.00 H new ATOM 0 HD12 LEU A 67 23.863 -8.605 18.551 1.00 0.00 H new ATOM 0 HD13 LEU A 67 23.902 -7.790 16.969 1.00 0.00 H new ATOM 0 HD21 LEU A 67 20.863 -7.329 16.803 1.00 0.00 H new ATOM 0 HD22 LEU A 67 21.843 -7.950 15.454 1.00 0.00 H new ATOM 0 HD23 LEU A 67 20.432 -8.871 16.027 1.00 0.00 H new ATOM 1009 N SER A 68 21.907 -13.597 16.760 1.00 0.00 N ATOM 1010 CA SER A 68 21.960 -14.841 16.002 1.00 0.00 C ATOM 1011 C SER A 68 20.556 -15.363 15.711 1.00 0.00 C ATOM 1012 O SER A 68 19.686 -15.351 16.581 1.00 0.00 O ATOM 1013 CB SER A 68 22.759 -15.896 16.768 1.00 0.00 C ATOM 1014 OG SER A 68 23.327 -16.847 15.884 1.00 0.00 O ATOM 0 H SER A 68 21.042 -13.458 17.282 1.00 0.00 H new ATOM 0 HA SER A 68 22.456 -14.637 15.053 1.00 0.00 H new ATOM 0 HB2 SER A 68 23.549 -15.412 17.343 1.00 0.00 H new ATOM 0 HB3 SER A 68 22.109 -16.401 17.482 1.00 0.00 H new ATOM 0 HG SER A 68 23.834 -17.510 16.398 1.00 0.00 H new ATOM 1020 N LYS A 69 20.345 -15.821 14.482 1.00 0.00 N ATOM 1021 CA LYS A 69 19.049 -16.350 14.074 1.00 0.00 C ATOM 1022 C LYS A 69 17.963 -15.286 14.197 1.00 0.00 C ATOM 1023 O LYS A 69 17.482 -15.000 15.293 1.00 0.00 O ATOM 1024 CB LYS A 69 18.681 -17.570 14.921 1.00 0.00 C ATOM 1025 CG LYS A 69 19.442 -18.829 14.537 1.00 0.00 C ATOM 1026 CD LYS A 69 18.536 -20.050 14.540 1.00 0.00 C ATOM 1027 CE LYS A 69 17.584 -20.040 13.356 1.00 0.00 C ATOM 1028 NZ LYS A 69 17.087 -21.405 13.031 1.00 0.00 N ATOM 0 H LYS A 69 21.056 -15.837 13.750 1.00 0.00 H new ATOM 0 HA LYS A 69 19.122 -16.651 13.029 1.00 0.00 H new ATOM 0 HB2 LYS A 69 18.873 -17.345 15.970 1.00 0.00 H new ATOM 0 HB3 LYS A 69 17.612 -17.759 14.826 1.00 0.00 H new ATOM 0 HG2 LYS A 69 19.881 -18.703 13.547 1.00 0.00 H new ATOM 0 HG3 LYS A 69 20.266 -18.984 15.234 1.00 0.00 H new ATOM 0 HD2 LYS A 69 19.143 -20.955 14.512 1.00 0.00 H new ATOM 0 HD3 LYS A 69 17.964 -20.078 15.468 1.00 0.00 H new ATOM 0 HE2 LYS A 69 16.738 -19.389 13.576 1.00 0.00 H new ATOM 0 HE3 LYS A 69 18.091 -19.622 12.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 16.441 -21.355 12.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 17.892 -22.021 12.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 16.581 -21.795 13.852 1.00 0.00 H new ATOM 1042 N GLU A 70 17.577 -14.707 13.063 1.00 0.00 N ATOM 1043 CA GLU A 70 16.541 -13.677 13.041 1.00 0.00 C ATOM 1044 C GLU A 70 15.865 -13.591 11.670 1.00 0.00 C ATOM 1045 O GLU A 70 14.639 -13.659 11.580 1.00 0.00 O ATOM 1046 CB GLU A 70 17.114 -12.310 13.430 1.00 0.00 C ATOM 1047 CG GLU A 70 18.089 -12.359 14.595 1.00 0.00 C ATOM 1048 CD GLU A 70 18.608 -10.988 14.980 1.00 0.00 C ATOM 1049 OE1 GLU A 70 19.454 -10.444 14.239 1.00 0.00 O ATOM 1050 OE2 GLU A 70 18.169 -10.458 16.021 1.00 0.00 O ATOM 0 H GLU A 70 17.966 -14.933 12.147 1.00 0.00 H new ATOM 0 HA GLU A 70 15.788 -13.962 13.776 1.00 0.00 H new ATOM 0 HB2 GLU A 70 17.618 -11.879 12.565 1.00 0.00 H new ATOM 0 HB3 GLU A 70 16.292 -11.642 13.685 1.00 0.00 H new ATOM 0 HG2 GLU A 70 17.598 -12.812 15.456 1.00 0.00 H new ATOM 0 HG3 GLU A 70 18.930 -13.001 14.333 1.00 0.00 H new ATOM 1057 N PRO A 71 16.642 -13.437 10.577 1.00 0.00 N ATOM 1058 CA PRO A 71 16.079 -13.343 9.225 1.00 0.00 C ATOM 1059 C PRO A 71 15.329 -14.608 8.823 1.00 0.00 C ATOM 1060 O PRO A 71 15.290 -15.583 9.573 1.00 0.00 O ATOM 1061 CB PRO A 71 17.307 -13.140 8.327 1.00 0.00 C ATOM 1062 CG PRO A 71 18.384 -12.674 9.245 1.00 0.00 C ATOM 1063 CD PRO A 71 18.113 -13.341 10.560 1.00 0.00 C ATOM 0 HA PRO A 71 15.348 -12.538 9.148 1.00 0.00 H new ATOM 0 HB2 PRO A 71 17.588 -14.067 7.827 1.00 0.00 H new ATOM 0 HB3 PRO A 71 17.108 -12.405 7.547 1.00 0.00 H new ATOM 0 HG2 PRO A 71 19.368 -12.946 8.864 1.00 0.00 H new ATOM 0 HG3 PRO A 71 18.370 -11.589 9.346 1.00 0.00 H new ATOM 0 HD2 PRO A 71 18.584 -14.322 10.621 1.00 0.00 H new ATOM 0 HD3 PRO A 71 18.490 -12.754 11.397 1.00 0.00 H new ATOM 1071 N ALA A 72 14.733 -14.584 7.636 1.00 0.00 N ATOM 1072 CA ALA A 72 13.982 -15.728 7.134 1.00 0.00 C ATOM 1073 C ALA A 72 12.809 -16.060 8.050 1.00 0.00 C ATOM 1074 O ALA A 72 12.409 -17.218 8.168 1.00 0.00 O ATOM 1075 CB ALA A 72 14.896 -16.936 6.985 1.00 0.00 C ATOM 0 H ALA A 72 14.756 -13.784 7.003 1.00 0.00 H new ATOM 0 HA ALA A 72 13.582 -15.466 6.155 1.00 0.00 H new ATOM 0 HB1 ALA A 72 14.322 -17.783 6.609 1.00 0.00 H new ATOM 0 HB2 ALA A 72 15.697 -16.702 6.284 1.00 0.00 H new ATOM 0 HB3 ALA A 72 15.324 -17.190 7.955 1.00 0.00 H new ATOM 1081 N GLY A 73 12.265 -15.037 8.698 1.00 0.00 N ATOM 1082 CA GLY A 73 11.143 -15.240 9.597 1.00 0.00 C ATOM 1083 C GLY A 73 9.812 -15.252 8.870 1.00 0.00 C ATOM 1084 O GLY A 73 9.198 -14.206 8.668 1.00 0.00 O ATOM 0 H GLY A 73 12.580 -14.070 8.618 1.00 0.00 H new ATOM 0 HA2 GLY A 73 11.272 -16.184 10.127 1.00 0.00 H new ATOM 0 HA3 GLY A 73 11.136 -14.450 10.348 1.00 0.00 H new ATOM 1088 N SER A 74 9.367 -16.441 8.478 1.00 0.00 N ATOM 1089 CA SER A 74 8.100 -16.587 7.770 1.00 0.00 C ATOM 1090 C SER A 74 7.782 -18.058 7.526 1.00 0.00 C ATOM 1091 O SER A 74 6.649 -18.500 7.723 1.00 0.00 O ATOM 1092 CB SER A 74 8.146 -15.836 6.438 1.00 0.00 C ATOM 1093 OG SER A 74 9.457 -15.829 5.901 1.00 0.00 O ATOM 0 H SER A 74 9.864 -17.317 8.638 1.00 0.00 H new ATOM 0 HA SER A 74 7.313 -16.161 8.392 1.00 0.00 H new ATOM 0 HB2 SER A 74 7.462 -16.304 5.730 1.00 0.00 H new ATOM 0 HB3 SER A 74 7.804 -14.811 6.583 1.00 0.00 H new ATOM 0 HG SER A 74 9.459 -15.344 5.049 1.00 0.00 H new ATOM 1099 N ASP A 75 8.787 -18.814 7.097 1.00 0.00 N ATOM 1100 CA ASP A 75 8.614 -20.236 6.826 1.00 0.00 C ATOM 1101 C ASP A 75 9.360 -21.080 7.854 1.00 0.00 C ATOM 1102 O ASP A 75 8.927 -22.178 8.203 1.00 0.00 O ATOM 1103 CB ASP A 75 9.108 -20.573 5.418 1.00 0.00 C ATOM 1104 CG ASP A 75 8.633 -21.934 4.949 1.00 0.00 C ATOM 1105 OD1 ASP A 75 9.312 -22.938 5.254 1.00 0.00 O ATOM 1106 OD2 ASP A 75 7.583 -21.998 4.276 1.00 0.00 O ATOM 0 H ASP A 75 9.731 -18.465 6.929 1.00 0.00 H new ATOM 0 HA ASP A 75 7.551 -20.466 6.895 1.00 0.00 H new ATOM 0 HB2 ASP A 75 8.760 -19.810 4.722 1.00 0.00 H new ATOM 0 HB3 ASP A 75 10.198 -20.546 5.402 1.00 0.00 H new ATOM 1111 N GLU A 76 10.484 -20.560 8.337 1.00 0.00 N ATOM 1112 CA GLU A 76 11.291 -21.265 9.326 1.00 0.00 C ATOM 1113 C GLU A 76 10.659 -21.170 10.711 1.00 0.00 C ATOM 1114 O GLU A 76 10.404 -22.185 11.359 1.00 0.00 O ATOM 1115 CB GLU A 76 12.710 -20.696 9.358 1.00 0.00 C ATOM 1116 CG GLU A 76 13.679 -21.426 8.443 1.00 0.00 C ATOM 1117 CD GLU A 76 15.124 -21.256 8.870 1.00 0.00 C ATOM 1118 OE1 GLU A 76 15.514 -21.854 9.895 1.00 0.00 O ATOM 1119 OE2 GLU A 76 15.866 -20.525 8.180 1.00 0.00 O ATOM 0 H GLU A 76 10.857 -19.652 8.059 1.00 0.00 H new ATOM 0 HA GLU A 76 11.337 -22.316 9.039 1.00 0.00 H new ATOM 0 HB2 GLU A 76 12.677 -19.644 9.074 1.00 0.00 H new ATOM 0 HB3 GLU A 76 13.086 -20.738 10.380 1.00 0.00 H new ATOM 0 HG2 GLU A 76 13.430 -22.487 8.429 1.00 0.00 H new ATOM 0 HG3 GLU A 76 13.559 -21.057 7.424 1.00 0.00 H new ATOM 1126 N GLN A 77 10.408 -19.943 11.159 1.00 0.00 N ATOM 1127 CA GLN A 77 9.805 -19.716 12.467 1.00 0.00 C ATOM 1128 C GLN A 77 8.436 -20.381 12.558 1.00 0.00 C ATOM 1129 O GLN A 77 8.154 -21.118 13.501 1.00 0.00 O ATOM 1130 CB GLN A 77 9.680 -18.215 12.740 1.00 0.00 C ATOM 1131 CG GLN A 77 10.768 -17.670 13.650 1.00 0.00 C ATOM 1132 CD GLN A 77 10.819 -18.381 14.989 1.00 0.00 C ATOM 1133 OE1 GLN A 77 9.791 -18.797 15.523 1.00 0.00 O ATOM 1134 NE2 GLN A 77 12.021 -18.524 15.537 1.00 0.00 N ATOM 0 H GLN A 77 10.613 -19.092 10.635 1.00 0.00 H new ATOM 0 HA GLN A 77 10.453 -20.161 13.222 1.00 0.00 H new ATOM 0 HB2 GLN A 77 9.708 -17.678 11.792 1.00 0.00 H new ATOM 0 HB3 GLN A 77 8.708 -18.016 13.190 1.00 0.00 H new ATOM 0 HG2 GLN A 77 11.734 -17.767 13.154 1.00 0.00 H new ATOM 0 HG3 GLN A 77 10.600 -16.606 13.814 1.00 0.00 H new ATOM 0 HE21 GLN A 77 12.846 -18.163 15.058 1.00 0.00 H new ATOM 0 HE22 GLN A 77 12.119 -18.995 16.437 1.00 0.00 H new ATOM 1143 N LYS A 78 7.588 -20.116 11.569 1.00 0.00 N ATOM 1144 CA LYS A 78 6.247 -20.688 11.537 1.00 0.00 C ATOM 1145 C LYS A 78 6.270 -22.088 10.930 1.00 0.00 C ATOM 1146 O LYS A 78 6.951 -22.333 9.934 1.00 0.00 O ATOM 1147 CB LYS A 78 5.303 -19.787 10.739 1.00 0.00 C ATOM 1148 CG LYS A 78 4.550 -18.784 11.597 1.00 0.00 C ATOM 1149 CD LYS A 78 4.306 -17.483 10.849 1.00 0.00 C ATOM 1150 CE LYS A 78 3.098 -17.585 9.932 1.00 0.00 C ATOM 1151 NZ LYS A 78 3.313 -16.869 8.645 1.00 0.00 N ATOM 0 H LYS A 78 7.806 -19.509 10.779 1.00 0.00 H new ATOM 0 HA LYS A 78 5.884 -20.761 12.562 1.00 0.00 H new ATOM 0 HB2 LYS A 78 5.878 -19.249 9.986 1.00 0.00 H new ATOM 0 HB3 LYS A 78 4.584 -20.409 10.206 1.00 0.00 H new ATOM 0 HG2 LYS A 78 3.596 -19.212 11.906 1.00 0.00 H new ATOM 0 HG3 LYS A 78 5.118 -18.582 12.505 1.00 0.00 H new ATOM 0 HD2 LYS A 78 4.154 -16.674 11.564 1.00 0.00 H new ATOM 0 HD3 LYS A 78 5.189 -17.228 10.262 1.00 0.00 H new ATOM 0 HE2 LYS A 78 2.883 -18.635 9.731 1.00 0.00 H new ATOM 0 HE3 LYS A 78 2.224 -17.171 10.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 2.466 -16.963 8.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 3.493 -15.862 8.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 4.131 -17.280 8.151 1.00 0.00 H new ATOM 1165 N GLN A 79 5.521 -23.003 11.536 1.00 0.00 N ATOM 1166 CA GLN A 79 5.456 -24.378 11.055 1.00 0.00 C ATOM 1167 C GLN A 79 4.010 -24.857 10.966 1.00 0.00 C ATOM 1168 O GLN A 79 3.136 -24.358 11.674 1.00 0.00 O ATOM 1169 CB GLN A 79 6.255 -25.301 11.977 1.00 0.00 C ATOM 1170 CG GLN A 79 7.647 -24.781 12.301 1.00 0.00 C ATOM 1171 CD GLN A 79 8.412 -25.702 13.231 1.00 0.00 C ATOM 1172 OE1 GLN A 79 8.338 -26.925 13.113 1.00 0.00 O ATOM 1173 NE2 GLN A 79 9.152 -25.117 14.166 1.00 0.00 N ATOM 0 H GLN A 79 4.951 -22.817 12.361 1.00 0.00 H new ATOM 0 HA GLN A 79 5.891 -24.407 10.056 1.00 0.00 H new ATOM 0 HB2 GLN A 79 5.702 -25.439 12.906 1.00 0.00 H new ATOM 0 HB3 GLN A 79 6.342 -26.282 11.509 1.00 0.00 H new ATOM 0 HG2 GLN A 79 8.209 -24.657 11.375 1.00 0.00 H new ATOM 0 HG3 GLN A 79 7.565 -23.795 12.759 1.00 0.00 H new ATOM 0 HE21 GLN A 79 9.185 -24.099 14.228 1.00 0.00 H new ATOM 0 HE22 GLN A 79 9.688 -25.685 14.822 1.00 0.00 H new ATOM 1182 N LEU A 80 3.768 -25.828 10.092 1.00 0.00 N ATOM 1183 CA LEU A 80 2.429 -26.375 9.909 1.00 0.00 C ATOM 1184 C LEU A 80 2.228 -27.620 10.769 1.00 0.00 C ATOM 1185 O LEU A 80 1.269 -27.709 11.535 1.00 0.00 O ATOM 1186 CB LEU A 80 2.189 -26.714 8.436 1.00 0.00 C ATOM 1187 CG LEU A 80 1.630 -25.565 7.591 1.00 0.00 C ATOM 1188 CD1 LEU A 80 2.292 -25.538 6.221 1.00 0.00 C ATOM 1189 CD2 LEU A 80 0.121 -25.692 7.454 1.00 0.00 C ATOM 0 H LEU A 80 4.482 -26.252 9.499 1.00 0.00 H new ATOM 0 HA LEU A 80 1.709 -25.619 10.222 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.130 -27.044 7.996 1.00 0.00 H new ATOM 0 HB3 LEU A 80 1.499 -27.556 8.380 1.00 0.00 H new ATOM 0 HG LEU A 80 1.852 -24.625 8.096 1.00 0.00 H new ATOM 0 HD11 LEU A 80 1.882 -24.715 5.635 1.00 0.00 H new ATOM 0 HD12 LEU A 80 3.367 -25.399 6.339 1.00 0.00 H new ATOM 0 HD13 LEU A 80 2.102 -26.480 5.706 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -0.260 -24.868 6.851 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -0.122 -26.638 6.971 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -0.338 -25.661 8.442 1.00 0.00 H new ATOM 1201 N ARG A 81 3.140 -28.577 10.634 1.00 0.00 N ATOM 1202 CA ARG A 81 3.066 -29.818 11.399 1.00 0.00 C ATOM 1203 C ARG A 81 1.754 -30.548 11.125 1.00 0.00 C ATOM 1204 O ARG A 81 1.049 -30.949 12.052 1.00 0.00 O ATOM 1205 CB ARG A 81 3.203 -29.527 12.895 1.00 0.00 C ATOM 1206 CG ARG A 81 4.089 -30.521 13.628 1.00 0.00 C ATOM 1207 CD ARG A 81 4.127 -30.242 15.123 1.00 0.00 C ATOM 1208 NE ARG A 81 5.490 -30.025 15.605 1.00 0.00 N ATOM 1209 CZ ARG A 81 6.140 -28.867 15.499 1.00 0.00 C ATOM 1210 NH1 ARG A 81 5.556 -27.819 14.932 1.00 0.00 N ATOM 1211 NH2 ARG A 81 7.377 -28.757 15.962 1.00 0.00 N ATOM 0 H ARG A 81 3.939 -28.518 10.003 1.00 0.00 H new ATOM 0 HA ARG A 81 3.889 -30.461 11.086 1.00 0.00 H new ATOM 0 HB2 ARG A 81 3.610 -28.524 13.026 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.212 -29.531 13.350 1.00 0.00 H new ATOM 0 HG2 ARG A 81 3.722 -31.533 13.455 1.00 0.00 H new ATOM 0 HG3 ARG A 81 5.100 -30.476 13.223 1.00 0.00 H new ATOM 0 HD2 ARG A 81 3.520 -29.364 15.343 1.00 0.00 H new ATOM 0 HD3 ARG A 81 3.682 -31.080 15.660 1.00 0.00 H new ATOM 0 HE ARG A 81 5.972 -30.807 16.049 1.00 0.00 H new ATOM 0 HH11 ARG A 81 4.604 -27.897 14.574 1.00 0.00 H new ATOM 0 HH12 ARG A 81 6.059 -26.935 14.854 1.00 0.00 H new ATOM 0 HH21 ARG A 81 7.831 -29.559 16.399 1.00 0.00 H new ATOM 0 HH22 ARG A 81 7.875 -27.870 15.881 1.00 0.00 H new ATOM 1225 N ALA A 82 1.432 -30.719 9.847 1.00 0.00 N ATOM 1226 CA ALA A 82 0.205 -31.400 9.454 1.00 0.00 C ATOM 1227 C ALA A 82 0.336 -32.014 8.066 1.00 0.00 C ATOM 1228 O ALA A 82 0.359 -33.235 7.916 1.00 0.00 O ATOM 1229 CB ALA A 82 -0.970 -30.434 9.498 1.00 0.00 C ATOM 0 H ALA A 82 2.004 -30.395 9.067 1.00 0.00 H new ATOM 0 HA ALA A 82 0.025 -32.209 10.162 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -1.881 -30.955 9.202 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -1.086 -30.048 10.511 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -0.787 -29.607 8.813 1.00 0.00 H new ATOM 1235 N ASP A 83 0.420 -31.160 7.050 1.00 0.00 N ATOM 1236 CA ASP A 83 0.546 -31.622 5.673 1.00 0.00 C ATOM 1237 C ASP A 83 1.921 -32.243 5.424 1.00 0.00 C ATOM 1238 O ASP A 83 2.028 -33.439 5.155 1.00 0.00 O ATOM 1239 CB ASP A 83 0.305 -30.469 4.698 1.00 0.00 C ATOM 1240 CG ASP A 83 -1.152 -30.347 4.295 1.00 0.00 C ATOM 1241 OD1 ASP A 83 -1.904 -29.634 4.993 1.00 0.00 O ATOM 1242 OD2 ASP A 83 -1.542 -30.965 3.282 1.00 0.00 O ATOM 0 H ASP A 83 0.403 -30.146 7.155 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.210 -32.389 5.507 1.00 0.00 H new ATOM 0 HB2 ASP A 83 0.632 -29.535 5.156 1.00 0.00 H new ATOM 0 HB3 ASP A 83 0.914 -30.617 3.807 1.00 0.00 H new ATOM 1247 N PRO A 84 3.000 -31.437 5.505 1.00 0.00 N ATOM 1248 CA PRO A 84 4.363 -31.917 5.283 1.00 0.00 C ATOM 1249 C PRO A 84 4.634 -33.262 5.962 1.00 0.00 C ATOM 1250 O PRO A 84 4.998 -34.233 5.300 1.00 0.00 O ATOM 1251 CB PRO A 84 5.254 -30.814 5.881 1.00 0.00 C ATOM 1252 CG PRO A 84 4.329 -29.768 6.429 1.00 0.00 C ATOM 1253 CD PRO A 84 2.980 -30.004 5.810 1.00 0.00 C ATOM 0 HA PRO A 84 4.553 -32.096 4.225 1.00 0.00 H new ATOM 0 HB2 PRO A 84 5.894 -31.216 6.667 1.00 0.00 H new ATOM 0 HB3 PRO A 84 5.910 -30.391 5.121 1.00 0.00 H new ATOM 0 HG2 PRO A 84 4.272 -29.835 7.515 1.00 0.00 H new ATOM 0 HG3 PRO A 84 4.693 -28.769 6.190 1.00 0.00 H new ATOM 0 HD2 PRO A 84 2.172 -29.749 6.496 1.00 0.00 H new ATOM 0 HD3 PRO A 84 2.838 -29.403 4.912 1.00 0.00 H new ATOM 1261 N PRO A 85 4.457 -33.342 7.295 1.00 0.00 N ATOM 1262 CA PRO A 85 4.685 -34.582 8.045 1.00 0.00 C ATOM 1263 C PRO A 85 3.607 -35.627 7.780 1.00 0.00 C ATOM 1264 O PRO A 85 2.803 -35.484 6.858 1.00 0.00 O ATOM 1265 CB PRO A 85 4.635 -34.127 9.504 1.00 0.00 C ATOM 1266 CG PRO A 85 3.760 -32.923 9.488 1.00 0.00 C ATOM 1267 CD PRO A 85 4.024 -32.239 8.174 1.00 0.00 C ATOM 0 HA PRO A 85 5.623 -35.061 7.763 1.00 0.00 H new ATOM 0 HB2 PRO A 85 4.228 -34.905 10.149 1.00 0.00 H new ATOM 0 HB3 PRO A 85 5.630 -33.890 9.880 1.00 0.00 H new ATOM 0 HG2 PRO A 85 2.710 -33.202 9.579 1.00 0.00 H new ATOM 0 HG3 PRO A 85 3.988 -32.263 10.325 1.00 0.00 H new ATOM 0 HD2 PRO A 85 3.130 -31.747 7.791 1.00 0.00 H new ATOM 0 HD3 PRO A 85 4.794 -31.473 8.267 1.00 0.00 H new ATOM 1275 N SER A 86 3.593 -36.676 8.596 1.00 0.00 N ATOM 1276 CA SER A 86 2.612 -37.743 8.454 1.00 0.00 C ATOM 1277 C SER A 86 1.560 -37.662 9.556 1.00 0.00 C ATOM 1278 O SER A 86 1.777 -37.025 10.587 1.00 0.00 O ATOM 1279 CB SER A 86 3.302 -39.108 8.490 1.00 0.00 C ATOM 1280 OG SER A 86 4.622 -39.025 7.981 1.00 0.00 O ATOM 0 H SER A 86 4.252 -36.809 9.363 1.00 0.00 H new ATOM 0 HA SER A 86 2.115 -37.621 7.491 1.00 0.00 H new ATOM 0 HB2 SER A 86 3.326 -39.480 9.514 1.00 0.00 H new ATOM 0 HB3 SER A 86 2.727 -39.825 7.904 1.00 0.00 H new ATOM 0 HG SER A 86 5.042 -39.910 8.016 1.00 0.00 H new ATOM 1286 N THR A 87 0.421 -38.309 9.332 1.00 0.00 N ATOM 1287 CA THR A 87 -0.662 -38.308 10.309 1.00 0.00 C ATOM 1288 C THR A 87 -1.297 -39.691 10.420 1.00 0.00 C ATOM 1289 O THR A 87 -1.714 -40.277 9.421 1.00 0.00 O ATOM 1290 CB THR A 87 -1.723 -37.274 9.924 1.00 0.00 C ATOM 1291 OG1 THR A 87 -1.680 -37.007 8.534 1.00 0.00 O ATOM 1292 CG2 THR A 87 -1.563 -35.955 10.650 1.00 0.00 C ATOM 0 H THR A 87 0.224 -38.840 8.484 1.00 0.00 H new ATOM 0 HA THR A 87 -0.243 -38.043 11.280 1.00 0.00 H new ATOM 0 HB THR A 87 -2.677 -37.716 10.212 1.00 0.00 H new ATOM 0 HG1 THR A 87 -2.366 -36.345 8.307 1.00 0.00 H new ATOM 0 HG21 THR A 87 -2.346 -35.267 10.332 1.00 0.00 H new ATOM 0 HG22 THR A 87 -1.640 -36.120 11.725 1.00 0.00 H new ATOM 0 HG23 THR A 87 -0.588 -35.527 10.417 1.00 0.00 H new ATOM 1300 N ASP A 88 -1.368 -40.207 11.643 1.00 0.00 N ATOM 1301 CA ASP A 88 -1.953 -41.520 11.887 1.00 0.00 C ATOM 1302 C ASP A 88 -1.192 -42.605 11.131 1.00 0.00 C ATOM 1303 O ASP A 88 -0.258 -42.314 10.384 1.00 0.00 O ATOM 1304 CB ASP A 88 -3.426 -41.531 11.474 1.00 0.00 C ATOM 1305 CG ASP A 88 -4.305 -40.781 12.454 1.00 0.00 C ATOM 1306 OD1 ASP A 88 -3.877 -39.714 12.942 1.00 0.00 O ATOM 1307 OD2 ASP A 88 -5.424 -41.262 12.736 1.00 0.00 O ATOM 0 H ASP A 88 -1.027 -39.735 12.481 1.00 0.00 H new ATOM 0 HA ASP A 88 -1.881 -41.729 12.954 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -3.527 -41.085 10.485 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -3.771 -42.562 11.396 1.00 0.00 H new ATOM 1312 N LEU A 89 -1.597 -43.855 11.335 1.00 0.00 N ATOM 1313 CA LEU A 89 -0.962 -44.999 10.680 1.00 0.00 C ATOM 1314 C LEU A 89 0.443 -45.246 11.227 1.00 0.00 C ATOM 1315 O LEU A 89 0.747 -46.336 11.706 1.00 0.00 O ATOM 1316 CB LEU A 89 -0.902 -44.793 9.164 1.00 0.00 C ATOM 1317 CG LEU A 89 -0.403 -46.000 8.368 1.00 0.00 C ATOM 1318 CD1 LEU A 89 -1.244 -47.228 8.677 1.00 0.00 C ATOM 1319 CD2 LEU A 89 -0.422 -45.698 6.878 1.00 0.00 C ATOM 0 H LEU A 89 -2.368 -44.105 11.954 1.00 0.00 H new ATOM 0 HA LEU A 89 -1.572 -45.876 10.894 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -1.898 -44.529 8.808 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -0.252 -43.944 8.953 1.00 0.00 H new ATOM 0 HG LEU A 89 0.625 -46.207 8.664 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -0.874 -48.077 8.101 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -1.179 -47.455 9.741 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -2.283 -47.034 8.410 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -0.064 -46.567 6.326 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -1.440 -45.465 6.567 1.00 0.00 H new ATOM 0 HD23 LEU A 89 0.225 -44.845 6.671 1.00 0.00 H new ATOM 1331 N ASN A 90 1.300 -44.231 11.153 1.00 0.00 N ATOM 1332 CA ASN A 90 2.670 -44.350 11.643 1.00 0.00 C ATOM 1333 C ASN A 90 2.705 -44.939 13.053 1.00 0.00 C ATOM 1334 O ASN A 90 3.460 -45.872 13.328 1.00 0.00 O ATOM 1335 CB ASN A 90 3.358 -42.985 11.632 1.00 0.00 C ATOM 1336 CG ASN A 90 4.869 -43.098 11.673 1.00 0.00 C ATOM 1337 OD1 ASN A 90 5.425 -44.188 11.534 1.00 0.00 O ATOM 1338 ND2 ASN A 90 5.542 -41.970 11.865 1.00 0.00 N ATOM 0 H ASN A 90 1.070 -43.319 10.759 1.00 0.00 H new ATOM 0 HA ASN A 90 3.205 -45.027 10.977 1.00 0.00 H new ATOM 0 HB2 ASN A 90 3.062 -42.439 10.736 1.00 0.00 H new ATOM 0 HB3 ASN A 90 3.017 -42.402 12.488 1.00 0.00 H new ATOM 0 HD21 ASN A 90 6.561 -41.984 11.902 1.00 0.00 H new ATOM 0 HD22 ASN A 90 5.040 -41.089 11.975 1.00 0.00 H new ATOM 1345 N THR A 91 1.892 -44.379 13.946 1.00 0.00 N ATOM 1346 CA THR A 91 1.841 -44.840 15.332 1.00 0.00 C ATOM 1347 C THR A 91 1.380 -46.299 15.449 1.00 0.00 C ATOM 1348 O THR A 91 1.526 -46.908 16.509 1.00 0.00 O ATOM 1349 CB THR A 91 0.913 -43.938 16.148 1.00 0.00 C ATOM 1350 OG1 THR A 91 -0.031 -43.299 15.308 1.00 0.00 O ATOM 1351 CG2 THR A 91 1.649 -42.860 16.915 1.00 0.00 C ATOM 0 H THR A 91 1.260 -43.606 13.735 1.00 0.00 H new ATOM 0 HA THR A 91 2.856 -44.787 15.726 1.00 0.00 H new ATOM 0 HB THR A 91 0.422 -44.599 16.862 1.00 0.00 H new ATOM 0 HG1 THR A 91 -0.616 -42.728 15.848 1.00 0.00 H new ATOM 0 HG21 THR A 91 0.933 -42.256 17.472 1.00 0.00 H new ATOM 0 HG22 THR A 91 2.351 -43.322 17.609 1.00 0.00 H new ATOM 0 HG23 THR A 91 2.194 -42.224 16.217 1.00 0.00 H new ATOM 1359 N PHE A 92 0.825 -46.864 14.375 1.00 0.00 N ATOM 1360 CA PHE A 92 0.363 -48.247 14.409 1.00 0.00 C ATOM 1361 C PHE A 92 1.535 -49.208 14.250 1.00 0.00 C ATOM 1362 O PHE A 92 2.441 -48.969 13.451 1.00 0.00 O ATOM 1363 CB PHE A 92 -0.677 -48.503 13.311 1.00 0.00 C ATOM 1364 CG PHE A 92 -2.032 -47.917 13.608 1.00 0.00 C ATOM 1365 CD1 PHE A 92 -2.154 -46.669 14.203 1.00 0.00 C ATOM 1366 CD2 PHE A 92 -3.185 -48.617 13.291 1.00 0.00 C ATOM 1367 CE1 PHE A 92 -3.399 -46.135 14.475 1.00 0.00 C ATOM 1368 CE2 PHE A 92 -4.431 -48.086 13.561 1.00 0.00 C ATOM 1369 CZ PHE A 92 -4.539 -46.843 14.154 1.00 0.00 C ATOM 0 H PHE A 92 0.687 -46.390 13.483 1.00 0.00 H new ATOM 0 HA PHE A 92 -0.105 -48.420 15.378 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -0.310 -48.088 12.372 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -0.781 -49.578 13.165 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -1.266 -46.109 14.456 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -3.108 -49.589 12.827 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -3.480 -45.163 14.939 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -5.321 -48.643 13.308 1.00 0.00 H new ATOM 0 HZ PHE A 92 -5.513 -46.427 14.366 1.00 0.00 H new ATOM 1379 N THR A 93 1.516 -50.293 15.017 1.00 0.00 N ATOM 1380 CA THR A 93 2.584 -51.285 14.958 1.00 0.00 C ATOM 1381 C THR A 93 2.023 -52.689 14.750 1.00 0.00 C ATOM 1382 O THR A 93 2.186 -53.278 13.682 1.00 0.00 O ATOM 1383 CB THR A 93 3.444 -51.234 16.230 1.00 0.00 C ATOM 1384 OG1 THR A 93 4.078 -52.481 16.463 1.00 0.00 O ATOM 1385 CG2 THR A 93 2.668 -50.874 17.482 1.00 0.00 C ATOM 0 H THR A 93 0.775 -50.508 15.685 1.00 0.00 H new ATOM 0 HA THR A 93 3.215 -51.043 14.103 1.00 0.00 H new ATOM 0 HB THR A 93 4.173 -50.446 16.041 1.00 0.00 H new ATOM 0 HG1 THR A 93 4.621 -52.425 17.277 1.00 0.00 H new ATOM 0 HG21 THR A 93 3.344 -50.858 18.337 1.00 0.00 H new ATOM 0 HG22 THR A 93 2.215 -49.890 17.359 1.00 0.00 H new ATOM 0 HG23 THR A 93 1.886 -51.614 17.651 1.00 0.00 H new ATOM 1393 N VAL A 94 1.366 -53.221 15.772 1.00 0.00 N ATOM 1394 CA VAL A 94 0.786 -54.556 15.694 1.00 0.00 C ATOM 1395 C VAL A 94 -0.409 -54.700 16.633 1.00 0.00 C ATOM 1396 O VAL A 94 -1.441 -55.258 16.264 1.00 0.00 O ATOM 1397 CB VAL A 94 1.828 -55.639 16.037 1.00 0.00 C ATOM 1398 CG1 VAL A 94 1.244 -57.030 15.833 1.00 0.00 C ATOM 1399 CG2 VAL A 94 3.085 -55.455 15.199 1.00 0.00 C ATOM 0 H VAL A 94 1.221 -52.749 16.665 1.00 0.00 H new ATOM 0 HA VAL A 94 0.450 -54.693 14.666 1.00 0.00 H new ATOM 0 HB VAL A 94 2.099 -55.534 17.088 1.00 0.00 H new ATOM 0 HG11 VAL A 94 1.995 -57.780 16.080 1.00 0.00 H new ATOM 0 HG12 VAL A 94 0.376 -57.159 16.480 1.00 0.00 H new ATOM 0 HG13 VAL A 94 0.942 -57.149 14.792 1.00 0.00 H new ATOM 0 HG21 VAL A 94 3.809 -56.228 15.455 1.00 0.00 H new ATOM 0 HG22 VAL A 94 2.832 -55.531 14.142 1.00 0.00 H new ATOM 0 HG23 VAL A 94 3.516 -54.474 15.400 1.00 0.00 H new ATOM 1409 N GLU A 95 -0.255 -54.198 17.851 1.00 0.00 N ATOM 1410 CA GLU A 95 -1.311 -54.271 18.854 1.00 0.00 C ATOM 1411 C GLU A 95 -2.344 -53.162 18.666 1.00 0.00 C ATOM 1412 O GLU A 95 -3.469 -53.263 19.155 1.00 0.00 O ATOM 1413 CB GLU A 95 -0.711 -54.190 20.259 1.00 0.00 C ATOM 1414 CG GLU A 95 0.225 -53.009 20.453 1.00 0.00 C ATOM 1415 CD GLU A 95 1.650 -53.434 20.751 1.00 0.00 C ATOM 1416 OE1 GLU A 95 1.832 -54.419 21.498 1.00 0.00 O ATOM 1417 OE2 GLU A 95 2.584 -52.784 20.238 1.00 0.00 O ATOM 0 H GLU A 95 0.595 -53.733 18.170 1.00 0.00 H new ATOM 0 HA GLU A 95 -1.819 -55.228 18.730 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -1.520 -54.126 20.987 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -0.168 -55.112 20.467 1.00 0.00 H new ATOM 0 HG2 GLU A 95 0.215 -52.391 19.555 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -0.143 -52.389 21.270 1.00 0.00 H new ATOM 1424 N GLN A 96 -1.956 -52.098 17.968 1.00 0.00 N ATOM 1425 CA GLN A 96 -2.851 -50.971 17.736 1.00 0.00 C ATOM 1426 C GLN A 96 -3.879 -51.306 16.668 1.00 0.00 C ATOM 1427 O GLN A 96 -5.066 -51.024 16.824 1.00 0.00 O ATOM 1428 CB GLN A 96 -2.049 -49.732 17.328 1.00 0.00 C ATOM 1429 CG GLN A 96 -2.065 -48.626 18.372 1.00 0.00 C ATOM 1430 CD GLN A 96 -0.789 -48.577 19.189 1.00 0.00 C ATOM 1431 OE1 GLN A 96 -0.501 -49.486 19.968 1.00 0.00 O ATOM 1432 NE2 GLN A 96 -0.016 -47.511 19.017 1.00 0.00 N ATOM 0 H GLN A 96 -1.029 -51.994 17.554 1.00 0.00 H new ATOM 0 HA GLN A 96 -3.380 -50.759 18.665 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -1.017 -50.025 17.136 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -2.449 -49.342 16.392 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -2.212 -47.666 17.877 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -2.914 -48.774 19.039 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -0.293 -46.781 18.361 1.00 0.00 H new ATOM 0 HE22 GLN A 96 0.855 -47.422 19.541 1.00 0.00 H new ATOM 1441 N LEU A 97 -3.416 -51.909 15.585 1.00 0.00 N ATOM 1442 CA LEU A 97 -4.306 -52.286 14.489 1.00 0.00 C ATOM 1443 C LEU A 97 -5.378 -53.237 14.986 1.00 0.00 C ATOM 1444 O LEU A 97 -6.572 -52.955 14.905 1.00 0.00 O ATOM 1445 CB LEU A 97 -3.534 -52.970 13.351 1.00 0.00 C ATOM 1446 CG LEU A 97 -2.110 -53.450 13.685 1.00 0.00 C ATOM 1447 CD1 LEU A 97 -2.021 -54.956 13.627 1.00 0.00 C ATOM 1448 CD2 LEU A 97 -1.109 -52.844 12.730 1.00 0.00 C ATOM 0 H LEU A 97 -2.436 -52.149 15.438 1.00 0.00 H new ATOM 0 HA LEU A 97 -4.761 -51.371 14.111 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -4.114 -53.829 13.012 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -3.473 -52.276 12.513 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.878 -53.125 14.699 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -1.005 -55.270 13.867 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -2.714 -55.389 14.348 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -2.279 -55.297 12.625 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.108 -53.195 12.981 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -1.352 -53.142 11.710 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -1.143 -51.757 12.808 1.00 0.00 H new ATOM 1460 N LYS A 98 -4.933 -54.364 15.507 1.00 0.00 N ATOM 1461 CA LYS A 98 -5.850 -55.375 16.029 1.00 0.00 C ATOM 1462 C LYS A 98 -6.731 -54.797 17.134 1.00 0.00 C ATOM 1463 O LYS A 98 -7.872 -55.223 17.314 1.00 0.00 O ATOM 1464 CB LYS A 98 -5.076 -56.582 16.560 1.00 0.00 C ATOM 1465 CG LYS A 98 -5.936 -57.828 16.713 1.00 0.00 C ATOM 1466 CD LYS A 98 -5.325 -59.023 15.998 1.00 0.00 C ATOM 1467 CE LYS A 98 -5.160 -58.763 14.508 1.00 0.00 C ATOM 1468 NZ LYS A 98 -3.884 -59.327 13.986 1.00 0.00 N ATOM 0 H LYS A 98 -3.946 -54.608 15.583 1.00 0.00 H new ATOM 0 HA LYS A 98 -6.490 -55.698 15.208 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -4.249 -56.800 15.884 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -4.640 -56.329 17.526 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -6.057 -58.059 17.771 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -6.932 -57.635 16.314 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -4.354 -59.252 16.437 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -5.957 -59.898 16.147 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -5.999 -59.201 13.967 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -5.186 -57.689 14.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -3.962 -59.470 12.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -3.105 -58.667 14.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -3.692 -60.238 14.449 1.00 0.00 H new ATOM 1482 N ALA A 99 -6.199 -53.827 17.872 1.00 0.00 N ATOM 1483 CA ALA A 99 -6.946 -53.198 18.954 1.00 0.00 C ATOM 1484 C ALA A 99 -7.834 -52.075 18.442 1.00 0.00 C ATOM 1485 O ALA A 99 -8.800 -51.680 19.096 1.00 0.00 O ATOM 1486 CB ALA A 99 -6.000 -52.683 20.028 1.00 0.00 C ATOM 0 H ALA A 99 -5.256 -53.461 17.740 1.00 0.00 H new ATOM 0 HA ALA A 99 -7.593 -53.957 19.393 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -6.576 -52.217 20.827 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -5.423 -53.514 20.434 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -5.322 -51.949 19.594 1.00 0.00 H new ATOM 1492 N GLN A 100 -7.490 -51.560 17.277 1.00 0.00 N ATOM 1493 CA GLN A 100 -8.239 -50.470 16.664 1.00 0.00 C ATOM 1494 C GLN A 100 -9.429 -50.987 15.867 1.00 0.00 C ATOM 1495 O GLN A 100 -10.495 -50.372 15.865 1.00 0.00 O ATOM 1496 CB GLN A 100 -7.327 -49.639 15.760 1.00 0.00 C ATOM 1497 CG GLN A 100 -6.620 -48.505 16.485 1.00 0.00 C ATOM 1498 CD GLN A 100 -7.366 -47.188 16.379 1.00 0.00 C ATOM 1499 OE1 GLN A 100 -6.759 -46.132 16.201 1.00 0.00 O ATOM 1500 NE2 GLN A 100 -8.688 -47.244 16.489 1.00 0.00 N ATOM 0 H GLN A 100 -6.691 -51.879 16.729 1.00 0.00 H new ATOM 0 HA GLN A 100 -8.620 -49.840 17.468 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -6.580 -50.294 15.311 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -7.919 -49.224 14.944 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -6.503 -48.768 17.536 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -5.618 -48.385 16.073 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -9.150 -48.141 16.636 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -9.242 -46.390 16.426 1.00 0.00 H new ATOM 1509 N LEU A 101 -9.254 -52.119 15.194 1.00 0.00 N ATOM 1510 CA LEU A 101 -10.336 -52.696 14.405 1.00 0.00 C ATOM 1511 C LEU A 101 -11.473 -53.106 15.324 1.00 0.00 C ATOM 1512 O LEU A 101 -12.643 -52.836 15.053 1.00 0.00 O ATOM 1513 CB LEU A 101 -9.860 -53.926 13.619 1.00 0.00 C ATOM 1514 CG LEU A 101 -9.126 -53.660 12.294 1.00 0.00 C ATOM 1515 CD1 LEU A 101 -9.216 -54.880 11.390 1.00 0.00 C ATOM 1516 CD2 LEU A 101 -9.683 -52.435 11.577 1.00 0.00 C ATOM 0 H LEU A 101 -8.383 -52.650 15.178 1.00 0.00 H new ATOM 0 HA LEU A 101 -10.675 -51.941 13.696 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -9.199 -54.506 14.263 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -10.728 -54.551 13.407 1.00 0.00 H new ATOM 0 HG LEU A 101 -8.080 -53.461 12.529 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -8.693 -54.679 10.455 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.757 -55.735 11.886 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -10.263 -55.101 11.180 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -9.139 -52.280 10.645 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -10.739 -52.590 11.358 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -9.569 -51.558 12.214 1.00 0.00 H new ATOM 1528 N THR A 102 -11.111 -53.762 16.418 1.00 0.00 N ATOM 1529 CA THR A 102 -12.087 -54.219 17.391 1.00 0.00 C ATOM 1530 C THR A 102 -12.807 -53.044 18.027 1.00 0.00 C ATOM 1531 O THR A 102 -14.017 -53.091 18.251 1.00 0.00 O ATOM 1532 CB THR A 102 -11.404 -55.053 18.470 1.00 0.00 C ATOM 1533 OG1 THR A 102 -10.046 -54.675 18.616 1.00 0.00 O ATOM 1534 CG2 THR A 102 -11.441 -56.529 18.174 1.00 0.00 C ATOM 0 H THR A 102 -10.145 -53.989 16.652 1.00 0.00 H new ATOM 0 HA THR A 102 -12.821 -54.835 16.872 1.00 0.00 H new ATOM 0 HB THR A 102 -11.961 -54.862 19.388 1.00 0.00 H new ATOM 0 HG1 THR A 102 -9.486 -55.239 18.043 1.00 0.00 H new ATOM 0 HG21 THR A 102 -10.941 -57.073 18.975 1.00 0.00 H new ATOM 0 HG22 THR A 102 -12.477 -56.860 18.103 1.00 0.00 H new ATOM 0 HG23 THR A 102 -10.932 -56.724 17.230 1.00 0.00 H new ATOM 1542 N GLU A 103 -12.059 -51.989 18.318 1.00 0.00 N ATOM 1543 CA GLU A 103 -12.639 -50.807 18.929 1.00 0.00 C ATOM 1544 C GLU A 103 -13.393 -49.968 17.903 1.00 0.00 C ATOM 1545 O GLU A 103 -14.062 -48.994 18.250 1.00 0.00 O ATOM 1546 CB GLU A 103 -11.560 -49.964 19.612 1.00 0.00 C ATOM 1547 CG GLU A 103 -12.050 -49.241 20.856 1.00 0.00 C ATOM 1548 CD GLU A 103 -11.002 -49.185 21.949 1.00 0.00 C ATOM 1549 OE1 GLU A 103 -10.029 -48.416 21.800 1.00 0.00 O ATOM 1550 OE2 GLU A 103 -11.154 -49.910 22.955 1.00 0.00 O ATOM 0 H GLU A 103 -11.056 -51.929 18.141 1.00 0.00 H new ATOM 0 HA GLU A 103 -13.351 -51.141 19.684 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -10.724 -50.609 19.882 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -11.180 -49.230 18.901 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -12.346 -48.226 20.589 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -12.940 -49.743 21.236 1.00 0.00 H new ATOM 1557 N ARG A 104 -13.284 -50.357 16.641 1.00 0.00 N ATOM 1558 CA ARG A 104 -13.958 -49.649 15.559 1.00 0.00 C ATOM 1559 C ARG A 104 -15.214 -50.397 15.113 1.00 0.00 C ATOM 1560 O ARG A 104 -16.065 -49.840 14.421 1.00 0.00 O ATOM 1561 CB ARG A 104 -13.011 -49.470 14.373 1.00 0.00 C ATOM 1562 CG ARG A 104 -13.465 -48.406 13.388 1.00 0.00 C ATOM 1563 CD ARG A 104 -12.281 -47.710 12.734 1.00 0.00 C ATOM 1564 NE ARG A 104 -11.973 -46.434 13.378 1.00 0.00 N ATOM 1565 CZ ARG A 104 -10.805 -45.807 13.259 1.00 0.00 C ATOM 1566 NH1 ARG A 104 -9.833 -46.332 12.523 1.00 0.00 N ATOM 1567 NH2 ARG A 104 -10.609 -44.651 13.879 1.00 0.00 N ATOM 0 H ARG A 104 -12.734 -51.161 16.339 1.00 0.00 H new ATOM 0 HA ARG A 104 -14.255 -48.669 15.931 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -12.020 -49.209 14.746 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -12.914 -50.421 13.849 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -14.090 -48.862 12.620 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -14.081 -47.670 13.904 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -11.407 -48.360 12.780 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -12.497 -47.541 11.679 1.00 0.00 H new ATOM 0 HE ARG A 104 -12.695 -45.999 13.952 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -9.979 -47.221 12.045 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -8.940 -45.846 12.436 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -11.353 -44.244 14.446 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -9.714 -44.169 13.789 1.00 0.00 H new ATOM 1581 N GLY A 105 -15.326 -51.662 15.516 1.00 0.00 N ATOM 1582 CA GLY A 105 -16.481 -52.458 15.146 1.00 0.00 C ATOM 1583 C GLY A 105 -16.400 -52.964 13.720 1.00 0.00 C ATOM 1584 O GLY A 105 -17.246 -52.633 12.888 1.00 0.00 O ATOM 0 H GLY A 105 -14.637 -52.147 16.091 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -16.567 -53.306 15.825 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -17.385 -51.860 15.266 1.00 0.00 H new ATOM 1588 N ILE A 106 -15.378 -53.764 13.435 1.00 0.00 N ATOM 1589 CA ILE A 106 -15.189 -54.314 12.098 1.00 0.00 C ATOM 1590 C ILE A 106 -14.459 -55.656 12.152 1.00 0.00 C ATOM 1591 O ILE A 106 -13.230 -55.704 12.166 1.00 0.00 O ATOM 1592 CB ILE A 106 -14.394 -53.339 11.205 1.00 0.00 C ATOM 1593 CG1 ILE A 106 -14.234 -53.911 9.794 1.00 0.00 C ATOM 1594 CG2 ILE A 106 -13.037 -53.040 11.819 1.00 0.00 C ATOM 1595 CD1 ILE A 106 -14.117 -52.851 8.722 1.00 0.00 C ATOM 0 H ILE A 106 -14.668 -54.046 14.111 1.00 0.00 H new ATOM 0 HA ILE A 106 -16.180 -54.465 11.669 1.00 0.00 H new ATOM 0 HB ILE A 106 -14.951 -52.405 11.134 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -13.347 -54.544 9.766 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -15.089 -54.549 9.570 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -12.490 -52.351 11.175 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -13.174 -52.588 12.801 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -12.472 -53.966 11.921 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -14.006 -53.329 7.749 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -15.014 -52.232 8.723 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -13.246 -52.227 8.921 1.00 0.00 H new ATOM 1607 N THR A 107 -15.223 -56.746 12.179 1.00 0.00 N ATOM 1608 CA THR A 107 -14.650 -58.090 12.228 1.00 0.00 C ATOM 1609 C THR A 107 -13.546 -58.255 11.184 1.00 0.00 C ATOM 1610 O THR A 107 -13.659 -57.756 10.064 1.00 0.00 O ATOM 1611 CB THR A 107 -15.742 -59.139 11.998 1.00 0.00 C ATOM 1612 OG1 THR A 107 -17.028 -58.573 12.180 1.00 0.00 O ATOM 1613 CG2 THR A 107 -15.633 -60.334 12.921 1.00 0.00 C ATOM 0 H THR A 107 -16.243 -56.725 12.168 1.00 0.00 H new ATOM 0 HA THR A 107 -14.214 -58.234 13.216 1.00 0.00 H new ATOM 0 HB THR A 107 -15.600 -59.480 10.972 1.00 0.00 H new ATOM 0 HG1 THR A 107 -17.712 -59.258 12.027 1.00 0.00 H new ATOM 0 HG21 THR A 107 -16.437 -61.037 12.703 1.00 0.00 H new ATOM 0 HG22 THR A 107 -14.672 -60.825 12.769 1.00 0.00 H new ATOM 0 HG23 THR A 107 -15.712 -60.002 13.956 1.00 0.00 H new ATOM 1621 N PHE A 108 -12.479 -58.957 11.557 1.00 0.00 N ATOM 1622 CA PHE A 108 -11.360 -59.185 10.650 1.00 0.00 C ATOM 1623 C PHE A 108 -11.119 -60.680 10.452 1.00 0.00 C ATOM 1624 O PHE A 108 -11.641 -61.278 9.512 1.00 0.00 O ATOM 1625 CB PHE A 108 -10.080 -58.491 11.153 1.00 0.00 C ATOM 1626 CG PHE A 108 -9.989 -58.330 12.650 1.00 0.00 C ATOM 1627 CD1 PHE A 108 -10.943 -57.605 13.347 1.00 0.00 C ATOM 1628 CD2 PHE A 108 -8.940 -58.899 13.357 1.00 0.00 C ATOM 1629 CE1 PHE A 108 -10.855 -57.452 14.717 1.00 0.00 C ATOM 1630 CE2 PHE A 108 -8.847 -58.748 14.727 1.00 0.00 C ATOM 1631 CZ PHE A 108 -9.805 -58.025 15.409 1.00 0.00 C ATOM 0 H PHE A 108 -12.367 -59.377 12.480 1.00 0.00 H new ATOM 0 HA PHE A 108 -11.621 -58.747 9.686 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -9.217 -59.062 10.811 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -10.014 -57.506 10.692 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -11.766 -57.154 12.812 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -8.187 -59.467 12.830 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -11.606 -56.885 15.247 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -8.024 -59.196 15.265 1.00 0.00 H new ATOM 0 HZ PHE A 108 -9.734 -57.908 16.480 1.00 0.00 H new ATOM 1641 N LYS A 109 -10.334 -61.282 11.343 1.00 0.00 N ATOM 1642 CA LYS A 109 -10.033 -62.711 11.262 1.00 0.00 C ATOM 1643 C LYS A 109 -9.523 -63.094 9.874 1.00 0.00 C ATOM 1644 O LYS A 109 -10.300 -63.202 8.924 1.00 0.00 O ATOM 1645 CB LYS A 109 -11.275 -63.535 11.606 1.00 0.00 C ATOM 1646 CG LYS A 109 -11.966 -63.092 12.886 1.00 0.00 C ATOM 1647 CD LYS A 109 -13.463 -63.354 12.829 1.00 0.00 C ATOM 1648 CE LYS A 109 -13.804 -64.749 13.327 1.00 0.00 C ATOM 1649 NZ LYS A 109 -13.368 -64.958 14.735 1.00 0.00 N ATOM 0 H LYS A 109 -9.895 -60.803 12.129 1.00 0.00 H new ATOM 0 HA LYS A 109 -9.246 -62.927 11.985 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -11.983 -63.471 10.780 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -10.990 -64.583 11.701 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -11.535 -63.621 13.736 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -11.787 -62.029 13.048 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -13.986 -62.613 13.433 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -13.815 -63.236 11.804 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -14.880 -64.908 13.253 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -13.327 -65.490 12.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -13.953 -65.698 15.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -12.370 -65.251 14.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -13.476 -64.071 15.267 1.00 0.00 H new ATOM 1663 N GLN A 110 -8.216 -63.305 9.764 1.00 0.00 N ATOM 1664 CA GLN A 110 -7.604 -63.680 8.493 1.00 0.00 C ATOM 1665 C GLN A 110 -7.758 -62.566 7.462 1.00 0.00 C ATOM 1666 O GLN A 110 -8.360 -61.529 7.736 1.00 0.00 O ATOM 1667 CB GLN A 110 -8.225 -64.974 7.963 1.00 0.00 C ATOM 1668 CG GLN A 110 -7.465 -66.226 8.371 1.00 0.00 C ATOM 1669 CD GLN A 110 -8.383 -67.348 8.818 1.00 0.00 C ATOM 1670 OE1 GLN A 110 -9.598 -67.172 8.913 1.00 0.00 O ATOM 1671 NE2 GLN A 110 -7.803 -68.510 9.096 1.00 0.00 N ATOM 0 H GLN A 110 -7.559 -63.223 10.540 1.00 0.00 H new ATOM 0 HA GLN A 110 -6.540 -63.842 8.667 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -9.251 -65.049 8.323 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -8.272 -64.926 6.875 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -6.861 -66.569 7.531 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -6.777 -65.981 9.180 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -6.792 -68.611 9.003 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -8.368 -69.302 9.402 1.00 0.00 H new ATOM 1680 N SER A 111 -7.202 -62.789 6.275 1.00 0.00 N ATOM 1681 CA SER A 111 -7.269 -61.806 5.197 1.00 0.00 C ATOM 1682 C SER A 111 -6.691 -60.464 5.642 1.00 0.00 C ATOM 1683 O SER A 111 -7.013 -59.420 5.078 1.00 0.00 O ATOM 1684 CB SER A 111 -8.715 -61.623 4.733 1.00 0.00 C ATOM 1685 OG SER A 111 -9.392 -62.866 4.668 1.00 0.00 O ATOM 0 H SER A 111 -6.699 -63.643 6.034 1.00 0.00 H new ATOM 0 HA SER A 111 -6.672 -62.179 4.365 1.00 0.00 H new ATOM 0 HB2 SER A 111 -9.238 -60.956 5.418 1.00 0.00 H new ATOM 0 HB3 SER A 111 -8.728 -61.147 3.753 1.00 0.00 H new ATOM 0 HG SER A 111 -10.314 -62.721 4.371 1.00 0.00 H new ATOM 1691 N ALA A 112 -5.833 -60.507 6.658 1.00 0.00 N ATOM 1692 CA ALA A 112 -5.196 -59.309 7.196 1.00 0.00 C ATOM 1693 C ALA A 112 -4.510 -59.631 8.515 1.00 0.00 C ATOM 1694 O ALA A 112 -5.014 -59.301 9.588 1.00 0.00 O ATOM 1695 CB ALA A 112 -6.211 -58.190 7.387 1.00 0.00 C ATOM 0 H ALA A 112 -5.561 -61.370 7.130 1.00 0.00 H new ATOM 0 HA ALA A 112 -4.448 -58.968 6.480 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -5.710 -57.309 7.789 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -6.665 -57.943 6.427 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -6.985 -58.516 8.082 1.00 0.00 H new ATOM 1701 N THR A 113 -3.365 -60.297 8.427 1.00 0.00 N ATOM 1702 CA THR A 113 -2.618 -60.686 9.614 1.00 0.00 C ATOM 1703 C THR A 113 -1.965 -59.487 10.287 1.00 0.00 C ATOM 1704 O THR A 113 -2.493 -58.954 11.263 1.00 0.00 O ATOM 1705 CB THR A 113 -1.565 -61.731 9.256 1.00 0.00 C ATOM 1706 OG1 THR A 113 -1.158 -61.598 7.906 1.00 0.00 O ATOM 1707 CG2 THR A 113 -2.061 -63.145 9.452 1.00 0.00 C ATOM 0 H THR A 113 -2.935 -60.578 7.546 1.00 0.00 H new ATOM 0 HA THR A 113 -3.324 -61.118 10.323 1.00 0.00 H new ATOM 0 HB THR A 113 -0.728 -61.551 9.931 1.00 0.00 H new ATOM 0 HG1 THR A 113 -0.482 -62.277 7.700 1.00 0.00 H new ATOM 0 HG21 THR A 113 -1.273 -63.848 9.183 1.00 0.00 H new ATOM 0 HG22 THR A 113 -2.337 -63.292 10.496 1.00 0.00 H new ATOM 0 HG23 THR A 113 -2.931 -63.316 8.819 1.00 0.00 H new ATOM 1715 N LYS A 114 -0.812 -59.062 9.776 1.00 0.00 N ATOM 1716 CA LYS A 114 -0.113 -57.927 10.362 1.00 0.00 C ATOM 1717 C LYS A 114 0.319 -56.918 9.313 1.00 0.00 C ATOM 1718 O LYS A 114 -0.053 -55.751 9.388 1.00 0.00 O ATOM 1719 CB LYS A 114 1.099 -58.396 11.172 1.00 0.00 C ATOM 1720 CG LYS A 114 1.855 -59.556 10.538 1.00 0.00 C ATOM 1721 CD LYS A 114 3.318 -59.213 10.310 1.00 0.00 C ATOM 1722 CE LYS A 114 4.155 -60.464 10.101 1.00 0.00 C ATOM 1723 NZ LYS A 114 5.574 -60.138 9.788 1.00 0.00 N ATOM 0 H LYS A 114 -0.349 -59.481 8.969 1.00 0.00 H new ATOM 0 HA LYS A 114 -0.817 -57.429 11.029 1.00 0.00 H new ATOM 0 HB2 LYS A 114 1.783 -57.557 11.302 1.00 0.00 H new ATOM 0 HB3 LYS A 114 0.766 -58.693 12.167 1.00 0.00 H new ATOM 0 HG2 LYS A 114 1.782 -60.433 11.181 1.00 0.00 H new ATOM 0 HG3 LYS A 114 1.390 -59.818 9.588 1.00 0.00 H new ATOM 0 HD2 LYS A 114 3.409 -58.563 9.440 1.00 0.00 H new ATOM 0 HD3 LYS A 114 3.700 -58.656 11.166 1.00 0.00 H new ATOM 0 HE2 LYS A 114 4.114 -61.082 10.998 1.00 0.00 H new ATOM 0 HE3 LYS A 114 3.730 -61.053 9.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 6.111 -61.018 9.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 5.616 -59.570 8.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 5.988 -59.598 10.575 1.00 0.00 H new ATOM 1737 N ALA A 115 1.100 -57.361 8.340 1.00 0.00 N ATOM 1738 CA ALA A 115 1.568 -56.470 7.287 1.00 0.00 C ATOM 1739 C ALA A 115 0.396 -55.903 6.501 1.00 0.00 C ATOM 1740 O ALA A 115 0.432 -54.759 6.047 1.00 0.00 O ATOM 1741 CB ALA A 115 2.530 -57.200 6.362 1.00 0.00 C ATOM 0 H ALA A 115 1.422 -58.325 8.256 1.00 0.00 H new ATOM 0 HA ALA A 115 2.099 -55.639 7.752 1.00 0.00 H new ATOM 0 HB1 ALA A 115 2.870 -56.520 5.581 1.00 0.00 H new ATOM 0 HB2 ALA A 115 3.388 -57.553 6.934 1.00 0.00 H new ATOM 0 HB3 ALA A 115 2.022 -58.050 5.907 1.00 0.00 H new ATOM 1747 N GLU A 116 -0.649 -56.706 6.358 1.00 0.00 N ATOM 1748 CA GLU A 116 -1.846 -56.282 5.642 1.00 0.00 C ATOM 1749 C GLU A 116 -2.791 -55.544 6.580 1.00 0.00 C ATOM 1750 O GLU A 116 -3.501 -54.623 6.179 1.00 0.00 O ATOM 1751 CB GLU A 116 -2.555 -57.488 5.025 1.00 0.00 C ATOM 1752 CG GLU A 116 -1.743 -58.183 3.943 1.00 0.00 C ATOM 1753 CD GLU A 116 -2.553 -58.457 2.690 1.00 0.00 C ATOM 1754 OE1 GLU A 116 -2.786 -57.507 1.914 1.00 0.00 O ATOM 1755 OE2 GLU A 116 -2.953 -59.621 2.486 1.00 0.00 O ATOM 0 H GLU A 116 -0.693 -57.655 6.728 1.00 0.00 H new ATOM 0 HA GLU A 116 -1.546 -55.605 4.842 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -2.785 -58.206 5.812 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -3.506 -57.163 4.602 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -0.882 -57.565 3.687 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -1.355 -59.124 4.333 1.00 0.00 H new ATOM 1762 N LEU A 117 -2.790 -55.975 7.834 1.00 0.00 N ATOM 1763 CA LEU A 117 -3.638 -55.394 8.863 1.00 0.00 C ATOM 1764 C LEU A 117 -3.062 -54.076 9.365 1.00 0.00 C ATOM 1765 O LEU A 117 -3.793 -53.237 9.894 1.00 0.00 O ATOM 1766 CB LEU A 117 -3.795 -56.414 9.996 1.00 0.00 C ATOM 1767 CG LEU A 117 -4.227 -55.880 11.357 1.00 0.00 C ATOM 1768 CD1 LEU A 117 -5.724 -55.616 11.389 1.00 0.00 C ATOM 1769 CD2 LEU A 117 -3.840 -56.876 12.431 1.00 0.00 C ATOM 0 H LEU A 117 -2.200 -56.738 8.166 1.00 0.00 H new ATOM 0 HA LEU A 117 -4.620 -55.165 8.450 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -4.522 -57.162 9.680 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.843 -56.929 10.122 1.00 0.00 H new ATOM 0 HG LEU A 117 -3.721 -54.933 11.542 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -6.006 -55.236 12.371 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -5.980 -54.879 10.628 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -6.261 -56.544 11.191 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -4.147 -56.498 13.406 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -4.334 -57.828 12.239 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -2.760 -57.020 12.422 1.00 0.00 H new ATOM 1781 N ILE A 118 -1.763 -53.875 9.173 1.00 0.00 N ATOM 1782 CA ILE A 118 -1.138 -52.631 9.589 1.00 0.00 C ATOM 1783 C ILE A 118 -1.354 -51.565 8.517 1.00 0.00 C ATOM 1784 O ILE A 118 -1.437 -50.374 8.815 1.00 0.00 O ATOM 1785 CB ILE A 118 0.383 -52.784 9.878 1.00 0.00 C ATOM 1786 CG1 ILE A 118 1.013 -51.431 10.235 1.00 0.00 C ATOM 1787 CG2 ILE A 118 1.132 -53.395 8.698 1.00 0.00 C ATOM 1788 CD1 ILE A 118 0.241 -50.637 11.265 1.00 0.00 C ATOM 0 H ILE A 118 -1.132 -54.548 8.738 1.00 0.00 H new ATOM 0 HA ILE A 118 -1.611 -52.332 10.524 1.00 0.00 H new ATOM 0 HB ILE A 118 0.472 -53.461 10.727 1.00 0.00 H new ATOM 0 HG12 ILE A 118 2.023 -51.601 10.607 1.00 0.00 H new ATOM 0 HG13 ILE A 118 1.104 -50.835 9.327 1.00 0.00 H new ATOM 0 HG21 ILE A 118 2.190 -53.483 8.945 1.00 0.00 H new ATOM 0 HG22 ILE A 118 0.726 -54.383 8.482 1.00 0.00 H new ATOM 0 HG23 ILE A 118 1.015 -52.756 7.823 1.00 0.00 H new ATOM 0 HD11 ILE A 118 0.755 -49.696 11.459 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -0.762 -50.432 10.890 1.00 0.00 H new ATOM 0 HD13 ILE A 118 0.172 -51.210 12.190 1.00 0.00 H new ATOM 1800 N ALA A 119 -1.460 -52.013 7.266 1.00 0.00 N ATOM 1801 CA ALA A 119 -1.688 -51.117 6.142 1.00 0.00 C ATOM 1802 C ALA A 119 -3.177 -50.862 5.950 1.00 0.00 C ATOM 1803 O ALA A 119 -3.584 -49.793 5.497 1.00 0.00 O ATOM 1804 CB ALA A 119 -1.078 -51.692 4.873 1.00 0.00 C ATOM 0 H ALA A 119 -1.391 -52.998 7.009 1.00 0.00 H new ATOM 0 HA ALA A 119 -1.204 -50.165 6.359 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -1.257 -51.010 4.042 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -0.005 -51.821 5.011 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -1.534 -52.658 4.655 1.00 0.00 H new ATOM 1810 N LEU A 120 -3.987 -51.862 6.296 1.00 0.00 N ATOM 1811 CA LEU A 120 -5.436 -51.762 6.160 1.00 0.00 C ATOM 1812 C LEU A 120 -5.955 -50.466 6.769 1.00 0.00 C ATOM 1813 O LEU A 120 -6.778 -49.777 6.168 1.00 0.00 O ATOM 1814 CB LEU A 120 -6.120 -52.958 6.827 1.00 0.00 C ATOM 1815 CG LEU A 120 -7.507 -53.299 6.278 1.00 0.00 C ATOM 1816 CD1 LEU A 120 -7.394 -54.248 5.096 1.00 0.00 C ATOM 1817 CD2 LEU A 120 -8.377 -53.906 7.369 1.00 0.00 C ATOM 0 H LEU A 120 -3.661 -52.752 6.673 1.00 0.00 H new ATOM 0 HA LEU A 120 -5.672 -51.763 5.096 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -5.478 -53.832 6.718 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -6.208 -52.758 7.895 1.00 0.00 H new ATOM 0 HG LEU A 120 -7.978 -52.378 5.935 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -8.390 -54.479 4.719 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -6.807 -53.778 4.307 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -6.904 -55.168 5.414 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -9.360 -54.142 6.961 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -7.910 -54.818 7.742 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -8.485 -53.193 8.187 1.00 0.00 H new ATOM 1829 N PHE A 121 -5.469 -50.136 7.962 1.00 0.00 N ATOM 1830 CA PHE A 121 -5.897 -48.914 8.636 1.00 0.00 C ATOM 1831 C PHE A 121 -5.512 -47.680 7.825 1.00 0.00 C ATOM 1832 O PHE A 121 -4.496 -47.039 8.094 1.00 0.00 O ATOM 1833 CB PHE A 121 -5.285 -48.829 10.031 1.00 0.00 C ATOM 1834 CG PHE A 121 -5.993 -49.687 11.032 1.00 0.00 C ATOM 1835 CD1 PHE A 121 -7.111 -49.218 11.703 1.00 0.00 C ATOM 1836 CD2 PHE A 121 -5.542 -50.967 11.300 1.00 0.00 C ATOM 1837 CE1 PHE A 121 -7.762 -50.009 12.621 1.00 0.00 C ATOM 1838 CE2 PHE A 121 -6.190 -51.762 12.217 1.00 0.00 C ATOM 1839 CZ PHE A 121 -7.302 -51.281 12.878 1.00 0.00 C ATOM 0 H PHE A 121 -4.786 -50.691 8.478 1.00 0.00 H new ATOM 0 HA PHE A 121 -6.983 -48.945 8.726 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -4.238 -49.127 9.981 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -5.306 -47.793 10.369 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -7.475 -48.221 11.503 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -4.672 -51.346 10.784 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -8.632 -49.633 13.139 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -5.829 -52.760 12.419 1.00 0.00 H new ATOM 0 HZ PHE A 121 -7.812 -51.903 13.598 1.00 0.00 H new ATOM 1849 N ALA A 122 -6.330 -47.356 6.829 1.00 0.00 N ATOM 1850 CA ALA A 122 -6.078 -46.202 5.976 1.00 0.00 C ATOM 1851 C ALA A 122 -7.239 -45.208 6.036 1.00 0.00 C ATOM 1852 O ALA A 122 -8.283 -45.428 5.422 1.00 0.00 O ATOM 1853 CB ALA A 122 -5.843 -46.651 4.542 1.00 0.00 C ATOM 0 H ALA A 122 -7.174 -47.878 6.593 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.183 -45.699 6.342 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -5.656 -45.780 3.914 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -4.981 -47.317 4.506 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -6.724 -47.179 4.177 1.00 0.00 H new ATOM 1859 N PRO A 123 -7.072 -44.097 6.777 1.00 0.00 N ATOM 1860 CA PRO A 123 -8.116 -43.074 6.908 1.00 0.00 C ATOM 1861 C PRO A 123 -8.678 -42.641 5.557 1.00 0.00 C ATOM 1862 O PRO A 123 -9.818 -42.185 5.466 1.00 0.00 O ATOM 1863 CB PRO A 123 -7.388 -41.911 7.582 1.00 0.00 C ATOM 1864 CG PRO A 123 -6.284 -42.552 8.349 1.00 0.00 C ATOM 1865 CD PRO A 123 -5.859 -43.750 7.544 1.00 0.00 C ATOM 0 HA PRO A 123 -8.977 -43.439 7.469 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -7.002 -41.205 6.846 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -8.055 -41.353 8.239 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -5.453 -41.861 8.488 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -6.621 -42.849 9.342 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -5.022 -43.515 6.887 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -5.540 -44.572 8.185 1.00 0.00 H new ATOM 1873 N ALA A 124 -7.871 -42.786 4.510 1.00 0.00 N ATOM 1874 CA ALA A 124 -8.287 -42.409 3.165 1.00 0.00 C ATOM 1875 C ALA A 124 -9.566 -43.136 2.761 1.00 0.00 C ATOM 1876 O ALA A 124 -9.867 -44.214 3.274 1.00 0.00 O ATOM 1877 CB ALA A 124 -7.175 -42.702 2.169 1.00 0.00 C ATOM 0 H ALA A 124 -6.925 -43.162 4.568 1.00 0.00 H new ATOM 0 HA ALA A 124 -8.492 -41.339 3.161 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -7.498 -42.416 1.168 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -6.285 -42.133 2.439 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -6.944 -43.767 2.185 1.00 0.00 H new ATOM 1883 N ASP A 125 -10.317 -42.538 1.841 1.00 0.00 N ATOM 1884 CA ASP A 125 -11.564 -43.129 1.371 1.00 0.00 C ATOM 1885 C ASP A 125 -11.340 -43.936 0.098 1.00 0.00 C ATOM 1886 O ASP A 125 -10.421 -43.658 -0.673 1.00 0.00 O ATOM 1887 CB ASP A 125 -12.606 -42.038 1.121 1.00 0.00 C ATOM 1888 CG ASP A 125 -13.466 -41.770 2.340 1.00 0.00 C ATOM 1889 OD1 ASP A 125 -14.194 -42.692 2.767 1.00 0.00 O ATOM 1890 OD2 ASP A 125 -13.413 -40.640 2.868 1.00 0.00 O ATOM 0 H ASP A 125 -10.083 -41.645 1.407 1.00 0.00 H new ATOM 0 HA ASP A 125 -11.931 -43.803 2.145 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -12.101 -41.118 0.827 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -13.244 -42.333 0.288 1.00 0.00 H new ATOM 1895 N GLY A 126 -12.185 -44.940 -0.118 1.00 0.00 N ATOM 1896 CA GLY A 126 -12.062 -45.774 -1.299 1.00 0.00 C ATOM 1897 C GLY A 126 -13.387 -45.973 -2.008 1.00 0.00 C ATOM 1898 O GLY A 126 -13.835 -45.105 -2.757 1.00 0.00 O ATOM 0 H GLY A 126 -12.953 -45.190 0.505 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -11.349 -45.320 -1.988 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -11.656 -46.745 -1.014 1.00 0.00 H new ATOM 1902 N GLU A 127 -14.016 -47.121 -1.773 1.00 0.00 N ATOM 1903 CA GLU A 127 -15.297 -47.432 -2.397 1.00 0.00 C ATOM 1904 C GLU A 127 -16.208 -48.184 -1.430 1.00 0.00 C ATOM 1905 O GLU A 127 -15.925 -48.266 -0.234 1.00 0.00 O ATOM 1906 CB GLU A 127 -15.079 -48.263 -3.665 1.00 0.00 C ATOM 1907 CG GLU A 127 -15.624 -47.606 -4.923 1.00 0.00 C ATOM 1908 CD GLU A 127 -15.232 -48.351 -6.184 1.00 0.00 C ATOM 1909 OE1 GLU A 127 -14.029 -48.637 -6.356 1.00 0.00 O ATOM 1910 OE2 GLU A 127 -16.129 -48.649 -7.001 1.00 0.00 O ATOM 0 H GLU A 127 -13.659 -47.850 -1.155 1.00 0.00 H new ATOM 0 HA GLU A 127 -15.781 -46.493 -2.664 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -14.012 -48.443 -3.792 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -15.554 -49.236 -3.538 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -16.711 -47.553 -4.859 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -15.258 -46.581 -4.982 1.00 0.00 H new ATOM 1917 N LYS A 128 -17.300 -48.728 -1.955 1.00 0.00 N ATOM 1918 CA LYS A 128 -18.254 -49.472 -1.140 1.00 0.00 C ATOM 1919 C LYS A 128 -18.851 -48.585 -0.053 1.00 0.00 C ATOM 1920 O LYS A 128 -18.153 -48.156 0.866 1.00 0.00 O ATOM 1921 CB LYS A 128 -17.576 -50.689 -0.507 1.00 0.00 C ATOM 1922 CG LYS A 128 -17.383 -51.848 -1.472 1.00 0.00 C ATOM 1923 CD LYS A 128 -18.402 -52.951 -1.231 1.00 0.00 C ATOM 1924 CE LYS A 128 -19.600 -52.814 -2.156 1.00 0.00 C ATOM 1925 NZ LYS A 128 -19.289 -53.268 -3.540 1.00 0.00 N ATOM 0 H LYS A 128 -17.547 -48.668 -2.943 1.00 0.00 H new ATOM 0 HA LYS A 128 -19.061 -49.811 -1.790 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -16.605 -50.390 -0.113 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -18.173 -51.028 0.340 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -17.471 -51.488 -2.497 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -16.376 -52.251 -1.361 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -17.932 -53.922 -1.384 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -18.736 -52.919 -0.194 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -20.432 -53.397 -1.761 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -19.923 -51.773 -2.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -19.959 -52.834 -4.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -18.320 -52.985 -3.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -19.371 -54.303 -3.592 1.00 0.00 H new ATOM 1939 N SER A 129 -20.148 -48.313 -0.164 1.00 0.00 N ATOM 1940 CA SER A 129 -20.839 -47.477 0.811 1.00 0.00 C ATOM 1941 C SER A 129 -22.326 -47.811 0.857 1.00 0.00 C ATOM 1942 O SER A 129 -22.898 -47.993 1.932 1.00 0.00 O ATOM 1943 CB SER A 129 -20.648 -45.998 0.471 1.00 0.00 C ATOM 1944 OG SER A 129 -21.457 -45.176 1.295 1.00 0.00 O ATOM 0 H SER A 129 -20.741 -48.659 -0.919 1.00 0.00 H new ATOM 0 HA SER A 129 -20.409 -47.676 1.793 1.00 0.00 H new ATOM 0 HB2 SER A 129 -19.600 -45.725 0.597 1.00 0.00 H new ATOM 0 HB3 SER A 129 -20.898 -45.827 -0.576 1.00 0.00 H new ATOM 0 HG SER A 129 -21.315 -44.236 1.059 1.00 0.00 H new ATOM 1950 N GLU A 130 -22.947 -47.890 -0.316 1.00 0.00 N ATOM 1951 CA GLU A 130 -24.369 -48.203 -0.409 1.00 0.00 C ATOM 1952 C GLU A 130 -24.585 -49.592 -0.999 1.00 0.00 C ATOM 1953 O GLU A 130 -23.680 -50.167 -1.605 1.00 0.00 O ATOM 1954 CB GLU A 130 -25.087 -47.157 -1.263 1.00 0.00 C ATOM 1955 CG GLU A 130 -25.559 -45.946 -0.473 1.00 0.00 C ATOM 1956 CD GLU A 130 -26.652 -45.175 -1.187 1.00 0.00 C ATOM 1957 OE1 GLU A 130 -26.318 -44.313 -2.026 1.00 0.00 O ATOM 1958 OE2 GLU A 130 -27.841 -45.433 -0.905 1.00 0.00 O ATOM 0 H GLU A 130 -22.488 -47.742 -1.215 1.00 0.00 H new ATOM 0 HA GLU A 130 -24.784 -48.189 0.599 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -24.416 -46.825 -2.055 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -25.946 -47.622 -1.747 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -25.926 -46.272 0.500 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -24.713 -45.284 -0.289 1.00 0.00 H new ATOM 1965 N ALA A 131 -25.788 -50.127 -0.818 1.00 0.00 N ATOM 1966 CA ALA A 131 -26.123 -51.449 -1.333 1.00 0.00 C ATOM 1967 C ALA A 131 -25.210 -52.516 -0.741 1.00 0.00 C ATOM 1968 O ALA A 131 -24.498 -52.208 0.239 1.00 0.00 O ATOM 1969 CB ALA A 131 -26.037 -51.460 -2.853 1.00 0.00 C ATOM 1970 OXT ALA A 131 -25.213 -53.652 -1.261 1.00 0.00 O ATOM 0 H ALA A 131 -26.547 -49.665 -0.318 1.00 0.00 H new ATOM 0 HA ALA A 131 -27.146 -51.680 -1.036 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -26.290 -52.453 -3.225 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -26.736 -50.731 -3.262 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -25.024 -51.204 -3.162 1.00 0.00 H new TER 1976 ALA A 131