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 22 THR OG1 : rot -65:sc= 2.06 USER MOD Set 1.2: A 24 LYS NZ :NH3+ 175:sc= 2.16 (180deg=1.18) USER MOD Set 2.1: A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 10 GLN : amide:sc= 0.336 K(o=1.1,f=0.21) USER MOD Set 2.3: B 289 TYR OH : rot -162:sc= 0.788 USER MOD Single : A 1 MET CE :methyl 156:sc= -0.468 (180deg=-1.17) USER MOD Single : A 1 MET N :NH3+ -174:sc= 0.991 (180deg=0.97) USER MOD Single : A 2 GLN : amide:sc= 1.04 K(o=1,f=-0.067) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.313 USER MOD Single : A 9 GLN : amide:sc= -0.147 X(o=-0.15,f=-0.15) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 165:sc= 2.22 (180deg=1.83) USER MOD Single : A 29 LYS NZ :NH3+ -159:sc= 2.44 (180deg=1.85) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -119:sc= 0.765 (180deg=0.0267) USER MOD Single : A 36 LYS NZ :NH3+ -170:sc= 1.1 (180deg=1.04) USER MOD Single : A 44 GLN : amide:sc= 0.752 K(o=0.75,f=-2) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 54 ASN : amide:sc= 0.22 K(o=0.22,f=-5.3!) USER MOD Single : A 57 THR OG1 : rot 180:sc=-0.00259 USER MOD Single : A 60 LYS NZ :NH3+ -172:sc= 1.26 (180deg=1.24) USER MOD Single : A 62 TYR OH : rot 150:sc= 0.525 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ -172:sc= 1.21 (180deg=1.13) USER MOD Single : A 68 ASN : amide:sc= 0 K(o=0,f=-1.9!) USER MOD Single : A 73 MET CE :methyl -175:sc= -0.586 (180deg=-0.665) USER MOD Single : B 286 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 291 MET CE :methyl 174:sc= 0 (180deg=-0.055) USER MOD Single : B 292 GLN : amide:sc= 0.514 K(o=0.51,f=0) USER MOD Single : B 293 MET CE :methyl -154:sc= -0.0708 (180deg=-0.629) USER MOD Single : B 294 SER OG : rot 20:sc= 0.26 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.390 2.974 8.235 1.00 0.00 N ATOM 2 CA MET A 1 9.155 2.513 6.844 1.00 0.00 C ATOM 3 C MET A 1 7.980 1.542 6.791 1.00 0.00 C ATOM 4 O MET A 1 8.091 0.414 7.263 1.00 0.00 O ATOM 5 CB MET A 1 10.391 1.820 6.231 1.00 0.00 C ATOM 6 CG MET A 1 11.372 2.780 5.552 1.00 0.00 C ATOM 7 SD MET A 1 12.891 2.004 4.911 1.00 0.00 S ATOM 8 CE MET A 1 12.239 0.569 4.002 1.00 0.00 C ATOM 0 H1 MET A 1 10.125 3.710 8.237 1.00 0.00 H new ATOM 0 H2 MET A 1 8.508 3.364 8.625 1.00 0.00 H new ATOM 0 H3 MET A 1 9.701 2.172 8.819 1.00 0.00 H new ATOM 0 HA MET A 1 8.937 3.408 6.260 1.00 0.00 H new ATOM 0 HB2 MET A 1 10.916 1.276 7.016 1.00 0.00 H new ATOM 0 HB3 MET A 1 10.056 1.083 5.501 1.00 0.00 H new ATOM 0 HG2 MET A 1 10.860 3.276 4.728 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.651 3.555 6.266 1.00 0.00 H new ATOM 0 HE1 MET A 1 12.955 0.266 3.238 1.00 0.00 H new ATOM 0 HE2 MET A 1 12.076 -0.257 4.694 1.00 0.00 H new ATOM 0 HE3 MET A 1 11.295 0.837 3.528 1.00 0.00 H new ATOM 20 N GLN A 2 6.855 1.938 6.196 1.00 0.00 N ATOM 21 CA GLN A 2 5.748 1.026 5.886 1.00 0.00 C ATOM 22 C GLN A 2 6.004 0.357 4.523 1.00 0.00 C ATOM 23 O GLN A 2 5.480 0.773 3.488 1.00 0.00 O ATOM 24 CB GLN A 2 4.388 1.733 5.984 1.00 0.00 C ATOM 25 CG GLN A 2 4.176 2.419 7.338 1.00 0.00 C ATOM 26 CD GLN A 2 2.748 2.928 7.547 1.00 0.00 C ATOM 27 OE1 GLN A 2 2.054 3.355 6.631 1.00 0.00 O ATOM 28 NE2 GLN A 2 2.251 2.912 8.765 1.00 0.00 N ATOM 0 H GLN A 2 6.683 2.903 5.914 1.00 0.00 H new ATOM 0 HA GLN A 2 5.705 0.233 6.633 1.00 0.00 H new ATOM 0 HB2 GLN A 2 4.310 2.475 5.189 1.00 0.00 H new ATOM 0 HB3 GLN A 2 3.592 1.006 5.821 1.00 0.00 H new ATOM 0 HG2 GLN A 2 4.423 1.717 8.135 1.00 0.00 H new ATOM 0 HG3 GLN A 2 4.868 3.257 7.424 1.00 0.00 H new ATOM 0 HE21 GLN A 2 2.813 2.561 9.540 1.00 0.00 H new ATOM 0 HE22 GLN A 2 1.304 3.251 8.934 1.00 0.00 H new ATOM 37 N VAL A 3 6.878 -0.653 4.522 1.00 0.00 N ATOM 38 CA VAL A 3 7.278 -1.444 3.345 1.00 0.00 C ATOM 39 C VAL A 3 6.083 -2.250 2.830 1.00 0.00 C ATOM 40 O VAL A 3 5.377 -2.876 3.622 1.00 0.00 O ATOM 41 CB VAL A 3 8.426 -2.414 3.703 1.00 0.00 C ATOM 42 CG1 VAL A 3 8.933 -3.198 2.485 1.00 0.00 C ATOM 43 CG2 VAL A 3 9.631 -1.645 4.242 1.00 0.00 C ATOM 0 H VAL A 3 7.348 -0.958 5.374 1.00 0.00 H new ATOM 0 HA VAL A 3 7.622 -0.756 2.572 1.00 0.00 H new ATOM 0 HB VAL A 3 8.012 -3.098 4.444 1.00 0.00 H new ATOM 0 HG11 VAL A 3 9.739 -3.865 2.791 1.00 0.00 H new ATOM 0 HG12 VAL A 3 8.116 -3.785 2.064 1.00 0.00 H new ATOM 0 HG13 VAL A 3 9.304 -2.502 1.733 1.00 0.00 H new ATOM 0 HG21 VAL A 3 10.429 -2.345 4.488 1.00 0.00 H new ATOM 0 HG22 VAL A 3 9.984 -0.945 3.485 1.00 0.00 H new ATOM 0 HG23 VAL A 3 9.341 -1.096 5.138 1.00 0.00 H new ATOM 53 N THR A 4 5.851 -2.274 1.517 1.00 0.00 N ATOM 54 CA THR A 4 4.874 -3.191 0.904 1.00 0.00 C ATOM 55 C THR A 4 5.506 -4.569 0.695 1.00 0.00 C ATOM 56 O THR A 4 6.629 -4.680 0.207 1.00 0.00 O ATOM 57 CB THR A 4 4.365 -2.640 -0.431 1.00 0.00 C ATOM 58 OG1 THR A 4 3.655 -1.437 -0.212 1.00 0.00 O ATOM 59 CG2 THR A 4 3.397 -3.605 -1.113 1.00 0.00 C ATOM 0 H THR A 4 6.327 -1.667 0.849 1.00 0.00 H new ATOM 0 HA THR A 4 4.025 -3.284 1.581 1.00 0.00 H new ATOM 0 HB THR A 4 5.240 -2.487 -1.063 1.00 0.00 H new ATOM 0 HG1 THR A 4 3.333 -1.087 -1.069 1.00 0.00 H new ATOM 0 HG21 THR A 4 3.060 -3.176 -2.057 1.00 0.00 H new ATOM 0 HG22 THR A 4 3.902 -4.552 -1.305 1.00 0.00 H new ATOM 0 HG23 THR A 4 2.538 -3.777 -0.465 1.00 0.00 H new ATOM 67 N LEU A 5 4.787 -5.633 1.045 1.00 0.00 N ATOM 68 CA LEU A 5 5.201 -7.032 0.930 1.00 0.00 C ATOM 69 C LEU A 5 4.402 -7.749 -0.166 1.00 0.00 C ATOM 70 O LEU A 5 3.231 -7.438 -0.396 1.00 0.00 O ATOM 71 CB LEU A 5 4.960 -7.711 2.294 1.00 0.00 C ATOM 72 CG LEU A 5 6.005 -7.451 3.400 1.00 0.00 C ATOM 73 CD1 LEU A 5 6.990 -8.613 3.457 1.00 0.00 C ATOM 74 CD2 LEU A 5 6.769 -6.128 3.346 1.00 0.00 C ATOM 0 H LEU A 5 3.850 -5.539 1.437 1.00 0.00 H new ATOM 0 HA LEU A 5 6.255 -7.085 0.657 1.00 0.00 H new ATOM 0 HB2 LEU A 5 3.987 -7.390 2.665 1.00 0.00 H new ATOM 0 HB3 LEU A 5 4.900 -8.787 2.131 1.00 0.00 H new ATOM 0 HG LEU A 5 5.409 -7.368 4.309 1.00 0.00 H new ATOM 0 HD11 LEU A 5 7.727 -8.427 4.238 1.00 0.00 H new ATOM 0 HD12 LEU A 5 6.452 -9.535 3.677 1.00 0.00 H new ATOM 0 HD13 LEU A 5 7.496 -8.708 2.496 1.00 0.00 H new ATOM 0 HD21 LEU A 5 7.468 -6.077 4.180 1.00 0.00 H new ATOM 0 HD22 LEU A 5 7.319 -6.063 2.407 1.00 0.00 H new ATOM 0 HD23 LEU A 5 6.065 -5.298 3.412 1.00 0.00 H new ATOM 86 N LYS A 6 5.023 -8.761 -0.778 1.00 0.00 N ATOM 87 CA LYS A 6 4.421 -9.695 -1.746 1.00 0.00 C ATOM 88 C LYS A 6 4.878 -11.135 -1.485 1.00 0.00 C ATOM 89 O LYS A 6 6.077 -11.401 -1.386 1.00 0.00 O ATOM 90 CB LYS A 6 4.712 -9.235 -3.184 1.00 0.00 C ATOM 91 CG LYS A 6 3.948 -10.125 -4.175 1.00 0.00 C ATOM 92 CD LYS A 6 3.822 -9.501 -5.567 1.00 0.00 C ATOM 93 CE LYS A 6 2.835 -10.372 -6.347 1.00 0.00 C ATOM 94 NZ LYS A 6 2.506 -9.799 -7.680 1.00 0.00 N ATOM 0 H LYS A 6 6.008 -8.965 -0.607 1.00 0.00 H new ATOM 0 HA LYS A 6 3.339 -9.687 -1.615 1.00 0.00 H new ATOM 0 HB2 LYS A 6 4.414 -8.194 -3.311 1.00 0.00 H new ATOM 0 HB3 LYS A 6 5.782 -9.287 -3.384 1.00 0.00 H new ATOM 0 HG2 LYS A 6 4.456 -11.086 -4.258 1.00 0.00 H new ATOM 0 HG3 LYS A 6 2.951 -10.325 -3.781 1.00 0.00 H new ATOM 0 HD2 LYS A 6 3.464 -8.474 -5.500 1.00 0.00 H new ATOM 0 HD3 LYS A 6 4.790 -9.469 -6.067 1.00 0.00 H new ATOM 0 HE2 LYS A 6 3.257 -11.368 -6.477 1.00 0.00 H new ATOM 0 HE3 LYS A 6 1.919 -10.487 -5.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 1.835 -10.424 -8.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 2.078 -8.859 -7.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 3.375 -9.713 -8.245 1.00 0.00 H new ATOM 108 N THR A 7 3.924 -12.053 -1.343 1.00 0.00 N ATOM 109 CA THR A 7 4.159 -13.487 -1.093 1.00 0.00 C ATOM 110 C THR A 7 4.400 -14.270 -2.393 1.00 0.00 C ATOM 111 O THR A 7 4.113 -13.780 -3.489 1.00 0.00 O ATOM 112 CB THR A 7 2.982 -14.118 -0.321 1.00 0.00 C ATOM 113 OG1 THR A 7 1.891 -14.395 -1.175 1.00 0.00 O ATOM 114 CG2 THR A 7 2.444 -13.238 0.811 1.00 0.00 C ATOM 0 H THR A 7 2.933 -11.819 -1.399 1.00 0.00 H new ATOM 0 HA THR A 7 5.062 -13.551 -0.486 1.00 0.00 H new ATOM 0 HB THR A 7 3.400 -15.031 0.103 1.00 0.00 H new ATOM 0 HG1 THR A 7 1.163 -14.796 -0.656 1.00 0.00 H new ATOM 0 HG21 THR A 7 1.618 -13.748 1.307 1.00 0.00 H new ATOM 0 HG22 THR A 7 3.239 -13.047 1.532 1.00 0.00 H new ATOM 0 HG23 THR A 7 2.091 -12.292 0.400 1.00 0.00 H new ATOM 122 N LEU A 8 4.863 -15.525 -2.296 1.00 0.00 N ATOM 123 CA LEU A 8 4.966 -16.427 -3.459 1.00 0.00 C ATOM 124 C LEU A 8 3.603 -16.869 -4.017 1.00 0.00 C ATOM 125 O LEU A 8 3.487 -17.163 -5.207 1.00 0.00 O ATOM 126 CB LEU A 8 5.834 -17.650 -3.127 1.00 0.00 C ATOM 127 CG LEU A 8 7.274 -17.319 -2.705 1.00 0.00 C ATOM 128 CD1 LEU A 8 8.106 -18.597 -2.641 1.00 0.00 C ATOM 129 CD2 LEU A 8 8.001 -16.389 -3.671 1.00 0.00 C ATOM 0 H LEU A 8 5.175 -15.943 -1.419 1.00 0.00 H new ATOM 0 HA LEU A 8 5.446 -15.847 -4.247 1.00 0.00 H new ATOM 0 HB2 LEU A 8 5.355 -18.212 -2.325 1.00 0.00 H new ATOM 0 HB3 LEU A 8 5.866 -18.303 -3.999 1.00 0.00 H new ATOM 0 HG LEU A 8 7.180 -16.824 -1.738 1.00 0.00 H new ATOM 0 HD11 LEU A 8 9.125 -18.353 -2.341 1.00 0.00 H new ATOM 0 HD12 LEU A 8 7.668 -19.281 -1.914 1.00 0.00 H new ATOM 0 HD13 LEU A 8 8.120 -19.071 -3.622 1.00 0.00 H new ATOM 0 HD21 LEU A 8 9.011 -16.202 -3.305 1.00 0.00 H new ATOM 0 HD22 LEU A 8 8.052 -16.854 -4.655 1.00 0.00 H new ATOM 0 HD23 LEU A 8 7.461 -15.445 -3.743 1.00 0.00 H new ATOM 141 N GLN A 9 2.553 -16.841 -3.192 1.00 0.00 N ATOM 142 CA GLN A 9 1.161 -17.021 -3.627 1.00 0.00 C ATOM 143 C GLN A 9 0.582 -15.742 -4.280 1.00 0.00 C ATOM 144 O GLN A 9 -0.606 -15.681 -4.603 1.00 0.00 O ATOM 145 CB GLN A 9 0.307 -17.518 -2.449 1.00 0.00 C ATOM 146 CG GLN A 9 0.781 -18.889 -1.936 1.00 0.00 C ATOM 147 CD GLN A 9 0.801 -19.987 -3.003 1.00 0.00 C ATOM 148 OE1 GLN A 9 1.846 -20.515 -3.362 1.00 0.00 O ATOM 149 NE2 GLN A 9 -0.331 -20.370 -3.554 1.00 0.00 N ATOM 0 H GLN A 9 2.645 -16.690 -2.187 1.00 0.00 H new ATOM 0 HA GLN A 9 1.139 -17.782 -4.407 1.00 0.00 H new ATOM 0 HB2 GLN A 9 0.350 -16.792 -1.637 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -0.735 -17.587 -2.760 1.00 0.00 H new ATOM 0 HG2 GLN A 9 1.784 -18.782 -1.522 1.00 0.00 H new ATOM 0 HG3 GLN A 9 0.131 -19.203 -1.120 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -1.210 -19.940 -3.266 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -0.330 -21.097 -4.269 1.00 0.00 H new ATOM 158 N GLN A 10 1.424 -14.720 -4.484 1.00 0.00 N ATOM 159 CA GLN A 10 1.135 -13.402 -5.052 1.00 0.00 C ATOM 160 C GLN A 10 0.067 -12.601 -4.286 1.00 0.00 C ATOM 161 O GLN A 10 -0.659 -11.789 -4.867 1.00 0.00 O ATOM 162 CB GLN A 10 0.924 -13.484 -6.576 1.00 0.00 C ATOM 163 CG GLN A 10 2.181 -14.026 -7.282 1.00 0.00 C ATOM 164 CD GLN A 10 2.166 -13.792 -8.792 1.00 0.00 C ATOM 165 OE1 GLN A 10 1.826 -12.721 -9.284 1.00 0.00 O ATOM 166 NE2 GLN A 10 2.559 -14.765 -9.587 1.00 0.00 N ATOM 0 H GLN A 10 2.409 -14.805 -4.233 1.00 0.00 H new ATOM 0 HA GLN A 10 2.027 -12.792 -4.906 1.00 0.00 H new ATOM 0 HB2 GLN A 10 0.074 -14.130 -6.794 1.00 0.00 H new ATOM 0 HB3 GLN A 10 0.682 -12.496 -6.966 1.00 0.00 H new ATOM 0 HG2 GLN A 10 3.064 -13.551 -6.855 1.00 0.00 H new ATOM 0 HG3 GLN A 10 2.268 -15.095 -7.086 1.00 0.00 H new ATOM 0 HE21 GLN A 10 2.845 -15.661 -9.193 1.00 0.00 H new ATOM 0 HE22 GLN A 10 2.578 -14.622 -10.597 1.00 0.00 H new ATOM 175 N GLN A 11 0.015 -12.779 -2.964 1.00 0.00 N ATOM 176 CA GLN A 11 -0.777 -11.940 -2.061 1.00 0.00 C ATOM 177 C GLN A 11 0.080 -10.753 -1.613 1.00 0.00 C ATOM 178 O GLN A 11 1.303 -10.873 -1.529 1.00 0.00 O ATOM 179 CB GLN A 11 -1.270 -12.750 -0.855 1.00 0.00 C ATOM 180 CG GLN A 11 -2.153 -13.930 -1.284 1.00 0.00 C ATOM 181 CD GLN A 11 -2.830 -14.593 -0.085 1.00 0.00 C ATOM 182 OE1 GLN A 11 -3.800 -14.094 0.472 1.00 0.00 O ATOM 183 NE2 GLN A 11 -2.361 -15.739 0.364 1.00 0.00 N ATOM 0 H GLN A 11 0.528 -13.519 -2.484 1.00 0.00 H new ATOM 0 HA GLN A 11 -1.659 -11.572 -2.585 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -0.414 -13.122 -0.293 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -1.833 -12.099 -0.186 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -2.912 -13.581 -1.984 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -1.546 -14.666 -1.812 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -1.554 -16.171 -0.086 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -2.805 -16.194 1.162 1.00 0.00 H new ATOM 192 N THR A 12 -0.535 -9.602 -1.339 1.00 0.00 N ATOM 193 CA THR A 12 0.184 -8.369 -0.982 1.00 0.00 C ATOM 194 C THR A 12 -0.366 -7.718 0.284 1.00 0.00 C ATOM 195 O THR A 12 -1.577 -7.678 0.525 1.00 0.00 O ATOM 196 CB THR A 12 0.232 -7.354 -2.139 1.00 0.00 C ATOM 197 OG1 THR A 12 -1.056 -7.129 -2.680 1.00 0.00 O ATOM 198 CG2 THR A 12 1.144 -7.824 -3.275 1.00 0.00 C ATOM 0 H THR A 12 -1.549 -9.494 -1.357 1.00 0.00 H new ATOM 0 HA THR A 12 1.208 -8.679 -0.776 1.00 0.00 H new ATOM 0 HB THR A 12 0.627 -6.432 -1.713 1.00 0.00 H new ATOM 0 HG1 THR A 12 -0.995 -6.479 -3.411 1.00 0.00 H new ATOM 0 HG21 THR A 12 1.149 -7.078 -4.070 1.00 0.00 H new ATOM 0 HG22 THR A 12 2.157 -7.957 -2.897 1.00 0.00 H new ATOM 0 HG23 THR A 12 0.776 -8.772 -3.668 1.00 0.00 H new ATOM 206 N PHE A 13 0.557 -7.224 1.109 1.00 0.00 N ATOM 207 CA PHE A 13 0.341 -6.669 2.450 1.00 0.00 C ATOM 208 C PHE A 13 1.303 -5.495 2.697 1.00 0.00 C ATOM 209 O PHE A 13 2.124 -5.175 1.835 1.00 0.00 O ATOM 210 CB PHE A 13 0.546 -7.781 3.494 1.00 0.00 C ATOM 211 CG PHE A 13 -0.298 -9.025 3.282 1.00 0.00 C ATOM 212 CD1 PHE A 13 -1.677 -8.995 3.567 1.00 0.00 C ATOM 213 CD2 PHE A 13 0.281 -10.203 2.768 1.00 0.00 C ATOM 214 CE1 PHE A 13 -2.476 -10.127 3.321 1.00 0.00 C ATOM 215 CE2 PHE A 13 -0.517 -11.336 2.529 1.00 0.00 C ATOM 216 CZ PHE A 13 -1.897 -11.297 2.797 1.00 0.00 C ATOM 0 H PHE A 13 1.541 -7.198 0.843 1.00 0.00 H new ATOM 0 HA PHE A 13 -0.677 -6.290 2.534 1.00 0.00 H new ATOM 0 HB2 PHE A 13 1.597 -8.069 3.494 1.00 0.00 H new ATOM 0 HB3 PHE A 13 0.327 -7.376 4.482 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -2.123 -8.100 3.976 1.00 0.00 H new ATOM 0 HD2 PHE A 13 1.340 -10.235 2.557 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -3.534 -10.097 3.535 1.00 0.00 H new ATOM 0 HE2 PHE A 13 -0.069 -12.238 2.139 1.00 0.00 H new ATOM 0 HZ PHE A 13 -2.511 -12.164 2.601 1.00 0.00 H new ATOM 226 N LYS A 14 1.257 -4.866 3.875 1.00 0.00 N ATOM 227 CA LYS A 14 2.260 -3.878 4.317 1.00 0.00 C ATOM 228 C LYS A 14 2.804 -4.217 5.708 1.00 0.00 C ATOM 229 O LYS A 14 2.089 -4.772 6.544 1.00 0.00 O ATOM 230 CB LYS A 14 1.668 -2.458 4.277 1.00 0.00 C ATOM 231 CG LYS A 14 1.304 -2.039 2.845 1.00 0.00 C ATOM 232 CD LYS A 14 0.786 -0.601 2.786 1.00 0.00 C ATOM 233 CE LYS A 14 0.425 -0.279 1.332 1.00 0.00 C ATOM 234 NZ LYS A 14 -0.091 1.107 1.186 1.00 0.00 N ATOM 0 H LYS A 14 0.518 -5.026 4.559 1.00 0.00 H new ATOM 0 HA LYS A 14 3.102 -3.916 3.625 1.00 0.00 H new ATOM 0 HB2 LYS A 14 0.779 -2.416 4.906 1.00 0.00 H new ATOM 0 HB3 LYS A 14 2.387 -1.751 4.692 1.00 0.00 H new ATOM 0 HG2 LYS A 14 2.181 -2.136 2.204 1.00 0.00 H new ATOM 0 HG3 LYS A 14 0.545 -2.715 2.451 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -0.087 -0.485 3.429 1.00 0.00 H new ATOM 0 HD3 LYS A 14 1.545 0.091 3.151 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.305 -0.408 0.702 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -0.326 -0.986 0.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -0.324 1.287 0.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -0.945 1.222 1.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 0.635 1.783 1.499 1.00 0.00 H new ATOM 248 N ILE A 15 4.062 -3.854 5.956 1.00 0.00 N ATOM 249 CA ILE A 15 4.790 -4.019 7.220 1.00 0.00 C ATOM 250 C ILE A 15 5.425 -2.687 7.614 1.00 0.00 C ATOM 251 O ILE A 15 6.318 -2.175 6.943 1.00 0.00 O ATOM 252 CB ILE A 15 5.829 -5.160 7.127 1.00 0.00 C ATOM 253 CG1 ILE A 15 5.156 -6.548 7.109 1.00 0.00 C ATOM 254 CG2 ILE A 15 6.869 -5.094 8.257 1.00 0.00 C ATOM 255 CD1 ILE A 15 4.509 -7.004 8.428 1.00 0.00 C ATOM 0 H ILE A 15 4.637 -3.410 5.240 1.00 0.00 H new ATOM 0 HA ILE A 15 4.091 -4.310 8.004 1.00 0.00 H new ATOM 0 HB ILE A 15 6.350 -5.017 6.181 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.390 -6.548 6.333 1.00 0.00 H new ATOM 0 HG13 ILE A 15 5.903 -7.287 6.820 1.00 0.00 H new ATOM 0 HG21 ILE A 15 7.577 -5.916 8.149 1.00 0.00 H new ATOM 0 HG22 ILE A 15 7.403 -4.145 8.205 1.00 0.00 H new ATOM 0 HG23 ILE A 15 6.365 -5.174 9.220 1.00 0.00 H new ATOM 0 HD11 ILE A 15 4.069 -7.992 8.295 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.268 -7.047 9.209 1.00 0.00 H new ATOM 0 HD13 ILE A 15 3.732 -6.296 8.716 1.00 0.00 H new ATOM 267 N ASP A 16 4.934 -2.123 8.713 1.00 0.00 N ATOM 268 CA ASP A 16 5.520 -0.961 9.391 1.00 0.00 C ATOM 269 C ASP A 16 6.753 -1.394 10.217 1.00 0.00 C ATOM 270 O ASP A 16 6.627 -1.919 11.328 1.00 0.00 O ATOM 271 CB ASP A 16 4.443 -0.283 10.248 1.00 0.00 C ATOM 272 CG ASP A 16 4.835 1.125 10.734 1.00 0.00 C ATOM 273 OD1 ASP A 16 6.037 1.413 10.936 1.00 0.00 O ATOM 274 OD2 ASP A 16 3.917 1.970 10.875 1.00 0.00 O ATOM 0 H ASP A 16 4.092 -2.469 9.174 1.00 0.00 H new ATOM 0 HA ASP A 16 5.872 -0.232 8.661 1.00 0.00 H new ATOM 0 HB2 ASP A 16 3.521 -0.215 9.670 1.00 0.00 H new ATOM 0 HB3 ASP A 16 4.231 -0.911 11.114 1.00 0.00 H new ATOM 279 N ILE A 17 7.944 -1.224 9.643 1.00 0.00 N ATOM 280 CA ILE A 17 9.256 -1.620 10.184 1.00 0.00 C ATOM 281 C ILE A 17 10.184 -0.405 10.343 1.00 0.00 C ATOM 282 O ILE A 17 10.158 0.531 9.540 1.00 0.00 O ATOM 283 CB ILE A 17 9.875 -2.747 9.311 1.00 0.00 C ATOM 284 CG1 ILE A 17 11.297 -3.174 9.734 1.00 0.00 C ATOM 285 CG2 ILE A 17 9.910 -2.404 7.806 1.00 0.00 C ATOM 286 CD1 ILE A 17 11.393 -3.738 11.155 1.00 0.00 C ATOM 0 H ILE A 17 8.030 -0.778 8.730 1.00 0.00 H new ATOM 0 HA ILE A 17 9.121 -2.026 11.187 1.00 0.00 H new ATOM 0 HB ILE A 17 9.196 -3.582 9.484 1.00 0.00 H new ATOM 0 HG12 ILE A 17 11.661 -3.925 9.033 1.00 0.00 H new ATOM 0 HG13 ILE A 17 11.961 -2.313 9.652 1.00 0.00 H new ATOM 0 HG21 ILE A 17 10.354 -3.233 7.254 1.00 0.00 H new ATOM 0 HG22 ILE A 17 8.895 -2.232 7.448 1.00 0.00 H new ATOM 0 HG23 ILE A 17 10.506 -1.505 7.652 1.00 0.00 H new ATOM 0 HD11 ILE A 17 12.426 -4.012 11.369 1.00 0.00 H new ATOM 0 HD12 ILE A 17 11.063 -2.984 11.869 1.00 0.00 H new ATOM 0 HD13 ILE A 17 10.758 -4.620 11.240 1.00 0.00 H new ATOM 298 N ASP A 18 11.032 -0.413 11.375 1.00 0.00 N ATOM 299 CA ASP A 18 12.116 0.567 11.537 1.00 0.00 C ATOM 300 C ASP A 18 13.405 0.059 10.847 1.00 0.00 C ATOM 301 O ASP A 18 13.885 -1.026 11.194 1.00 0.00 O ATOM 302 CB ASP A 18 12.341 0.853 13.029 1.00 0.00 C ATOM 303 CG ASP A 18 11.334 1.878 13.575 1.00 0.00 C ATOM 304 OD1 ASP A 18 11.423 3.070 13.194 1.00 0.00 O ATOM 305 OD2 ASP A 18 10.463 1.506 14.399 1.00 0.00 O ATOM 0 H ASP A 18 10.988 -1.101 12.126 1.00 0.00 H new ATOM 0 HA ASP A 18 11.836 1.504 11.056 1.00 0.00 H new ATOM 0 HB2 ASP A 18 12.256 -0.076 13.593 1.00 0.00 H new ATOM 0 HB3 ASP A 18 13.355 1.225 13.178 1.00 0.00 H new ATOM 310 N PRO A 19 13.986 0.797 9.874 1.00 0.00 N ATOM 311 CA PRO A 19 15.078 0.301 9.022 1.00 0.00 C ATOM 312 C PRO A 19 16.359 -0.066 9.787 1.00 0.00 C ATOM 313 O PRO A 19 17.108 -0.950 9.360 1.00 0.00 O ATOM 314 CB PRO A 19 15.327 1.399 7.981 1.00 0.00 C ATOM 315 CG PRO A 19 14.786 2.666 8.637 1.00 0.00 C ATOM 316 CD PRO A 19 13.618 2.148 9.474 1.00 0.00 C ATOM 0 HA PRO A 19 14.784 -0.642 8.561 1.00 0.00 H new ATOM 0 HB2 PRO A 19 16.387 1.493 7.747 1.00 0.00 H new ATOM 0 HB3 PRO A 19 14.812 1.184 7.045 1.00 0.00 H new ATOM 0 HG2 PRO A 19 15.540 3.154 9.255 1.00 0.00 H new ATOM 0 HG3 PRO A 19 14.459 3.396 7.896 1.00 0.00 H new ATOM 0 HD2 PRO A 19 13.450 2.782 10.345 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.693 2.147 8.897 1.00 0.00 H new ATOM 324 N GLU A 20 16.597 0.583 10.930 1.00 0.00 N ATOM 325 CA GLU A 20 17.748 0.389 11.809 1.00 0.00 C ATOM 326 C GLU A 20 17.701 -0.915 12.630 1.00 0.00 C ATOM 327 O GLU A 20 18.739 -1.356 13.125 1.00 0.00 O ATOM 328 CB GLU A 20 17.817 1.590 12.768 1.00 0.00 C ATOM 329 CG GLU A 20 18.026 2.952 12.084 1.00 0.00 C ATOM 330 CD GLU A 20 19.351 3.019 11.300 1.00 0.00 C ATOM 331 OE1 GLU A 20 20.430 3.136 11.931 1.00 0.00 O ATOM 332 OE2 GLU A 20 19.324 2.965 10.046 1.00 0.00 O ATOM 0 H GLU A 20 15.957 1.294 11.283 1.00 0.00 H new ATOM 0 HA GLU A 20 18.632 0.312 11.176 1.00 0.00 H new ATOM 0 HB2 GLU A 20 16.894 1.628 13.347 1.00 0.00 H new ATOM 0 HB3 GLU A 20 18.630 1.426 13.475 1.00 0.00 H new ATOM 0 HG2 GLU A 20 17.195 3.146 11.405 1.00 0.00 H new ATOM 0 HG3 GLU A 20 18.013 3.740 12.837 1.00 0.00 H new ATOM 339 N GLU A 21 16.533 -1.562 12.777 1.00 0.00 N ATOM 340 CA GLU A 21 16.401 -2.812 13.555 1.00 0.00 C ATOM 341 C GLU A 21 16.939 -4.064 12.836 1.00 0.00 C ATOM 342 O GLU A 21 17.104 -5.121 13.446 1.00 0.00 O ATOM 343 CB GLU A 21 14.944 -3.054 13.977 1.00 0.00 C ATOM 344 CG GLU A 21 14.296 -1.945 14.796 1.00 0.00 C ATOM 345 CD GLU A 21 12.960 -2.410 15.417 1.00 0.00 C ATOM 346 OE1 GLU A 21 12.067 -2.908 14.687 1.00 0.00 O ATOM 347 OE2 GLU A 21 12.789 -2.285 16.654 1.00 0.00 O ATOM 0 H GLU A 21 15.658 -1.239 12.365 1.00 0.00 H new ATOM 0 HA GLU A 21 17.026 -2.659 14.435 1.00 0.00 H new ATOM 0 HB2 GLU A 21 14.347 -3.212 13.079 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.902 -3.978 14.554 1.00 0.00 H new ATOM 0 HG2 GLU A 21 14.976 -1.630 15.587 1.00 0.00 H new ATOM 0 HG3 GLU A 21 14.121 -1.076 14.161 1.00 0.00 H new ATOM 354 N THR A 22 17.248 -3.908 11.550 1.00 0.00 N ATOM 355 CA THR A 22 17.831 -4.830 10.545 1.00 0.00 C ATOM 356 C THR A 22 16.810 -5.774 9.896 1.00 0.00 C ATOM 357 O THR A 22 15.636 -5.809 10.264 1.00 0.00 O ATOM 358 CB THR A 22 19.082 -5.603 11.026 1.00 0.00 C ATOM 359 OG1 THR A 22 18.776 -6.555 12.013 1.00 0.00 O ATOM 360 CG2 THR A 22 20.167 -4.690 11.587 1.00 0.00 C ATOM 0 H THR A 22 17.073 -3.002 11.115 1.00 0.00 H new ATOM 0 HA THR A 22 18.175 -4.150 9.766 1.00 0.00 H new ATOM 0 HB THR A 22 19.454 -6.100 10.130 1.00 0.00 H new ATOM 0 HG1 THR A 22 18.462 -6.099 12.821 1.00 0.00 H new ATOM 0 HG21 THR A 22 21.018 -5.291 11.908 1.00 0.00 H new ATOM 0 HG22 THR A 22 20.487 -3.989 10.816 1.00 0.00 H new ATOM 0 HG23 THR A 22 19.772 -4.137 12.439 1.00 0.00 H new ATOM 368 N VAL A 23 17.235 -6.549 8.895 1.00 0.00 N ATOM 369 CA VAL A 23 16.379 -7.510 8.168 1.00 0.00 C ATOM 370 C VAL A 23 15.760 -8.565 9.097 1.00 0.00 C ATOM 371 O VAL A 23 14.608 -8.955 8.893 1.00 0.00 O ATOM 372 CB VAL A 23 17.194 -8.164 7.041 1.00 0.00 C ATOM 373 CG1 VAL A 23 16.501 -9.349 6.352 1.00 0.00 C ATOM 374 CG2 VAL A 23 17.540 -7.135 5.957 1.00 0.00 C ATOM 0 H VAL A 23 18.197 -6.532 8.556 1.00 0.00 H new ATOM 0 HA VAL A 23 15.541 -6.962 7.737 1.00 0.00 H new ATOM 0 HB VAL A 23 18.085 -8.547 7.538 1.00 0.00 H new ATOM 0 HG11 VAL A 23 17.150 -9.746 5.571 1.00 0.00 H new ATOM 0 HG12 VAL A 23 16.297 -10.128 7.086 1.00 0.00 H new ATOM 0 HG13 VAL A 23 15.563 -9.014 5.909 1.00 0.00 H new ATOM 0 HG21 VAL A 23 18.117 -7.618 5.168 1.00 0.00 H new ATOM 0 HG22 VAL A 23 16.621 -6.727 5.536 1.00 0.00 H new ATOM 0 HG23 VAL A 23 18.128 -6.329 6.395 1.00 0.00 H new ATOM 384 N LYS A 24 16.454 -8.988 10.165 1.00 0.00 N ATOM 385 CA LYS A 24 15.872 -9.897 11.170 1.00 0.00 C ATOM 386 C LYS A 24 14.665 -9.284 11.898 1.00 0.00 C ATOM 387 O LYS A 24 13.776 -10.018 12.323 1.00 0.00 O ATOM 388 CB LYS A 24 16.956 -10.427 12.131 1.00 0.00 C ATOM 389 CG LYS A 24 17.236 -9.525 13.347 1.00 0.00 C ATOM 390 CD LYS A 24 18.385 -10.052 14.220 1.00 0.00 C ATOM 391 CE LYS A 24 19.782 -9.866 13.608 1.00 0.00 C ATOM 392 NZ LYS A 24 20.219 -8.448 13.629 1.00 0.00 N ATOM 0 H LYS A 24 17.418 -8.716 10.357 1.00 0.00 H new ATOM 0 HA LYS A 24 15.471 -10.759 10.637 1.00 0.00 H new ATOM 0 HB2 LYS A 24 16.655 -11.412 12.488 1.00 0.00 H new ATOM 0 HB3 LYS A 24 17.883 -10.560 11.573 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.478 -8.520 13.001 1.00 0.00 H new ATOM 0 HG3 LYS A 24 16.332 -9.445 13.951 1.00 0.00 H new ATOM 0 HD2 LYS A 24 18.354 -9.546 15.185 1.00 0.00 H new ATOM 0 HD3 LYS A 24 18.223 -11.113 14.411 1.00 0.00 H new ATOM 0 HE2 LYS A 24 20.501 -10.474 14.157 1.00 0.00 H new ATOM 0 HE3 LYS A 24 19.777 -10.228 12.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 21.198 -8.381 13.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 19.597 -7.884 13.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 20.168 -8.083 14.602 1.00 0.00 H new ATOM 406 N ALA A 25 14.587 -7.954 11.997 1.00 0.00 N ATOM 407 CA ALA A 25 13.430 -7.239 12.532 1.00 0.00 C ATOM 408 C ALA A 25 12.277 -7.105 11.522 1.00 0.00 C ATOM 409 O ALA A 25 11.118 -7.153 11.922 1.00 0.00 O ATOM 410 CB ALA A 25 13.883 -5.887 13.067 1.00 0.00 C ATOM 0 H ALA A 25 15.342 -7.335 11.701 1.00 0.00 H new ATOM 0 HA ALA A 25 13.016 -7.830 13.349 1.00 0.00 H new ATOM 0 HB1 ALA A 25 13.024 -5.348 13.468 1.00 0.00 H new ATOM 0 HB2 ALA A 25 14.619 -6.036 13.857 1.00 0.00 H new ATOM 0 HB3 ALA A 25 14.330 -5.308 12.259 1.00 0.00 H new ATOM 416 N LEU A 26 12.544 -7.005 10.214 1.00 0.00 N ATOM 417 CA LEU A 26 11.491 -7.112 9.195 1.00 0.00 C ATOM 418 C LEU A 26 10.763 -8.456 9.374 1.00 0.00 C ATOM 419 O LEU A 26 9.549 -8.515 9.567 1.00 0.00 O ATOM 420 CB LEU A 26 12.131 -6.916 7.804 1.00 0.00 C ATOM 421 CG LEU A 26 11.216 -7.102 6.581 1.00 0.00 C ATOM 422 CD1 LEU A 26 9.842 -6.491 6.802 1.00 0.00 C ATOM 423 CD2 LEU A 26 11.843 -6.432 5.359 1.00 0.00 C ATOM 0 H LEU A 26 13.479 -6.850 9.836 1.00 0.00 H new ATOM 0 HA LEU A 26 10.733 -6.336 9.300 1.00 0.00 H new ATOM 0 HB2 LEU A 26 12.551 -5.911 7.763 1.00 0.00 H new ATOM 0 HB3 LEU A 26 12.964 -7.613 7.713 1.00 0.00 H new ATOM 0 HG LEU A 26 11.103 -8.175 6.424 1.00 0.00 H new ATOM 0 HD11 LEU A 26 9.228 -6.645 5.914 1.00 0.00 H new ATOM 0 HD12 LEU A 26 9.366 -6.967 7.659 1.00 0.00 H new ATOM 0 HD13 LEU A 26 9.945 -5.422 6.991 1.00 0.00 H new ATOM 0 HD21 LEU A 26 11.191 -6.567 4.496 1.00 0.00 H new ATOM 0 HD22 LEU A 26 11.972 -5.367 5.554 1.00 0.00 H new ATOM 0 HD23 LEU A 26 12.814 -6.884 5.155 1.00 0.00 H new ATOM 435 N LYS A 27 11.547 -9.531 9.434 1.00 0.00 N ATOM 436 CA LYS A 27 11.119 -10.888 9.810 1.00 0.00 C ATOM 437 C LYS A 27 10.392 -10.952 11.167 1.00 0.00 C ATOM 438 O LYS A 27 9.362 -11.616 11.246 1.00 0.00 O ATOM 439 CB LYS A 27 12.323 -11.841 9.733 1.00 0.00 C ATOM 440 CG LYS A 27 12.801 -12.020 8.278 1.00 0.00 C ATOM 441 CD LYS A 27 14.124 -12.787 8.135 1.00 0.00 C ATOM 442 CE LYS A 27 14.158 -14.076 8.965 1.00 0.00 C ATOM 443 NZ LYS A 27 15.211 -15.005 8.498 1.00 0.00 N ATOM 0 H LYS A 27 12.542 -9.484 9.213 1.00 0.00 H new ATOM 0 HA LYS A 27 10.367 -11.214 9.091 1.00 0.00 H new ATOM 0 HB2 LYS A 27 13.139 -11.450 10.341 1.00 0.00 H new ATOM 0 HB3 LYS A 27 12.050 -12.810 10.151 1.00 0.00 H new ATOM 0 HG2 LYS A 27 12.028 -12.545 7.716 1.00 0.00 H new ATOM 0 HG3 LYS A 27 12.914 -11.037 7.822 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.285 -13.032 7.085 1.00 0.00 H new ATOM 0 HD3 LYS A 27 14.947 -12.142 8.441 1.00 0.00 H new ATOM 0 HE2 LYS A 27 14.330 -13.829 10.013 1.00 0.00 H new ATOM 0 HE3 LYS A 27 13.188 -14.569 8.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 15.375 -15.735 9.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 14.907 -15.457 7.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 16.092 -14.477 8.333 1.00 0.00 H new ATOM 457 N GLU A 28 10.851 -10.255 12.214 1.00 0.00 N ATOM 458 CA GLU A 28 10.151 -10.175 13.518 1.00 0.00 C ATOM 459 C GLU A 28 8.742 -9.559 13.407 1.00 0.00 C ATOM 460 O GLU A 28 7.776 -10.105 13.944 1.00 0.00 O ATOM 461 CB GLU A 28 11.039 -9.542 14.618 1.00 0.00 C ATOM 462 CG GLU A 28 10.820 -8.066 15.024 1.00 0.00 C ATOM 463 CD GLU A 28 9.846 -7.810 16.196 1.00 0.00 C ATOM 464 OE1 GLU A 28 9.242 -8.755 16.757 1.00 0.00 O ATOM 465 OE2 GLU A 28 9.691 -6.619 16.566 1.00 0.00 O ATOM 0 H GLU A 28 11.722 -9.725 12.188 1.00 0.00 H new ATOM 0 HA GLU A 28 9.972 -11.199 13.846 1.00 0.00 H new ATOM 0 HB2 GLU A 28 10.925 -10.147 15.517 1.00 0.00 H new ATOM 0 HB3 GLU A 28 12.076 -9.641 14.297 1.00 0.00 H new ATOM 0 HG2 GLU A 28 11.787 -7.637 15.285 1.00 0.00 H new ATOM 0 HG3 GLU A 28 10.455 -7.523 14.152 1.00 0.00 H new ATOM 472 N LYS A 29 8.596 -8.470 12.640 1.00 0.00 N ATOM 473 CA LYS A 29 7.300 -7.850 12.316 1.00 0.00 C ATOM 474 C LYS A 29 6.397 -8.788 11.511 1.00 0.00 C ATOM 475 O LYS A 29 5.226 -8.929 11.853 1.00 0.00 O ATOM 476 CB LYS A 29 7.508 -6.516 11.575 1.00 0.00 C ATOM 477 CG LYS A 29 7.510 -5.280 12.485 1.00 0.00 C ATOM 478 CD LYS A 29 8.628 -5.279 13.538 1.00 0.00 C ATOM 479 CE LYS A 29 8.562 -4.029 14.421 1.00 0.00 C ATOM 480 NZ LYS A 29 9.637 -4.036 15.445 1.00 0.00 N ATOM 0 H LYS A 29 9.388 -7.985 12.219 1.00 0.00 H new ATOM 0 HA LYS A 29 6.791 -7.649 13.259 1.00 0.00 H new ATOM 0 HB2 LYS A 29 8.455 -6.557 11.036 1.00 0.00 H new ATOM 0 HB3 LYS A 29 6.721 -6.402 10.829 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.607 -4.387 11.867 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.548 -5.214 12.992 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.545 -6.170 14.160 1.00 0.00 H new ATOM 0 HD3 LYS A 29 9.597 -5.325 13.042 1.00 0.00 H new ATOM 0 HE2 LYS A 29 8.653 -3.137 13.801 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.590 -3.978 14.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.375 -3.403 16.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 9.764 -5.002 15.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 10.526 -3.708 15.017 1.00 0.00 H new ATOM 494 N ILE A 30 6.924 -9.446 10.476 1.00 0.00 N ATOM 495 CA ILE A 30 6.202 -10.443 9.664 1.00 0.00 C ATOM 496 C ILE A 30 5.687 -11.595 10.544 1.00 0.00 C ATOM 497 O ILE A 30 4.500 -11.913 10.498 1.00 0.00 O ATOM 498 CB ILE A 30 7.091 -10.938 8.500 1.00 0.00 C ATOM 499 CG1 ILE A 30 7.336 -9.798 7.486 1.00 0.00 C ATOM 500 CG2 ILE A 30 6.462 -12.136 7.768 1.00 0.00 C ATOM 501 CD1 ILE A 30 8.565 -10.045 6.605 1.00 0.00 C ATOM 0 H ILE A 30 7.885 -9.301 10.168 1.00 0.00 H new ATOM 0 HA ILE A 30 5.325 -9.971 9.220 1.00 0.00 H new ATOM 0 HB ILE A 30 8.038 -11.258 8.935 1.00 0.00 H new ATOM 0 HG12 ILE A 30 6.456 -9.686 6.852 1.00 0.00 H new ATOM 0 HG13 ILE A 30 7.463 -8.859 8.025 1.00 0.00 H new ATOM 0 HG21 ILE A 30 7.118 -12.453 6.958 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.327 -12.960 8.468 1.00 0.00 H new ATOM 0 HG23 ILE A 30 5.495 -11.845 7.359 1.00 0.00 H new ATOM 0 HD11 ILE A 30 8.689 -9.213 5.912 1.00 0.00 H new ATOM 0 HD12 ILE A 30 9.452 -10.129 7.233 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.430 -10.969 6.042 1.00 0.00 H new ATOM 513 N GLU A 31 6.542 -12.182 11.384 1.00 0.00 N ATOM 514 CA GLU A 31 6.176 -13.210 12.369 1.00 0.00 C ATOM 515 C GLU A 31 5.045 -12.739 13.303 1.00 0.00 C ATOM 516 O GLU A 31 4.031 -13.428 13.446 1.00 0.00 O ATOM 517 CB GLU A 31 7.437 -13.626 13.146 1.00 0.00 C ATOM 518 CG GLU A 31 7.182 -14.747 14.164 1.00 0.00 C ATOM 519 CD GLU A 31 7.314 -14.260 15.621 1.00 0.00 C ATOM 520 OE1 GLU A 31 6.304 -13.806 16.210 1.00 0.00 O ATOM 521 OE2 GLU A 31 8.426 -14.353 16.196 1.00 0.00 O ATOM 0 H GLU A 31 7.535 -11.951 11.401 1.00 0.00 H new ATOM 0 HA GLU A 31 5.780 -14.080 11.846 1.00 0.00 H new ATOM 0 HB2 GLU A 31 8.199 -13.953 12.439 1.00 0.00 H new ATOM 0 HB3 GLU A 31 7.838 -12.756 13.667 1.00 0.00 H new ATOM 0 HG2 GLU A 31 6.183 -15.154 14.009 1.00 0.00 H new ATOM 0 HG3 GLU A 31 7.888 -15.559 13.990 1.00 0.00 H new ATOM 528 N SER A 32 5.188 -11.548 13.895 1.00 0.00 N ATOM 529 CA SER A 32 4.198 -10.935 14.791 1.00 0.00 C ATOM 530 C SER A 32 2.839 -10.695 14.108 1.00 0.00 C ATOM 531 O SER A 32 1.792 -11.053 14.652 1.00 0.00 O ATOM 532 CB SER A 32 4.766 -9.618 15.339 1.00 0.00 C ATOM 533 OG SER A 32 3.916 -9.054 16.326 1.00 0.00 O ATOM 0 H SER A 32 6.016 -10.968 13.762 1.00 0.00 H new ATOM 0 HA SER A 32 4.009 -11.633 15.606 1.00 0.00 H new ATOM 0 HB2 SER A 32 5.753 -9.796 15.766 1.00 0.00 H new ATOM 0 HB3 SER A 32 4.896 -8.909 14.521 1.00 0.00 H new ATOM 0 HG SER A 32 4.307 -8.218 16.655 1.00 0.00 H new ATOM 539 N GLU A 33 2.840 -10.107 12.908 1.00 0.00 N ATOM 540 CA GLU A 33 1.643 -9.761 12.131 1.00 0.00 C ATOM 541 C GLU A 33 0.918 -10.999 11.573 1.00 0.00 C ATOM 542 O GLU A 33 -0.289 -11.159 11.772 1.00 0.00 O ATOM 543 CB GLU A 33 2.054 -8.817 10.984 1.00 0.00 C ATOM 544 CG GLU A 33 0.879 -8.220 10.195 1.00 0.00 C ATOM 545 CD GLU A 33 -0.063 -7.358 11.063 1.00 0.00 C ATOM 546 OE1 GLU A 33 0.413 -6.430 11.760 1.00 0.00 O ATOM 547 OE2 GLU A 33 -1.296 -7.592 11.041 1.00 0.00 O ATOM 0 H GLU A 33 3.705 -9.849 12.433 1.00 0.00 H new ATOM 0 HA GLU A 33 0.937 -9.267 12.799 1.00 0.00 H new ATOM 0 HB2 GLU A 33 2.649 -8.002 11.397 1.00 0.00 H new ATOM 0 HB3 GLU A 33 2.697 -9.363 10.294 1.00 0.00 H new ATOM 0 HG2 GLU A 33 1.270 -7.611 9.380 1.00 0.00 H new ATOM 0 HG3 GLU A 33 0.306 -9.029 9.742 1.00 0.00 H new ATOM 554 N LYS A 34 1.642 -11.863 10.847 1.00 0.00 N ATOM 555 CA LYS A 34 1.081 -12.978 10.063 1.00 0.00 C ATOM 556 C LYS A 34 0.928 -14.291 10.845 1.00 0.00 C ATOM 557 O LYS A 34 0.194 -15.180 10.407 1.00 0.00 O ATOM 558 CB LYS A 34 1.942 -13.208 8.807 1.00 0.00 C ATOM 559 CG LYS A 34 2.189 -11.970 7.923 1.00 0.00 C ATOM 560 CD LYS A 34 0.908 -11.270 7.448 1.00 0.00 C ATOM 561 CE LYS A 34 0.072 -12.170 6.527 1.00 0.00 C ATOM 562 NZ LYS A 34 -1.148 -11.473 6.045 1.00 0.00 N ATOM 0 H LYS A 34 2.659 -11.806 10.786 1.00 0.00 H new ATOM 0 HA LYS A 34 0.069 -12.679 9.791 1.00 0.00 H new ATOM 0 HB2 LYS A 34 2.908 -13.605 9.120 1.00 0.00 H new ATOM 0 HB3 LYS A 34 1.464 -13.975 8.198 1.00 0.00 H new ATOM 0 HG2 LYS A 34 2.795 -11.255 8.480 1.00 0.00 H new ATOM 0 HG3 LYS A 34 2.770 -12.270 7.051 1.00 0.00 H new ATOM 0 HD2 LYS A 34 0.311 -10.980 8.312 1.00 0.00 H new ATOM 0 HD3 LYS A 34 1.170 -10.353 6.920 1.00 0.00 H new ATOM 0 HE2 LYS A 34 0.676 -12.480 5.674 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -0.213 -13.076 7.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -1.992 -11.989 6.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -1.168 -10.505 6.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -1.139 -11.436 5.006 1.00 0.00 H new ATOM 576 N GLY A 35 1.584 -14.402 12.000 1.00 0.00 N ATOM 577 CA GLY A 35 1.563 -15.562 12.901 1.00 0.00 C ATOM 578 C GLY A 35 2.724 -16.533 12.651 1.00 0.00 C ATOM 579 O GLY A 35 2.871 -17.062 11.544 1.00 0.00 O ATOM 0 H GLY A 35 2.175 -13.649 12.353 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.602 -15.215 13.933 1.00 0.00 H new ATOM 0 HA3 GLY A 35 0.619 -16.093 12.779 1.00 0.00 H new ATOM 583 N LYS A 36 3.538 -16.800 13.685 1.00 0.00 N ATOM 584 CA LYS A 36 4.791 -17.583 13.605 1.00 0.00 C ATOM 585 C LYS A 36 4.640 -18.965 12.959 1.00 0.00 C ATOM 586 O LYS A 36 5.566 -19.443 12.314 1.00 0.00 O ATOM 587 CB LYS A 36 5.470 -17.670 14.997 1.00 0.00 C ATOM 588 CG LYS A 36 5.220 -18.997 15.731 1.00 0.00 C ATOM 589 CD LYS A 36 5.708 -19.012 17.184 1.00 0.00 C ATOM 590 CE LYS A 36 5.637 -20.427 17.786 1.00 0.00 C ATOM 591 NZ LYS A 36 4.256 -20.982 17.825 1.00 0.00 N ATOM 0 H LYS A 36 3.340 -16.469 14.629 1.00 0.00 H new ATOM 0 HA LYS A 36 5.442 -17.033 12.925 1.00 0.00 H new ATOM 0 HB2 LYS A 36 6.544 -17.530 14.876 1.00 0.00 H new ATOM 0 HB3 LYS A 36 5.110 -16.850 15.618 1.00 0.00 H new ATOM 0 HG2 LYS A 36 4.152 -19.212 15.716 1.00 0.00 H new ATOM 0 HG3 LYS A 36 5.715 -19.800 15.185 1.00 0.00 H new ATOM 0 HD2 LYS A 36 6.734 -18.647 17.228 1.00 0.00 H new ATOM 0 HD3 LYS A 36 5.101 -18.330 17.780 1.00 0.00 H new ATOM 0 HE2 LYS A 36 6.273 -21.094 17.204 1.00 0.00 H new ATOM 0 HE3 LYS A 36 6.041 -20.404 18.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 4.249 -21.856 18.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 3.614 -20.286 18.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 3.939 -21.192 16.857 1.00 0.00 H new ATOM 605 N ASP A 37 3.493 -19.618 13.140 1.00 0.00 N ATOM 606 CA ASP A 37 3.282 -21.006 12.706 1.00 0.00 C ATOM 607 C ASP A 37 3.303 -21.147 11.177 1.00 0.00 C ATOM 608 O ASP A 37 3.773 -22.158 10.649 1.00 0.00 O ATOM 609 CB ASP A 37 1.944 -21.523 13.241 1.00 0.00 C ATOM 610 CG ASP A 37 1.844 -21.502 14.780 1.00 0.00 C ATOM 611 OD1 ASP A 37 2.871 -21.694 15.478 1.00 0.00 O ATOM 612 OD2 ASP A 37 0.726 -21.279 15.303 1.00 0.00 O ATOM 0 H ASP A 37 2.679 -19.202 13.593 1.00 0.00 H new ATOM 0 HA ASP A 37 4.105 -21.597 13.109 1.00 0.00 H new ATOM 0 HB2 ASP A 37 1.138 -20.919 12.825 1.00 0.00 H new ATOM 0 HB3 ASP A 37 1.792 -22.543 12.889 1.00 0.00 H new ATOM 617 N ALA A 38 2.823 -20.117 10.470 1.00 0.00 N ATOM 618 CA ALA A 38 2.865 -20.019 9.015 1.00 0.00 C ATOM 619 C ALA A 38 4.021 -19.124 8.503 1.00 0.00 C ATOM 620 O ALA A 38 4.496 -19.310 7.380 1.00 0.00 O ATOM 621 CB ALA A 38 1.497 -19.520 8.534 1.00 0.00 C ATOM 0 H ALA A 38 2.384 -19.309 10.911 1.00 0.00 H new ATOM 0 HA ALA A 38 3.071 -21.005 8.598 1.00 0.00 H new ATOM 0 HB1 ALA A 38 1.501 -19.438 7.447 1.00 0.00 H new ATOM 0 HB2 ALA A 38 0.724 -20.224 8.841 1.00 0.00 H new ATOM 0 HB3 ALA A 38 1.292 -18.543 8.971 1.00 0.00 H new ATOM 627 N PHE A 39 4.495 -18.183 9.330 1.00 0.00 N ATOM 628 CA PHE A 39 5.529 -17.186 9.023 1.00 0.00 C ATOM 629 C PHE A 39 6.614 -17.128 10.131 1.00 0.00 C ATOM 630 O PHE A 39 6.690 -16.146 10.876 1.00 0.00 O ATOM 631 CB PHE A 39 4.835 -15.826 8.799 1.00 0.00 C ATOM 632 CG PHE A 39 4.049 -15.701 7.503 1.00 0.00 C ATOM 633 CD1 PHE A 39 2.735 -16.198 7.418 1.00 0.00 C ATOM 634 CD2 PHE A 39 4.614 -15.051 6.388 1.00 0.00 C ATOM 635 CE1 PHE A 39 1.999 -16.065 6.226 1.00 0.00 C ATOM 636 CE2 PHE A 39 3.879 -14.912 5.197 1.00 0.00 C ATOM 637 CZ PHE A 39 2.572 -15.422 5.114 1.00 0.00 C ATOM 0 H PHE A 39 4.148 -18.092 10.285 1.00 0.00 H new ATOM 0 HA PHE A 39 6.060 -17.466 8.114 1.00 0.00 H new ATOM 0 HB2 PHE A 39 4.159 -15.640 9.634 1.00 0.00 H new ATOM 0 HB3 PHE A 39 5.592 -15.042 8.822 1.00 0.00 H new ATOM 0 HD1 PHE A 39 2.289 -16.684 8.273 1.00 0.00 H new ATOM 0 HD2 PHE A 39 5.618 -14.657 6.448 1.00 0.00 H new ATOM 0 HE1 PHE A 39 0.994 -16.457 6.165 1.00 0.00 H new ATOM 0 HE2 PHE A 39 4.319 -14.413 4.346 1.00 0.00 H new ATOM 0 HZ PHE A 39 2.009 -15.320 4.198 1.00 0.00 H new ATOM 647 N PRO A 40 7.447 -18.176 10.303 1.00 0.00 N ATOM 648 CA PRO A 40 8.444 -18.235 11.377 1.00 0.00 C ATOM 649 C PRO A 40 9.712 -17.444 11.017 1.00 0.00 C ATOM 650 O PRO A 40 10.239 -17.591 9.913 1.00 0.00 O ATOM 651 CB PRO A 40 8.782 -19.728 11.509 1.00 0.00 C ATOM 652 CG PRO A 40 8.586 -20.271 10.091 1.00 0.00 C ATOM 653 CD PRO A 40 7.431 -19.425 9.551 1.00 0.00 C ATOM 0 HA PRO A 40 8.062 -17.798 12.300 1.00 0.00 H new ATOM 0 HB2 PRO A 40 9.804 -19.878 11.858 1.00 0.00 H new ATOM 0 HB3 PRO A 40 8.125 -20.226 12.223 1.00 0.00 H new ATOM 0 HG2 PRO A 40 9.486 -20.156 9.487 1.00 0.00 H new ATOM 0 HG3 PRO A 40 8.340 -21.333 10.097 1.00 0.00 H new ATOM 0 HD2 PRO A 40 7.553 -19.237 8.484 1.00 0.00 H new ATOM 0 HD3 PRO A 40 6.480 -19.942 9.677 1.00 0.00 H new ATOM 661 N VAL A 41 10.297 -16.700 11.966 1.00 0.00 N ATOM 662 CA VAL A 41 11.599 -16.007 11.783 1.00 0.00 C ATOM 663 C VAL A 41 12.680 -16.966 11.277 1.00 0.00 C ATOM 664 O VAL A 41 13.397 -16.661 10.324 1.00 0.00 O ATOM 665 CB VAL A 41 12.076 -15.333 13.089 1.00 0.00 C ATOM 666 CG1 VAL A 41 13.466 -14.696 12.953 1.00 0.00 C ATOM 667 CG2 VAL A 41 11.098 -14.240 13.524 1.00 0.00 C ATOM 0 H VAL A 41 9.887 -16.556 12.889 1.00 0.00 H new ATOM 0 HA VAL A 41 11.436 -15.234 11.032 1.00 0.00 H new ATOM 0 HB VAL A 41 12.125 -16.128 13.833 1.00 0.00 H new ATOM 0 HG11 VAL A 41 13.750 -14.237 13.900 1.00 0.00 H new ATOM 0 HG12 VAL A 41 14.194 -15.463 12.688 1.00 0.00 H new ATOM 0 HG13 VAL A 41 13.442 -13.934 12.174 1.00 0.00 H new ATOM 0 HG21 VAL A 41 11.454 -13.779 14.445 1.00 0.00 H new ATOM 0 HG22 VAL A 41 11.028 -13.483 12.743 1.00 0.00 H new ATOM 0 HG23 VAL A 41 10.115 -14.678 13.694 1.00 0.00 H new ATOM 677 N ALA A 42 12.772 -18.147 11.891 1.00 0.00 N ATOM 678 CA ALA A 42 13.768 -19.172 11.576 1.00 0.00 C ATOM 679 C ALA A 42 13.584 -19.878 10.205 1.00 0.00 C ATOM 680 O ALA A 42 14.406 -20.727 9.852 1.00 0.00 O ATOM 681 CB ALA A 42 13.777 -20.185 12.729 1.00 0.00 C ATOM 0 H ALA A 42 12.139 -18.424 12.641 1.00 0.00 H new ATOM 0 HA ALA A 42 14.730 -18.670 11.475 1.00 0.00 H new ATOM 0 HB1 ALA A 42 14.511 -20.964 12.523 1.00 0.00 H new ATOM 0 HB2 ALA A 42 14.037 -19.677 13.658 1.00 0.00 H new ATOM 0 HB3 ALA A 42 12.789 -20.635 12.826 1.00 0.00 H new ATOM 687 N GLY A 43 12.527 -19.555 9.443 1.00 0.00 N ATOM 688 CA GLY A 43 12.246 -20.066 8.088 1.00 0.00 C ATOM 689 C GLY A 43 11.984 -18.991 7.021 1.00 0.00 C ATOM 690 O GLY A 43 12.051 -19.280 5.829 1.00 0.00 O ATOM 0 H GLY A 43 11.813 -18.903 9.767 1.00 0.00 H new ATOM 0 HA2 GLY A 43 13.090 -20.676 7.766 1.00 0.00 H new ATOM 0 HA3 GLY A 43 11.378 -20.723 8.138 1.00 0.00 H new ATOM 694 N GLN A 44 11.686 -17.750 7.407 1.00 0.00 N ATOM 695 CA GLN A 44 11.431 -16.643 6.479 1.00 0.00 C ATOM 696 C GLN A 44 12.691 -16.232 5.693 1.00 0.00 C ATOM 697 O GLN A 44 13.774 -16.077 6.270 1.00 0.00 O ATOM 698 CB GLN A 44 10.902 -15.443 7.282 1.00 0.00 C ATOM 699 CG GLN A 44 9.840 -14.641 6.526 1.00 0.00 C ATOM 700 CD GLN A 44 8.494 -15.356 6.570 1.00 0.00 C ATOM 701 OE1 GLN A 44 7.827 -15.406 7.590 1.00 0.00 O ATOM 702 NE2 GLN A 44 8.049 -15.956 5.490 1.00 0.00 N ATOM 0 H GLN A 44 11.613 -17.479 8.388 1.00 0.00 H new ATOM 0 HA GLN A 44 10.695 -16.975 5.747 1.00 0.00 H new ATOM 0 HB2 GLN A 44 10.480 -15.799 8.222 1.00 0.00 H new ATOM 0 HB3 GLN A 44 11.734 -14.786 7.535 1.00 0.00 H new ATOM 0 HG2 GLN A 44 9.745 -13.648 6.966 1.00 0.00 H new ATOM 0 HG3 GLN A 44 10.150 -14.502 5.490 1.00 0.00 H new ATOM 0 HE21 GLN A 44 8.594 -15.925 4.628 1.00 0.00 H new ATOM 0 HE22 GLN A 44 7.159 -16.453 5.513 1.00 0.00 H new ATOM 711 N LYS A 45 12.535 -15.982 4.390 1.00 0.00 N ATOM 712 CA LYS A 45 13.540 -15.361 3.510 1.00 0.00 C ATOM 713 C LYS A 45 12.954 -14.092 2.903 1.00 0.00 C ATOM 714 O LYS A 45 11.747 -13.996 2.667 1.00 0.00 O ATOM 715 CB LYS A 45 14.012 -16.312 2.401 1.00 0.00 C ATOM 716 CG LYS A 45 14.727 -17.579 2.877 1.00 0.00 C ATOM 717 CD LYS A 45 16.092 -17.320 3.525 1.00 0.00 C ATOM 718 CE LYS A 45 16.768 -18.669 3.796 1.00 0.00 C ATOM 719 NZ LYS A 45 18.123 -18.496 4.382 1.00 0.00 N ATOM 0 H LYS A 45 11.673 -16.214 3.896 1.00 0.00 H new ATOM 0 HA LYS A 45 14.415 -15.121 4.113 1.00 0.00 H new ATOM 0 HB2 LYS A 45 13.147 -16.606 1.807 1.00 0.00 H new ATOM 0 HB3 LYS A 45 14.683 -15.765 1.739 1.00 0.00 H new ATOM 0 HG2 LYS A 45 14.089 -18.096 3.593 1.00 0.00 H new ATOM 0 HG3 LYS A 45 14.861 -18.249 2.028 1.00 0.00 H new ATOM 0 HD2 LYS A 45 16.713 -16.711 2.868 1.00 0.00 H new ATOM 0 HD3 LYS A 45 15.970 -16.764 4.455 1.00 0.00 H new ATOM 0 HE2 LYS A 45 16.150 -19.256 4.475 1.00 0.00 H new ATOM 0 HE3 LYS A 45 16.843 -19.232 2.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 18.550 -19.429 4.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 18.720 -17.957 3.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 18.049 -17.980 5.282 1.00 0.00 H new ATOM 733 N LEU A 46 13.835 -13.134 2.645 1.00 0.00 N ATOM 734 CA LEU A 46 13.528 -11.761 2.265 1.00 0.00 C ATOM 735 C LEU A 46 14.381 -11.365 1.057 1.00 0.00 C ATOM 736 O LEU A 46 15.602 -11.495 1.109 1.00 0.00 O ATOM 737 CB LEU A 46 13.795 -10.855 3.493 1.00 0.00 C ATOM 738 CG LEU A 46 12.584 -10.052 3.982 1.00 0.00 C ATOM 739 CD1 LEU A 46 12.062 -9.130 2.888 1.00 0.00 C ATOM 740 CD2 LEU A 46 11.448 -10.949 4.472 1.00 0.00 C ATOM 0 H LEU A 46 14.839 -13.304 2.698 1.00 0.00 H new ATOM 0 HA LEU A 46 12.484 -11.651 1.971 1.00 0.00 H new ATOM 0 HB2 LEU A 46 14.155 -11.477 4.313 1.00 0.00 H new ATOM 0 HB3 LEU A 46 14.597 -10.160 3.245 1.00 0.00 H new ATOM 0 HG LEU A 46 12.933 -9.457 4.826 1.00 0.00 H new ATOM 0 HD11 LEU A 46 11.203 -8.572 3.261 1.00 0.00 H new ATOM 0 HD12 LEU A 46 12.847 -8.433 2.594 1.00 0.00 H new ATOM 0 HD13 LEU A 46 11.762 -9.724 2.025 1.00 0.00 H new ATOM 0 HD21 LEU A 46 10.615 -10.331 4.807 1.00 0.00 H new ATOM 0 HD22 LEU A 46 11.117 -11.594 3.658 1.00 0.00 H new ATOM 0 HD23 LEU A 46 11.801 -11.563 5.301 1.00 0.00 H new ATOM 752 N ILE A 47 13.751 -10.925 -0.033 1.00 0.00 N ATOM 753 CA ILE A 47 14.382 -10.706 -1.342 1.00 0.00 C ATOM 754 C ILE A 47 13.993 -9.329 -1.903 1.00 0.00 C ATOM 755 O ILE A 47 12.809 -9.049 -2.109 1.00 0.00 O ATOM 756 CB ILE A 47 14.018 -11.878 -2.290 1.00 0.00 C ATOM 757 CG1 ILE A 47 14.515 -13.250 -1.762 1.00 0.00 C ATOM 758 CG2 ILE A 47 14.617 -11.720 -3.690 1.00 0.00 C ATOM 759 CD1 ILE A 47 13.396 -14.101 -1.177 1.00 0.00 C ATOM 0 H ILE A 47 12.755 -10.703 -0.033 1.00 0.00 H new ATOM 0 HA ILE A 47 15.467 -10.696 -1.241 1.00 0.00 H new ATOM 0 HB ILE A 47 12.929 -11.849 -2.333 1.00 0.00 H new ATOM 0 HG12 ILE A 47 14.992 -13.796 -2.576 1.00 0.00 H new ATOM 0 HG13 ILE A 47 15.276 -13.086 -0.999 1.00 0.00 H new ATOM 0 HG21 ILE A 47 14.328 -12.570 -4.308 1.00 0.00 H new ATOM 0 HG22 ILE A 47 14.247 -10.800 -4.143 1.00 0.00 H new ATOM 0 HG23 ILE A 47 15.704 -11.677 -3.618 1.00 0.00 H new ATOM 0 HD11 ILE A 47 13.805 -15.048 -0.825 1.00 0.00 H new ATOM 0 HD12 ILE A 47 12.935 -13.572 -0.343 1.00 0.00 H new ATOM 0 HD13 ILE A 47 12.646 -14.293 -1.944 1.00 0.00 H new ATOM 771 N TYR A 48 14.989 -8.471 -2.160 1.00 0.00 N ATOM 772 CA TYR A 48 14.824 -7.205 -2.891 1.00 0.00 C ATOM 773 C TYR A 48 15.820 -7.089 -4.047 1.00 0.00 C ATOM 774 O TYR A 48 16.936 -7.603 -3.964 1.00 0.00 O ATOM 775 CB TYR A 48 14.912 -5.986 -1.963 1.00 0.00 C ATOM 776 CG TYR A 48 14.434 -4.692 -2.607 1.00 0.00 C ATOM 777 CD1 TYR A 48 13.100 -4.570 -3.046 1.00 0.00 C ATOM 778 CD2 TYR A 48 15.326 -3.614 -2.781 1.00 0.00 C ATOM 779 CE1 TYR A 48 12.658 -3.380 -3.655 1.00 0.00 C ATOM 780 CE2 TYR A 48 14.885 -2.417 -3.380 1.00 0.00 C ATOM 781 CZ TYR A 48 13.548 -2.297 -3.821 1.00 0.00 C ATOM 782 OH TYR A 48 13.110 -1.146 -4.401 1.00 0.00 O ATOM 0 H TYR A 48 15.950 -8.639 -1.861 1.00 0.00 H new ATOM 0 HA TYR A 48 13.820 -7.217 -3.315 1.00 0.00 H new ATOM 0 HB2 TYR A 48 14.319 -6.177 -1.069 1.00 0.00 H new ATOM 0 HB3 TYR A 48 15.945 -5.861 -1.639 1.00 0.00 H new ATOM 0 HD1 TYR A 48 12.414 -5.393 -2.915 1.00 0.00 H new ATOM 0 HD2 TYR A 48 16.351 -3.706 -2.454 1.00 0.00 H new ATOM 0 HE1 TYR A 48 11.637 -3.296 -3.996 1.00 0.00 H new ATOM 0 HE2 TYR A 48 15.570 -1.591 -3.502 1.00 0.00 H new ATOM 0 HH TYR A 48 13.845 -0.499 -4.440 1.00 0.00 H new ATOM 792 N ALA A 49 15.418 -6.421 -5.134 1.00 0.00 N ATOM 793 CA ALA A 49 16.192 -6.287 -6.371 1.00 0.00 C ATOM 794 C ALA A 49 16.714 -7.632 -6.946 1.00 0.00 C ATOM 795 O ALA A 49 17.740 -7.676 -7.629 1.00 0.00 O ATOM 796 CB ALA A 49 17.279 -5.235 -6.112 1.00 0.00 C ATOM 0 H ALA A 49 14.517 -5.944 -5.177 1.00 0.00 H new ATOM 0 HA ALA A 49 15.544 -5.945 -7.178 1.00 0.00 H new ATOM 0 HB1 ALA A 49 17.880 -5.104 -7.012 1.00 0.00 H new ATOM 0 HB2 ALA A 49 16.812 -4.287 -5.847 1.00 0.00 H new ATOM 0 HB3 ALA A 49 17.918 -5.566 -5.293 1.00 0.00 H new ATOM 802 N GLY A 50 16.020 -8.740 -6.651 1.00 0.00 N ATOM 803 CA GLY A 50 16.415 -10.107 -7.014 1.00 0.00 C ATOM 804 C GLY A 50 17.581 -10.689 -6.197 1.00 0.00 C ATOM 805 O GLY A 50 18.203 -11.654 -6.641 1.00 0.00 O ATOM 0 H GLY A 50 15.140 -8.708 -6.136 1.00 0.00 H new ATOM 0 HA2 GLY A 50 15.550 -10.761 -6.900 1.00 0.00 H new ATOM 0 HA3 GLY A 50 16.688 -10.121 -8.069 1.00 0.00 H new ATOM 809 N LYS A 51 17.883 -10.131 -5.016 1.00 0.00 N ATOM 810 CA LYS A 51 18.948 -10.560 -4.089 1.00 0.00 C ATOM 811 C LYS A 51 18.397 -10.793 -2.678 1.00 0.00 C ATOM 812 O LYS A 51 17.697 -9.940 -2.130 1.00 0.00 O ATOM 813 CB LYS A 51 20.065 -9.506 -4.061 1.00 0.00 C ATOM 814 CG LYS A 51 20.853 -9.550 -5.373 1.00 0.00 C ATOM 815 CD LYS A 51 22.069 -8.624 -5.343 1.00 0.00 C ATOM 816 CE LYS A 51 22.875 -8.920 -6.607 1.00 0.00 C ATOM 817 NZ LYS A 51 24.096 -8.077 -6.696 1.00 0.00 N ATOM 0 H LYS A 51 17.366 -9.327 -4.660 1.00 0.00 H new ATOM 0 HA LYS A 51 19.354 -11.507 -4.446 1.00 0.00 H new ATOM 0 HB2 LYS A 51 19.638 -8.514 -3.916 1.00 0.00 H new ATOM 0 HB3 LYS A 51 20.732 -9.692 -3.219 1.00 0.00 H new ATOM 0 HG2 LYS A 51 21.180 -10.572 -5.565 1.00 0.00 H new ATOM 0 HG3 LYS A 51 20.200 -9.264 -6.198 1.00 0.00 H new ATOM 0 HD2 LYS A 51 21.760 -7.579 -5.317 1.00 0.00 H new ATOM 0 HD3 LYS A 51 22.669 -8.801 -4.451 1.00 0.00 H new ATOM 0 HE2 LYS A 51 23.159 -9.972 -6.618 1.00 0.00 H new ATOM 0 HE3 LYS A 51 22.251 -8.749 -7.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 24.615 -8.308 -7.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 23.824 -7.073 -6.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 24.704 -8.259 -5.872 1.00 0.00 H new ATOM 831 N ILE A 52 18.702 -11.949 -2.081 1.00 0.00 N ATOM 832 CA ILE A 52 18.322 -12.273 -0.698 1.00 0.00 C ATOM 833 C ILE A 52 19.081 -11.377 0.294 1.00 0.00 C ATOM 834 O ILE A 52 20.309 -11.266 0.243 1.00 0.00 O ATOM 835 CB ILE A 52 18.537 -13.768 -0.390 1.00 0.00 C ATOM 836 CG1 ILE A 52 17.998 -14.619 -1.566 1.00 0.00 C ATOM 837 CG2 ILE A 52 17.882 -14.114 0.958 1.00 0.00 C ATOM 838 CD1 ILE A 52 17.390 -15.969 -1.217 1.00 0.00 C ATOM 0 H ILE A 52 19.223 -12.693 -2.545 1.00 0.00 H new ATOM 0 HA ILE A 52 17.256 -12.074 -0.584 1.00 0.00 H new ATOM 0 HB ILE A 52 19.599 -13.995 -0.294 1.00 0.00 H new ATOM 0 HG12 ILE A 52 17.244 -14.033 -2.091 1.00 0.00 H new ATOM 0 HG13 ILE A 52 18.816 -14.786 -2.266 1.00 0.00 H new ATOM 0 HG21 ILE A 52 18.034 -15.171 1.176 1.00 0.00 H new ATOM 0 HG22 ILE A 52 18.333 -13.512 1.747 1.00 0.00 H new ATOM 0 HG23 ILE A 52 16.814 -13.904 0.908 1.00 0.00 H new ATOM 0 HD11 ILE A 52 17.052 -16.462 -2.128 1.00 0.00 H new ATOM 0 HD12 ILE A 52 18.139 -16.589 -0.725 1.00 0.00 H new ATOM 0 HD13 ILE A 52 16.542 -15.824 -0.547 1.00 0.00 H new ATOM 850 N LEU A 53 18.338 -10.719 1.181 1.00 0.00 N ATOM 851 CA LEU A 53 18.835 -9.764 2.171 1.00 0.00 C ATOM 852 C LEU A 53 19.533 -10.471 3.351 1.00 0.00 C ATOM 853 O LEU A 53 19.047 -11.487 3.856 1.00 0.00 O ATOM 854 CB LEU A 53 17.653 -8.911 2.668 1.00 0.00 C ATOM 855 CG LEU A 53 16.780 -8.248 1.585 1.00 0.00 C ATOM 856 CD1 LEU A 53 15.738 -7.341 2.242 1.00 0.00 C ATOM 857 CD2 LEU A 53 17.609 -7.400 0.631 1.00 0.00 C ATOM 0 H LEU A 53 17.327 -10.842 1.232 1.00 0.00 H new ATOM 0 HA LEU A 53 19.584 -9.126 1.701 1.00 0.00 H new ATOM 0 HB2 LEU A 53 17.012 -9.542 3.284 1.00 0.00 H new ATOM 0 HB3 LEU A 53 18.046 -8.128 3.316 1.00 0.00 H new ATOM 0 HG LEU A 53 16.301 -9.049 1.022 1.00 0.00 H new ATOM 0 HD11 LEU A 53 15.124 -6.875 1.472 1.00 0.00 H new ATOM 0 HD12 LEU A 53 15.104 -7.933 2.902 1.00 0.00 H new ATOM 0 HD13 LEU A 53 16.242 -6.567 2.821 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.956 -6.950 -0.117 1.00 0.00 H new ATOM 0 HD22 LEU A 53 18.116 -6.614 1.190 1.00 0.00 H new ATOM 0 HD23 LEU A 53 18.350 -8.028 0.136 1.00 0.00 H new ATOM 869 N ASN A 54 20.658 -9.924 3.817 1.00 0.00 N ATOM 870 CA ASN A 54 21.395 -10.399 4.994 1.00 0.00 C ATOM 871 C ASN A 54 20.645 -10.040 6.292 1.00 0.00 C ATOM 872 O ASN A 54 20.418 -8.859 6.554 1.00 0.00 O ATOM 873 CB ASN A 54 22.791 -9.755 4.985 1.00 0.00 C ATOM 874 CG ASN A 54 23.718 -10.317 6.056 1.00 0.00 C ATOM 875 OD1 ASN A 54 23.412 -10.341 7.241 1.00 0.00 O ATOM 876 ND2 ASN A 54 24.878 -10.808 5.681 1.00 0.00 N ATOM 0 H ASN A 54 21.095 -9.116 3.375 1.00 0.00 H new ATOM 0 HA ASN A 54 21.485 -11.485 4.956 1.00 0.00 H new ATOM 0 HB2 ASN A 54 23.246 -9.903 4.006 1.00 0.00 H new ATOM 0 HB3 ASN A 54 22.689 -8.680 5.130 1.00 0.00 H new ATOM 0 HD21 ASN A 54 25.513 -11.204 6.375 1.00 0.00 H new ATOM 0 HD22 ASN A 54 25.144 -10.793 4.696 1.00 0.00 H new ATOM 883 N ASP A 55 20.299 -11.034 7.118 1.00 0.00 N ATOM 884 CA ASP A 55 19.535 -10.878 8.368 1.00 0.00 C ATOM 885 C ASP A 55 20.091 -9.804 9.328 1.00 0.00 C ATOM 886 O ASP A 55 19.319 -9.139 10.019 1.00 0.00 O ATOM 887 CB ASP A 55 19.456 -12.223 9.110 1.00 0.00 C ATOM 888 CG ASP A 55 18.806 -13.332 8.271 1.00 0.00 C ATOM 889 OD1 ASP A 55 19.518 -13.975 7.463 1.00 0.00 O ATOM 890 OD2 ASP A 55 17.587 -13.576 8.433 1.00 0.00 O ATOM 0 H ASP A 55 20.551 -12.005 6.931 1.00 0.00 H new ATOM 0 HA ASP A 55 18.546 -10.537 8.062 1.00 0.00 H new ATOM 0 HB2 ASP A 55 20.461 -12.533 9.397 1.00 0.00 H new ATOM 0 HB3 ASP A 55 18.888 -12.091 10.031 1.00 0.00 H new ATOM 895 N ASP A 56 21.412 -9.610 9.376 1.00 0.00 N ATOM 896 CA ASP A 56 22.080 -8.686 10.303 1.00 0.00 C ATOM 897 C ASP A 56 22.475 -7.332 9.675 1.00 0.00 C ATOM 898 O ASP A 56 22.949 -6.436 10.376 1.00 0.00 O ATOM 899 CB ASP A 56 23.285 -9.403 10.932 1.00 0.00 C ATOM 900 CG ASP A 56 23.791 -8.694 12.200 1.00 0.00 C ATOM 901 OD1 ASP A 56 22.962 -8.435 13.107 1.00 0.00 O ATOM 902 OD2 ASP A 56 25.014 -8.440 12.315 1.00 0.00 O ATOM 0 H ASP A 56 22.062 -10.099 8.760 1.00 0.00 H new ATOM 0 HA ASP A 56 21.360 -8.417 11.076 1.00 0.00 H new ATOM 0 HB2 ASP A 56 23.007 -10.428 11.178 1.00 0.00 H new ATOM 0 HB3 ASP A 56 24.093 -9.458 10.203 1.00 0.00 H new ATOM 907 N THR A 57 22.255 -7.147 8.370 1.00 0.00 N ATOM 908 CA THR A 57 22.440 -5.867 7.666 1.00 0.00 C ATOM 909 C THR A 57 21.150 -5.031 7.731 1.00 0.00 C ATOM 910 O THR A 57 20.039 -5.570 7.745 1.00 0.00 O ATOM 911 CB THR A 57 22.901 -6.132 6.218 1.00 0.00 C ATOM 912 OG1 THR A 57 24.114 -6.864 6.232 1.00 0.00 O ATOM 913 CG2 THR A 57 23.194 -4.870 5.421 1.00 0.00 C ATOM 0 H THR A 57 21.936 -7.897 7.757 1.00 0.00 H new ATOM 0 HA THR A 57 23.220 -5.284 8.156 1.00 0.00 H new ATOM 0 HB THR A 57 22.074 -6.666 5.750 1.00 0.00 H new ATOM 0 HG1 THR A 57 24.405 -7.033 5.312 1.00 0.00 H new ATOM 0 HG21 THR A 57 23.512 -5.141 4.414 1.00 0.00 H new ATOM 0 HG22 THR A 57 22.294 -4.258 5.365 1.00 0.00 H new ATOM 0 HG23 THR A 57 23.986 -4.305 5.912 1.00 0.00 H new ATOM 921 N ALA A 58 21.274 -3.701 7.818 1.00 0.00 N ATOM 922 CA ALA A 58 20.127 -2.793 7.905 1.00 0.00 C ATOM 923 C ALA A 58 19.379 -2.622 6.569 1.00 0.00 C ATOM 924 O ALA A 58 19.959 -2.739 5.489 1.00 0.00 O ATOM 925 CB ALA A 58 20.590 -1.458 8.491 1.00 0.00 C ATOM 0 H ALA A 58 22.176 -3.224 7.830 1.00 0.00 H new ATOM 0 HA ALA A 58 19.390 -3.240 8.572 1.00 0.00 H new ATOM 0 HB1 ALA A 58 19.742 -0.777 8.559 1.00 0.00 H new ATOM 0 HB2 ALA A 58 21.005 -1.622 9.486 1.00 0.00 H new ATOM 0 HB3 ALA A 58 21.354 -1.023 7.846 1.00 0.00 H new ATOM 931 N LEU A 59 18.084 -2.289 6.636 1.00 0.00 N ATOM 932 CA LEU A 59 17.211 -2.124 5.460 1.00 0.00 C ATOM 933 C LEU A 59 17.624 -0.939 4.564 1.00 0.00 C ATOM 934 O LEU A 59 17.476 -0.995 3.341 1.00 0.00 O ATOM 935 CB LEU A 59 15.757 -1.986 5.954 1.00 0.00 C ATOM 936 CG LEU A 59 15.158 -3.281 6.542 1.00 0.00 C ATOM 937 CD1 LEU A 59 13.757 -3.004 7.084 1.00 0.00 C ATOM 938 CD2 LEU A 59 15.013 -4.398 5.507 1.00 0.00 C ATOM 0 H LEU A 59 17.603 -2.124 7.520 1.00 0.00 H new ATOM 0 HA LEU A 59 17.309 -3.005 4.826 1.00 0.00 H new ATOM 0 HB2 LEU A 59 15.716 -1.204 6.713 1.00 0.00 H new ATOM 0 HB3 LEU A 59 15.133 -1.656 5.123 1.00 0.00 H new ATOM 0 HG LEU A 59 15.849 -3.603 7.321 1.00 0.00 H new ATOM 0 HD11 LEU A 59 13.339 -3.922 7.498 1.00 0.00 H new ATOM 0 HD12 LEU A 59 13.812 -2.246 7.865 1.00 0.00 H new ATOM 0 HD13 LEU A 59 13.118 -2.646 6.276 1.00 0.00 H new ATOM 0 HD21 LEU A 59 14.587 -5.281 5.982 1.00 0.00 H new ATOM 0 HD22 LEU A 59 14.356 -4.066 4.703 1.00 0.00 H new ATOM 0 HD23 LEU A 59 15.993 -4.644 5.097 1.00 0.00 H new ATOM 950 N LYS A 60 18.216 0.103 5.166 1.00 0.00 N ATOM 951 CA LYS A 60 18.798 1.274 4.485 1.00 0.00 C ATOM 952 C LYS A 60 19.899 0.900 3.483 1.00 0.00 C ATOM 953 O LYS A 60 19.986 1.506 2.417 1.00 0.00 O ATOM 954 CB LYS A 60 19.278 2.265 5.565 1.00 0.00 C ATOM 955 CG LYS A 60 19.813 3.605 5.021 1.00 0.00 C ATOM 956 CD LYS A 60 21.336 3.645 4.803 1.00 0.00 C ATOM 957 CE LYS A 60 22.097 3.689 6.136 1.00 0.00 C ATOM 958 NZ LYS A 60 23.560 3.565 5.923 1.00 0.00 N ATOM 0 H LYS A 60 18.307 0.157 6.180 1.00 0.00 H new ATOM 0 HA LYS A 60 18.034 1.751 3.871 1.00 0.00 H new ATOM 0 HB2 LYS A 60 18.450 2.469 6.244 1.00 0.00 H new ATOM 0 HB3 LYS A 60 20.063 1.788 6.153 1.00 0.00 H new ATOM 0 HG2 LYS A 60 19.318 3.822 4.074 1.00 0.00 H new ATOM 0 HG3 LYS A 60 19.537 4.400 5.714 1.00 0.00 H new ATOM 0 HD2 LYS A 60 21.646 2.768 4.235 1.00 0.00 H new ATOM 0 HD3 LYS A 60 21.596 4.519 4.206 1.00 0.00 H new ATOM 0 HE2 LYS A 60 21.880 4.625 6.651 1.00 0.00 H new ATOM 0 HE3 LYS A 60 21.751 2.882 6.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 24.037 3.462 6.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 23.756 2.730 5.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 23.914 4.417 5.443 1.00 0.00 H new ATOM 972 N GLU A 61 20.699 -0.129 3.773 1.00 0.00 N ATOM 973 CA GLU A 61 21.815 -0.595 2.933 1.00 0.00 C ATOM 974 C GLU A 61 21.374 -1.154 1.565 1.00 0.00 C ATOM 975 O GLU A 61 22.185 -1.246 0.640 1.00 0.00 O ATOM 976 CB GLU A 61 22.597 -1.687 3.677 1.00 0.00 C ATOM 977 CG GLU A 61 23.174 -1.259 5.032 1.00 0.00 C ATOM 978 CD GLU A 61 24.284 -0.204 4.877 1.00 0.00 C ATOM 979 OE1 GLU A 61 25.468 -0.579 4.694 1.00 0.00 O ATOM 980 OE2 GLU A 61 23.979 1.011 4.945 1.00 0.00 O ATOM 0 H GLU A 61 20.588 -0.680 4.624 1.00 0.00 H new ATOM 0 HA GLU A 61 22.434 0.281 2.739 1.00 0.00 H new ATOM 0 HB2 GLU A 61 21.939 -2.542 3.832 1.00 0.00 H new ATOM 0 HB3 GLU A 61 23.415 -2.025 3.041 1.00 0.00 H new ATOM 0 HG2 GLU A 61 22.376 -0.857 5.656 1.00 0.00 H new ATOM 0 HG3 GLU A 61 23.573 -2.132 5.549 1.00 0.00 H new ATOM 987 N TYR A 62 20.088 -1.493 1.422 1.00 0.00 N ATOM 988 CA TYR A 62 19.469 -2.041 0.209 1.00 0.00 C ATOM 989 C TYR A 62 18.565 -1.023 -0.507 1.00 0.00 C ATOM 990 O TYR A 62 17.986 -1.329 -1.552 1.00 0.00 O ATOM 991 CB TYR A 62 18.698 -3.310 0.595 1.00 0.00 C ATOM 992 CG TYR A 62 19.589 -4.416 1.125 1.00 0.00 C ATOM 993 CD1 TYR A 62 20.359 -5.174 0.221 1.00 0.00 C ATOM 994 CD2 TYR A 62 19.639 -4.699 2.505 1.00 0.00 C ATOM 995 CE1 TYR A 62 21.166 -6.227 0.690 1.00 0.00 C ATOM 996 CE2 TYR A 62 20.439 -5.758 2.977 1.00 0.00 C ATOM 997 CZ TYR A 62 21.205 -6.524 2.070 1.00 0.00 C ATOM 998 OH TYR A 62 21.973 -7.549 2.527 1.00 0.00 O ATOM 0 H TYR A 62 19.419 -1.388 2.184 1.00 0.00 H new ATOM 0 HA TYR A 62 20.252 -2.285 -0.509 1.00 0.00 H new ATOM 0 HB2 TYR A 62 17.954 -3.059 1.351 1.00 0.00 H new ATOM 0 HB3 TYR A 62 18.156 -3.676 -0.277 1.00 0.00 H new ATOM 0 HD1 TYR A 62 20.330 -4.946 -0.834 1.00 0.00 H new ATOM 0 HD2 TYR A 62 19.064 -4.104 3.200 1.00 0.00 H new ATOM 0 HE1 TYR A 62 21.755 -6.807 -0.005 1.00 0.00 H new ATOM 0 HE2 TYR A 62 20.467 -5.984 4.033 1.00 0.00 H new ATOM 0 HH TYR A 62 22.273 -7.352 3.439 1.00 0.00 H new ATOM 1008 N LYS A 63 18.457 0.195 0.048 1.00 0.00 N ATOM 1009 CA LYS A 63 17.652 1.334 -0.424 1.00 0.00 C ATOM 1010 C LYS A 63 16.197 0.968 -0.785 1.00 0.00 C ATOM 1011 O LYS A 63 15.618 1.515 -1.727 1.00 0.00 O ATOM 1012 CB LYS A 63 18.405 2.085 -1.544 1.00 0.00 C ATOM 1013 CG LYS A 63 19.774 2.622 -1.082 1.00 0.00 C ATOM 1014 CD LYS A 63 20.531 3.374 -2.187 1.00 0.00 C ATOM 1015 CE LYS A 63 19.850 4.696 -2.566 1.00 0.00 C ATOM 1016 NZ LYS A 63 20.636 5.442 -3.584 1.00 0.00 N ATOM 0 H LYS A 63 18.967 0.427 0.900 1.00 0.00 H new ATOM 0 HA LYS A 63 17.532 2.022 0.413 1.00 0.00 H new ATOM 0 HB2 LYS A 63 18.549 1.415 -2.392 1.00 0.00 H new ATOM 0 HB3 LYS A 63 17.793 2.916 -1.894 1.00 0.00 H new ATOM 0 HG2 LYS A 63 19.628 3.288 -0.232 1.00 0.00 H new ATOM 0 HG3 LYS A 63 20.385 1.790 -0.733 1.00 0.00 H new ATOM 0 HD2 LYS A 63 21.549 3.575 -1.854 1.00 0.00 H new ATOM 0 HD3 LYS A 63 20.604 2.740 -3.070 1.00 0.00 H new ATOM 0 HE2 LYS A 63 18.851 4.494 -2.952 1.00 0.00 H new ATOM 0 HE3 LYS A 63 19.729 5.312 -1.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 20.148 6.330 -3.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 21.581 5.656 -3.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 20.730 4.863 -4.443 1.00 0.00 H new ATOM 1030 N ILE A 64 15.601 0.048 -0.020 1.00 0.00 N ATOM 1031 CA ILE A 64 14.172 -0.306 -0.077 1.00 0.00 C ATOM 1032 C ILE A 64 13.332 0.950 0.228 1.00 0.00 C ATOM 1033 O ILE A 64 13.731 1.798 1.030 1.00 0.00 O ATOM 1034 CB ILE A 64 13.862 -1.455 0.918 1.00 0.00 C ATOM 1035 CG1 ILE A 64 14.710 -2.718 0.638 1.00 0.00 C ATOM 1036 CG2 ILE A 64 12.372 -1.853 0.895 1.00 0.00 C ATOM 1037 CD1 ILE A 64 14.817 -3.626 1.867 1.00 0.00 C ATOM 0 H ILE A 64 16.113 -0.490 0.679 1.00 0.00 H new ATOM 0 HA ILE A 64 13.916 -0.663 -1.075 1.00 0.00 H new ATOM 0 HB ILE A 64 14.118 -1.063 1.902 1.00 0.00 H new ATOM 0 HG12 ILE A 64 14.267 -3.276 -0.187 1.00 0.00 H new ATOM 0 HG13 ILE A 64 15.709 -2.420 0.320 1.00 0.00 H new ATOM 0 HG21 ILE A 64 12.200 -2.661 1.607 1.00 0.00 H new ATOM 0 HG22 ILE A 64 11.761 -0.992 1.168 1.00 0.00 H new ATOM 0 HG23 ILE A 64 12.100 -2.188 -0.106 1.00 0.00 H new ATOM 0 HD11 ILE A 64 15.421 -4.500 1.622 1.00 0.00 H new ATOM 0 HD12 ILE A 64 15.285 -3.078 2.685 1.00 0.00 H new ATOM 0 HD13 ILE A 64 13.820 -3.947 2.170 1.00 0.00 H new ATOM 1049 N ASP A 65 12.163 1.067 -0.400 1.00 0.00 N ATOM 1050 CA ASP A 65 11.252 2.214 -0.282 1.00 0.00 C ATOM 1051 C ASP A 65 9.855 1.772 0.199 1.00 0.00 C ATOM 1052 O ASP A 65 9.503 0.592 0.141 1.00 0.00 O ATOM 1053 CB ASP A 65 11.199 2.926 -1.644 1.00 0.00 C ATOM 1054 CG ASP A 65 10.665 4.360 -1.551 1.00 0.00 C ATOM 1055 OD1 ASP A 65 9.427 4.544 -1.510 1.00 0.00 O ATOM 1056 OD2 ASP A 65 11.470 5.319 -1.531 1.00 0.00 O ATOM 0 H ASP A 65 11.809 0.344 -1.027 1.00 0.00 H new ATOM 0 HA ASP A 65 11.621 2.910 0.471 1.00 0.00 H new ATOM 0 HB2 ASP A 65 12.199 2.944 -2.077 1.00 0.00 H new ATOM 0 HB3 ASP A 65 10.568 2.353 -2.323 1.00 0.00 H new ATOM 1061 N GLU A 66 9.039 2.716 0.666 1.00 0.00 N ATOM 1062 CA GLU A 66 7.643 2.473 1.051 1.00 0.00 C ATOM 1063 C GLU A 66 6.713 2.298 -0.170 1.00 0.00 C ATOM 1064 O GLU A 66 5.695 1.608 -0.083 1.00 0.00 O ATOM 1065 CB GLU A 66 7.132 3.638 1.917 1.00 0.00 C ATOM 1066 CG GLU A 66 7.990 3.869 3.170 1.00 0.00 C ATOM 1067 CD GLU A 66 7.370 4.918 4.111 1.00 0.00 C ATOM 1068 OE1 GLU A 66 7.115 6.070 3.682 1.00 0.00 O ATOM 1069 OE2 GLU A 66 7.166 4.592 5.305 1.00 0.00 O ATOM 0 H GLU A 66 9.330 3.686 0.791 1.00 0.00 H new ATOM 0 HA GLU A 66 7.624 1.541 1.615 1.00 0.00 H new ATOM 0 HB2 GLU A 66 7.117 4.549 1.319 1.00 0.00 H new ATOM 0 HB3 GLU A 66 6.104 3.437 2.218 1.00 0.00 H new ATOM 0 HG2 GLU A 66 8.109 2.927 3.706 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.987 4.194 2.872 1.00 0.00 H new ATOM 1076 N LYS A 67 7.056 2.914 -1.314 1.00 0.00 N ATOM 1077 CA LYS A 67 6.290 2.870 -2.576 1.00 0.00 C ATOM 1078 C LYS A 67 6.512 1.573 -3.366 1.00 0.00 C ATOM 1079 O LYS A 67 5.574 1.052 -3.974 1.00 0.00 O ATOM 1080 CB LYS A 67 6.663 4.084 -3.448 1.00 0.00 C ATOM 1081 CG LYS A 67 6.293 5.421 -2.780 1.00 0.00 C ATOM 1082 CD LYS A 67 6.622 6.645 -3.651 1.00 0.00 C ATOM 1083 CE LYS A 67 8.113 6.817 -3.987 1.00 0.00 C ATOM 1084 NZ LYS A 67 8.958 6.975 -2.776 1.00 0.00 N ATOM 0 H LYS A 67 7.903 3.476 -1.390 1.00 0.00 H new ATOM 0 HA LYS A 67 5.233 2.902 -2.312 1.00 0.00 H new ATOM 0 HB2 LYS A 67 7.734 4.067 -3.652 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.154 4.008 -4.409 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.227 5.422 -2.550 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.824 5.505 -1.832 1.00 0.00 H new ATOM 0 HD2 LYS A 67 6.060 6.572 -4.582 1.00 0.00 H new ATOM 0 HD3 LYS A 67 6.274 7.542 -3.139 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.456 5.952 -4.554 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.238 7.689 -4.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.928 7.222 -3.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 8.569 7.731 -2.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.970 6.083 -2.242 1.00 0.00 H new ATOM 1098 N ASN A 68 7.743 1.058 -3.368 1.00 0.00 N ATOM 1099 CA ASN A 68 8.116 -0.236 -3.955 1.00 0.00 C ATOM 1100 C ASN A 68 7.629 -1.409 -3.078 1.00 0.00 C ATOM 1101 O ASN A 68 7.253 -1.212 -1.919 1.00 0.00 O ATOM 1102 CB ASN A 68 9.647 -0.270 -4.137 1.00 0.00 C ATOM 1103 CG ASN A 68 10.134 0.733 -5.172 1.00 0.00 C ATOM 1104 OD1 ASN A 68 10.344 1.906 -4.896 1.00 0.00 O ATOM 1105 ND2 ASN A 68 10.312 0.318 -6.403 1.00 0.00 N ATOM 0 H ASN A 68 8.535 1.544 -2.948 1.00 0.00 H new ATOM 0 HA ASN A 68 7.633 -0.349 -4.925 1.00 0.00 H new ATOM 0 HB2 ASN A 68 10.128 -0.063 -3.181 1.00 0.00 H new ATOM 0 HB3 ASN A 68 9.952 -1.273 -4.436 1.00 0.00 H new ATOM 0 HD21 ASN A 68 10.623 0.972 -7.122 1.00 0.00 H new ATOM 0 HD22 ASN A 68 10.139 -0.658 -6.642 1.00 0.00 H new ATOM 1112 N PHE A 69 7.681 -2.639 -3.605 1.00 0.00 N ATOM 1113 CA PHE A 69 7.385 -3.861 -2.846 1.00 0.00 C ATOM 1114 C PHE A 69 8.609 -4.784 -2.722 1.00 0.00 C ATOM 1115 O PHE A 69 9.394 -4.939 -3.661 1.00 0.00 O ATOM 1116 CB PHE A 69 6.151 -4.585 -3.408 1.00 0.00 C ATOM 1117 CG PHE A 69 6.284 -5.221 -4.781 1.00 0.00 C ATOM 1118 CD1 PHE A 69 6.779 -6.534 -4.909 1.00 0.00 C ATOM 1119 CD2 PHE A 69 5.846 -4.527 -5.926 1.00 0.00 C ATOM 1120 CE1 PHE A 69 6.840 -7.149 -6.173 1.00 0.00 C ATOM 1121 CE2 PHE A 69 5.884 -5.152 -7.186 1.00 0.00 C ATOM 1122 CZ PHE A 69 6.385 -6.461 -7.311 1.00 0.00 C ATOM 0 H PHE A 69 7.932 -2.815 -4.578 1.00 0.00 H new ATOM 0 HA PHE A 69 7.138 -3.558 -1.829 1.00 0.00 H new ATOM 0 HB2 PHE A 69 5.866 -5.364 -2.701 1.00 0.00 H new ATOM 0 HB3 PHE A 69 5.328 -3.871 -3.445 1.00 0.00 H new ATOM 0 HD1 PHE A 69 7.113 -7.071 -4.033 1.00 0.00 H new ATOM 0 HD2 PHE A 69 5.481 -3.515 -5.837 1.00 0.00 H new ATOM 0 HE1 PHE A 69 7.236 -8.149 -6.269 1.00 0.00 H new ATOM 0 HE2 PHE A 69 5.528 -4.626 -8.059 1.00 0.00 H new ATOM 0 HZ PHE A 69 6.420 -6.936 -8.280 1.00 0.00 H new ATOM 1132 N VAL A 70 8.756 -5.406 -1.551 1.00 0.00 N ATOM 1133 CA VAL A 70 9.711 -6.486 -1.255 1.00 0.00 C ATOM 1134 C VAL A 70 9.052 -7.846 -1.531 1.00 0.00 C ATOM 1135 O VAL A 70 7.821 -7.944 -1.550 1.00 0.00 O ATOM 1136 CB VAL A 70 10.204 -6.345 0.210 1.00 0.00 C ATOM 1137 CG1 VAL A 70 9.569 -7.320 1.204 1.00 0.00 C ATOM 1138 CG2 VAL A 70 11.727 -6.479 0.295 1.00 0.00 C ATOM 0 H VAL A 70 8.187 -5.162 -0.741 1.00 0.00 H new ATOM 0 HA VAL A 70 10.585 -6.416 -1.902 1.00 0.00 H new ATOM 0 HB VAL A 70 9.883 -5.345 0.503 1.00 0.00 H new ATOM 0 HG11 VAL A 70 9.978 -7.143 2.199 1.00 0.00 H new ATOM 0 HG12 VAL A 70 8.490 -7.169 1.223 1.00 0.00 H new ATOM 0 HG13 VAL A 70 9.787 -8.344 0.899 1.00 0.00 H new ATOM 0 HG21 VAL A 70 12.044 -6.376 1.333 1.00 0.00 H new ATOM 0 HG22 VAL A 70 12.028 -7.457 -0.081 1.00 0.00 H new ATOM 0 HG23 VAL A 70 12.195 -5.700 -0.306 1.00 0.00 H new ATOM 1148 N VAL A 71 9.843 -8.910 -1.678 1.00 0.00 N ATOM 1149 CA VAL A 71 9.326 -10.287 -1.807 1.00 0.00 C ATOM 1150 C VAL A 71 9.698 -11.115 -0.577 1.00 0.00 C ATOM 1151 O VAL A 71 10.846 -11.100 -0.131 1.00 0.00 O ATOM 1152 CB VAL A 71 9.783 -10.961 -3.111 1.00 0.00 C ATOM 1153 CG1 VAL A 71 9.151 -12.350 -3.273 1.00 0.00 C ATOM 1154 CG2 VAL A 71 9.348 -10.133 -4.324 1.00 0.00 C ATOM 0 H VAL A 71 10.861 -8.849 -1.712 1.00 0.00 H new ATOM 0 HA VAL A 71 8.239 -10.229 -1.860 1.00 0.00 H new ATOM 0 HB VAL A 71 10.869 -11.042 -3.057 1.00 0.00 H new ATOM 0 HG11 VAL A 71 9.494 -12.800 -4.205 1.00 0.00 H new ATOM 0 HG12 VAL A 71 9.444 -12.983 -2.435 1.00 0.00 H new ATOM 0 HG13 VAL A 71 8.065 -12.256 -3.294 1.00 0.00 H new ATOM 0 HG21 VAL A 71 9.680 -10.625 -5.238 1.00 0.00 H new ATOM 0 HG22 VAL A 71 8.262 -10.044 -4.333 1.00 0.00 H new ATOM 0 HG23 VAL A 71 9.792 -9.140 -4.265 1.00 0.00 H new ATOM 1164 N VAL A 72 8.720 -11.847 -0.036 1.00 0.00 N ATOM 1165 CA VAL A 72 8.867 -12.742 1.122 1.00 0.00 C ATOM 1166 C VAL A 72 8.481 -14.182 0.766 1.00 0.00 C ATOM 1167 O VAL A 72 7.509 -14.431 0.047 1.00 0.00 O ATOM 1168 CB VAL A 72 8.091 -12.207 2.348 1.00 0.00 C ATOM 1169 CG1 VAL A 72 6.596 -11.967 2.084 1.00 0.00 C ATOM 1170 CG2 VAL A 72 8.238 -13.137 3.562 1.00 0.00 C ATOM 0 H VAL A 72 7.769 -11.834 -0.404 1.00 0.00 H new ATOM 0 HA VAL A 72 9.920 -12.760 1.402 1.00 0.00 H new ATOM 0 HB VAL A 72 8.547 -11.240 2.560 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.122 -11.593 2.991 1.00 0.00 H new ATOM 0 HG12 VAL A 72 6.481 -11.234 1.285 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.124 -12.904 1.788 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.679 -12.728 4.404 1.00 0.00 H new ATOM 0 HG22 VAL A 72 7.849 -14.124 3.313 1.00 0.00 H new ATOM 0 HG23 VAL A 72 9.291 -13.220 3.832 1.00 0.00 H new ATOM 1180 N MET A 73 9.246 -15.136 1.295 1.00 0.00 N ATOM 1181 CA MET A 73 8.993 -16.579 1.216 1.00 0.00 C ATOM 1182 C MET A 73 9.359 -17.288 2.520 1.00 0.00 C ATOM 1183 O MET A 73 9.902 -16.667 3.436 1.00 0.00 O ATOM 1184 CB MET A 73 9.710 -17.162 -0.007 1.00 0.00 C ATOM 1185 CG MET A 73 11.236 -17.137 0.064 1.00 0.00 C ATOM 1186 SD MET A 73 12.072 -17.784 -1.407 1.00 0.00 S ATOM 1187 CE MET A 73 11.608 -19.533 -1.293 1.00 0.00 C ATOM 0 H MET A 73 10.097 -14.917 1.813 1.00 0.00 H new ATOM 0 HA MET A 73 7.924 -16.748 1.084 1.00 0.00 H new ATOM 0 HB2 MET A 73 9.385 -18.194 -0.142 1.00 0.00 H new ATOM 0 HB3 MET A 73 9.394 -16.610 -0.892 1.00 0.00 H new ATOM 0 HG2 MET A 73 11.562 -16.110 0.228 1.00 0.00 H new ATOM 0 HG3 MET A 73 11.556 -17.715 0.931 1.00 0.00 H new ATOM 0 HE1 MET A 73 12.115 -20.096 -2.077 1.00 0.00 H new ATOM 0 HE2 MET A 73 11.900 -19.924 -0.319 1.00 0.00 H new ATOM 0 HE3 MET A 73 10.529 -19.632 -1.415 1.00 0.00 H new ATOM 1197 N VAL A 74 9.047 -18.580 2.618 1.00 0.00 N ATOM 1198 CA VAL A 74 9.336 -19.429 3.780 1.00 0.00 C ATOM 1199 C VAL A 74 10.006 -20.734 3.326 1.00 0.00 C ATOM 1200 O VAL A 74 9.369 -21.612 2.741 1.00 0.00 O ATOM 1201 CB VAL A 74 8.082 -19.628 4.664 1.00 0.00 C ATOM 1202 CG1 VAL A 74 6.844 -20.187 3.947 1.00 0.00 C ATOM 1203 CG2 VAL A 74 8.386 -20.490 5.893 1.00 0.00 C ATOM 0 H VAL A 74 8.571 -19.083 1.869 1.00 0.00 H new ATOM 0 HA VAL A 74 10.054 -18.926 4.428 1.00 0.00 H new ATOM 0 HB VAL A 74 7.824 -18.612 4.964 1.00 0.00 H new ATOM 0 HG11 VAL A 74 6.025 -20.286 4.659 1.00 0.00 H new ATOM 0 HG12 VAL A 74 6.549 -19.508 3.147 1.00 0.00 H new ATOM 0 HG13 VAL A 74 7.078 -21.164 3.525 1.00 0.00 H new ATOM 0 HG21 VAL A 74 7.481 -20.607 6.489 1.00 0.00 H new ATOM 0 HG22 VAL A 74 8.738 -21.470 5.572 1.00 0.00 H new ATOM 0 HG23 VAL A 74 9.156 -20.007 6.495 1.00 0.00 H new ATOM 1872 N GLU B 283 13.500 -25.703 -3.558 1.00 0.00 N ATOM 1873 CA GLU B 283 13.771 -24.486 -2.780 1.00 0.00 C ATOM 1874 C GLU B 283 14.562 -23.442 -3.595 1.00 0.00 C ATOM 1875 O GLU B 283 14.279 -22.248 -3.518 1.00 0.00 O ATOM 1876 CB GLU B 283 14.476 -24.890 -1.475 1.00 0.00 C ATOM 1877 CG GLU B 283 14.581 -23.754 -0.453 1.00 0.00 C ATOM 1878 CD GLU B 283 14.829 -24.319 0.960 1.00 0.00 C ATOM 1879 OE1 GLU B 283 13.842 -24.662 1.658 1.00 0.00 O ATOM 1880 OE2 GLU B 283 16.007 -24.414 1.382 1.00 0.00 O ATOM 0 HA GLU B 283 12.832 -23.992 -2.531 1.00 0.00 H new ATOM 0 HB2 GLU B 283 13.937 -25.723 -1.024 1.00 0.00 H new ATOM 0 HB3 GLU B 283 15.478 -25.249 -1.710 1.00 0.00 H new ATOM 0 HG2 GLU B 283 15.393 -23.082 -0.730 1.00 0.00 H new ATOM 0 HG3 GLU B 283 13.664 -23.165 -0.460 1.00 0.00 H new ATOM 1887 N GLU B 284 15.492 -23.884 -4.445 1.00 0.00 N ATOM 1888 CA GLU B 284 16.239 -23.045 -5.391 1.00 0.00 C ATOM 1889 C GLU B 284 15.338 -22.423 -6.477 1.00 0.00 C ATOM 1890 O GLU B 284 15.463 -21.235 -6.775 1.00 0.00 O ATOM 1891 CB GLU B 284 17.360 -23.862 -6.060 1.00 0.00 C ATOM 1892 CG GLU B 284 18.494 -24.288 -5.109 1.00 0.00 C ATOM 1893 CD GLU B 284 18.108 -25.362 -4.067 1.00 0.00 C ATOM 1894 OE1 GLU B 284 17.224 -26.212 -4.337 1.00 0.00 O ATOM 1895 OE2 GLU B 284 18.710 -25.372 -2.965 1.00 0.00 O ATOM 0 H GLU B 284 15.756 -24.868 -4.497 1.00 0.00 H new ATOM 0 HA GLU B 284 16.667 -22.227 -4.812 1.00 0.00 H new ATOM 0 HB2 GLU B 284 16.924 -24.755 -6.508 1.00 0.00 H new ATOM 0 HB3 GLU B 284 17.786 -23.273 -6.872 1.00 0.00 H new ATOM 0 HG2 GLU B 284 19.325 -24.665 -5.705 1.00 0.00 H new ATOM 0 HG3 GLU B 284 18.855 -23.405 -4.581 1.00 0.00 H new ATOM 1902 N GLU B 285 14.412 -23.190 -7.064 1.00 0.00 N ATOM 1903 CA GLU B 285 13.446 -22.668 -8.044 1.00 0.00 C ATOM 1904 C GLU B 285 12.414 -21.723 -7.403 1.00 0.00 C ATOM 1905 O GLU B 285 12.077 -20.697 -7.996 1.00 0.00 O ATOM 1906 CB GLU B 285 12.734 -23.824 -8.762 1.00 0.00 C ATOM 1907 CG GLU B 285 13.624 -24.569 -9.768 1.00 0.00 C ATOM 1908 CD GLU B 285 13.892 -23.735 -11.036 1.00 0.00 C ATOM 1909 OE1 GLU B 285 13.071 -23.783 -11.985 1.00 0.00 O ATOM 1910 OE2 GLU B 285 14.932 -23.035 -11.103 1.00 0.00 O ATOM 0 H GLU B 285 14.309 -24.187 -6.875 1.00 0.00 H new ATOM 0 HA GLU B 285 14.011 -22.085 -8.771 1.00 0.00 H new ATOM 0 HB2 GLU B 285 12.370 -24.533 -8.018 1.00 0.00 H new ATOM 0 HB3 GLU B 285 11.860 -23.433 -9.284 1.00 0.00 H new ATOM 0 HG2 GLU B 285 14.572 -24.822 -9.294 1.00 0.00 H new ATOM 0 HG3 GLU B 285 13.147 -25.508 -10.047 1.00 0.00 H new ATOM 1917 N GLN B 286 11.955 -22.010 -6.178 1.00 0.00 N ATOM 1918 CA GLN B 286 11.135 -21.094 -5.374 1.00 0.00 C ATOM 1919 C GLN B 286 11.864 -19.764 -5.116 1.00 0.00 C ATOM 1920 O GLN B 286 11.276 -18.697 -5.297 1.00 0.00 O ATOM 1921 CB GLN B 286 10.748 -21.746 -4.037 1.00 0.00 C ATOM 1922 CG GLN B 286 9.668 -22.826 -4.158 1.00 0.00 C ATOM 1923 CD GLN B 286 9.412 -23.512 -2.816 1.00 0.00 C ATOM 1924 OE1 GLN B 286 9.132 -22.881 -1.806 1.00 0.00 O ATOM 1925 NE2 GLN B 286 9.491 -24.823 -2.736 1.00 0.00 N ATOM 0 H GLN B 286 12.145 -22.897 -5.711 1.00 0.00 H new ATOM 0 HA GLN B 286 10.230 -20.881 -5.943 1.00 0.00 H new ATOM 0 HB2 GLN B 286 11.639 -22.186 -3.588 1.00 0.00 H new ATOM 0 HB3 GLN B 286 10.397 -20.971 -3.355 1.00 0.00 H new ATOM 0 HG2 GLN B 286 8.743 -22.379 -4.522 1.00 0.00 H new ATOM 0 HG3 GLN B 286 9.975 -23.568 -4.895 1.00 0.00 H new ATOM 0 HE21 GLN B 286 9.723 -25.371 -3.564 1.00 0.00 H new ATOM 0 HE22 GLN B 286 9.320 -25.291 -1.846 1.00 0.00 H new ATOM 1934 N ILE B 287 13.150 -19.817 -4.745 1.00 0.00 N ATOM 1935 CA ILE B 287 14.026 -18.642 -4.629 1.00 0.00 C ATOM 1936 C ILE B 287 14.088 -17.869 -5.954 1.00 0.00 C ATOM 1937 O ILE B 287 13.797 -16.677 -5.964 1.00 0.00 O ATOM 1938 CB ILE B 287 15.416 -19.047 -4.076 1.00 0.00 C ATOM 1939 CG1 ILE B 287 15.310 -19.254 -2.546 1.00 0.00 C ATOM 1940 CG2 ILE B 287 16.491 -17.997 -4.406 1.00 0.00 C ATOM 1941 CD1 ILE B 287 16.498 -19.998 -1.922 1.00 0.00 C ATOM 0 H ILE B 287 13.620 -20.692 -4.513 1.00 0.00 H new ATOM 0 HA ILE B 287 13.602 -17.950 -3.902 1.00 0.00 H new ATOM 0 HB ILE B 287 15.722 -19.977 -4.555 1.00 0.00 H new ATOM 0 HG12 ILE B 287 15.214 -18.280 -2.066 1.00 0.00 H new ATOM 0 HG13 ILE B 287 14.396 -19.807 -2.329 1.00 0.00 H new ATOM 0 HG21 ILE B 287 17.450 -18.319 -4.001 1.00 0.00 H new ATOM 0 HG22 ILE B 287 16.572 -17.887 -5.487 1.00 0.00 H new ATOM 0 HG23 ILE B 287 16.213 -17.040 -3.964 1.00 0.00 H new ATOM 0 HD11 ILE B 287 16.341 -20.099 -0.848 1.00 0.00 H new ATOM 0 HD12 ILE B 287 16.584 -20.988 -2.371 1.00 0.00 H new ATOM 0 HD13 ILE B 287 17.415 -19.437 -2.103 1.00 0.00 H new ATOM 1953 N ALA B 288 14.422 -18.505 -7.079 1.00 0.00 N ATOM 1954 CA ALA B 288 14.515 -17.813 -8.370 1.00 0.00 C ATOM 1955 C ALA B 288 13.177 -17.190 -8.834 1.00 0.00 C ATOM 1956 O ALA B 288 13.167 -16.095 -9.401 1.00 0.00 O ATOM 1957 CB ALA B 288 15.078 -18.790 -9.405 1.00 0.00 C ATOM 0 H ALA B 288 14.634 -19.502 -7.124 1.00 0.00 H new ATOM 0 HA ALA B 288 15.188 -16.964 -8.254 1.00 0.00 H new ATOM 0 HB1 ALA B 288 15.154 -18.292 -10.372 1.00 0.00 H new ATOM 0 HB2 ALA B 288 16.067 -19.124 -9.090 1.00 0.00 H new ATOM 0 HB3 ALA B 288 14.415 -19.651 -9.491 1.00 0.00 H new ATOM 1963 N TYR B 289 12.041 -17.834 -8.550 1.00 0.00 N ATOM 1964 CA TYR B 289 10.697 -17.270 -8.733 1.00 0.00 C ATOM 1965 C TYR B 289 10.482 -16.010 -7.870 1.00 0.00 C ATOM 1966 O TYR B 289 10.018 -14.986 -8.380 1.00 0.00 O ATOM 1967 CB TYR B 289 9.663 -18.370 -8.445 1.00 0.00 C ATOM 1968 CG TYR B 289 8.212 -17.929 -8.361 1.00 0.00 C ATOM 1969 CD1 TYR B 289 7.613 -17.203 -9.411 1.00 0.00 C ATOM 1970 CD2 TYR B 289 7.449 -18.282 -7.230 1.00 0.00 C ATOM 1971 CE1 TYR B 289 6.256 -16.826 -9.327 1.00 0.00 C ATOM 1972 CE2 TYR B 289 6.095 -17.913 -7.149 1.00 0.00 C ATOM 1973 CZ TYR B 289 5.492 -17.183 -8.195 1.00 0.00 C ATOM 1974 OH TYR B 289 4.179 -16.831 -8.109 1.00 0.00 O ATOM 0 H TYR B 289 12.028 -18.784 -8.178 1.00 0.00 H new ATOM 0 HA TYR B 289 10.576 -16.936 -9.763 1.00 0.00 H new ATOM 0 HB2 TYR B 289 9.745 -19.128 -9.224 1.00 0.00 H new ATOM 0 HB3 TYR B 289 9.929 -18.851 -7.503 1.00 0.00 H new ATOM 0 HD1 TYR B 289 8.194 -16.935 -10.281 1.00 0.00 H new ATOM 0 HD2 TYR B 289 7.905 -18.837 -6.424 1.00 0.00 H new ATOM 0 HE1 TYR B 289 5.801 -16.264 -10.129 1.00 0.00 H new ATOM 0 HE2 TYR B 289 5.514 -18.190 -6.282 1.00 0.00 H new ATOM 0 HH TYR B 289 3.882 -16.901 -7.178 1.00 0.00 H new ATOM 1984 N ALA B 290 10.893 -16.034 -6.595 1.00 0.00 N ATOM 1985 CA ALA B 290 10.927 -14.855 -5.729 1.00 0.00 C ATOM 1986 C ALA B 290 11.786 -13.718 -6.320 1.00 0.00 C ATOM 1987 O ALA B 290 11.338 -12.573 -6.397 1.00 0.00 O ATOM 1988 CB ALA B 290 11.429 -15.262 -4.336 1.00 0.00 C ATOM 0 H ALA B 290 11.215 -16.885 -6.133 1.00 0.00 H new ATOM 0 HA ALA B 290 9.913 -14.462 -5.649 1.00 0.00 H new ATOM 0 HB1 ALA B 290 11.455 -14.386 -3.688 1.00 0.00 H new ATOM 0 HB2 ALA B 290 10.757 -16.007 -3.911 1.00 0.00 H new ATOM 0 HB3 ALA B 290 12.431 -15.682 -4.419 1.00 0.00 H new ATOM 1994 N MET B 291 13.005 -14.036 -6.778 1.00 0.00 N ATOM 1995 CA MET B 291 13.928 -13.102 -7.427 1.00 0.00 C ATOM 1996 C MET B 291 13.312 -12.443 -8.667 1.00 0.00 C ATOM 1997 O MET B 291 13.398 -11.227 -8.809 1.00 0.00 O ATOM 1998 CB MET B 291 15.254 -13.791 -7.797 1.00 0.00 C ATOM 1999 CG MET B 291 16.044 -14.288 -6.582 1.00 0.00 C ATOM 2000 SD MET B 291 17.623 -15.074 -7.004 1.00 0.00 S ATOM 2001 CE MET B 291 18.437 -15.001 -5.385 1.00 0.00 C ATOM 0 H MET B 291 13.385 -14.980 -6.703 1.00 0.00 H new ATOM 0 HA MET B 291 14.133 -12.316 -6.700 1.00 0.00 H new ATOM 0 HB2 MET B 291 15.045 -14.635 -8.454 1.00 0.00 H new ATOM 0 HB3 MET B 291 15.872 -13.093 -8.361 1.00 0.00 H new ATOM 0 HG2 MET B 291 16.235 -13.447 -5.916 1.00 0.00 H new ATOM 0 HG3 MET B 291 15.431 -15.000 -6.029 1.00 0.00 H new ATOM 0 HE1 MET B 291 19.384 -15.538 -5.429 1.00 0.00 H new ATOM 0 HE2 MET B 291 18.622 -13.961 -5.117 1.00 0.00 H new ATOM 0 HE3 MET B 291 17.794 -15.460 -4.634 1.00 0.00 H new ATOM 2011 N GLN B 292 12.649 -13.206 -9.542 1.00 0.00 N ATOM 2012 CA GLN B 292 11.981 -12.666 -10.731 1.00 0.00 C ATOM 2013 C GLN B 292 10.918 -11.612 -10.381 1.00 0.00 C ATOM 2014 O GLN B 292 10.893 -10.549 -11.005 1.00 0.00 O ATOM 2015 CB GLN B 292 11.376 -13.818 -11.555 1.00 0.00 C ATOM 2016 CG GLN B 292 10.594 -13.357 -12.800 1.00 0.00 C ATOM 2017 CD GLN B 292 11.478 -12.664 -13.839 1.00 0.00 C ATOM 2018 OE1 GLN B 292 11.982 -13.277 -14.771 1.00 0.00 O ATOM 2019 NE2 GLN B 292 11.704 -11.373 -13.723 1.00 0.00 N ATOM 0 H GLN B 292 12.560 -14.218 -9.446 1.00 0.00 H new ATOM 0 HA GLN B 292 12.732 -12.152 -11.332 1.00 0.00 H new ATOM 0 HB2 GLN B 292 12.178 -14.486 -11.869 1.00 0.00 H new ATOM 0 HB3 GLN B 292 10.711 -14.398 -10.915 1.00 0.00 H new ATOM 0 HG2 GLN B 292 10.111 -14.220 -13.259 1.00 0.00 H new ATOM 0 HG3 GLN B 292 9.801 -12.675 -12.492 1.00 0.00 H new ATOM 0 HE21 GLN B 292 11.290 -10.850 -12.951 1.00 0.00 H new ATOM 0 HE22 GLN B 292 12.293 -10.895 -14.405 1.00 0.00 H new ATOM 2028 N MET B 293 10.050 -11.878 -9.400 1.00 0.00 N ATOM 2029 CA MET B 293 9.051 -10.897 -8.949 1.00 0.00 C ATOM 2030 C MET B 293 9.707 -9.674 -8.285 1.00 0.00 C ATOM 2031 O MET B 293 9.308 -8.536 -8.531 1.00 0.00 O ATOM 2032 CB MET B 293 8.051 -11.558 -7.989 1.00 0.00 C ATOM 2033 CG MET B 293 7.168 -12.576 -8.720 1.00 0.00 C ATOM 2034 SD MET B 293 5.867 -13.314 -7.698 1.00 0.00 S ATOM 2035 CE MET B 293 6.874 -14.350 -6.603 1.00 0.00 C ATOM 0 H MET B 293 10.017 -12.766 -8.900 1.00 0.00 H new ATOM 0 HA MET B 293 8.517 -10.542 -9.830 1.00 0.00 H new ATOM 0 HB2 MET B 293 8.591 -12.054 -7.183 1.00 0.00 H new ATOM 0 HB3 MET B 293 7.425 -10.793 -7.530 1.00 0.00 H new ATOM 0 HG2 MET B 293 6.705 -12.087 -9.577 1.00 0.00 H new ATOM 0 HG3 MET B 293 7.801 -13.373 -9.111 1.00 0.00 H new ATOM 0 HE1 MET B 293 6.277 -15.188 -6.244 1.00 0.00 H new ATOM 0 HE2 MET B 293 7.737 -14.728 -7.152 1.00 0.00 H new ATOM 0 HE3 MET B 293 7.215 -13.758 -5.754 1.00 0.00 H new ATOM 2045 N SER B 294 10.757 -9.892 -7.488 1.00 0.00 N ATOM 2046 CA SER B 294 11.579 -8.854 -6.860 1.00 0.00 C ATOM 2047 C SER B 294 12.232 -7.895 -7.869 1.00 0.00 C ATOM 2048 O SER B 294 12.228 -6.680 -7.661 1.00 0.00 O ATOM 2049 CB SER B 294 12.639 -9.555 -6.016 1.00 0.00 C ATOM 2050 OG SER B 294 13.335 -8.616 -5.238 1.00 0.00 O ATOM 0 H SER B 294 11.070 -10.834 -7.253 1.00 0.00 H new ATOM 0 HA SER B 294 10.934 -8.226 -6.246 1.00 0.00 H new ATOM 0 HB2 SER B 294 12.169 -10.297 -5.370 1.00 0.00 H new ATOM 0 HB3 SER B 294 13.334 -10.090 -6.663 1.00 0.00 H new ATOM 0 HG SER B 294 12.803 -7.797 -5.160 1.00 0.00 H new