USER MOD reduce.3.24.130724 H: found=0, std=0, add=708, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 709 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 54 ASN : amide:sc= 0.427 K(o=1.1,f=0.26) USER MOD Set 1.2: A 62 TYR OH : rot 150:sc= 0.654 USER MOD Set 2.1: A 4 THR OG1 : rot 86:sc= 1.24 USER MOD Set 2.2: A 14 LYS NZ :NH3+ 175:sc= 0.894 (180deg=0) USER MOD Single : A 1 MET CE :methyl -168:sc= -0.142 (180deg=-0.434) USER MOD Single : A 1 MET N :NH3+ -162:sc= 2.25 (180deg=1.8) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.048) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.224 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 GLN : amide:sc= 0.835 K(o=0.84,f=-0.018) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ -164:sc= 2 (180deg=1.47) USER MOD Single : A 29 LYS NZ :NH3+ -171:sc= 1.2 (180deg=1.14) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -125:sc= 0.452 (180deg=0.00789) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= 0.648 K(o=0.65,f=-3.1!) USER MOD Single : A 45 LYS NZ :NH3+ 153:sc= 1.31 (180deg=0.579) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot -179:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 146:sc= 1.18 (180deg=0.862) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ -158:sc= 0.785 (180deg=0.497) USER MOD Single : A 68 ASN : amide:sc= 1.06 K(o=1.1,f=0) USER MOD Single : A 73 MET CE :methyl -177:sc= -0.657 (180deg=-0.666) USER MOD Single : B 286 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 289 TYR OH : rot 180:sc= 0 USER MOD Single : B 291 MET CE :methyl 173:sc= 0 (180deg=-0.0412) USER MOD Single : B 292 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 293 MET CE :methyl 171:sc= -0.376 (180deg=-0.397) USER MOD Single : B 294 SER OG : rot 50:sc=-0.00269 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.754 1.357 6.749 1.00 0.00 N ATOM 2 CA MET A 1 3.736 0.998 5.312 1.00 0.00 C ATOM 3 C MET A 1 4.443 -0.330 5.113 1.00 0.00 C ATOM 4 O MET A 1 5.628 -0.479 5.404 1.00 0.00 O ATOM 5 CB MET A 1 4.370 2.081 4.429 1.00 0.00 C ATOM 6 CG MET A 1 4.166 1.835 2.929 1.00 0.00 C ATOM 7 SD MET A 1 4.936 3.078 1.853 1.00 0.00 S ATOM 8 CE MET A 1 6.518 2.267 1.482 1.00 0.00 C ATOM 0 H1 MET A 1 3.031 2.081 6.935 1.00 0.00 H new ATOM 0 H2 MET A 1 3.553 0.512 7.321 1.00 0.00 H new ATOM 0 H3 MET A 1 4.691 1.731 7.002 1.00 0.00 H new ATOM 0 HA MET A 1 2.694 0.913 5.004 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.945 3.050 4.693 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.438 2.133 4.640 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.568 0.854 2.676 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.097 1.804 2.721 1.00 0.00 H new ATOM 0 HE1 MET A 1 7.192 2.983 1.011 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.965 1.901 2.406 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.348 1.430 0.805 1.00 0.00 H new ATOM 20 N GLN A 2 3.703 -1.316 4.633 1.00 0.00 N ATOM 21 CA GLN A 2 4.107 -2.710 4.555 1.00 0.00 C ATOM 22 C GLN A 2 4.812 -3.026 3.228 1.00 0.00 C ATOM 23 O GLN A 2 4.235 -3.584 2.295 1.00 0.00 O ATOM 24 CB GLN A 2 2.889 -3.581 4.883 1.00 0.00 C ATOM 25 CG GLN A 2 3.368 -4.929 5.415 1.00 0.00 C ATOM 26 CD GLN A 2 2.226 -5.935 5.559 1.00 0.00 C ATOM 27 OE1 GLN A 2 1.605 -6.362 4.596 1.00 0.00 O ATOM 28 NE2 GLN A 2 1.902 -6.363 6.762 1.00 0.00 N ATOM 0 H GLN A 2 2.762 -1.159 4.271 1.00 0.00 H new ATOM 0 HA GLN A 2 4.871 -2.940 5.298 1.00 0.00 H new ATOM 0 HB2 GLN A 2 2.261 -3.086 5.624 1.00 0.00 H new ATOM 0 HB3 GLN A 2 2.278 -3.724 3.992 1.00 0.00 H new ATOM 0 HG2 GLN A 2 4.124 -5.335 4.743 1.00 0.00 H new ATOM 0 HG3 GLN A 2 3.847 -4.785 6.384 1.00 0.00 H new ATOM 0 HE21 GLN A 2 2.407 -6.020 7.579 1.00 0.00 H new ATOM 0 HE22 GLN A 2 1.146 -7.038 6.877 1.00 0.00 H new ATOM 37 N VAL A 3 6.086 -2.640 3.155 1.00 0.00 N ATOM 38 CA VAL A 3 6.999 -2.891 2.029 1.00 0.00 C ATOM 39 C VAL A 3 7.241 -4.393 1.867 1.00 0.00 C ATOM 40 O VAL A 3 7.728 -5.059 2.785 1.00 0.00 O ATOM 41 CB VAL A 3 8.343 -2.157 2.229 1.00 0.00 C ATOM 42 CG1 VAL A 3 9.304 -2.393 1.055 1.00 0.00 C ATOM 43 CG2 VAL A 3 8.139 -0.642 2.311 1.00 0.00 C ATOM 0 H VAL A 3 6.534 -2.121 3.910 1.00 0.00 H new ATOM 0 HA VAL A 3 6.531 -2.505 1.123 1.00 0.00 H new ATOM 0 HB VAL A 3 8.759 -2.554 3.155 1.00 0.00 H new ATOM 0 HG11 VAL A 3 10.237 -1.859 1.236 1.00 0.00 H new ATOM 0 HG12 VAL A 3 9.508 -3.460 0.961 1.00 0.00 H new ATOM 0 HG13 VAL A 3 8.850 -2.028 0.134 1.00 0.00 H new ATOM 0 HG21 VAL A 3 9.103 -0.152 2.452 1.00 0.00 H new ATOM 0 HG22 VAL A 3 7.682 -0.286 1.388 1.00 0.00 H new ATOM 0 HG23 VAL A 3 7.487 -0.408 3.152 1.00 0.00 H new ATOM 53 N THR A 4 6.925 -4.938 0.692 1.00 0.00 N ATOM 54 CA THR A 4 7.310 -6.310 0.332 1.00 0.00 C ATOM 55 C THR A 4 8.765 -6.342 -0.113 1.00 0.00 C ATOM 56 O THR A 4 9.218 -5.475 -0.863 1.00 0.00 O ATOM 57 CB THR A 4 6.480 -6.840 -0.833 1.00 0.00 C ATOM 58 OG1 THR A 4 5.112 -6.883 -0.487 1.00 0.00 O ATOM 59 CG2 THR A 4 6.886 -8.261 -1.230 1.00 0.00 C ATOM 0 H THR A 4 6.400 -4.449 -0.033 1.00 0.00 H new ATOM 0 HA THR A 4 7.146 -6.926 1.216 1.00 0.00 H new ATOM 0 HB THR A 4 6.657 -6.160 -1.666 1.00 0.00 H new ATOM 0 HG1 THR A 4 4.702 -6.011 -0.665 1.00 0.00 H new ATOM 0 HG21 THR A 4 6.268 -8.597 -2.063 1.00 0.00 H new ATOM 0 HG22 THR A 4 7.934 -8.270 -1.529 1.00 0.00 H new ATOM 0 HG23 THR A 4 6.745 -8.930 -0.381 1.00 0.00 H new ATOM 67 N LEU A 5 9.476 -7.392 0.287 1.00 0.00 N ATOM 68 CA LEU A 5 10.870 -7.649 -0.036 1.00 0.00 C ATOM 69 C LEU A 5 11.035 -8.920 -0.863 1.00 0.00 C ATOM 70 O LEU A 5 10.262 -9.871 -0.728 1.00 0.00 O ATOM 71 CB LEU A 5 11.668 -7.791 1.270 1.00 0.00 C ATOM 72 CG LEU A 5 11.450 -6.666 2.292 1.00 0.00 C ATOM 73 CD1 LEU A 5 12.435 -6.864 3.434 1.00 0.00 C ATOM 74 CD2 LEU A 5 11.671 -5.290 1.690 1.00 0.00 C ATOM 0 H LEU A 5 9.072 -8.122 0.875 1.00 0.00 H new ATOM 0 HA LEU A 5 11.240 -6.812 -0.628 1.00 0.00 H new ATOM 0 HB2 LEU A 5 11.406 -8.740 1.737 1.00 0.00 H new ATOM 0 HB3 LEU A 5 12.729 -7.838 1.026 1.00 0.00 H new ATOM 0 HG LEU A 5 10.417 -6.714 2.636 1.00 0.00 H new ATOM 0 HD11 LEU A 5 12.298 -6.075 4.173 1.00 0.00 H new ATOM 0 HD12 LEU A 5 12.260 -7.833 3.901 1.00 0.00 H new ATOM 0 HD13 LEU A 5 13.453 -6.826 3.047 1.00 0.00 H new ATOM 0 HD21 LEU A 5 11.505 -4.529 2.452 1.00 0.00 H new ATOM 0 HD22 LEU A 5 12.693 -5.215 1.319 1.00 0.00 H new ATOM 0 HD23 LEU A 5 10.974 -5.137 0.866 1.00 0.00 H new ATOM 86 N LYS A 6 12.111 -8.947 -1.646 1.00 0.00 N ATOM 87 CA LYS A 6 12.618 -10.115 -2.371 1.00 0.00 C ATOM 88 C LYS A 6 14.133 -10.232 -2.206 1.00 0.00 C ATOM 89 O LYS A 6 14.848 -9.235 -2.314 1.00 0.00 O ATOM 90 CB LYS A 6 12.170 -10.064 -3.839 1.00 0.00 C ATOM 91 CG LYS A 6 12.511 -11.381 -4.554 1.00 0.00 C ATOM 92 CD LYS A 6 11.560 -11.660 -5.722 1.00 0.00 C ATOM 93 CE LYS A 6 11.734 -13.118 -6.155 1.00 0.00 C ATOM 94 NZ LYS A 6 10.669 -13.525 -7.111 1.00 0.00 N ATOM 0 H LYS A 6 12.682 -8.116 -1.801 1.00 0.00 H new ATOM 0 HA LYS A 6 12.192 -11.024 -1.945 1.00 0.00 H new ATOM 0 HB2 LYS A 6 11.096 -9.883 -3.891 1.00 0.00 H new ATOM 0 HB3 LYS A 6 12.659 -9.232 -4.345 1.00 0.00 H new ATOM 0 HG2 LYS A 6 13.536 -11.339 -4.923 1.00 0.00 H new ATOM 0 HG3 LYS A 6 12.462 -12.204 -3.841 1.00 0.00 H new ATOM 0 HD2 LYS A 6 10.528 -11.475 -5.423 1.00 0.00 H new ATOM 0 HD3 LYS A 6 11.776 -10.990 -6.554 1.00 0.00 H new ATOM 0 HE2 LYS A 6 12.712 -13.248 -6.618 1.00 0.00 H new ATOM 0 HE3 LYS A 6 11.707 -13.766 -5.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 10.812 -14.517 -7.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 9.738 -13.422 -6.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 10.712 -12.920 -7.956 1.00 0.00 H new ATOM 108 N THR A 7 14.609 -11.435 -1.904 1.00 0.00 N ATOM 109 CA THR A 7 16.027 -11.751 -1.680 1.00 0.00 C ATOM 110 C THR A 7 16.720 -12.187 -2.976 1.00 0.00 C ATOM 111 O THR A 7 16.069 -12.550 -3.961 1.00 0.00 O ATOM 112 CB THR A 7 16.195 -12.842 -0.603 1.00 0.00 C ATOM 113 OG1 THR A 7 15.932 -14.128 -1.124 1.00 0.00 O ATOM 114 CG2 THR A 7 15.281 -12.661 0.613 1.00 0.00 C ATOM 0 H THR A 7 14.003 -12.249 -1.804 1.00 0.00 H new ATOM 0 HA THR A 7 16.503 -10.836 -1.327 1.00 0.00 H new ATOM 0 HB THR A 7 17.233 -12.743 -0.285 1.00 0.00 H new ATOM 0 HG1 THR A 7 16.049 -14.797 -0.418 1.00 0.00 H new ATOM 0 HG21 THR A 7 15.459 -13.467 1.325 1.00 0.00 H new ATOM 0 HG22 THR A 7 15.494 -11.704 1.089 1.00 0.00 H new ATOM 0 HG23 THR A 7 14.240 -12.683 0.292 1.00 0.00 H new ATOM 122 N LEU A 8 18.058 -12.231 -2.975 1.00 0.00 N ATOM 123 CA LEU A 8 18.847 -12.789 -4.089 1.00 0.00 C ATOM 124 C LEU A 8 18.742 -14.323 -4.201 1.00 0.00 C ATOM 125 O LEU A 8 19.063 -14.896 -5.241 1.00 0.00 O ATOM 126 CB LEU A 8 20.312 -12.334 -3.985 1.00 0.00 C ATOM 127 CG LEU A 8 20.508 -10.813 -3.848 1.00 0.00 C ATOM 128 CD1 LEU A 8 21.988 -10.451 -3.908 1.00 0.00 C ATOM 129 CD2 LEU A 8 19.839 -10.013 -4.957 1.00 0.00 C ATOM 0 H LEU A 8 18.627 -11.882 -2.204 1.00 0.00 H new ATOM 0 HA LEU A 8 18.418 -12.395 -5.010 1.00 0.00 H new ATOM 0 HB2 LEU A 8 20.770 -12.824 -3.126 1.00 0.00 H new ATOM 0 HB3 LEU A 8 20.848 -12.677 -4.870 1.00 0.00 H new ATOM 0 HG LEU A 8 20.056 -10.561 -2.889 1.00 0.00 H new ATOM 0 HD11 LEU A 8 22.103 -9.372 -3.809 1.00 0.00 H new ATOM 0 HD12 LEU A 8 22.517 -10.948 -3.095 1.00 0.00 H new ATOM 0 HD13 LEU A 8 22.403 -10.774 -4.863 1.00 0.00 H new ATOM 0 HD21 LEU A 8 20.018 -8.950 -4.797 1.00 0.00 H new ATOM 0 HD22 LEU A 8 20.253 -10.310 -5.921 1.00 0.00 H new ATOM 0 HD23 LEU A 8 18.766 -10.206 -4.948 1.00 0.00 H new ATOM 141 N GLN A 9 18.235 -14.984 -3.156 1.00 0.00 N ATOM 142 CA GLN A 9 17.853 -16.402 -3.134 1.00 0.00 C ATOM 143 C GLN A 9 16.401 -16.620 -3.626 1.00 0.00 C ATOM 144 O GLN A 9 15.857 -17.718 -3.486 1.00 0.00 O ATOM 145 CB GLN A 9 18.077 -16.957 -1.714 1.00 0.00 C ATOM 146 CG GLN A 9 19.562 -16.965 -1.314 1.00 0.00 C ATOM 147 CD GLN A 9 19.765 -17.535 0.089 1.00 0.00 C ATOM 148 OE1 GLN A 9 19.800 -16.820 1.083 1.00 0.00 O ATOM 149 NE2 GLN A 9 19.906 -18.837 0.235 1.00 0.00 N ATOM 0 H GLN A 9 18.072 -14.525 -2.260 1.00 0.00 H new ATOM 0 HA GLN A 9 18.484 -16.953 -3.832 1.00 0.00 H new ATOM 0 HB2 GLN A 9 17.514 -16.356 -0.999 1.00 0.00 H new ATOM 0 HB3 GLN A 9 17.683 -17.972 -1.657 1.00 0.00 H new ATOM 0 HG2 GLN A 9 20.130 -17.556 -2.033 1.00 0.00 H new ATOM 0 HG3 GLN A 9 19.956 -15.949 -1.355 1.00 0.00 H new ATOM 0 HE21 GLN A 9 19.879 -19.448 -0.582 1.00 0.00 H new ATOM 0 HE22 GLN A 9 20.042 -19.234 1.165 1.00 0.00 H new ATOM 158 N GLN A 10 15.761 -15.588 -4.200 1.00 0.00 N ATOM 159 CA GLN A 10 14.409 -15.597 -4.787 1.00 0.00 C ATOM 160 C GLN A 10 13.277 -15.783 -3.752 1.00 0.00 C ATOM 161 O GLN A 10 12.135 -16.069 -4.114 1.00 0.00 O ATOM 162 CB GLN A 10 14.374 -16.603 -5.963 1.00 0.00 C ATOM 163 CG GLN A 10 13.353 -16.263 -7.060 1.00 0.00 C ATOM 164 CD GLN A 10 13.378 -17.295 -8.188 1.00 0.00 C ATOM 165 OE1 GLN A 10 12.648 -18.279 -8.187 1.00 0.00 O ATOM 166 NE2 GLN A 10 14.204 -17.116 -9.199 1.00 0.00 N ATOM 0 H GLN A 10 16.199 -14.670 -4.271 1.00 0.00 H new ATOM 0 HA GLN A 10 14.199 -14.605 -5.187 1.00 0.00 H new ATOM 0 HB2 GLN A 10 15.366 -16.654 -6.411 1.00 0.00 H new ATOM 0 HB3 GLN A 10 14.150 -17.595 -5.570 1.00 0.00 H new ATOM 0 HG2 GLN A 10 12.353 -16.219 -6.627 1.00 0.00 H new ATOM 0 HG3 GLN A 10 13.568 -15.274 -7.465 1.00 0.00 H new ATOM 0 HE21 GLN A 10 14.819 -16.303 -9.217 1.00 0.00 H new ATOM 0 HE22 GLN A 10 14.228 -17.791 -9.964 1.00 0.00 H new ATOM 175 N GLN A 11 13.569 -15.585 -2.462 1.00 0.00 N ATOM 176 CA GLN A 11 12.596 -15.683 -1.366 1.00 0.00 C ATOM 177 C GLN A 11 11.931 -14.325 -1.128 1.00 0.00 C ATOM 178 O GLN A 11 12.509 -13.294 -1.468 1.00 0.00 O ATOM 179 CB GLN A 11 13.283 -16.194 -0.089 1.00 0.00 C ATOM 180 CG GLN A 11 14.138 -17.452 -0.318 1.00 0.00 C ATOM 181 CD GLN A 11 13.350 -18.618 -0.917 1.00 0.00 C ATOM 182 OE1 GLN A 11 12.405 -19.136 -0.334 1.00 0.00 O ATOM 183 NE2 GLN A 11 13.704 -19.083 -2.097 1.00 0.00 N ATOM 0 H GLN A 11 14.508 -15.347 -2.143 1.00 0.00 H new ATOM 0 HA GLN A 11 11.820 -16.397 -1.642 1.00 0.00 H new ATOM 0 HB2 GLN A 11 13.914 -15.403 0.317 1.00 0.00 H new ATOM 0 HB3 GLN A 11 12.523 -16.412 0.662 1.00 0.00 H new ATOM 0 HG2 GLN A 11 14.967 -17.204 -0.981 1.00 0.00 H new ATOM 0 HG3 GLN A 11 14.572 -17.766 0.631 1.00 0.00 H new ATOM 0 HE21 GLN A 11 14.488 -18.663 -2.596 1.00 0.00 H new ATOM 0 HE22 GLN A 11 13.194 -19.863 -2.512 1.00 0.00 H new ATOM 192 N THR A 12 10.724 -14.296 -0.561 1.00 0.00 N ATOM 193 CA THR A 12 9.944 -13.057 -0.397 1.00 0.00 C ATOM 194 C THR A 12 9.295 -12.946 0.983 1.00 0.00 C ATOM 195 O THR A 12 8.782 -13.926 1.527 1.00 0.00 O ATOM 196 CB THR A 12 8.886 -12.894 -1.506 1.00 0.00 C ATOM 197 OG1 THR A 12 8.076 -14.049 -1.637 1.00 0.00 O ATOM 198 CG2 THR A 12 9.522 -12.634 -2.877 1.00 0.00 C ATOM 0 H THR A 12 10.255 -15.127 -0.201 1.00 0.00 H new ATOM 0 HA THR A 12 10.661 -12.240 -0.485 1.00 0.00 H new ATOM 0 HB THR A 12 8.283 -12.038 -1.202 1.00 0.00 H new ATOM 0 HG1 THR A 12 7.417 -13.907 -2.348 1.00 0.00 H new ATOM 0 HG21 THR A 12 8.738 -12.526 -3.627 1.00 0.00 H new ATOM 0 HG22 THR A 12 10.114 -11.720 -2.836 1.00 0.00 H new ATOM 0 HG23 THR A 12 10.166 -13.472 -3.144 1.00 0.00 H new ATOM 206 N PHE A 13 9.320 -11.734 1.543 1.00 0.00 N ATOM 207 CA PHE A 13 8.868 -11.386 2.899 1.00 0.00 C ATOM 208 C PHE A 13 8.186 -10.005 2.909 1.00 0.00 C ATOM 209 O PHE A 13 8.203 -9.300 1.900 1.00 0.00 O ATOM 210 CB PHE A 13 10.079 -11.410 3.853 1.00 0.00 C ATOM 211 CG PHE A 13 10.838 -12.726 3.887 1.00 0.00 C ATOM 212 CD1 PHE A 13 10.290 -13.838 4.556 1.00 0.00 C ATOM 213 CD2 PHE A 13 12.074 -12.855 3.222 1.00 0.00 C ATOM 214 CE1 PHE A 13 10.964 -15.073 4.547 1.00 0.00 C ATOM 215 CE2 PHE A 13 12.750 -14.089 3.218 1.00 0.00 C ATOM 216 CZ PHE A 13 12.192 -15.200 3.874 1.00 0.00 C ATOM 0 H PHE A 13 9.675 -10.922 1.038 1.00 0.00 H new ATOM 0 HA PHE A 13 8.132 -12.116 3.235 1.00 0.00 H new ATOM 0 HB2 PHE A 13 10.768 -10.617 3.563 1.00 0.00 H new ATOM 0 HB3 PHE A 13 9.734 -11.180 4.861 1.00 0.00 H new ATOM 0 HD1 PHE A 13 9.349 -13.742 5.078 1.00 0.00 H new ATOM 0 HD2 PHE A 13 12.503 -12.004 2.714 1.00 0.00 H new ATOM 0 HE1 PHE A 13 10.538 -15.924 5.057 1.00 0.00 H new ATOM 0 HE2 PHE A 13 13.699 -14.183 2.710 1.00 0.00 H new ATOM 0 HZ PHE A 13 12.706 -16.150 3.861 1.00 0.00 H new ATOM 226 N LYS A 14 7.608 -9.582 4.040 1.00 0.00 N ATOM 227 CA LYS A 14 7.009 -8.244 4.221 1.00 0.00 C ATOM 228 C LYS A 14 7.484 -7.576 5.514 1.00 0.00 C ATOM 229 O LYS A 14 7.619 -8.235 6.547 1.00 0.00 O ATOM 230 CB LYS A 14 5.475 -8.349 4.186 1.00 0.00 C ATOM 231 CG LYS A 14 4.958 -8.787 2.807 1.00 0.00 C ATOM 232 CD LYS A 14 3.430 -8.884 2.797 1.00 0.00 C ATOM 233 CE LYS A 14 2.929 -9.482 1.478 1.00 0.00 C ATOM 234 NZ LYS A 14 2.926 -8.489 0.372 1.00 0.00 N ATOM 0 H LYS A 14 7.540 -10.167 4.873 1.00 0.00 H new ATOM 0 HA LYS A 14 7.340 -7.611 3.398 1.00 0.00 H new ATOM 0 HB2 LYS A 14 5.143 -9.062 4.941 1.00 0.00 H new ATOM 0 HB3 LYS A 14 5.040 -7.384 4.446 1.00 0.00 H new ATOM 0 HG2 LYS A 14 5.285 -8.075 2.049 1.00 0.00 H new ATOM 0 HG3 LYS A 14 5.389 -9.753 2.544 1.00 0.00 H new ATOM 0 HD2 LYS A 14 3.095 -9.501 3.631 1.00 0.00 H new ATOM 0 HD3 LYS A 14 2.998 -7.894 2.939 1.00 0.00 H new ATOM 0 HE2 LYS A 14 3.560 -10.327 1.202 1.00 0.00 H new ATOM 0 HE3 LYS A 14 1.920 -9.870 1.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 2.661 -8.960 -0.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 2.240 -7.736 0.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 3.875 -8.075 0.275 1.00 0.00 H new ATOM 248 N ILE A 15 7.715 -6.265 5.449 1.00 0.00 N ATOM 249 CA ILE A 15 8.215 -5.406 6.533 1.00 0.00 C ATOM 250 C ILE A 15 7.354 -4.145 6.622 1.00 0.00 C ATOM 251 O ILE A 15 7.350 -3.307 5.721 1.00 0.00 O ATOM 252 CB ILE A 15 9.720 -5.096 6.324 1.00 0.00 C ATOM 253 CG1 ILE A 15 10.588 -6.308 6.730 1.00 0.00 C ATOM 254 CG2 ILE A 15 10.208 -3.832 7.052 1.00 0.00 C ATOM 255 CD1 ILE A 15 10.744 -6.568 8.235 1.00 0.00 C ATOM 0 H ILE A 15 7.550 -5.739 4.591 1.00 0.00 H new ATOM 0 HA ILE A 15 8.136 -5.923 7.489 1.00 0.00 H new ATOM 0 HB ILE A 15 9.832 -4.897 5.258 1.00 0.00 H new ATOM 0 HG12 ILE A 15 10.162 -7.201 6.272 1.00 0.00 H new ATOM 0 HG13 ILE A 15 11.582 -6.174 6.303 1.00 0.00 H new ATOM 0 HG21 ILE A 15 11.270 -3.686 6.855 1.00 0.00 H new ATOM 0 HG22 ILE A 15 9.650 -2.967 6.693 1.00 0.00 H new ATOM 0 HG23 ILE A 15 10.050 -3.946 8.124 1.00 0.00 H new ATOM 0 HD11 ILE A 15 11.374 -7.444 8.390 1.00 0.00 H new ATOM 0 HD12 ILE A 15 11.205 -5.701 8.708 1.00 0.00 H new ATOM 0 HD13 ILE A 15 9.763 -6.744 8.677 1.00 0.00 H new ATOM 267 N ASP A 16 6.594 -4.022 7.710 1.00 0.00 N ATOM 268 CA ASP A 16 5.883 -2.785 8.048 1.00 0.00 C ATOM 269 C ASP A 16 6.857 -1.738 8.617 1.00 0.00 C ATOM 270 O ASP A 16 7.303 -1.846 9.762 1.00 0.00 O ATOM 271 CB ASP A 16 4.715 -3.051 9.004 1.00 0.00 C ATOM 272 CG ASP A 16 3.911 -1.766 9.280 1.00 0.00 C ATOM 273 OD1 ASP A 16 3.671 -0.982 8.328 1.00 0.00 O ATOM 274 OD2 ASP A 16 3.512 -1.540 10.447 1.00 0.00 O ATOM 0 H ASP A 16 6.453 -4.776 8.383 1.00 0.00 H new ATOM 0 HA ASP A 16 5.455 -2.380 7.131 1.00 0.00 H new ATOM 0 HB2 ASP A 16 4.058 -3.808 8.576 1.00 0.00 H new ATOM 0 HB3 ASP A 16 5.096 -3.453 9.943 1.00 0.00 H new ATOM 279 N ILE A 17 7.203 -0.741 7.807 1.00 0.00 N ATOM 280 CA ILE A 17 8.136 0.352 8.112 1.00 0.00 C ATOM 281 C ILE A 17 7.433 1.718 8.026 1.00 0.00 C ATOM 282 O ILE A 17 6.484 1.899 7.263 1.00 0.00 O ATOM 283 CB ILE A 17 9.382 0.241 7.194 1.00 0.00 C ATOM 284 CG1 ILE A 17 10.395 1.387 7.391 1.00 0.00 C ATOM 285 CG2 ILE A 17 9.008 0.142 5.699 1.00 0.00 C ATOM 286 CD1 ILE A 17 10.974 1.466 8.809 1.00 0.00 C ATOM 0 H ILE A 17 6.820 -0.665 6.865 1.00 0.00 H new ATOM 0 HA ILE A 17 8.484 0.265 9.141 1.00 0.00 H new ATOM 0 HB ILE A 17 9.863 -0.688 7.502 1.00 0.00 H new ATOM 0 HG12 ILE A 17 11.213 1.262 6.681 1.00 0.00 H new ATOM 0 HG13 ILE A 17 9.909 2.333 7.154 1.00 0.00 H new ATOM 0 HG21 ILE A 17 9.916 0.066 5.101 1.00 0.00 H new ATOM 0 HG22 ILE A 17 8.392 -0.742 5.536 1.00 0.00 H new ATOM 0 HG23 ILE A 17 8.452 1.032 5.403 1.00 0.00 H new ATOM 0 HD11 ILE A 17 11.678 2.296 8.869 1.00 0.00 H new ATOM 0 HD12 ILE A 17 10.166 1.623 9.524 1.00 0.00 H new ATOM 0 HD13 ILE A 17 11.490 0.535 9.044 1.00 0.00 H new ATOM 298 N ASP A 18 7.885 2.698 8.810 1.00 0.00 N ATOM 299 CA ASP A 18 7.385 4.080 8.756 1.00 0.00 C ATOM 300 C ASP A 18 7.905 4.820 7.497 1.00 0.00 C ATOM 301 O ASP A 18 9.111 5.054 7.398 1.00 0.00 O ATOM 302 CB ASP A 18 7.810 4.819 10.032 1.00 0.00 C ATOM 303 CG ASP A 18 7.071 4.292 11.272 1.00 0.00 C ATOM 304 OD1 ASP A 18 5.882 4.643 11.460 1.00 0.00 O ATOM 305 OD2 ASP A 18 7.677 3.531 12.065 1.00 0.00 O ATOM 0 H ASP A 18 8.615 2.557 9.508 1.00 0.00 H new ATOM 0 HA ASP A 18 6.297 4.058 8.692 1.00 0.00 H new ATOM 0 HB2 ASP A 18 8.885 4.708 10.175 1.00 0.00 H new ATOM 0 HB3 ASP A 18 7.612 5.885 9.917 1.00 0.00 H new ATOM 310 N PRO A 19 7.051 5.218 6.529 1.00 0.00 N ATOM 311 CA PRO A 19 7.500 5.845 5.276 1.00 0.00 C ATOM 312 C PRO A 19 8.032 7.279 5.461 1.00 0.00 C ATOM 313 O PRO A 19 8.729 7.804 4.591 1.00 0.00 O ATOM 314 CB PRO A 19 6.273 5.818 4.361 1.00 0.00 C ATOM 315 CG PRO A 19 5.107 5.922 5.341 1.00 0.00 C ATOM 316 CD PRO A 19 5.598 5.115 6.544 1.00 0.00 C ATOM 0 HA PRO A 19 8.348 5.302 4.859 1.00 0.00 H new ATOM 0 HB2 PRO A 19 6.280 6.647 3.653 1.00 0.00 H new ATOM 0 HB3 PRO A 19 6.227 4.900 3.776 1.00 0.00 H new ATOM 0 HG2 PRO A 19 4.895 6.957 5.608 1.00 0.00 H new ATOM 0 HG3 PRO A 19 4.190 5.507 4.923 1.00 0.00 H new ATOM 0 HD2 PRO A 19 5.188 5.511 7.473 1.00 0.00 H new ATOM 0 HD3 PRO A 19 5.280 4.075 6.473 1.00 0.00 H new ATOM 324 N GLU A 20 7.726 7.912 6.598 1.00 0.00 N ATOM 325 CA GLU A 20 8.285 9.193 7.040 1.00 0.00 C ATOM 326 C GLU A 20 9.743 9.074 7.534 1.00 0.00 C ATOM 327 O GLU A 20 10.457 10.077 7.599 1.00 0.00 O ATOM 328 CB GLU A 20 7.407 9.749 8.173 1.00 0.00 C ATOM 329 CG GLU A 20 5.981 10.089 7.714 1.00 0.00 C ATOM 330 CD GLU A 20 5.162 10.702 8.867 1.00 0.00 C ATOM 331 OE1 GLU A 20 4.525 9.942 9.637 1.00 0.00 O ATOM 332 OE2 GLU A 20 5.141 11.950 9.009 1.00 0.00 O ATOM 0 H GLU A 20 7.054 7.529 7.263 1.00 0.00 H new ATOM 0 HA GLU A 20 8.294 9.863 6.181 1.00 0.00 H new ATOM 0 HB2 GLU A 20 7.359 9.018 8.980 1.00 0.00 H new ATOM 0 HB3 GLU A 20 7.875 10.645 8.582 1.00 0.00 H new ATOM 0 HG2 GLU A 20 6.021 10.789 6.879 1.00 0.00 H new ATOM 0 HG3 GLU A 20 5.487 9.188 7.351 1.00 0.00 H new ATOM 339 N GLU A 21 10.202 7.863 7.870 1.00 0.00 N ATOM 340 CA GLU A 21 11.596 7.562 8.221 1.00 0.00 C ATOM 341 C GLU A 21 12.449 7.243 6.976 1.00 0.00 C ATOM 342 O GLU A 21 11.978 7.252 5.831 1.00 0.00 O ATOM 343 CB GLU A 21 11.657 6.405 9.238 1.00 0.00 C ATOM 344 CG GLU A 21 10.931 6.681 10.562 1.00 0.00 C ATOM 345 CD GLU A 21 11.516 7.886 11.329 1.00 0.00 C ATOM 346 OE1 GLU A 21 12.755 7.957 11.517 1.00 0.00 O ATOM 347 OE2 GLU A 21 10.738 8.770 11.765 1.00 0.00 O ATOM 0 H GLU A 21 9.598 7.042 7.906 1.00 0.00 H new ATOM 0 HA GLU A 21 12.019 8.455 8.680 1.00 0.00 H new ATOM 0 HB2 GLU A 21 11.226 5.514 8.781 1.00 0.00 H new ATOM 0 HB3 GLU A 21 12.702 6.181 9.451 1.00 0.00 H new ATOM 0 HG2 GLU A 21 9.875 6.863 10.360 1.00 0.00 H new ATOM 0 HG3 GLU A 21 10.987 5.794 11.193 1.00 0.00 H new ATOM 354 N THR A 22 13.741 6.995 7.194 1.00 0.00 N ATOM 355 CA THR A 22 14.724 6.804 6.123 1.00 0.00 C ATOM 356 C THR A 22 14.898 5.348 5.692 1.00 0.00 C ATOM 357 O THR A 22 14.373 4.413 6.299 1.00 0.00 O ATOM 358 CB THR A 22 16.076 7.427 6.484 1.00 0.00 C ATOM 359 OG1 THR A 22 16.659 6.713 7.554 1.00 0.00 O ATOM 360 CG2 THR A 22 15.966 8.897 6.883 1.00 0.00 C ATOM 0 H THR A 22 14.141 6.920 8.129 1.00 0.00 H new ATOM 0 HA THR A 22 14.313 7.328 5.260 1.00 0.00 H new ATOM 0 HB THR A 22 16.695 7.370 5.589 1.00 0.00 H new ATOM 0 HG1 THR A 22 17.524 7.113 7.781 1.00 0.00 H new ATOM 0 HG21 THR A 22 16.956 9.283 7.127 1.00 0.00 H new ATOM 0 HG22 THR A 22 15.548 9.469 6.054 1.00 0.00 H new ATOM 0 HG23 THR A 22 15.315 8.990 7.752 1.00 0.00 H new ATOM 368 N VAL A 23 15.677 5.137 4.631 1.00 0.00 N ATOM 369 CA VAL A 23 16.079 3.805 4.152 1.00 0.00 C ATOM 370 C VAL A 23 16.861 3.034 5.226 1.00 0.00 C ATOM 371 O VAL A 23 16.691 1.822 5.363 1.00 0.00 O ATOM 372 CB VAL A 23 16.907 3.962 2.866 1.00 0.00 C ATOM 373 CG1 VAL A 23 17.497 2.642 2.354 1.00 0.00 C ATOM 374 CG2 VAL A 23 16.059 4.578 1.744 1.00 0.00 C ATOM 0 H VAL A 23 16.056 5.898 4.067 1.00 0.00 H new ATOM 0 HA VAL A 23 15.185 3.221 3.934 1.00 0.00 H new ATOM 0 HB VAL A 23 17.734 4.620 3.133 1.00 0.00 H new ATOM 0 HG11 VAL A 23 18.069 2.827 1.445 1.00 0.00 H new ATOM 0 HG12 VAL A 23 18.153 2.217 3.114 1.00 0.00 H new ATOM 0 HG13 VAL A 23 16.690 1.942 2.139 1.00 0.00 H new ATOM 0 HG21 VAL A 23 16.665 4.680 0.844 1.00 0.00 H new ATOM 0 HG22 VAL A 23 15.206 3.932 1.536 1.00 0.00 H new ATOM 0 HG23 VAL A 23 15.703 5.560 2.055 1.00 0.00 H new ATOM 384 N LYS A 24 17.660 3.721 6.055 1.00 0.00 N ATOM 385 CA LYS A 24 18.309 3.127 7.235 1.00 0.00 C ATOM 386 C LYS A 24 17.296 2.539 8.230 1.00 0.00 C ATOM 387 O LYS A 24 17.572 1.501 8.826 1.00 0.00 O ATOM 388 CB LYS A 24 19.227 4.171 7.892 1.00 0.00 C ATOM 389 CG LYS A 24 20.150 3.550 8.953 1.00 0.00 C ATOM 390 CD LYS A 24 21.097 4.604 9.539 1.00 0.00 C ATOM 391 CE LYS A 24 22.016 3.962 10.587 1.00 0.00 C ATOM 392 NZ LYS A 24 22.933 4.962 11.195 1.00 0.00 N ATOM 0 H LYS A 24 17.876 4.709 5.926 1.00 0.00 H new ATOM 0 HA LYS A 24 18.915 2.283 6.906 1.00 0.00 H new ATOM 0 HB2 LYS A 24 19.832 4.654 7.125 1.00 0.00 H new ATOM 0 HB3 LYS A 24 18.618 4.948 8.353 1.00 0.00 H new ATOM 0 HG2 LYS A 24 19.550 3.111 9.750 1.00 0.00 H new ATOM 0 HG3 LYS A 24 20.730 2.742 8.508 1.00 0.00 H new ATOM 0 HD2 LYS A 24 21.695 5.050 8.744 1.00 0.00 H new ATOM 0 HD3 LYS A 24 20.521 5.409 9.994 1.00 0.00 H new ATOM 0 HE2 LYS A 24 21.412 3.499 11.367 1.00 0.00 H new ATOM 0 HE3 LYS A 24 22.600 3.167 10.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 23.540 4.494 11.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 23.526 5.385 10.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 22.375 5.707 11.659 1.00 0.00 H new ATOM 406 N ALA A 25 16.112 3.137 8.380 1.00 0.00 N ATOM 407 CA ALA A 25 15.037 2.586 9.210 1.00 0.00 C ATOM 408 C ALA A 25 14.397 1.317 8.600 1.00 0.00 C ATOM 409 O ALA A 25 14.109 0.369 9.328 1.00 0.00 O ATOM 410 CB ALA A 25 14.008 3.681 9.503 1.00 0.00 C ATOM 0 H ALA A 25 15.871 4.019 7.928 1.00 0.00 H new ATOM 0 HA ALA A 25 15.469 2.254 10.154 1.00 0.00 H new ATOM 0 HB1 ALA A 25 13.208 3.273 10.120 1.00 0.00 H new ATOM 0 HB2 ALA A 25 14.491 4.502 10.032 1.00 0.00 H new ATOM 0 HB3 ALA A 25 13.591 4.049 8.565 1.00 0.00 H new ATOM 416 N LEU A 26 14.224 1.235 7.273 1.00 0.00 N ATOM 417 CA LEU A 26 13.834 -0.009 6.594 1.00 0.00 C ATOM 418 C LEU A 26 14.824 -1.136 6.945 1.00 0.00 C ATOM 419 O LEU A 26 14.433 -2.172 7.487 1.00 0.00 O ATOM 420 CB LEU A 26 13.690 0.271 5.081 1.00 0.00 C ATOM 421 CG LEU A 26 13.478 -0.949 4.170 1.00 0.00 C ATOM 422 CD1 LEU A 26 12.414 -1.886 4.723 1.00 0.00 C ATOM 423 CD2 LEU A 26 13.037 -0.483 2.781 1.00 0.00 C ATOM 0 H LEU A 26 14.350 2.026 6.642 1.00 0.00 H new ATOM 0 HA LEU A 26 12.862 -0.362 6.939 1.00 0.00 H new ATOM 0 HB2 LEU A 26 12.850 0.951 4.939 1.00 0.00 H new ATOM 0 HB3 LEU A 26 14.585 0.795 4.745 1.00 0.00 H new ATOM 0 HG LEU A 26 14.425 -1.487 4.116 1.00 0.00 H new ATOM 0 HD11 LEU A 26 12.293 -2.736 4.051 1.00 0.00 H new ATOM 0 HD12 LEU A 26 12.719 -2.242 5.707 1.00 0.00 H new ATOM 0 HD13 LEU A 26 11.467 -1.352 4.807 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.887 -1.350 2.137 1.00 0.00 H new ATOM 0 HD22 LEU A 26 12.103 0.073 2.863 1.00 0.00 H new ATOM 0 HD23 LEU A 26 13.806 0.160 2.352 1.00 0.00 H new ATOM 435 N LYS A 27 16.118 -0.884 6.732 1.00 0.00 N ATOM 436 CA LYS A 27 17.214 -1.760 7.182 1.00 0.00 C ATOM 437 C LYS A 27 17.135 -2.128 8.669 1.00 0.00 C ATOM 438 O LYS A 27 17.332 -3.298 8.995 1.00 0.00 O ATOM 439 CB LYS A 27 18.591 -1.170 6.840 1.00 0.00 C ATOM 440 CG LYS A 27 18.844 -1.033 5.332 1.00 0.00 C ATOM 441 CD LYS A 27 20.268 -0.521 5.084 1.00 0.00 C ATOM 442 CE LYS A 27 20.533 -0.326 3.587 1.00 0.00 C ATOM 443 NZ LYS A 27 21.943 0.069 3.355 1.00 0.00 N ATOM 0 H LYS A 27 16.443 -0.055 6.235 1.00 0.00 H new ATOM 0 HA LYS A 27 17.087 -2.689 6.627 1.00 0.00 H new ATOM 0 HB2 LYS A 27 18.682 -0.189 7.306 1.00 0.00 H new ATOM 0 HB3 LYS A 27 19.366 -1.802 7.274 1.00 0.00 H new ATOM 0 HG2 LYS A 27 18.705 -1.997 4.842 1.00 0.00 H new ATOM 0 HG3 LYS A 27 18.120 -0.346 4.894 1.00 0.00 H new ATOM 0 HD2 LYS A 27 20.414 0.423 5.608 1.00 0.00 H new ATOM 0 HD3 LYS A 27 20.988 -1.228 5.495 1.00 0.00 H new ATOM 0 HE2 LYS A 27 20.315 -1.249 3.050 1.00 0.00 H new ATOM 0 HE3 LYS A 27 19.865 0.439 3.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 22.042 0.456 2.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 22.220 0.792 4.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 22.558 -0.763 3.458 1.00 0.00 H new ATOM 457 N GLU A 28 16.828 -1.185 9.567 1.00 0.00 N ATOM 458 CA GLU A 28 16.662 -1.452 11.009 1.00 0.00 C ATOM 459 C GLU A 28 15.541 -2.458 11.300 1.00 0.00 C ATOM 460 O GLU A 28 15.734 -3.394 12.078 1.00 0.00 O ATOM 461 CB GLU A 28 16.534 -0.152 11.846 1.00 0.00 C ATOM 462 CG GLU A 28 15.164 0.243 12.449 1.00 0.00 C ATOM 463 CD GLU A 28 15.334 1.417 13.433 1.00 0.00 C ATOM 464 OE1 GLU A 28 15.328 2.593 12.994 1.00 0.00 O ATOM 465 OE2 GLU A 28 15.471 1.174 14.657 1.00 0.00 O ATOM 0 H GLU A 28 16.686 -0.207 9.316 1.00 0.00 H new ATOM 0 HA GLU A 28 17.585 -1.930 11.336 1.00 0.00 H new ATOM 0 HB2 GLU A 28 17.243 -0.225 12.670 1.00 0.00 H new ATOM 0 HB3 GLU A 28 16.862 0.674 11.215 1.00 0.00 H new ATOM 0 HG2 GLU A 28 14.475 0.524 11.652 1.00 0.00 H new ATOM 0 HG3 GLU A 28 14.725 -0.612 12.964 1.00 0.00 H new ATOM 472 N LYS A 29 14.374 -2.303 10.663 1.00 0.00 N ATOM 473 CA LYS A 29 13.237 -3.209 10.829 1.00 0.00 C ATOM 474 C LYS A 29 13.508 -4.596 10.233 1.00 0.00 C ATOM 475 O LYS A 29 13.153 -5.596 10.855 1.00 0.00 O ATOM 476 CB LYS A 29 11.991 -2.514 10.261 1.00 0.00 C ATOM 477 CG LYS A 29 10.667 -3.145 10.704 1.00 0.00 C ATOM 478 CD LYS A 29 10.437 -3.109 12.227 1.00 0.00 C ATOM 479 CE LYS A 29 9.031 -3.577 12.631 1.00 0.00 C ATOM 480 NZ LYS A 29 7.992 -2.543 12.387 1.00 0.00 N ATOM 0 H LYS A 29 14.193 -1.538 10.013 1.00 0.00 H new ATOM 0 HA LYS A 29 13.064 -3.412 11.886 1.00 0.00 H new ATOM 0 HB2 LYS A 29 12.002 -1.467 10.564 1.00 0.00 H new ATOM 0 HB3 LYS A 29 12.043 -2.531 9.172 1.00 0.00 H new ATOM 0 HG2 LYS A 29 9.845 -2.626 10.210 1.00 0.00 H new ATOM 0 HG3 LYS A 29 10.639 -4.181 10.367 1.00 0.00 H new ATOM 0 HD2 LYS A 29 11.179 -3.740 12.716 1.00 0.00 H new ATOM 0 HD3 LYS A 29 10.594 -2.093 12.589 1.00 0.00 H new ATOM 0 HE2 LYS A 29 8.778 -4.479 12.074 1.00 0.00 H new ATOM 0 HE3 LYS A 29 9.031 -3.845 13.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 7.093 -2.846 12.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.291 -1.643 12.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 7.863 -2.415 11.363 1.00 0.00 H new ATOM 494 N ILE A 30 14.205 -4.671 9.094 1.00 0.00 N ATOM 495 CA ILE A 30 14.725 -5.925 8.517 1.00 0.00 C ATOM 496 C ILE A 30 15.683 -6.616 9.500 1.00 0.00 C ATOM 497 O ILE A 30 15.501 -7.791 9.806 1.00 0.00 O ATOM 498 CB ILE A 30 15.403 -5.670 7.150 1.00 0.00 C ATOM 499 CG1 ILE A 30 14.356 -5.236 6.104 1.00 0.00 C ATOM 500 CG2 ILE A 30 16.124 -6.937 6.641 1.00 0.00 C ATOM 501 CD1 ILE A 30 14.952 -4.546 4.870 1.00 0.00 C ATOM 0 H ILE A 30 14.430 -3.849 8.534 1.00 0.00 H new ATOM 0 HA ILE A 30 13.884 -6.596 8.342 1.00 0.00 H new ATOM 0 HB ILE A 30 16.136 -4.876 7.290 1.00 0.00 H new ATOM 0 HG12 ILE A 30 13.795 -6.113 5.781 1.00 0.00 H new ATOM 0 HG13 ILE A 30 13.644 -4.559 6.577 1.00 0.00 H new ATOM 0 HG21 ILE A 30 16.591 -6.728 5.679 1.00 0.00 H new ATOM 0 HG22 ILE A 30 16.889 -7.234 7.359 1.00 0.00 H new ATOM 0 HG23 ILE A 30 15.402 -7.745 6.526 1.00 0.00 H new ATOM 0 HD11 ILE A 30 14.151 -4.272 4.184 1.00 0.00 H new ATOM 0 HD12 ILE A 30 15.488 -3.648 5.178 1.00 0.00 H new ATOM 0 HD13 ILE A 30 15.641 -5.226 4.370 1.00 0.00 H new ATOM 513 N GLU A 31 16.681 -5.895 10.018 1.00 0.00 N ATOM 514 CA GLU A 31 17.645 -6.398 11.007 1.00 0.00 C ATOM 515 C GLU A 31 16.938 -6.940 12.263 1.00 0.00 C ATOM 516 O GLU A 31 17.223 -8.055 12.700 1.00 0.00 O ATOM 517 CB GLU A 31 18.654 -5.283 11.335 1.00 0.00 C ATOM 518 CG GLU A 31 19.744 -5.708 12.328 1.00 0.00 C ATOM 519 CD GLU A 31 19.501 -5.143 13.744 1.00 0.00 C ATOM 520 OE1 GLU A 31 19.905 -3.986 14.011 1.00 0.00 O ATOM 521 OE2 GLU A 31 18.931 -5.854 14.605 1.00 0.00 O ATOM 0 H GLU A 31 16.847 -4.923 9.757 1.00 0.00 H new ATOM 0 HA GLU A 31 18.189 -7.244 10.586 1.00 0.00 H new ATOM 0 HB2 GLU A 31 19.127 -4.950 10.411 1.00 0.00 H new ATOM 0 HB3 GLU A 31 18.116 -4.428 11.744 1.00 0.00 H new ATOM 0 HG2 GLU A 31 19.784 -6.796 12.376 1.00 0.00 H new ATOM 0 HG3 GLU A 31 20.714 -5.369 11.966 1.00 0.00 H new ATOM 528 N SER A 32 15.969 -6.190 12.798 1.00 0.00 N ATOM 529 CA SER A 32 15.135 -6.583 13.941 1.00 0.00 C ATOM 530 C SER A 32 14.343 -7.877 13.684 1.00 0.00 C ATOM 531 O SER A 32 14.369 -8.798 14.505 1.00 0.00 O ATOM 532 CB SER A 32 14.190 -5.429 14.300 1.00 0.00 C ATOM 533 OG SER A 32 13.486 -5.710 15.500 1.00 0.00 O ATOM 0 H SER A 32 15.736 -5.265 12.438 1.00 0.00 H new ATOM 0 HA SER A 32 15.798 -6.794 14.780 1.00 0.00 H new ATOM 0 HB2 SER A 32 14.761 -4.508 14.415 1.00 0.00 H new ATOM 0 HB3 SER A 32 13.482 -5.266 13.487 1.00 0.00 H new ATOM 0 HG SER A 32 12.890 -4.962 15.713 1.00 0.00 H new ATOM 539 N GLU A 33 13.650 -7.976 12.544 1.00 0.00 N ATOM 540 CA GLU A 33 12.831 -9.136 12.163 1.00 0.00 C ATOM 541 C GLU A 33 13.675 -10.388 11.855 1.00 0.00 C ATOM 542 O GLU A 33 13.482 -11.443 12.466 1.00 0.00 O ATOM 543 CB GLU A 33 11.960 -8.757 10.951 1.00 0.00 C ATOM 544 CG GLU A 33 10.895 -9.802 10.587 1.00 0.00 C ATOM 545 CD GLU A 33 9.804 -9.923 11.670 1.00 0.00 C ATOM 546 OE1 GLU A 33 8.867 -9.088 11.694 1.00 0.00 O ATOM 547 OE2 GLU A 33 9.868 -10.860 12.503 1.00 0.00 O ATOM 0 H GLU A 33 13.642 -7.235 11.843 1.00 0.00 H new ATOM 0 HA GLU A 33 12.201 -9.396 13.014 1.00 0.00 H new ATOM 0 HB2 GLU A 33 11.465 -7.808 11.156 1.00 0.00 H new ATOM 0 HB3 GLU A 33 12.607 -8.599 10.088 1.00 0.00 H new ATOM 0 HG2 GLU A 33 10.433 -9.532 9.637 1.00 0.00 H new ATOM 0 HG3 GLU A 33 11.373 -10.771 10.445 1.00 0.00 H new ATOM 554 N LYS A 34 14.597 -10.291 10.886 1.00 0.00 N ATOM 555 CA LYS A 34 15.384 -11.419 10.352 1.00 0.00 C ATOM 556 C LYS A 34 16.556 -11.840 11.251 1.00 0.00 C ATOM 557 O LYS A 34 17.068 -12.953 11.118 1.00 0.00 O ATOM 558 CB LYS A 34 15.916 -11.063 8.950 1.00 0.00 C ATOM 559 CG LYS A 34 14.853 -10.614 7.927 1.00 0.00 C ATOM 560 CD LYS A 34 13.704 -11.611 7.717 1.00 0.00 C ATOM 561 CE LYS A 34 14.200 -12.940 7.129 1.00 0.00 C ATOM 562 NZ LYS A 34 13.076 -13.875 6.862 1.00 0.00 N ATOM 0 H LYS A 34 14.824 -9.403 10.438 1.00 0.00 H new ATOM 0 HA LYS A 34 14.705 -12.271 10.308 1.00 0.00 H new ATOM 0 HB2 LYS A 34 16.654 -10.268 9.053 1.00 0.00 H new ATOM 0 HB3 LYS A 34 16.437 -11.932 8.548 1.00 0.00 H new ATOM 0 HG2 LYS A 34 14.435 -9.661 8.252 1.00 0.00 H new ATOM 0 HG3 LYS A 34 15.342 -10.437 6.969 1.00 0.00 H new ATOM 0 HD2 LYS A 34 13.207 -11.798 8.669 1.00 0.00 H new ATOM 0 HD3 LYS A 34 12.961 -11.174 7.050 1.00 0.00 H new ATOM 0 HE2 LYS A 34 14.742 -12.749 6.203 1.00 0.00 H new ATOM 0 HE3 LYS A 34 14.903 -13.404 7.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 13.251 -14.777 7.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 12.189 -13.460 7.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 13.000 -14.044 5.839 1.00 0.00 H new ATOM 576 N GLY A 35 16.969 -10.957 12.158 1.00 0.00 N ATOM 577 CA GLY A 35 18.161 -11.064 13.005 1.00 0.00 C ATOM 578 C GLY A 35 19.410 -10.494 12.320 1.00 0.00 C ATOM 579 O GLY A 35 19.645 -10.734 11.130 1.00 0.00 O ATOM 0 H GLY A 35 16.452 -10.096 12.334 1.00 0.00 H new ATOM 0 HA2 GLY A 35 17.988 -10.534 13.942 1.00 0.00 H new ATOM 0 HA3 GLY A 35 18.333 -12.110 13.258 1.00 0.00 H new ATOM 583 N LYS A 36 20.253 -9.772 13.073 1.00 0.00 N ATOM 584 CA LYS A 36 21.477 -9.132 12.548 1.00 0.00 C ATOM 585 C LYS A 36 22.560 -10.123 12.097 1.00 0.00 C ATOM 586 O LYS A 36 23.449 -9.748 11.341 1.00 0.00 O ATOM 587 CB LYS A 36 22.005 -8.076 13.546 1.00 0.00 C ATOM 588 CG LYS A 36 23.095 -8.582 14.497 1.00 0.00 C ATOM 589 CD LYS A 36 23.408 -7.555 15.594 1.00 0.00 C ATOM 590 CE LYS A 36 24.526 -8.084 16.501 1.00 0.00 C ATOM 591 NZ LYS A 36 24.861 -7.118 17.579 1.00 0.00 N ATOM 0 H LYS A 36 20.107 -9.612 14.070 1.00 0.00 H new ATOM 0 HA LYS A 36 21.193 -8.618 11.629 1.00 0.00 H new ATOM 0 HB2 LYS A 36 22.397 -7.229 12.984 1.00 0.00 H new ATOM 0 HB3 LYS A 36 21.168 -7.706 14.138 1.00 0.00 H new ATOM 0 HG2 LYS A 36 22.774 -9.518 14.955 1.00 0.00 H new ATOM 0 HG3 LYS A 36 24.001 -8.798 13.931 1.00 0.00 H new ATOM 0 HD2 LYS A 36 23.710 -6.610 15.144 1.00 0.00 H new ATOM 0 HD3 LYS A 36 22.513 -7.356 16.184 1.00 0.00 H new ATOM 0 HE2 LYS A 36 24.218 -9.031 16.944 1.00 0.00 H new ATOM 0 HE3 LYS A 36 25.415 -8.285 15.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 25.620 -7.509 18.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 25.179 -6.222 17.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 24.019 -6.945 18.164 1.00 0.00 H new ATOM 605 N ASP A 37 22.485 -11.388 12.515 1.00 0.00 N ATOM 606 CA ASP A 37 23.332 -12.465 11.983 1.00 0.00 C ATOM 607 C ASP A 37 23.080 -12.686 10.482 1.00 0.00 C ATOM 608 O ASP A 37 24.018 -12.838 9.696 1.00 0.00 O ATOM 609 CB ASP A 37 23.038 -13.768 12.733 1.00 0.00 C ATOM 610 CG ASP A 37 24.053 -14.867 12.375 1.00 0.00 C ATOM 611 OD1 ASP A 37 25.225 -14.775 12.815 1.00 0.00 O ATOM 612 OD2 ASP A 37 23.681 -15.833 11.666 1.00 0.00 O ATOM 0 H ASP A 37 21.833 -11.699 13.235 1.00 0.00 H new ATOM 0 HA ASP A 37 24.373 -12.173 12.122 1.00 0.00 H new ATOM 0 HB2 ASP A 37 23.063 -13.584 13.807 1.00 0.00 H new ATOM 0 HB3 ASP A 37 22.031 -14.109 12.491 1.00 0.00 H new ATOM 617 N ALA A 38 21.800 -12.694 10.094 1.00 0.00 N ATOM 618 CA ALA A 38 21.354 -12.901 8.724 1.00 0.00 C ATOM 619 C ALA A 38 21.427 -11.606 7.888 1.00 0.00 C ATOM 620 O ALA A 38 21.928 -11.627 6.763 1.00 0.00 O ATOM 621 CB ALA A 38 19.932 -13.475 8.760 1.00 0.00 C ATOM 0 H ALA A 38 21.029 -12.552 10.747 1.00 0.00 H new ATOM 0 HA ALA A 38 22.022 -13.608 8.232 1.00 0.00 H new ATOM 0 HB1 ALA A 38 19.579 -13.637 7.742 1.00 0.00 H new ATOM 0 HB2 ALA A 38 19.936 -14.423 9.298 1.00 0.00 H new ATOM 0 HB3 ALA A 38 19.269 -12.773 9.266 1.00 0.00 H new ATOM 627 N PHE A 39 20.939 -10.484 8.436 1.00 0.00 N ATOM 628 CA PHE A 39 20.835 -9.180 7.763 1.00 0.00 C ATOM 629 C PHE A 39 21.249 -8.013 8.694 1.00 0.00 C ATOM 630 O PHE A 39 20.386 -7.272 9.175 1.00 0.00 O ATOM 631 CB PHE A 39 19.404 -9.001 7.216 1.00 0.00 C ATOM 632 CG PHE A 39 19.022 -9.919 6.065 1.00 0.00 C ATOM 633 CD1 PHE A 39 18.447 -11.177 6.325 1.00 0.00 C ATOM 634 CD2 PHE A 39 19.219 -9.513 4.730 1.00 0.00 C ATOM 635 CE1 PHE A 39 18.073 -12.023 5.265 1.00 0.00 C ATOM 636 CE2 PHE A 39 18.846 -10.357 3.668 1.00 0.00 C ATOM 637 CZ PHE A 39 18.271 -11.612 3.935 1.00 0.00 C ATOM 0 H PHE A 39 20.593 -10.458 9.395 1.00 0.00 H new ATOM 0 HA PHE A 39 21.535 -9.160 6.928 1.00 0.00 H new ATOM 0 HB2 PHE A 39 18.699 -9.159 8.033 1.00 0.00 H new ATOM 0 HB3 PHE A 39 19.286 -7.968 6.888 1.00 0.00 H new ATOM 0 HD1 PHE A 39 18.292 -11.495 7.345 1.00 0.00 H new ATOM 0 HD2 PHE A 39 19.659 -8.549 4.521 1.00 0.00 H new ATOM 0 HE1 PHE A 39 17.634 -12.988 5.473 1.00 0.00 H new ATOM 0 HE2 PHE A 39 19.001 -10.041 2.647 1.00 0.00 H new ATOM 0 HZ PHE A 39 17.982 -12.259 3.120 1.00 0.00 H new ATOM 647 N PRO A 40 22.553 -7.789 8.946 1.00 0.00 N ATOM 648 CA PRO A 40 23.021 -6.640 9.727 1.00 0.00 C ATOM 649 C PRO A 40 22.826 -5.341 8.924 1.00 0.00 C ATOM 650 O PRO A 40 23.068 -5.324 7.716 1.00 0.00 O ATOM 651 CB PRO A 40 24.508 -6.910 9.987 1.00 0.00 C ATOM 652 CG PRO A 40 24.942 -7.769 8.798 1.00 0.00 C ATOM 653 CD PRO A 40 23.680 -8.542 8.409 1.00 0.00 C ATOM 0 HA PRO A 40 22.469 -6.518 10.659 1.00 0.00 H new ATOM 0 HB2 PRO A 40 25.079 -5.983 10.039 1.00 0.00 H new ATOM 0 HB3 PRO A 40 24.660 -7.431 10.932 1.00 0.00 H new ATOM 0 HG2 PRO A 40 25.302 -7.154 7.973 1.00 0.00 H new ATOM 0 HG3 PRO A 40 25.754 -8.444 9.070 1.00 0.00 H new ATOM 0 HD2 PRO A 40 23.602 -8.638 7.326 1.00 0.00 H new ATOM 0 HD3 PRO A 40 23.702 -9.552 8.818 1.00 0.00 H new ATOM 661 N VAL A 41 22.447 -4.231 9.571 1.00 0.00 N ATOM 662 CA VAL A 41 22.213 -2.924 8.904 1.00 0.00 C ATOM 663 C VAL A 41 23.400 -2.503 8.033 1.00 0.00 C ATOM 664 O VAL A 41 23.225 -2.109 6.880 1.00 0.00 O ATOM 665 CB VAL A 41 21.905 -1.812 9.932 1.00 0.00 C ATOM 666 CG1 VAL A 41 21.770 -0.424 9.287 1.00 0.00 C ATOM 667 CG2 VAL A 41 20.606 -2.119 10.679 1.00 0.00 C ATOM 0 H VAL A 41 22.291 -4.205 10.579 1.00 0.00 H new ATOM 0 HA VAL A 41 21.345 -3.060 8.259 1.00 0.00 H new ATOM 0 HB VAL A 41 22.752 -1.793 10.617 1.00 0.00 H new ATOM 0 HG11 VAL A 41 21.554 0.316 10.058 1.00 0.00 H new ATOM 0 HG12 VAL A 41 22.702 -0.164 8.785 1.00 0.00 H new ATOM 0 HG13 VAL A 41 20.958 -0.438 8.560 1.00 0.00 H new ATOM 0 HG21 VAL A 41 20.404 -1.326 11.399 1.00 0.00 H new ATOM 0 HG22 VAL A 41 19.783 -2.181 9.967 1.00 0.00 H new ATOM 0 HG23 VAL A 41 20.704 -3.069 11.204 1.00 0.00 H new ATOM 677 N ALA A 42 24.613 -2.619 8.578 1.00 0.00 N ATOM 678 CA ALA A 42 25.857 -2.242 7.906 1.00 0.00 C ATOM 679 C ALA A 42 26.230 -3.127 6.688 1.00 0.00 C ATOM 680 O ALA A 42 27.044 -2.711 5.860 1.00 0.00 O ATOM 681 CB ALA A 42 26.978 -2.254 8.955 1.00 0.00 C ATOM 0 H ALA A 42 24.760 -2.985 9.518 1.00 0.00 H new ATOM 0 HA ALA A 42 25.714 -1.248 7.481 1.00 0.00 H new ATOM 0 HB1 ALA A 42 27.921 -1.976 8.483 1.00 0.00 H new ATOM 0 HB2 ALA A 42 26.744 -1.541 9.746 1.00 0.00 H new ATOM 0 HB3 ALA A 42 27.066 -3.253 9.382 1.00 0.00 H new ATOM 687 N GLY A 43 25.642 -4.326 6.558 1.00 0.00 N ATOM 688 CA GLY A 43 25.852 -5.261 5.439 1.00 0.00 C ATOM 689 C GLY A 43 24.717 -5.270 4.408 1.00 0.00 C ATOM 690 O GLY A 43 24.949 -5.586 3.239 1.00 0.00 O ATOM 0 H GLY A 43 24.985 -4.684 7.251 1.00 0.00 H new ATOM 0 HA2 GLY A 43 26.784 -5.004 4.935 1.00 0.00 H new ATOM 0 HA3 GLY A 43 25.973 -6.268 5.839 1.00 0.00 H new ATOM 694 N GLN A 44 23.496 -4.916 4.814 1.00 0.00 N ATOM 695 CA GLN A 44 22.333 -4.784 3.933 1.00 0.00 C ATOM 696 C GLN A 44 22.503 -3.690 2.860 1.00 0.00 C ATOM 697 O GLN A 44 22.987 -2.589 3.143 1.00 0.00 O ATOM 698 CB GLN A 44 21.094 -4.421 4.763 1.00 0.00 C ATOM 699 CG GLN A 44 20.454 -5.582 5.534 1.00 0.00 C ATOM 700 CD GLN A 44 19.228 -5.070 6.284 1.00 0.00 C ATOM 701 OE1 GLN A 44 18.297 -4.552 5.691 1.00 0.00 O ATOM 702 NE2 GLN A 44 19.173 -5.155 7.594 1.00 0.00 N ATOM 0 H GLN A 44 23.283 -4.708 5.790 1.00 0.00 H new ATOM 0 HA GLN A 44 22.224 -5.746 3.432 1.00 0.00 H new ATOM 0 HB2 GLN A 44 21.370 -3.643 5.475 1.00 0.00 H new ATOM 0 HB3 GLN A 44 20.345 -3.993 4.097 1.00 0.00 H new ATOM 0 HG2 GLN A 44 20.168 -6.378 4.846 1.00 0.00 H new ATOM 0 HG3 GLN A 44 21.172 -6.009 6.234 1.00 0.00 H new ATOM 0 HE21 GLN A 44 19.941 -5.585 8.110 1.00 0.00 H new ATOM 0 HE22 GLN A 44 18.362 -4.791 8.095 1.00 0.00 H new ATOM 711 N LYS A 45 22.002 -3.962 1.650 1.00 0.00 N ATOM 712 CA LYS A 45 21.819 -3.012 0.537 1.00 0.00 C ATOM 713 C LYS A 45 20.382 -3.157 0.022 1.00 0.00 C ATOM 714 O LYS A 45 19.834 -4.261 -0.016 1.00 0.00 O ATOM 715 CB LYS A 45 22.876 -3.159 -0.576 1.00 0.00 C ATOM 716 CG LYS A 45 24.310 -2.985 -0.049 1.00 0.00 C ATOM 717 CD LYS A 45 25.335 -2.746 -1.168 1.00 0.00 C ATOM 718 CE LYS A 45 26.686 -2.397 -0.526 1.00 0.00 C ATOM 719 NZ LYS A 45 27.743 -2.097 -1.525 1.00 0.00 N ATOM 0 H LYS A 45 21.695 -4.903 1.403 1.00 0.00 H new ATOM 0 HA LYS A 45 21.974 -1.998 0.905 1.00 0.00 H new ATOM 0 HB2 LYS A 45 22.778 -4.141 -1.039 1.00 0.00 H new ATOM 0 HB3 LYS A 45 22.686 -2.420 -1.354 1.00 0.00 H new ATOM 0 HG2 LYS A 45 24.337 -2.146 0.646 1.00 0.00 H new ATOM 0 HG3 LYS A 45 24.595 -3.874 0.514 1.00 0.00 H new ATOM 0 HD2 LYS A 45 25.430 -3.636 -1.791 1.00 0.00 H new ATOM 0 HD3 LYS A 45 25.004 -1.936 -1.818 1.00 0.00 H new ATOM 0 HE2 LYS A 45 26.559 -1.536 0.130 1.00 0.00 H new ATOM 0 HE3 LYS A 45 27.010 -3.229 0.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 28.446 -1.456 -1.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 28.209 -2.981 -1.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 27.315 -1.643 -2.357 1.00 0.00 H new ATOM 733 N LEU A 46 19.775 -2.029 -0.337 1.00 0.00 N ATOM 734 CA LEU A 46 18.353 -1.873 -0.645 1.00 0.00 C ATOM 735 C LEU A 46 18.171 -1.249 -2.032 1.00 0.00 C ATOM 736 O LEU A 46 18.764 -0.210 -2.309 1.00 0.00 O ATOM 737 CB LEU A 46 17.736 -0.986 0.466 1.00 0.00 C ATOM 738 CG LEU A 46 16.731 -1.675 1.398 1.00 0.00 C ATOM 739 CD1 LEU A 46 15.506 -2.108 0.606 1.00 0.00 C ATOM 740 CD2 LEU A 46 17.325 -2.883 2.120 1.00 0.00 C ATOM 0 H LEU A 46 20.288 -1.152 -0.426 1.00 0.00 H new ATOM 0 HA LEU A 46 17.850 -2.839 -0.669 1.00 0.00 H new ATOM 0 HB2 LEU A 46 18.547 -0.583 1.073 1.00 0.00 H new ATOM 0 HB3 LEU A 46 17.240 -0.138 -0.007 1.00 0.00 H new ATOM 0 HG LEU A 46 16.453 -0.947 2.160 1.00 0.00 H new ATOM 0 HD11 LEU A 46 14.796 -2.597 1.273 1.00 0.00 H new ATOM 0 HD12 LEU A 46 15.037 -1.234 0.154 1.00 0.00 H new ATOM 0 HD13 LEU A 46 15.806 -2.804 -0.177 1.00 0.00 H new ATOM 0 HD21 LEU A 46 16.568 -3.330 2.765 1.00 0.00 H new ATOM 0 HD22 LEU A 46 17.657 -3.618 1.387 1.00 0.00 H new ATOM 0 HD23 LEU A 46 18.174 -2.564 2.724 1.00 0.00 H new ATOM 752 N ILE A 47 17.377 -1.870 -2.907 1.00 0.00 N ATOM 753 CA ILE A 47 17.265 -1.523 -4.334 1.00 0.00 C ATOM 754 C ILE A 47 15.793 -1.453 -4.776 1.00 0.00 C ATOM 755 O ILE A 47 15.045 -2.418 -4.597 1.00 0.00 O ATOM 756 CB ILE A 47 18.099 -2.533 -5.162 1.00 0.00 C ATOM 757 CG1 ILE A 47 19.614 -2.461 -4.829 1.00 0.00 C ATOM 758 CG2 ILE A 47 17.974 -2.328 -6.674 1.00 0.00 C ATOM 759 CD1 ILE A 47 20.075 -3.617 -3.949 1.00 0.00 C ATOM 0 H ILE A 47 16.776 -2.650 -2.640 1.00 0.00 H new ATOM 0 HA ILE A 47 17.670 -0.526 -4.508 1.00 0.00 H new ATOM 0 HB ILE A 47 17.685 -3.502 -4.884 1.00 0.00 H new ATOM 0 HG12 ILE A 47 20.187 -2.464 -5.756 1.00 0.00 H new ATOM 0 HG13 ILE A 47 19.827 -1.518 -4.326 1.00 0.00 H new ATOM 0 HG21 ILE A 47 18.583 -3.068 -7.193 1.00 0.00 H new ATOM 0 HG22 ILE A 47 16.932 -2.442 -6.972 1.00 0.00 H new ATOM 0 HG23 ILE A 47 18.318 -1.327 -6.935 1.00 0.00 H new ATOM 0 HD11 ILE A 47 21.141 -3.518 -3.747 1.00 0.00 H new ATOM 0 HD12 ILE A 47 19.524 -3.600 -3.008 1.00 0.00 H new ATOM 0 HD13 ILE A 47 19.889 -4.561 -4.462 1.00 0.00 H new ATOM 771 N TYR A 48 15.386 -0.322 -5.370 1.00 0.00 N ATOM 772 CA TYR A 48 14.078 -0.132 -6.017 1.00 0.00 C ATOM 773 C TYR A 48 14.216 0.476 -7.417 1.00 0.00 C ATOM 774 O TYR A 48 15.109 1.288 -7.654 1.00 0.00 O ATOM 775 CB TYR A 48 13.151 0.735 -5.154 1.00 0.00 C ATOM 776 CG TYR A 48 11.682 0.712 -5.555 1.00 0.00 C ATOM 777 CD1 TYR A 48 10.965 -0.503 -5.567 1.00 0.00 C ATOM 778 CD2 TYR A 48 11.016 1.911 -5.878 1.00 0.00 C ATOM 779 CE1 TYR A 48 9.588 -0.514 -5.858 1.00 0.00 C ATOM 780 CE2 TYR A 48 9.638 1.903 -6.176 1.00 0.00 C ATOM 781 CZ TYR A 48 8.916 0.690 -6.154 1.00 0.00 C ATOM 782 OH TYR A 48 7.576 0.674 -6.397 1.00 0.00 O ATOM 0 H TYR A 48 15.974 0.510 -5.415 1.00 0.00 H new ATOM 0 HA TYR A 48 13.632 -1.121 -6.122 1.00 0.00 H new ATOM 0 HB2 TYR A 48 13.233 0.407 -4.118 1.00 0.00 H new ATOM 0 HB3 TYR A 48 13.505 1.765 -5.191 1.00 0.00 H new ATOM 0 HD1 TYR A 48 11.476 -1.430 -5.352 1.00 0.00 H new ATOM 0 HD2 TYR A 48 11.564 2.841 -5.897 1.00 0.00 H new ATOM 0 HE1 TYR A 48 9.044 -1.447 -5.855 1.00 0.00 H new ATOM 0 HE2 TYR A 48 9.134 2.826 -6.421 1.00 0.00 H new ATOM 0 HH TYR A 48 7.266 1.585 -6.583 1.00 0.00 H new ATOM 792 N ALA A 49 13.331 0.103 -8.349 1.00 0.00 N ATOM 793 CA ALA A 49 13.364 0.529 -9.753 1.00 0.00 C ATOM 794 C ALA A 49 14.740 0.346 -10.443 1.00 0.00 C ATOM 795 O ALA A 49 15.106 1.100 -11.347 1.00 0.00 O ATOM 796 CB ALA A 49 12.804 1.958 -9.800 1.00 0.00 C ATOM 0 H ALA A 49 12.551 -0.521 -8.142 1.00 0.00 H new ATOM 0 HA ALA A 49 12.736 -0.126 -10.356 1.00 0.00 H new ATOM 0 HB1 ALA A 49 12.810 2.317 -10.829 1.00 0.00 H new ATOM 0 HB2 ALA A 49 11.782 1.961 -9.420 1.00 0.00 H new ATOM 0 HB3 ALA A 49 13.422 2.611 -9.184 1.00 0.00 H new ATOM 802 N GLY A 50 15.516 -0.654 -10.005 1.00 0.00 N ATOM 803 CA GLY A 50 16.883 -0.924 -10.468 1.00 0.00 C ATOM 804 C GLY A 50 17.961 0.030 -9.922 1.00 0.00 C ATOM 805 O GLY A 50 19.073 0.044 -10.450 1.00 0.00 O ATOM 0 H GLY A 50 15.200 -1.317 -9.297 1.00 0.00 H new ATOM 0 HA2 GLY A 50 17.149 -1.944 -10.190 1.00 0.00 H new ATOM 0 HA3 GLY A 50 16.897 -0.877 -11.557 1.00 0.00 H new ATOM 809 N LYS A 51 17.657 0.836 -8.893 1.00 0.00 N ATOM 810 CA LYS A 51 18.528 1.864 -8.287 1.00 0.00 C ATOM 811 C LYS A 51 18.667 1.651 -6.776 1.00 0.00 C ATOM 812 O LYS A 51 17.675 1.424 -6.082 1.00 0.00 O ATOM 813 CB LYS A 51 17.944 3.265 -8.556 1.00 0.00 C ATOM 814 CG LYS A 51 17.909 3.628 -10.052 1.00 0.00 C ATOM 815 CD LYS A 51 17.248 4.988 -10.324 1.00 0.00 C ATOM 816 CE LYS A 51 18.072 6.161 -9.774 1.00 0.00 C ATOM 817 NZ LYS A 51 17.447 7.469 -10.103 1.00 0.00 N ATOM 0 H LYS A 51 16.748 0.788 -8.434 1.00 0.00 H new ATOM 0 HA LYS A 51 19.516 1.781 -8.739 1.00 0.00 H new ATOM 0 HB2 LYS A 51 16.933 3.314 -8.153 1.00 0.00 H new ATOM 0 HB3 LYS A 51 18.537 4.008 -8.022 1.00 0.00 H new ATOM 0 HG2 LYS A 51 18.927 3.641 -10.441 1.00 0.00 H new ATOM 0 HG3 LYS A 51 17.369 2.853 -10.596 1.00 0.00 H new ATOM 0 HD2 LYS A 51 17.113 5.115 -11.398 1.00 0.00 H new ATOM 0 HD3 LYS A 51 16.255 5.003 -9.874 1.00 0.00 H new ATOM 0 HE2 LYS A 51 18.167 6.064 -8.693 1.00 0.00 H new ATOM 0 HE3 LYS A 51 19.080 6.124 -10.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 18.029 8.239 -9.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 17.379 7.571 -11.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 16.495 7.513 -9.687 1.00 0.00 H new ATOM 831 N ILE A 52 19.891 1.721 -6.251 1.00 0.00 N ATOM 832 CA ILE A 52 20.153 1.585 -4.812 1.00 0.00 C ATOM 833 C ILE A 52 19.616 2.794 -4.036 1.00 0.00 C ATOM 834 O ILE A 52 19.924 3.948 -4.341 1.00 0.00 O ATOM 835 CB ILE A 52 21.649 1.341 -4.531 1.00 0.00 C ATOM 836 CG1 ILE A 52 22.176 0.271 -5.515 1.00 0.00 C ATOM 837 CG2 ILE A 52 21.850 0.950 -3.055 1.00 0.00 C ATOM 838 CD1 ILE A 52 23.277 -0.644 -5.005 1.00 0.00 C ATOM 0 H ILE A 52 20.731 1.874 -6.809 1.00 0.00 H new ATOM 0 HA ILE A 52 19.615 0.706 -4.457 1.00 0.00 H new ATOM 0 HB ILE A 52 22.226 2.252 -4.693 1.00 0.00 H new ATOM 0 HG12 ILE A 52 21.335 -0.349 -5.825 1.00 0.00 H new ATOM 0 HG13 ILE A 52 22.543 0.780 -6.406 1.00 0.00 H new ATOM 0 HG21 ILE A 52 22.910 0.779 -2.865 1.00 0.00 H new ATOM 0 HG22 ILE A 52 21.491 1.755 -2.413 1.00 0.00 H new ATOM 0 HG23 ILE A 52 21.292 0.039 -2.841 1.00 0.00 H new ATOM 0 HD11 ILE A 52 23.558 -1.348 -5.789 1.00 0.00 H new ATOM 0 HD12 ILE A 52 24.145 -0.047 -4.725 1.00 0.00 H new ATOM 0 HD13 ILE A 52 22.919 -1.194 -4.135 1.00 0.00 H new ATOM 850 N LEU A 53 18.802 2.504 -3.026 1.00 0.00 N ATOM 851 CA LEU A 53 18.232 3.442 -2.070 1.00 0.00 C ATOM 852 C LEU A 53 19.323 3.999 -1.136 1.00 0.00 C ATOM 853 O LEU A 53 19.993 3.245 -0.426 1.00 0.00 O ATOM 854 CB LEU A 53 17.141 2.718 -1.264 1.00 0.00 C ATOM 855 CG LEU A 53 16.017 2.036 -2.061 1.00 0.00 C ATOM 856 CD1 LEU A 53 14.912 1.587 -1.104 1.00 0.00 C ATOM 857 CD2 LEU A 53 15.389 2.996 -3.058 1.00 0.00 C ATOM 0 H LEU A 53 18.505 1.545 -2.843 1.00 0.00 H new ATOM 0 HA LEU A 53 17.794 4.287 -2.601 1.00 0.00 H new ATOM 0 HB2 LEU A 53 17.624 1.962 -0.645 1.00 0.00 H new ATOM 0 HB3 LEU A 53 16.685 3.440 -0.587 1.00 0.00 H new ATOM 0 HG LEU A 53 16.455 1.190 -2.590 1.00 0.00 H new ATOM 0 HD11 LEU A 53 14.115 1.104 -1.669 1.00 0.00 H new ATOM 0 HD12 LEU A 53 15.322 0.883 -0.380 1.00 0.00 H new ATOM 0 HD13 LEU A 53 14.510 2.454 -0.580 1.00 0.00 H new ATOM 0 HD21 LEU A 53 14.598 2.485 -3.606 1.00 0.00 H new ATOM 0 HD22 LEU A 53 14.969 3.850 -2.526 1.00 0.00 H new ATOM 0 HD23 LEU A 53 16.149 3.343 -3.758 1.00 0.00 H new ATOM 869 N ASN A 54 19.515 5.318 -1.142 1.00 0.00 N ATOM 870 CA ASN A 54 20.477 6.011 -0.277 1.00 0.00 C ATOM 871 C ASN A 54 20.035 5.980 1.201 1.00 0.00 C ATOM 872 O ASN A 54 18.936 6.424 1.530 1.00 0.00 O ATOM 873 CB ASN A 54 20.646 7.456 -0.772 1.00 0.00 C ATOM 874 CG ASN A 54 21.387 7.541 -2.096 1.00 0.00 C ATOM 875 OD1 ASN A 54 22.610 7.510 -2.150 1.00 0.00 O ATOM 876 ND2 ASN A 54 20.688 7.652 -3.204 1.00 0.00 N ATOM 0 H ASN A 54 18.999 5.948 -1.757 1.00 0.00 H new ATOM 0 HA ASN A 54 21.436 5.495 -0.330 1.00 0.00 H new ATOM 0 HB2 ASN A 54 19.664 7.916 -0.880 1.00 0.00 H new ATOM 0 HB3 ASN A 54 21.186 8.032 -0.021 1.00 0.00 H new ATOM 0 HD21 ASN A 54 21.165 7.712 -4.104 1.00 0.00 H new ATOM 0 HD22 ASN A 54 19.669 7.678 -3.164 1.00 0.00 H new ATOM 883 N ASP A 55 20.896 5.480 2.093 1.00 0.00 N ATOM 884 CA ASP A 55 20.624 5.214 3.520 1.00 0.00 C ATOM 885 C ASP A 55 19.976 6.389 4.277 1.00 0.00 C ATOM 886 O ASP A 55 18.974 6.210 4.971 1.00 0.00 O ATOM 887 CB ASP A 55 21.931 4.816 4.226 1.00 0.00 C ATOM 888 CG ASP A 55 22.381 3.396 3.868 1.00 0.00 C ATOM 889 OD1 ASP A 55 22.930 3.181 2.763 1.00 0.00 O ATOM 890 OD2 ASP A 55 22.176 2.474 4.690 1.00 0.00 O ATOM 0 H ASP A 55 21.851 5.236 1.832 1.00 0.00 H new ATOM 0 HA ASP A 55 19.896 4.403 3.539 1.00 0.00 H new ATOM 0 HB2 ASP A 55 22.716 5.522 3.955 1.00 0.00 H new ATOM 0 HB3 ASP A 55 21.795 4.890 5.305 1.00 0.00 H new ATOM 895 N ASP A 56 20.560 7.585 4.159 1.00 0.00 N ATOM 896 CA ASP A 56 20.122 8.811 4.843 1.00 0.00 C ATOM 897 C ASP A 56 18.868 9.462 4.215 1.00 0.00 C ATOM 898 O ASP A 56 18.232 10.319 4.834 1.00 0.00 O ATOM 899 CB ASP A 56 21.304 9.795 4.840 1.00 0.00 C ATOM 900 CG ASP A 56 21.052 11.044 5.704 1.00 0.00 C ATOM 901 OD1 ASP A 56 20.919 10.907 6.944 1.00 0.00 O ATOM 902 OD2 ASP A 56 21.039 12.172 5.154 1.00 0.00 O ATOM 0 H ASP A 56 21.377 7.734 3.567 1.00 0.00 H new ATOM 0 HA ASP A 56 19.825 8.547 5.858 1.00 0.00 H new ATOM 0 HB2 ASP A 56 22.196 9.284 5.203 1.00 0.00 H new ATOM 0 HB3 ASP A 56 21.509 10.105 3.815 1.00 0.00 H new ATOM 907 N THR A 57 18.492 9.067 2.996 1.00 0.00 N ATOM 908 CA THR A 57 17.332 9.595 2.260 1.00 0.00 C ATOM 909 C THR A 57 16.038 8.900 2.710 1.00 0.00 C ATOM 910 O THR A 57 16.047 7.742 3.137 1.00 0.00 O ATOM 911 CB THR A 57 17.570 9.434 0.747 1.00 0.00 C ATOM 912 OG1 THR A 57 18.797 10.038 0.382 1.00 0.00 O ATOM 913 CG2 THR A 57 16.510 10.101 -0.122 1.00 0.00 C ATOM 0 H THR A 57 18.998 8.351 2.476 1.00 0.00 H new ATOM 0 HA THR A 57 17.216 10.656 2.480 1.00 0.00 H new ATOM 0 HB THR A 57 17.551 8.358 0.575 1.00 0.00 H new ATOM 0 HG1 THR A 57 18.934 9.944 -0.584 1.00 0.00 H new ATOM 0 HG21 THR A 57 16.749 9.942 -1.174 1.00 0.00 H new ATOM 0 HG22 THR A 57 15.534 9.668 0.098 1.00 0.00 H new ATOM 0 HG23 THR A 57 16.488 11.170 0.088 1.00 0.00 H new ATOM 921 N ALA A 58 14.904 9.605 2.646 1.00 0.00 N ATOM 922 CA ALA A 58 13.609 9.074 3.075 1.00 0.00 C ATOM 923 C ALA A 58 12.971 8.097 2.070 1.00 0.00 C ATOM 924 O ALA A 58 13.223 8.171 0.868 1.00 0.00 O ATOM 925 CB ALA A 58 12.685 10.244 3.409 1.00 0.00 C ATOM 0 H ALA A 58 14.860 10.561 2.294 1.00 0.00 H new ATOM 0 HA ALA A 58 13.774 8.468 3.966 1.00 0.00 H new ATOM 0 HB1 ALA A 58 11.716 9.862 3.730 1.00 0.00 H new ATOM 0 HB2 ALA A 58 13.125 10.838 4.210 1.00 0.00 H new ATOM 0 HB3 ALA A 58 12.554 10.868 2.525 1.00 0.00 H new ATOM 931 N LEU A 59 12.091 7.208 2.548 1.00 0.00 N ATOM 932 CA LEU A 59 11.374 6.237 1.700 1.00 0.00 C ATOM 933 C LEU A 59 10.394 6.908 0.718 1.00 0.00 C ATOM 934 O LEU A 59 10.226 6.441 -0.413 1.00 0.00 O ATOM 935 CB LEU A 59 10.649 5.217 2.598 1.00 0.00 C ATOM 936 CG LEU A 59 11.602 4.323 3.416 1.00 0.00 C ATOM 937 CD1 LEU A 59 10.811 3.481 4.411 1.00 0.00 C ATOM 938 CD2 LEU A 59 12.371 3.347 2.528 1.00 0.00 C ATOM 0 H LEU A 59 11.853 7.139 3.537 1.00 0.00 H new ATOM 0 HA LEU A 59 12.111 5.725 1.082 1.00 0.00 H new ATOM 0 HB2 LEU A 59 9.991 5.752 3.282 1.00 0.00 H new ATOM 0 HB3 LEU A 59 10.016 4.584 1.976 1.00 0.00 H new ATOM 0 HG LEU A 59 12.297 4.994 3.920 1.00 0.00 H new ATOM 0 HD11 LEU A 59 11.496 2.854 4.982 1.00 0.00 H new ATOM 0 HD12 LEU A 59 10.267 4.137 5.091 1.00 0.00 H new ATOM 0 HD13 LEU A 59 10.105 2.849 3.872 1.00 0.00 H new ATOM 0 HD21 LEU A 59 13.031 2.736 3.145 1.00 0.00 H new ATOM 0 HD22 LEU A 59 11.667 2.702 2.001 1.00 0.00 H new ATOM 0 HD23 LEU A 59 12.965 3.905 1.804 1.00 0.00 H new ATOM 950 N LYS A 60 9.819 8.052 1.116 1.00 0.00 N ATOM 951 CA LYS A 60 8.993 8.956 0.293 1.00 0.00 C ATOM 952 C LYS A 60 9.632 9.291 -1.061 1.00 0.00 C ATOM 953 O LYS A 60 8.950 9.316 -2.083 1.00 0.00 O ATOM 954 CB LYS A 60 8.717 10.226 1.118 1.00 0.00 C ATOM 955 CG LYS A 60 7.881 11.278 0.367 1.00 0.00 C ATOM 956 CD LYS A 60 7.470 12.458 1.263 1.00 0.00 C ATOM 957 CE LYS A 60 8.638 13.293 1.813 1.00 0.00 C ATOM 958 NZ LYS A 60 9.363 14.045 0.754 1.00 0.00 N ATOM 0 H LYS A 60 9.921 8.393 2.072 1.00 0.00 H new ATOM 0 HA LYS A 60 8.059 8.451 0.046 1.00 0.00 H new ATOM 0 HB2 LYS A 60 8.197 9.948 2.035 1.00 0.00 H new ATOM 0 HB3 LYS A 60 9.667 10.672 1.413 1.00 0.00 H new ATOM 0 HG2 LYS A 60 8.453 11.653 -0.481 1.00 0.00 H new ATOM 0 HG3 LYS A 60 6.986 10.805 -0.037 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.810 13.114 0.695 1.00 0.00 H new ATOM 0 HD3 LYS A 60 6.891 12.073 2.103 1.00 0.00 H new ATOM 0 HE2 LYS A 60 8.258 13.996 2.554 1.00 0.00 H new ATOM 0 HE3 LYS A 60 9.338 12.634 2.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 9.697 14.952 1.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 10.177 13.487 0.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 8.722 14.223 -0.046 1.00 0.00 H new ATOM 972 N GLU A 61 10.946 9.501 -1.076 1.00 0.00 N ATOM 973 CA GLU A 61 11.732 9.950 -2.236 1.00 0.00 C ATOM 974 C GLU A 61 11.780 8.946 -3.399 1.00 0.00 C ATOM 975 O GLU A 61 12.096 9.320 -4.531 1.00 0.00 O ATOM 976 CB GLU A 61 13.162 10.261 -1.769 1.00 0.00 C ATOM 977 CG GLU A 61 13.190 11.375 -0.705 1.00 0.00 C ATOM 978 CD GLU A 61 12.534 12.681 -1.188 1.00 0.00 C ATOM 979 OE1 GLU A 61 13.172 13.445 -1.952 1.00 0.00 O ATOM 980 OE2 GLU A 61 11.370 12.947 -0.799 1.00 0.00 O ATOM 0 H GLU A 61 11.523 9.358 -0.247 1.00 0.00 H new ATOM 0 HA GLU A 61 11.231 10.835 -2.629 1.00 0.00 H new ATOM 0 HB2 GLU A 61 13.615 9.358 -1.361 1.00 0.00 H new ATOM 0 HB3 GLU A 61 13.766 10.561 -2.625 1.00 0.00 H new ATOM 0 HG2 GLU A 61 12.677 11.027 0.192 1.00 0.00 H new ATOM 0 HG3 GLU A 61 14.224 11.576 -0.424 1.00 0.00 H new ATOM 987 N TYR A 62 11.422 7.687 -3.136 1.00 0.00 N ATOM 988 CA TYR A 62 11.455 6.575 -4.089 1.00 0.00 C ATOM 989 C TYR A 62 10.053 6.030 -4.406 1.00 0.00 C ATOM 990 O TYR A 62 9.912 5.135 -5.241 1.00 0.00 O ATOM 991 CB TYR A 62 12.398 5.500 -3.534 1.00 0.00 C ATOM 992 CG TYR A 62 13.810 6.007 -3.302 1.00 0.00 C ATOM 993 CD1 TYR A 62 14.731 6.031 -4.368 1.00 0.00 C ATOM 994 CD2 TYR A 62 14.207 6.438 -2.019 1.00 0.00 C ATOM 995 CE1 TYR A 62 16.051 6.472 -4.152 1.00 0.00 C ATOM 996 CE2 TYR A 62 15.523 6.890 -1.801 1.00 0.00 C ATOM 997 CZ TYR A 62 16.446 6.911 -2.869 1.00 0.00 C ATOM 998 OH TYR A 62 17.713 7.362 -2.660 1.00 0.00 O ATOM 0 H TYR A 62 11.087 7.403 -2.215 1.00 0.00 H new ATOM 0 HA TYR A 62 11.835 6.927 -5.048 1.00 0.00 H new ATOM 0 HB2 TYR A 62 11.995 5.122 -2.594 1.00 0.00 H new ATOM 0 HB3 TYR A 62 12.430 4.660 -4.228 1.00 0.00 H new ATOM 0 HD1 TYR A 62 14.424 5.711 -5.353 1.00 0.00 H new ATOM 0 HD2 TYR A 62 13.501 6.421 -1.202 1.00 0.00 H new ATOM 0 HE1 TYR A 62 16.760 6.474 -4.966 1.00 0.00 H new ATOM 0 HE2 TYR A 62 15.826 7.220 -0.818 1.00 0.00 H new ATOM 0 HH TYR A 62 17.708 8.034 -1.946 1.00 0.00 H new ATOM 1008 N LYS A 63 9.012 6.599 -3.775 1.00 0.00 N ATOM 1009 CA LYS A 63 7.578 6.300 -3.948 1.00 0.00 C ATOM 1010 C LYS A 63 7.254 4.792 -3.946 1.00 0.00 C ATOM 1011 O LYS A 63 6.428 4.315 -4.729 1.00 0.00 O ATOM 1012 CB LYS A 63 7.039 7.049 -5.186 1.00 0.00 C ATOM 1013 CG LYS A 63 7.213 8.577 -5.079 1.00 0.00 C ATOM 1014 CD LYS A 63 6.602 9.331 -6.271 1.00 0.00 C ATOM 1015 CE LYS A 63 7.287 9.051 -7.619 1.00 0.00 C ATOM 1016 NZ LYS A 63 8.676 9.584 -7.676 1.00 0.00 N ATOM 0 H LYS A 63 9.160 7.332 -3.081 1.00 0.00 H new ATOM 0 HA LYS A 63 7.048 6.672 -3.071 1.00 0.00 H new ATOM 0 HB2 LYS A 63 7.556 6.690 -6.076 1.00 0.00 H new ATOM 0 HB3 LYS A 63 5.982 6.816 -5.315 1.00 0.00 H new ATOM 0 HG2 LYS A 63 6.749 8.927 -4.157 1.00 0.00 H new ATOM 0 HG3 LYS A 63 8.275 8.813 -5.011 1.00 0.00 H new ATOM 0 HD2 LYS A 63 5.548 9.066 -6.351 1.00 0.00 H new ATOM 0 HD3 LYS A 63 6.647 10.401 -6.070 1.00 0.00 H new ATOM 0 HE2 LYS A 63 7.307 7.976 -7.796 1.00 0.00 H new ATOM 0 HE3 LYS A 63 6.698 9.495 -8.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 9.093 9.369 -8.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 8.659 10.614 -7.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 9.249 9.142 -6.929 1.00 0.00 H new ATOM 1030 N ILE A 64 7.923 4.042 -3.066 1.00 0.00 N ATOM 1031 CA ILE A 64 7.769 2.589 -2.891 1.00 0.00 C ATOM 1032 C ILE A 64 6.316 2.261 -2.510 1.00 0.00 C ATOM 1033 O ILE A 64 5.708 2.946 -1.685 1.00 0.00 O ATOM 1034 CB ILE A 64 8.772 2.040 -1.846 1.00 0.00 C ATOM 1035 CG1 ILE A 64 10.227 2.455 -2.171 1.00 0.00 C ATOM 1036 CG2 ILE A 64 8.685 0.504 -1.763 1.00 0.00 C ATOM 1037 CD1 ILE A 64 11.203 2.141 -1.036 1.00 0.00 C ATOM 0 H ILE A 64 8.613 4.442 -2.431 1.00 0.00 H new ATOM 0 HA ILE A 64 7.996 2.095 -3.836 1.00 0.00 H new ATOM 0 HB ILE A 64 8.498 2.473 -0.884 1.00 0.00 H new ATOM 0 HG12 ILE A 64 10.552 1.942 -3.076 1.00 0.00 H new ATOM 0 HG13 ILE A 64 10.256 3.524 -2.383 1.00 0.00 H new ATOM 0 HG21 ILE A 64 9.397 0.139 -1.023 1.00 0.00 H new ATOM 0 HG22 ILE A 64 7.676 0.212 -1.470 1.00 0.00 H new ATOM 0 HG23 ILE A 64 8.919 0.073 -2.736 1.00 0.00 H new ATOM 0 HD11 ILE A 64 12.207 2.454 -1.322 1.00 0.00 H new ATOM 0 HD12 ILE A 64 10.899 2.676 -0.136 1.00 0.00 H new ATOM 0 HD13 ILE A 64 11.200 1.069 -0.840 1.00 0.00 H new ATOM 1049 N ASP A 65 5.762 1.211 -3.112 1.00 0.00 N ATOM 1050 CA ASP A 65 4.409 0.706 -2.849 1.00 0.00 C ATOM 1051 C ASP A 65 4.435 -0.575 -1.990 1.00 0.00 C ATOM 1052 O ASP A 65 5.459 -1.246 -1.856 1.00 0.00 O ATOM 1053 CB ASP A 65 3.701 0.491 -4.196 1.00 0.00 C ATOM 1054 CG ASP A 65 2.311 -0.131 -4.056 1.00 0.00 C ATOM 1055 OD1 ASP A 65 1.446 0.437 -3.355 1.00 0.00 O ATOM 1056 OD2 ASP A 65 2.089 -1.234 -4.604 1.00 0.00 O ATOM 0 H ASP A 65 6.256 0.668 -3.820 1.00 0.00 H new ATOM 0 HA ASP A 65 3.850 1.438 -2.266 1.00 0.00 H new ATOM 0 HB2 ASP A 65 3.613 1.449 -4.709 1.00 0.00 H new ATOM 0 HB3 ASP A 65 4.318 -0.152 -4.824 1.00 0.00 H new ATOM 1061 N GLU A 66 3.292 -0.919 -1.399 1.00 0.00 N ATOM 1062 CA GLU A 66 3.139 -2.075 -0.506 1.00 0.00 C ATOM 1063 C GLU A 66 2.924 -3.397 -1.267 1.00 0.00 C ATOM 1064 O GLU A 66 3.417 -4.451 -0.854 1.00 0.00 O ATOM 1065 CB GLU A 66 1.946 -1.844 0.440 1.00 0.00 C ATOM 1066 CG GLU A 66 2.133 -0.611 1.334 1.00 0.00 C ATOM 1067 CD GLU A 66 0.984 -0.446 2.348 1.00 0.00 C ATOM 1068 OE1 GLU A 66 -0.198 -0.347 1.938 1.00 0.00 O ATOM 1069 OE2 GLU A 66 1.271 -0.384 3.568 1.00 0.00 O ATOM 0 H GLU A 66 2.427 -0.394 -1.528 1.00 0.00 H new ATOM 0 HA GLU A 66 4.070 -2.166 0.054 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.037 -1.726 -0.150 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.808 -2.725 1.067 1.00 0.00 H new ATOM 0 HG2 GLU A 66 3.079 -0.693 1.870 1.00 0.00 H new ATOM 0 HG3 GLU A 66 2.196 0.281 0.711 1.00 0.00 H new ATOM 1076 N LYS A 67 2.174 -3.349 -2.379 1.00 0.00 N ATOM 1077 CA LYS A 67 1.798 -4.508 -3.212 1.00 0.00 C ATOM 1078 C LYS A 67 2.950 -4.944 -4.120 1.00 0.00 C ATOM 1079 O LYS A 67 3.168 -6.139 -4.329 1.00 0.00 O ATOM 1080 CB LYS A 67 0.572 -4.171 -4.085 1.00 0.00 C ATOM 1081 CG LYS A 67 -0.586 -3.503 -3.322 1.00 0.00 C ATOM 1082 CD LYS A 67 -1.776 -3.151 -4.230 1.00 0.00 C ATOM 1083 CE LYS A 67 -1.438 -2.255 -5.435 1.00 0.00 C ATOM 1084 NZ LYS A 67 -0.734 -1.001 -5.053 1.00 0.00 N ATOM 0 H LYS A 67 1.798 -2.471 -2.738 1.00 0.00 H new ATOM 0 HA LYS A 67 1.556 -5.327 -2.534 1.00 0.00 H new ATOM 0 HB2 LYS A 67 0.887 -3.511 -4.894 1.00 0.00 H new ATOM 0 HB3 LYS A 67 0.206 -5.088 -4.546 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -0.925 -4.170 -2.529 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -0.222 -2.595 -2.841 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -2.218 -4.077 -4.599 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -2.536 -2.652 -3.629 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -0.816 -2.815 -6.133 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -2.359 -2.002 -5.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -0.860 -0.290 -5.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -1.129 -0.639 -4.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 0.280 -1.196 -4.928 1.00 0.00 H new ATOM 1098 N ASN A 68 3.676 -3.964 -4.661 1.00 0.00 N ATOM 1099 CA ASN A 68 4.925 -4.158 -5.404 1.00 0.00 C ATOM 1100 C ASN A 68 6.076 -4.506 -4.437 1.00 0.00 C ATOM 1101 O ASN A 68 5.950 -4.328 -3.223 1.00 0.00 O ATOM 1102 CB ASN A 68 5.228 -2.884 -6.216 1.00 0.00 C ATOM 1103 CG ASN A 68 4.245 -2.660 -7.356 1.00 0.00 C ATOM 1104 OD1 ASN A 68 4.490 -3.037 -8.494 1.00 0.00 O ATOM 1105 ND2 ASN A 68 3.105 -2.051 -7.115 1.00 0.00 N ATOM 0 H ASN A 68 3.404 -2.983 -4.593 1.00 0.00 H new ATOM 0 HA ASN A 68 4.822 -4.994 -6.095 1.00 0.00 H new ATOM 0 HB2 ASN A 68 5.207 -2.021 -5.550 1.00 0.00 H new ATOM 0 HB3 ASN A 68 6.238 -2.949 -6.621 1.00 0.00 H new ATOM 0 HD21 ASN A 68 2.438 -1.898 -7.872 1.00 0.00 H new ATOM 0 HD22 ASN A 68 2.887 -1.731 -6.171 1.00 0.00 H new ATOM 1112 N PHE A 69 7.211 -4.978 -4.965 1.00 0.00 N ATOM 1113 CA PHE A 69 8.355 -5.414 -4.154 1.00 0.00 C ATOM 1114 C PHE A 69 9.617 -4.568 -4.363 1.00 0.00 C ATOM 1115 O PHE A 69 9.873 -4.022 -5.439 1.00 0.00 O ATOM 1116 CB PHE A 69 8.634 -6.911 -4.385 1.00 0.00 C ATOM 1117 CG PHE A 69 9.225 -7.272 -5.740 1.00 0.00 C ATOM 1118 CD1 PHE A 69 8.381 -7.583 -6.825 1.00 0.00 C ATOM 1119 CD2 PHE A 69 10.623 -7.312 -5.917 1.00 0.00 C ATOM 1120 CE1 PHE A 69 8.931 -7.919 -8.076 1.00 0.00 C ATOM 1121 CE2 PHE A 69 11.173 -7.643 -7.169 1.00 0.00 C ATOM 1122 CZ PHE A 69 10.326 -7.946 -8.250 1.00 0.00 C ATOM 0 H PHE A 69 7.363 -5.069 -5.969 1.00 0.00 H new ATOM 0 HA PHE A 69 8.075 -5.261 -3.112 1.00 0.00 H new ATOM 0 HB2 PHE A 69 9.315 -7.259 -3.608 1.00 0.00 H new ATOM 0 HB3 PHE A 69 7.700 -7.459 -4.259 1.00 0.00 H new ATOM 0 HD1 PHE A 69 7.309 -7.563 -6.696 1.00 0.00 H new ATOM 0 HD2 PHE A 69 11.276 -7.087 -5.087 1.00 0.00 H new ATOM 0 HE1 PHE A 69 8.280 -8.157 -8.904 1.00 0.00 H new ATOM 0 HE2 PHE A 69 12.245 -7.664 -7.300 1.00 0.00 H new ATOM 0 HZ PHE A 69 10.746 -8.199 -9.212 1.00 0.00 H new ATOM 1132 N VAL A 70 10.424 -4.509 -3.307 1.00 0.00 N ATOM 1133 CA VAL A 70 11.791 -3.977 -3.252 1.00 0.00 C ATOM 1134 C VAL A 70 12.752 -5.176 -3.241 1.00 0.00 C ATOM 1135 O VAL A 70 12.369 -6.275 -2.828 1.00 0.00 O ATOM 1136 CB VAL A 70 11.931 -3.068 -2.000 1.00 0.00 C ATOM 1137 CG1 VAL A 70 12.951 -3.542 -0.967 1.00 0.00 C ATOM 1138 CG2 VAL A 70 12.313 -1.635 -2.373 1.00 0.00 C ATOM 0 H VAL A 70 10.121 -4.857 -2.397 1.00 0.00 H new ATOM 0 HA VAL A 70 12.031 -3.356 -4.115 1.00 0.00 H new ATOM 0 HB VAL A 70 10.938 -3.118 -1.552 1.00 0.00 H new ATOM 0 HG11 VAL A 70 12.975 -2.842 -0.132 1.00 0.00 H new ATOM 0 HG12 VAL A 70 12.669 -4.530 -0.604 1.00 0.00 H new ATOM 0 HG13 VAL A 70 13.938 -3.592 -1.427 1.00 0.00 H new ATOM 0 HG21 VAL A 70 12.400 -1.034 -1.468 1.00 0.00 H new ATOM 0 HG22 VAL A 70 13.267 -1.638 -2.900 1.00 0.00 H new ATOM 0 HG23 VAL A 70 11.544 -1.210 -3.018 1.00 0.00 H new ATOM 1148 N VAL A 71 14.014 -4.983 -3.628 1.00 0.00 N ATOM 1149 CA VAL A 71 15.051 -6.025 -3.507 1.00 0.00 C ATOM 1150 C VAL A 71 15.995 -5.698 -2.353 1.00 0.00 C ATOM 1151 O VAL A 71 16.586 -4.618 -2.299 1.00 0.00 O ATOM 1152 CB VAL A 71 15.798 -6.265 -4.830 1.00 0.00 C ATOM 1153 CG1 VAL A 71 16.841 -7.380 -4.679 1.00 0.00 C ATOM 1154 CG2 VAL A 71 14.822 -6.715 -5.925 1.00 0.00 C ATOM 0 H VAL A 71 14.351 -4.109 -4.032 1.00 0.00 H new ATOM 0 HA VAL A 71 14.556 -6.969 -3.277 1.00 0.00 H new ATOM 0 HB VAL A 71 16.279 -5.324 -5.097 1.00 0.00 H new ATOM 0 HG11 VAL A 71 17.354 -7.529 -5.629 1.00 0.00 H new ATOM 0 HG12 VAL A 71 17.566 -7.099 -3.915 1.00 0.00 H new ATOM 0 HG13 VAL A 71 16.345 -8.305 -4.386 1.00 0.00 H new ATOM 0 HG21 VAL A 71 15.368 -6.880 -6.854 1.00 0.00 H new ATOM 0 HG22 VAL A 71 14.336 -7.642 -5.620 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.068 -5.943 -6.080 1.00 0.00 H new ATOM 1164 N VAL A 72 16.125 -6.647 -1.423 1.00 0.00 N ATOM 1165 CA VAL A 72 17.097 -6.636 -0.320 1.00 0.00 C ATOM 1166 C VAL A 72 18.232 -7.621 -0.624 1.00 0.00 C ATOM 1167 O VAL A 72 18.002 -8.741 -1.088 1.00 0.00 O ATOM 1168 CB VAL A 72 16.427 -6.922 1.041 1.00 0.00 C ATOM 1169 CG1 VAL A 72 15.677 -8.260 1.086 1.00 0.00 C ATOM 1170 CG2 VAL A 72 17.443 -6.873 2.196 1.00 0.00 C ATOM 0 H VAL A 72 15.534 -7.478 -1.415 1.00 0.00 H new ATOM 0 HA VAL A 72 17.522 -5.636 -0.240 1.00 0.00 H new ATOM 0 HB VAL A 72 15.692 -6.127 1.165 1.00 0.00 H new ATOM 0 HG11 VAL A 72 15.232 -8.394 2.072 1.00 0.00 H new ATOM 0 HG12 VAL A 72 14.892 -8.263 0.330 1.00 0.00 H new ATOM 0 HG13 VAL A 72 16.374 -9.075 0.889 1.00 0.00 H new ATOM 0 HG21 VAL A 72 16.934 -7.079 3.137 1.00 0.00 H new ATOM 0 HG22 VAL A 72 18.218 -7.622 2.031 1.00 0.00 H new ATOM 0 HG23 VAL A 72 17.898 -5.883 2.239 1.00 0.00 H new ATOM 1180 N MET A 73 19.466 -7.217 -0.340 1.00 0.00 N ATOM 1181 CA MET A 73 20.655 -8.075 -0.368 1.00 0.00 C ATOM 1182 C MET A 73 21.562 -7.795 0.826 1.00 0.00 C ATOM 1183 O MET A 73 21.432 -6.758 1.475 1.00 0.00 O ATOM 1184 CB MET A 73 21.374 -7.928 -1.712 1.00 0.00 C ATOM 1185 CG MET A 73 21.929 -6.535 -2.010 1.00 0.00 C ATOM 1186 SD MET A 73 22.777 -6.387 -3.607 1.00 0.00 S ATOM 1187 CE MET A 73 24.216 -7.450 -3.309 1.00 0.00 C ATOM 0 H MET A 73 19.677 -6.255 -0.075 1.00 0.00 H new ATOM 0 HA MET A 73 20.350 -9.117 -0.277 1.00 0.00 H new ATOM 0 HB2 MET A 73 22.196 -8.643 -1.745 1.00 0.00 H new ATOM 0 HB3 MET A 73 20.681 -8.202 -2.507 1.00 0.00 H new ATOM 0 HG2 MET A 73 21.109 -5.817 -1.981 1.00 0.00 H new ATOM 0 HG3 MET A 73 22.624 -6.258 -1.217 1.00 0.00 H new ATOM 0 HE1 MET A 73 24.872 -7.427 -4.179 1.00 0.00 H new ATOM 0 HE2 MET A 73 24.759 -7.090 -2.435 1.00 0.00 H new ATOM 0 HE3 MET A 73 23.883 -8.473 -3.133 1.00 0.00 H new ATOM 1197 N VAL A 74 22.485 -8.713 1.116 1.00 0.00 N ATOM 1198 CA VAL A 74 23.433 -8.620 2.232 1.00 0.00 C ATOM 1199 C VAL A 74 24.852 -8.936 1.745 1.00 0.00 C ATOM 1200 O VAL A 74 25.144 -10.046 1.297 1.00 0.00 O ATOM 1201 CB VAL A 74 22.971 -9.465 3.439 1.00 0.00 C ATOM 1202 CG1 VAL A 74 22.731 -10.951 3.142 1.00 0.00 C ATOM 1203 CG2 VAL A 74 23.949 -9.332 4.610 1.00 0.00 C ATOM 0 H VAL A 74 22.599 -9.565 0.568 1.00 0.00 H new ATOM 0 HA VAL A 74 23.458 -7.596 2.604 1.00 0.00 H new ATOM 0 HB VAL A 74 21.998 -9.049 3.701 1.00 0.00 H new ATOM 0 HG11 VAL A 74 22.410 -11.457 4.053 1.00 0.00 H new ATOM 0 HG12 VAL A 74 21.958 -11.050 2.380 1.00 0.00 H new ATOM 0 HG13 VAL A 74 23.655 -11.404 2.782 1.00 0.00 H new ATOM 0 HG21 VAL A 74 23.599 -9.937 5.446 1.00 0.00 H new ATOM 0 HG22 VAL A 74 24.936 -9.676 4.301 1.00 0.00 H new ATOM 0 HG23 VAL A 74 24.009 -8.288 4.917 1.00 0.00 H new ATOM 1872 N GLU B 283 30.580 -8.639 -6.034 1.00 0.00 N ATOM 1873 CA GLU B 283 29.566 -7.792 -5.376 1.00 0.00 C ATOM 1874 C GLU B 283 28.824 -6.880 -6.373 1.00 0.00 C ATOM 1875 O GLU B 283 27.605 -6.750 -6.305 1.00 0.00 O ATOM 1876 CB GLU B 283 30.214 -6.963 -4.256 1.00 0.00 C ATOM 1877 CG GLU B 283 29.157 -6.343 -3.331 1.00 0.00 C ATOM 1878 CD GLU B 283 29.777 -5.363 -2.321 1.00 0.00 C ATOM 1879 OE1 GLU B 283 30.648 -5.770 -1.516 1.00 0.00 O ATOM 1880 OE2 GLU B 283 29.371 -4.175 -2.319 1.00 0.00 O ATOM 0 HA GLU B 283 28.818 -8.456 -4.942 1.00 0.00 H new ATOM 0 HB2 GLU B 283 30.882 -7.597 -3.673 1.00 0.00 H new ATOM 0 HB3 GLU B 283 30.825 -6.173 -4.693 1.00 0.00 H new ATOM 0 HG2 GLU B 283 28.412 -5.821 -3.931 1.00 0.00 H new ATOM 0 HG3 GLU B 283 28.636 -7.136 -2.794 1.00 0.00 H new ATOM 1887 N GLU B 284 29.531 -6.298 -7.347 1.00 0.00 N ATOM 1888 CA GLU B 284 28.934 -5.477 -8.414 1.00 0.00 C ATOM 1889 C GLU B 284 27.980 -6.274 -9.326 1.00 0.00 C ATOM 1890 O GLU B 284 26.984 -5.736 -9.806 1.00 0.00 O ATOM 1891 CB GLU B 284 30.039 -4.829 -9.263 1.00 0.00 C ATOM 1892 CG GLU B 284 30.898 -3.841 -8.461 1.00 0.00 C ATOM 1893 CD GLU B 284 31.921 -3.134 -9.371 1.00 0.00 C ATOM 1894 OE1 GLU B 284 33.034 -3.678 -9.580 1.00 0.00 O ATOM 1895 OE2 GLU B 284 31.626 -2.025 -9.880 1.00 0.00 O ATOM 0 H GLU B 284 30.545 -6.382 -7.421 1.00 0.00 H new ATOM 0 HA GLU B 284 28.339 -4.709 -7.920 1.00 0.00 H new ATOM 0 HB2 GLU B 284 30.679 -5.609 -9.676 1.00 0.00 H new ATOM 0 HB3 GLU B 284 29.586 -4.309 -10.107 1.00 0.00 H new ATOM 0 HG2 GLU B 284 30.257 -3.100 -7.984 1.00 0.00 H new ATOM 0 HG3 GLU B 284 31.420 -4.371 -7.664 1.00 0.00 H new ATOM 1902 N GLU B 285 28.249 -7.564 -9.548 1.00 0.00 N ATOM 1903 CA GLU B 285 27.393 -8.471 -10.329 1.00 0.00 C ATOM 1904 C GLU B 285 26.164 -8.923 -9.523 1.00 0.00 C ATOM 1905 O GLU B 285 25.055 -8.956 -10.055 1.00 0.00 O ATOM 1906 CB GLU B 285 28.201 -9.690 -10.800 1.00 0.00 C ATOM 1907 CG GLU B 285 29.325 -9.307 -11.772 1.00 0.00 C ATOM 1908 CD GLU B 285 30.176 -10.535 -12.135 1.00 0.00 C ATOM 1909 OE1 GLU B 285 31.066 -10.900 -11.330 1.00 0.00 O ATOM 1910 OE2 GLU B 285 29.960 -11.137 -13.215 1.00 0.00 O ATOM 0 H GLU B 285 29.085 -8.020 -9.183 1.00 0.00 H new ATOM 0 HA GLU B 285 27.034 -7.923 -11.200 1.00 0.00 H new ATOM 0 HB2 GLU B 285 28.629 -10.195 -9.934 1.00 0.00 H new ATOM 0 HB3 GLU B 285 27.532 -10.401 -11.285 1.00 0.00 H new ATOM 0 HG2 GLU B 285 28.898 -8.875 -12.677 1.00 0.00 H new ATOM 0 HG3 GLU B 285 29.957 -8.542 -11.321 1.00 0.00 H new ATOM 1917 N GLN B 286 26.334 -9.203 -8.225 1.00 0.00 N ATOM 1918 CA GLN B 286 25.237 -9.440 -7.276 1.00 0.00 C ATOM 1919 C GLN B 286 24.304 -8.219 -7.189 1.00 0.00 C ATOM 1920 O GLN B 286 23.083 -8.365 -7.257 1.00 0.00 O ATOM 1921 CB GLN B 286 25.814 -9.766 -5.891 1.00 0.00 C ATOM 1922 CG GLN B 286 26.495 -11.139 -5.808 1.00 0.00 C ATOM 1923 CD GLN B 286 27.337 -11.257 -4.538 1.00 0.00 C ATOM 1924 OE1 GLN B 286 26.865 -11.066 -3.425 1.00 0.00 O ATOM 1925 NE2 GLN B 286 28.611 -11.566 -4.634 1.00 0.00 N ATOM 0 H GLN B 286 27.257 -9.273 -7.795 1.00 0.00 H new ATOM 0 HA GLN B 286 24.649 -10.286 -7.633 1.00 0.00 H new ATOM 0 HB2 GLN B 286 26.536 -8.996 -5.619 1.00 0.00 H new ATOM 0 HB3 GLN B 286 25.011 -9.725 -5.155 1.00 0.00 H new ATOM 0 HG2 GLN B 286 25.740 -11.925 -5.822 1.00 0.00 H new ATOM 0 HG3 GLN B 286 27.127 -11.289 -6.683 1.00 0.00 H new ATOM 0 HE21 GLN B 286 29.028 -11.730 -5.550 1.00 0.00 H new ATOM 0 HE22 GLN B 286 29.182 -11.642 -3.792 1.00 0.00 H new ATOM 1934 N ILE B 287 24.872 -7.010 -7.099 1.00 0.00 N ATOM 1935 CA ILE B 287 24.154 -5.735 -7.216 1.00 0.00 C ATOM 1936 C ILE B 287 23.407 -5.648 -8.553 1.00 0.00 C ATOM 1937 O ILE B 287 22.203 -5.419 -8.546 1.00 0.00 O ATOM 1938 CB ILE B 287 25.111 -4.542 -6.964 1.00 0.00 C ATOM 1939 CG1 ILE B 287 25.360 -4.409 -5.442 1.00 0.00 C ATOM 1940 CG2 ILE B 287 24.548 -3.230 -7.538 1.00 0.00 C ATOM 1941 CD1 ILE B 287 26.506 -3.465 -5.053 1.00 0.00 C ATOM 0 H ILE B 287 25.872 -6.889 -6.938 1.00 0.00 H new ATOM 0 HA ILE B 287 23.390 -5.683 -6.440 1.00 0.00 H new ATOM 0 HB ILE B 287 26.053 -4.735 -7.477 1.00 0.00 H new ATOM 0 HG12 ILE B 287 24.443 -4.058 -4.968 1.00 0.00 H new ATOM 0 HG13 ILE B 287 25.570 -5.398 -5.035 1.00 0.00 H new ATOM 0 HG21 ILE B 287 25.247 -2.417 -7.341 1.00 0.00 H new ATOM 0 HG22 ILE B 287 24.406 -3.335 -8.614 1.00 0.00 H new ATOM 0 HG23 ILE B 287 23.591 -3.007 -7.066 1.00 0.00 H new ATOM 0 HD11 ILE B 287 26.603 -3.438 -3.968 1.00 0.00 H new ATOM 0 HD12 ILE B 287 27.437 -3.823 -5.492 1.00 0.00 H new ATOM 0 HD13 ILE B 287 26.293 -2.462 -5.423 1.00 0.00 H new ATOM 1953 N ALA B 288 24.062 -5.850 -9.699 1.00 0.00 N ATOM 1954 CA ALA B 288 23.394 -5.774 -11.003 1.00 0.00 C ATOM 1955 C ALA B 288 22.257 -6.809 -11.173 1.00 0.00 C ATOM 1956 O ALA B 288 21.236 -6.504 -11.792 1.00 0.00 O ATOM 1957 CB ALA B 288 24.446 -5.900 -12.107 1.00 0.00 C ATOM 0 H ALA B 288 25.057 -6.068 -9.751 1.00 0.00 H new ATOM 0 HA ALA B 288 22.902 -4.804 -11.072 1.00 0.00 H new ATOM 0 HB1 ALA B 288 23.960 -5.845 -13.081 1.00 0.00 H new ATOM 0 HB2 ALA B 288 25.168 -5.089 -12.016 1.00 0.00 H new ATOM 0 HB3 ALA B 288 24.960 -6.856 -12.012 1.00 0.00 H new ATOM 1963 N TYR B 289 22.381 -8.004 -10.586 1.00 0.00 N ATOM 1964 CA TYR B 289 21.300 -8.991 -10.486 1.00 0.00 C ATOM 1965 C TYR B 289 20.126 -8.466 -9.635 1.00 0.00 C ATOM 1966 O TYR B 289 18.971 -8.538 -10.065 1.00 0.00 O ATOM 1967 CB TYR B 289 21.874 -10.309 -9.944 1.00 0.00 C ATOM 1968 CG TYR B 289 20.864 -11.428 -9.761 1.00 0.00 C ATOM 1969 CD1 TYR B 289 20.132 -11.909 -10.865 1.00 0.00 C ATOM 1970 CD2 TYR B 289 20.676 -12.006 -8.490 1.00 0.00 C ATOM 1971 CE1 TYR B 289 19.209 -12.961 -10.698 1.00 0.00 C ATOM 1972 CE2 TYR B 289 19.758 -13.060 -8.320 1.00 0.00 C ATOM 1973 CZ TYR B 289 19.020 -13.541 -9.424 1.00 0.00 C ATOM 1974 OH TYR B 289 18.142 -14.570 -9.272 1.00 0.00 O ATOM 0 H TYR B 289 23.252 -8.319 -10.159 1.00 0.00 H new ATOM 0 HA TYR B 289 20.886 -9.175 -11.477 1.00 0.00 H new ATOM 0 HB2 TYR B 289 22.654 -10.653 -10.623 1.00 0.00 H new ATOM 0 HB3 TYR B 289 22.351 -10.111 -8.984 1.00 0.00 H new ATOM 0 HD1 TYR B 289 20.279 -11.471 -11.841 1.00 0.00 H new ATOM 0 HD2 TYR B 289 21.238 -11.640 -7.644 1.00 0.00 H new ATOM 0 HE1 TYR B 289 18.646 -13.324 -11.545 1.00 0.00 H new ATOM 0 HE2 TYR B 289 19.618 -13.501 -7.344 1.00 0.00 H new ATOM 0 HH TYR B 289 18.131 -14.855 -8.334 1.00 0.00 H new ATOM 1984 N ALA B 290 20.406 -7.863 -8.472 1.00 0.00 N ATOM 1985 CA ALA B 290 19.418 -7.169 -7.647 1.00 0.00 C ATOM 1986 C ALA B 290 18.686 -6.046 -8.412 1.00 0.00 C ATOM 1987 O ALA B 290 17.453 -5.983 -8.395 1.00 0.00 O ATOM 1988 CB ALA B 290 20.112 -6.626 -6.390 1.00 0.00 C ATOM 0 H ALA B 290 21.345 -7.846 -8.074 1.00 0.00 H new ATOM 0 HA ALA B 290 18.647 -7.885 -7.363 1.00 0.00 H new ATOM 0 HB1 ALA B 290 19.383 -6.106 -5.768 1.00 0.00 H new ATOM 0 HB2 ALA B 290 20.545 -7.453 -5.828 1.00 0.00 H new ATOM 0 HB3 ALA B 290 20.901 -5.932 -6.681 1.00 0.00 H new ATOM 1994 N MET B 291 19.437 -5.189 -9.119 1.00 0.00 N ATOM 1995 CA MET B 291 18.933 -4.154 -10.017 1.00 0.00 C ATOM 1996 C MET B 291 17.988 -4.752 -11.058 1.00 0.00 C ATOM 1997 O MET B 291 16.833 -4.358 -11.101 1.00 0.00 O ATOM 1998 CB MET B 291 20.078 -3.385 -10.701 1.00 0.00 C ATOM 1999 CG MET B 291 20.947 -2.576 -9.733 1.00 0.00 C ATOM 2000 SD MET B 291 22.267 -1.640 -10.554 1.00 0.00 S ATOM 2001 CE MET B 291 22.679 -0.476 -9.227 1.00 0.00 C ATOM 0 H MET B 291 20.456 -5.204 -9.075 1.00 0.00 H new ATOM 0 HA MET B 291 18.375 -3.441 -9.411 1.00 0.00 H new ATOM 0 HB2 MET B 291 20.710 -4.094 -11.236 1.00 0.00 H new ATOM 0 HB3 MET B 291 19.656 -2.710 -11.445 1.00 0.00 H new ATOM 0 HG2 MET B 291 20.312 -1.884 -9.179 1.00 0.00 H new ATOM 0 HG3 MET B 291 21.392 -3.253 -9.004 1.00 0.00 H new ATOM 0 HE1 MET B 291 23.560 0.101 -9.509 1.00 0.00 H new ATOM 0 HE2 MET B 291 21.840 0.200 -9.063 1.00 0.00 H new ATOM 0 HE3 MET B 291 22.885 -1.028 -8.310 1.00 0.00 H new ATOM 2011 N GLN B 292 18.434 -5.723 -11.858 1.00 0.00 N ATOM 2012 CA GLN B 292 17.642 -6.376 -12.908 1.00 0.00 C ATOM 2013 C GLN B 292 16.304 -6.949 -12.404 1.00 0.00 C ATOM 2014 O GLN B 292 15.288 -6.810 -13.089 1.00 0.00 O ATOM 2015 CB GLN B 292 18.524 -7.468 -13.545 1.00 0.00 C ATOM 2016 CG GLN B 292 17.791 -8.356 -14.560 1.00 0.00 C ATOM 2017 CD GLN B 292 18.739 -9.364 -15.206 1.00 0.00 C ATOM 2018 OE1 GLN B 292 19.367 -9.110 -16.227 1.00 0.00 O ATOM 2019 NE2 GLN B 292 18.884 -10.547 -14.644 1.00 0.00 N ATOM 0 H GLN B 292 19.384 -6.089 -11.793 1.00 0.00 H new ATOM 0 HA GLN B 292 17.356 -5.628 -13.648 1.00 0.00 H new ATOM 0 HB2 GLN B 292 19.371 -6.992 -14.040 1.00 0.00 H new ATOM 0 HB3 GLN B 292 18.930 -8.099 -12.754 1.00 0.00 H new ATOM 0 HG2 GLN B 292 16.979 -8.886 -14.062 1.00 0.00 H new ATOM 0 HG3 GLN B 292 17.340 -7.733 -15.332 1.00 0.00 H new ATOM 0 HE21 GLN B 292 18.368 -10.774 -13.794 1.00 0.00 H new ATOM 0 HE22 GLN B 292 19.512 -11.235 -15.059 1.00 0.00 H new ATOM 2028 N MET B 293 16.272 -7.589 -11.230 1.00 0.00 N ATOM 2029 CA MET B 293 15.016 -8.068 -10.633 1.00 0.00 C ATOM 2030 C MET B 293 14.084 -6.901 -10.262 1.00 0.00 C ATOM 2031 O MET B 293 12.935 -6.856 -10.705 1.00 0.00 O ATOM 2032 CB MET B 293 15.288 -8.948 -9.405 1.00 0.00 C ATOM 2033 CG MET B 293 15.883 -10.308 -9.790 1.00 0.00 C ATOM 2034 SD MET B 293 15.917 -11.519 -8.438 1.00 0.00 S ATOM 2035 CE MET B 293 17.096 -10.722 -7.315 1.00 0.00 C ATOM 0 H MET B 293 17.102 -7.789 -10.672 1.00 0.00 H new ATOM 0 HA MET B 293 14.512 -8.673 -11.386 1.00 0.00 H new ATOM 0 HB2 MET B 293 15.973 -8.430 -8.733 1.00 0.00 H new ATOM 0 HB3 MET B 293 14.359 -9.102 -8.857 1.00 0.00 H new ATOM 0 HG2 MET B 293 15.308 -10.722 -10.618 1.00 0.00 H new ATOM 0 HG3 MET B 293 16.900 -10.157 -10.152 1.00 0.00 H new ATOM 0 HE1 MET B 293 17.110 -11.255 -6.364 1.00 0.00 H new ATOM 0 HE2 MET B 293 18.092 -10.744 -7.758 1.00 0.00 H new ATOM 0 HE3 MET B 293 16.796 -9.688 -7.147 1.00 0.00 H new ATOM 2045 N SER B 294 14.586 -5.931 -9.490 1.00 0.00 N ATOM 2046 CA SER B 294 13.882 -4.706 -9.090 1.00 0.00 C ATOM 2047 C SER B 294 13.319 -3.907 -10.277 1.00 0.00 C ATOM 2048 O SER B 294 12.153 -3.514 -10.292 1.00 0.00 O ATOM 2049 CB SER B 294 14.878 -3.849 -8.308 1.00 0.00 C ATOM 2050 OG SER B 294 14.261 -2.657 -7.891 1.00 0.00 O ATOM 0 H SER B 294 15.532 -5.979 -9.111 1.00 0.00 H new ATOM 0 HA SER B 294 13.017 -4.984 -8.487 1.00 0.00 H new ATOM 0 HB2 SER B 294 15.244 -4.401 -7.442 1.00 0.00 H new ATOM 0 HB3 SER B 294 15.743 -3.622 -8.931 1.00 0.00 H new ATOM 0 HG SER B 294 13.409 -2.865 -7.453 1.00 0.00 H new