USER MOD reduce.3.24.130724 H: found=0, std=0, add=891, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 892 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 NoAdj-H: B 219 HIS HD1 : B 219 HIS ND1 : B 301 ZNZN :(H bumps) USER MOD Set 1.1: B 198 GLN : amide:sc= 0.313 X(o=0.62,f=0.29) USER MOD Set 1.2: B 200 THR OG1 : rot 180:sc= 0.303 USER MOD Set 2.1: A 6 LYS NZ :NH3+ -119:sc= 1.26 (180deg=0) USER MOD Set 2.2: A 12 THR OG1 : rot 180:sc= 1.07 USER MOD Set 3.1: A 7 THR OG1 : rot 139:sc= 0.171 USER MOD Set 3.2: A 9 THR OG1 : rot 180:sc= 0.777 USER MOD Single : A 0 HIS : no HE2:sc= 0.0107 X(o=0.011,f=-0.46) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= -0.0697 K(o=-0.07,f=-3.6!) USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A -2 GLY N :NH3+ 142:sc= 0.0242 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 150:sc= -1.09 (180deg=-2.29!) USER MOD Single : A 14 THR OG1 : rot -78:sc= 0.185 USER MOD Single : A 20 SER OG : rot -41:sc= 0.354 USER MOD Single : A 22 THR OG1 : rot 35:sc= 0.0991 USER MOD Single : A 25 ASN : amide:sc= -0.261 K(o=-0.26,f=-2.2) USER MOD Single : A 27 LYS NZ :NH3+ -143:sc= 0.00697 (180deg=-1.19!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.615 X(o=-0.62,f=-0.2) USER MOD Single : A 33 LYS NZ :NH3+ -152:sc= 0.0239 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -2.1! C(o=-2.1!,f=-4.8!) USER MOD Single : A 41 GLN : amide:sc= -6.28 K(o=-6.3,f=-4.7!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.325 K(o=-0.32,f=-1.2) USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.0018 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -77:sc= 0.0381 USER MOD Single : A 60 ASN : amide:sc= -0.186 X(o=-0.19,f=0) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -159:sc= 0.915 (180deg=0.666) USER MOD Single : A 65 SER OG : rot -120:sc= 0.185 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 196 SER OG : rot 50:sc= 0.134 USER MOD Single : B 201 LYS NZ :NH3+ 163:sc= 0.995 (180deg=0.793) USER MOD Single : B 210 ASN : amide:sc= -0.238 K(o=-0.24,f=-2.9!) USER MOD Single : B 214 SER OG : rot 180:sc= -0.0129 USER MOD Single : B 215 HIS : no HD1:sc=-0.00454 X(o=-0.0045,f=-0.19) USER MOD Single : B 217 ASN : amide:sc= -0.404 K(o=-0.4,f=-2.9!) USER MOD Single : B 218 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0224) USER MOD Single : B 222 SER OG : rot 180:sc= 0 USER MOD Single : B 225 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -2 3.546 0.499 -0.749 1.00 0.00 N ATOM 2 CA GLY A -2 2.584 1.330 -1.489 1.00 0.00 C ATOM 3 C GLY A -2 3.192 2.660 -1.907 1.00 0.00 C ATOM 4 O GLY A -2 3.972 3.239 -1.142 1.00 0.00 O ATOM 0 H1 GLY A -2 3.054 -0.003 0.018 1.00 0.00 H new ATOM 0 H2 GLY A -2 3.976 -0.193 -1.395 1.00 0.00 H new ATOM 0 H3 GLY A -2 4.289 1.104 -0.345 1.00 0.00 H new ATOM 0 HA2 GLY A -2 2.244 0.792 -2.374 1.00 0.00 H new ATOM 0 HA3 GLY A -2 1.706 1.510 -0.868 1.00 0.00 H new ATOM 10 N SER A -1 2.808 3.152 -3.109 1.00 0.00 N ATOM 11 CA SER A -1 3.353 4.387 -3.702 1.00 0.00 C ATOM 12 C SER A -1 2.949 5.614 -2.855 1.00 0.00 C ATOM 13 O SER A -1 1.816 6.100 -2.932 1.00 0.00 O ATOM 14 CB SER A -1 2.864 4.526 -5.165 1.00 0.00 C ATOM 15 OG SER A -1 3.220 3.388 -5.929 1.00 0.00 O ATOM 0 H SER A -1 2.107 2.697 -3.694 1.00 0.00 H new ATOM 0 HA SER A -1 4.442 4.334 -3.709 1.00 0.00 H new ATOM 0 HB2 SER A -1 1.782 4.654 -5.180 1.00 0.00 H new ATOM 0 HB3 SER A -1 3.297 5.420 -5.614 1.00 0.00 H new ATOM 0 HG SER A -1 2.899 3.498 -6.848 1.00 0.00 H new ATOM 21 N HIS A 0 3.870 6.050 -1.987 1.00 0.00 N ATOM 22 CA HIS A 0 3.668 7.176 -1.066 1.00 0.00 C ATOM 23 C HIS A 0 4.651 8.314 -1.384 1.00 0.00 C ATOM 24 O HIS A 0 5.754 8.080 -1.891 1.00 0.00 O ATOM 25 CB HIS A 0 3.854 6.705 0.399 1.00 0.00 C ATOM 26 CG HIS A 0 2.876 5.648 0.870 1.00 0.00 C ATOM 27 ND1 HIS A 0 1.717 5.314 0.196 1.00 0.00 N ATOM 28 CD2 HIS A 0 2.899 4.855 1.965 1.00 0.00 C ATOM 29 CE1 HIS A 0 1.083 4.373 0.859 1.00 0.00 C ATOM 30 NE2 HIS A 0 1.778 4.075 1.933 1.00 0.00 N ATOM 0 H HIS A 0 4.793 5.623 -1.903 1.00 0.00 H new ATOM 0 HA HIS A 0 2.652 7.550 -1.192 1.00 0.00 H new ATOM 0 HB2 HIS A 0 4.866 6.316 0.512 1.00 0.00 H new ATOM 0 HB3 HIS A 0 3.770 7.572 1.055 1.00 0.00 H new ATOM 0 HD1 HIS A 0 1.403 5.732 -0.679 1.00 0.00 H new ATOM 0 HD2 HIS A 0 3.665 4.841 2.727 1.00 0.00 H new ATOM 0 HE1 HIS A 0 0.146 3.920 0.569 1.00 0.00 H new ATOM 39 N MET A 1 4.240 9.540 -1.049 1.00 0.00 N ATOM 40 CA MET A 1 5.029 10.765 -1.271 1.00 0.00 C ATOM 41 C MET A 1 5.695 11.213 0.039 1.00 0.00 C ATOM 42 O MET A 1 5.531 10.579 1.083 1.00 0.00 O ATOM 43 CB MET A 1 4.101 11.876 -1.831 1.00 0.00 C ATOM 44 CG MET A 1 3.464 11.520 -3.177 1.00 0.00 C ATOM 45 SD MET A 1 4.712 11.246 -4.454 1.00 0.00 S ATOM 46 CE MET A 1 3.708 10.793 -5.862 1.00 0.00 C ATOM 0 H MET A 1 3.337 9.717 -0.609 1.00 0.00 H new ATOM 0 HA MET A 1 5.818 10.566 -1.996 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.312 12.078 -1.107 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.675 12.796 -1.942 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.854 10.623 -3.065 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.796 12.323 -3.487 1.00 0.00 H new ATOM 0 HE1 MET A 1 4.351 10.597 -6.720 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.134 9.897 -5.626 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.026 11.609 -6.100 1.00 0.00 H new ATOM 56 N GLN A 2 6.466 12.302 -0.037 1.00 0.00 N ATOM 57 CA GLN A 2 7.106 12.929 1.127 1.00 0.00 C ATOM 58 C GLN A 2 6.438 14.269 1.427 1.00 0.00 C ATOM 59 O GLN A 2 6.019 14.968 0.512 1.00 0.00 O ATOM 60 CB GLN A 2 8.625 13.145 0.896 1.00 0.00 C ATOM 61 CG GLN A 2 9.456 11.841 0.792 1.00 0.00 C ATOM 62 CD GLN A 2 9.629 11.280 -0.622 1.00 0.00 C ATOM 63 OE1 GLN A 2 8.772 11.425 -1.496 1.00 0.00 O ATOM 64 NE2 GLN A 2 10.750 10.621 -0.853 1.00 0.00 N ATOM 0 H GLN A 2 6.666 12.779 -0.916 1.00 0.00 H new ATOM 0 HA GLN A 2 6.985 12.256 1.976 1.00 0.00 H new ATOM 0 HB2 GLN A 2 8.761 13.721 -0.020 1.00 0.00 H new ATOM 0 HB3 GLN A 2 9.021 13.748 1.713 1.00 0.00 H new ATOM 0 HG2 GLN A 2 10.444 12.026 1.214 1.00 0.00 H new ATOM 0 HG3 GLN A 2 8.983 11.079 1.411 1.00 0.00 H new ATOM 0 HE21 GLN A 2 11.442 10.516 -0.111 1.00 0.00 H new ATOM 0 HE22 GLN A 2 10.924 10.217 -1.773 1.00 0.00 H new ATOM 73 N ILE A 3 6.331 14.599 2.723 1.00 0.00 N ATOM 74 CA ILE A 3 5.918 15.942 3.204 1.00 0.00 C ATOM 75 C ILE A 3 6.827 16.362 4.365 1.00 0.00 C ATOM 76 O ILE A 3 7.322 15.518 5.121 1.00 0.00 O ATOM 77 CB ILE A 3 4.391 16.053 3.653 1.00 0.00 C ATOM 78 CG1 ILE A 3 3.979 14.933 4.681 1.00 0.00 C ATOM 79 CG2 ILE A 3 3.446 16.077 2.424 1.00 0.00 C ATOM 80 CD1 ILE A 3 3.811 13.535 4.094 1.00 0.00 C ATOM 0 H ILE A 3 6.528 13.942 3.478 1.00 0.00 H new ATOM 0 HA ILE A 3 6.021 16.612 2.350 1.00 0.00 H new ATOM 0 HB ILE A 3 4.284 17.003 4.176 1.00 0.00 H new ATOM 0 HG12 ILE A 3 4.733 14.890 5.467 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.041 15.225 5.154 1.00 0.00 H new ATOM 0 HG21 ILE A 3 2.412 16.153 2.761 1.00 0.00 H new ATOM 0 HG22 ILE A 3 3.687 16.935 1.796 1.00 0.00 H new ATOM 0 HG23 ILE A 3 3.573 15.160 1.849 1.00 0.00 H new ATOM 0 HD11 ILE A 3 3.527 12.840 4.884 1.00 0.00 H new ATOM 0 HD12 ILE A 3 3.034 13.552 3.330 1.00 0.00 H new ATOM 0 HD13 ILE A 3 4.752 13.212 3.648 1.00 0.00 H new ATOM 92 N PHE A 4 7.030 17.683 4.484 1.00 0.00 N ATOM 93 CA PHE A 4 7.975 18.282 5.453 1.00 0.00 C ATOM 94 C PHE A 4 7.203 18.938 6.615 1.00 0.00 C ATOM 95 O PHE A 4 6.674 20.038 6.492 1.00 0.00 O ATOM 96 CB PHE A 4 8.888 19.315 4.730 1.00 0.00 C ATOM 97 CG PHE A 4 9.639 18.732 3.528 1.00 0.00 C ATOM 98 CD1 PHE A 4 10.685 17.829 3.715 1.00 0.00 C ATOM 99 CD2 PHE A 4 9.278 19.059 2.219 1.00 0.00 C ATOM 100 CE1 PHE A 4 11.361 17.291 2.636 1.00 0.00 C ATOM 101 CE2 PHE A 4 9.956 18.516 1.139 1.00 0.00 C ATOM 102 CZ PHE A 4 10.991 17.627 1.348 1.00 0.00 C ATOM 0 H PHE A 4 6.544 18.373 3.911 1.00 0.00 H new ATOM 0 HA PHE A 4 8.607 17.499 5.871 1.00 0.00 H new ATOM 0 HB2 PHE A 4 8.279 20.155 4.395 1.00 0.00 H new ATOM 0 HB3 PHE A 4 9.611 19.710 5.443 1.00 0.00 H new ATOM 0 HD1 PHE A 4 10.971 17.546 4.717 1.00 0.00 H new ATOM 0 HD2 PHE A 4 8.461 19.743 2.046 1.00 0.00 H new ATOM 0 HE1 PHE A 4 12.180 16.607 2.800 1.00 0.00 H new ATOM 0 HE2 PHE A 4 9.674 18.789 0.133 1.00 0.00 H new ATOM 0 HZ PHE A 4 11.511 17.195 0.506 1.00 0.00 H new ATOM 112 N VAL A 5 7.127 18.227 7.740 1.00 0.00 N ATOM 113 CA VAL A 5 6.509 18.726 8.977 1.00 0.00 C ATOM 114 C VAL A 5 7.627 19.266 9.891 1.00 0.00 C ATOM 115 O VAL A 5 8.485 18.517 10.329 1.00 0.00 O ATOM 116 CB VAL A 5 5.681 17.584 9.683 1.00 0.00 C ATOM 117 CG1 VAL A 5 5.139 18.038 11.046 1.00 0.00 C ATOM 118 CG2 VAL A 5 4.514 17.108 8.781 1.00 0.00 C ATOM 0 H VAL A 5 7.495 17.279 7.823 1.00 0.00 H new ATOM 0 HA VAL A 5 5.809 19.531 8.753 1.00 0.00 H new ATOM 0 HB VAL A 5 6.362 16.749 9.849 1.00 0.00 H new ATOM 0 HG11 VAL A 5 4.574 17.225 11.502 1.00 0.00 H new ATOM 0 HG12 VAL A 5 5.971 18.311 11.696 1.00 0.00 H new ATOM 0 HG13 VAL A 5 4.487 18.901 10.909 1.00 0.00 H new ATOM 0 HG21 VAL A 5 3.958 16.320 9.290 1.00 0.00 H new ATOM 0 HG22 VAL A 5 3.849 17.946 8.574 1.00 0.00 H new ATOM 0 HG23 VAL A 5 4.913 16.722 7.843 1.00 0.00 H new ATOM 128 N LYS A 6 7.606 20.578 10.135 1.00 0.00 N ATOM 129 CA LYS A 6 8.666 21.312 10.844 1.00 0.00 C ATOM 130 C LYS A 6 8.250 21.576 12.304 1.00 0.00 C ATOM 131 O LYS A 6 7.221 22.223 12.520 1.00 0.00 O ATOM 132 CB LYS A 6 8.893 22.674 10.117 1.00 0.00 C ATOM 133 CG LYS A 6 10.207 23.387 10.494 1.00 0.00 C ATOM 134 CD LYS A 6 11.431 22.722 9.837 1.00 0.00 C ATOM 135 CE LYS A 6 12.759 23.363 10.268 1.00 0.00 C ATOM 136 NZ LYS A 6 13.919 22.752 9.584 1.00 0.00 N ATOM 0 H LYS A 6 6.835 21.177 9.840 1.00 0.00 H new ATOM 0 HA LYS A 6 9.582 20.721 10.844 1.00 0.00 H new ATOM 0 HB2 LYS A 6 8.883 22.503 9.041 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.057 23.336 10.343 1.00 0.00 H new ATOM 0 HG2 LYS A 6 10.154 24.432 10.188 1.00 0.00 H new ATOM 0 HG3 LYS A 6 10.327 23.378 11.577 1.00 0.00 H new ATOM 0 HD2 LYS A 6 11.444 21.663 10.093 1.00 0.00 H new ATOM 0 HD3 LYS A 6 11.336 22.787 8.753 1.00 0.00 H new ATOM 0 HE2 LYS A 6 12.733 24.431 10.052 1.00 0.00 H new ATOM 0 HE3 LYS A 6 12.878 23.259 11.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 14.555 22.329 10.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 13.587 22.014 8.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 14.432 23.483 9.050 1.00 0.00 H new ATOM 150 N THR A 7 9.042 21.112 13.299 1.00 0.00 N ATOM 151 CA THR A 7 8.772 21.425 14.716 1.00 0.00 C ATOM 152 C THR A 7 9.071 22.898 15.022 1.00 0.00 C ATOM 153 O THR A 7 9.804 23.572 14.281 1.00 0.00 O ATOM 154 CB THR A 7 9.605 20.560 15.713 1.00 0.00 C ATOM 155 OG1 THR A 7 10.997 20.699 15.426 1.00 0.00 O ATOM 156 CG2 THR A 7 9.207 19.084 15.698 1.00 0.00 C ATOM 0 H THR A 7 9.863 20.527 13.146 1.00 0.00 H new ATOM 0 HA THR A 7 7.715 21.200 14.857 1.00 0.00 H new ATOM 0 HB THR A 7 9.392 20.931 16.716 1.00 0.00 H new ATOM 0 HG1 THR A 7 11.499 20.768 16.265 1.00 0.00 H new ATOM 0 HG21 THR A 7 9.821 18.534 16.411 1.00 0.00 H new ATOM 0 HG22 THR A 7 8.157 18.988 15.973 1.00 0.00 H new ATOM 0 HG23 THR A 7 9.359 18.676 14.699 1.00 0.00 H new ATOM 164 N LEU A 8 8.522 23.362 16.152 1.00 0.00 N ATOM 165 CA LEU A 8 8.838 24.678 16.723 1.00 0.00 C ATOM 166 C LEU A 8 10.274 24.703 17.301 1.00 0.00 C ATOM 167 O LEU A 8 10.841 25.775 17.505 1.00 0.00 O ATOM 168 CB LEU A 8 7.824 25.021 17.825 1.00 0.00 C ATOM 169 CG LEU A 8 6.325 25.072 17.413 1.00 0.00 C ATOM 170 CD1 LEU A 8 5.453 25.426 18.634 1.00 0.00 C ATOM 171 CD2 LEU A 8 6.085 26.058 16.240 1.00 0.00 C ATOM 0 H LEU A 8 7.843 22.833 16.699 1.00 0.00 H new ATOM 0 HA LEU A 8 8.779 25.421 15.928 1.00 0.00 H new ATOM 0 HB2 LEU A 8 7.931 24.288 18.624 1.00 0.00 H new ATOM 0 HB3 LEU A 8 8.094 25.991 18.244 1.00 0.00 H new ATOM 0 HG LEU A 8 6.036 24.083 17.056 1.00 0.00 H new ATOM 0 HD11 LEU A 8 4.405 25.459 18.335 1.00 0.00 H new ATOM 0 HD12 LEU A 8 5.586 24.670 19.408 1.00 0.00 H new ATOM 0 HD13 LEU A 8 5.750 26.400 19.023 1.00 0.00 H new ATOM 0 HD21 LEU A 8 5.026 26.065 15.982 1.00 0.00 H new ATOM 0 HD22 LEU A 8 6.392 27.060 16.538 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.668 25.742 15.374 1.00 0.00 H new ATOM 183 N THR A 9 10.828 23.501 17.587 1.00 0.00 N ATOM 184 CA THR A 9 12.228 23.333 18.038 1.00 0.00 C ATOM 185 C THR A 9 13.210 23.381 16.844 1.00 0.00 C ATOM 186 O THR A 9 14.428 23.348 17.037 1.00 0.00 O ATOM 187 CB THR A 9 12.401 22.006 18.852 1.00 0.00 C ATOM 188 OG1 THR A 9 11.905 20.891 18.096 1.00 0.00 O ATOM 189 CG2 THR A 9 11.670 22.072 20.210 1.00 0.00 C ATOM 0 H THR A 9 10.317 22.622 17.511 1.00 0.00 H new ATOM 0 HA THR A 9 12.466 24.167 18.699 1.00 0.00 H new ATOM 0 HB THR A 9 13.466 21.876 19.043 1.00 0.00 H new ATOM 0 HG1 THR A 9 12.020 20.067 18.614 1.00 0.00 H new ATOM 0 HG21 THR A 9 11.813 21.134 20.746 1.00 0.00 H new ATOM 0 HG22 THR A 9 12.075 22.893 20.802 1.00 0.00 H new ATOM 0 HG23 THR A 9 10.605 22.236 20.043 1.00 0.00 H new ATOM 197 N GLY A 10 12.659 23.448 15.614 1.00 0.00 N ATOM 198 CA GLY A 10 13.431 23.795 14.416 1.00 0.00 C ATOM 199 C GLY A 10 13.979 22.604 13.656 1.00 0.00 C ATOM 200 O GLY A 10 14.872 22.771 12.819 1.00 0.00 O ATOM 0 H GLY A 10 11.673 23.263 15.430 1.00 0.00 H new ATOM 0 HA2 GLY A 10 12.798 24.377 13.747 1.00 0.00 H new ATOM 0 HA3 GLY A 10 14.262 24.438 14.708 1.00 0.00 H new ATOM 204 N LYS A 11 13.464 21.400 13.944 1.00 0.00 N ATOM 205 CA LYS A 11 13.836 20.179 13.204 1.00 0.00 C ATOM 206 C LYS A 11 12.799 19.925 12.090 1.00 0.00 C ATOM 207 O LYS A 11 11.640 20.339 12.211 1.00 0.00 O ATOM 208 CB LYS A 11 13.960 18.941 14.153 1.00 0.00 C ATOM 209 CG LYS A 11 12.661 18.141 14.372 1.00 0.00 C ATOM 210 CD LYS A 11 12.832 16.850 15.213 1.00 0.00 C ATOM 211 CE LYS A 11 13.406 15.660 14.411 1.00 0.00 C ATOM 212 NZ LYS A 11 14.777 15.897 13.890 1.00 0.00 N ATOM 0 H LYS A 11 12.784 21.242 14.688 1.00 0.00 H new ATOM 0 HA LYS A 11 14.818 20.328 12.755 1.00 0.00 H new ATOM 0 HB2 LYS A 11 14.716 18.269 13.748 1.00 0.00 H new ATOM 0 HB3 LYS A 11 14.324 19.283 15.122 1.00 0.00 H new ATOM 0 HG2 LYS A 11 11.932 18.785 14.863 1.00 0.00 H new ATOM 0 HG3 LYS A 11 12.246 17.873 13.400 1.00 0.00 H new ATOM 0 HD2 LYS A 11 13.490 17.060 16.056 1.00 0.00 H new ATOM 0 HD3 LYS A 11 11.865 16.565 15.627 1.00 0.00 H new ATOM 0 HE2 LYS A 11 13.417 14.775 15.048 1.00 0.00 H new ATOM 0 HE3 LYS A 11 12.742 15.443 13.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 15.287 14.992 13.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 14.720 16.326 12.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 15.286 16.539 14.531 1.00 0.00 H new ATOM 226 N THR A 12 13.225 19.267 11.007 1.00 0.00 N ATOM 227 CA THR A 12 12.316 18.813 9.938 1.00 0.00 C ATOM 228 C THR A 12 12.021 17.312 10.110 1.00 0.00 C ATOM 229 O THR A 12 12.908 16.530 10.484 1.00 0.00 O ATOM 230 CB THR A 12 12.933 19.060 8.527 1.00 0.00 C ATOM 231 OG1 THR A 12 13.265 20.439 8.364 1.00 0.00 O ATOM 232 CG2 THR A 12 11.980 18.636 7.386 1.00 0.00 C ATOM 0 H THR A 12 14.204 19.033 10.843 1.00 0.00 H new ATOM 0 HA THR A 12 11.392 19.386 10.015 1.00 0.00 H new ATOM 0 HB THR A 12 13.831 18.446 8.467 1.00 0.00 H new ATOM 0 HG1 THR A 12 13.653 20.579 7.475 1.00 0.00 H new ATOM 0 HG21 THR A 12 12.456 18.828 6.424 1.00 0.00 H new ATOM 0 HG22 THR A 12 11.757 17.573 7.475 1.00 0.00 H new ATOM 0 HG23 THR A 12 11.054 19.208 7.454 1.00 0.00 H new ATOM 240 N ILE A 13 10.769 16.931 9.845 1.00 0.00 N ATOM 241 CA ILE A 13 10.307 15.533 9.856 1.00 0.00 C ATOM 242 C ILE A 13 9.699 15.215 8.481 1.00 0.00 C ATOM 243 O ILE A 13 8.713 15.827 8.082 1.00 0.00 O ATOM 244 CB ILE A 13 9.251 15.255 10.998 1.00 0.00 C ATOM 245 CG1 ILE A 13 9.817 15.615 12.415 1.00 0.00 C ATOM 246 CG2 ILE A 13 8.788 13.797 10.972 1.00 0.00 C ATOM 247 CD1 ILE A 13 9.612 17.059 12.821 1.00 0.00 C ATOM 0 H ILE A 13 10.031 17.595 9.612 1.00 0.00 H new ATOM 0 HA ILE A 13 11.161 14.888 10.060 1.00 0.00 H new ATOM 0 HB ILE A 13 8.394 15.900 10.805 1.00 0.00 H new ATOM 0 HG12 ILE A 13 9.344 14.971 13.156 1.00 0.00 H new ATOM 0 HG13 ILE A 13 10.884 15.393 12.434 1.00 0.00 H new ATOM 0 HG21 ILE A 13 8.062 13.632 11.768 1.00 0.00 H new ATOM 0 HG22 ILE A 13 8.327 13.579 10.009 1.00 0.00 H new ATOM 0 HG23 ILE A 13 9.645 13.140 11.121 1.00 0.00 H new ATOM 0 HD11 ILE A 13 10.033 17.221 13.813 1.00 0.00 H new ATOM 0 HD12 ILE A 13 10.110 17.713 12.104 1.00 0.00 H new ATOM 0 HD13 ILE A 13 8.546 17.284 12.838 1.00 0.00 H new ATOM 259 N THR A 14 10.317 14.275 7.753 1.00 0.00 N ATOM 260 CA THR A 14 9.870 13.860 6.413 1.00 0.00 C ATOM 261 C THR A 14 9.102 12.531 6.514 1.00 0.00 C ATOM 262 O THR A 14 9.666 11.508 6.924 1.00 0.00 O ATOM 263 CB THR A 14 11.086 13.735 5.442 1.00 0.00 C ATOM 264 OG1 THR A 14 11.758 15.012 5.372 1.00 0.00 O ATOM 265 CG2 THR A 14 10.664 13.291 4.024 1.00 0.00 C ATOM 0 H THR A 14 11.146 13.777 8.078 1.00 0.00 H new ATOM 0 HA THR A 14 9.201 14.619 6.007 1.00 0.00 H new ATOM 0 HB THR A 14 11.753 12.967 5.833 1.00 0.00 H new ATOM 0 HG1 THR A 14 11.259 15.612 4.780 1.00 0.00 H new ATOM 0 HG21 THR A 14 11.546 13.219 3.388 1.00 0.00 H new ATOM 0 HG22 THR A 14 10.175 12.318 4.078 1.00 0.00 H new ATOM 0 HG23 THR A 14 9.973 14.022 3.605 1.00 0.00 H new ATOM 273 N LEU A 15 7.805 12.569 6.144 1.00 0.00 N ATOM 274 CA LEU A 15 6.885 11.417 6.261 1.00 0.00 C ATOM 275 C LEU A 15 6.654 10.812 4.890 1.00 0.00 C ATOM 276 O LEU A 15 6.668 11.522 3.887 1.00 0.00 O ATOM 277 CB LEU A 15 5.505 11.816 6.865 1.00 0.00 C ATOM 278 CG LEU A 15 5.530 12.623 8.197 1.00 0.00 C ATOM 279 CD1 LEU A 15 6.486 11.990 9.214 1.00 0.00 C ATOM 280 CD2 LEU A 15 5.870 14.106 7.967 1.00 0.00 C ATOM 0 H LEU A 15 7.364 13.402 5.754 1.00 0.00 H new ATOM 0 HA LEU A 15 7.354 10.699 6.934 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.966 12.403 6.122 1.00 0.00 H new ATOM 0 HB3 LEU A 15 4.930 10.905 7.030 1.00 0.00 H new ATOM 0 HG LEU A 15 4.523 12.583 8.612 1.00 0.00 H new ATOM 0 HD11 LEU A 15 6.481 12.577 10.133 1.00 0.00 H new ATOM 0 HD12 LEU A 15 6.163 10.972 9.432 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.495 11.971 8.802 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.876 14.630 8.923 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.853 14.186 7.503 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.122 14.554 7.313 1.00 0.00 H new ATOM 292 N GLU A 16 6.374 9.505 4.879 1.00 0.00 N ATOM 293 CA GLU A 16 6.172 8.729 3.651 1.00 0.00 C ATOM 294 C GLU A 16 4.684 8.359 3.521 1.00 0.00 C ATOM 295 O GLU A 16 4.292 7.229 3.833 1.00 0.00 O ATOM 296 CB GLU A 16 7.060 7.453 3.676 1.00 0.00 C ATOM 297 CG GLU A 16 8.548 7.710 3.961 1.00 0.00 C ATOM 298 CD GLU A 16 9.206 8.717 2.999 1.00 0.00 C ATOM 299 OE1 GLU A 16 9.289 8.431 1.783 1.00 0.00 O ATOM 300 OE2 GLU A 16 9.668 9.783 3.468 1.00 0.00 O ATOM 0 H GLU A 16 6.280 8.951 5.730 1.00 0.00 H new ATOM 0 HA GLU A 16 6.462 9.327 2.787 1.00 0.00 H new ATOM 0 HB2 GLU A 16 6.672 6.772 4.433 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.971 6.946 2.715 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.654 8.077 4.982 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.087 6.764 3.905 1.00 0.00 H new ATOM 307 N VAL A 17 3.846 9.333 3.108 1.00 0.00 N ATOM 308 CA VAL A 17 2.388 9.114 2.928 1.00 0.00 C ATOM 309 C VAL A 17 1.912 9.862 1.672 1.00 0.00 C ATOM 310 O VAL A 17 2.638 10.687 1.109 1.00 0.00 O ATOM 311 CB VAL A 17 1.496 9.564 4.172 1.00 0.00 C ATOM 312 CG1 VAL A 17 2.053 9.081 5.531 1.00 0.00 C ATOM 313 CG2 VAL A 17 1.250 11.084 4.186 1.00 0.00 C ATOM 0 H VAL A 17 4.151 10.282 2.892 1.00 0.00 H new ATOM 0 HA VAL A 17 2.255 8.037 2.829 1.00 0.00 H new ATOM 0 HB VAL A 17 0.535 9.067 4.035 1.00 0.00 H new ATOM 0 HG11 VAL A 17 1.399 9.421 6.334 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.100 7.992 5.538 1.00 0.00 H new ATOM 0 HG13 VAL A 17 3.053 9.489 5.680 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.639 11.346 5.050 1.00 0.00 H new ATOM 0 HG22 VAL A 17 2.205 11.607 4.246 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.732 11.377 3.273 1.00 0.00 H new ATOM 323 N GLU A 18 0.673 9.595 1.277 1.00 0.00 N ATOM 324 CA GLU A 18 0.045 10.214 0.098 1.00 0.00 C ATOM 325 C GLU A 18 -0.711 11.490 0.536 1.00 0.00 C ATOM 326 O GLU A 18 -1.067 11.613 1.716 1.00 0.00 O ATOM 327 CB GLU A 18 -0.931 9.186 -0.553 1.00 0.00 C ATOM 328 CG GLU A 18 -0.353 7.758 -0.606 1.00 0.00 C ATOM 329 CD GLU A 18 -1.218 6.743 -1.371 1.00 0.00 C ATOM 330 OE1 GLU A 18 -1.374 6.899 -2.596 1.00 0.00 O ATOM 331 OE2 GLU A 18 -1.714 5.772 -0.754 1.00 0.00 O ATOM 0 H GLU A 18 0.064 8.938 1.765 1.00 0.00 H new ATOM 0 HA GLU A 18 0.802 10.494 -0.635 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.865 9.174 0.009 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.172 9.512 -1.565 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.633 7.797 -1.069 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.212 7.399 0.414 1.00 0.00 H new ATOM 338 N PRO A 19 -0.983 12.469 -0.389 1.00 0.00 N ATOM 339 CA PRO A 19 -1.916 13.582 -0.089 1.00 0.00 C ATOM 340 C PRO A 19 -3.343 13.052 0.215 1.00 0.00 C ATOM 341 O PRO A 19 -4.062 13.621 1.027 1.00 0.00 O ATOM 342 CB PRO A 19 -1.864 14.467 -1.369 1.00 0.00 C ATOM 343 CG PRO A 19 -1.334 13.562 -2.442 1.00 0.00 C ATOM 344 CD PRO A 19 -0.386 12.607 -1.748 1.00 0.00 C ATOM 0 HA PRO A 19 -1.640 14.145 0.802 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.852 14.848 -1.626 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -1.216 15.332 -1.226 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -2.144 13.021 -2.932 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.818 14.132 -3.214 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -0.330 11.648 -2.263 1.00 0.00 H new ATOM 0 HD3 PRO A 19 0.628 13.005 -1.705 1.00 0.00 H new ATOM 352 N SER A 20 -3.696 11.902 -0.390 1.00 0.00 N ATOM 353 CA SER A 20 -5.018 11.270 -0.238 1.00 0.00 C ATOM 354 C SER A 20 -4.957 10.124 0.800 1.00 0.00 C ATOM 355 O SER A 20 -5.846 9.273 0.838 1.00 0.00 O ATOM 356 CB SER A 20 -5.490 10.761 -1.629 1.00 0.00 C ATOM 357 OG SER A 20 -6.839 10.314 -1.613 1.00 0.00 O ATOM 0 H SER A 20 -3.067 11.383 -1.002 1.00 0.00 H new ATOM 0 HA SER A 20 -5.739 11.998 0.135 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.384 11.562 -2.361 1.00 0.00 H new ATOM 0 HB3 SER A 20 -4.844 9.945 -1.953 1.00 0.00 H new ATOM 0 HG SER A 20 -7.004 9.803 -0.794 1.00 0.00 H new ATOM 363 N ASP A 21 -3.922 10.132 1.676 1.00 0.00 N ATOM 364 CA ASP A 21 -3.712 9.068 2.683 1.00 0.00 C ATOM 365 C ASP A 21 -4.640 9.325 3.902 1.00 0.00 C ATOM 366 O ASP A 21 -5.813 8.932 3.856 1.00 0.00 O ATOM 367 CB ASP A 21 -2.204 9.009 3.060 1.00 0.00 C ATOM 368 CG ASP A 21 -1.776 7.735 3.803 1.00 0.00 C ATOM 369 OD1 ASP A 21 -2.020 7.636 5.018 1.00 0.00 O ATOM 370 OD2 ASP A 21 -1.185 6.838 3.166 1.00 0.00 O ATOM 0 H ASP A 21 -3.217 10.869 1.703 1.00 0.00 H new ATOM 0 HA ASP A 21 -3.978 8.090 2.282 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -1.612 9.098 2.149 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -1.965 9.873 3.681 1.00 0.00 H new ATOM 375 N THR A 22 -4.116 10.009 4.960 1.00 0.00 N ATOM 376 CA THR A 22 -4.889 10.470 6.139 1.00 0.00 C ATOM 377 C THR A 22 -3.939 11.140 7.156 1.00 0.00 C ATOM 378 O THR A 22 -2.795 10.701 7.324 1.00 0.00 O ATOM 379 CB THR A 22 -5.711 9.326 6.858 1.00 0.00 C ATOM 380 OG1 THR A 22 -6.434 9.857 7.987 1.00 0.00 O ATOM 381 CG2 THR A 22 -4.829 8.156 7.330 1.00 0.00 C ATOM 0 H THR A 22 -3.128 10.257 5.013 1.00 0.00 H new ATOM 0 HA THR A 22 -5.621 11.183 5.761 1.00 0.00 H new ATOM 0 HB THR A 22 -6.405 8.937 6.113 1.00 0.00 H new ATOM 0 HG1 THR A 22 -6.729 10.770 7.787 1.00 0.00 H new ATOM 0 HG21 THR A 22 -5.451 7.404 7.815 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.325 7.711 6.472 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.086 8.523 8.037 1.00 0.00 H new ATOM 389 N ILE A 23 -4.441 12.201 7.825 1.00 0.00 N ATOM 390 CA ILE A 23 -3.695 12.985 8.841 1.00 0.00 C ATOM 391 C ILE A 23 -3.292 12.104 10.045 1.00 0.00 C ATOM 392 O ILE A 23 -2.197 12.270 10.608 1.00 0.00 O ATOM 393 CB ILE A 23 -4.555 14.208 9.365 1.00 0.00 C ATOM 394 CG1 ILE A 23 -4.948 15.193 8.210 1.00 0.00 C ATOM 395 CG2 ILE A 23 -3.844 14.972 10.509 1.00 0.00 C ATOM 396 CD1 ILE A 23 -3.776 15.874 7.514 1.00 0.00 C ATOM 0 H ILE A 23 -5.390 12.544 7.674 1.00 0.00 H new ATOM 0 HA ILE A 23 -2.795 13.359 8.353 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.474 13.781 9.767 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -5.523 14.643 7.465 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -5.605 15.962 8.617 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -4.470 15.802 10.837 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.671 14.295 11.346 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.889 15.357 10.151 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -4.151 16.534 6.732 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -3.210 16.457 8.241 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -3.127 15.119 7.071 1.00 0.00 H new ATOM 408 N GLU A 24 -4.204 11.185 10.429 1.00 0.00 N ATOM 409 CA GLU A 24 -3.990 10.217 11.526 1.00 0.00 C ATOM 410 C GLU A 24 -2.678 9.434 11.324 1.00 0.00 C ATOM 411 O GLU A 24 -1.908 9.199 12.275 1.00 0.00 O ATOM 412 CB GLU A 24 -5.183 9.227 11.590 1.00 0.00 C ATOM 413 CG GLU A 24 -5.066 8.141 12.682 1.00 0.00 C ATOM 414 CD GLU A 24 -6.194 7.102 12.616 1.00 0.00 C ATOM 415 OE1 GLU A 24 -6.158 6.238 11.715 1.00 0.00 O ATOM 416 OE2 GLU A 24 -7.122 7.150 13.445 1.00 0.00 O ATOM 0 H GLU A 24 -5.117 11.094 9.983 1.00 0.00 H new ATOM 0 HA GLU A 24 -3.920 10.770 12.462 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -6.099 9.794 11.758 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -5.284 8.738 10.621 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -4.106 7.634 12.582 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -5.074 8.617 13.663 1.00 0.00 H new ATOM 423 N ASN A 25 -2.426 9.064 10.060 1.00 0.00 N ATOM 424 CA ASN A 25 -1.242 8.289 9.683 1.00 0.00 C ATOM 425 C ASN A 25 0.000 9.164 9.753 1.00 0.00 C ATOM 426 O ASN A 25 1.008 8.750 10.304 1.00 0.00 O ATOM 427 CB ASN A 25 -1.397 7.711 8.264 1.00 0.00 C ATOM 428 CG ASN A 25 -0.416 6.580 7.967 1.00 0.00 C ATOM 429 OD1 ASN A 25 0.637 6.780 7.370 1.00 0.00 O ATOM 430 ND2 ASN A 25 -0.738 5.389 8.437 1.00 0.00 N ATOM 0 H ASN A 25 -3.036 9.294 9.276 1.00 0.00 H new ATOM 0 HA ASN A 25 -1.137 7.461 10.384 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -2.415 7.343 8.137 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -1.253 8.509 7.536 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -0.103 4.601 8.308 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -1.622 5.257 8.929 1.00 0.00 H new ATOM 437 N VAL A 26 -0.125 10.396 9.212 1.00 0.00 N ATOM 438 CA VAL A 26 0.982 11.380 9.137 1.00 0.00 C ATOM 439 C VAL A 26 1.588 11.637 10.525 1.00 0.00 C ATOM 440 O VAL A 26 2.800 11.581 10.690 1.00 0.00 O ATOM 441 CB VAL A 26 0.520 12.764 8.520 1.00 0.00 C ATOM 442 CG1 VAL A 26 1.696 13.776 8.392 1.00 0.00 C ATOM 443 CG2 VAL A 26 -0.176 12.553 7.164 1.00 0.00 C ATOM 0 H VAL A 26 -0.999 10.739 8.813 1.00 0.00 H new ATOM 0 HA VAL A 26 1.732 10.940 8.479 1.00 0.00 H new ATOM 0 HB VAL A 26 -0.199 13.200 9.214 1.00 0.00 H new ATOM 0 HG11 VAL A 26 1.328 14.709 7.964 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.118 13.970 9.378 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.466 13.358 7.744 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -0.484 13.517 6.759 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.515 12.073 6.471 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -1.052 11.919 7.300 1.00 0.00 H new ATOM 453 N LYS A 27 0.716 11.875 11.520 1.00 0.00 N ATOM 454 CA LYS A 27 1.139 12.177 12.900 1.00 0.00 C ATOM 455 C LYS A 27 1.752 10.939 13.589 1.00 0.00 C ATOM 456 O LYS A 27 2.700 11.058 14.390 1.00 0.00 O ATOM 457 CB LYS A 27 -0.035 12.761 13.722 1.00 0.00 C ATOM 458 CG LYS A 27 -1.213 11.812 13.979 1.00 0.00 C ATOM 459 CD LYS A 27 -2.395 12.517 14.680 1.00 0.00 C ATOM 460 CE LYS A 27 -3.009 13.633 13.813 1.00 0.00 C ATOM 461 NZ LYS A 27 -4.107 14.350 14.515 1.00 0.00 N ATOM 0 H LYS A 27 -0.296 11.864 11.392 1.00 0.00 H new ATOM 0 HA LYS A 27 1.920 12.935 12.850 1.00 0.00 H new ATOM 0 HB2 LYS A 27 0.352 13.096 14.684 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -0.411 13.644 13.205 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -1.553 11.394 13.031 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -0.876 10.977 14.593 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -3.163 11.782 14.919 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -2.054 12.940 15.625 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -2.231 14.345 13.536 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -3.392 13.203 12.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -4.855 14.591 13.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -4.500 13.739 15.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -3.734 15.222 14.943 1.00 0.00 H new ATOM 475 N ALA A 28 1.218 9.748 13.245 1.00 0.00 N ATOM 476 CA ALA A 28 1.801 8.462 13.662 1.00 0.00 C ATOM 477 C ALA A 28 3.168 8.225 12.971 1.00 0.00 C ATOM 478 O ALA A 28 4.022 7.508 13.502 1.00 0.00 O ATOM 479 CB ALA A 28 0.814 7.321 13.366 1.00 0.00 C ATOM 0 H ALA A 28 0.377 9.654 12.675 1.00 0.00 H new ATOM 0 HA ALA A 28 1.983 8.487 14.736 1.00 0.00 H new ATOM 0 HB1 ALA A 28 1.251 6.372 13.677 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -0.113 7.490 13.914 1.00 0.00 H new ATOM 0 HB3 ALA A 28 0.603 7.291 12.297 1.00 0.00 H new ATOM 485 N LYS A 29 3.372 8.858 11.791 1.00 0.00 N ATOM 486 CA LYS A 29 4.652 8.791 11.071 1.00 0.00 C ATOM 487 C LYS A 29 5.690 9.733 11.720 1.00 0.00 C ATOM 488 O LYS A 29 6.868 9.435 11.665 1.00 0.00 O ATOM 489 CB LYS A 29 4.521 9.109 9.551 1.00 0.00 C ATOM 490 CG LYS A 29 3.628 8.184 8.689 1.00 0.00 C ATOM 491 CD LYS A 29 3.891 6.656 8.876 1.00 0.00 C ATOM 492 CE LYS A 29 2.867 5.981 9.811 1.00 0.00 C ATOM 493 NZ LYS A 29 3.158 4.539 10.013 1.00 0.00 N ATOM 0 H LYS A 29 2.661 9.420 11.323 1.00 0.00 H new ATOM 0 HA LYS A 29 4.992 7.758 11.150 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.140 10.126 9.454 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.523 9.102 9.121 1.00 0.00 H new ATOM 0 HG2 LYS A 29 2.584 8.390 8.924 1.00 0.00 H new ATOM 0 HG3 LYS A 29 3.774 8.437 7.639 1.00 0.00 H new ATOM 0 HD2 LYS A 29 3.865 6.166 7.903 1.00 0.00 H new ATOM 0 HD3 LYS A 29 4.894 6.512 9.279 1.00 0.00 H new ATOM 0 HE2 LYS A 29 2.868 6.489 10.775 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.867 6.093 9.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 2.445 4.127 10.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 3.132 4.048 9.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 4.102 4.431 10.436 1.00 0.00 H new ATOM 507 N ILE A 30 5.263 10.889 12.301 1.00 0.00 N ATOM 508 CA ILE A 30 6.167 11.731 13.139 1.00 0.00 C ATOM 509 C ILE A 30 6.738 10.893 14.305 1.00 0.00 C ATOM 510 O ILE A 30 7.940 10.945 14.607 1.00 0.00 O ATOM 511 CB ILE A 30 5.454 13.045 13.688 1.00 0.00 C ATOM 512 CG1 ILE A 30 5.388 14.192 12.606 1.00 0.00 C ATOM 513 CG2 ILE A 30 6.113 13.585 14.984 1.00 0.00 C ATOM 514 CD1 ILE A 30 4.290 14.078 11.578 1.00 0.00 C ATOM 0 H ILE A 30 4.316 11.255 12.208 1.00 0.00 H new ATOM 0 HA ILE A 30 6.982 12.066 12.498 1.00 0.00 H new ATOM 0 HB ILE A 30 4.436 12.739 13.927 1.00 0.00 H new ATOM 0 HG12 ILE A 30 5.275 15.145 13.124 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.344 14.225 12.083 1.00 0.00 H new ATOM 0 HG21 ILE A 30 5.587 14.481 15.314 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.059 12.825 15.764 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.157 13.829 14.787 1.00 0.00 H new ATOM 0 HD11 ILE A 30 4.347 14.922 10.890 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.407 13.148 11.022 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.322 14.082 12.078 1.00 0.00 H new ATOM 526 N GLN A 31 5.856 10.098 14.924 1.00 0.00 N ATOM 527 CA GLN A 31 6.227 9.139 15.979 1.00 0.00 C ATOM 528 C GLN A 31 7.201 8.052 15.448 1.00 0.00 C ATOM 529 O GLN A 31 8.038 7.530 16.192 1.00 0.00 O ATOM 530 CB GLN A 31 4.941 8.507 16.555 1.00 0.00 C ATOM 531 CG GLN A 31 5.165 7.543 17.730 1.00 0.00 C ATOM 532 CD GLN A 31 3.872 6.943 18.306 1.00 0.00 C ATOM 533 OE1 GLN A 31 3.793 6.653 19.494 1.00 0.00 O ATOM 534 NE2 GLN A 31 2.857 6.732 17.479 1.00 0.00 N ATOM 0 H GLN A 31 4.859 10.100 14.708 1.00 0.00 H new ATOM 0 HA GLN A 31 6.756 9.669 16.771 1.00 0.00 H new ATOM 0 HB2 GLN A 31 4.275 9.306 16.881 1.00 0.00 H new ATOM 0 HB3 GLN A 31 4.428 7.971 15.757 1.00 0.00 H new ATOM 0 HG2 GLN A 31 5.814 6.731 17.401 1.00 0.00 H new ATOM 0 HG3 GLN A 31 5.693 8.072 18.524 1.00 0.00 H new ATOM 0 HE21 GLN A 31 2.942 6.980 16.493 1.00 0.00 H new ATOM 0 HE22 GLN A 31 1.991 6.322 17.829 1.00 0.00 H new ATOM 543 N ASP A 32 7.067 7.727 14.158 1.00 0.00 N ATOM 544 CA ASP A 32 7.971 6.792 13.451 1.00 0.00 C ATOM 545 C ASP A 32 9.357 7.435 13.162 1.00 0.00 C ATOM 546 O ASP A 32 10.369 6.726 13.127 1.00 0.00 O ATOM 547 CB ASP A 32 7.276 6.334 12.133 1.00 0.00 C ATOM 548 CG ASP A 32 8.101 5.385 11.249 1.00 0.00 C ATOM 549 OD1 ASP A 32 8.358 4.246 11.670 1.00 0.00 O ATOM 550 OD2 ASP A 32 8.491 5.775 10.126 1.00 0.00 O ATOM 0 H ASP A 32 6.327 8.103 13.565 1.00 0.00 H new ATOM 0 HA ASP A 32 8.161 5.928 14.088 1.00 0.00 H new ATOM 0 HB2 ASP A 32 6.338 5.841 12.389 1.00 0.00 H new ATOM 0 HB3 ASP A 32 7.023 7.219 11.549 1.00 0.00 H new ATOM 555 N LYS A 33 9.398 8.778 12.984 1.00 0.00 N ATOM 556 CA LYS A 33 10.635 9.492 12.568 1.00 0.00 C ATOM 557 C LYS A 33 11.417 10.055 13.771 1.00 0.00 C ATOM 558 O LYS A 33 12.523 9.584 14.064 1.00 0.00 O ATOM 559 CB LYS A 33 10.306 10.647 11.584 1.00 0.00 C ATOM 560 CG LYS A 33 9.538 10.233 10.314 1.00 0.00 C ATOM 561 CD LYS A 33 10.258 9.159 9.484 1.00 0.00 C ATOM 562 CE LYS A 33 9.355 8.574 8.386 1.00 0.00 C ATOM 563 NZ LYS A 33 9.972 7.383 7.769 1.00 0.00 N ATOM 0 H LYS A 33 8.593 9.389 13.121 1.00 0.00 H new ATOM 0 HA LYS A 33 11.263 8.755 12.068 1.00 0.00 H new ATOM 0 HB2 LYS A 33 9.720 11.398 12.114 1.00 0.00 H new ATOM 0 HB3 LYS A 33 11.239 11.124 11.285 1.00 0.00 H new ATOM 0 HG2 LYS A 33 8.554 9.861 10.599 1.00 0.00 H new ATOM 0 HG3 LYS A 33 9.378 11.114 9.693 1.00 0.00 H new ATOM 0 HD2 LYS A 33 11.149 9.591 9.028 1.00 0.00 H new ATOM 0 HD3 LYS A 33 10.593 8.357 10.142 1.00 0.00 H new ATOM 0 HE2 LYS A 33 8.387 8.307 8.811 1.00 0.00 H new ATOM 0 HE3 LYS A 33 9.171 9.329 7.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 9.638 7.288 6.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 11.007 7.486 7.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 9.706 6.535 8.309 1.00 0.00 H new ATOM 577 N GLU A 34 10.844 11.072 14.466 1.00 0.00 N ATOM 578 CA GLU A 34 11.527 11.738 15.601 1.00 0.00 C ATOM 579 C GLU A 34 11.331 10.940 16.907 1.00 0.00 C ATOM 580 O GLU A 34 12.144 11.044 17.835 1.00 0.00 O ATOM 581 CB GLU A 34 11.079 13.220 15.774 1.00 0.00 C ATOM 582 CG GLU A 34 9.605 13.444 16.162 1.00 0.00 C ATOM 583 CD GLU A 34 9.275 14.932 16.452 1.00 0.00 C ATOM 584 OE1 GLU A 34 9.718 15.451 17.496 1.00 0.00 O ATOM 585 OE2 GLU A 34 8.595 15.579 15.636 1.00 0.00 O ATOM 0 H GLU A 34 9.917 11.445 14.260 1.00 0.00 H new ATOM 0 HA GLU A 34 12.592 11.756 15.368 1.00 0.00 H new ATOM 0 HB2 GLU A 34 11.708 13.681 16.536 1.00 0.00 H new ATOM 0 HB3 GLU A 34 11.271 13.747 14.840 1.00 0.00 H new ATOM 0 HG2 GLU A 34 8.964 13.086 15.356 1.00 0.00 H new ATOM 0 HG3 GLU A 34 9.372 12.847 17.044 1.00 0.00 H new ATOM 592 N GLY A 35 10.249 10.136 16.958 1.00 0.00 N ATOM 593 CA GLY A 35 9.992 9.223 18.078 1.00 0.00 C ATOM 594 C GLY A 35 9.025 9.792 19.105 1.00 0.00 C ATOM 595 O GLY A 35 8.918 9.259 20.218 1.00 0.00 O ATOM 0 H GLY A 35 9.537 10.105 16.228 1.00 0.00 H new ATOM 0 HA2 GLY A 35 9.591 8.287 17.690 1.00 0.00 H new ATOM 0 HA3 GLY A 35 10.936 8.986 18.569 1.00 0.00 H new ATOM 599 N ILE A 36 8.315 10.869 18.731 1.00 0.00 N ATOM 600 CA ILE A 36 7.402 11.595 19.638 1.00 0.00 C ATOM 601 C ILE A 36 5.934 11.234 19.277 1.00 0.00 C ATOM 602 O ILE A 36 5.529 11.404 18.122 1.00 0.00 O ATOM 603 CB ILE A 36 7.656 13.170 19.594 1.00 0.00 C ATOM 604 CG1 ILE A 36 8.920 13.581 20.453 1.00 0.00 C ATOM 605 CG2 ILE A 36 6.417 13.971 20.064 1.00 0.00 C ATOM 606 CD1 ILE A 36 10.270 13.118 19.928 1.00 0.00 C ATOM 0 H ILE A 36 8.356 11.263 17.791 1.00 0.00 H new ATOM 0 HA ILE A 36 7.599 11.286 20.665 1.00 0.00 H new ATOM 0 HB ILE A 36 7.848 13.421 18.551 1.00 0.00 H new ATOM 0 HG12 ILE A 36 8.939 14.668 20.535 1.00 0.00 H new ATOM 0 HG13 ILE A 36 8.791 13.187 21.461 1.00 0.00 H new ATOM 0 HG21 ILE A 36 6.635 15.038 20.018 1.00 0.00 H new ATOM 0 HG22 ILE A 36 5.570 13.745 19.416 1.00 0.00 H new ATOM 0 HG23 ILE A 36 6.173 13.695 21.090 1.00 0.00 H new ATOM 0 HD11 ILE A 36 11.058 13.459 20.599 1.00 0.00 H new ATOM 0 HD12 ILE A 36 10.285 12.029 19.874 1.00 0.00 H new ATOM 0 HD13 ILE A 36 10.436 13.533 18.934 1.00 0.00 H new ATOM 618 N PRO A 37 5.117 10.740 20.274 1.00 0.00 N ATOM 619 CA PRO A 37 3.743 10.226 20.022 1.00 0.00 C ATOM 620 C PRO A 37 2.743 11.349 19.657 1.00 0.00 C ATOM 621 O PRO A 37 3.000 12.505 19.997 1.00 0.00 O ATOM 622 CB PRO A 37 3.378 9.548 21.374 1.00 0.00 C ATOM 623 CG PRO A 37 4.147 10.315 22.397 1.00 0.00 C ATOM 624 CD PRO A 37 5.458 10.681 21.729 1.00 0.00 C ATOM 0 HA PRO A 37 3.698 9.550 19.168 1.00 0.00 H new ATOM 0 HB2 PRO A 37 2.306 9.596 21.565 1.00 0.00 H new ATOM 0 HB3 PRO A 37 3.656 8.494 21.377 1.00 0.00 H new ATOM 0 HG2 PRO A 37 3.603 11.207 22.709 1.00 0.00 H new ATOM 0 HG3 PRO A 37 4.316 9.715 23.291 1.00 0.00 H new ATOM 0 HD2 PRO A 37 5.837 11.637 22.090 1.00 0.00 H new ATOM 0 HD3 PRO A 37 6.229 9.937 21.929 1.00 0.00 H new ATOM 632 N PRO A 38 1.583 11.021 18.970 1.00 0.00 N ATOM 633 CA PRO A 38 0.505 12.006 18.637 1.00 0.00 C ATOM 634 C PRO A 38 -0.087 12.738 19.872 1.00 0.00 C ATOM 635 O PRO A 38 -0.751 13.772 19.732 1.00 0.00 O ATOM 636 CB PRO A 38 -0.573 11.144 17.905 1.00 0.00 C ATOM 637 CG PRO A 38 -0.249 9.727 18.274 1.00 0.00 C ATOM 638 CD PRO A 38 1.252 9.680 18.416 1.00 0.00 C ATOM 0 HA PRO A 38 0.894 12.823 18.029 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -1.579 11.415 18.224 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -0.530 11.291 16.826 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -0.740 9.442 19.204 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -0.592 9.033 17.506 1.00 0.00 H new ATOM 0 HD2 PRO A 38 1.568 8.879 19.084 1.00 0.00 H new ATOM 0 HD3 PRO A 38 1.742 9.508 17.458 1.00 0.00 H new ATOM 646 N ASP A 39 0.171 12.183 21.069 1.00 0.00 N ATOM 647 CA ASP A 39 -0.232 12.782 22.359 1.00 0.00 C ATOM 648 C ASP A 39 0.670 13.994 22.709 1.00 0.00 C ATOM 649 O ASP A 39 0.250 14.910 23.420 1.00 0.00 O ATOM 650 CB ASP A 39 -0.154 11.691 23.465 1.00 0.00 C ATOM 651 CG ASP A 39 -0.546 12.177 24.880 1.00 0.00 C ATOM 652 OD1 ASP A 39 -1.589 12.848 25.022 1.00 0.00 O ATOM 653 OD2 ASP A 39 0.174 11.875 25.858 1.00 0.00 O ATOM 0 H ASP A 39 0.669 11.299 21.172 1.00 0.00 H new ATOM 0 HA ASP A 39 -1.255 13.150 22.286 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -0.806 10.863 23.186 1.00 0.00 H new ATOM 0 HB3 ASP A 39 0.863 11.299 23.499 1.00 0.00 H new ATOM 658 N GLN A 40 1.922 13.960 22.208 1.00 0.00 N ATOM 659 CA GLN A 40 2.981 14.974 22.490 1.00 0.00 C ATOM 660 C GLN A 40 3.286 15.880 21.291 1.00 0.00 C ATOM 661 O GLN A 40 3.929 16.910 21.451 1.00 0.00 O ATOM 662 CB GLN A 40 4.291 14.267 22.957 1.00 0.00 C ATOM 663 CG GLN A 40 4.405 14.053 24.466 1.00 0.00 C ATOM 664 CD GLN A 40 3.219 13.310 25.065 1.00 0.00 C ATOM 665 OE1 GLN A 40 2.252 13.928 25.483 1.00 0.00 O ATOM 666 NE2 GLN A 40 3.271 11.995 25.114 1.00 0.00 N ATOM 0 H GLN A 40 2.239 13.218 21.584 1.00 0.00 H new ATOM 0 HA GLN A 40 2.592 15.613 23.283 1.00 0.00 H new ATOM 0 HB2 GLN A 40 4.360 13.299 22.461 1.00 0.00 H new ATOM 0 HB3 GLN A 40 5.144 14.858 22.623 1.00 0.00 H new ATOM 0 HG2 GLN A 40 5.317 13.496 24.678 1.00 0.00 H new ATOM 0 HG3 GLN A 40 4.502 15.022 24.956 1.00 0.00 H new ATOM 0 HE21 GLN A 40 4.091 11.503 24.758 1.00 0.00 H new ATOM 0 HE22 GLN A 40 2.492 11.468 25.508 1.00 0.00 H new ATOM 675 N GLN A 41 2.889 15.470 20.105 1.00 0.00 N ATOM 676 CA GLN A 41 3.053 16.277 18.877 1.00 0.00 C ATOM 677 C GLN A 41 1.686 16.763 18.375 1.00 0.00 C ATOM 678 O GLN A 41 0.660 16.155 18.692 1.00 0.00 O ATOM 679 CB GLN A 41 3.838 15.463 17.818 1.00 0.00 C ATOM 680 CG GLN A 41 3.212 14.132 17.357 1.00 0.00 C ATOM 681 CD GLN A 41 2.217 14.268 16.206 1.00 0.00 C ATOM 682 OE1 GLN A 41 1.009 14.404 16.389 1.00 0.00 O ATOM 683 NE2 GLN A 41 2.736 14.281 15.010 1.00 0.00 N ATOM 0 H GLN A 41 2.440 14.568 19.947 1.00 0.00 H new ATOM 0 HA GLN A 41 3.639 17.171 19.090 1.00 0.00 H new ATOM 0 HB2 GLN A 41 3.978 16.094 16.940 1.00 0.00 H new ATOM 0 HB3 GLN A 41 4.829 15.251 18.219 1.00 0.00 H new ATOM 0 HG2 GLN A 41 4.010 13.455 17.053 1.00 0.00 H new ATOM 0 HG3 GLN A 41 2.707 13.669 18.205 1.00 0.00 H new ATOM 0 HE21 GLN A 41 3.742 14.166 14.889 1.00 0.00 H new ATOM 0 HE22 GLN A 41 2.136 14.407 14.195 1.00 0.00 H new ATOM 692 N ARG A 42 1.675 17.873 17.616 1.00 0.00 N ATOM 693 CA ARG A 42 0.431 18.525 17.167 1.00 0.00 C ATOM 694 C ARG A 42 0.574 18.998 15.707 1.00 0.00 C ATOM 695 O ARG A 42 1.497 19.755 15.391 1.00 0.00 O ATOM 696 CB ARG A 42 0.143 19.717 18.124 1.00 0.00 C ATOM 697 CG ARG A 42 -1.322 20.176 18.212 1.00 0.00 C ATOM 698 CD ARG A 42 -1.517 21.138 19.390 1.00 0.00 C ATOM 699 NE ARG A 42 -2.934 21.382 19.705 1.00 0.00 N ATOM 700 CZ ARG A 42 -3.377 22.083 20.767 1.00 0.00 C ATOM 701 NH1 ARG A 42 -2.525 22.671 21.603 1.00 0.00 N ATOM 702 NH2 ARG A 42 -4.676 22.201 20.973 1.00 0.00 N ATOM 0 H ARG A 42 2.523 18.342 17.298 1.00 0.00 H new ATOM 0 HA ARG A 42 -0.403 17.824 17.198 1.00 0.00 H new ATOM 0 HB2 ARG A 42 0.477 19.442 19.124 1.00 0.00 H new ATOM 0 HB3 ARG A 42 0.750 20.565 17.807 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -1.611 20.667 17.283 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -1.973 19.310 18.331 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -1.020 20.731 20.270 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -1.033 22.087 19.161 1.00 0.00 H new ATOM 0 HE ARG A 42 -3.632 20.991 19.072 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -1.520 22.595 21.444 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -2.877 23.198 22.402 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -5.336 21.763 20.330 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -5.019 22.730 21.775 1.00 0.00 H new ATOM 716 N LEU A 43 -0.359 18.559 14.838 1.00 0.00 N ATOM 717 CA LEU A 43 -0.328 18.854 13.385 1.00 0.00 C ATOM 718 C LEU A 43 -1.162 20.096 13.086 1.00 0.00 C ATOM 719 O LEU A 43 -2.336 20.150 13.457 1.00 0.00 O ATOM 720 CB LEU A 43 -0.854 17.629 12.544 1.00 0.00 C ATOM 721 CG LEU A 43 0.240 16.709 11.918 1.00 0.00 C ATOM 722 CD1 LEU A 43 1.105 17.480 10.895 1.00 0.00 C ATOM 723 CD2 LEU A 43 1.111 16.083 13.005 1.00 0.00 C ATOM 0 H LEU A 43 -1.157 17.990 15.121 1.00 0.00 H new ATOM 0 HA LEU A 43 0.707 19.040 13.098 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.490 17.019 13.186 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.484 18.009 11.740 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.268 15.906 11.384 1.00 0.00 H new ATOM 0 HD11 LEU A 43 1.857 16.811 10.477 1.00 0.00 H new ATOM 0 HD12 LEU A 43 0.470 17.858 10.093 1.00 0.00 H new ATOM 0 HD13 LEU A 43 1.598 18.315 11.392 1.00 0.00 H new ATOM 0 HD21 LEU A 43 1.866 15.446 12.544 1.00 0.00 H new ATOM 0 HD22 LEU A 43 1.601 16.871 13.577 1.00 0.00 H new ATOM 0 HD23 LEU A 43 0.489 15.485 13.670 1.00 0.00 H new ATOM 735 N ILE A 44 -0.527 21.098 12.441 1.00 0.00 N ATOM 736 CA ILE A 44 -1.168 22.375 12.054 1.00 0.00 C ATOM 737 C ILE A 44 -0.632 22.825 10.682 1.00 0.00 C ATOM 738 O ILE A 44 0.585 22.856 10.473 1.00 0.00 O ATOM 739 CB ILE A 44 -0.901 23.493 13.140 1.00 0.00 C ATOM 740 CG1 ILE A 44 -1.588 23.084 14.492 1.00 0.00 C ATOM 741 CG2 ILE A 44 -1.368 24.908 12.679 1.00 0.00 C ATOM 742 CD1 ILE A 44 -1.248 23.939 15.668 1.00 0.00 C ATOM 0 H ILE A 44 0.455 21.043 12.171 1.00 0.00 H new ATOM 0 HA ILE A 44 -2.245 22.220 11.989 1.00 0.00 H new ATOM 0 HB ILE A 44 0.177 23.565 13.285 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -2.669 23.103 14.351 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -1.314 22.054 14.722 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -1.159 25.634 13.465 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.833 25.190 11.773 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.439 24.890 12.477 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -1.774 23.572 16.549 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -0.173 23.903 15.846 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -1.548 24.968 15.469 1.00 0.00 H new ATOM 754 N PHE A 45 -1.554 23.172 9.767 1.00 0.00 N ATOM 755 CA PHE A 45 -1.231 23.789 8.472 1.00 0.00 C ATOM 756 C PHE A 45 -2.089 25.043 8.323 1.00 0.00 C ATOM 757 O PHE A 45 -3.269 25.007 8.652 1.00 0.00 O ATOM 758 CB PHE A 45 -1.499 22.807 7.305 1.00 0.00 C ATOM 759 CG PHE A 45 -1.203 23.383 5.908 1.00 0.00 C ATOM 760 CD1 PHE A 45 0.111 23.526 5.458 1.00 0.00 C ATOM 761 CD2 PHE A 45 -2.236 23.763 5.046 1.00 0.00 C ATOM 762 CE1 PHE A 45 0.386 24.035 4.203 1.00 0.00 C ATOM 763 CE2 PHE A 45 -1.959 24.268 3.789 1.00 0.00 C ATOM 764 CZ PHE A 45 -0.650 24.398 3.367 1.00 0.00 C ATOM 0 H PHE A 45 -2.554 23.030 9.909 1.00 0.00 H new ATOM 0 HA PHE A 45 -0.172 24.047 8.439 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.893 21.913 7.452 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -2.542 22.494 7.342 1.00 0.00 H new ATOM 0 HD1 PHE A 45 0.927 23.234 6.102 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.263 23.661 5.366 1.00 0.00 H new ATOM 0 HE1 PHE A 45 1.409 24.148 3.877 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.768 24.561 3.136 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.437 24.784 2.381 1.00 0.00 H new ATOM 774 N ALA A 46 -1.468 26.141 7.870 1.00 0.00 N ATOM 775 CA ALA A 46 -2.155 27.422 7.564 1.00 0.00 C ATOM 776 C ALA A 46 -2.730 28.101 8.833 1.00 0.00 C ATOM 777 O ALA A 46 -3.540 29.025 8.725 1.00 0.00 O ATOM 778 CB ALA A 46 -3.253 27.209 6.491 1.00 0.00 C ATOM 0 H ALA A 46 -0.463 26.174 7.701 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.406 28.104 7.160 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -3.745 28.159 6.280 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -2.799 26.825 5.577 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -3.988 26.494 6.860 1.00 0.00 H new ATOM 784 N GLY A 47 -2.255 27.668 10.021 1.00 0.00 N ATOM 785 CA GLY A 47 -2.730 28.198 11.300 1.00 0.00 C ATOM 786 C GLY A 47 -4.024 27.544 11.800 1.00 0.00 C ATOM 787 O GLY A 47 -4.743 28.136 12.614 1.00 0.00 O ATOM 0 H GLY A 47 -1.538 26.948 10.111 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.952 28.061 12.051 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.892 29.271 11.200 1.00 0.00 H new ATOM 791 N LYS A 48 -4.320 26.325 11.312 1.00 0.00 N ATOM 792 CA LYS A 48 -5.474 25.517 11.782 1.00 0.00 C ATOM 793 C LYS A 48 -4.999 24.087 12.103 1.00 0.00 C ATOM 794 O LYS A 48 -4.099 23.556 11.431 1.00 0.00 O ATOM 795 CB LYS A 48 -6.602 25.494 10.705 1.00 0.00 C ATOM 796 CG LYS A 48 -6.271 24.634 9.455 1.00 0.00 C ATOM 797 CD LYS A 48 -7.106 24.968 8.209 1.00 0.00 C ATOM 798 CE LYS A 48 -6.874 26.398 7.701 1.00 0.00 C ATOM 799 NZ LYS A 48 -7.633 26.663 6.453 1.00 0.00 N ATOM 0 H LYS A 48 -3.771 25.869 10.583 1.00 0.00 H new ATOM 0 HA LYS A 48 -5.884 25.968 12.686 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -7.517 25.115 11.161 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.805 26.516 10.386 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.216 24.759 9.213 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.418 23.583 9.704 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -6.863 24.262 7.415 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -8.163 24.837 8.440 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -7.174 27.111 8.469 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.810 26.553 7.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -7.453 27.638 6.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -7.328 25.998 5.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -8.650 26.539 6.632 1.00 0.00 H new ATOM 813 N GLN A 49 -5.603 23.472 13.131 1.00 0.00 N ATOM 814 CA GLN A 49 -5.249 22.108 13.566 1.00 0.00 C ATOM 815 C GLN A 49 -5.808 21.073 12.571 1.00 0.00 C ATOM 816 O GLN A 49 -6.924 21.227 12.058 1.00 0.00 O ATOM 817 CB GLN A 49 -5.780 21.854 14.996 1.00 0.00 C ATOM 818 CG GLN A 49 -5.248 20.580 15.681 1.00 0.00 C ATOM 819 CD GLN A 49 -5.801 20.370 17.099 1.00 0.00 C ATOM 820 OE1 GLN A 49 -5.104 19.854 17.978 1.00 0.00 O ATOM 821 NE2 GLN A 49 -7.069 20.718 17.325 1.00 0.00 N ATOM 0 H GLN A 49 -6.346 23.901 13.683 1.00 0.00 H new ATOM 0 HA GLN A 49 -4.164 22.006 13.584 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -5.527 22.713 15.617 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -6.868 21.798 14.957 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -5.502 19.715 15.069 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -4.160 20.629 15.727 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -7.622 21.143 16.580 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -7.486 20.559 18.242 1.00 0.00 H new ATOM 830 N LEU A 50 -5.014 20.032 12.287 1.00 0.00 N ATOM 831 CA LEU A 50 -5.361 19.003 11.303 1.00 0.00 C ATOM 832 C LEU A 50 -6.099 17.828 11.981 1.00 0.00 C ATOM 833 O LEU A 50 -5.578 17.220 12.929 1.00 0.00 O ATOM 834 CB LEU A 50 -4.088 18.512 10.582 1.00 0.00 C ATOM 835 CG LEU A 50 -3.166 19.610 9.958 1.00 0.00 C ATOM 836 CD1 LEU A 50 -2.056 18.969 9.119 1.00 0.00 C ATOM 837 CD2 LEU A 50 -3.960 20.663 9.147 1.00 0.00 C ATOM 0 H LEU A 50 -4.111 19.881 12.736 1.00 0.00 H new ATOM 0 HA LEU A 50 -6.033 19.437 10.563 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.496 17.934 11.292 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.389 17.829 9.788 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.702 20.151 10.783 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -1.425 19.749 8.693 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -1.452 18.318 9.751 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -2.500 18.383 8.315 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -3.271 21.401 8.736 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -4.491 20.170 8.333 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -4.677 21.160 9.800 1.00 0.00 H new ATOM 849 N GLU A 51 -7.301 17.508 11.459 1.00 0.00 N ATOM 850 CA GLU A 51 -8.181 16.467 12.009 1.00 0.00 C ATOM 851 C GLU A 51 -7.779 15.085 11.464 1.00 0.00 C ATOM 852 O GLU A 51 -7.544 14.940 10.259 1.00 0.00 O ATOM 853 CB GLU A 51 -9.654 16.793 11.642 1.00 0.00 C ATOM 854 CG GLU A 51 -10.683 15.711 12.037 1.00 0.00 C ATOM 855 CD GLU A 51 -12.129 16.102 11.706 1.00 0.00 C ATOM 856 OE1 GLU A 51 -12.542 15.961 10.541 1.00 0.00 O ATOM 857 OE2 GLU A 51 -12.854 16.579 12.610 1.00 0.00 O ATOM 0 H GLU A 51 -7.688 17.971 10.637 1.00 0.00 H new ATOM 0 HA GLU A 51 -8.081 16.444 13.094 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -9.933 17.730 12.123 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -9.716 16.956 10.566 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -10.438 14.781 11.523 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -10.602 15.515 13.106 1.00 0.00 H new ATOM 864 N ASP A 52 -7.790 14.076 12.358 1.00 0.00 N ATOM 865 CA ASP A 52 -7.290 12.708 12.090 1.00 0.00 C ATOM 866 C ASP A 52 -7.998 12.050 10.898 1.00 0.00 C ATOM 867 O ASP A 52 -7.338 11.474 10.025 1.00 0.00 O ATOM 868 CB ASP A 52 -7.480 11.823 13.347 1.00 0.00 C ATOM 869 CG ASP A 52 -6.671 12.310 14.553 1.00 0.00 C ATOM 870 OD1 ASP A 52 -7.051 13.332 15.168 1.00 0.00 O ATOM 871 OD2 ASP A 52 -5.623 11.709 14.864 1.00 0.00 O ATOM 0 H ASP A 52 -8.153 14.189 13.305 1.00 0.00 H new ATOM 0 HA ASP A 52 -6.232 12.796 11.842 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -8.537 11.800 13.612 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -7.188 10.800 13.111 1.00 0.00 H new ATOM 876 N GLY A 53 -9.343 12.156 10.884 1.00 0.00 N ATOM 877 CA GLY A 53 -10.184 11.517 9.863 1.00 0.00 C ATOM 878 C GLY A 53 -9.975 12.077 8.461 1.00 0.00 C ATOM 879 O GLY A 53 -10.194 11.381 7.467 1.00 0.00 O ATOM 0 H GLY A 53 -9.870 12.685 11.579 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -9.977 10.447 9.852 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -11.231 11.637 10.140 1.00 0.00 H new ATOM 883 N ARG A 54 -9.537 13.348 8.391 1.00 0.00 N ATOM 884 CA ARG A 54 -9.277 14.046 7.118 1.00 0.00 C ATOM 885 C ARG A 54 -7.944 13.608 6.496 1.00 0.00 C ATOM 886 O ARG A 54 -7.208 12.803 7.071 1.00 0.00 O ATOM 887 CB ARG A 54 -9.299 15.576 7.340 1.00 0.00 C ATOM 888 CG ARG A 54 -10.667 16.105 7.802 1.00 0.00 C ATOM 889 CD ARG A 54 -10.696 17.625 7.937 1.00 0.00 C ATOM 890 NE ARG A 54 -12.018 18.132 8.320 1.00 0.00 N ATOM 891 CZ ARG A 54 -12.628 19.203 7.780 1.00 0.00 C ATOM 892 NH1 ARG A 54 -12.085 19.852 6.764 1.00 0.00 N ATOM 893 NH2 ARG A 54 -13.783 19.608 8.253 1.00 0.00 N ATOM 0 H ARG A 54 -9.353 13.920 9.215 1.00 0.00 H new ATOM 0 HA ARG A 54 -10.067 13.777 6.417 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -8.546 15.839 8.083 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -9.019 16.075 6.412 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -11.432 15.793 7.091 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -10.921 15.654 8.761 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -9.963 17.934 8.682 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -10.398 18.076 6.990 1.00 0.00 H new ATOM 0 HE ARG A 54 -12.516 17.632 9.056 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -11.192 19.542 6.380 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -12.559 20.662 6.365 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -14.218 19.111 9.030 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -14.245 20.420 7.844 1.00 0.00 H new ATOM 907 N THR A 55 -7.655 14.147 5.306 1.00 0.00 N ATOM 908 CA THR A 55 -6.407 13.882 4.572 1.00 0.00 C ATOM 909 C THR A 55 -5.605 15.168 4.439 1.00 0.00 C ATOM 910 O THR A 55 -6.112 16.264 4.731 1.00 0.00 O ATOM 911 CB THR A 55 -6.687 13.300 3.145 1.00 0.00 C ATOM 912 OG1 THR A 55 -7.534 14.200 2.405 1.00 0.00 O ATOM 913 CG2 THR A 55 -7.326 11.903 3.210 1.00 0.00 C ATOM 0 H THR A 55 -8.284 14.785 4.819 1.00 0.00 H new ATOM 0 HA THR A 55 -5.841 13.142 5.138 1.00 0.00 H new ATOM 0 HB THR A 55 -5.729 13.198 2.635 1.00 0.00 H new ATOM 0 HG1 THR A 55 -7.704 13.831 1.513 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.503 11.537 2.199 1.00 0.00 H new ATOM 0 HG22 THR A 55 -6.655 11.220 3.731 1.00 0.00 H new ATOM 0 HG23 THR A 55 -8.273 11.961 3.746 1.00 0.00 H new ATOM 921 N LEU A 56 -4.349 15.019 3.994 1.00 0.00 N ATOM 922 CA LEU A 56 -3.476 16.154 3.676 1.00 0.00 C ATOM 923 C LEU A 56 -4.163 17.063 2.636 1.00 0.00 C ATOM 924 O LEU A 56 -4.359 18.253 2.876 1.00 0.00 O ATOM 925 CB LEU A 56 -2.106 15.653 3.135 1.00 0.00 C ATOM 926 CG LEU A 56 -1.174 14.915 4.145 1.00 0.00 C ATOM 927 CD1 LEU A 56 0.103 14.404 3.436 1.00 0.00 C ATOM 928 CD2 LEU A 56 -0.807 15.825 5.348 1.00 0.00 C ATOM 0 H LEU A 56 -3.912 14.109 3.845 1.00 0.00 H new ATOM 0 HA LEU A 56 -3.295 16.726 4.586 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -2.297 14.982 2.298 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -1.564 16.511 2.738 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.721 14.056 4.535 1.00 0.00 H new ATOM 0 HD11 LEU A 56 0.740 13.892 4.158 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.174 13.711 2.641 1.00 0.00 H new ATOM 0 HD13 LEU A 56 0.644 15.248 3.009 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -0.157 15.279 6.032 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.290 16.714 4.987 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -1.716 16.121 5.871 1.00 0.00 H new ATOM 940 N SER A 57 -4.589 16.439 1.525 1.00 0.00 N ATOM 941 CA SER A 57 -5.203 17.115 0.371 1.00 0.00 C ATOM 942 C SER A 57 -6.509 17.834 0.762 1.00 0.00 C ATOM 943 O SER A 57 -6.899 18.817 0.113 1.00 0.00 O ATOM 944 CB SER A 57 -5.464 16.085 -0.750 1.00 0.00 C ATOM 945 OG SER A 57 -5.876 16.707 -1.952 1.00 0.00 O ATOM 0 H SER A 57 -4.514 15.429 1.402 1.00 0.00 H new ATOM 0 HA SER A 57 -4.511 17.877 0.011 1.00 0.00 H new ATOM 0 HB2 SER A 57 -4.557 15.509 -0.932 1.00 0.00 H new ATOM 0 HB3 SER A 57 -6.230 15.381 -0.425 1.00 0.00 H new ATOM 0 HG SER A 57 -6.030 16.024 -2.638 1.00 0.00 H new ATOM 951 N ASP A 58 -7.163 17.354 1.847 1.00 0.00 N ATOM 952 CA ASP A 58 -8.391 17.974 2.382 1.00 0.00 C ATOM 953 C ASP A 58 -8.067 19.383 2.925 1.00 0.00 C ATOM 954 O ASP A 58 -8.818 20.341 2.695 1.00 0.00 O ATOM 955 CB ASP A 58 -8.992 17.078 3.497 1.00 0.00 C ATOM 956 CG ASP A 58 -10.330 17.597 4.053 1.00 0.00 C ATOM 957 OD1 ASP A 58 -10.322 18.533 4.878 1.00 0.00 O ATOM 958 OD2 ASP A 58 -11.396 17.077 3.657 1.00 0.00 O ATOM 0 H ASP A 58 -6.855 16.534 2.369 1.00 0.00 H new ATOM 0 HA ASP A 58 -9.128 18.070 1.585 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -9.138 16.072 3.103 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -8.275 17.000 4.314 1.00 0.00 H new ATOM 963 N TYR A 59 -6.919 19.483 3.623 1.00 0.00 N ATOM 964 CA TYR A 59 -6.415 20.743 4.187 1.00 0.00 C ATOM 965 C TYR A 59 -5.467 21.479 3.200 1.00 0.00 C ATOM 966 O TYR A 59 -4.675 22.318 3.634 1.00 0.00 O ATOM 967 CB TYR A 59 -5.685 20.465 5.531 1.00 0.00 C ATOM 968 CG TYR A 59 -6.615 20.273 6.730 1.00 0.00 C ATOM 969 CD1 TYR A 59 -7.320 21.357 7.259 1.00 0.00 C ATOM 970 CD2 TYR A 59 -6.758 19.036 7.356 1.00 0.00 C ATOM 971 CE1 TYR A 59 -8.129 21.216 8.365 1.00 0.00 C ATOM 972 CE2 TYR A 59 -7.568 18.896 8.456 1.00 0.00 C ATOM 973 CZ TYR A 59 -8.251 19.989 8.956 1.00 0.00 C ATOM 974 OH TYR A 59 -9.052 19.850 10.073 1.00 0.00 O ATOM 0 H TYR A 59 -6.314 18.684 3.811 1.00 0.00 H new ATOM 0 HA TYR A 59 -7.270 21.396 4.366 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -5.070 19.572 5.418 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -5.009 21.294 5.741 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -7.229 22.326 6.791 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -6.226 18.178 6.972 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -8.662 22.067 8.762 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -7.672 17.931 8.931 1.00 0.00 H new ATOM 0 HH TYR A 59 -8.584 20.205 10.857 1.00 0.00 H new ATOM 984 N ASN A 60 -5.565 21.152 1.882 1.00 0.00 N ATOM 985 CA ASN A 60 -4.787 21.808 0.777 1.00 0.00 C ATOM 986 C ASN A 60 -3.292 21.405 0.775 1.00 0.00 C ATOM 987 O ASN A 60 -2.503 21.955 -0.003 1.00 0.00 O ATOM 988 CB ASN A 60 -4.920 23.370 0.805 1.00 0.00 C ATOM 989 CG ASN A 60 -6.357 23.870 0.624 1.00 0.00 C ATOM 990 OD1 ASN A 60 -6.783 24.202 -0.480 1.00 0.00 O ATOM 991 ND2 ASN A 60 -7.125 23.901 1.705 1.00 0.00 N ATOM 0 H ASN A 60 -6.190 20.419 1.547 1.00 0.00 H new ATOM 0 HA ASN A 60 -5.233 21.440 -0.147 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -4.532 23.742 1.754 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -4.296 23.793 0.018 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -8.096 24.206 1.632 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -6.745 23.620 2.609 1.00 0.00 H new ATOM 998 N ILE A 61 -2.924 20.430 1.616 1.00 0.00 N ATOM 999 CA ILE A 61 -1.540 19.938 1.743 1.00 0.00 C ATOM 1000 C ILE A 61 -1.292 18.872 0.654 1.00 0.00 C ATOM 1001 O ILE A 61 -1.949 17.831 0.633 1.00 0.00 O ATOM 1002 CB ILE A 61 -1.306 19.292 3.165 1.00 0.00 C ATOM 1003 CG1 ILE A 61 -1.887 20.197 4.292 1.00 0.00 C ATOM 1004 CG2 ILE A 61 0.193 18.975 3.419 1.00 0.00 C ATOM 1005 CD1 ILE A 61 -2.181 19.468 5.592 1.00 0.00 C ATOM 0 H ILE A 61 -3.582 19.954 2.234 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.852 20.775 1.624 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.842 18.343 3.181 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.182 21.004 4.493 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -2.806 20.659 3.933 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.309 18.532 4.408 1.00 0.00 H new ATOM 0 HG22 ILE A 61 0.550 18.275 2.664 1.00 0.00 H new ATOM 0 HG23 ILE A 61 0.774 19.896 3.363 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -2.582 20.172 6.321 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.911 18.679 5.410 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -1.261 19.029 5.979 1.00 0.00 H new ATOM 1017 N GLN A 62 -0.368 19.147 -0.252 1.00 0.00 N ATOM 1018 CA GLN A 62 0.038 18.197 -1.301 1.00 0.00 C ATOM 1019 C GLN A 62 1.430 17.629 -0.966 1.00 0.00 C ATOM 1020 O GLN A 62 1.963 17.856 0.137 1.00 0.00 O ATOM 1021 CB GLN A 62 0.025 18.899 -2.690 1.00 0.00 C ATOM 1022 CG GLN A 62 0.998 20.091 -2.831 1.00 0.00 C ATOM 1023 CD GLN A 62 1.115 20.593 -4.266 1.00 0.00 C ATOM 1024 OE1 GLN A 62 0.384 21.482 -4.699 1.00 0.00 O ATOM 1025 NE2 GLN A 62 2.033 20.016 -5.016 1.00 0.00 N ATOM 0 H GLN A 62 0.130 20.037 -0.289 1.00 0.00 H new ATOM 0 HA GLN A 62 -0.668 17.368 -1.344 1.00 0.00 H new ATOM 0 HB2 GLN A 62 0.266 18.161 -3.455 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -0.987 19.250 -2.893 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.660 20.907 -2.192 1.00 0.00 H new ATOM 0 HG3 GLN A 62 1.984 19.793 -2.474 1.00 0.00 H new ATOM 0 HE21 GLN A 62 2.623 19.281 -4.625 1.00 0.00 H new ATOM 0 HE22 GLN A 62 2.153 20.304 -5.987 1.00 0.00 H new ATOM 1034 N LYS A 63 2.010 16.871 -1.910 1.00 0.00 N ATOM 1035 CA LYS A 63 3.399 16.393 -1.802 1.00 0.00 C ATOM 1036 C LYS A 63 4.370 17.579 -1.676 1.00 0.00 C ATOM 1037 O LYS A 63 4.125 18.671 -2.220 1.00 0.00 O ATOM 1038 CB LYS A 63 3.782 15.518 -3.025 1.00 0.00 C ATOM 1039 CG LYS A 63 3.623 16.210 -4.397 1.00 0.00 C ATOM 1040 CD LYS A 63 3.854 15.219 -5.558 1.00 0.00 C ATOM 1041 CE LYS A 63 5.278 14.634 -5.561 1.00 0.00 C ATOM 1042 NZ LYS A 63 6.234 15.517 -6.271 1.00 0.00 N ATOM 0 H LYS A 63 1.535 16.574 -2.762 1.00 0.00 H new ATOM 0 HA LYS A 63 3.474 15.780 -0.904 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.818 15.198 -2.914 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.168 14.618 -3.015 1.00 0.00 H new ATOM 0 HG2 LYS A 63 2.624 16.639 -4.476 1.00 0.00 H new ATOM 0 HG3 LYS A 63 4.331 17.035 -4.474 1.00 0.00 H new ATOM 0 HD2 LYS A 63 3.131 14.406 -5.487 1.00 0.00 H new ATOM 0 HD3 LYS A 63 3.671 15.726 -6.506 1.00 0.00 H new ATOM 0 HE2 LYS A 63 5.613 14.487 -4.534 1.00 0.00 H new ATOM 0 HE3 LYS A 63 5.267 13.653 -6.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 7.064 14.964 -6.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 5.774 15.924 -7.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 6.536 16.284 -5.636 1.00 0.00 H new ATOM 1056 N GLU A 64 5.448 17.334 -0.920 1.00 0.00 N ATOM 1057 CA GLU A 64 6.527 18.299 -0.620 1.00 0.00 C ATOM 1058 C GLU A 64 6.050 19.539 0.175 1.00 0.00 C ATOM 1059 O GLU A 64 6.856 20.441 0.425 1.00 0.00 O ATOM 1060 CB GLU A 64 7.260 18.709 -1.935 1.00 0.00 C ATOM 1061 CG GLU A 64 7.881 17.518 -2.703 1.00 0.00 C ATOM 1062 CD GLU A 64 8.283 17.884 -4.142 1.00 0.00 C ATOM 1063 OE1 GLU A 64 7.417 17.822 -5.036 1.00 0.00 O ATOM 1064 OE2 GLU A 64 9.450 18.259 -4.383 1.00 0.00 O ATOM 0 H GLU A 64 5.603 16.426 -0.482 1.00 0.00 H new ATOM 0 HA GLU A 64 7.231 17.790 0.039 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.554 19.222 -2.588 1.00 0.00 H new ATOM 0 HB3 GLU A 64 8.047 19.423 -1.693 1.00 0.00 H new ATOM 0 HG2 GLU A 64 8.759 17.162 -2.164 1.00 0.00 H new ATOM 0 HG3 GLU A 64 7.167 16.695 -2.728 1.00 0.00 H new ATOM 1071 N SER A 65 4.769 19.577 0.612 1.00 0.00 N ATOM 1072 CA SER A 65 4.239 20.725 1.369 1.00 0.00 C ATOM 1073 C SER A 65 4.840 20.784 2.782 1.00 0.00 C ATOM 1074 O SER A 65 5.096 19.743 3.407 1.00 0.00 O ATOM 1075 CB SER A 65 2.708 20.672 1.446 1.00 0.00 C ATOM 1076 OG SER A 65 2.128 20.734 0.155 1.00 0.00 O ATOM 0 H SER A 65 4.092 18.831 0.453 1.00 0.00 H new ATOM 0 HA SER A 65 4.528 21.631 0.836 1.00 0.00 H new ATOM 0 HB2 SER A 65 2.398 19.753 1.943 1.00 0.00 H new ATOM 0 HB3 SER A 65 2.343 21.501 2.052 1.00 0.00 H new ATOM 0 HG SER A 65 1.546 21.520 0.095 1.00 0.00 H new ATOM 1082 N THR A 66 5.079 22.014 3.263 1.00 0.00 N ATOM 1083 CA THR A 66 5.644 22.262 4.591 1.00 0.00 C ATOM 1084 C THR A 66 4.570 22.841 5.523 1.00 0.00 C ATOM 1085 O THR A 66 3.821 23.748 5.145 1.00 0.00 O ATOM 1086 CB THR A 66 6.881 23.208 4.511 1.00 0.00 C ATOM 1087 OG1 THR A 66 7.805 22.688 3.540 1.00 0.00 O ATOM 1088 CG2 THR A 66 7.597 23.341 5.877 1.00 0.00 C ATOM 0 H THR A 66 4.884 22.865 2.737 1.00 0.00 H new ATOM 0 HA THR A 66 5.985 21.311 5.001 1.00 0.00 H new ATOM 0 HB THR A 66 6.531 24.199 4.221 1.00 0.00 H new ATOM 0 HG1 THR A 66 8.585 23.278 3.482 1.00 0.00 H new ATOM 0 HG21 THR A 66 8.453 24.009 5.776 1.00 0.00 H new ATOM 0 HG22 THR A 66 6.904 23.748 6.613 1.00 0.00 H new ATOM 0 HG23 THR A 66 7.939 22.360 6.205 1.00 0.00 H new ATOM 1096 N LEU A 67 4.517 22.290 6.737 1.00 0.00 N ATOM 1097 CA LEU A 67 3.532 22.625 7.770 1.00 0.00 C ATOM 1098 C LEU A 67 4.216 22.545 9.140 1.00 0.00 C ATOM 1099 O LEU A 67 5.370 22.144 9.231 1.00 0.00 O ATOM 1100 CB LEU A 67 2.276 21.701 7.678 1.00 0.00 C ATOM 1101 CG LEU A 67 2.485 20.144 7.687 1.00 0.00 C ATOM 1102 CD1 LEU A 67 1.148 19.422 7.922 1.00 0.00 C ATOM 1103 CD2 LEU A 67 3.128 19.606 6.379 1.00 0.00 C ATOM 0 H LEU A 67 5.179 21.575 7.039 1.00 0.00 H new ATOM 0 HA LEU A 67 3.167 23.641 7.619 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.619 21.952 8.511 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.742 21.958 6.763 1.00 0.00 H new ATOM 0 HG LEU A 67 3.177 19.938 8.504 1.00 0.00 H new ATOM 0 HD11 LEU A 67 1.312 18.344 7.925 1.00 0.00 H new ATOM 0 HD12 LEU A 67 0.733 19.729 8.882 1.00 0.00 H new ATOM 0 HD13 LEU A 67 0.450 19.680 7.126 1.00 0.00 H new ATOM 0 HD21 LEU A 67 3.245 18.525 6.449 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.486 19.847 5.532 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.105 20.068 6.237 1.00 0.00 H new ATOM 1115 N HIS A 68 3.512 22.956 10.205 1.00 0.00 N ATOM 1116 CA HIS A 68 4.105 23.088 11.557 1.00 0.00 C ATOM 1117 C HIS A 68 3.717 21.926 12.492 1.00 0.00 C ATOM 1118 O HIS A 68 2.659 21.293 12.342 1.00 0.00 O ATOM 1119 CB HIS A 68 3.731 24.454 12.188 1.00 0.00 C ATOM 1120 CG HIS A 68 4.352 25.631 11.473 1.00 0.00 C ATOM 1121 ND1 HIS A 68 3.632 26.513 10.705 1.00 0.00 N ATOM 1122 CD2 HIS A 68 5.644 26.052 11.411 1.00 0.00 C ATOM 1123 CE1 HIS A 68 4.442 27.420 10.200 1.00 0.00 C ATOM 1124 NE2 HIS A 68 5.668 27.165 10.608 1.00 0.00 N ATOM 0 H HIS A 68 2.524 23.206 10.162 1.00 0.00 H new ATOM 0 HA HIS A 68 5.187 23.042 11.434 1.00 0.00 H new ATOM 0 HB2 HIS A 68 2.647 24.565 12.182 1.00 0.00 H new ATOM 0 HB3 HIS A 68 4.047 24.463 13.231 1.00 0.00 H new ATOM 0 HD2 HIS A 68 6.492 25.596 11.901 1.00 0.00 H new ATOM 0 HE1 HIS A 68 4.150 28.238 9.558 1.00 0.00 H new ATOM 0 HE2 HIS A 68 6.499 27.706 10.367 1.00 0.00 H new ATOM 1133 N LEU A 69 4.615 21.689 13.462 1.00 0.00 N ATOM 1134 CA LEU A 69 4.510 20.650 14.483 1.00 0.00 C ATOM 1135 C LEU A 69 4.776 21.331 15.828 1.00 0.00 C ATOM 1136 O LEU A 69 5.805 22.000 15.998 1.00 0.00 O ATOM 1137 CB LEU A 69 5.557 19.522 14.202 1.00 0.00 C ATOM 1138 CG LEU A 69 5.391 18.131 14.920 1.00 0.00 C ATOM 1139 CD1 LEU A 69 5.672 18.198 16.436 1.00 0.00 C ATOM 1140 CD2 LEU A 69 4.001 17.526 14.637 1.00 0.00 C ATOM 0 H LEU A 69 5.467 22.242 13.554 1.00 0.00 H new ATOM 0 HA LEU A 69 3.526 20.182 14.483 1.00 0.00 H new ATOM 0 HB2 LEU A 69 5.563 19.339 13.127 1.00 0.00 H new ATOM 0 HB3 LEU A 69 6.540 19.913 14.465 1.00 0.00 H new ATOM 0 HG LEU A 69 6.148 17.471 14.497 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.541 17.209 16.874 1.00 0.00 H new ATOM 0 HD12 LEU A 69 6.695 18.536 16.602 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.979 18.897 16.904 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.912 16.565 15.144 1.00 0.00 H new ATOM 0 HD22 LEU A 69 3.228 18.202 15.003 1.00 0.00 H new ATOM 0 HD23 LEU A 69 3.879 17.382 13.564 1.00 0.00 H new ATOM 1152 N VAL A 70 3.845 21.164 16.769 1.00 0.00 N ATOM 1153 CA VAL A 70 3.962 21.716 18.126 1.00 0.00 C ATOM 1154 C VAL A 70 4.163 20.577 19.133 1.00 0.00 C ATOM 1155 O VAL A 70 3.365 19.626 19.172 1.00 0.00 O ATOM 1156 CB VAL A 70 2.694 22.566 18.494 1.00 0.00 C ATOM 1157 CG1 VAL A 70 2.788 23.147 19.934 1.00 0.00 C ATOM 1158 CG2 VAL A 70 2.477 23.683 17.431 1.00 0.00 C ATOM 0 H VAL A 70 2.984 20.640 16.614 1.00 0.00 H new ATOM 0 HA VAL A 70 4.828 22.377 18.163 1.00 0.00 H new ATOM 0 HB VAL A 70 1.824 21.910 18.484 1.00 0.00 H new ATOM 0 HG11 VAL A 70 1.892 23.729 20.151 1.00 0.00 H new ATOM 0 HG12 VAL A 70 2.873 22.330 20.651 1.00 0.00 H new ATOM 0 HG13 VAL A 70 3.665 23.790 20.011 1.00 0.00 H new ATOM 0 HG21 VAL A 70 1.596 24.268 17.693 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.351 24.334 17.404 1.00 0.00 H new ATOM 0 HG23 VAL A 70 2.333 23.229 16.451 1.00 0.00 H new ATOM 1168 N LEU A 71 5.251 20.674 19.913 1.00 0.00 N ATOM 1169 CA LEU A 71 5.578 19.715 20.981 1.00 0.00 C ATOM 1170 C LEU A 71 4.858 20.099 22.283 1.00 0.00 C ATOM 1171 O LEU A 71 4.636 21.283 22.555 1.00 0.00 O ATOM 1172 CB LEU A 71 7.107 19.653 21.193 1.00 0.00 C ATOM 1173 CG LEU A 71 7.945 19.138 19.973 1.00 0.00 C ATOM 1174 CD1 LEU A 71 9.455 19.141 20.304 1.00 0.00 C ATOM 1175 CD2 LEU A 71 7.482 17.725 19.522 1.00 0.00 C ATOM 0 H LEU A 71 5.934 21.426 19.820 1.00 0.00 H new ATOM 0 HA LEU A 71 5.234 18.725 20.683 1.00 0.00 H new ATOM 0 HB2 LEU A 71 7.459 20.651 21.456 1.00 0.00 H new ATOM 0 HB3 LEU A 71 7.310 19.008 22.048 1.00 0.00 H new ATOM 0 HG LEU A 71 7.775 19.823 19.142 1.00 0.00 H new ATOM 0 HD11 LEU A 71 10.017 18.780 19.443 1.00 0.00 H new ATOM 0 HD12 LEU A 71 9.773 20.155 20.545 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.642 18.490 21.158 1.00 0.00 H new ATOM 0 HD21 LEU A 71 8.084 17.398 18.674 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.604 17.022 20.346 1.00 0.00 H new ATOM 0 HD23 LEU A 71 6.433 17.762 19.229 1.00 0.00 H new ATOM 1187 N ARG A 72 4.487 19.074 23.072 1.00 0.00 N ATOM 1188 CA ARG A 72 3.667 19.233 24.293 1.00 0.00 C ATOM 1189 C ARG A 72 4.413 18.671 25.520 1.00 0.00 C ATOM 1190 O ARG A 72 4.402 19.282 26.597 1.00 0.00 O ATOM 1191 CB ARG A 72 2.312 18.498 24.119 1.00 0.00 C ATOM 1192 CG ARG A 72 1.582 18.740 22.769 1.00 0.00 C ATOM 1193 CD ARG A 72 0.255 17.973 22.689 1.00 0.00 C ATOM 1194 NE ARG A 72 -0.218 17.723 21.313 1.00 0.00 N ATOM 1195 CZ ARG A 72 -1.506 17.522 20.971 1.00 0.00 C ATOM 1196 NH1 ARG A 72 -2.484 17.782 21.826 1.00 0.00 N ATOM 1197 NH2 ARG A 72 -1.805 17.083 19.762 1.00 0.00 N ATOM 0 H ARG A 72 4.748 18.106 22.882 1.00 0.00 H new ATOM 0 HA ARG A 72 3.482 20.295 24.452 1.00 0.00 H new ATOM 0 HB2 ARG A 72 2.483 17.427 24.231 1.00 0.00 H new ATOM 0 HB3 ARG A 72 1.649 18.801 24.929 1.00 0.00 H new ATOM 0 HG2 ARG A 72 1.393 19.806 22.645 1.00 0.00 H new ATOM 0 HG3 ARG A 72 2.229 18.433 21.947 1.00 0.00 H new ATOM 0 HD2 ARG A 72 0.369 17.018 23.201 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -0.509 18.534 23.227 1.00 0.00 H new ATOM 0 HE ARG A 72 0.479 17.701 20.569 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -2.267 18.139 22.756 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -3.454 17.625 21.554 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -1.062 16.897 19.089 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -2.779 16.930 19.501 1.00 0.00 H new ATOM 1211 N LEU A 73 5.019 17.474 25.330 1.00 0.00 N ATOM 1212 CA LEU A 73 5.781 16.735 26.372 1.00 0.00 C ATOM 1213 C LEU A 73 4.921 16.447 27.628 1.00 0.00 C ATOM 1214 O LEU A 73 5.416 16.481 28.757 1.00 0.00 O ATOM 1215 CB LEU A 73 7.144 17.449 26.709 1.00 0.00 C ATOM 1216 CG LEU A 73 8.319 17.243 25.678 1.00 0.00 C ATOM 1217 CD1 LEU A 73 8.659 15.743 25.493 1.00 0.00 C ATOM 1218 CD2 LEU A 73 8.032 17.928 24.322 1.00 0.00 C ATOM 0 H LEU A 73 4.993 16.985 24.435 1.00 0.00 H new ATOM 0 HA LEU A 73 6.039 15.760 25.958 1.00 0.00 H new ATOM 0 HB2 LEU A 73 6.955 18.518 26.802 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.481 17.099 27.685 1.00 0.00 H new ATOM 0 HG LEU A 73 9.197 17.730 26.101 1.00 0.00 H new ATOM 0 HD11 LEU A 73 9.473 15.640 24.776 1.00 0.00 H new ATOM 0 HD12 LEU A 73 8.963 15.318 26.450 1.00 0.00 H new ATOM 0 HD13 LEU A 73 7.781 15.214 25.123 1.00 0.00 H new ATOM 0 HD21 LEU A 73 8.869 17.759 23.645 1.00 0.00 H new ATOM 0 HD22 LEU A 73 7.124 17.510 23.888 1.00 0.00 H new ATOM 0 HD23 LEU A 73 7.901 18.999 24.476 1.00 0.00 H new ATOM 1230 N ARG A 74 3.642 16.089 27.391 1.00 0.00 N ATOM 1231 CA ARG A 74 2.662 15.772 28.457 1.00 0.00 C ATOM 1232 C ARG A 74 3.041 14.451 29.159 1.00 0.00 C ATOM 1233 O ARG A 74 3.266 14.420 30.372 1.00 0.00 O ATOM 1234 CB ARG A 74 1.234 15.683 27.846 1.00 0.00 C ATOM 1235 CG ARG A 74 0.748 16.967 27.135 1.00 0.00 C ATOM 1236 CD ARG A 74 0.443 18.117 28.116 1.00 0.00 C ATOM 1237 NE ARG A 74 -0.719 17.801 28.976 1.00 0.00 N ATOM 1238 CZ ARG A 74 -0.788 17.965 30.309 1.00 0.00 C ATOM 1239 NH1 ARG A 74 0.253 18.411 30.998 1.00 0.00 N ATOM 1240 NH2 ARG A 74 -1.904 17.651 30.951 1.00 0.00 N ATOM 0 H ARG A 74 3.256 16.011 26.450 1.00 0.00 H new ATOM 0 HA ARG A 74 2.675 16.566 29.203 1.00 0.00 H new ATOM 0 HB2 ARG A 74 1.211 14.859 27.132 1.00 0.00 H new ATOM 0 HB3 ARG A 74 0.530 15.436 28.640 1.00 0.00 H new ATOM 0 HG2 ARG A 74 1.508 17.293 26.425 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -0.149 16.740 26.559 1.00 0.00 H new ATOM 0 HD2 ARG A 74 1.317 18.307 28.739 1.00 0.00 H new ATOM 0 HD3 ARG A 74 0.245 19.031 27.557 1.00 0.00 H new ATOM 0 HE ARG A 74 -1.546 17.423 28.514 1.00 0.00 H new ATOM 0 HH11 ARG A 74 1.124 18.636 30.517 1.00 0.00 H new ATOM 0 HH12 ARG A 74 0.183 18.529 32.009 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -2.705 17.287 30.434 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -1.962 17.773 31.962 1.00 0.00 H new ATOM 1254 N GLY A 75 3.110 13.371 28.362 1.00 0.00 N ATOM 1255 CA GLY A 75 3.514 12.037 28.826 1.00 0.00 C ATOM 1256 C GLY A 75 4.909 11.632 28.341 1.00 0.00 C ATOM 1257 O GLY A 75 5.260 10.451 28.410 1.00 0.00 O ATOM 0 H GLY A 75 2.884 13.402 27.368 1.00 0.00 H new ATOM 0 HA2 GLY A 75 3.494 12.016 29.916 1.00 0.00 H new ATOM 0 HA3 GLY A 75 2.787 11.302 28.479 1.00 0.00 H new ATOM 1261 N GLY A 76 5.695 12.615 27.833 1.00 0.00 N ATOM 1262 CA GLY A 76 7.070 12.367 27.350 1.00 0.00 C ATOM 1263 C GLY A 76 7.128 11.723 25.957 1.00 0.00 C ATOM 1264 O GLY A 76 6.090 11.387 25.376 1.00 0.00 O ATOM 0 H GLY A 76 5.396 13.587 27.749 1.00 0.00 H new ATOM 0 HA2 GLY A 76 7.613 13.312 27.327 1.00 0.00 H new ATOM 0 HA3 GLY A 76 7.584 11.721 28.061 1.00 0.00 H new TER 1268 GLY A 76 ATOM 1269 N GLY B 195 15.239 15.965 24.698 1.00 0.00 N ATOM 1270 CA GLY B 195 14.091 15.778 25.591 1.00 0.00 C ATOM 1271 C GLY B 195 13.715 17.063 26.319 1.00 0.00 C ATOM 1272 O GLY B 195 14.300 18.128 26.060 1.00 0.00 O ATOM 0 HA2 GLY B 195 13.236 15.426 25.013 1.00 0.00 H new ATOM 0 HA3 GLY B 195 14.323 15.003 26.321 1.00 0.00 H new ATOM 1276 N SER B 196 12.738 16.969 27.237 1.00 0.00 N ATOM 1277 CA SER B 196 12.274 18.109 28.046 1.00 0.00 C ATOM 1278 C SER B 196 13.254 18.376 29.212 1.00 0.00 C ATOM 1279 O SER B 196 13.010 18.000 30.366 1.00 0.00 O ATOM 1280 CB SER B 196 10.832 17.834 28.540 1.00 0.00 C ATOM 1281 OG SER B 196 10.742 16.585 29.213 1.00 0.00 O ATOM 0 H SER B 196 12.247 16.098 27.439 1.00 0.00 H new ATOM 0 HA SER B 196 12.253 19.013 27.438 1.00 0.00 H new ATOM 0 HB2 SER B 196 10.517 18.634 29.211 1.00 0.00 H new ATOM 0 HB3 SER B 196 10.148 17.842 27.692 1.00 0.00 H new ATOM 0 HG SER B 196 11.447 16.528 29.892 1.00 0.00 H new ATOM 1287 N ARG B 197 14.405 18.986 28.868 1.00 0.00 N ATOM 1288 CA ARG B 197 15.484 19.315 29.827 1.00 0.00 C ATOM 1289 C ARG B 197 15.459 20.815 30.185 1.00 0.00 C ATOM 1290 O ARG B 197 16.379 21.317 30.839 1.00 0.00 O ATOM 1291 CB ARG B 197 16.869 18.910 29.230 1.00 0.00 C ATOM 1292 CG ARG B 197 16.999 17.420 28.812 1.00 0.00 C ATOM 1293 CD ARG B 197 16.605 16.430 29.932 1.00 0.00 C ATOM 1294 NE ARG B 197 17.299 16.707 31.203 1.00 0.00 N ATOM 1295 CZ ARG B 197 17.064 16.085 32.367 1.00 0.00 C ATOM 1296 NH1 ARG B 197 16.226 15.059 32.442 1.00 0.00 N ATOM 1297 NH2 ARG B 197 17.700 16.482 33.450 1.00 0.00 N ATOM 0 H ARG B 197 14.616 19.267 27.911 1.00 0.00 H new ATOM 0 HA ARG B 197 15.321 18.750 30.745 1.00 0.00 H new ATOM 0 HB2 ARG B 197 17.067 19.534 28.358 1.00 0.00 H new ATOM 0 HB3 ARG B 197 17.643 19.133 29.965 1.00 0.00 H new ATOM 0 HG2 ARG B 197 16.370 17.239 27.940 1.00 0.00 H new ATOM 0 HG3 ARG B 197 18.028 17.224 28.510 1.00 0.00 H new ATOM 0 HD2 ARG B 197 15.528 16.478 30.092 1.00 0.00 H new ATOM 0 HD3 ARG B 197 16.834 15.414 29.611 1.00 0.00 H new ATOM 0 HE ARG B 197 18.017 17.431 31.196 1.00 0.00 H new ATOM 0 HH11 ARG B 197 15.747 14.730 31.604 1.00 0.00 H new ATOM 0 HH12 ARG B 197 16.061 14.600 33.338 1.00 0.00 H new ATOM 0 HH21 ARG B 197 18.363 17.255 33.397 1.00 0.00 H new ATOM 0 HH22 ARG B 197 17.529 16.016 34.341 1.00 0.00 H new ATOM 1311 N GLN B 198 14.379 21.508 29.777 1.00 0.00 N ATOM 1312 CA GLN B 198 14.253 22.978 29.880 1.00 0.00 C ATOM 1313 C GLN B 198 12.780 23.394 29.724 1.00 0.00 C ATOM 1314 O GLN B 198 11.917 22.560 29.407 1.00 0.00 O ATOM 1315 CB GLN B 198 15.108 23.651 28.760 1.00 0.00 C ATOM 1316 CG GLN B 198 14.714 23.213 27.321 1.00 0.00 C ATOM 1317 CD GLN B 198 15.523 23.882 26.206 1.00 0.00 C ATOM 1318 OE1 GLN B 198 16.687 24.253 26.384 1.00 0.00 O ATOM 1319 NE2 GLN B 198 14.919 24.026 25.032 1.00 0.00 N ATOM 0 H GLN B 198 13.561 21.061 29.363 1.00 0.00 H new ATOM 0 HA GLN B 198 14.610 23.300 30.858 1.00 0.00 H new ATOM 0 HB2 GLN B 198 15.008 24.733 28.840 1.00 0.00 H new ATOM 0 HB3 GLN B 198 16.159 23.415 28.927 1.00 0.00 H new ATOM 0 HG2 GLN B 198 14.832 22.133 27.239 1.00 0.00 H new ATOM 0 HG3 GLN B 198 13.657 23.431 27.166 1.00 0.00 H new ATOM 0 HE21 GLN B 198 13.956 23.711 24.912 1.00 0.00 H new ATOM 0 HE22 GLN B 198 15.418 24.452 24.251 1.00 0.00 H new ATOM 1328 N VAL B 199 12.496 24.687 29.967 1.00 0.00 N ATOM 1329 CA VAL B 199 11.247 25.324 29.529 1.00 0.00 C ATOM 1330 C VAL B 199 11.534 26.043 28.190 1.00 0.00 C ATOM 1331 O VAL B 199 12.043 27.170 28.153 1.00 0.00 O ATOM 1332 CB VAL B 199 10.627 26.290 30.621 1.00 0.00 C ATOM 1333 CG1 VAL B 199 11.649 27.322 31.177 1.00 0.00 C ATOM 1334 CG2 VAL B 199 9.342 26.982 30.085 1.00 0.00 C ATOM 0 H VAL B 199 13.124 25.314 30.470 1.00 0.00 H new ATOM 0 HA VAL B 199 10.481 24.562 29.384 1.00 0.00 H new ATOM 0 HB VAL B 199 10.349 25.664 31.469 1.00 0.00 H new ATOM 0 HG11 VAL B 199 11.161 27.953 31.920 1.00 0.00 H new ATOM 0 HG12 VAL B 199 12.483 26.795 31.640 1.00 0.00 H new ATOM 0 HG13 VAL B 199 12.020 27.943 30.361 1.00 0.00 H new ATOM 0 HG21 VAL B 199 8.936 27.640 30.853 1.00 0.00 H new ATOM 0 HG22 VAL B 199 9.587 27.567 29.199 1.00 0.00 H new ATOM 0 HG23 VAL B 199 8.602 26.225 29.827 1.00 0.00 H new ATOM 1344 N THR B 200 11.281 25.315 27.094 1.00 0.00 N ATOM 1345 CA THR B 200 11.588 25.756 25.723 1.00 0.00 C ATOM 1346 C THR B 200 10.714 26.964 25.322 1.00 0.00 C ATOM 1347 O THR B 200 9.506 26.937 25.539 1.00 0.00 O ATOM 1348 CB THR B 200 11.341 24.581 24.713 1.00 0.00 C ATOM 1349 OG1 THR B 200 11.919 23.364 25.219 1.00 0.00 O ATOM 1350 CG2 THR B 200 11.944 24.873 23.323 1.00 0.00 C ATOM 0 H THR B 200 10.852 24.391 27.133 1.00 0.00 H new ATOM 0 HA THR B 200 12.636 26.055 25.692 1.00 0.00 H new ATOM 0 HB THR B 200 10.261 24.476 24.606 1.00 0.00 H new ATOM 0 HG1 THR B 200 11.758 22.636 24.583 1.00 0.00 H new ATOM 0 HG21 THR B 200 11.748 24.032 22.658 1.00 0.00 H new ATOM 0 HG22 THR B 200 11.490 25.775 22.912 1.00 0.00 H new ATOM 0 HG23 THR B 200 13.020 25.019 23.417 1.00 0.00 H new ATOM 1358 N LYS B 201 11.328 28.033 24.781 1.00 0.00 N ATOM 1359 CA LYS B 201 10.579 29.147 24.163 1.00 0.00 C ATOM 1360 C LYS B 201 10.470 28.881 22.661 1.00 0.00 C ATOM 1361 O LYS B 201 11.477 28.671 21.974 1.00 0.00 O ATOM 1362 CB LYS B 201 11.225 30.538 24.456 1.00 0.00 C ATOM 1363 CG LYS B 201 10.889 31.123 25.858 1.00 0.00 C ATOM 1364 CD LYS B 201 11.500 30.321 27.030 1.00 0.00 C ATOM 1365 CE LYS B 201 13.039 30.369 27.040 1.00 0.00 C ATOM 1366 NZ LYS B 201 13.612 29.585 28.164 1.00 0.00 N ATOM 0 H LYS B 201 12.341 28.150 24.759 1.00 0.00 H new ATOM 0 HA LYS B 201 9.583 29.190 24.604 1.00 0.00 H new ATOM 0 HB2 LYS B 201 12.307 30.448 24.364 1.00 0.00 H new ATOM 0 HB3 LYS B 201 10.897 31.245 23.693 1.00 0.00 H new ATOM 0 HG2 LYS B 201 11.247 32.151 25.908 1.00 0.00 H new ATOM 0 HG3 LYS B 201 9.806 31.156 25.978 1.00 0.00 H new ATOM 0 HD2 LYS B 201 11.121 30.716 27.973 1.00 0.00 H new ATOM 0 HD3 LYS B 201 11.173 29.283 26.965 1.00 0.00 H new ATOM 0 HE2 LYS B 201 13.420 29.981 26.096 1.00 0.00 H new ATOM 0 HE3 LYS B 201 13.369 31.405 27.115 1.00 0.00 H new ATOM 0 HZ1 LYS B 201 14.619 29.400 27.980 1.00 0.00 H new ATOM 0 HZ2 LYS B 201 13.515 30.124 29.048 1.00 0.00 H new ATOM 0 HZ3 LYS B 201 13.104 28.682 28.251 1.00 0.00 H new ATOM 1380 N VAL B 202 9.228 28.865 22.183 1.00 0.00 N ATOM 1381 CA VAL B 202 8.855 28.494 20.814 1.00 0.00 C ATOM 1382 C VAL B 202 7.735 29.419 20.303 1.00 0.00 C ATOM 1383 O VAL B 202 6.932 29.942 21.087 1.00 0.00 O ATOM 1384 CB VAL B 202 8.394 26.987 20.765 1.00 0.00 C ATOM 1385 CG1 VAL B 202 9.599 26.018 20.808 1.00 0.00 C ATOM 1386 CG2 VAL B 202 7.398 26.666 21.909 1.00 0.00 C ATOM 0 H VAL B 202 8.423 29.118 22.756 1.00 0.00 H new ATOM 0 HA VAL B 202 9.724 28.610 20.166 1.00 0.00 H new ATOM 0 HB VAL B 202 7.882 26.841 19.814 1.00 0.00 H new ATOM 0 HG11 VAL B 202 9.240 24.989 20.772 1.00 0.00 H new ATOM 0 HG12 VAL B 202 10.248 26.206 19.952 1.00 0.00 H new ATOM 0 HG13 VAL B 202 10.159 26.175 21.730 1.00 0.00 H new ATOM 0 HG21 VAL B 202 7.099 25.620 21.848 1.00 0.00 H new ATOM 0 HG22 VAL B 202 7.877 26.851 22.871 1.00 0.00 H new ATOM 0 HG23 VAL B 202 6.517 27.301 21.814 1.00 0.00 H new ATOM 1396 N ASP B 203 7.702 29.612 18.980 1.00 0.00 N ATOM 1397 CA ASP B 203 6.756 30.534 18.318 1.00 0.00 C ATOM 1398 C ASP B 203 5.371 29.891 18.191 1.00 0.00 C ATOM 1399 O ASP B 203 5.254 28.680 18.037 1.00 0.00 O ATOM 1400 CB ASP B 203 7.284 30.976 16.925 1.00 0.00 C ATOM 1401 CG ASP B 203 8.579 31.794 17.031 1.00 0.00 C ATOM 1402 OD1 ASP B 203 9.662 31.190 17.209 1.00 0.00 O ATOM 1403 OD2 ASP B 203 8.519 33.036 16.982 1.00 0.00 O ATOM 0 H ASP B 203 8.329 29.135 18.332 1.00 0.00 H new ATOM 0 HA ASP B 203 6.667 31.424 18.941 1.00 0.00 H new ATOM 0 HB2 ASP B 203 7.462 30.095 16.309 1.00 0.00 H new ATOM 0 HB3 ASP B 203 6.521 31.569 16.420 1.00 0.00 H new ATOM 1408 N CYS B 204 4.330 30.731 18.271 1.00 0.00 N ATOM 1409 CA CYS B 204 2.927 30.319 18.153 1.00 0.00 C ATOM 1410 C CYS B 204 2.537 30.393 16.664 1.00 0.00 C ATOM 1411 O CYS B 204 2.221 31.474 16.184 1.00 0.00 O ATOM 1412 CB CYS B 204 2.054 31.246 19.037 1.00 0.00 C ATOM 1413 SG CYS B 204 0.316 30.745 19.287 1.00 0.00 S ATOM 0 H CYS B 204 4.443 31.733 18.422 1.00 0.00 H new ATOM 0 HA CYS B 204 2.773 29.298 18.501 1.00 0.00 H new ATOM 0 HB2 CYS B 204 2.528 31.328 20.015 1.00 0.00 H new ATOM 0 HB3 CYS B 204 2.060 32.242 18.595 1.00 0.00 H new ATOM 1418 N PRO B 205 2.551 29.237 15.908 1.00 0.00 N ATOM 1419 CA PRO B 205 2.543 29.228 14.406 1.00 0.00 C ATOM 1420 C PRO B 205 1.234 29.716 13.733 1.00 0.00 C ATOM 1421 O PRO B 205 1.075 29.569 12.512 1.00 0.00 O ATOM 1422 CB PRO B 205 2.818 27.735 14.076 1.00 0.00 C ATOM 1423 CG PRO B 205 2.256 26.994 15.246 1.00 0.00 C ATOM 1424 CD PRO B 205 2.583 27.848 16.447 1.00 0.00 C ATOM 0 HA PRO B 205 3.274 29.936 14.015 1.00 0.00 H new ATOM 0 HB2 PRO B 205 2.335 27.437 13.146 1.00 0.00 H new ATOM 0 HB3 PRO B 205 3.884 27.543 13.957 1.00 0.00 H new ATOM 0 HG2 PRO B 205 1.180 26.853 15.144 1.00 0.00 H new ATOM 0 HG3 PRO B 205 2.700 26.002 15.335 1.00 0.00 H new ATOM 0 HD2 PRO B 205 1.855 27.711 17.246 1.00 0.00 H new ATOM 0 HD3 PRO B 205 3.561 27.601 16.861 1.00 0.00 H new ATOM 1432 N VAL B 206 0.302 30.273 14.523 1.00 0.00 N ATOM 1433 CA VAL B 206 -0.933 30.880 13.996 1.00 0.00 C ATOM 1434 C VAL B 206 -0.843 32.427 14.038 1.00 0.00 C ATOM 1435 O VAL B 206 -1.141 33.098 13.046 1.00 0.00 O ATOM 1436 CB VAL B 206 -2.202 30.406 14.792 1.00 0.00 C ATOM 1437 CG1 VAL B 206 -3.495 30.934 14.123 1.00 0.00 C ATOM 1438 CG2 VAL B 206 -2.229 28.862 14.953 1.00 0.00 C ATOM 0 H VAL B 206 0.381 30.316 15.539 1.00 0.00 H new ATOM 0 HA VAL B 206 -1.036 30.550 12.962 1.00 0.00 H new ATOM 0 HB VAL B 206 -2.148 30.829 15.795 1.00 0.00 H new ATOM 0 HG11 VAL B 206 -4.362 30.595 14.689 1.00 0.00 H new ATOM 0 HG12 VAL B 206 -3.477 32.024 14.105 1.00 0.00 H new ATOM 0 HG13 VAL B 206 -3.557 30.556 13.103 1.00 0.00 H new ATOM 0 HG21 VAL B 206 -3.120 28.570 15.508 1.00 0.00 H new ATOM 0 HG22 VAL B 206 -2.245 28.394 13.969 1.00 0.00 H new ATOM 0 HG23 VAL B 206 -1.341 28.537 15.495 1.00 0.00 H new ATOM 1448 N CYS B 207 -0.432 32.987 15.199 1.00 0.00 N ATOM 1449 CA CYS B 207 -0.439 34.458 15.435 1.00 0.00 C ATOM 1450 C CYS B 207 0.990 35.058 15.432 1.00 0.00 C ATOM 1451 O CYS B 207 1.148 36.277 15.485 1.00 0.00 O ATOM 1452 CB CYS B 207 -1.161 34.783 16.762 1.00 0.00 C ATOM 1453 SG CYS B 207 -0.244 34.313 18.260 1.00 0.00 S ATOM 0 H CYS B 207 -0.090 32.444 15.992 1.00 0.00 H new ATOM 0 HA CYS B 207 -0.982 34.919 14.610 1.00 0.00 H new ATOM 0 HB2 CYS B 207 -1.363 35.853 16.797 1.00 0.00 H new ATOM 0 HB3 CYS B 207 -2.126 34.276 16.769 1.00 0.00 H new ATOM 1458 N GLY B 208 2.018 34.185 15.390 1.00 0.00 N ATOM 1459 CA GLY B 208 3.430 34.591 15.221 1.00 0.00 C ATOM 1460 C GLY B 208 4.062 35.301 16.420 1.00 0.00 C ATOM 1461 O GLY B 208 4.792 36.279 16.237 1.00 0.00 O ATOM 0 H GLY B 208 1.892 33.176 15.472 1.00 0.00 H new ATOM 0 HA2 GLY B 208 4.020 33.703 14.995 1.00 0.00 H new ATOM 0 HA3 GLY B 208 3.499 35.249 14.354 1.00 0.00 H new ATOM 1465 N VAL B 209 3.787 34.820 17.647 1.00 0.00 N ATOM 1466 CA VAL B 209 4.409 35.363 18.892 1.00 0.00 C ATOM 1467 C VAL B 209 5.227 34.262 19.599 1.00 0.00 C ATOM 1468 O VAL B 209 4.750 33.131 19.745 1.00 0.00 O ATOM 1469 CB VAL B 209 3.329 35.985 19.871 1.00 0.00 C ATOM 1470 CG1 VAL B 209 2.549 37.120 19.164 1.00 0.00 C ATOM 1471 CG2 VAL B 209 2.349 34.921 20.441 1.00 0.00 C ATOM 0 H VAL B 209 3.136 34.053 17.814 1.00 0.00 H new ATOM 0 HA VAL B 209 5.080 36.172 18.605 1.00 0.00 H new ATOM 0 HB VAL B 209 3.873 36.398 20.721 1.00 0.00 H new ATOM 0 HG11 VAL B 209 1.811 37.537 19.850 1.00 0.00 H new ATOM 0 HG12 VAL B 209 3.243 37.903 18.858 1.00 0.00 H new ATOM 0 HG13 VAL B 209 2.043 36.721 18.285 1.00 0.00 H new ATOM 0 HG21 VAL B 209 1.632 35.405 21.105 1.00 0.00 H new ATOM 0 HG22 VAL B 209 1.816 34.440 19.620 1.00 0.00 H new ATOM 0 HG23 VAL B 209 2.910 34.171 20.998 1.00 0.00 H new ATOM 1481 N ASN B 210 6.472 34.584 20.011 1.00 0.00 N ATOM 1482 CA ASN B 210 7.353 33.624 20.712 1.00 0.00 C ATOM 1483 C ASN B 210 7.062 33.656 22.229 1.00 0.00 C ATOM 1484 O ASN B 210 7.096 34.719 22.856 1.00 0.00 O ATOM 1485 CB ASN B 210 8.850 33.905 20.419 1.00 0.00 C ATOM 1486 CG ASN B 210 9.783 32.847 21.029 1.00 0.00 C ATOM 1487 OD1 ASN B 210 10.265 32.993 22.147 1.00 0.00 O ATOM 1488 ND2 ASN B 210 10.013 31.756 20.311 1.00 0.00 N ATOM 0 H ASN B 210 6.891 35.503 19.870 1.00 0.00 H new ATOM 0 HA ASN B 210 7.140 32.623 20.336 1.00 0.00 H new ATOM 0 HB2 ASN B 210 9.004 33.941 19.341 1.00 0.00 H new ATOM 0 HB3 ASN B 210 9.115 34.887 20.812 1.00 0.00 H new ATOM 0 HD21 ASN B 210 10.603 31.013 20.686 1.00 0.00 H new ATOM 0 HD22 ASN B 210 9.600 31.659 19.383 1.00 0.00 H new ATOM 1495 N ILE B 211 6.790 32.467 22.781 1.00 0.00 N ATOM 1496 CA ILE B 211 6.268 32.244 24.152 1.00 0.00 C ATOM 1497 C ILE B 211 6.805 30.885 24.683 1.00 0.00 C ATOM 1498 O ILE B 211 7.211 30.051 23.878 1.00 0.00 O ATOM 1499 CB ILE B 211 4.676 32.228 24.126 1.00 0.00 C ATOM 1500 CG1 ILE B 211 4.172 31.347 22.924 1.00 0.00 C ATOM 1501 CG2 ILE B 211 4.081 33.667 24.076 1.00 0.00 C ATOM 1502 CD1 ILE B 211 2.675 31.328 22.717 1.00 0.00 C ATOM 0 H ILE B 211 6.930 31.594 22.272 1.00 0.00 H new ATOM 0 HA ILE B 211 6.600 33.049 24.808 1.00 0.00 H new ATOM 0 HB ILE B 211 4.321 31.783 25.055 1.00 0.00 H new ATOM 0 HG12 ILE B 211 4.644 31.706 22.009 1.00 0.00 H new ATOM 0 HG13 ILE B 211 4.513 30.323 23.078 1.00 0.00 H new ATOM 0 HG21 ILE B 211 2.993 33.610 24.059 1.00 0.00 H new ATOM 0 HG22 ILE B 211 4.402 34.224 24.956 1.00 0.00 H new ATOM 0 HG23 ILE B 211 4.432 34.175 23.177 1.00 0.00 H new ATOM 0 HD11 ILE B 211 2.434 30.693 21.865 1.00 0.00 H new ATOM 0 HD12 ILE B 211 2.189 30.937 23.611 1.00 0.00 H new ATOM 0 HD13 ILE B 211 2.321 32.341 22.526 1.00 0.00 H new ATOM 1514 N PRO B 212 6.832 30.629 26.043 1.00 0.00 N ATOM 1515 CA PRO B 212 7.221 29.295 26.601 1.00 0.00 C ATOM 1516 C PRO B 212 6.306 28.162 26.082 1.00 0.00 C ATOM 1517 O PRO B 212 5.168 28.416 25.708 1.00 0.00 O ATOM 1518 CB PRO B 212 7.084 29.482 28.139 1.00 0.00 C ATOM 1519 CG PRO B 212 6.212 30.694 28.305 1.00 0.00 C ATOM 1520 CD PRO B 212 6.519 31.592 27.128 1.00 0.00 C ATOM 0 HA PRO B 212 8.226 28.997 26.301 1.00 0.00 H new ATOM 0 HB2 PRO B 212 6.635 28.605 28.605 1.00 0.00 H new ATOM 0 HB3 PRO B 212 8.057 29.628 28.607 1.00 0.00 H new ATOM 0 HG2 PRO B 212 5.158 30.417 28.320 1.00 0.00 H new ATOM 0 HG3 PRO B 212 6.422 31.200 29.247 1.00 0.00 H new ATOM 0 HD2 PRO B 212 5.670 32.226 26.872 1.00 0.00 H new ATOM 0 HD3 PRO B 212 7.360 32.254 27.335 1.00 0.00 H new ATOM 1528 N GLU B 213 6.815 26.914 26.094 1.00 0.00 N ATOM 1529 CA GLU B 213 6.164 25.745 25.450 1.00 0.00 C ATOM 1530 C GLU B 213 4.829 25.372 26.138 1.00 0.00 C ATOM 1531 O GLU B 213 3.901 24.863 25.496 1.00 0.00 O ATOM 1532 CB GLU B 213 7.141 24.537 25.437 1.00 0.00 C ATOM 1533 CG GLU B 213 6.747 23.384 24.480 1.00 0.00 C ATOM 1534 CD GLU B 213 7.650 22.143 24.629 1.00 0.00 C ATOM 1535 OE1 GLU B 213 8.840 22.205 24.238 1.00 0.00 O ATOM 1536 OE2 GLU B 213 7.183 21.112 25.164 1.00 0.00 O ATOM 0 H GLU B 213 7.696 26.682 26.553 1.00 0.00 H new ATOM 0 HA GLU B 213 5.922 26.018 24.423 1.00 0.00 H new ATOM 0 HB2 GLU B 213 8.133 24.895 25.161 1.00 0.00 H new ATOM 0 HB3 GLU B 213 7.216 24.139 26.449 1.00 0.00 H new ATOM 0 HG2 GLU B 213 5.712 23.099 24.670 1.00 0.00 H new ATOM 0 HG3 GLU B 213 6.795 23.740 23.451 1.00 0.00 H new ATOM 1543 N SER B 214 4.733 25.634 27.445 1.00 0.00 N ATOM 1544 CA SER B 214 3.478 25.465 28.193 1.00 0.00 C ATOM 1545 C SER B 214 2.415 26.447 27.649 1.00 0.00 C ATOM 1546 O SER B 214 1.302 26.051 27.256 1.00 0.00 O ATOM 1547 CB SER B 214 3.753 25.709 29.695 1.00 0.00 C ATOM 1548 OG SER B 214 4.366 26.979 29.904 1.00 0.00 O ATOM 0 H SER B 214 5.513 25.966 28.012 1.00 0.00 H new ATOM 0 HA SER B 214 3.095 24.452 28.069 1.00 0.00 H new ATOM 0 HB2 SER B 214 2.818 25.657 30.252 1.00 0.00 H new ATOM 0 HB3 SER B 214 4.399 24.921 30.082 1.00 0.00 H new ATOM 0 HG SER B 214 4.528 27.110 30.862 1.00 0.00 H new ATOM 1554 N HIS B 215 2.825 27.724 27.544 1.00 0.00 N ATOM 1555 CA HIS B 215 1.968 28.805 27.043 1.00 0.00 C ATOM 1556 C HIS B 215 1.820 28.756 25.523 1.00 0.00 C ATOM 1557 O HIS B 215 0.951 29.443 24.987 1.00 0.00 O ATOM 1558 CB HIS B 215 2.494 30.189 27.508 1.00 0.00 C ATOM 1559 CG HIS B 215 2.154 30.512 28.939 1.00 0.00 C ATOM 1560 ND1 HIS B 215 2.990 30.260 29.998 1.00 0.00 N ATOM 1561 CD2 HIS B 215 1.031 31.052 29.476 1.00 0.00 C ATOM 1562 CE1 HIS B 215 2.404 30.634 31.116 1.00 0.00 C ATOM 1563 NE2 HIS B 215 1.217 31.118 30.828 1.00 0.00 N ATOM 0 H HIS B 215 3.762 28.032 27.805 1.00 0.00 H new ATOM 0 HA HIS B 215 0.975 28.657 27.468 1.00 0.00 H new ATOM 0 HB2 HIS B 215 3.577 30.217 27.385 1.00 0.00 H new ATOM 0 HB3 HIS B 215 2.080 30.962 26.861 1.00 0.00 H new ATOM 0 HD2 HIS B 215 0.152 31.371 28.935 1.00 0.00 H new ATOM 0 HE1 HIS B 215 2.829 30.556 32.106 1.00 0.00 H new ATOM 0 HE2 HIS B 215 0.545 31.483 31.503 1.00 0.00 H new ATOM 1572 N ILE B 216 2.652 27.940 24.820 1.00 0.00 N ATOM 1573 CA ILE B 216 2.498 27.772 23.372 1.00 0.00 C ATOM 1574 C ILE B 216 1.256 26.925 23.133 1.00 0.00 C ATOM 1575 O ILE B 216 0.380 27.375 22.439 1.00 0.00 O ATOM 1576 CB ILE B 216 3.793 27.230 22.589 1.00 0.00 C ATOM 1577 CG1 ILE B 216 3.873 27.818 21.129 1.00 0.00 C ATOM 1578 CG2 ILE B 216 3.888 25.681 22.511 1.00 0.00 C ATOM 1579 CD1 ILE B 216 2.820 27.301 20.150 1.00 0.00 C ATOM 0 H ILE B 216 3.416 27.405 25.233 1.00 0.00 H new ATOM 0 HA ILE B 216 2.377 28.763 22.935 1.00 0.00 H new ATOM 0 HB ILE B 216 4.637 27.579 23.184 1.00 0.00 H new ATOM 0 HG12 ILE B 216 3.786 28.903 21.188 1.00 0.00 H new ATOM 0 HG13 ILE B 216 4.860 27.599 20.722 1.00 0.00 H new ATOM 0 HG21 ILE B 216 4.789 25.399 21.967 1.00 0.00 H new ATOM 0 HG22 ILE B 216 3.928 25.268 23.519 1.00 0.00 H new ATOM 0 HG23 ILE B 216 3.013 25.289 21.992 1.00 0.00 H new ATOM 0 HD11 ILE B 216 2.967 27.770 19.177 1.00 0.00 H new ATOM 0 HD12 ILE B 216 2.916 26.220 20.050 1.00 0.00 H new ATOM 0 HD13 ILE B 216 1.825 27.544 20.524 1.00 0.00 H new ATOM 1591 N ASN B 217 1.145 25.754 23.797 1.00 0.00 N ATOM 1592 CA ASN B 217 -0.014 24.845 23.620 1.00 0.00 C ATOM 1593 C ASN B 217 -1.329 25.498 24.092 1.00 0.00 C ATOM 1594 O ASN B 217 -2.391 25.214 23.531 1.00 0.00 O ATOM 1595 CB ASN B 217 0.219 23.484 24.322 1.00 0.00 C ATOM 1596 CG ASN B 217 1.317 22.663 23.642 1.00 0.00 C ATOM 1597 OD1 ASN B 217 1.058 21.966 22.659 1.00 0.00 O ATOM 1598 ND2 ASN B 217 2.539 22.739 24.151 1.00 0.00 N ATOM 0 H ASN B 217 1.842 25.414 24.460 1.00 0.00 H new ATOM 0 HA ASN B 217 -0.110 24.653 22.551 1.00 0.00 H new ATOM 0 HB2 ASN B 217 0.489 23.656 25.364 1.00 0.00 H new ATOM 0 HB3 ASN B 217 -0.710 22.914 24.323 1.00 0.00 H new ATOM 0 HD21 ASN B 217 3.302 22.210 23.728 1.00 0.00 H new ATOM 0 HD22 ASN B 217 2.716 23.326 24.966 1.00 0.00 H new ATOM 1605 N LYS B 218 -1.228 26.376 25.108 1.00 0.00 N ATOM 1606 CA LYS B 218 -2.358 27.180 25.604 1.00 0.00 C ATOM 1607 C LYS B 218 -2.840 28.201 24.542 1.00 0.00 C ATOM 1608 O LYS B 218 -3.984 28.116 24.042 1.00 0.00 O ATOM 1609 CB LYS B 218 -1.915 27.904 26.904 1.00 0.00 C ATOM 1610 CG LYS B 218 -2.975 28.843 27.526 1.00 0.00 C ATOM 1611 CD LYS B 218 -2.445 29.578 28.781 1.00 0.00 C ATOM 1612 CE LYS B 218 -3.454 30.580 29.346 1.00 0.00 C ATOM 1613 NZ LYS B 218 -4.709 29.929 29.790 1.00 0.00 N ATOM 0 H LYS B 218 -0.356 26.547 25.609 1.00 0.00 H new ATOM 0 HA LYS B 218 -3.201 26.522 25.814 1.00 0.00 H new ATOM 0 HB2 LYS B 218 -1.639 27.153 27.644 1.00 0.00 H new ATOM 0 HB3 LYS B 218 -1.018 28.485 26.690 1.00 0.00 H new ATOM 0 HG2 LYS B 218 -3.288 29.577 26.783 1.00 0.00 H new ATOM 0 HG3 LYS B 218 -3.859 28.263 27.793 1.00 0.00 H new ATOM 0 HD2 LYS B 218 -2.197 28.845 29.549 1.00 0.00 H new ATOM 0 HD3 LYS B 218 -1.522 30.100 28.529 1.00 0.00 H new ATOM 0 HE2 LYS B 218 -3.005 31.109 30.187 1.00 0.00 H new ATOM 0 HE3 LYS B 218 -3.684 31.327 28.586 1.00 0.00 H new ATOM 0 HZ1 LYS B 218 -5.332 30.638 30.226 1.00 0.00 H new ATOM 0 HZ2 LYS B 218 -5.188 29.504 28.971 1.00 0.00 H new ATOM 0 HZ3 LYS B 218 -4.488 29.188 30.485 1.00 0.00 H new ATOM 1627 N HIS B 219 -1.935 29.153 24.192 1.00 0.00 N ATOM 1628 CA HIS B 219 -2.203 30.249 23.222 1.00 0.00 C ATOM 1629 C HIS B 219 -2.706 29.664 21.904 1.00 0.00 C ATOM 1630 O HIS B 219 -3.663 30.151 21.313 1.00 0.00 O ATOM 1631 CB HIS B 219 -0.905 31.084 22.947 1.00 0.00 C ATOM 1632 CG HIS B 219 -1.098 32.579 22.808 1.00 0.00 C ATOM 1633 ND1 HIS B 219 -0.875 33.278 21.617 1.00 0.00 N ATOM 1634 CD2 HIS B 219 -1.374 33.475 23.790 1.00 0.00 C ATOM 1635 CE1 HIS B 219 -1.016 34.555 21.948 1.00 0.00 C ATOM 1636 NE2 HIS B 219 -1.308 34.713 23.237 1.00 0.00 N ATOM 0 H HIS B 219 -0.991 29.182 24.578 1.00 0.00 H new ATOM 0 HA HIS B 219 -2.960 30.904 23.653 1.00 0.00 H new ATOM 0 HB2 HIS B 219 -0.200 30.902 23.758 1.00 0.00 H new ATOM 0 HB3 HIS B 219 -0.443 30.710 22.033 1.00 0.00 H new ATOM 0 HD2 HIS B 219 -1.603 33.245 24.820 1.00 0.00 H new ATOM 0 HE1 HIS B 219 -0.906 35.373 21.251 1.00 0.00 H new ATOM 0 HE2 HIS B 219 -1.455 35.600 23.720 1.00 0.00 H new ATOM 1644 N LEU B 220 -2.026 28.581 21.502 1.00 0.00 N ATOM 1645 CA LEU B 220 -2.262 27.856 20.272 1.00 0.00 C ATOM 1646 C LEU B 220 -3.644 27.237 20.240 1.00 0.00 C ATOM 1647 O LEU B 220 -4.315 27.345 19.233 1.00 0.00 O ATOM 1648 CB LEU B 220 -1.240 26.737 20.158 1.00 0.00 C ATOM 1649 CG LEU B 220 -1.256 25.927 18.857 1.00 0.00 C ATOM 1650 CD1 LEU B 220 -0.725 26.786 17.683 1.00 0.00 C ATOM 1651 CD2 LEU B 220 -0.468 24.625 19.056 1.00 0.00 C ATOM 0 H LEU B 220 -1.269 28.180 22.056 1.00 0.00 H new ATOM 0 HA LEU B 220 -2.178 28.562 19.446 1.00 0.00 H new ATOM 0 HB2 LEU B 220 -0.246 27.169 20.279 1.00 0.00 H new ATOM 0 HB3 LEU B 220 -1.392 26.049 20.990 1.00 0.00 H new ATOM 0 HG LEU B 220 -2.278 25.650 18.597 1.00 0.00 H new ATOM 0 HD11 LEU B 220 -0.742 26.198 16.765 1.00 0.00 H new ATOM 0 HD12 LEU B 220 -1.356 27.666 17.562 1.00 0.00 H new ATOM 0 HD13 LEU B 220 0.297 27.099 17.895 1.00 0.00 H new ATOM 0 HD21 LEU B 220 -0.479 24.048 18.131 1.00 0.00 H new ATOM 0 HD22 LEU B 220 0.562 24.860 19.325 1.00 0.00 H new ATOM 0 HD23 LEU B 220 -0.927 24.040 19.854 1.00 0.00 H new ATOM 1663 N ASP B 221 -4.041 26.581 21.354 1.00 0.00 N ATOM 1664 CA ASP B 221 -5.353 25.900 21.467 1.00 0.00 C ATOM 1665 C ASP B 221 -6.495 26.883 21.155 1.00 0.00 C ATOM 1666 O ASP B 221 -7.494 26.511 20.542 1.00 0.00 O ATOM 1667 CB ASP B 221 -5.531 25.289 22.879 1.00 0.00 C ATOM 1668 CG ASP B 221 -6.816 24.449 23.018 1.00 0.00 C ATOM 1669 OD1 ASP B 221 -6.827 23.293 22.569 1.00 0.00 O ATOM 1670 OD2 ASP B 221 -7.825 24.946 23.558 1.00 0.00 O ATOM 0 H ASP B 221 -3.467 26.508 22.194 1.00 0.00 H new ATOM 0 HA ASP B 221 -5.385 25.090 20.739 1.00 0.00 H new ATOM 0 HB2 ASP B 221 -4.669 24.663 23.109 1.00 0.00 H new ATOM 0 HB3 ASP B 221 -5.548 26.092 23.616 1.00 0.00 H new ATOM 1675 N SER B 222 -6.295 28.148 21.560 1.00 0.00 N ATOM 1676 CA SER B 222 -7.238 29.242 21.271 1.00 0.00 C ATOM 1677 C SER B 222 -7.052 29.768 19.825 1.00 0.00 C ATOM 1678 O SER B 222 -8.027 30.075 19.140 1.00 0.00 O ATOM 1679 CB SER B 222 -7.040 30.378 22.296 1.00 0.00 C ATOM 1680 OG SER B 222 -7.992 31.424 22.127 1.00 0.00 O ATOM 0 H SER B 222 -5.478 28.441 22.095 1.00 0.00 H new ATOM 0 HA SER B 222 -8.256 28.861 21.354 1.00 0.00 H new ATOM 0 HB2 SER B 222 -7.122 29.974 23.305 1.00 0.00 H new ATOM 0 HB3 SER B 222 -6.034 30.785 22.196 1.00 0.00 H new ATOM 0 HG SER B 222 -7.833 32.122 22.796 1.00 0.00 H new ATOM 1686 N CYS B 223 -5.782 29.835 19.381 1.00 0.00 N ATOM 1687 CA CYS B 223 -5.375 30.454 18.102 1.00 0.00 C ATOM 1688 C CYS B 223 -5.740 29.582 16.875 1.00 0.00 C ATOM 1689 O CYS B 223 -6.133 30.119 15.836 1.00 0.00 O ATOM 1690 CB CYS B 223 -3.851 30.757 18.126 1.00 0.00 C ATOM 1691 SG CYS B 223 -3.386 32.109 19.263 1.00 0.00 S ATOM 0 H CYS B 223 -4.996 29.455 19.909 1.00 0.00 H new ATOM 0 HA CYS B 223 -5.931 31.386 17.997 1.00 0.00 H new ATOM 0 HB2 CYS B 223 -3.315 29.853 18.413 1.00 0.00 H new ATOM 0 HB3 CYS B 223 -3.525 31.014 17.118 1.00 0.00 H new ATOM 1696 N LEU B 224 -5.662 28.239 17.025 1.00 0.00 N ATOM 1697 CA LEU B 224 -5.727 27.278 15.888 1.00 0.00 C ATOM 1698 C LEU B 224 -7.149 27.156 15.324 1.00 0.00 C ATOM 1699 O LEU B 224 -7.365 26.499 14.295 1.00 0.00 O ATOM 1700 CB LEU B 224 -5.130 25.885 16.301 1.00 0.00 C ATOM 1701 CG LEU B 224 -5.754 25.135 17.543 1.00 0.00 C ATOM 1702 CD1 LEU B 224 -7.133 24.492 17.271 1.00 0.00 C ATOM 1703 CD2 LEU B 224 -4.765 24.088 18.095 1.00 0.00 C ATOM 0 H LEU B 224 -5.553 27.788 17.933 1.00 0.00 H new ATOM 0 HA LEU B 224 -5.110 27.672 15.080 1.00 0.00 H new ATOM 0 HB2 LEU B 224 -5.209 25.222 15.439 1.00 0.00 H new ATOM 0 HB3 LEU B 224 -4.067 26.025 16.498 1.00 0.00 H new ATOM 0 HG LEU B 224 -5.933 25.905 18.294 1.00 0.00 H new ATOM 0 HD11 LEU B 224 -7.489 23.998 18.175 1.00 0.00 H new ATOM 0 HD12 LEU B 224 -7.843 25.265 16.976 1.00 0.00 H new ATOM 0 HD13 LEU B 224 -7.041 23.759 16.470 1.00 0.00 H new ATOM 0 HD21 LEU B 224 -5.212 23.581 18.950 1.00 0.00 H new ATOM 0 HD22 LEU B 224 -4.537 23.358 17.319 1.00 0.00 H new ATOM 0 HD23 LEU B 224 -3.846 24.584 18.407 1.00 0.00 H new ATOM 1715 N SER B 225 -8.113 27.757 16.034 1.00 0.00 N ATOM 1716 CA SER B 225 -9.491 27.863 15.585 1.00 0.00 C ATOM 1717 C SER B 225 -9.567 28.899 14.440 1.00 0.00 C ATOM 1718 O SER B 225 -9.744 30.096 14.678 1.00 0.00 O ATOM 1719 CB SER B 225 -10.389 28.260 16.780 1.00 0.00 C ATOM 1720 OG SER B 225 -10.270 27.332 17.842 1.00 0.00 O ATOM 0 H SER B 225 -7.947 28.185 16.945 1.00 0.00 H new ATOM 0 HA SER B 225 -9.848 26.906 15.203 1.00 0.00 H new ATOM 0 HB2 SER B 225 -10.113 29.255 17.130 1.00 0.00 H new ATOM 0 HB3 SER B 225 -11.428 28.313 16.455 1.00 0.00 H new ATOM 0 HG SER B 225 -10.847 27.609 18.584 1.00 0.00 H new ATOM 1726 N ARG B 226 -9.338 28.419 13.207 1.00 0.00 N ATOM 1727 CA ARG B 226 -9.342 29.245 11.984 1.00 0.00 C ATOM 1728 C ARG B 226 -10.315 28.641 10.957 1.00 0.00 C ATOM 1729 O ARG B 226 -10.183 27.465 10.580 1.00 0.00 O ATOM 1730 CB ARG B 226 -7.906 29.352 11.386 1.00 0.00 C ATOM 1731 CG ARG B 226 -7.835 30.047 10.001 1.00 0.00 C ATOM 1732 CD ARG B 226 -6.403 30.171 9.460 1.00 0.00 C ATOM 1733 NE ARG B 226 -6.382 30.664 8.068 1.00 0.00 N ATOM 1734 CZ ARG B 226 -6.262 31.948 7.684 1.00 0.00 C ATOM 1735 NH1 ARG B 226 -6.224 32.934 8.568 1.00 0.00 N ATOM 1736 NH2 ARG B 226 -6.217 32.228 6.393 1.00 0.00 N ATOM 0 H ARG B 226 -9.142 27.434 13.027 1.00 0.00 H new ATOM 0 HA ARG B 226 -9.674 30.252 12.237 1.00 0.00 H new ATOM 0 HB2 ARG B 226 -7.275 29.900 12.086 1.00 0.00 H new ATOM 0 HB3 ARG B 226 -7.488 28.349 11.297 1.00 0.00 H new ATOM 0 HG2 ARG B 226 -8.439 29.485 9.288 1.00 0.00 H new ATOM 0 HG3 ARG B 226 -8.275 31.041 10.077 1.00 0.00 H new ATOM 0 HD2 ARG B 226 -5.833 30.850 10.094 1.00 0.00 H new ATOM 0 HD3 ARG B 226 -5.911 29.200 9.509 1.00 0.00 H new ATOM 0 HE ARG B 226 -6.466 29.966 7.329 1.00 0.00 H new ATOM 0 HH11 ARG B 226 -6.286 32.728 9.565 1.00 0.00 H new ATOM 0 HH12 ARG B 226 -6.132 33.899 8.252 1.00 0.00 H new ATOM 0 HH21 ARG B 226 -6.273 31.476 5.706 1.00 0.00 H new ATOM 0 HH22 ARG B 226 -6.126 33.196 6.084 1.00 0.00 H new ATOM 1750 N GLU B 227 -11.288 29.456 10.529 1.00 0.00 N ATOM 1751 CA GLU B 227 -12.307 29.063 9.535 1.00 0.00 C ATOM 1752 C GLU B 227 -11.851 29.492 8.111 1.00 0.00 C ATOM 1753 O GLU B 227 -11.618 30.702 7.871 1.00 0.00 O ATOM 1754 CB GLU B 227 -13.697 29.657 9.933 1.00 0.00 C ATOM 1755 CG GLU B 227 -13.701 31.174 10.251 1.00 0.00 C ATOM 1756 CD GLU B 227 -15.039 31.676 10.820 1.00 0.00 C ATOM 1757 OE1 GLU B 227 -15.211 31.659 12.057 1.00 0.00 O ATOM 1758 OE2 GLU B 227 -15.929 32.072 10.036 1.00 0.00 O ATOM 1759 OXT GLU B 227 -11.700 28.619 7.235 1.00 0.00 O ATOM 0 H GLU B 227 -11.395 30.414 10.862 1.00 0.00 H new ATOM 0 HA GLU B 227 -12.417 27.979 9.521 1.00 0.00 H new ATOM 0 HB2 GLU B 227 -14.400 29.471 9.121 1.00 0.00 H new ATOM 0 HB3 GLU B 227 -14.068 29.118 10.805 1.00 0.00 H new ATOM 0 HG2 GLU B 227 -12.907 31.390 10.966 1.00 0.00 H new ATOM 0 HG3 GLU B 227 -13.471 31.729 9.342 1.00 0.00 H new TER 1766 GLU B 227 HETATM 1767 ZN ZN B 301 -1.088 32.584 19.625 1.00 0.00 ZN