USER MOD reduce.3.24.130724 H: found=0, std=0, add=791, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 786 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 204 CYS SG : rot 177:sc= -0.603 USER MOD Set 1.2: B 207 CYS SG : rot -63:sc= -0.325 USER MOD Set 1.3: B 219 HIS : no HD1:sc= 0.067 X(o=-0.48,f=-0.87) USER MOD Set 1.4: B 223 CYS SG : rot 76:sc= 0.378 USER MOD Set 2.1: A 7 THR OG1 : rot 127:sc= 0.378 USER MOD Set 2.2: A 9 THR OG1 : rot 180:sc= 1.02 USER MOD Set 3.1: A 6 LYS NZ :NH3+ 180:sc= 1.27 (180deg=0) USER MOD Set 3.2: A 12 THR OG1 : rot 180:sc= 1.07 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -173:sc= 0.433 (180deg=0.386) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 162:sc= 0.517 (180deg=0.157) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -37:sc= 0.392 USER MOD Single : A 22 THR OG1 : rot 32:sc= 0.476 USER MOD Single : A 25 ASN : amide:sc= -0.842 K(o=-0.84,f=-4.5!) USER MOD Single : A 27 LYS NZ :NH3+ -153:sc= -0.0177 (180deg=-0.863) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.685 X(o=-0.68,f=-0.21) USER MOD Single : A 33 LYS NZ :NH3+ -136:sc= 0.664 (180deg=0.0328) USER MOD Single : A 40 GLN : amide:sc= -0.238 K(o=-0.24,f=0.27) USER MOD Single : A 41 GLN : amide:sc= -12.2! C(o=-12!,f=-15!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.717 K(o=0.72,f=-6.4!) USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.628 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -69:sc= 1.45 USER MOD Single : A 60 ASN : amide:sc= -0.142 X(o=-0.14,f=0) USER MOD Single : A 62 GLN : amide:sc= 0.0687 X(o=0.069,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -122:sc= 1.13 (180deg=-0.229) USER MOD Single : A 65 SER OG : rot -130:sc= 0.0909 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.2 K(o=-0.2,f=-0.84) USER MOD Single : B 201 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 210 ASN : amide:sc= -0.621 K(o=-0.62,f=0) USER MOD Single : B 214 SER OG : rot 180:sc= 0 USER MOD Single : B 215 HIS : no HD1:sc= -0.495 X(o=-0.5,f=-0.5) USER MOD Single : B 217 ASN : amide:sc= -0.393 K(o=-0.39,f=-3!) USER MOD Single : B 218 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 222 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 39 N MET A 1 5.119 8.814 0.312 1.00 0.00 N ATOM 40 CA MET A 1 5.431 10.163 -0.196 1.00 0.00 C ATOM 41 C MET A 1 5.945 11.007 0.964 1.00 0.00 C ATOM 42 O MET A 1 5.487 10.866 2.099 1.00 0.00 O ATOM 43 CB MET A 1 4.189 10.846 -0.820 1.00 0.00 C ATOM 44 CG MET A 1 3.498 10.051 -1.930 1.00 0.00 C ATOM 45 SD MET A 1 4.586 9.765 -3.347 1.00 0.00 S ATOM 46 CE MET A 1 3.455 9.046 -4.539 1.00 0.00 C ATOM 0 H1 MET A 1 4.880 8.190 -0.485 1.00 0.00 H new ATOM 0 H2 MET A 1 5.946 8.433 0.815 1.00 0.00 H new ATOM 0 H3 MET A 1 4.311 8.867 0.965 1.00 0.00 H new ATOM 0 HA MET A 1 6.184 10.074 -0.979 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.465 11.040 -0.029 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.489 11.814 -1.221 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.162 9.093 -1.533 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.609 10.589 -2.260 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.992 8.820 -5.460 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.032 8.128 -4.131 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.652 9.752 -4.751 1.00 0.00 H new ATOM 56 N GLN A 2 6.857 11.911 0.665 1.00 0.00 N ATOM 57 CA GLN A 2 7.563 12.689 1.691 1.00 0.00 C ATOM 58 C GLN A 2 6.891 14.038 1.900 1.00 0.00 C ATOM 59 O GLN A 2 6.654 14.756 0.941 1.00 0.00 O ATOM 60 CB GLN A 2 9.062 12.870 1.344 1.00 0.00 C ATOM 61 CG GLN A 2 9.927 11.612 1.597 1.00 0.00 C ATOM 62 CD GLN A 2 9.788 10.527 0.534 1.00 0.00 C ATOM 63 OE1 GLN A 2 8.967 9.613 0.644 1.00 0.00 O ATOM 64 NE2 GLN A 2 10.588 10.632 -0.509 1.00 0.00 N ATOM 0 H GLN A 2 7.136 12.134 -0.290 1.00 0.00 H new ATOM 0 HA GLN A 2 7.509 12.127 2.623 1.00 0.00 H new ATOM 0 HB2 GLN A 2 9.149 13.152 0.295 1.00 0.00 H new ATOM 0 HB3 GLN A 2 9.462 13.697 1.931 1.00 0.00 H new ATOM 0 HG2 GLN A 2 10.973 11.912 1.658 1.00 0.00 H new ATOM 0 HG3 GLN A 2 9.659 11.191 2.566 1.00 0.00 H new ATOM 0 HE21 GLN A 2 11.255 11.402 -0.565 1.00 0.00 H new ATOM 0 HE22 GLN A 2 10.540 9.943 -1.260 1.00 0.00 H new ATOM 73 N ILE A 3 6.593 14.353 3.171 1.00 0.00 N ATOM 74 CA ILE A 3 6.057 15.660 3.614 1.00 0.00 C ATOM 75 C ILE A 3 6.991 16.227 4.694 1.00 0.00 C ATOM 76 O ILE A 3 7.600 15.465 5.469 1.00 0.00 O ATOM 77 CB ILE A 3 4.559 15.610 4.162 1.00 0.00 C ATOM 78 CG1 ILE A 3 4.318 14.441 5.188 1.00 0.00 C ATOM 79 CG2 ILE A 3 3.535 15.556 3.001 1.00 0.00 C ATOM 80 CD1 ILE A 3 4.142 13.046 4.575 1.00 0.00 C ATOM 0 H ILE A 3 6.719 13.695 3.940 1.00 0.00 H new ATOM 0 HA ILE A 3 6.020 16.302 2.734 1.00 0.00 H new ATOM 0 HB ILE A 3 4.404 16.539 4.711 1.00 0.00 H new ATOM 0 HG12 ILE A 3 5.159 14.410 5.880 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.430 14.675 5.775 1.00 0.00 H new ATOM 0 HG21 ILE A 3 2.525 15.523 3.408 1.00 0.00 H new ATOM 0 HG22 ILE A 3 3.646 16.443 2.377 1.00 0.00 H new ATOM 0 HG23 ILE A 3 3.713 14.664 2.400 1.00 0.00 H new ATOM 0 HD11 ILE A 3 3.982 12.317 5.369 1.00 0.00 H new ATOM 0 HD12 ILE A 3 3.281 13.048 3.906 1.00 0.00 H new ATOM 0 HD13 ILE A 3 5.037 12.780 4.013 1.00 0.00 H new ATOM 92 N PHE A 4 7.098 17.564 4.735 1.00 0.00 N ATOM 93 CA PHE A 4 8.065 18.271 5.590 1.00 0.00 C ATOM 94 C PHE A 4 7.347 18.855 6.812 1.00 0.00 C ATOM 95 O PHE A 4 6.664 19.873 6.719 1.00 0.00 O ATOM 96 CB PHE A 4 8.780 19.389 4.776 1.00 0.00 C ATOM 97 CG PHE A 4 9.415 18.906 3.466 1.00 0.00 C ATOM 98 CD1 PHE A 4 10.366 17.886 3.474 1.00 0.00 C ATOM 99 CD2 PHE A 4 9.040 19.441 2.233 1.00 0.00 C ATOM 100 CE1 PHE A 4 10.941 17.439 2.298 1.00 0.00 C ATOM 101 CE2 PHE A 4 9.617 18.993 1.057 1.00 0.00 C ATOM 102 CZ PHE A 4 10.559 17.981 1.089 1.00 0.00 C ATOM 0 H PHE A 4 6.516 18.187 4.175 1.00 0.00 H new ATOM 0 HA PHE A 4 8.822 17.568 5.938 1.00 0.00 H new ATOM 0 HB2 PHE A 4 8.059 20.175 4.549 1.00 0.00 H new ATOM 0 HB3 PHE A 4 9.555 19.837 5.398 1.00 0.00 H new ATOM 0 HD1 PHE A 4 10.658 17.438 4.413 1.00 0.00 H new ATOM 0 HD2 PHE A 4 8.289 20.216 2.196 1.00 0.00 H new ATOM 0 HE1 PHE A 4 11.692 16.663 2.327 1.00 0.00 H new ATOM 0 HE2 PHE A 4 9.331 19.434 0.114 1.00 0.00 H new ATOM 0 HZ PHE A 4 10.994 17.616 0.170 1.00 0.00 H new ATOM 112 N VAL A 5 7.476 18.184 7.955 1.00 0.00 N ATOM 113 CA VAL A 5 6.939 18.667 9.233 1.00 0.00 C ATOM 114 C VAL A 5 8.084 19.365 9.982 1.00 0.00 C ATOM 115 O VAL A 5 9.102 18.751 10.262 1.00 0.00 O ATOM 116 CB VAL A 5 6.310 17.479 10.064 1.00 0.00 C ATOM 117 CG1 VAL A 5 6.169 17.810 11.556 1.00 0.00 C ATOM 118 CG2 VAL A 5 4.932 17.075 9.479 1.00 0.00 C ATOM 0 H VAL A 5 7.957 17.287 8.025 1.00 0.00 H new ATOM 0 HA VAL A 5 6.129 19.378 9.071 1.00 0.00 H new ATOM 0 HB VAL A 5 7.001 16.640 9.982 1.00 0.00 H new ATOM 0 HG11 VAL A 5 5.732 16.959 12.078 1.00 0.00 H new ATOM 0 HG12 VAL A 5 7.152 18.027 11.975 1.00 0.00 H new ATOM 0 HG13 VAL A 5 5.523 18.680 11.676 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.514 16.256 10.064 1.00 0.00 H new ATOM 0 HG22 VAL A 5 4.256 17.929 9.517 1.00 0.00 H new ATOM 0 HG23 VAL A 5 5.056 16.756 8.444 1.00 0.00 H new ATOM 128 N LYS A 6 7.926 20.664 10.244 1.00 0.00 N ATOM 129 CA LYS A 6 8.963 21.496 10.873 1.00 0.00 C ATOM 130 C LYS A 6 8.543 21.835 12.317 1.00 0.00 C ATOM 131 O LYS A 6 7.456 22.389 12.514 1.00 0.00 O ATOM 132 CB LYS A 6 9.129 22.809 10.051 1.00 0.00 C ATOM 133 CG LYS A 6 10.465 23.550 10.283 1.00 0.00 C ATOM 134 CD LYS A 6 11.625 22.929 9.471 1.00 0.00 C ATOM 135 CE LYS A 6 12.968 23.635 9.721 1.00 0.00 C ATOM 136 NZ LYS A 6 14.004 23.237 8.739 1.00 0.00 N ATOM 0 H LYS A 6 7.071 21.175 10.026 1.00 0.00 H new ATOM 0 HA LYS A 6 9.910 20.956 10.893 1.00 0.00 H new ATOM 0 HB2 LYS A 6 9.040 22.572 8.991 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.308 23.482 10.297 1.00 0.00 H new ATOM 0 HG2 LYS A 6 10.350 24.598 10.006 1.00 0.00 H new ATOM 0 HG3 LYS A 6 10.713 23.526 11.344 1.00 0.00 H new ATOM 0 HD2 LYS A 6 11.720 21.874 9.729 1.00 0.00 H new ATOM 0 HD3 LYS A 6 11.386 22.977 8.409 1.00 0.00 H new ATOM 0 HE2 LYS A 6 12.823 24.714 9.675 1.00 0.00 H new ATOM 0 HE3 LYS A 6 13.316 23.403 10.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 14.891 23.738 8.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 14.164 22.211 8.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 13.685 23.482 7.780 1.00 0.00 H new ATOM 150 N THR A 7 9.398 21.526 13.317 1.00 0.00 N ATOM 151 CA THR A 7 9.128 21.888 14.719 1.00 0.00 C ATOM 152 C THR A 7 9.314 23.392 14.952 1.00 0.00 C ATOM 153 O THR A 7 9.903 24.107 14.128 1.00 0.00 O ATOM 154 CB THR A 7 10.051 21.124 15.721 1.00 0.00 C ATOM 155 OG1 THR A 7 11.416 21.293 15.332 1.00 0.00 O ATOM 156 CG2 THR A 7 9.710 19.639 15.821 1.00 0.00 C ATOM 0 H THR A 7 10.277 21.028 13.176 1.00 0.00 H new ATOM 0 HA THR A 7 8.092 21.603 14.902 1.00 0.00 H new ATOM 0 HB THR A 7 9.887 21.550 16.711 1.00 0.00 H new ATOM 0 HG1 THR A 7 11.935 21.621 16.095 1.00 0.00 H new ATOM 0 HG21 THR A 7 10.383 19.158 16.531 1.00 0.00 H new ATOM 0 HG22 THR A 7 8.681 19.524 16.161 1.00 0.00 H new ATOM 0 HG23 THR A 7 9.823 19.173 14.842 1.00 0.00 H new ATOM 164 N LEU A 8 8.833 23.839 16.119 1.00 0.00 N ATOM 165 CA LEU A 8 9.050 25.205 16.621 1.00 0.00 C ATOM 166 C LEU A 8 10.531 25.421 16.999 1.00 0.00 C ATOM 167 O LEU A 8 11.016 26.554 17.025 1.00 0.00 O ATOM 168 CB LEU A 8 8.168 25.453 17.861 1.00 0.00 C ATOM 169 CG LEU A 8 6.663 25.097 17.731 1.00 0.00 C ATOM 170 CD1 LEU A 8 5.924 25.372 19.051 1.00 0.00 C ATOM 171 CD2 LEU A 8 6.002 25.831 16.547 1.00 0.00 C ATOM 0 H LEU A 8 8.277 23.259 16.748 1.00 0.00 H new ATOM 0 HA LEU A 8 8.782 25.906 15.830 1.00 0.00 H new ATOM 0 HB2 LEU A 8 8.582 24.882 18.692 1.00 0.00 H new ATOM 0 HB3 LEU A 8 8.246 26.507 18.128 1.00 0.00 H new ATOM 0 HG LEU A 8 6.590 24.030 17.521 1.00 0.00 H new ATOM 0 HD11 LEU A 8 4.871 25.116 18.938 1.00 0.00 H new ATOM 0 HD12 LEU A 8 6.361 24.768 19.846 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.015 26.428 19.306 1.00 0.00 H new ATOM 0 HD21 LEU A 8 4.949 25.555 16.490 1.00 0.00 H new ATOM 0 HD22 LEU A 8 6.088 26.908 16.693 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.501 25.550 15.620 1.00 0.00 H new ATOM 183 N THR A 9 11.225 24.305 17.301 1.00 0.00 N ATOM 184 CA THR A 9 12.654 24.303 17.637 1.00 0.00 C ATOM 185 C THR A 9 13.517 24.413 16.360 1.00 0.00 C ATOM 186 O THR A 9 14.713 24.701 16.434 1.00 0.00 O ATOM 187 CB THR A 9 13.028 23.018 18.456 1.00 0.00 C ATOM 188 OG1 THR A 9 12.678 21.842 17.712 1.00 0.00 O ATOM 189 CG2 THR A 9 12.307 22.973 19.819 1.00 0.00 C ATOM 0 H THR A 9 10.803 23.377 17.317 1.00 0.00 H new ATOM 0 HA THR A 9 12.860 25.174 18.259 1.00 0.00 H new ATOM 0 HB THR A 9 14.103 23.052 18.634 1.00 0.00 H new ATOM 0 HG1 THR A 9 12.916 21.045 18.230 1.00 0.00 H new ATOM 0 HG21 THR A 9 12.594 22.067 20.353 1.00 0.00 H new ATOM 0 HG22 THR A 9 12.588 23.846 20.408 1.00 0.00 H new ATOM 0 HG23 THR A 9 11.229 22.974 19.660 1.00 0.00 H new ATOM 197 N GLY A 10 12.887 24.193 15.190 1.00 0.00 N ATOM 198 CA GLY A 10 13.517 24.461 13.896 1.00 0.00 C ATOM 199 C GLY A 10 14.180 23.248 13.268 1.00 0.00 C ATOM 200 O GLY A 10 15.026 23.397 12.375 1.00 0.00 O ATOM 0 H GLY A 10 11.937 23.828 15.122 1.00 0.00 H new ATOM 0 HA2 GLY A 10 12.763 24.846 13.209 1.00 0.00 H new ATOM 0 HA3 GLY A 10 14.263 25.245 14.022 1.00 0.00 H new ATOM 204 N LYS A 11 13.803 22.046 13.721 1.00 0.00 N ATOM 205 CA LYS A 11 14.248 20.787 13.093 1.00 0.00 C ATOM 206 C LYS A 11 13.201 20.352 12.056 1.00 0.00 C ATOM 207 O LYS A 11 12.017 20.707 12.168 1.00 0.00 O ATOM 208 CB LYS A 11 14.500 19.662 14.146 1.00 0.00 C ATOM 209 CG LYS A 11 13.271 18.804 14.511 1.00 0.00 C ATOM 210 CD LYS A 11 13.604 17.578 15.409 1.00 0.00 C ATOM 211 CE LYS A 11 13.742 16.265 14.613 1.00 0.00 C ATOM 212 NZ LYS A 11 14.646 16.370 13.444 1.00 0.00 N ATOM 0 H LYS A 11 13.188 21.914 14.524 1.00 0.00 H new ATOM 0 HA LYS A 11 15.204 20.962 12.599 1.00 0.00 H new ATOM 0 HB2 LYS A 11 15.281 19.003 13.767 1.00 0.00 H new ATOM 0 HB3 LYS A 11 14.884 20.121 15.057 1.00 0.00 H new ATOM 0 HG2 LYS A 11 12.542 19.431 15.024 1.00 0.00 H new ATOM 0 HG3 LYS A 11 12.800 18.453 13.593 1.00 0.00 H new ATOM 0 HD2 LYS A 11 14.533 17.770 15.946 1.00 0.00 H new ATOM 0 HD3 LYS A 11 12.821 17.461 16.159 1.00 0.00 H new ATOM 0 HE2 LYS A 11 14.111 15.484 15.278 1.00 0.00 H new ATOM 0 HE3 LYS A 11 12.755 15.952 14.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 14.934 15.418 13.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 14.150 16.847 12.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 15.489 16.920 13.706 1.00 0.00 H new ATOM 226 N THR A 12 13.639 19.608 11.041 1.00 0.00 N ATOM 227 CA THR A 12 12.743 19.032 10.035 1.00 0.00 C ATOM 228 C THR A 12 12.515 17.538 10.325 1.00 0.00 C ATOM 229 O THR A 12 13.415 16.836 10.815 1.00 0.00 O ATOM 230 CB THR A 12 13.335 19.187 8.611 1.00 0.00 C ATOM 231 OG1 THR A 12 13.890 20.491 8.451 1.00 0.00 O ATOM 232 CG2 THR A 12 12.275 18.946 7.512 1.00 0.00 C ATOM 0 H THR A 12 14.623 19.387 10.892 1.00 0.00 H new ATOM 0 HA THR A 12 11.795 19.568 10.084 1.00 0.00 H new ATOM 0 HB THR A 12 14.113 18.432 8.501 1.00 0.00 H new ATOM 0 HG1 THR A 12 14.263 20.579 7.549 1.00 0.00 H new ATOM 0 HG21 THR A 12 12.735 19.065 6.531 1.00 0.00 H new ATOM 0 HG22 THR A 12 11.877 17.936 7.606 1.00 0.00 H new ATOM 0 HG23 THR A 12 11.465 19.667 7.623 1.00 0.00 H new ATOM 240 N ILE A 13 11.301 17.085 10.017 1.00 0.00 N ATOM 241 CA ILE A 13 10.852 15.704 10.184 1.00 0.00 C ATOM 242 C ILE A 13 10.244 15.258 8.845 1.00 0.00 C ATOM 243 O ILE A 13 9.186 15.756 8.443 1.00 0.00 O ATOM 244 CB ILE A 13 9.783 15.557 11.346 1.00 0.00 C ATOM 245 CG1 ILE A 13 10.333 16.074 12.719 1.00 0.00 C ATOM 246 CG2 ILE A 13 9.310 14.104 11.481 1.00 0.00 C ATOM 247 CD1 ILE A 13 10.142 17.560 12.958 1.00 0.00 C ATOM 0 H ILE A 13 10.577 17.691 9.631 1.00 0.00 H new ATOM 0 HA ILE A 13 11.700 15.079 10.465 1.00 0.00 H new ATOM 0 HB ILE A 13 8.932 16.180 11.071 1.00 0.00 H new ATOM 0 HG12 ILE A 13 9.842 15.524 13.522 1.00 0.00 H new ATOM 0 HG13 ILE A 13 11.397 15.844 12.779 1.00 0.00 H new ATOM 0 HG21 ILE A 13 8.578 14.033 12.285 1.00 0.00 H new ATOM 0 HG22 ILE A 13 8.854 13.781 10.545 1.00 0.00 H new ATOM 0 HG23 ILE A 13 10.162 13.464 11.709 1.00 0.00 H new ATOM 0 HD11 ILE A 13 10.552 17.828 13.932 1.00 0.00 H new ATOM 0 HD12 ILE A 13 10.657 18.123 12.180 1.00 0.00 H new ATOM 0 HD13 ILE A 13 9.079 17.799 12.934 1.00 0.00 H new ATOM 259 N THR A 14 10.948 14.368 8.135 1.00 0.00 N ATOM 260 CA THR A 14 10.485 13.807 6.862 1.00 0.00 C ATOM 261 C THR A 14 9.632 12.560 7.141 1.00 0.00 C ATOM 262 O THR A 14 10.141 11.573 7.681 1.00 0.00 O ATOM 263 CB THR A 14 11.692 13.426 5.941 1.00 0.00 C ATOM 264 OG1 THR A 14 12.552 14.560 5.774 1.00 0.00 O ATOM 265 CG2 THR A 14 11.242 12.936 4.552 1.00 0.00 C ATOM 0 H THR A 14 11.859 14.016 8.430 1.00 0.00 H new ATOM 0 HA THR A 14 9.890 14.560 6.345 1.00 0.00 H new ATOM 0 HB THR A 14 12.220 12.609 6.432 1.00 0.00 H new ATOM 0 HG1 THR A 14 13.307 14.316 5.198 1.00 0.00 H new ATOM 0 HG21 THR A 14 12.118 12.685 3.953 1.00 0.00 H new ATOM 0 HG22 THR A 14 10.614 12.052 4.664 1.00 0.00 H new ATOM 0 HG23 THR A 14 10.676 13.723 4.054 1.00 0.00 H new ATOM 273 N LEU A 15 8.334 12.618 6.797 1.00 0.00 N ATOM 274 CA LEU A 15 7.410 11.468 6.928 1.00 0.00 C ATOM 275 C LEU A 15 7.195 10.879 5.549 1.00 0.00 C ATOM 276 O LEU A 15 7.269 11.593 4.558 1.00 0.00 O ATOM 277 CB LEU A 15 6.031 11.854 7.543 1.00 0.00 C ATOM 278 CG LEU A 15 6.060 12.665 8.869 1.00 0.00 C ATOM 279 CD1 LEU A 15 7.040 12.060 9.884 1.00 0.00 C ATOM 280 CD2 LEU A 15 6.372 14.144 8.616 1.00 0.00 C ATOM 0 H LEU A 15 7.893 13.458 6.421 1.00 0.00 H new ATOM 0 HA LEU A 15 7.865 10.750 7.611 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.478 12.432 6.803 1.00 0.00 H new ATOM 0 HB3 LEU A 15 5.468 10.937 7.717 1.00 0.00 H new ATOM 0 HG LEU A 15 5.061 12.605 9.302 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.031 12.655 10.797 1.00 0.00 H new ATOM 0 HD12 LEU A 15 6.740 11.038 10.114 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.045 12.057 9.462 1.00 0.00 H new ATOM 0 HD21 LEU A 15 6.384 14.681 9.565 1.00 0.00 H new ATOM 0 HD22 LEU A 15 7.346 14.233 8.136 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.607 14.571 7.967 1.00 0.00 H new ATOM 292 N GLU A 16 6.902 9.585 5.498 1.00 0.00 N ATOM 293 CA GLU A 16 6.836 8.824 4.247 1.00 0.00 C ATOM 294 C GLU A 16 5.495 8.074 4.183 1.00 0.00 C ATOM 295 O GLU A 16 5.417 6.879 4.502 1.00 0.00 O ATOM 296 CB GLU A 16 8.054 7.865 4.177 1.00 0.00 C ATOM 297 CG GLU A 16 9.422 8.575 4.192 1.00 0.00 C ATOM 298 CD GLU A 16 10.594 7.606 4.352 1.00 0.00 C ATOM 299 OE1 GLU A 16 11.129 7.114 3.333 1.00 0.00 O ATOM 300 OE2 GLU A 16 10.971 7.307 5.512 1.00 0.00 O ATOM 0 H GLU A 16 6.701 9.026 6.327 1.00 0.00 H new ATOM 0 HA GLU A 16 6.883 9.486 3.382 1.00 0.00 H new ATOM 0 HB2 GLU A 16 8.007 7.175 5.019 1.00 0.00 H new ATOM 0 HB3 GLU A 16 7.978 7.266 3.269 1.00 0.00 H new ATOM 0 HG2 GLU A 16 9.545 9.136 3.265 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.441 9.298 5.007 1.00 0.00 H new ATOM 307 N VAL A 17 4.429 8.805 3.814 1.00 0.00 N ATOM 308 CA VAL A 17 3.042 8.285 3.714 1.00 0.00 C ATOM 309 C VAL A 17 2.320 8.998 2.559 1.00 0.00 C ATOM 310 O VAL A 17 2.877 9.895 1.928 1.00 0.00 O ATOM 311 CB VAL A 17 2.205 8.512 5.038 1.00 0.00 C ATOM 312 CG1 VAL A 17 2.785 7.756 6.255 1.00 0.00 C ATOM 313 CG2 VAL A 17 2.058 10.024 5.326 1.00 0.00 C ATOM 0 H VAL A 17 4.502 9.793 3.571 1.00 0.00 H new ATOM 0 HA VAL A 17 3.114 7.211 3.543 1.00 0.00 H new ATOM 0 HB VAL A 17 1.214 8.089 4.870 1.00 0.00 H new ATOM 0 HG11 VAL A 17 2.168 7.951 7.132 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.794 6.686 6.048 1.00 0.00 H new ATOM 0 HG13 VAL A 17 3.803 8.097 6.444 1.00 0.00 H new ATOM 0 HG21 VAL A 17 1.480 10.166 6.239 1.00 0.00 H new ATOM 0 HG22 VAL A 17 3.046 10.469 5.449 1.00 0.00 H new ATOM 0 HG23 VAL A 17 1.544 10.505 4.493 1.00 0.00 H new ATOM 323 N GLU A 18 1.062 8.630 2.320 1.00 0.00 N ATOM 324 CA GLU A 18 0.250 9.248 1.260 1.00 0.00 C ATOM 325 C GLU A 18 -0.420 10.533 1.786 1.00 0.00 C ATOM 326 O GLU A 18 -0.653 10.656 2.997 1.00 0.00 O ATOM 327 CB GLU A 18 -0.830 8.254 0.758 1.00 0.00 C ATOM 328 CG GLU A 18 -0.303 6.826 0.541 1.00 0.00 C ATOM 329 CD GLU A 18 -1.164 5.957 -0.398 1.00 0.00 C ATOM 330 OE1 GLU A 18 -1.746 6.491 -1.367 1.00 0.00 O ATOM 331 OE2 GLU A 18 -1.213 4.728 -0.208 1.00 0.00 O ATOM 0 H GLU A 18 0.577 7.904 2.846 1.00 0.00 H new ATOM 0 HA GLU A 18 0.904 9.505 0.427 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.647 8.225 1.479 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.245 8.625 -0.179 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.707 6.884 0.136 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.230 6.329 1.508 1.00 0.00 H new ATOM 338 N PRO A 19 -0.735 11.525 0.891 1.00 0.00 N ATOM 339 CA PRO A 19 -1.670 12.622 1.237 1.00 0.00 C ATOM 340 C PRO A 19 -3.064 12.058 1.627 1.00 0.00 C ATOM 341 O PRO A 19 -3.728 12.573 2.524 1.00 0.00 O ATOM 342 CB PRO A 19 -1.715 13.496 -0.052 1.00 0.00 C ATOM 343 CG PRO A 19 -1.188 12.604 -1.144 1.00 0.00 C ATOM 344 CD PRO A 19 -0.176 11.692 -0.482 1.00 0.00 C ATOM 0 HA PRO A 19 -1.354 13.202 2.104 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.730 13.828 -0.269 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -1.103 14.391 0.056 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -1.993 12.028 -1.601 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.725 13.190 -1.938 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -0.089 10.738 -1.003 1.00 0.00 H new ATOM 0 HD3 PRO A 19 0.819 12.137 -0.463 1.00 0.00 H new ATOM 352 N SER A 20 -3.442 10.936 0.992 1.00 0.00 N ATOM 353 CA SER A 20 -4.749 10.285 1.178 1.00 0.00 C ATOM 354 C SER A 20 -4.693 9.206 2.292 1.00 0.00 C ATOM 355 O SER A 20 -5.671 8.474 2.493 1.00 0.00 O ATOM 356 CB SER A 20 -5.191 9.672 -0.181 1.00 0.00 C ATOM 357 OG SER A 20 -6.520 9.170 -0.142 1.00 0.00 O ATOM 0 H SER A 20 -2.841 10.450 0.327 1.00 0.00 H new ATOM 0 HA SER A 20 -5.481 11.025 1.501 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.115 10.430 -0.960 1.00 0.00 H new ATOM 0 HB3 SER A 20 -4.509 8.866 -0.452 1.00 0.00 H new ATOM 0 HG SER A 20 -6.693 8.770 0.736 1.00 0.00 H new ATOM 363 N ASP A 21 -3.558 9.145 3.040 1.00 0.00 N ATOM 364 CA ASP A 21 -3.320 8.113 4.076 1.00 0.00 C ATOM 365 C ASP A 21 -4.177 8.417 5.340 1.00 0.00 C ATOM 366 O ASP A 21 -5.337 8.002 5.394 1.00 0.00 O ATOM 367 CB ASP A 21 -1.795 8.020 4.380 1.00 0.00 C ATOM 368 CG ASP A 21 -1.385 6.758 5.147 1.00 0.00 C ATOM 369 OD1 ASP A 21 -1.462 6.757 6.385 1.00 0.00 O ATOM 370 OD2 ASP A 21 -0.990 5.760 4.502 1.00 0.00 O ATOM 0 H ASP A 21 -2.789 9.808 2.940 1.00 0.00 H new ATOM 0 HA ASP A 21 -3.635 7.134 3.714 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -1.245 8.055 3.439 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -1.496 8.896 4.957 1.00 0.00 H new ATOM 375 N THR A 22 -3.605 9.162 6.325 1.00 0.00 N ATOM 376 CA THR A 22 -4.334 9.698 7.508 1.00 0.00 C ATOM 377 C THR A 22 -3.351 10.427 8.441 1.00 0.00 C ATOM 378 O THR A 22 -2.200 10.009 8.582 1.00 0.00 O ATOM 379 CB THR A 22 -5.129 8.610 8.336 1.00 0.00 C ATOM 380 OG1 THR A 22 -5.846 9.227 9.426 1.00 0.00 O ATOM 381 CG2 THR A 22 -4.221 7.499 8.893 1.00 0.00 C ATOM 0 H THR A 22 -2.616 9.410 6.320 1.00 0.00 H new ATOM 0 HA THR A 22 -5.081 10.383 7.107 1.00 0.00 H new ATOM 0 HB THR A 22 -5.828 8.148 7.639 1.00 0.00 H new ATOM 0 HG1 THR A 22 -6.119 10.132 9.167 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.823 6.783 9.451 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.722 6.989 8.069 1.00 0.00 H new ATOM 0 HG23 THR A 22 -3.473 7.937 9.554 1.00 0.00 H new ATOM 389 N ILE A 23 -3.841 11.510 9.090 1.00 0.00 N ATOM 390 CA ILE A 23 -3.060 12.333 10.044 1.00 0.00 C ATOM 391 C ILE A 23 -2.633 11.493 11.266 1.00 0.00 C ATOM 392 O ILE A 23 -1.559 11.710 11.815 1.00 0.00 O ATOM 393 CB ILE A 23 -3.884 13.588 10.553 1.00 0.00 C ATOM 394 CG1 ILE A 23 -4.365 14.501 9.379 1.00 0.00 C ATOM 395 CG2 ILE A 23 -3.086 14.431 11.584 1.00 0.00 C ATOM 396 CD1 ILE A 23 -3.250 15.161 8.587 1.00 0.00 C ATOM 0 H ILE A 23 -4.798 11.840 8.965 1.00 0.00 H new ATOM 0 HA ILE A 23 -2.179 12.685 9.507 1.00 0.00 H new ATOM 0 HB ILE A 23 -4.765 13.181 11.048 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -4.971 13.904 8.698 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -5.013 15.278 9.784 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -3.690 15.280 11.905 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -2.841 13.813 12.448 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.166 14.793 11.124 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -3.680 15.774 7.795 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -2.656 15.790 9.250 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -2.613 14.394 8.147 1.00 0.00 H new ATOM 408 N GLU A 24 -3.505 10.543 11.668 1.00 0.00 N ATOM 409 CA GLU A 24 -3.243 9.594 12.778 1.00 0.00 C ATOM 410 C GLU A 24 -1.915 8.855 12.557 1.00 0.00 C ATOM 411 O GLU A 24 -1.114 8.666 13.486 1.00 0.00 O ATOM 412 CB GLU A 24 -4.402 8.565 12.878 1.00 0.00 C ATOM 413 CG GLU A 24 -4.270 7.532 14.014 1.00 0.00 C ATOM 414 CD GLU A 24 -5.351 6.442 13.960 1.00 0.00 C ATOM 415 OE1 GLU A 24 -5.242 5.536 13.104 1.00 0.00 O ATOM 416 OE2 GLU A 24 -6.313 6.499 14.746 1.00 0.00 O ATOM 0 H GLU A 24 -4.417 10.410 11.230 1.00 0.00 H new ATOM 0 HA GLU A 24 -3.178 10.160 13.707 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -5.338 9.108 13.010 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -4.475 8.031 11.930 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -3.287 7.064 13.960 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -4.327 8.046 14.974 1.00 0.00 H new ATOM 423 N ASN A 25 -1.689 8.479 11.298 1.00 0.00 N ATOM 424 CA ASN A 25 -0.501 7.731 10.901 1.00 0.00 C ATOM 425 C ASN A 25 0.700 8.664 10.820 1.00 0.00 C ATOM 426 O ASN A 25 1.767 8.331 11.306 1.00 0.00 O ATOM 427 CB ASN A 25 -0.736 7.049 9.550 1.00 0.00 C ATOM 428 CG ASN A 25 0.293 5.963 9.250 1.00 0.00 C ATOM 429 OD1 ASN A 25 1.298 6.197 8.593 1.00 0.00 O ATOM 430 ND2 ASN A 25 0.071 4.782 9.791 1.00 0.00 N ATOM 0 H ASN A 25 -2.325 8.685 10.527 1.00 0.00 H new ATOM 0 HA ASN A 25 -0.299 6.964 11.649 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -1.734 6.611 9.538 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -0.707 7.799 8.760 1.00 0.00 H new ATOM 0 HD21 ASN A 25 0.748 4.029 9.668 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -0.778 4.621 10.333 1.00 0.00 H new ATOM 437 N VAL A 26 0.473 9.851 10.225 1.00 0.00 N ATOM 438 CA VAL A 26 1.510 10.892 10.035 1.00 0.00 C ATOM 439 C VAL A 26 2.128 11.285 11.383 1.00 0.00 C ATOM 440 O VAL A 26 3.339 11.360 11.509 1.00 0.00 O ATOM 441 CB VAL A 26 0.936 12.183 9.324 1.00 0.00 C ATOM 442 CG1 VAL A 26 2.011 13.297 9.155 1.00 0.00 C ATOM 443 CG2 VAL A 26 0.312 11.827 7.962 1.00 0.00 C ATOM 0 H VAL A 26 -0.440 10.119 9.859 1.00 0.00 H new ATOM 0 HA VAL A 26 2.276 10.463 9.388 1.00 0.00 H new ATOM 0 HB VAL A 26 0.159 12.581 9.976 1.00 0.00 H new ATOM 0 HG11 VAL A 26 1.565 14.161 8.662 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.386 13.592 10.135 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.835 12.919 8.550 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -0.076 12.731 7.492 1.00 0.00 H new ATOM 0 HG22 VAL A 26 1.071 11.381 7.319 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -0.502 11.117 8.109 1.00 0.00 H new ATOM 453 N LYS A 27 1.272 11.471 12.399 1.00 0.00 N ATOM 454 CA LYS A 27 1.703 11.889 13.742 1.00 0.00 C ATOM 455 C LYS A 27 2.438 10.734 14.462 1.00 0.00 C ATOM 456 O LYS A 27 3.383 10.966 15.230 1.00 0.00 O ATOM 457 CB LYS A 27 0.499 12.434 14.557 1.00 0.00 C ATOM 458 CG LYS A 27 -0.604 11.429 14.941 1.00 0.00 C ATOM 459 CD LYS A 27 -1.762 12.104 15.717 1.00 0.00 C ATOM 460 CE LYS A 27 -2.465 13.201 14.902 1.00 0.00 C ATOM 461 NZ LYS A 27 -3.405 14.018 15.720 1.00 0.00 N ATOM 0 H LYS A 27 0.265 11.336 12.314 1.00 0.00 H new ATOM 0 HA LYS A 27 2.417 12.707 13.649 1.00 0.00 H new ATOM 0 HB2 LYS A 27 0.885 12.878 15.474 1.00 0.00 H new ATOM 0 HB3 LYS A 27 0.039 13.238 13.983 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -0.997 10.961 14.039 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -0.174 10.635 15.551 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -2.492 11.346 16.003 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -1.372 12.536 16.639 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -1.714 13.855 14.459 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -3.013 12.741 14.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -4.155 14.400 15.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -3.830 13.422 16.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -2.887 14.803 16.164 1.00 0.00 H new ATOM 475 N ALA A 28 2.018 9.484 14.170 1.00 0.00 N ATOM 476 CA ALA A 28 2.747 8.272 14.600 1.00 0.00 C ATOM 477 C ALA A 28 4.116 8.161 13.887 1.00 0.00 C ATOM 478 O ALA A 28 5.062 7.585 14.439 1.00 0.00 O ATOM 479 CB ALA A 28 1.896 7.024 14.335 1.00 0.00 C ATOM 0 H ALA A 28 1.172 9.288 13.635 1.00 0.00 H new ATOM 0 HA ALA A 28 2.936 8.348 15.671 1.00 0.00 H new ATOM 0 HB1 ALA A 28 2.442 6.137 14.655 1.00 0.00 H new ATOM 0 HB2 ALA A 28 0.962 7.096 14.892 1.00 0.00 H new ATOM 0 HB3 ALA A 28 1.679 6.951 13.269 1.00 0.00 H new ATOM 485 N LYS A 29 4.205 8.726 12.659 1.00 0.00 N ATOM 486 CA LYS A 29 5.456 8.757 11.881 1.00 0.00 C ATOM 487 C LYS A 29 6.442 9.771 12.496 1.00 0.00 C ATOM 488 O LYS A 29 7.633 9.520 12.487 1.00 0.00 O ATOM 489 CB LYS A 29 5.224 9.093 10.375 1.00 0.00 C ATOM 490 CG LYS A 29 4.354 8.117 9.551 1.00 0.00 C ATOM 491 CD LYS A 29 4.825 6.633 9.595 1.00 0.00 C ATOM 492 CE LYS A 29 3.959 5.750 10.510 1.00 0.00 C ATOM 493 NZ LYS A 29 4.477 4.360 10.589 1.00 0.00 N ATOM 0 H LYS A 29 3.416 9.168 12.188 1.00 0.00 H new ATOM 0 HA LYS A 29 5.878 7.753 11.926 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.767 10.081 10.318 1.00 0.00 H new ATOM 0 HB3 LYS A 29 6.199 9.164 9.892 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.328 8.170 9.915 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.341 8.450 8.513 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.810 6.223 8.585 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.859 6.597 9.938 1.00 0.00 H new ATOM 0 HE2 LYS A 29 3.928 6.183 11.510 1.00 0.00 H new ATOM 0 HE3 LYS A 29 2.935 5.735 10.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 3.866 3.797 11.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 4.483 3.937 9.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 5.445 4.371 10.969 1.00 0.00 H new ATOM 507 N ILE A 30 5.943 10.928 13.014 1.00 0.00 N ATOM 508 CA ILE A 30 6.797 11.889 13.770 1.00 0.00 C ATOM 509 C ILE A 30 7.428 11.180 14.997 1.00 0.00 C ATOM 510 O ILE A 30 8.619 11.344 15.288 1.00 0.00 O ATOM 511 CB ILE A 30 6.016 13.201 14.231 1.00 0.00 C ATOM 512 CG1 ILE A 30 5.815 14.243 13.063 1.00 0.00 C ATOM 513 CG2 ILE A 30 6.714 13.896 15.425 1.00 0.00 C ATOM 514 CD1 ILE A 30 4.606 14.029 12.180 1.00 0.00 C ATOM 0 H ILE A 30 4.968 11.215 12.924 1.00 0.00 H new ATOM 0 HA ILE A 30 7.579 12.221 13.087 1.00 0.00 H new ATOM 0 HB ILE A 30 5.031 12.854 14.543 1.00 0.00 H new ATOM 0 HG12 ILE A 30 5.748 15.239 13.500 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.705 14.230 12.434 1.00 0.00 H new ATOM 0 HG21 ILE A 30 6.151 14.785 15.708 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.758 13.210 16.271 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.726 14.183 15.138 1.00 0.00 H new ATOM 0 HD11 ILE A 30 4.572 14.805 11.415 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.672 13.051 11.703 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.701 14.077 12.785 1.00 0.00 H new ATOM 526 N GLN A 31 6.603 10.373 15.683 1.00 0.00 N ATOM 527 CA GLN A 31 7.044 9.542 16.820 1.00 0.00 C ATOM 528 C GLN A 31 8.094 8.487 16.375 1.00 0.00 C ATOM 529 O GLN A 31 8.938 8.063 17.165 1.00 0.00 O ATOM 530 CB GLN A 31 5.807 8.867 17.466 1.00 0.00 C ATOM 531 CG GLN A 31 6.100 8.069 18.753 1.00 0.00 C ATOM 532 CD GLN A 31 4.860 7.407 19.377 1.00 0.00 C ATOM 533 OE1 GLN A 31 4.778 7.244 20.592 1.00 0.00 O ATOM 534 NE2 GLN A 31 3.891 7.001 18.558 1.00 0.00 N ATOM 0 H GLN A 31 5.611 10.277 15.467 1.00 0.00 H new ATOM 0 HA GLN A 31 7.530 10.179 17.559 1.00 0.00 H new ATOM 0 HB2 GLN A 31 5.069 9.636 17.693 1.00 0.00 H new ATOM 0 HB3 GLN A 31 5.354 8.197 16.735 1.00 0.00 H new ATOM 0 HG2 GLN A 31 6.837 7.298 18.530 1.00 0.00 H new ATOM 0 HG3 GLN A 31 6.550 8.737 19.487 1.00 0.00 H new ATOM 0 HE21 GLN A 31 3.979 7.146 17.552 1.00 0.00 H new ATOM 0 HE22 GLN A 31 3.061 6.545 18.937 1.00 0.00 H new ATOM 543 N ASP A 32 8.019 8.078 15.100 1.00 0.00 N ATOM 544 CA ASP A 32 9.007 7.171 14.470 1.00 0.00 C ATOM 545 C ASP A 32 10.303 7.924 14.075 1.00 0.00 C ATOM 546 O ASP A 32 11.386 7.321 14.042 1.00 0.00 O ATOM 547 CB ASP A 32 8.371 6.478 13.226 1.00 0.00 C ATOM 548 CG ASP A 32 9.376 5.678 12.365 1.00 0.00 C ATOM 549 OD1 ASP A 32 9.976 4.712 12.880 1.00 0.00 O ATOM 550 OD2 ASP A 32 9.589 6.034 11.181 1.00 0.00 O ATOM 0 H ASP A 32 7.271 8.365 14.469 1.00 0.00 H new ATOM 0 HA ASP A 32 9.284 6.411 15.200 1.00 0.00 H new ATOM 0 HB2 ASP A 32 7.582 5.806 13.562 1.00 0.00 H new ATOM 0 HB3 ASP A 32 7.899 7.237 12.603 1.00 0.00 H new ATOM 555 N LYS A 33 10.208 9.241 13.788 1.00 0.00 N ATOM 556 CA LYS A 33 11.362 10.017 13.276 1.00 0.00 C ATOM 557 C LYS A 33 12.091 10.743 14.421 1.00 0.00 C ATOM 558 O LYS A 33 13.221 10.378 14.762 1.00 0.00 O ATOM 559 CB LYS A 33 10.926 11.027 12.180 1.00 0.00 C ATOM 560 CG LYS A 33 10.187 10.415 10.968 1.00 0.00 C ATOM 561 CD LYS A 33 10.993 9.334 10.221 1.00 0.00 C ATOM 562 CE LYS A 33 10.183 8.672 9.090 1.00 0.00 C ATOM 563 NZ LYS A 33 10.916 7.539 8.475 1.00 0.00 N ATOM 0 H LYS A 33 9.353 9.786 13.900 1.00 0.00 H new ATOM 0 HA LYS A 33 12.055 9.309 12.822 1.00 0.00 H new ATOM 0 HB2 LYS A 33 10.280 11.776 12.637 1.00 0.00 H new ATOM 0 HB3 LYS A 33 11.812 11.549 11.818 1.00 0.00 H new ATOM 0 HG2 LYS A 33 9.247 9.981 11.310 1.00 0.00 H new ATOM 0 HG3 LYS A 33 9.934 11.213 10.269 1.00 0.00 H new ATOM 0 HD2 LYS A 33 11.895 9.781 9.804 1.00 0.00 H new ATOM 0 HD3 LYS A 33 11.314 8.570 10.929 1.00 0.00 H new ATOM 0 HE2 LYS A 33 9.231 8.317 9.485 1.00 0.00 H new ATOM 0 HE3 LYS A 33 9.954 9.414 8.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 10.829 7.590 7.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 11.920 7.590 8.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 10.514 6.641 8.812 1.00 0.00 H new ATOM 577 N GLU A 34 11.438 11.755 15.042 1.00 0.00 N ATOM 578 CA GLU A 34 12.066 12.546 16.123 1.00 0.00 C ATOM 579 C GLU A 34 11.893 11.865 17.498 1.00 0.00 C ATOM 580 O GLU A 34 12.657 12.149 18.433 1.00 0.00 O ATOM 581 CB GLU A 34 11.563 14.013 16.149 1.00 0.00 C ATOM 582 CG GLU A 34 10.097 14.241 16.546 1.00 0.00 C ATOM 583 CD GLU A 34 9.742 15.745 16.655 1.00 0.00 C ATOM 584 OE1 GLU A 34 10.320 16.434 17.526 1.00 0.00 O ATOM 585 OE2 GLU A 34 8.901 16.236 15.877 1.00 0.00 O ATOM 0 H GLU A 34 10.485 12.039 14.814 1.00 0.00 H new ATOM 0 HA GLU A 34 13.133 12.583 15.904 1.00 0.00 H new ATOM 0 HB2 GLU A 34 12.192 14.575 16.840 1.00 0.00 H new ATOM 0 HB3 GLU A 34 11.716 14.441 15.158 1.00 0.00 H new ATOM 0 HG2 GLU A 34 9.446 13.769 15.810 1.00 0.00 H new ATOM 0 HG3 GLU A 34 9.902 13.754 17.502 1.00 0.00 H new ATOM 592 N GLY A 35 10.906 10.955 17.609 1.00 0.00 N ATOM 593 CA GLY A 35 10.747 10.115 18.803 1.00 0.00 C ATOM 594 C GLY A 35 9.908 10.767 19.886 1.00 0.00 C ATOM 595 O GLY A 35 10.050 10.442 21.073 1.00 0.00 O ATOM 0 H GLY A 35 10.209 10.786 16.884 1.00 0.00 H new ATOM 0 HA2 GLY A 35 10.286 9.170 18.515 1.00 0.00 H new ATOM 0 HA3 GLY A 35 11.731 9.880 19.207 1.00 0.00 H new ATOM 599 N ILE A 36 9.031 11.702 19.480 1.00 0.00 N ATOM 600 CA ILE A 36 8.103 12.395 20.399 1.00 0.00 C ATOM 601 C ILE A 36 6.670 11.857 20.144 1.00 0.00 C ATOM 602 O ILE A 36 6.231 11.841 18.990 1.00 0.00 O ATOM 603 CB ILE A 36 8.171 13.983 20.251 1.00 0.00 C ATOM 604 CG1 ILE A 36 9.476 14.580 20.894 1.00 0.00 C ATOM 605 CG2 ILE A 36 6.935 14.669 20.887 1.00 0.00 C ATOM 606 CD1 ILE A 36 10.778 14.289 20.177 1.00 0.00 C ATOM 0 H ILE A 36 8.943 12.000 18.508 1.00 0.00 H new ATOM 0 HA ILE A 36 8.399 12.185 21.427 1.00 0.00 H new ATOM 0 HB ILE A 36 8.183 14.186 19.180 1.00 0.00 H new ATOM 0 HG12 ILE A 36 9.359 15.662 20.962 1.00 0.00 H new ATOM 0 HG13 ILE A 36 9.557 14.203 21.914 1.00 0.00 H new ATOM 0 HG21 ILE A 36 7.016 15.749 20.767 1.00 0.00 H new ATOM 0 HG22 ILE A 36 6.029 14.316 20.394 1.00 0.00 H new ATOM 0 HG23 ILE A 36 6.889 14.424 21.948 1.00 0.00 H new ATOM 0 HD11 ILE A 36 11.603 14.754 20.717 1.00 0.00 H new ATOM 0 HD12 ILE A 36 10.935 13.211 20.132 1.00 0.00 H new ATOM 0 HD13 ILE A 36 10.734 14.692 19.165 1.00 0.00 H new ATOM 618 N PRO A 37 5.932 11.388 21.213 1.00 0.00 N ATOM 619 CA PRO A 37 4.602 10.735 21.056 1.00 0.00 C ATOM 620 C PRO A 37 3.508 11.725 20.591 1.00 0.00 C ATOM 621 O PRO A 37 3.604 12.912 20.917 1.00 0.00 O ATOM 622 CB PRO A 37 4.313 10.188 22.482 1.00 0.00 C ATOM 623 CG PRO A 37 5.033 11.138 23.382 1.00 0.00 C ATOM 624 CD PRO A 37 6.317 11.480 22.655 1.00 0.00 C ATOM 0 HA PRO A 37 4.602 9.962 20.287 1.00 0.00 H new ATOM 0 HB2 PRO A 37 3.244 10.169 22.694 1.00 0.00 H new ATOM 0 HB3 PRO A 37 4.680 9.169 22.601 1.00 0.00 H new ATOM 0 HG2 PRO A 37 4.437 12.031 23.569 1.00 0.00 H new ATOM 0 HG3 PRO A 37 5.239 10.683 24.351 1.00 0.00 H new ATOM 0 HD2 PRO A 37 6.672 12.478 22.914 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.117 10.783 22.903 1.00 0.00 H new ATOM 632 N PRO A 38 2.442 11.245 19.854 1.00 0.00 N ATOM 633 CA PRO A 38 1.347 12.103 19.316 1.00 0.00 C ATOM 634 C PRO A 38 0.589 12.918 20.374 1.00 0.00 C ATOM 635 O PRO A 38 -0.158 13.839 20.023 1.00 0.00 O ATOM 636 CB PRO A 38 0.413 11.101 18.578 1.00 0.00 C ATOM 637 CG PRO A 38 0.771 9.758 19.135 1.00 0.00 C ATOM 638 CD PRO A 38 2.244 9.830 19.447 1.00 0.00 C ATOM 0 HA PRO A 38 1.753 12.879 18.667 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -0.637 11.335 18.756 1.00 0.00 H new ATOM 0 HB3 PRO A 38 0.569 11.136 17.500 1.00 0.00 H new ATOM 0 HG2 PRO A 38 0.191 9.537 20.031 1.00 0.00 H new ATOM 0 HG3 PRO A 38 0.561 8.966 18.416 1.00 0.00 H new ATOM 0 HD2 PRO A 38 2.520 9.140 20.245 1.00 0.00 H new ATOM 0 HD3 PRO A 38 2.851 9.573 18.579 1.00 0.00 H new ATOM 646 N ASP A 39 0.778 12.566 21.653 1.00 0.00 N ATOM 647 CA ASP A 39 0.244 13.345 22.779 1.00 0.00 C ATOM 648 C ASP A 39 1.000 14.686 22.906 1.00 0.00 C ATOM 649 O ASP A 39 0.388 15.746 23.055 1.00 0.00 O ATOM 650 CB ASP A 39 0.350 12.529 24.095 1.00 0.00 C ATOM 651 CG ASP A 39 -0.371 13.193 25.279 1.00 0.00 C ATOM 652 OD1 ASP A 39 -1.616 13.316 25.237 1.00 0.00 O ATOM 653 OD2 ASP A 39 0.289 13.595 26.253 1.00 0.00 O ATOM 0 H ASP A 39 1.302 11.738 21.936 1.00 0.00 H new ATOM 0 HA ASP A 39 -0.808 13.559 22.592 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -0.069 11.536 23.934 1.00 0.00 H new ATOM 0 HB3 ASP A 39 1.402 12.394 24.348 1.00 0.00 H new ATOM 658 N GLN A 40 2.338 14.608 22.797 1.00 0.00 N ATOM 659 CA GLN A 40 3.253 15.752 23.001 1.00 0.00 C ATOM 660 C GLN A 40 3.438 16.575 21.714 1.00 0.00 C ATOM 661 O GLN A 40 3.555 17.791 21.772 1.00 0.00 O ATOM 662 CB GLN A 40 4.629 15.233 23.541 1.00 0.00 C ATOM 663 CG GLN A 40 4.736 15.082 25.079 1.00 0.00 C ATOM 664 CD GLN A 40 3.460 14.564 25.746 1.00 0.00 C ATOM 665 OE1 GLN A 40 2.603 15.349 26.144 1.00 0.00 O ATOM 666 NE2 GLN A 40 3.322 13.259 25.868 1.00 0.00 N ATOM 0 H GLN A 40 2.822 13.741 22.563 1.00 0.00 H new ATOM 0 HA GLN A 40 2.808 16.420 23.739 1.00 0.00 H new ATOM 0 HB2 GLN A 40 4.835 14.265 23.085 1.00 0.00 H new ATOM 0 HB3 GLN A 40 5.410 15.916 23.207 1.00 0.00 H new ATOM 0 HG2 GLN A 40 5.556 14.402 25.310 1.00 0.00 H new ATOM 0 HG3 GLN A 40 4.992 16.049 25.511 1.00 0.00 H new ATOM 0 HE21 GLN A 40 4.053 12.635 25.527 1.00 0.00 H new ATOM 0 HE22 GLN A 40 2.484 12.873 26.304 1.00 0.00 H new ATOM 675 N GLN A 41 3.453 15.914 20.559 1.00 0.00 N ATOM 676 CA GLN A 41 3.666 16.596 19.267 1.00 0.00 C ATOM 677 C GLN A 41 2.301 16.944 18.625 1.00 0.00 C ATOM 678 O GLN A 41 1.463 16.061 18.387 1.00 0.00 O ATOM 679 CB GLN A 41 4.592 15.743 18.350 1.00 0.00 C ATOM 680 CG GLN A 41 4.148 14.286 18.087 1.00 0.00 C ATOM 681 CD GLN A 41 3.354 14.081 16.801 1.00 0.00 C ATOM 682 OE1 GLN A 41 2.487 13.246 16.735 1.00 0.00 O ATOM 683 NE2 GLN A 41 3.685 14.802 15.754 1.00 0.00 N ATOM 0 H GLN A 41 3.321 14.906 20.482 1.00 0.00 H new ATOM 0 HA GLN A 41 4.186 17.541 19.422 1.00 0.00 H new ATOM 0 HB2 GLN A 41 4.683 16.251 17.390 1.00 0.00 H new ATOM 0 HB3 GLN A 41 5.587 15.722 18.795 1.00 0.00 H new ATOM 0 HG2 GLN A 41 5.034 13.651 18.056 1.00 0.00 H new ATOM 0 HG3 GLN A 41 3.543 13.948 18.928 1.00 0.00 H new ATOM 0 HE21 GLN A 41 4.421 15.504 15.830 1.00 0.00 H new ATOM 0 HE22 GLN A 41 3.206 14.660 14.865 1.00 0.00 H new ATOM 692 N ARG A 42 2.076 18.252 18.393 1.00 0.00 N ATOM 693 CA ARG A 42 0.791 18.797 17.921 1.00 0.00 C ATOM 694 C ARG A 42 0.919 19.212 16.449 1.00 0.00 C ATOM 695 O ARG A 42 1.833 19.966 16.085 1.00 0.00 O ATOM 696 CB ARG A 42 0.384 20.013 18.808 1.00 0.00 C ATOM 697 CG ARG A 42 -1.097 20.432 18.704 1.00 0.00 C ATOM 698 CD ARG A 42 -1.469 21.548 19.702 1.00 0.00 C ATOM 699 NE ARG A 42 -2.925 21.782 19.738 1.00 0.00 N ATOM 700 CZ ARG A 42 -3.599 22.414 20.721 1.00 0.00 C ATOM 701 NH1 ARG A 42 -2.967 22.964 21.752 1.00 0.00 N ATOM 702 NH2 ARG A 42 -4.923 22.480 20.661 1.00 0.00 N ATOM 0 H ARG A 42 2.791 18.967 18.530 1.00 0.00 H new ATOM 0 HA ARG A 42 0.014 18.036 17.999 1.00 0.00 H new ATOM 0 HB2 ARG A 42 0.606 19.775 19.848 1.00 0.00 H new ATOM 0 HB3 ARG A 42 1.007 20.865 18.537 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -1.304 20.773 17.690 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -1.730 19.563 18.884 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -1.119 21.277 20.698 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -0.959 22.470 19.424 1.00 0.00 H new ATOM 0 HE ARG A 42 -3.471 21.435 18.949 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -1.950 22.914 21.813 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -3.499 23.437 22.483 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -5.420 22.056 19.878 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -5.444 22.955 21.398 1.00 0.00 H new ATOM 716 N LEU A 43 -0.019 18.733 15.620 1.00 0.00 N ATOM 717 CA LEU A 43 0.006 18.918 14.157 1.00 0.00 C ATOM 718 C LEU A 43 -0.818 20.145 13.781 1.00 0.00 C ATOM 719 O LEU A 43 -1.969 20.266 14.209 1.00 0.00 O ATOM 720 CB LEU A 43 -0.551 17.648 13.437 1.00 0.00 C ATOM 721 CG LEU A 43 0.469 16.507 13.169 1.00 0.00 C ATOM 722 CD1 LEU A 43 1.597 16.998 12.231 1.00 0.00 C ATOM 723 CD2 LEU A 43 1.020 15.937 14.490 1.00 0.00 C ATOM 0 H LEU A 43 -0.825 18.201 15.947 1.00 0.00 H new ATOM 0 HA LEU A 43 1.037 19.069 13.836 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.366 17.244 14.037 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.979 17.955 12.483 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.046 15.691 12.662 1.00 0.00 H new ATOM 0 HD11 LEU A 43 2.302 16.186 12.054 1.00 0.00 H new ATOM 0 HD12 LEU A 43 1.167 17.319 11.282 1.00 0.00 H new ATOM 0 HD13 LEU A 43 2.117 17.836 12.695 1.00 0.00 H new ATOM 0 HD21 LEU A 43 1.732 15.140 14.274 1.00 0.00 H new ATOM 0 HD22 LEU A 43 1.520 16.729 15.047 1.00 0.00 H new ATOM 0 HD23 LEU A 43 0.198 15.538 15.085 1.00 0.00 H new ATOM 735 N ILE A 44 -0.210 21.062 13.002 1.00 0.00 N ATOM 736 CA ILE A 44 -0.858 22.306 12.545 1.00 0.00 C ATOM 737 C ILE A 44 -0.445 22.619 11.092 1.00 0.00 C ATOM 738 O ILE A 44 0.745 22.580 10.766 1.00 0.00 O ATOM 739 CB ILE A 44 -0.504 23.526 13.495 1.00 0.00 C ATOM 740 CG1 ILE A 44 -1.053 23.267 14.942 1.00 0.00 C ATOM 741 CG2 ILE A 44 -1.032 24.881 12.938 1.00 0.00 C ATOM 742 CD1 ILE A 44 -0.575 24.227 15.995 1.00 0.00 C ATOM 0 H ILE A 44 0.749 20.959 12.671 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.937 22.157 12.584 1.00 0.00 H new ATOM 0 HB ILE A 44 0.583 23.602 13.536 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -2.142 23.302 14.911 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -0.775 22.257 15.242 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.765 25.685 13.624 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.585 25.072 11.962 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.116 24.835 12.838 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -1.013 23.960 16.957 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.512 24.179 16.065 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.877 25.240 15.728 1.00 0.00 H new ATOM 754 N PHE A 45 -1.442 22.922 10.237 1.00 0.00 N ATOM 755 CA PHE A 45 -1.238 23.403 8.859 1.00 0.00 C ATOM 756 C PHE A 45 -2.225 24.551 8.619 1.00 0.00 C ATOM 757 O PHE A 45 -3.410 24.399 8.896 1.00 0.00 O ATOM 758 CB PHE A 45 -1.466 22.259 7.839 1.00 0.00 C ATOM 759 CG PHE A 45 -1.284 22.647 6.361 1.00 0.00 C ATOM 760 CD1 PHE A 45 -0.024 22.597 5.758 1.00 0.00 C ATOM 761 CD2 PHE A 45 -2.372 23.029 5.567 1.00 0.00 C ATOM 762 CE1 PHE A 45 0.146 22.924 4.427 1.00 0.00 C ATOM 763 CE2 PHE A 45 -2.199 23.352 4.235 1.00 0.00 C ATOM 764 CZ PHE A 45 -0.942 23.294 3.662 1.00 0.00 C ATOM 0 H PHE A 45 -2.427 22.838 10.490 1.00 0.00 H new ATOM 0 HA PHE A 45 -0.214 23.751 8.726 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.778 21.446 8.071 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -2.476 21.871 7.974 1.00 0.00 H new ATOM 0 HD1 PHE A 45 0.832 22.297 6.344 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.360 23.072 6.002 1.00 0.00 H new ATOM 0 HE1 PHE A 45 1.131 22.890 3.984 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.049 23.651 3.639 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.812 23.538 2.618 1.00 0.00 H new ATOM 774 N ALA A 46 -1.711 25.693 8.141 1.00 0.00 N ATOM 775 CA ALA A 46 -2.504 26.903 7.827 1.00 0.00 C ATOM 776 C ALA A 46 -3.133 27.533 9.092 1.00 0.00 C ATOM 777 O ALA A 46 -4.100 28.295 9.000 1.00 0.00 O ATOM 778 CB ALA A 46 -3.566 26.615 6.736 1.00 0.00 C ATOM 0 H ALA A 46 -0.715 25.810 7.956 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.813 27.643 7.422 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -4.131 27.524 6.529 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -3.070 26.281 5.825 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -4.245 25.838 7.086 1.00 0.00 H new ATOM 784 N GLY A 47 -2.548 27.227 10.269 1.00 0.00 N ATOM 785 CA GLY A 47 -2.996 27.802 11.542 1.00 0.00 C ATOM 786 C GLY A 47 -4.047 26.964 12.268 1.00 0.00 C ATOM 787 O GLY A 47 -4.483 27.348 13.356 1.00 0.00 O ATOM 0 H GLY A 47 -1.762 26.582 10.358 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -2.133 27.929 12.195 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -3.404 28.796 11.356 1.00 0.00 H new ATOM 791 N LYS A 48 -4.447 25.813 11.683 1.00 0.00 N ATOM 792 CA LYS A 48 -5.487 24.930 12.267 1.00 0.00 C ATOM 793 C LYS A 48 -4.866 23.599 12.722 1.00 0.00 C ATOM 794 O LYS A 48 -3.869 23.143 12.148 1.00 0.00 O ATOM 795 CB LYS A 48 -6.612 24.678 11.225 1.00 0.00 C ATOM 796 CG LYS A 48 -6.227 23.731 10.058 1.00 0.00 C ATOM 797 CD LYS A 48 -7.147 23.869 8.829 1.00 0.00 C ATOM 798 CE LYS A 48 -7.003 25.224 8.120 1.00 0.00 C ATOM 799 NZ LYS A 48 -8.128 25.482 7.183 1.00 0.00 N ATOM 0 H LYS A 48 -4.064 25.471 10.802 1.00 0.00 H new ATOM 0 HA LYS A 48 -5.919 25.421 13.139 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -7.477 24.261 11.741 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.921 25.636 10.808 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.199 23.935 9.758 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.257 22.700 10.411 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -6.922 23.070 8.122 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -8.183 23.737 9.141 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -6.960 26.020 8.863 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.061 25.249 7.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -7.993 26.406 6.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -8.154 24.737 6.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -9.025 25.484 7.710 1.00 0.00 H new ATOM 813 N GLN A 49 -5.475 22.977 13.745 1.00 0.00 N ATOM 814 CA GLN A 49 -5.036 21.673 14.272 1.00 0.00 C ATOM 815 C GLN A 49 -5.498 20.538 13.343 1.00 0.00 C ATOM 816 O GLN A 49 -6.661 20.502 12.924 1.00 0.00 O ATOM 817 CB GLN A 49 -5.600 21.455 15.698 1.00 0.00 C ATOM 818 CG GLN A 49 -5.218 20.117 16.361 1.00 0.00 C ATOM 819 CD GLN A 49 -5.813 19.970 17.764 1.00 0.00 C ATOM 820 OE1 GLN A 49 -5.189 20.332 18.755 1.00 0.00 O ATOM 821 NE2 GLN A 49 -7.038 19.480 17.850 1.00 0.00 N ATOM 0 H GLN A 49 -6.285 23.363 14.230 1.00 0.00 H new ATOM 0 HA GLN A 49 -3.947 21.666 14.319 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -5.255 22.269 16.336 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -6.687 21.523 15.655 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -5.562 19.293 15.735 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -4.132 20.041 16.420 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -7.531 19.188 17.006 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -7.490 19.395 18.760 1.00 0.00 H new ATOM 830 N LEU A 50 -4.577 19.617 13.025 1.00 0.00 N ATOM 831 CA LEU A 50 -4.866 18.476 12.161 1.00 0.00 C ATOM 832 C LEU A 50 -5.448 17.312 12.990 1.00 0.00 C ATOM 833 O LEU A 50 -4.792 16.807 13.917 1.00 0.00 O ATOM 834 CB LEU A 50 -3.597 18.034 11.406 1.00 0.00 C ATOM 835 CG LEU A 50 -2.786 19.159 10.684 1.00 0.00 C ATOM 836 CD1 LEU A 50 -1.649 18.552 9.855 1.00 0.00 C ATOM 837 CD2 LEU A 50 -3.691 20.081 9.831 1.00 0.00 C ATOM 0 H LEU A 50 -3.615 19.647 13.361 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.610 18.776 11.423 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -2.934 17.537 12.115 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.884 17.290 10.663 1.00 0.00 H new ATOM 0 HG LEU A 50 -2.345 19.794 11.453 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -1.095 19.349 9.359 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.978 17.996 10.510 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -2.065 17.878 9.106 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -3.081 20.846 9.350 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -4.198 19.489 9.069 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -4.432 20.558 10.472 1.00 0.00 H new ATOM 849 N GLU A 51 -6.677 16.896 12.634 1.00 0.00 N ATOM 850 CA GLU A 51 -7.411 15.837 13.331 1.00 0.00 C ATOM 851 C GLU A 51 -6.887 14.478 12.869 1.00 0.00 C ATOM 852 O GLU A 51 -6.754 14.250 11.662 1.00 0.00 O ATOM 853 CB GLU A 51 -8.923 15.967 13.003 1.00 0.00 C ATOM 854 CG GLU A 51 -9.835 14.886 13.624 1.00 0.00 C ATOM 855 CD GLU A 51 -11.295 14.997 13.151 1.00 0.00 C ATOM 856 OE1 GLU A 51 -12.021 15.891 13.631 1.00 0.00 O ATOM 857 OE2 GLU A 51 -11.720 14.201 12.294 1.00 0.00 O ATOM 0 H GLU A 51 -7.189 17.293 11.846 1.00 0.00 H new ATOM 0 HA GLU A 51 -7.270 15.927 14.408 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -9.267 16.945 13.340 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -9.045 15.942 11.920 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -9.448 13.900 13.368 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -9.802 14.969 14.710 1.00 0.00 H new ATOM 864 N ASP A 52 -6.682 13.570 13.833 1.00 0.00 N ATOM 865 CA ASP A 52 -6.114 12.232 13.591 1.00 0.00 C ATOM 866 C ASP A 52 -6.989 11.411 12.625 1.00 0.00 C ATOM 867 O ASP A 52 -6.466 10.698 11.767 1.00 0.00 O ATOM 868 CB ASP A 52 -5.914 11.484 14.935 1.00 0.00 C ATOM 869 CG ASP A 52 -7.199 11.387 15.767 1.00 0.00 C ATOM 870 OD1 ASP A 52 -7.495 12.337 16.518 1.00 0.00 O ATOM 871 OD2 ASP A 52 -7.933 10.383 15.653 1.00 0.00 O ATOM 0 H ASP A 52 -6.907 13.743 14.813 1.00 0.00 H new ATOM 0 HA ASP A 52 -5.142 12.358 13.115 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -5.542 10.479 14.733 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -5.148 11.996 15.518 1.00 0.00 H new ATOM 876 N GLY A 53 -8.321 11.559 12.768 1.00 0.00 N ATOM 877 CA GLY A 53 -9.284 10.852 11.930 1.00 0.00 C ATOM 878 C GLY A 53 -9.172 11.225 10.453 1.00 0.00 C ATOM 879 O GLY A 53 -9.255 10.350 9.582 1.00 0.00 O ATOM 0 H GLY A 53 -8.748 12.169 13.465 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -9.135 9.778 12.041 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -10.293 11.072 12.280 1.00 0.00 H new ATOM 883 N ARG A 54 -8.918 12.526 10.183 1.00 0.00 N ATOM 884 CA ARG A 54 -8.833 13.081 8.810 1.00 0.00 C ATOM 885 C ARG A 54 -7.518 12.695 8.112 1.00 0.00 C ATOM 886 O ARG A 54 -6.668 12.024 8.696 1.00 0.00 O ATOM 887 CB ARG A 54 -8.993 14.625 8.853 1.00 0.00 C ATOM 888 CG ARG A 54 -10.376 15.089 9.352 1.00 0.00 C ATOM 889 CD ARG A 54 -10.564 16.610 9.308 1.00 0.00 C ATOM 890 NE ARG A 54 -11.926 17.001 9.731 1.00 0.00 N ATOM 891 CZ ARG A 54 -12.232 17.844 10.730 1.00 0.00 C ATOM 892 NH1 ARG A 54 -11.294 18.413 11.463 1.00 0.00 N ATOM 893 NH2 ARG A 54 -13.491 18.113 10.996 1.00 0.00 N ATOM 0 H ARG A 54 -8.766 13.223 10.912 1.00 0.00 H new ATOM 0 HA ARG A 54 -9.646 12.649 8.226 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -8.223 15.044 9.501 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -8.823 15.027 7.854 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -11.149 14.618 8.745 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -10.519 14.743 10.376 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -9.830 17.087 9.957 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -10.378 16.971 8.297 1.00 0.00 H new ATOM 0 HE ARG A 54 -12.706 16.592 9.216 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -10.311 18.216 11.276 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -11.552 19.050 12.217 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -14.232 17.682 10.444 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -13.727 18.753 11.754 1.00 0.00 H new ATOM 907 N THR A 55 -7.382 13.115 6.845 1.00 0.00 N ATOM 908 CA THR A 55 -6.175 12.875 6.028 1.00 0.00 C ATOM 909 C THR A 55 -5.428 14.192 5.793 1.00 0.00 C ATOM 910 O THR A 55 -5.973 15.278 6.056 1.00 0.00 O ATOM 911 CB THR A 55 -6.527 12.229 4.643 1.00 0.00 C ATOM 912 OG1 THR A 55 -7.472 13.049 3.940 1.00 0.00 O ATOM 913 CG2 THR A 55 -7.092 10.812 4.791 1.00 0.00 C ATOM 0 H THR A 55 -8.109 13.634 6.352 1.00 0.00 H new ATOM 0 HA THR A 55 -5.543 12.179 6.579 1.00 0.00 H new ATOM 0 HB THR A 55 -5.598 12.161 4.076 1.00 0.00 H new ATOM 0 HG1 THR A 55 -7.683 12.637 3.076 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.320 10.407 3.805 1.00 0.00 H new ATOM 0 HG22 THR A 55 -6.356 10.176 5.283 1.00 0.00 H new ATOM 0 HG23 THR A 55 -8.002 10.844 5.390 1.00 0.00 H new ATOM 921 N LEU A 56 -4.180 14.081 5.289 1.00 0.00 N ATOM 922 CA LEU A 56 -3.390 15.246 4.848 1.00 0.00 C ATOM 923 C LEU A 56 -4.197 16.032 3.793 1.00 0.00 C ATOM 924 O LEU A 56 -4.458 17.222 3.955 1.00 0.00 O ATOM 925 CB LEU A 56 -2.014 14.800 4.256 1.00 0.00 C ATOM 926 CG LEU A 56 -0.967 14.198 5.250 1.00 0.00 C ATOM 927 CD1 LEU A 56 0.239 13.585 4.494 1.00 0.00 C ATOM 928 CD2 LEU A 56 -0.483 15.260 6.271 1.00 0.00 C ATOM 0 H LEU A 56 -3.697 13.189 5.178 1.00 0.00 H new ATOM 0 HA LEU A 56 -3.189 15.884 5.709 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -2.205 14.060 3.478 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -1.560 15.664 3.770 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.465 13.400 5.800 1.00 0.00 H new ATOM 0 HD11 LEU A 56 0.949 13.175 5.213 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.110 12.790 3.835 1.00 0.00 H new ATOM 0 HD13 LEU A 56 0.728 14.358 3.902 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.244 14.810 6.947 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.018 16.090 5.740 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -1.334 15.627 6.845 1.00 0.00 H new ATOM 940 N SER A 57 -4.669 15.290 2.778 1.00 0.00 N ATOM 941 CA SER A 57 -5.387 15.832 1.614 1.00 0.00 C ATOM 942 C SER A 57 -6.718 16.499 2.022 1.00 0.00 C ATOM 943 O SER A 57 -7.212 17.386 1.315 1.00 0.00 O ATOM 944 CB SER A 57 -5.636 14.703 0.588 1.00 0.00 C ATOM 945 OG SER A 57 -6.164 15.197 -0.638 1.00 0.00 O ATOM 0 H SER A 57 -4.560 14.276 2.743 1.00 0.00 H new ATOM 0 HA SER A 57 -4.767 16.605 1.160 1.00 0.00 H new ATOM 0 HB2 SER A 57 -4.701 14.178 0.393 1.00 0.00 H new ATOM 0 HB3 SER A 57 -6.327 13.975 1.012 1.00 0.00 H new ATOM 0 HG SER A 57 -6.305 14.451 -1.258 1.00 0.00 H new ATOM 951 N ASP A 58 -7.275 16.084 3.184 1.00 0.00 N ATOM 952 CA ASP A 58 -8.538 16.640 3.715 1.00 0.00 C ATOM 953 C ASP A 58 -8.303 18.071 4.237 1.00 0.00 C ATOM 954 O ASP A 58 -9.187 18.929 4.169 1.00 0.00 O ATOM 955 CB ASP A 58 -9.095 15.731 4.846 1.00 0.00 C ATOM 956 CG ASP A 58 -10.577 15.991 5.168 1.00 0.00 C ATOM 957 OD1 ASP A 58 -10.882 16.857 6.009 1.00 0.00 O ATOM 958 OD2 ASP A 58 -11.449 15.338 4.554 1.00 0.00 O ATOM 0 H ASP A 58 -6.864 15.360 3.774 1.00 0.00 H new ATOM 0 HA ASP A 58 -9.274 16.677 2.912 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -8.972 14.687 4.556 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -8.503 15.883 5.749 1.00 0.00 H new ATOM 963 N TYR A 59 -7.078 18.314 4.743 1.00 0.00 N ATOM 964 CA TYR A 59 -6.640 19.637 5.219 1.00 0.00 C ATOM 965 C TYR A 59 -5.887 20.423 4.117 1.00 0.00 C ATOM 966 O TYR A 59 -5.185 21.395 4.429 1.00 0.00 O ATOM 967 CB TYR A 59 -5.747 19.469 6.473 1.00 0.00 C ATOM 968 CG TYR A 59 -6.524 19.252 7.761 1.00 0.00 C ATOM 969 CD1 TYR A 59 -7.195 20.316 8.354 1.00 0.00 C ATOM 970 CD2 TYR A 59 -6.567 18.017 8.400 1.00 0.00 C ATOM 971 CE1 TYR A 59 -7.882 20.163 9.528 1.00 0.00 C ATOM 972 CE2 TYR A 59 -7.260 17.862 9.569 1.00 0.00 C ATOM 973 CZ TYR A 59 -7.914 18.940 10.134 1.00 0.00 C ATOM 974 OH TYR A 59 -8.578 18.799 11.326 1.00 0.00 O ATOM 0 H TYR A 59 -6.362 17.593 4.833 1.00 0.00 H new ATOM 0 HA TYR A 59 -7.526 20.215 5.479 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -5.077 18.623 6.318 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -5.122 20.355 6.583 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -7.174 21.285 7.877 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -6.049 17.173 7.969 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -8.395 21.004 9.972 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -7.296 16.896 10.051 1.00 0.00 H new ATOM 0 HH TYR A 59 -8.096 19.284 12.028 1.00 0.00 H new ATOM 984 N ASN A 60 -6.050 19.995 2.840 1.00 0.00 N ATOM 985 CA ASN A 60 -5.427 20.639 1.649 1.00 0.00 C ATOM 986 C ASN A 60 -3.889 20.449 1.623 1.00 0.00 C ATOM 987 O ASN A 60 -3.184 21.122 0.870 1.00 0.00 O ATOM 988 CB ASN A 60 -5.810 22.151 1.540 1.00 0.00 C ATOM 989 CG ASN A 60 -7.323 22.392 1.437 1.00 0.00 C ATOM 990 OD1 ASN A 60 -7.875 22.529 0.346 1.00 0.00 O ATOM 991 ND2 ASN A 60 -8.002 22.431 2.578 1.00 0.00 N ATOM 0 H ASN A 60 -6.623 19.185 2.602 1.00 0.00 H new ATOM 0 HA ASN A 60 -5.832 20.132 0.773 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -5.424 22.679 2.412 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -5.321 22.580 0.665 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -9.011 22.578 2.566 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -7.514 22.314 3.466 1.00 0.00 H new ATOM 998 N ILE A 61 -3.391 19.488 2.421 1.00 0.00 N ATOM 999 CA ILE A 61 -1.960 19.131 2.479 1.00 0.00 C ATOM 1000 C ILE A 61 -1.683 18.066 1.407 1.00 0.00 C ATOM 1001 O ILE A 61 -2.281 16.983 1.429 1.00 0.00 O ATOM 1002 CB ILE A 61 -1.572 18.535 3.884 1.00 0.00 C ATOM 1003 CG1 ILE A 61 -2.123 19.416 5.036 1.00 0.00 C ATOM 1004 CG2 ILE A 61 -0.041 18.316 4.028 1.00 0.00 C ATOM 1005 CD1 ILE A 61 -2.223 18.707 6.373 1.00 0.00 C ATOM 0 H ILE A 61 -3.973 18.933 3.048 1.00 0.00 H new ATOM 0 HA ILE A 61 -1.370 20.032 2.311 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.040 17.553 3.953 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.481 20.289 5.149 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -3.111 19.781 4.757 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.177 17.904 5.013 1.00 0.00 H new ATOM 0 HG22 ILE A 61 0.301 17.622 3.261 1.00 0.00 H new ATOM 0 HG23 ILE A 61 0.475 19.269 3.911 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -2.617 19.395 7.121 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.890 17.850 6.281 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -1.234 18.366 6.679 1.00 0.00 H new ATOM 1017 N GLN A 62 -0.804 18.381 0.470 1.00 0.00 N ATOM 1018 CA GLN A 62 -0.328 17.410 -0.526 1.00 0.00 C ATOM 1019 C GLN A 62 1.038 16.873 -0.083 1.00 0.00 C ATOM 1020 O GLN A 62 1.566 17.278 0.971 1.00 0.00 O ATOM 1021 CB GLN A 62 -0.232 18.065 -1.930 1.00 0.00 C ATOM 1022 CG GLN A 62 0.777 19.230 -2.033 1.00 0.00 C ATOM 1023 CD GLN A 62 1.109 19.619 -3.469 1.00 0.00 C ATOM 1024 OE1 GLN A 62 0.451 20.473 -4.066 1.00 0.00 O ATOM 1025 NE2 GLN A 62 2.136 18.993 -4.029 1.00 0.00 N ATOM 0 H GLN A 62 -0.396 19.311 0.371 1.00 0.00 H new ATOM 0 HA GLN A 62 -1.037 16.585 -0.596 1.00 0.00 H new ATOM 0 HB2 GLN A 62 0.044 17.299 -2.655 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -1.219 18.431 -2.213 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.372 20.099 -1.514 1.00 0.00 H new ATOM 0 HG3 GLN A 62 1.696 18.951 -1.518 1.00 0.00 H new ATOM 0 HE21 GLN A 62 2.655 18.292 -3.501 1.00 0.00 H new ATOM 0 HE22 GLN A 62 2.406 19.213 -4.988 1.00 0.00 H new ATOM 1034 N LYS A 63 1.614 15.967 -0.884 1.00 0.00 N ATOM 1035 CA LYS A 63 3.000 15.527 -0.689 1.00 0.00 C ATOM 1036 C LYS A 63 3.956 16.730 -0.810 1.00 0.00 C ATOM 1037 O LYS A 63 3.718 17.650 -1.613 1.00 0.00 O ATOM 1038 CB LYS A 63 3.400 14.423 -1.692 1.00 0.00 C ATOM 1039 CG LYS A 63 3.289 14.817 -3.177 1.00 0.00 C ATOM 1040 CD LYS A 63 3.649 13.631 -4.091 1.00 0.00 C ATOM 1041 CE LYS A 63 5.101 13.159 -3.907 1.00 0.00 C ATOM 1042 NZ LYS A 63 6.050 13.924 -4.748 1.00 0.00 N ATOM 0 H LYS A 63 1.141 15.525 -1.672 1.00 0.00 H new ATOM 0 HA LYS A 63 3.076 15.102 0.312 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.428 14.123 -1.488 1.00 0.00 H new ATOM 0 HB3 LYS A 63 2.772 13.549 -1.516 1.00 0.00 H new ATOM 0 HG2 LYS A 63 2.275 15.152 -3.393 1.00 0.00 H new ATOM 0 HG3 LYS A 63 3.953 15.656 -3.385 1.00 0.00 H new ATOM 0 HD2 LYS A 63 2.973 12.801 -3.886 1.00 0.00 H new ATOM 0 HD3 LYS A 63 3.494 13.919 -5.131 1.00 0.00 H new ATOM 0 HE2 LYS A 63 5.384 13.260 -2.859 1.00 0.00 H new ATOM 0 HE3 LYS A 63 5.171 12.100 -4.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 6.565 13.271 -5.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 5.526 14.613 -5.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 6.727 14.427 -4.139 1.00 0.00 H new ATOM 1056 N GLU A 64 5.000 16.711 0.033 1.00 0.00 N ATOM 1057 CA GLU A 64 6.052 17.748 0.101 1.00 0.00 C ATOM 1058 C GLU A 64 5.544 19.103 0.637 1.00 0.00 C ATOM 1059 O GLU A 64 6.290 20.092 0.607 1.00 0.00 O ATOM 1060 CB GLU A 64 6.757 17.894 -1.273 1.00 0.00 C ATOM 1061 CG GLU A 64 7.485 16.616 -1.756 1.00 0.00 C ATOM 1062 CD GLU A 64 7.923 16.655 -3.228 1.00 0.00 C ATOM 1063 OE1 GLU A 64 8.096 17.760 -3.794 1.00 0.00 O ATOM 1064 OE2 GLU A 64 8.098 15.572 -3.828 1.00 0.00 O ATOM 0 H GLU A 64 5.143 15.957 0.705 1.00 0.00 H new ATOM 0 HA GLU A 64 6.786 17.409 0.832 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.016 18.180 -2.020 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.479 18.708 -1.213 1.00 0.00 H new ATOM 0 HG2 GLU A 64 8.364 16.455 -1.132 1.00 0.00 H new ATOM 0 HG3 GLU A 64 6.827 15.759 -1.607 1.00 0.00 H new ATOM 1071 N SER A 65 4.293 19.151 1.161 1.00 0.00 N ATOM 1072 CA SER A 65 3.800 20.351 1.855 1.00 0.00 C ATOM 1073 C SER A 65 4.519 20.506 3.205 1.00 0.00 C ATOM 1074 O SER A 65 4.748 19.512 3.914 1.00 0.00 O ATOM 1075 CB SER A 65 2.273 20.292 2.066 1.00 0.00 C ATOM 1076 OG SER A 65 1.582 20.235 0.833 1.00 0.00 O ATOM 0 H SER A 65 3.623 18.383 1.114 1.00 0.00 H new ATOM 0 HA SER A 65 4.015 21.218 1.230 1.00 0.00 H new ATOM 0 HB2 SER A 65 2.021 19.418 2.666 1.00 0.00 H new ATOM 0 HB3 SER A 65 1.948 21.168 2.627 1.00 0.00 H new ATOM 0 HG SER A 65 0.874 20.913 0.823 1.00 0.00 H new ATOM 1082 N THR A 66 4.905 21.745 3.529 1.00 0.00 N ATOM 1083 CA THR A 66 5.563 22.068 4.793 1.00 0.00 C ATOM 1084 C THR A 66 4.525 22.613 5.788 1.00 0.00 C ATOM 1085 O THR A 66 3.791 23.560 5.479 1.00 0.00 O ATOM 1086 CB THR A 66 6.723 23.093 4.587 1.00 0.00 C ATOM 1087 OG1 THR A 66 7.599 22.618 3.544 1.00 0.00 O ATOM 1088 CG2 THR A 66 7.540 23.301 5.880 1.00 0.00 C ATOM 0 H THR A 66 4.768 22.551 2.919 1.00 0.00 H new ATOM 0 HA THR A 66 6.004 21.157 5.197 1.00 0.00 H new ATOM 0 HB THR A 66 6.280 24.050 4.310 1.00 0.00 H new ATOM 0 HG1 THR A 66 8.327 23.260 3.411 1.00 0.00 H new ATOM 0 HG21 THR A 66 8.337 24.021 5.695 1.00 0.00 H new ATOM 0 HG22 THR A 66 6.886 23.678 6.667 1.00 0.00 H new ATOM 0 HG23 THR A 66 7.974 22.351 6.193 1.00 0.00 H new ATOM 1096 N LEU A 67 4.474 21.992 6.972 1.00 0.00 N ATOM 1097 CA LEU A 67 3.540 22.334 8.053 1.00 0.00 C ATOM 1098 C LEU A 67 4.317 22.419 9.370 1.00 0.00 C ATOM 1099 O LEU A 67 5.506 22.093 9.417 1.00 0.00 O ATOM 1100 CB LEU A 67 2.379 21.295 8.153 1.00 0.00 C ATOM 1101 CG LEU A 67 2.769 19.779 8.279 1.00 0.00 C ATOM 1102 CD1 LEU A 67 1.641 18.967 8.945 1.00 0.00 C ATOM 1103 CD2 LEU A 67 3.128 19.155 6.903 1.00 0.00 C ATOM 0 H LEU A 67 5.095 21.219 7.212 1.00 0.00 H new ATOM 0 HA LEU A 67 3.082 23.299 7.838 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.767 21.557 9.016 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.750 21.408 7.270 1.00 0.00 H new ATOM 0 HG LEU A 67 3.656 19.736 8.911 1.00 0.00 H new ATOM 0 HD11 LEU A 67 1.940 17.921 9.018 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.450 19.361 9.943 1.00 0.00 H new ATOM 0 HD13 LEU A 67 0.734 19.044 8.345 1.00 0.00 H new ATOM 0 HD21 LEU A 67 3.391 18.106 7.037 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.271 19.231 6.234 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.974 19.689 6.471 1.00 0.00 H new ATOM 1115 N HIS A 68 3.646 22.872 10.437 1.00 0.00 N ATOM 1116 CA HIS A 68 4.286 23.124 11.744 1.00 0.00 C ATOM 1117 C HIS A 68 4.010 21.991 12.737 1.00 0.00 C ATOM 1118 O HIS A 68 3.000 21.277 12.642 1.00 0.00 O ATOM 1119 CB HIS A 68 3.819 24.483 12.326 1.00 0.00 C ATOM 1120 CG HIS A 68 4.234 25.659 11.475 1.00 0.00 C ATOM 1121 ND1 HIS A 68 5.282 26.491 11.804 1.00 0.00 N ATOM 1122 CD2 HIS A 68 3.735 26.144 10.310 1.00 0.00 C ATOM 1123 CE1 HIS A 68 5.416 27.415 10.877 1.00 0.00 C ATOM 1124 NE2 HIS A 68 4.490 27.229 9.959 1.00 0.00 N ATOM 0 H HIS A 68 2.647 23.075 10.423 1.00 0.00 H new ATOM 0 HA HIS A 68 5.363 23.164 11.581 1.00 0.00 H new ATOM 0 HB2 HIS A 68 2.733 24.477 12.424 1.00 0.00 H new ATOM 0 HB3 HIS A 68 4.229 24.604 13.329 1.00 0.00 H new ATOM 0 HD2 HIS A 68 2.895 25.746 9.760 1.00 0.00 H new ATOM 0 HE1 HIS A 68 6.162 28.196 10.870 1.00 0.00 H new ATOM 0 HE2 HIS A 68 4.358 27.800 9.124 1.00 0.00 H new ATOM 1133 N LEU A 69 4.934 21.867 13.700 1.00 0.00 N ATOM 1134 CA LEU A 69 4.906 20.850 14.747 1.00 0.00 C ATOM 1135 C LEU A 69 5.250 21.528 16.070 1.00 0.00 C ATOM 1136 O LEU A 69 6.221 22.291 16.155 1.00 0.00 O ATOM 1137 CB LEU A 69 5.925 19.724 14.409 1.00 0.00 C ATOM 1138 CG LEU A 69 5.758 18.345 15.138 1.00 0.00 C ATOM 1139 CD1 LEU A 69 6.227 18.382 16.603 1.00 0.00 C ATOM 1140 CD2 LEU A 69 4.300 17.852 15.017 1.00 0.00 C ATOM 0 H LEU A 69 5.739 22.489 13.769 1.00 0.00 H new ATOM 0 HA LEU A 69 3.919 20.392 14.821 1.00 0.00 H new ATOM 0 HB2 LEU A 69 5.880 19.543 13.335 1.00 0.00 H new ATOM 0 HB3 LEU A 69 6.925 20.100 14.628 1.00 0.00 H new ATOM 0 HG LEU A 69 6.411 17.630 14.637 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.087 17.400 17.055 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.282 18.651 16.640 1.00 0.00 H new ATOM 0 HD13 LEU A 69 5.644 19.121 17.153 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.196 16.894 15.527 1.00 0.00 H new ATOM 0 HD22 LEU A 69 3.630 18.581 15.474 1.00 0.00 H new ATOM 0 HD23 LEU A 69 4.042 17.733 13.965 1.00 0.00 H new ATOM 1152 N VAL A 70 4.447 21.231 17.089 1.00 0.00 N ATOM 1153 CA VAL A 70 4.553 21.839 18.418 1.00 0.00 C ATOM 1154 C VAL A 70 4.887 20.780 19.468 1.00 0.00 C ATOM 1155 O VAL A 70 4.164 19.800 19.614 1.00 0.00 O ATOM 1156 CB VAL A 70 3.210 22.562 18.772 1.00 0.00 C ATOM 1157 CG1 VAL A 70 3.235 23.151 20.209 1.00 0.00 C ATOM 1158 CG2 VAL A 70 2.894 23.640 17.696 1.00 0.00 C ATOM 0 H VAL A 70 3.691 20.550 17.016 1.00 0.00 H new ATOM 0 HA VAL A 70 5.360 22.572 18.411 1.00 0.00 H new ATOM 0 HB VAL A 70 2.404 21.828 18.763 1.00 0.00 H new ATOM 0 HG11 VAL A 70 2.285 23.644 20.417 1.00 0.00 H new ATOM 0 HG12 VAL A 70 3.391 22.348 20.929 1.00 0.00 H new ATOM 0 HG13 VAL A 70 4.046 23.875 20.291 1.00 0.00 H new ATOM 0 HG21 VAL A 70 1.959 24.141 17.946 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.701 24.372 17.667 1.00 0.00 H new ATOM 0 HG23 VAL A 70 2.801 23.164 16.720 1.00 0.00 H new ATOM 1168 N LEU A 71 5.983 20.999 20.203 1.00 0.00 N ATOM 1169 CA LEU A 71 6.419 20.101 21.279 1.00 0.00 C ATOM 1170 C LEU A 71 5.833 20.578 22.623 1.00 0.00 C ATOM 1171 O LEU A 71 6.054 21.722 23.028 1.00 0.00 O ATOM 1172 CB LEU A 71 7.966 20.042 21.328 1.00 0.00 C ATOM 1173 CG LEU A 71 8.677 19.566 20.018 1.00 0.00 C ATOM 1174 CD1 LEU A 71 10.219 19.618 20.153 1.00 0.00 C ATOM 1175 CD2 LEU A 71 8.202 18.151 19.610 1.00 0.00 C ATOM 0 H LEU A 71 6.594 21.805 20.069 1.00 0.00 H new ATOM 0 HA LEU A 71 6.052 19.093 21.085 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.340 21.034 21.580 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.259 19.375 22.139 1.00 0.00 H new ATOM 0 HG LEU A 71 8.396 20.258 19.225 1.00 0.00 H new ATOM 0 HD11 LEU A 71 10.677 19.280 19.223 1.00 0.00 H new ATOM 0 HD12 LEU A 71 10.532 20.641 20.361 1.00 0.00 H new ATOM 0 HD13 LEU A 71 10.535 18.969 20.970 1.00 0.00 H new ATOM 0 HD21 LEU A 71 8.712 17.845 18.697 1.00 0.00 H new ATOM 0 HD22 LEU A 71 8.433 17.445 20.408 1.00 0.00 H new ATOM 0 HD23 LEU A 71 7.126 18.164 19.438 1.00 0.00 H new ATOM 1187 N ARG A 72 5.050 19.697 23.267 1.00 0.00 N ATOM 1188 CA ARG A 72 4.471 19.928 24.609 1.00 0.00 C ATOM 1189 C ARG A 72 5.432 19.396 25.684 1.00 0.00 C ATOM 1190 O ARG A 72 5.518 19.958 26.772 1.00 0.00 O ATOM 1191 CB ARG A 72 3.097 19.213 24.742 1.00 0.00 C ATOM 1192 CG ARG A 72 1.996 19.730 23.789 1.00 0.00 C ATOM 1193 CD ARG A 72 0.687 18.923 23.921 1.00 0.00 C ATOM 1194 NE ARG A 72 0.088 19.043 25.270 1.00 0.00 N ATOM 1195 CZ ARG A 72 -0.496 18.048 25.969 1.00 0.00 C ATOM 1196 NH1 ARG A 72 -0.505 16.799 25.524 1.00 0.00 N ATOM 1197 NH2 ARG A 72 -1.056 18.315 27.137 1.00 0.00 N ATOM 0 H ARG A 72 4.796 18.793 22.869 1.00 0.00 H new ATOM 0 HA ARG A 72 4.323 20.999 24.745 1.00 0.00 H new ATOM 0 HB2 ARG A 72 3.240 18.147 24.563 1.00 0.00 H new ATOM 0 HB3 ARG A 72 2.747 19.320 25.769 1.00 0.00 H new ATOM 0 HG2 ARG A 72 1.797 20.780 24.002 1.00 0.00 H new ATOM 0 HG3 ARG A 72 2.353 19.675 22.760 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -0.028 19.270 23.176 1.00 0.00 H new ATOM 0 HD3 ARG A 72 0.886 17.873 23.706 1.00 0.00 H new ATOM 0 HE ARG A 72 0.120 19.962 25.711 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -0.063 16.572 24.633 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -0.954 16.065 26.073 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -1.044 19.267 27.503 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -1.500 17.569 27.672 1.00 0.00 H new ATOM 1211 N LEU A 73 6.081 18.251 25.356 1.00 0.00 N ATOM 1212 CA LEU A 73 7.107 17.574 26.192 1.00 0.00 C ATOM 1213 C LEU A 73 6.678 17.412 27.668 1.00 0.00 C ATOM 1214 O LEU A 73 7.508 17.425 28.583 1.00 0.00 O ATOM 1215 CB LEU A 73 8.481 18.280 26.019 1.00 0.00 C ATOM 1216 CG LEU A 73 9.034 18.284 24.549 1.00 0.00 C ATOM 1217 CD1 LEU A 73 10.360 19.053 24.441 1.00 0.00 C ATOM 1218 CD2 LEU A 73 9.180 16.846 23.987 1.00 0.00 C ATOM 0 H LEU A 73 5.901 17.759 24.480 1.00 0.00 H new ATOM 0 HA LEU A 73 7.214 16.550 25.834 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.391 19.311 26.362 1.00 0.00 H new ATOM 0 HB3 LEU A 73 9.210 17.791 26.666 1.00 0.00 H new ATOM 0 HG LEU A 73 8.298 18.806 23.937 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.709 19.033 23.409 1.00 0.00 H new ATOM 0 HD12 LEU A 73 10.208 20.086 24.752 1.00 0.00 H new ATOM 0 HD13 LEU A 73 11.105 18.586 25.085 1.00 0.00 H new ATOM 0 HD21 LEU A 73 9.565 16.891 22.968 1.00 0.00 H new ATOM 0 HD22 LEU A 73 9.871 16.280 24.612 1.00 0.00 H new ATOM 0 HD23 LEU A 73 8.207 16.355 23.986 1.00 0.00 H new ATOM 1358 N LYS B 201 11.811 27.699 24.678 1.00 0.00 N ATOM 1359 CA LYS B 201 11.343 28.945 24.039 1.00 0.00 C ATOM 1360 C LYS B 201 11.025 28.612 22.580 1.00 0.00 C ATOM 1361 O LYS B 201 11.892 28.123 21.844 1.00 0.00 O ATOM 1362 CB LYS B 201 12.404 30.092 24.099 1.00 0.00 C ATOM 1363 CG LYS B 201 12.783 30.606 25.516 1.00 0.00 C ATOM 1364 CD LYS B 201 13.587 29.592 26.362 1.00 0.00 C ATOM 1365 CE LYS B 201 14.918 29.184 25.702 1.00 0.00 C ATOM 1366 NZ LYS B 201 15.635 28.155 26.501 1.00 0.00 N ATOM 0 HA LYS B 201 10.467 29.310 24.576 1.00 0.00 H new ATOM 0 HB2 LYS B 201 13.312 29.744 23.607 1.00 0.00 H new ATOM 0 HB3 LYS B 201 12.030 30.935 23.518 1.00 0.00 H new ATOM 0 HG2 LYS B 201 13.366 31.521 25.415 1.00 0.00 H new ATOM 0 HG3 LYS B 201 11.871 30.867 26.052 1.00 0.00 H new ATOM 0 HD2 LYS B 201 13.790 30.024 27.342 1.00 0.00 H new ATOM 0 HD3 LYS B 201 12.980 28.701 26.526 1.00 0.00 H new ATOM 0 HE2 LYS B 201 14.725 28.798 24.701 1.00 0.00 H new ATOM 0 HE3 LYS B 201 15.552 30.063 25.588 1.00 0.00 H new ATOM 0 HZ1 LYS B 201 16.526 27.905 26.026 1.00 0.00 H new ATOM 0 HZ2 LYS B 201 15.841 28.532 27.448 1.00 0.00 H new ATOM 0 HZ3 LYS B 201 15.040 27.307 26.589 1.00 0.00 H new ATOM 1380 N VAL B 202 9.792 28.885 22.178 1.00 0.00 N ATOM 1381 CA VAL B 202 9.224 28.455 20.894 1.00 0.00 C ATOM 1382 C VAL B 202 8.345 29.576 20.322 1.00 0.00 C ATOM 1383 O VAL B 202 8.291 30.665 20.891 1.00 0.00 O ATOM 1384 CB VAL B 202 8.393 27.117 21.080 1.00 0.00 C ATOM 1385 CG1 VAL B 202 9.303 25.869 21.225 1.00 0.00 C ATOM 1386 CG2 VAL B 202 7.449 27.220 22.296 1.00 0.00 C ATOM 0 H VAL B 202 9.137 29.424 22.744 1.00 0.00 H new ATOM 0 HA VAL B 202 10.031 28.251 20.190 1.00 0.00 H new ATOM 0 HB VAL B 202 7.801 26.991 20.173 1.00 0.00 H new ATOM 0 HG11 VAL B 202 8.684 24.980 21.350 1.00 0.00 H new ATOM 0 HG12 VAL B 202 9.918 25.761 20.331 1.00 0.00 H new ATOM 0 HG13 VAL B 202 9.947 25.988 22.096 1.00 0.00 H new ATOM 0 HG21 VAL B 202 6.890 26.290 22.403 1.00 0.00 H new ATOM 0 HG22 VAL B 202 8.035 27.396 23.198 1.00 0.00 H new ATOM 0 HG23 VAL B 202 6.754 28.046 22.148 1.00 0.00 H new ATOM 1396 N ASP B 203 7.694 29.323 19.178 1.00 0.00 N ATOM 1397 CA ASP B 203 6.810 30.308 18.510 1.00 0.00 C ATOM 1398 C ASP B 203 5.416 29.715 18.319 1.00 0.00 C ATOM 1399 O ASP B 203 5.288 28.524 18.075 1.00 0.00 O ATOM 1400 CB ASP B 203 7.395 30.735 17.136 1.00 0.00 C ATOM 1401 CG ASP B 203 8.719 31.503 17.262 1.00 0.00 C ATOM 1402 OD1 ASP B 203 9.786 30.860 17.365 1.00 0.00 O ATOM 1403 OD2 ASP B 203 8.704 32.753 17.276 1.00 0.00 O ATOM 0 H ASP B 203 7.761 28.433 18.684 1.00 0.00 H new ATOM 0 HA ASP B 203 6.742 31.191 19.145 1.00 0.00 H new ATOM 0 HB2 ASP B 203 7.553 29.848 16.523 1.00 0.00 H new ATOM 0 HB3 ASP B 203 6.668 31.358 16.615 1.00 0.00 H new ATOM 1408 N CYS B 204 4.378 30.562 18.466 1.00 0.00 N ATOM 1409 CA CYS B 204 2.971 30.222 18.168 1.00 0.00 C ATOM 1410 C CYS B 204 2.743 30.446 16.671 1.00 0.00 C ATOM 1411 O CYS B 204 2.541 31.587 16.274 1.00 0.00 O ATOM 1412 CB CYS B 204 2.018 31.104 19.024 1.00 0.00 C ATOM 1413 SG CYS B 204 0.227 30.723 18.943 1.00 0.00 S ATOM 0 H CYS B 204 4.495 31.518 18.801 1.00 0.00 H new ATOM 0 HA CYS B 204 2.761 29.182 18.417 1.00 0.00 H new ATOM 0 HB2 CYS B 204 2.333 31.030 20.065 1.00 0.00 H new ATOM 0 HB3 CYS B 204 2.157 32.142 18.723 1.00 0.00 H new ATOM 0 HG CYS B 204 -0.420 31.502 19.758 1.00 0.00 H new ATOM 1418 N PRO B 205 2.804 29.371 15.808 1.00 0.00 N ATOM 1419 CA PRO B 205 2.787 29.510 14.324 1.00 0.00 C ATOM 1420 C PRO B 205 1.543 30.248 13.788 1.00 0.00 C ATOM 1421 O PRO B 205 1.593 30.860 12.714 1.00 0.00 O ATOM 1422 CB PRO B 205 2.827 28.030 13.827 1.00 0.00 C ATOM 1423 CG PRO B 205 2.354 27.222 14.996 1.00 0.00 C ATOM 1424 CD PRO B 205 2.902 27.938 16.200 1.00 0.00 C ATOM 0 HA PRO B 205 3.619 30.118 13.968 1.00 0.00 H new ATOM 0 HB2 PRO B 205 2.182 27.886 12.960 1.00 0.00 H new ATOM 0 HB3 PRO B 205 3.834 27.740 13.527 1.00 0.00 H new ATOM 0 HG2 PRO B 205 1.266 27.170 15.027 1.00 0.00 H new ATOM 0 HG3 PRO B 205 2.721 26.197 14.944 1.00 0.00 H new ATOM 0 HD2 PRO B 205 2.321 27.724 17.097 1.00 0.00 H new ATOM 0 HD3 PRO B 205 3.931 27.646 16.410 1.00 0.00 H new ATOM 1432 N VAL B 206 0.447 30.191 14.563 1.00 0.00 N ATOM 1433 CA VAL B 206 -0.863 30.703 14.138 1.00 0.00 C ATOM 1434 C VAL B 206 -0.892 32.251 14.150 1.00 0.00 C ATOM 1435 O VAL B 206 -1.244 32.872 13.144 1.00 0.00 O ATOM 1436 CB VAL B 206 -2.024 30.129 15.035 1.00 0.00 C ATOM 1437 CG1 VAL B 206 -3.408 30.523 14.465 1.00 0.00 C ATOM 1438 CG2 VAL B 206 -1.899 28.589 15.203 1.00 0.00 C ATOM 0 H VAL B 206 0.446 29.789 15.500 1.00 0.00 H new ATOM 0 HA VAL B 206 -1.024 30.364 13.115 1.00 0.00 H new ATOM 0 HB VAL B 206 -1.932 30.573 16.026 1.00 0.00 H new ATOM 0 HG11 VAL B 206 -4.193 30.115 15.102 1.00 0.00 H new ATOM 0 HG12 VAL B 206 -3.493 31.609 14.435 1.00 0.00 H new ATOM 0 HG13 VAL B 206 -3.514 30.122 13.457 1.00 0.00 H new ATOM 0 HG21 VAL B 206 -2.715 28.224 15.827 1.00 0.00 H new ATOM 0 HG22 VAL B 206 -1.948 28.111 14.225 1.00 0.00 H new ATOM 0 HG23 VAL B 206 -0.946 28.351 15.675 1.00 0.00 H new ATOM 1448 N CYS B 207 -0.504 32.868 15.293 1.00 0.00 N ATOM 1449 CA CYS B 207 -0.553 34.350 15.450 1.00 0.00 C ATOM 1450 C CYS B 207 0.859 34.973 15.425 1.00 0.00 C ATOM 1451 O CYS B 207 0.994 36.192 15.497 1.00 0.00 O ATOM 1452 CB CYS B 207 -1.303 34.758 16.739 1.00 0.00 C ATOM 1453 SG CYS B 207 -0.424 34.396 18.288 1.00 0.00 S ATOM 0 H CYS B 207 -0.157 32.372 16.114 1.00 0.00 H new ATOM 0 HA CYS B 207 -1.107 34.741 14.597 1.00 0.00 H new ATOM 0 HB2 CYS B 207 -1.510 35.827 16.698 1.00 0.00 H new ATOM 0 HB3 CYS B 207 -2.266 34.248 16.758 1.00 0.00 H new ATOM 0 HG CYS B 207 -0.260 33.112 18.404 1.00 0.00 H new ATOM 1458 N GLY B 208 1.899 34.117 15.355 1.00 0.00 N ATOM 1459 CA GLY B 208 3.286 34.550 15.094 1.00 0.00 C ATOM 1460 C GLY B 208 3.972 35.275 16.256 1.00 0.00 C ATOM 1461 O GLY B 208 4.607 36.314 16.048 1.00 0.00 O ATOM 0 H GLY B 208 1.801 33.109 15.478 1.00 0.00 H new ATOM 0 HA2 GLY B 208 3.880 33.674 14.832 1.00 0.00 H new ATOM 0 HA3 GLY B 208 3.287 35.208 14.225 1.00 0.00 H new ATOM 1465 N VAL B 209 3.847 34.729 17.482 1.00 0.00 N ATOM 1466 CA VAL B 209 4.454 35.316 18.711 1.00 0.00 C ATOM 1467 C VAL B 209 5.446 34.319 19.361 1.00 0.00 C ATOM 1468 O VAL B 209 5.161 33.124 19.421 1.00 0.00 O ATOM 1469 CB VAL B 209 3.342 35.741 19.752 1.00 0.00 C ATOM 1470 CG1 VAL B 209 2.412 36.821 19.151 1.00 0.00 C ATOM 1471 CG2 VAL B 209 2.516 34.524 20.245 1.00 0.00 C ATOM 0 H VAL B 209 3.325 33.870 17.656 1.00 0.00 H new ATOM 0 HA VAL B 209 5.001 36.211 18.416 1.00 0.00 H new ATOM 0 HB VAL B 209 3.853 36.163 20.618 1.00 0.00 H new ATOM 0 HG11 VAL B 209 1.655 37.098 19.884 1.00 0.00 H new ATOM 0 HG12 VAL B 209 2.999 37.700 18.886 1.00 0.00 H new ATOM 0 HG13 VAL B 209 1.926 36.427 18.259 1.00 0.00 H new ATOM 0 HG21 VAL B 209 1.763 34.860 20.958 1.00 0.00 H new ATOM 0 HG22 VAL B 209 2.025 34.050 19.396 1.00 0.00 H new ATOM 0 HG23 VAL B 209 3.179 33.806 20.728 1.00 0.00 H new ATOM 1481 N ASN B 210 6.602 34.813 19.854 1.00 0.00 N ATOM 1482 CA ASN B 210 7.612 33.958 20.518 1.00 0.00 C ATOM 1483 C ASN B 210 7.310 33.876 22.029 1.00 0.00 C ATOM 1484 O ASN B 210 7.375 34.883 22.739 1.00 0.00 O ATOM 1485 CB ASN B 210 9.048 34.485 20.260 1.00 0.00 C ATOM 1486 CG ASN B 210 10.128 33.528 20.788 1.00 0.00 C ATOM 1487 OD1 ASN B 210 10.634 33.679 21.898 1.00 0.00 O ATOM 1488 ND2 ASN B 210 10.463 32.516 20.009 1.00 0.00 N ATOM 0 H ASN B 210 6.860 35.799 19.805 1.00 0.00 H new ATOM 0 HA ASN B 210 7.557 32.955 20.095 1.00 0.00 H new ATOM 0 HB2 ASN B 210 9.190 34.634 19.190 1.00 0.00 H new ATOM 0 HB3 ASN B 210 9.165 35.459 20.736 1.00 0.00 H new ATOM 0 HD21 ASN B 210 11.156 31.837 20.324 1.00 0.00 H new ATOM 0 HD22 ASN B 210 10.029 32.413 19.092 1.00 0.00 H new ATOM 1495 N ILE B 211 6.988 32.661 22.498 1.00 0.00 N ATOM 1496 CA ILE B 211 6.488 32.384 23.866 1.00 0.00 C ATOM 1497 C ILE B 211 7.027 31.011 24.356 1.00 0.00 C ATOM 1498 O ILE B 211 7.382 30.171 23.528 1.00 0.00 O ATOM 1499 CB ILE B 211 4.900 32.385 23.897 1.00 0.00 C ATOM 1500 CG1 ILE B 211 4.332 31.472 22.762 1.00 0.00 C ATOM 1501 CG2 ILE B 211 4.320 33.823 23.813 1.00 0.00 C ATOM 1502 CD1 ILE B 211 2.823 31.426 22.676 1.00 0.00 C ATOM 0 H ILE B 211 7.068 31.819 21.928 1.00 0.00 H new ATOM 0 HA ILE B 211 6.845 33.171 24.531 1.00 0.00 H new ATOM 0 HB ILE B 211 4.584 31.975 24.856 1.00 0.00 H new ATOM 0 HG12 ILE B 211 4.725 31.818 21.806 1.00 0.00 H new ATOM 0 HG13 ILE B 211 4.704 30.458 22.911 1.00 0.00 H new ATOM 0 HG21 ILE B 211 3.231 33.778 23.837 1.00 0.00 H new ATOM 0 HG22 ILE B 211 4.678 34.410 24.659 1.00 0.00 H new ATOM 0 HG23 ILE B 211 4.643 34.292 22.884 1.00 0.00 H new ATOM 0 HD11 ILE B 211 2.525 30.768 21.860 1.00 0.00 H new ATOM 0 HD12 ILE B 211 2.416 31.048 23.614 1.00 0.00 H new ATOM 0 HD13 ILE B 211 2.438 32.429 22.492 1.00 0.00 H new ATOM 1514 N PRO B 212 7.121 30.764 25.708 1.00 0.00 N ATOM 1515 CA PRO B 212 7.563 29.454 26.261 1.00 0.00 C ATOM 1516 C PRO B 212 6.583 28.282 25.968 1.00 0.00 C ATOM 1517 O PRO B 212 5.433 28.492 25.590 1.00 0.00 O ATOM 1518 CB PRO B 212 7.703 29.723 27.778 1.00 0.00 C ATOM 1519 CG PRO B 212 6.804 30.891 28.044 1.00 0.00 C ATOM 1520 CD PRO B 212 6.868 31.747 26.800 1.00 0.00 C ATOM 0 HA PRO B 212 8.490 29.121 25.794 1.00 0.00 H new ATOM 0 HB2 PRO B 212 7.405 28.853 28.363 1.00 0.00 H new ATOM 0 HB3 PRO B 212 8.735 29.949 28.046 1.00 0.00 H new ATOM 0 HG2 PRO B 212 5.784 30.563 28.241 1.00 0.00 H new ATOM 0 HG3 PRO B 212 7.135 31.448 28.920 1.00 0.00 H new ATOM 0 HD2 PRO B 212 5.938 32.292 26.641 1.00 0.00 H new ATOM 0 HD3 PRO B 212 7.665 32.488 26.864 1.00 0.00 H new ATOM 1528 N GLU B 213 7.099 27.063 26.182 1.00 0.00 N ATOM 1529 CA GLU B 213 6.509 25.772 25.757 1.00 0.00 C ATOM 1530 C GLU B 213 5.059 25.522 26.285 1.00 0.00 C ATOM 1531 O GLU B 213 4.169 25.114 25.522 1.00 0.00 O ATOM 1532 CB GLU B 213 7.487 24.657 26.220 1.00 0.00 C ATOM 1533 CG GLU B 213 7.156 23.224 25.762 1.00 0.00 C ATOM 1534 CD GLU B 213 8.042 22.179 26.458 1.00 0.00 C ATOM 1535 OE1 GLU B 213 7.689 21.737 27.572 1.00 0.00 O ATOM 1536 OE2 GLU B 213 9.114 21.836 25.925 1.00 0.00 O ATOM 0 H GLU B 213 7.981 26.938 26.679 1.00 0.00 H new ATOM 0 HA GLU B 213 6.391 25.779 24.673 1.00 0.00 H new ATOM 0 HB2 GLU B 213 8.486 24.908 25.863 1.00 0.00 H new ATOM 0 HB3 GLU B 213 7.526 24.667 27.309 1.00 0.00 H new ATOM 0 HG2 GLU B 213 6.108 23.009 25.972 1.00 0.00 H new ATOM 0 HG3 GLU B 213 7.287 23.149 24.682 1.00 0.00 H new ATOM 1543 N SER B 214 4.808 25.753 27.583 1.00 0.00 N ATOM 1544 CA SER B 214 3.455 25.540 28.165 1.00 0.00 C ATOM 1545 C SER B 214 2.467 26.607 27.637 1.00 0.00 C ATOM 1546 O SER B 214 1.293 26.311 27.320 1.00 0.00 O ATOM 1547 CB SER B 214 3.527 25.562 29.707 1.00 0.00 C ATOM 1548 OG SER B 214 4.543 24.688 30.178 1.00 0.00 O ATOM 0 H SER B 214 5.507 26.083 28.249 1.00 0.00 H new ATOM 0 HA SER B 214 3.088 24.561 27.857 1.00 0.00 H new ATOM 0 HB2 SER B 214 3.726 26.577 30.052 1.00 0.00 H new ATOM 0 HB3 SER B 214 2.565 25.266 30.125 1.00 0.00 H new ATOM 0 HG SER B 214 4.573 24.718 31.157 1.00 0.00 H new ATOM 1554 N HIS B 215 2.996 27.840 27.496 1.00 0.00 N ATOM 1555 CA HIS B 215 2.245 28.995 26.987 1.00 0.00 C ATOM 1556 C HIS B 215 1.886 28.807 25.511 1.00 0.00 C ATOM 1557 O HIS B 215 0.852 29.308 25.063 1.00 0.00 O ATOM 1558 CB HIS B 215 3.073 30.298 27.157 1.00 0.00 C ATOM 1559 CG HIS B 215 3.170 30.813 28.569 1.00 0.00 C ATOM 1560 ND1 HIS B 215 3.172 32.157 28.866 1.00 0.00 N ATOM 1561 CD2 HIS B 215 3.304 30.175 29.756 1.00 0.00 C ATOM 1562 CE1 HIS B 215 3.304 32.322 30.164 1.00 0.00 C ATOM 1563 NE2 HIS B 215 3.384 31.136 30.731 1.00 0.00 N ATOM 0 H HIS B 215 3.963 28.058 27.735 1.00 0.00 H new ATOM 0 HA HIS B 215 1.324 29.075 27.565 1.00 0.00 H new ATOM 0 HB2 HIS B 215 4.081 30.121 26.781 1.00 0.00 H new ATOM 0 HB3 HIS B 215 2.631 31.075 26.533 1.00 0.00 H new ATOM 0 HD2 HIS B 215 3.341 29.106 29.907 1.00 0.00 H new ATOM 0 HE1 HIS B 215 3.341 33.271 30.679 1.00 0.00 H new ATOM 0 HE2 HIS B 215 3.488 30.961 31.730 1.00 0.00 H new ATOM 1572 N ILE B 216 2.757 28.093 24.761 1.00 0.00 N ATOM 1573 CA ILE B 216 2.578 27.895 23.319 1.00 0.00 C ATOM 1574 C ILE B 216 1.379 26.971 23.080 1.00 0.00 C ATOM 1575 O ILE B 216 0.513 27.307 22.281 1.00 0.00 O ATOM 1576 CB ILE B 216 3.912 27.400 22.586 1.00 0.00 C ATOM 1577 CG1 ILE B 216 4.005 27.936 21.117 1.00 0.00 C ATOM 1578 CG2 ILE B 216 4.095 25.856 22.579 1.00 0.00 C ATOM 1579 CD1 ILE B 216 3.085 27.262 20.121 1.00 0.00 C ATOM 0 H ILE B 216 3.592 27.646 25.140 1.00 0.00 H new ATOM 0 HA ILE B 216 2.363 28.860 22.860 1.00 0.00 H new ATOM 0 HB ILE B 216 4.721 27.821 23.183 1.00 0.00 H new ATOM 0 HG12 ILE B 216 3.786 29.004 21.123 1.00 0.00 H new ATOM 0 HG13 ILE B 216 5.033 27.823 20.771 1.00 0.00 H new ATOM 0 HG21 ILE B 216 5.022 25.602 22.064 1.00 0.00 H new ATOM 0 HG22 ILE B 216 4.138 25.490 23.605 1.00 0.00 H new ATOM 0 HG23 ILE B 216 3.254 25.392 22.063 1.00 0.00 H new ATOM 0 HD11 ILE B 216 3.227 27.706 19.136 1.00 0.00 H new ATOM 0 HD12 ILE B 216 3.315 26.197 20.076 1.00 0.00 H new ATOM 0 HD13 ILE B 216 2.049 27.397 20.433 1.00 0.00 H new ATOM 1591 N ASN B 217 1.307 25.851 23.832 1.00 0.00 N ATOM 1592 CA ASN B 217 0.228 24.853 23.663 1.00 0.00 C ATOM 1593 C ASN B 217 -1.155 25.487 23.951 1.00 0.00 C ATOM 1594 O ASN B 217 -2.128 25.276 23.202 1.00 0.00 O ATOM 1595 CB ASN B 217 0.465 23.630 24.587 1.00 0.00 C ATOM 1596 CG ASN B 217 -0.442 22.447 24.238 1.00 0.00 C ATOM 1597 OD1 ASN B 217 -0.627 22.118 23.064 1.00 0.00 O ATOM 1598 ND2 ASN B 217 -1.030 21.822 25.241 1.00 0.00 N ATOM 0 H ASN B 217 1.981 25.616 24.560 1.00 0.00 H new ATOM 0 HA ASN B 217 0.241 24.512 22.628 1.00 0.00 H new ATOM 0 HB2 ASN B 217 1.507 23.319 24.513 1.00 0.00 H new ATOM 0 HB3 ASN B 217 0.293 23.922 25.623 1.00 0.00 H new ATOM 0 HD21 ASN B 217 -1.660 21.041 25.056 1.00 0.00 H new ATOM 0 HD22 ASN B 217 -0.855 22.120 26.201 1.00 0.00 H new ATOM 1605 N LYS B 218 -1.204 26.285 25.037 1.00 0.00 N ATOM 1606 CA LYS B 218 -2.405 27.049 25.432 1.00 0.00 C ATOM 1607 C LYS B 218 -2.836 28.039 24.325 1.00 0.00 C ATOM 1608 O LYS B 218 -4.011 28.052 23.891 1.00 0.00 O ATOM 1609 CB LYS B 218 -2.113 27.828 26.744 1.00 0.00 C ATOM 1610 CG LYS B 218 -3.281 28.736 27.212 1.00 0.00 C ATOM 1611 CD LYS B 218 -2.903 29.634 28.407 1.00 0.00 C ATOM 1612 CE LYS B 218 -4.047 30.578 28.807 1.00 0.00 C ATOM 1613 NZ LYS B 218 -3.678 31.450 29.947 1.00 0.00 N ATOM 0 H LYS B 218 -0.412 26.418 25.665 1.00 0.00 H new ATOM 0 HA LYS B 218 -3.221 26.344 25.589 1.00 0.00 H new ATOM 0 HB2 LYS B 218 -1.882 27.114 27.535 1.00 0.00 H new ATOM 0 HB3 LYS B 218 -1.224 28.442 26.600 1.00 0.00 H new ATOM 0 HG2 LYS B 218 -3.602 29.363 26.380 1.00 0.00 H new ATOM 0 HG3 LYS B 218 -4.131 28.112 27.488 1.00 0.00 H new ATOM 0 HD2 LYS B 218 -2.635 29.009 29.259 1.00 0.00 H new ATOM 0 HD3 LYS B 218 -2.021 30.222 28.153 1.00 0.00 H new ATOM 0 HE2 LYS B 218 -4.322 31.196 27.952 1.00 0.00 H new ATOM 0 HE3 LYS B 218 -4.926 29.990 29.071 1.00 0.00 H new ATOM 0 HZ1 LYS B 218 -4.479 32.070 30.183 1.00 0.00 H new ATOM 0 HZ2 LYS B 218 -3.441 30.862 30.771 1.00 0.00 H new ATOM 0 HZ3 LYS B 218 -2.855 32.031 29.688 1.00 0.00 H new ATOM 1627 N HIS B 219 -1.845 28.851 23.874 1.00 0.00 N ATOM 1628 CA HIS B 219 -2.051 29.938 22.895 1.00 0.00 C ATOM 1629 C HIS B 219 -2.657 29.376 21.619 1.00 0.00 C ATOM 1630 O HIS B 219 -3.558 29.971 21.059 1.00 0.00 O ATOM 1631 CB HIS B 219 -0.711 30.685 22.562 1.00 0.00 C ATOM 1632 CG HIS B 219 -0.790 32.197 22.669 1.00 0.00 C ATOM 1633 ND1 HIS B 219 -0.748 33.039 21.561 1.00 0.00 N ATOM 1634 CD2 HIS B 219 -0.849 32.957 23.793 1.00 0.00 C ATOM 1635 CE1 HIS B 219 -0.774 34.269 22.059 1.00 0.00 C ATOM 1636 NE2 HIS B 219 -0.834 34.264 23.395 1.00 0.00 N ATOM 0 H HIS B 219 -0.877 28.765 24.184 1.00 0.00 H new ATOM 0 HA HIS B 219 -2.734 30.661 23.341 1.00 0.00 H new ATOM 0 HB2 HIS B 219 0.067 30.326 23.235 1.00 0.00 H new ATOM 0 HB3 HIS B 219 -0.404 30.421 21.550 1.00 0.00 H new ATOM 0 HD2 HIS B 219 -0.898 32.596 24.810 1.00 0.00 H new ATOM 0 HE1 HIS B 219 -0.750 35.166 21.458 1.00 0.00 H new ATOM 0 HE2 HIS B 219 -0.863 35.083 24.003 1.00 0.00 H new ATOM 1644 N LEU B 220 -2.145 28.208 21.201 1.00 0.00 N ATOM 1645 CA LEU B 220 -2.623 27.497 20.017 1.00 0.00 C ATOM 1646 C LEU B 220 -4.084 27.165 20.139 1.00 0.00 C ATOM 1647 O LEU B 220 -4.841 27.530 19.279 1.00 0.00 O ATOM 1648 CB LEU B 220 -1.857 26.189 19.811 1.00 0.00 C ATOM 1649 CG LEU B 220 -0.374 26.350 19.492 1.00 0.00 C ATOM 1650 CD1 LEU B 220 0.309 24.992 19.474 1.00 0.00 C ATOM 1651 CD2 LEU B 220 -0.159 27.143 18.186 1.00 0.00 C ATOM 0 H LEU B 220 -1.382 27.731 21.682 1.00 0.00 H new ATOM 0 HA LEU B 220 -2.461 28.159 19.167 1.00 0.00 H new ATOM 0 HB2 LEU B 220 -1.955 25.583 20.712 1.00 0.00 H new ATOM 0 HB3 LEU B 220 -2.329 25.634 19.000 1.00 0.00 H new ATOM 0 HG LEU B 220 0.092 26.940 20.281 1.00 0.00 H new ATOM 0 HD11 LEU B 220 1.367 25.120 19.245 1.00 0.00 H new ATOM 0 HD12 LEU B 220 0.203 24.519 20.450 1.00 0.00 H new ATOM 0 HD13 LEU B 220 -0.153 24.362 18.714 1.00 0.00 H new ATOM 0 HD21 LEU B 220 0.909 27.238 17.990 1.00 0.00 H new ATOM 0 HD22 LEU B 220 -0.634 26.617 17.358 1.00 0.00 H new ATOM 0 HD23 LEU B 220 -0.600 28.135 18.286 1.00 0.00 H new ATOM 1663 N ASP B 221 -4.446 26.497 21.242 1.00 0.00 N ATOM 1664 CA ASP B 221 -5.793 25.933 21.441 1.00 0.00 C ATOM 1665 C ASP B 221 -6.886 27.014 21.287 1.00 0.00 C ATOM 1666 O ASP B 221 -7.995 26.728 20.845 1.00 0.00 O ATOM 1667 CB ASP B 221 -5.886 25.238 22.823 1.00 0.00 C ATOM 1668 CG ASP B 221 -7.150 24.373 22.969 1.00 0.00 C ATOM 1669 OD1 ASP B 221 -7.166 23.256 22.417 1.00 0.00 O ATOM 1670 OD2 ASP B 221 -8.129 24.806 23.609 1.00 0.00 O ATOM 0 H ASP B 221 -3.814 26.331 22.025 1.00 0.00 H new ATOM 0 HA ASP B 221 -5.966 25.186 20.666 1.00 0.00 H new ATOM 0 HB2 ASP B 221 -5.005 24.614 22.971 1.00 0.00 H new ATOM 0 HB3 ASP B 221 -5.876 25.995 23.607 1.00 0.00 H new ATOM 1675 N SER B 222 -6.525 28.266 21.632 1.00 0.00 N ATOM 1676 CA SER B 222 -7.398 29.442 21.440 1.00 0.00 C ATOM 1677 C SER B 222 -7.273 29.975 19.986 1.00 0.00 C ATOM 1678 O SER B 222 -8.276 30.248 19.322 1.00 0.00 O ATOM 1679 CB SER B 222 -7.013 30.536 22.469 1.00 0.00 C ATOM 1680 OG SER B 222 -7.860 31.678 22.374 1.00 0.00 O ATOM 0 H SER B 222 -5.622 28.490 22.051 1.00 0.00 H new ATOM 0 HA SER B 222 -8.438 29.157 21.601 1.00 0.00 H new ATOM 0 HB2 SER B 222 -7.072 30.123 23.476 1.00 0.00 H new ATOM 0 HB3 SER B 222 -5.978 30.838 22.308 1.00 0.00 H new ATOM 0 HG SER B 222 -7.587 32.344 23.039 1.00 0.00 H new ATOM 1686 N CYS B 223 -6.014 30.071 19.507 1.00 0.00 N ATOM 1687 CA CYS B 223 -5.652 30.685 18.209 1.00 0.00 C ATOM 1688 C CYS B 223 -6.141 29.847 16.993 1.00 0.00 C ATOM 1689 O CYS B 223 -6.441 30.404 15.939 1.00 0.00 O ATOM 1690 CB CYS B 223 -4.108 30.910 18.146 1.00 0.00 C ATOM 1691 SG CYS B 223 -3.484 32.166 19.329 1.00 0.00 S ATOM 0 H CYS B 223 -5.206 29.718 20.020 1.00 0.00 H new ATOM 0 HA CYS B 223 -6.163 31.646 18.144 1.00 0.00 H new ATOM 0 HB2 CYS B 223 -3.606 29.962 18.340 1.00 0.00 H new ATOM 0 HB3 CYS B 223 -3.837 31.213 17.135 1.00 0.00 H new ATOM 0 HG CYS B 223 -3.450 31.657 20.525 1.00 0.00 H new ATOM 1696 N LEU B 224 -6.248 28.510 17.168 1.00 0.00 N ATOM 1697 CA LEU B 224 -6.575 27.563 16.075 1.00 0.00 C ATOM 1698 C LEU B 224 -8.082 27.295 16.050 1.00 0.00 C ATOM 1699 O LEU B 224 -8.637 26.893 15.019 1.00 0.00 O ATOM 1700 CB LEU B 224 -5.719 26.245 16.207 1.00 0.00 C ATOM 1701 CG LEU B 224 -5.945 25.295 17.451 1.00 0.00 C ATOM 1702 CD1 LEU B 224 -7.187 24.382 17.320 1.00 0.00 C ATOM 1703 CD2 LEU B 224 -4.679 24.451 17.742 1.00 0.00 C ATOM 0 H LEU B 224 -6.110 28.056 18.071 1.00 0.00 H new ATOM 0 HA LEU B 224 -6.311 28.007 15.115 1.00 0.00 H new ATOM 0 HB2 LEU B 224 -5.889 25.653 15.308 1.00 0.00 H new ATOM 0 HB3 LEU B 224 -4.668 26.535 16.203 1.00 0.00 H new ATOM 0 HG LEU B 224 -6.139 25.956 18.296 1.00 0.00 H new ATOM 0 HD11 LEU B 224 -7.277 23.760 18.210 1.00 0.00 H new ATOM 0 HD12 LEU B 224 -8.081 24.997 17.215 1.00 0.00 H new ATOM 0 HD13 LEU B 224 -7.080 23.745 16.442 1.00 0.00 H new ATOM 0 HD21 LEU B 224 -4.861 23.807 18.602 1.00 0.00 H new ATOM 0 HD22 LEU B 224 -4.443 23.838 16.872 1.00 0.00 H new ATOM 0 HD23 LEU B 224 -3.841 25.114 17.957 1.00 0.00 H new