USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 586 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 60 ASN : amide:sc= 0.00542 K(o=0.011,f=-0.67) USER MOD Set 1.2: A 62 GLN : amide:sc= 0.00568 K(o=0.011,f=-2.2!) USER MOD Set 2.1: A 25 ASN : amide:sc= 0.977 K(o=2.1,f=-11!) USER MOD Set 2.2: A 29 LYS NZ :NH3+ 164:sc= 1.15 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -179:sc= 0.991 (180deg=0.983) USER MOD Single : A 2 GLN : amide:sc= 0.962 K(o=0.96,f=-0.32) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 72:sc= 1.43 USER MOD Single : A 9 THR OG1 : rot 180:sc= -0.129 USER MOD Single : A 11 LYS NZ :NH3+ -120:sc= 0.442 (180deg=-2.3!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 36:sc= 0.166 USER MOD Single : A 20 SER OG : rot 180:sc= 0.00193 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 178:sc= 1.3 (180deg=1.26) USER MOD Single : A 31 GLN : amide:sc= -0.21 K(o=-0.21,f=-1.2) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.171 K(o=-0.17,f=-3.6!) USER MOD Single : A 41 GLN : amide:sc= 0.944 K(o=0.94,f=-2.3) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.148 K(o=-0.15,f=-0.65) USER MOD Single : A 55 THR OG1 : rot -85:sc= 1.34 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -175:sc= 1.15 USER MOD Single : A 63 LYS NZ :NH3+ -159:sc= -0.0337 (180deg=-0.307) USER MOD Single : A 65 SER OG : rot 130:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.275 K(o=-0.28,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.417 33.536 20.157 1.00 0.00 N ATOM 2 CA MET A 1 12.739 32.677 19.007 1.00 0.00 C ATOM 3 C MET A 1 14.175 32.133 19.061 1.00 0.00 C ATOM 4 O MET A 1 14.644 31.529 18.104 1.00 0.00 O ATOM 5 CB MET A 1 12.410 33.452 17.727 1.00 0.00 C ATOM 6 CG MET A 1 12.241 32.732 16.394 1.00 0.00 C ATOM 7 SD MET A 1 12.396 33.941 15.047 1.00 0.00 S ATOM 8 CE MET A 1 12.859 32.893 13.646 1.00 0.00 C ATOM 0 H1 MET A 1 11.433 33.863 20.081 1.00 0.00 H new ATOM 0 H2 MET A 1 12.536 32.996 21.038 1.00 0.00 H new ATOM 0 H3 MET A 1 13.055 34.357 20.166 1.00 0.00 H new ATOM 0 HA MET A 1 12.126 31.776 19.030 1.00 0.00 H new ATOM 0 HB2 MET A 1 11.486 33.999 17.914 1.00 0.00 H new ATOM 0 HB3 MET A 1 13.197 34.194 17.592 1.00 0.00 H new ATOM 0 HG2 MET A 1 12.995 31.952 16.289 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.268 32.243 16.351 1.00 0.00 H new ATOM 0 HE1 MET A 1 12.985 33.510 12.756 1.00 0.00 H new ATOM 0 HE2 MET A 1 13.795 32.381 13.868 1.00 0.00 H new ATOM 0 HE3 MET A 1 12.076 32.156 13.468 1.00 0.00 H new ATOM 20 N GLN A 2 14.871 32.406 20.166 1.00 0.00 N ATOM 21 CA GLN A 2 16.299 32.276 20.303 1.00 0.00 C ATOM 22 C GLN A 2 16.808 30.979 20.937 1.00 0.00 C ATOM 23 O GLN A 2 16.141 30.281 21.690 1.00 0.00 O ATOM 24 CB GLN A 2 16.793 33.506 21.061 1.00 0.00 C ATOM 25 CG GLN A 2 16.809 34.778 20.223 1.00 0.00 C ATOM 26 CD GLN A 2 16.863 36.080 21.019 1.00 0.00 C ATOM 27 OE1 GLN A 2 16.586 36.229 22.213 1.00 0.00 O ATOM 28 NE2 GLN A 2 17.380 37.111 20.363 1.00 0.00 N ATOM 0 H GLN A 2 14.423 32.737 21.020 1.00 0.00 H new ATOM 0 HA GLN A 2 16.713 32.216 19.296 1.00 0.00 H new ATOM 0 HB2 GLN A 2 16.158 33.664 21.932 1.00 0.00 H new ATOM 0 HB3 GLN A 2 17.800 33.313 21.431 1.00 0.00 H new ATOM 0 HG2 GLN A 2 17.670 34.743 19.555 1.00 0.00 H new ATOM 0 HG3 GLN A 2 15.918 34.791 19.595 1.00 0.00 H new ATOM 0 HE21 GLN A 2 17.619 37.019 19.376 1.00 0.00 H new ATOM 0 HE22 GLN A 2 17.538 37.995 20.846 1.00 0.00 H new ATOM 37 N ILE A 3 18.112 30.744 20.812 1.00 0.00 N ATOM 38 CA ILE A 3 18.972 29.964 21.668 1.00 0.00 C ATOM 39 C ILE A 3 19.909 31.034 22.216 1.00 0.00 C ATOM 40 O ILE A 3 20.321 31.915 21.467 1.00 0.00 O ATOM 41 CB ILE A 3 19.718 28.848 20.943 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.330 29.258 19.598 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.787 27.651 20.786 1.00 0.00 C ATOM 44 CD1 ILE A 3 21.559 28.395 19.310 1.00 0.00 C ATOM 0 H ILE A 3 18.634 31.138 20.029 1.00 0.00 H new ATOM 0 HA ILE A 3 18.425 29.413 22.433 1.00 0.00 H new ATOM 0 HB ILE A 3 20.576 28.586 21.562 1.00 0.00 H new ATOM 0 HG12 ILE A 3 19.595 29.140 18.802 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.610 30.311 19.620 1.00 0.00 H new ATOM 0 HG21 ILE A 3 19.311 26.848 20.269 1.00 0.00 H new ATOM 0 HG22 ILE A 3 18.472 27.304 21.770 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.911 27.945 20.207 1.00 0.00 H new ATOM 0 HD11 ILE A 3 21.993 28.687 18.354 1.00 0.00 H new ATOM 0 HD12 ILE A 3 22.296 28.535 20.101 1.00 0.00 H new ATOM 0 HD13 ILE A 3 21.266 27.346 19.270 1.00 0.00 H new ATOM 56 N PHE A 4 20.183 31.051 23.521 1.00 0.00 N ATOM 57 CA PHE A 4 21.251 31.795 24.144 1.00 0.00 C ATOM 58 C PHE A 4 22.577 31.040 24.177 1.00 0.00 C ATOM 59 O PHE A 4 22.681 30.109 24.972 1.00 0.00 O ATOM 60 CB PHE A 4 20.907 32.232 25.571 1.00 0.00 C ATOM 61 CG PHE A 4 19.603 32.971 25.783 1.00 0.00 C ATOM 62 CD1 PHE A 4 18.404 32.269 25.942 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.603 34.378 25.864 1.00 0.00 C ATOM 64 CE1 PHE A 4 17.188 32.957 26.035 1.00 0.00 C ATOM 65 CE2 PHE A 4 18.373 35.039 25.790 1.00 0.00 C ATOM 66 CZ PHE A 4 17.163 34.356 25.971 1.00 0.00 C ATOM 0 H PHE A 4 19.634 30.517 24.195 1.00 0.00 H new ATOM 0 HA PHE A 4 21.367 32.675 23.511 1.00 0.00 H new ATOM 0 HB2 PHE A 4 20.895 31.343 26.201 1.00 0.00 H new ATOM 0 HB3 PHE A 4 21.716 32.868 25.932 1.00 0.00 H new ATOM 0 HD1 PHE A 4 18.416 31.190 25.993 1.00 0.00 H new ATOM 0 HD2 PHE A 4 20.525 34.929 25.980 1.00 0.00 H new ATOM 0 HE1 PHE A 4 16.266 32.407 26.156 1.00 0.00 H new ATOM 0 HE2 PHE A 4 18.355 36.100 25.589 1.00 0.00 H new ATOM 0 HZ PHE A 4 16.232 34.896 26.059 1.00 0.00 H new ATOM 76 N VAL A 5 23.650 31.403 23.471 1.00 0.00 N ATOM 77 CA VAL A 5 24.927 30.721 23.375 1.00 0.00 C ATOM 78 C VAL A 5 25.943 31.490 24.219 1.00 0.00 C ATOM 79 O VAL A 5 26.162 32.624 23.804 1.00 0.00 O ATOM 80 CB VAL A 5 25.348 30.709 21.911 1.00 0.00 C ATOM 81 CG1 VAL A 5 26.402 29.614 21.714 1.00 0.00 C ATOM 82 CG2 VAL A 5 24.196 30.383 20.957 1.00 0.00 C ATOM 0 H VAL A 5 23.639 32.253 22.908 1.00 0.00 H new ATOM 0 HA VAL A 5 24.862 29.696 23.739 1.00 0.00 H new ATOM 0 HB VAL A 5 25.719 31.708 21.684 1.00 0.00 H new ATOM 0 HG11 VAL A 5 26.714 29.593 20.670 1.00 0.00 H new ATOM 0 HG12 VAL A 5 27.265 29.822 22.346 1.00 0.00 H new ATOM 0 HG13 VAL A 5 25.978 28.647 21.986 1.00 0.00 H new ATOM 0 HG21 VAL A 5 24.561 30.390 19.930 1.00 0.00 H new ATOM 0 HG22 VAL A 5 23.796 29.397 21.193 1.00 0.00 H new ATOM 0 HG23 VAL A 5 23.410 31.130 21.068 1.00 0.00 H new ATOM 92 N LYS A 6 26.506 30.880 25.264 1.00 0.00 N ATOM 93 CA LYS A 6 27.324 31.422 26.328 1.00 0.00 C ATOM 94 C LYS A 6 28.687 30.719 26.260 1.00 0.00 C ATOM 95 O LYS A 6 28.790 29.532 25.986 1.00 0.00 O ATOM 96 CB LYS A 6 26.590 31.407 27.669 1.00 0.00 C ATOM 97 CG LYS A 6 25.685 32.616 27.899 1.00 0.00 C ATOM 98 CD LYS A 6 24.952 32.704 29.233 1.00 0.00 C ATOM 99 CE LYS A 6 24.262 34.014 29.624 1.00 0.00 C ATOM 100 NZ LYS A 6 24.050 34.081 31.080 1.00 0.00 N ATOM 0 H LYS A 6 26.378 29.876 25.390 1.00 0.00 H new ATOM 0 HA LYS A 6 27.523 32.487 26.204 1.00 0.00 H new ATOM 0 HB2 LYS A 6 25.989 30.500 27.732 1.00 0.00 H new ATOM 0 HB3 LYS A 6 27.325 31.359 28.473 1.00 0.00 H new ATOM 0 HG2 LYS A 6 26.291 33.515 27.788 1.00 0.00 H new ATOM 0 HG3 LYS A 6 24.940 32.634 27.104 1.00 0.00 H new ATOM 0 HD2 LYS A 6 24.195 31.919 29.243 1.00 0.00 H new ATOM 0 HD3 LYS A 6 25.670 32.465 30.018 1.00 0.00 H new ATOM 0 HE2 LYS A 6 24.869 34.860 29.301 1.00 0.00 H new ATOM 0 HE3 LYS A 6 23.305 34.094 29.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 23.581 34.977 31.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 23.452 33.285 31.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 24.967 34.028 31.567 1.00 0.00 H new ATOM 114 N THR A 7 29.717 31.418 26.720 1.00 0.00 N ATOM 115 CA THR A 7 31.093 30.971 26.769 1.00 0.00 C ATOM 116 C THR A 7 31.916 31.693 27.847 1.00 0.00 C ATOM 117 O THR A 7 31.447 32.676 28.415 1.00 0.00 O ATOM 118 CB THR A 7 31.688 30.956 25.366 1.00 0.00 C ATOM 119 OG1 THR A 7 32.793 30.072 25.366 1.00 0.00 O ATOM 120 CG2 THR A 7 32.063 32.351 24.872 1.00 0.00 C ATOM 0 H THR A 7 29.603 32.363 27.088 1.00 0.00 H new ATOM 0 HA THR A 7 31.126 29.936 27.109 1.00 0.00 H new ATOM 0 HB THR A 7 30.936 30.603 24.660 1.00 0.00 H new ATOM 0 HG1 THR A 7 32.472 29.148 25.424 1.00 0.00 H new ATOM 0 HG21 THR A 7 32.482 32.281 23.868 1.00 0.00 H new ATOM 0 HG22 THR A 7 31.174 32.981 24.851 1.00 0.00 H new ATOM 0 HG23 THR A 7 32.802 32.788 25.544 1.00 0.00 H new ATOM 128 N LEU A 8 33.107 31.133 28.010 1.00 0.00 N ATOM 129 CA LEU A 8 33.940 31.428 29.166 1.00 0.00 C ATOM 130 C LEU A 8 34.677 32.764 29.094 1.00 0.00 C ATOM 131 O LEU A 8 35.000 33.363 30.116 1.00 0.00 O ATOM 132 CB LEU A 8 34.879 30.276 29.516 1.00 0.00 C ATOM 133 CG LEU A 8 34.242 28.902 29.656 1.00 0.00 C ATOM 134 CD1 LEU A 8 32.881 28.888 30.352 1.00 0.00 C ATOM 135 CD2 LEU A 8 34.389 28.076 28.378 1.00 0.00 C ATOM 0 H LEU A 8 33.518 30.470 27.353 1.00 0.00 H new ATOM 0 HA LEU A 8 33.234 31.539 29.989 1.00 0.00 H new ATOM 0 HB2 LEU A 8 35.650 30.218 28.748 1.00 0.00 H new ATOM 0 HB3 LEU A 8 35.381 30.517 30.453 1.00 0.00 H new ATOM 0 HG LEU A 8 34.827 28.351 30.392 1.00 0.00 H new ATOM 0 HD11 LEU A 8 32.509 27.865 30.404 1.00 0.00 H new ATOM 0 HD12 LEU A 8 32.984 29.288 31.361 1.00 0.00 H new ATOM 0 HD13 LEU A 8 32.178 29.501 29.789 1.00 0.00 H new ATOM 0 HD21 LEU A 8 33.921 27.102 28.519 1.00 0.00 H new ATOM 0 HD22 LEU A 8 33.904 28.595 27.551 1.00 0.00 H new ATOM 0 HD23 LEU A 8 35.447 27.941 28.151 1.00 0.00 H new ATOM 147 N THR A 9 34.902 33.299 27.891 1.00 0.00 N ATOM 148 CA THR A 9 35.394 34.638 27.658 1.00 0.00 C ATOM 149 C THR A 9 34.353 35.744 27.838 1.00 0.00 C ATOM 150 O THR A 9 34.700 36.915 27.951 1.00 0.00 O ATOM 151 CB THR A 9 35.917 34.664 26.222 1.00 0.00 C ATOM 152 OG1 THR A 9 34.843 34.195 25.441 1.00 0.00 O ATOM 153 CG2 THR A 9 37.079 33.685 26.073 1.00 0.00 C ATOM 0 H THR A 9 34.737 32.783 27.027 1.00 0.00 H new ATOM 0 HA THR A 9 36.160 34.848 28.404 1.00 0.00 H new ATOM 0 HB THR A 9 36.261 35.657 25.934 1.00 0.00 H new ATOM 0 HG1 THR A 9 35.105 34.185 24.497 1.00 0.00 H new ATOM 0 HG21 THR A 9 37.446 33.709 25.047 1.00 0.00 H new ATOM 0 HG22 THR A 9 37.883 33.968 26.753 1.00 0.00 H new ATOM 0 HG23 THR A 9 36.739 32.678 26.313 1.00 0.00 H new ATOM 161 N GLY A 10 33.068 35.449 28.039 1.00 0.00 N ATOM 162 CA GLY A 10 32.030 36.357 28.478 1.00 0.00 C ATOM 163 C GLY A 10 30.868 36.502 27.492 1.00 0.00 C ATOM 164 O GLY A 10 29.828 36.995 27.927 1.00 0.00 O ATOM 0 H GLY A 10 32.711 34.506 27.887 1.00 0.00 H new ATOM 0 HA2 GLY A 10 31.639 36.010 29.435 1.00 0.00 H new ATOM 0 HA3 GLY A 10 32.470 37.339 28.651 1.00 0.00 H new ATOM 168 N LYS A 11 31.042 36.234 26.198 1.00 0.00 N ATOM 169 CA LYS A 11 30.019 36.430 25.195 1.00 0.00 C ATOM 170 C LYS A 11 28.702 35.668 25.352 1.00 0.00 C ATOM 171 O LYS A 11 28.723 34.448 25.440 1.00 0.00 O ATOM 172 CB LYS A 11 30.578 35.997 23.836 1.00 0.00 C ATOM 173 CG LYS A 11 31.750 36.806 23.281 1.00 0.00 C ATOM 174 CD LYS A 11 33.143 36.203 23.494 1.00 0.00 C ATOM 175 CE LYS A 11 34.260 37.241 23.369 1.00 0.00 C ATOM 176 NZ LYS A 11 34.492 37.493 21.937 1.00 0.00 N ATOM 0 H LYS A 11 31.916 35.869 25.820 1.00 0.00 H new ATOM 0 HA LYS A 11 29.775 37.487 25.300 1.00 0.00 H new ATOM 0 HB2 LYS A 11 30.891 34.956 23.914 1.00 0.00 H new ATOM 0 HB3 LYS A 11 29.767 36.032 23.109 1.00 0.00 H new ATOM 0 HG2 LYS A 11 31.596 36.945 22.211 1.00 0.00 H new ATOM 0 HG3 LYS A 11 31.731 37.796 23.737 1.00 0.00 H new ATOM 0 HD2 LYS A 11 33.188 35.743 24.481 1.00 0.00 H new ATOM 0 HD3 LYS A 11 33.306 35.409 22.765 1.00 0.00 H new ATOM 0 HE2 LYS A 11 33.981 38.164 23.878 1.00 0.00 H new ATOM 0 HE3 LYS A 11 35.171 36.878 23.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 35.475 37.252 21.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 33.844 36.908 21.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 34.321 38.498 21.729 1.00 0.00 H new ATOM 190 N THR A 12 27.612 36.412 25.184 1.00 0.00 N ATOM 191 CA THR A 12 26.274 35.869 25.093 1.00 0.00 C ATOM 192 C THR A 12 25.821 36.140 23.651 1.00 0.00 C ATOM 193 O THR A 12 25.492 37.284 23.354 1.00 0.00 O ATOM 194 CB THR A 12 25.462 36.598 26.166 1.00 0.00 C ATOM 195 OG1 THR A 12 26.058 36.460 27.439 1.00 0.00 O ATOM 196 CG2 THR A 12 24.057 36.012 26.274 1.00 0.00 C ATOM 0 H THR A 12 27.643 37.429 25.107 1.00 0.00 H new ATOM 0 HA THR A 12 26.171 34.799 25.275 1.00 0.00 H new ATOM 0 HB THR A 12 25.427 37.646 25.870 1.00 0.00 H new ATOM 0 HG1 THR A 12 25.520 36.936 28.105 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.498 36.546 27.043 1.00 0.00 H new ATOM 0 HG22 THR A 12 23.546 36.114 25.317 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.122 34.957 26.540 1.00 0.00 H new ATOM 204 N ILE A 13 25.802 35.164 22.750 1.00 0.00 N ATOM 205 CA ILE A 13 25.336 35.183 21.375 1.00 0.00 C ATOM 206 C ILE A 13 23.905 34.633 21.393 1.00 0.00 C ATOM 207 O ILE A 13 23.624 33.437 21.488 1.00 0.00 O ATOM 208 CB ILE A 13 26.334 34.410 20.512 1.00 0.00 C ATOM 209 CG1 ILE A 13 27.762 34.939 20.501 1.00 0.00 C ATOM 210 CG2 ILE A 13 25.831 34.382 19.066 1.00 0.00 C ATOM 211 CD1 ILE A 13 28.699 34.285 19.473 1.00 0.00 C ATOM 0 H ILE A 13 26.153 34.239 22.997 1.00 0.00 H new ATOM 0 HA ILE A 13 25.290 36.176 20.928 1.00 0.00 H new ATOM 0 HB ILE A 13 26.385 33.422 20.970 1.00 0.00 H new ATOM 0 HG12 ILE A 13 27.733 36.012 20.310 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.189 34.804 21.495 1.00 0.00 H new ATOM 0 HG21 ILE A 13 26.538 33.832 18.445 1.00 0.00 H new ATOM 0 HG22 ILE A 13 24.858 33.892 19.029 1.00 0.00 H new ATOM 0 HG23 ILE A 13 25.738 35.402 18.693 1.00 0.00 H new ATOM 0 HD11 ILE A 13 29.690 34.733 19.547 1.00 0.00 H new ATOM 0 HD12 ILE A 13 28.768 33.216 19.672 1.00 0.00 H new ATOM 0 HD13 ILE A 13 28.304 34.442 18.469 1.00 0.00 H new ATOM 223 N THR A 14 23.004 35.541 21.026 1.00 0.00 N ATOM 224 CA THR A 14 21.628 35.201 20.733 1.00 0.00 C ATOM 225 C THR A 14 21.429 34.847 19.261 1.00 0.00 C ATOM 226 O THR A 14 21.657 35.778 18.485 1.00 0.00 O ATOM 227 CB THR A 14 20.789 36.405 21.184 1.00 0.00 C ATOM 228 OG1 THR A 14 21.135 37.666 20.648 1.00 0.00 O ATOM 229 CG2 THR A 14 20.675 36.413 22.705 1.00 0.00 C ATOM 0 H THR A 14 23.215 36.534 20.925 1.00 0.00 H new ATOM 0 HA THR A 14 21.316 34.303 21.266 1.00 0.00 H new ATOM 0 HB THR A 14 19.806 36.250 20.739 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.431 37.557 19.720 1.00 0.00 H new ATOM 0 HG21 THR A 14 20.079 37.269 23.021 1.00 0.00 H new ATOM 0 HG22 THR A 14 20.194 35.493 23.039 1.00 0.00 H new ATOM 0 HG23 THR A 14 21.670 36.482 23.144 1.00 0.00 H new ATOM 237 N LEU A 15 21.166 33.627 18.796 1.00 0.00 N ATOM 238 CA LEU A 15 20.838 33.384 17.404 1.00 0.00 C ATOM 239 C LEU A 15 19.369 32.950 17.412 1.00 0.00 C ATOM 240 O LEU A 15 18.956 32.157 18.254 1.00 0.00 O ATOM 241 CB LEU A 15 21.712 32.278 16.818 1.00 0.00 C ATOM 242 CG LEU A 15 23.196 32.516 17.050 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.077 31.436 16.417 1.00 0.00 C ATOM 244 CD2 LEU A 15 23.557 33.884 16.469 1.00 0.00 C ATOM 0 H LEU A 15 21.176 32.787 19.375 1.00 0.00 H new ATOM 0 HA LEU A 15 21.007 34.270 16.792 1.00 0.00 H new ATOM 0 HB2 LEU A 15 21.428 31.323 17.261 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.524 32.201 15.747 1.00 0.00 H new ATOM 0 HG LEU A 15 23.382 32.479 18.123 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.125 31.659 16.616 1.00 0.00 H new ATOM 0 HD12 LEU A 15 23.825 30.465 16.844 1.00 0.00 H new ATOM 0 HD13 LEU A 15 23.908 31.414 15.340 1.00 0.00 H new ATOM 0 HD21 LEU A 15 24.619 34.077 16.624 1.00 0.00 H new ATOM 0 HD22 LEU A 15 23.338 33.895 15.401 1.00 0.00 H new ATOM 0 HD23 LEU A 15 22.972 34.657 16.967 1.00 0.00 H new ATOM 256 N GLU A 16 18.580 33.406 16.441 1.00 0.00 N ATOM 257 CA GLU A 16 17.187 33.079 16.219 1.00 0.00 C ATOM 258 C GLU A 16 17.140 31.839 15.330 1.00 0.00 C ATOM 259 O GLU A 16 17.906 31.696 14.379 1.00 0.00 O ATOM 260 CB GLU A 16 16.405 34.161 15.472 1.00 0.00 C ATOM 261 CG GLU A 16 16.158 35.463 16.241 1.00 0.00 C ATOM 262 CD GLU A 16 17.263 36.491 16.408 1.00 0.00 C ATOM 263 OE1 GLU A 16 17.912 36.804 15.380 1.00 0.00 O ATOM 264 OE2 GLU A 16 17.482 36.908 17.566 1.00 0.00 O ATOM 0 H GLU A 16 18.930 34.061 15.742 1.00 0.00 H new ATOM 0 HA GLU A 16 16.736 32.949 17.203 1.00 0.00 H new ATOM 0 HB2 GLU A 16 16.942 34.401 14.554 1.00 0.00 H new ATOM 0 HB3 GLU A 16 15.440 33.747 15.179 1.00 0.00 H new ATOM 0 HG2 GLU A 16 15.322 35.967 15.756 1.00 0.00 H new ATOM 0 HG3 GLU A 16 15.825 35.186 17.241 1.00 0.00 H new ATOM 271 N VAL A 17 16.257 30.916 15.722 1.00 0.00 N ATOM 272 CA VAL A 17 16.209 29.523 15.352 1.00 0.00 C ATOM 273 C VAL A 17 14.758 29.055 15.156 1.00 0.00 C ATOM 274 O VAL A 17 13.893 29.862 15.490 1.00 0.00 O ATOM 275 CB VAL A 17 16.974 28.623 16.324 1.00 0.00 C ATOM 276 CG1 VAL A 17 18.473 28.897 16.359 1.00 0.00 C ATOM 277 CG2 VAL A 17 16.417 28.920 17.717 1.00 0.00 C ATOM 0 H VAL A 17 15.499 31.158 16.360 1.00 0.00 H new ATOM 0 HA VAL A 17 16.723 29.431 14.395 1.00 0.00 H new ATOM 0 HB VAL A 17 16.846 27.589 16.003 1.00 0.00 H new ATOM 0 HG11 VAL A 17 18.950 28.222 17.070 1.00 0.00 H new ATOM 0 HG12 VAL A 17 18.895 28.737 15.367 1.00 0.00 H new ATOM 0 HG13 VAL A 17 18.647 29.928 16.665 1.00 0.00 H new ATOM 0 HG21 VAL A 17 16.930 28.302 18.454 1.00 0.00 H new ATOM 0 HG22 VAL A 17 16.573 29.972 17.955 1.00 0.00 H new ATOM 0 HG23 VAL A 17 15.350 28.698 17.737 1.00 0.00 H new ATOM 287 N GLU A 18 14.626 27.816 14.683 1.00 0.00 N ATOM 288 CA GLU A 18 13.462 27.028 14.998 1.00 0.00 C ATOM 289 C GLU A 18 13.922 25.632 15.431 1.00 0.00 C ATOM 290 O GLU A 18 15.065 25.257 15.176 1.00 0.00 O ATOM 291 CB GLU A 18 12.743 26.974 13.654 1.00 0.00 C ATOM 292 CG GLU A 18 12.175 28.336 13.244 1.00 0.00 C ATOM 293 CD GLU A 18 10.918 28.786 13.972 1.00 0.00 C ATOM 294 OE1 GLU A 18 10.389 28.151 14.912 1.00 0.00 O ATOM 295 OE2 GLU A 18 10.558 29.915 13.578 1.00 0.00 O ATOM 0 H GLU A 18 15.310 27.350 14.087 1.00 0.00 H new ATOM 0 HA GLU A 18 12.837 27.420 15.800 1.00 0.00 H new ATOM 0 HB2 GLU A 18 13.436 26.626 12.888 1.00 0.00 H new ATOM 0 HB3 GLU A 18 11.933 26.246 13.706 1.00 0.00 H new ATOM 0 HG2 GLU A 18 12.948 29.089 13.397 1.00 0.00 H new ATOM 0 HG3 GLU A 18 11.961 28.311 12.175 1.00 0.00 H new ATOM 302 N PRO A 19 13.040 24.833 16.022 1.00 0.00 N ATOM 303 CA PRO A 19 13.206 23.409 16.172 1.00 0.00 C ATOM 304 C PRO A 19 13.852 22.581 15.046 1.00 0.00 C ATOM 305 O PRO A 19 14.365 21.491 15.281 1.00 0.00 O ATOM 306 CB PRO A 19 11.820 22.842 16.498 1.00 0.00 C ATOM 307 CG PRO A 19 11.146 24.000 17.247 1.00 0.00 C ATOM 308 CD PRO A 19 11.774 25.233 16.601 1.00 0.00 C ATOM 0 HA PRO A 19 13.959 23.308 16.954 1.00 0.00 H new ATOM 0 HB2 PRO A 19 11.272 22.570 15.596 1.00 0.00 H new ATOM 0 HB3 PRO A 19 11.885 21.945 17.114 1.00 0.00 H new ATOM 0 HG2 PRO A 19 10.063 23.986 17.123 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.345 23.959 18.318 1.00 0.00 H new ATOM 0 HD2 PRO A 19 11.115 25.640 15.834 1.00 0.00 H new ATOM 0 HD3 PRO A 19 11.924 26.018 17.342 1.00 0.00 H new ATOM 316 N SER A 20 13.844 23.088 13.821 1.00 0.00 N ATOM 317 CA SER A 20 14.262 22.468 12.572 1.00 0.00 C ATOM 318 C SER A 20 15.709 22.775 12.189 1.00 0.00 C ATOM 319 O SER A 20 16.300 22.009 11.440 1.00 0.00 O ATOM 320 CB SER A 20 13.279 22.868 11.468 1.00 0.00 C ATOM 321 OG SER A 20 13.120 24.259 11.325 1.00 0.00 O ATOM 0 H SER A 20 13.511 24.039 13.662 1.00 0.00 H new ATOM 0 HA SER A 20 14.240 21.387 12.710 1.00 0.00 H new ATOM 0 HB2 SER A 20 13.622 22.452 10.521 1.00 0.00 H new ATOM 0 HB3 SER A 20 12.308 22.421 11.680 1.00 0.00 H new ATOM 0 HG SER A 20 12.482 24.443 10.604 1.00 0.00 H new ATOM 327 N ASP A 21 16.271 23.845 12.742 1.00 0.00 N ATOM 328 CA ASP A 21 17.664 24.195 12.520 1.00 0.00 C ATOM 329 C ASP A 21 18.626 23.210 13.179 1.00 0.00 C ATOM 330 O ASP A 21 18.343 22.612 14.215 1.00 0.00 O ATOM 331 CB ASP A 21 17.982 25.577 13.094 1.00 0.00 C ATOM 332 CG ASP A 21 17.334 26.663 12.242 1.00 0.00 C ATOM 333 OD1 ASP A 21 17.777 26.689 11.071 1.00 0.00 O ATOM 334 OD2 ASP A 21 16.682 27.588 12.761 1.00 0.00 O ATOM 0 H ASP A 21 15.773 24.491 13.355 1.00 0.00 H new ATOM 0 HA ASP A 21 17.800 24.176 11.439 1.00 0.00 H new ATOM 0 HB2 ASP A 21 17.620 25.645 14.120 1.00 0.00 H new ATOM 0 HB3 ASP A 21 19.061 25.726 13.127 1.00 0.00 H new ATOM 339 N THR A 22 19.735 23.023 12.477 1.00 0.00 N ATOM 340 CA THR A 22 20.730 22.029 12.825 1.00 0.00 C ATOM 341 C THR A 22 21.795 22.587 13.768 1.00 0.00 C ATOM 342 O THR A 22 22.092 23.782 13.808 1.00 0.00 O ATOM 343 CB THR A 22 21.285 21.414 11.532 1.00 0.00 C ATOM 344 OG1 THR A 22 22.064 22.271 10.733 1.00 0.00 O ATOM 345 CG2 THR A 22 20.269 20.702 10.646 1.00 0.00 C ATOM 0 H THR A 22 19.968 23.563 11.644 1.00 0.00 H new ATOM 0 HA THR A 22 20.271 21.225 13.400 1.00 0.00 H new ATOM 0 HB THR A 22 21.945 20.659 11.959 1.00 0.00 H new ATOM 0 HG1 THR A 22 22.371 21.788 9.937 1.00 0.00 H new ATOM 0 HG21 THR A 22 20.770 20.307 9.762 1.00 0.00 H new ATOM 0 HG22 THR A 22 19.813 19.882 11.201 1.00 0.00 H new ATOM 0 HG23 THR A 22 19.496 21.407 10.340 1.00 0.00 H new ATOM 353 N ILE A 23 22.559 21.677 14.373 1.00 0.00 N ATOM 354 CA ILE A 23 23.747 21.965 15.144 1.00 0.00 C ATOM 355 C ILE A 23 24.906 22.342 14.217 1.00 0.00 C ATOM 356 O ILE A 23 25.501 23.373 14.525 1.00 0.00 O ATOM 357 CB ILE A 23 24.108 20.785 16.040 1.00 0.00 C ATOM 358 CG1 ILE A 23 22.957 20.406 16.978 1.00 0.00 C ATOM 359 CG2 ILE A 23 25.437 21.008 16.759 1.00 0.00 C ATOM 360 CD1 ILE A 23 22.702 21.508 18.015 1.00 0.00 C ATOM 0 H ILE A 23 22.349 20.680 14.331 1.00 0.00 H new ATOM 0 HA ILE A 23 23.545 22.818 15.791 1.00 0.00 H new ATOM 0 HB ILE A 23 24.260 19.916 15.400 1.00 0.00 H new ATOM 0 HG12 ILE A 23 22.052 20.234 16.396 1.00 0.00 H new ATOM 0 HG13 ILE A 23 23.192 19.471 17.487 1.00 0.00 H new ATOM 0 HG21 ILE A 23 25.660 20.146 17.388 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.231 21.136 16.024 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.370 21.902 17.379 1.00 0.00 H new ATOM 0 HD11 ILE A 23 21.880 21.211 18.667 1.00 0.00 H new ATOM 0 HD12 ILE A 23 23.601 21.661 18.612 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.443 22.436 17.504 1.00 0.00 H new ATOM 372 N GLU A 24 25.298 21.658 13.150 1.00 0.00 N ATOM 373 CA GLU A 24 26.307 22.158 12.230 1.00 0.00 C ATOM 374 C GLU A 24 26.083 23.494 11.514 1.00 0.00 C ATOM 375 O GLU A 24 27.046 24.036 10.970 1.00 0.00 O ATOM 376 CB GLU A 24 26.542 21.057 11.201 1.00 0.00 C ATOM 377 CG GLU A 24 25.443 20.385 10.371 1.00 0.00 C ATOM 378 CD GLU A 24 24.519 19.435 11.120 1.00 0.00 C ATOM 379 OE1 GLU A 24 24.744 19.165 12.331 1.00 0.00 O ATOM 380 OE2 GLU A 24 23.723 18.791 10.411 1.00 0.00 O ATOM 0 H GLU A 24 24.925 20.742 12.900 1.00 0.00 H new ATOM 0 HA GLU A 24 27.161 22.399 12.864 1.00 0.00 H new ATOM 0 HB2 GLU A 24 27.254 21.464 10.483 1.00 0.00 H new ATOM 0 HB3 GLU A 24 27.051 20.253 11.733 1.00 0.00 H new ATOM 0 HG2 GLU A 24 24.834 21.165 9.914 1.00 0.00 H new ATOM 0 HG3 GLU A 24 25.916 19.833 9.559 1.00 0.00 H new ATOM 387 N ASN A 25 24.892 24.082 11.577 1.00 0.00 N ATOM 388 CA ASN A 25 24.783 25.484 11.259 1.00 0.00 C ATOM 389 C ASN A 25 25.326 26.375 12.376 1.00 0.00 C ATOM 390 O ASN A 25 25.970 27.408 12.141 1.00 0.00 O ATOM 391 CB ASN A 25 23.278 25.733 11.108 1.00 0.00 C ATOM 392 CG ASN A 25 22.930 27.030 10.381 1.00 0.00 C ATOM 393 OD1 ASN A 25 22.398 27.950 11.005 1.00 0.00 O ATOM 394 ND2 ASN A 25 23.305 27.186 9.117 1.00 0.00 N ATOM 0 H ASN A 25 24.021 23.620 11.837 1.00 0.00 H new ATOM 0 HA ASN A 25 25.360 25.722 10.366 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.835 24.896 10.568 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.822 25.751 12.098 1.00 0.00 H new ATOM 0 HD21 ASN A 25 23.154 28.078 8.647 1.00 0.00 H new ATOM 0 HD22 ASN A 25 23.744 26.413 8.616 1.00 0.00 H new ATOM 401 N VAL A 26 25.127 26.071 13.652 1.00 0.00 N ATOM 402 CA VAL A 26 25.403 26.980 14.739 1.00 0.00 C ATOM 403 C VAL A 26 26.914 27.122 14.911 1.00 0.00 C ATOM 404 O VAL A 26 27.416 28.164 15.341 1.00 0.00 O ATOM 405 CB VAL A 26 24.684 26.683 16.055 1.00 0.00 C ATOM 406 CG1 VAL A 26 25.207 27.341 17.332 1.00 0.00 C ATOM 407 CG2 VAL A 26 23.200 26.997 15.864 1.00 0.00 C ATOM 0 H VAL A 26 24.763 25.169 13.958 1.00 0.00 H new ATOM 0 HA VAL A 26 24.973 27.939 14.450 1.00 0.00 H new ATOM 0 HB VAL A 26 24.885 25.629 16.246 1.00 0.00 H new ATOM 0 HG11 VAL A 26 24.593 27.032 18.178 1.00 0.00 H new ATOM 0 HG12 VAL A 26 26.239 27.035 17.502 1.00 0.00 H new ATOM 0 HG13 VAL A 26 25.162 28.425 17.227 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.663 26.793 16.790 1.00 0.00 H new ATOM 0 HG22 VAL A 26 23.082 28.048 15.599 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.796 26.374 15.066 1.00 0.00 H new ATOM 417 N LYS A 27 27.578 25.997 14.652 1.00 0.00 N ATOM 418 CA LYS A 27 29.004 25.773 14.817 1.00 0.00 C ATOM 419 C LYS A 27 29.764 26.549 13.741 1.00 0.00 C ATOM 420 O LYS A 27 30.842 27.083 13.982 1.00 0.00 O ATOM 421 CB LYS A 27 29.347 24.296 14.951 1.00 0.00 C ATOM 422 CG LYS A 27 28.769 23.558 16.156 1.00 0.00 C ATOM 423 CD LYS A 27 29.065 22.064 16.150 1.00 0.00 C ATOM 424 CE LYS A 27 30.536 21.693 16.321 1.00 0.00 C ATOM 425 NZ LYS A 27 30.726 20.238 16.399 1.00 0.00 N ATOM 0 H LYS A 27 27.100 25.168 14.299 1.00 0.00 H new ATOM 0 HA LYS A 27 29.343 26.177 15.771 1.00 0.00 H new ATOM 0 HB2 LYS A 27 29.010 23.787 14.048 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.432 24.202 14.984 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.172 23.997 17.069 1.00 0.00 H new ATOM 0 HG3 LYS A 27 27.689 23.707 16.180 1.00 0.00 H new ATOM 0 HD2 LYS A 27 28.493 21.593 16.949 1.00 0.00 H new ATOM 0 HD3 LYS A 27 28.707 21.643 15.211 1.00 0.00 H new ATOM 0 HE2 LYS A 27 31.111 22.090 15.484 1.00 0.00 H new ATOM 0 HE3 LYS A 27 30.926 22.160 17.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 31.741 20.024 16.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 30.226 19.867 17.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 30.346 19.792 15.540 1.00 0.00 H new ATOM 439 N ALA A 28 29.277 26.601 12.510 1.00 0.00 N ATOM 440 CA ALA A 28 29.577 27.518 11.427 1.00 0.00 C ATOM 441 C ALA A 28 29.331 29.000 11.701 1.00 0.00 C ATOM 442 O ALA A 28 30.172 29.796 11.298 1.00 0.00 O ATOM 443 CB ALA A 28 28.842 27.154 10.132 1.00 0.00 C ATOM 0 H ALA A 28 28.579 25.918 12.215 1.00 0.00 H new ATOM 0 HA ALA A 28 30.654 27.390 11.324 1.00 0.00 H new ATOM 0 HB1 ALA A 28 29.101 27.871 9.353 1.00 0.00 H new ATOM 0 HB2 ALA A 28 29.136 26.153 9.816 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.766 27.179 10.305 1.00 0.00 H new ATOM 449 N LYS A 29 28.200 29.319 12.347 1.00 0.00 N ATOM 450 CA LYS A 29 27.867 30.710 12.599 1.00 0.00 C ATOM 451 C LYS A 29 28.548 31.290 13.834 1.00 0.00 C ATOM 452 O LYS A 29 28.781 32.495 13.918 1.00 0.00 O ATOM 453 CB LYS A 29 26.369 30.862 12.853 1.00 0.00 C ATOM 454 CG LYS A 29 25.493 30.756 11.605 1.00 0.00 C ATOM 455 CD LYS A 29 24.013 30.818 11.981 1.00 0.00 C ATOM 456 CE LYS A 29 23.115 30.905 10.746 1.00 0.00 C ATOM 457 NZ LYS A 29 21.696 30.537 10.901 1.00 0.00 N ATOM 0 H LYS A 29 27.520 28.643 12.694 1.00 0.00 H new ATOM 0 HA LYS A 29 28.205 31.240 11.709 1.00 0.00 H new ATOM 0 HB2 LYS A 29 26.056 30.098 13.565 1.00 0.00 H new ATOM 0 HB3 LYS A 29 26.191 31.829 13.324 1.00 0.00 H new ATOM 0 HG2 LYS A 29 25.733 31.565 10.916 1.00 0.00 H new ATOM 0 HG3 LYS A 29 25.703 29.821 11.085 1.00 0.00 H new ATOM 0 HD2 LYS A 29 23.748 29.934 12.561 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.837 31.683 12.620 1.00 0.00 H new ATOM 0 HE2 LYS A 29 23.157 31.928 10.373 1.00 0.00 H new ATOM 0 HE3 LYS A 29 23.544 30.266 9.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 21.155 30.891 10.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 21.609 29.502 10.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 21.322 30.958 11.775 1.00 0.00 H new ATOM 471 N ILE A 30 29.001 30.470 14.778 1.00 0.00 N ATOM 472 CA ILE A 30 29.979 30.760 15.808 1.00 0.00 C ATOM 473 C ILE A 30 31.262 31.260 15.156 1.00 0.00 C ATOM 474 O ILE A 30 31.821 32.267 15.589 1.00 0.00 O ATOM 475 CB ILE A 30 30.150 29.621 16.818 1.00 0.00 C ATOM 476 CG1 ILE A 30 28.877 29.428 17.654 1.00 0.00 C ATOM 477 CG2 ILE A 30 31.409 29.707 17.684 1.00 0.00 C ATOM 478 CD1 ILE A 30 29.035 28.145 18.471 1.00 0.00 C ATOM 0 H ILE A 30 28.663 29.510 14.843 1.00 0.00 H new ATOM 0 HA ILE A 30 29.612 31.570 16.438 1.00 0.00 H new ATOM 0 HB ILE A 30 30.307 28.725 16.218 1.00 0.00 H new ATOM 0 HG12 ILE A 30 28.721 30.282 18.313 1.00 0.00 H new ATOM 0 HG13 ILE A 30 28.003 29.362 17.006 1.00 0.00 H new ATOM 0 HG21 ILE A 30 31.440 28.857 18.366 1.00 0.00 H new ATOM 0 HG22 ILE A 30 32.292 29.692 17.045 1.00 0.00 H new ATOM 0 HG23 ILE A 30 31.393 30.633 18.259 1.00 0.00 H new ATOM 0 HD11 ILE A 30 28.141 27.986 19.075 1.00 0.00 H new ATOM 0 HD12 ILE A 30 29.173 27.299 17.797 1.00 0.00 H new ATOM 0 HD13 ILE A 30 29.903 28.234 19.124 1.00 0.00 H new ATOM 490 N GLN A 31 31.761 30.516 14.165 1.00 0.00 N ATOM 491 CA GLN A 31 33.038 30.771 13.531 1.00 0.00 C ATOM 492 C GLN A 31 33.195 32.041 12.690 1.00 0.00 C ATOM 493 O GLN A 31 34.191 32.758 12.833 1.00 0.00 O ATOM 494 CB GLN A 31 33.280 29.533 12.678 1.00 0.00 C ATOM 495 CG GLN A 31 34.627 29.387 11.970 1.00 0.00 C ATOM 496 CD GLN A 31 34.869 28.149 11.117 1.00 0.00 C ATOM 497 OE1 GLN A 31 34.031 27.259 11.031 1.00 0.00 O ATOM 498 NE2 GLN A 31 36.051 28.093 10.512 1.00 0.00 N ATOM 0 H GLN A 31 31.273 29.707 13.781 1.00 0.00 H new ATOM 0 HA GLN A 31 33.766 30.959 14.320 1.00 0.00 H new ATOM 0 HB2 GLN A 31 33.144 28.659 13.316 1.00 0.00 H new ATOM 0 HB3 GLN A 31 32.500 29.497 11.917 1.00 0.00 H new ATOM 0 HG2 GLN A 31 34.763 30.261 11.332 1.00 0.00 H new ATOM 0 HG3 GLN A 31 35.407 29.423 12.731 1.00 0.00 H new ATOM 0 HE21 GLN A 31 36.714 28.861 10.616 1.00 0.00 H new ATOM 0 HE22 GLN A 31 36.295 27.282 9.944 1.00 0.00 H new ATOM 507 N ASP A 32 32.078 32.488 12.124 1.00 0.00 N ATOM 508 CA ASP A 32 31.753 33.781 11.562 1.00 0.00 C ATOM 509 C ASP A 32 32.001 35.004 12.442 1.00 0.00 C ATOM 510 O ASP A 32 32.672 35.961 12.080 1.00 0.00 O ATOM 511 CB ASP A 32 30.405 33.671 10.845 1.00 0.00 C ATOM 512 CG ASP A 32 29.879 34.920 10.131 1.00 0.00 C ATOM 513 OD1 ASP A 32 30.565 35.462 9.249 1.00 0.00 O ATOM 514 OD2 ASP A 32 28.792 35.393 10.518 1.00 0.00 O ATOM 0 H ASP A 32 31.277 31.861 12.042 1.00 0.00 H new ATOM 0 HA ASP A 32 32.501 34.031 10.810 1.00 0.00 H new ATOM 0 HB2 ASP A 32 30.480 32.870 10.110 1.00 0.00 H new ATOM 0 HB3 ASP A 32 29.659 33.363 11.577 1.00 0.00 H new ATOM 519 N LYS A 33 31.549 34.867 13.690 1.00 0.00 N ATOM 520 CA LYS A 33 31.601 35.942 14.659 1.00 0.00 C ATOM 521 C LYS A 33 32.909 35.832 15.454 1.00 0.00 C ATOM 522 O LYS A 33 33.506 36.866 15.742 1.00 0.00 O ATOM 523 CB LYS A 33 30.484 35.800 15.693 1.00 0.00 C ATOM 524 CG LYS A 33 28.997 35.777 15.306 1.00 0.00 C ATOM 525 CD LYS A 33 28.046 36.656 16.117 1.00 0.00 C ATOM 526 CE LYS A 33 26.782 37.013 15.339 1.00 0.00 C ATOM 527 NZ LYS A 33 25.794 37.779 16.111 1.00 0.00 N ATOM 0 H LYS A 33 31.138 34.005 14.049 1.00 0.00 H new ATOM 0 HA LYS A 33 31.512 36.882 14.114 1.00 0.00 H new ATOM 0 HB2 LYS A 33 30.679 34.876 16.237 1.00 0.00 H new ATOM 0 HB3 LYS A 33 30.609 36.619 16.401 1.00 0.00 H new ATOM 0 HG2 LYS A 33 28.917 36.070 14.259 1.00 0.00 H new ATOM 0 HG3 LYS A 33 28.646 34.747 15.376 1.00 0.00 H new ATOM 0 HD2 LYS A 33 27.770 36.138 17.036 1.00 0.00 H new ATOM 0 HD3 LYS A 33 28.561 37.571 16.409 1.00 0.00 H new ATOM 0 HE2 LYS A 33 27.063 37.589 14.457 1.00 0.00 H new ATOM 0 HE3 LYS A 33 26.316 36.094 14.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 24.967 37.981 15.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 25.495 37.225 16.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 26.219 38.674 16.428 1.00 0.00 H new ATOM 541 N GLU A 34 33.241 34.649 15.960 1.00 0.00 N ATOM 542 CA GLU A 34 34.266 34.352 16.950 1.00 0.00 C ATOM 543 C GLU A 34 35.514 33.639 16.440 1.00 0.00 C ATOM 544 O GLU A 34 36.516 33.718 17.152 1.00 0.00 O ATOM 545 CB GLU A 34 33.541 33.795 18.181 1.00 0.00 C ATOM 546 CG GLU A 34 34.302 33.747 19.506 1.00 0.00 C ATOM 547 CD GLU A 34 34.734 35.136 19.963 1.00 0.00 C ATOM 548 OE1 GLU A 34 33.921 36.088 19.948 1.00 0.00 O ATOM 549 OE2 GLU A 34 35.870 35.231 20.480 1.00 0.00 O ATOM 0 H GLU A 34 32.757 33.802 15.661 1.00 0.00 H new ATOM 0 HA GLU A 34 34.786 35.260 17.257 1.00 0.00 H new ATOM 0 HB2 GLU A 34 32.641 34.390 18.335 1.00 0.00 H new ATOM 0 HB3 GLU A 34 33.217 32.781 17.946 1.00 0.00 H new ATOM 0 HG2 GLU A 34 33.672 33.293 20.271 1.00 0.00 H new ATOM 0 HG3 GLU A 34 35.180 33.111 19.398 1.00 0.00 H new ATOM 556 N GLY A 35 35.601 33.017 15.263 1.00 0.00 N ATOM 557 CA GLY A 35 36.803 32.707 14.515 1.00 0.00 C ATOM 558 C GLY A 35 37.243 31.253 14.715 1.00 0.00 C ATOM 559 O GLY A 35 37.983 30.696 13.910 1.00 0.00 O ATOM 0 H GLY A 35 34.764 32.695 14.778 1.00 0.00 H new ATOM 0 HA2 GLY A 35 36.628 32.891 13.455 1.00 0.00 H new ATOM 0 HA3 GLY A 35 37.606 33.375 14.826 1.00 0.00 H new ATOM 563 N ILE A 36 36.851 30.709 15.866 1.00 0.00 N ATOM 564 CA ILE A 36 37.294 29.424 16.383 1.00 0.00 C ATOM 565 C ILE A 36 36.728 28.333 15.471 1.00 0.00 C ATOM 566 O ILE A 36 35.531 28.445 15.248 1.00 0.00 O ATOM 567 CB ILE A 36 36.819 29.392 17.834 1.00 0.00 C ATOM 568 CG1 ILE A 36 37.187 28.111 18.576 1.00 0.00 C ATOM 569 CG2 ILE A 36 35.319 29.597 18.064 1.00 0.00 C ATOM 570 CD1 ILE A 36 38.662 28.059 19.002 1.00 0.00 C ATOM 0 H ILE A 36 36.188 31.174 16.486 1.00 0.00 H new ATOM 0 HA ILE A 36 38.372 29.260 16.384 1.00 0.00 H new ATOM 0 HB ILE A 36 37.357 30.254 18.229 1.00 0.00 H new ATOM 0 HG12 ILE A 36 36.557 28.018 19.461 1.00 0.00 H new ATOM 0 HG13 ILE A 36 36.970 27.254 17.938 1.00 0.00 H new ATOM 0 HG21 ILE A 36 35.105 29.553 19.132 1.00 0.00 H new ATOM 0 HG22 ILE A 36 35.021 30.570 17.674 1.00 0.00 H new ATOM 0 HG23 ILE A 36 34.762 28.814 17.550 1.00 0.00 H new ATOM 0 HD11 ILE A 36 38.857 27.122 19.524 1.00 0.00 H new ATOM 0 HD12 ILE A 36 39.298 28.121 18.119 1.00 0.00 H new ATOM 0 HD13 ILE A 36 38.879 28.896 19.665 1.00 0.00 H new ATOM 582 N PRO A 37 37.532 27.406 14.950 1.00 0.00 N ATOM 583 CA PRO A 37 37.092 26.327 14.096 1.00 0.00 C ATOM 584 C PRO A 37 36.387 25.129 14.748 1.00 0.00 C ATOM 585 O PRO A 37 36.891 24.756 15.807 1.00 0.00 O ATOM 586 CB PRO A 37 38.326 25.821 13.348 1.00 0.00 C ATOM 587 CG PRO A 37 39.457 26.148 14.310 1.00 0.00 C ATOM 588 CD PRO A 37 38.982 27.426 15.018 1.00 0.00 C ATOM 0 HA PRO A 37 36.314 26.761 13.468 1.00 0.00 H new ATOM 0 HB2 PRO A 37 38.265 24.752 13.143 1.00 0.00 H new ATOM 0 HB3 PRO A 37 38.452 26.323 12.389 1.00 0.00 H new ATOM 0 HG2 PRO A 37 39.625 25.337 15.019 1.00 0.00 H new ATOM 0 HG3 PRO A 37 40.397 26.310 13.782 1.00 0.00 H new ATOM 0 HD2 PRO A 37 39.324 27.449 16.053 1.00 0.00 H new ATOM 0 HD3 PRO A 37 39.383 28.314 14.530 1.00 0.00 H new ATOM 596 N PRO A 38 35.305 24.564 14.228 1.00 0.00 N ATOM 597 CA PRO A 38 34.624 23.417 14.798 1.00 0.00 C ATOM 598 C PRO A 38 35.483 22.354 15.496 1.00 0.00 C ATOM 599 O PRO A 38 35.048 21.860 16.537 1.00 0.00 O ATOM 600 CB PRO A 38 33.795 22.803 13.673 1.00 0.00 C ATOM 601 CG PRO A 38 33.435 23.985 12.767 1.00 0.00 C ATOM 602 CD PRO A 38 34.625 24.915 13.002 1.00 0.00 C ATOM 0 HA PRO A 38 34.026 23.791 15.629 1.00 0.00 H new ATOM 0 HB2 PRO A 38 34.362 22.046 13.131 1.00 0.00 H new ATOM 0 HB3 PRO A 38 32.901 22.314 14.061 1.00 0.00 H new ATOM 0 HG2 PRO A 38 33.344 23.689 11.722 1.00 0.00 H new ATOM 0 HG3 PRO A 38 32.490 24.447 13.051 1.00 0.00 H new ATOM 0 HD2 PRO A 38 35.318 24.849 12.163 1.00 0.00 H new ATOM 0 HD3 PRO A 38 34.283 25.949 13.052 1.00 0.00 H new ATOM 610 N ASP A 39 36.671 22.043 14.980 1.00 0.00 N ATOM 611 CA ASP A 39 37.670 21.201 15.612 1.00 0.00 C ATOM 612 C ASP A 39 37.946 21.425 17.097 1.00 0.00 C ATOM 613 O ASP A 39 38.288 20.529 17.865 1.00 0.00 O ATOM 614 CB ASP A 39 38.894 20.884 14.755 1.00 0.00 C ATOM 615 CG ASP A 39 39.755 19.736 15.269 1.00 0.00 C ATOM 616 OD1 ASP A 39 39.518 18.531 15.043 1.00 0.00 O ATOM 617 OD2 ASP A 39 40.779 20.057 15.903 1.00 0.00 O ATOM 0 H ASP A 39 36.971 22.390 14.069 1.00 0.00 H new ATOM 0 HA ASP A 39 37.134 20.253 15.656 1.00 0.00 H new ATOM 0 HB2 ASP A 39 38.561 20.646 13.745 1.00 0.00 H new ATOM 0 HB3 ASP A 39 39.512 21.779 14.684 1.00 0.00 H new ATOM 622 N GLN A 40 37.967 22.714 17.430 1.00 0.00 N ATOM 623 CA GLN A 40 38.285 23.200 18.761 1.00 0.00 C ATOM 624 C GLN A 40 37.039 23.742 19.472 1.00 0.00 C ATOM 625 O GLN A 40 37.199 24.427 20.485 1.00 0.00 O ATOM 626 CB GLN A 40 39.263 24.354 18.542 1.00 0.00 C ATOM 627 CG GLN A 40 40.473 24.146 17.637 1.00 0.00 C ATOM 628 CD GLN A 40 41.285 25.394 17.350 1.00 0.00 C ATOM 629 OE1 GLN A 40 41.049 26.433 17.964 1.00 0.00 O ATOM 630 NE2 GLN A 40 42.325 25.124 16.557 1.00 0.00 N ATOM 0 H GLN A 40 37.759 23.460 16.766 1.00 0.00 H new ATOM 0 HA GLN A 40 38.691 22.399 19.379 1.00 0.00 H new ATOM 0 HB2 GLN A 40 38.695 25.193 18.141 1.00 0.00 H new ATOM 0 HB3 GLN A 40 39.634 24.659 19.520 1.00 0.00 H new ATOM 0 HG2 GLN A 40 41.127 23.404 18.095 1.00 0.00 H new ATOM 0 HG3 GLN A 40 40.131 23.728 16.690 1.00 0.00 H new ATOM 0 HE21 GLN A 40 42.399 24.213 16.105 1.00 0.00 H new ATOM 0 HE22 GLN A 40 43.046 25.829 16.403 1.00 0.00 H new ATOM 639 N GLN A 41 35.825 23.517 18.990 1.00 0.00 N ATOM 640 CA GLN A 41 34.578 23.867 19.625 1.00 0.00 C ATOM 641 C GLN A 41 34.007 22.598 20.274 1.00 0.00 C ATOM 642 O GLN A 41 33.896 21.614 19.554 1.00 0.00 O ATOM 643 CB GLN A 41 33.547 24.399 18.624 1.00 0.00 C ATOM 644 CG GLN A 41 33.787 25.812 18.086 1.00 0.00 C ATOM 645 CD GLN A 41 32.730 26.130 17.034 1.00 0.00 C ATOM 646 OE1 GLN A 41 31.638 25.578 17.002 1.00 0.00 O ATOM 647 NE2 GLN A 41 33.051 26.925 16.018 1.00 0.00 N ATOM 0 H GLN A 41 35.684 23.057 18.091 1.00 0.00 H new ATOM 0 HA GLN A 41 34.774 24.652 20.355 1.00 0.00 H new ATOM 0 HB2 GLN A 41 33.507 23.713 17.778 1.00 0.00 H new ATOM 0 HB3 GLN A 41 32.566 24.376 19.099 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.739 26.537 18.898 1.00 0.00 H new ATOM 0 HG3 GLN A 41 34.784 25.885 17.652 1.00 0.00 H new ATOM 0 HE21 GLN A 41 33.952 27.402 16.009 1.00 0.00 H new ATOM 0 HE22 GLN A 41 32.396 27.058 15.247 1.00 0.00 H new ATOM 656 N ARG A 42 33.508 22.681 21.504 1.00 0.00 N ATOM 657 CA ARG A 42 32.789 21.664 22.249 1.00 0.00 C ATOM 658 C ARG A 42 31.495 22.206 22.843 1.00 0.00 C ATOM 659 O ARG A 42 31.492 23.402 23.130 1.00 0.00 O ATOM 660 CB ARG A 42 33.684 21.081 23.339 1.00 0.00 C ATOM 661 CG ARG A 42 34.924 20.275 22.918 1.00 0.00 C ATOM 662 CD ARG A 42 35.528 19.494 24.078 1.00 0.00 C ATOM 663 NE ARG A 42 36.607 20.304 24.660 1.00 0.00 N ATOM 664 CZ ARG A 42 36.970 20.377 25.943 1.00 0.00 C ATOM 665 NH1 ARG A 42 36.370 19.691 26.928 1.00 0.00 N ATOM 666 NH2 ARG A 42 37.986 21.188 26.264 1.00 0.00 N ATOM 0 H ARG A 42 33.608 23.538 22.048 1.00 0.00 H new ATOM 0 HA ARG A 42 32.515 20.870 21.554 1.00 0.00 H new ATOM 0 HB2 ARG A 42 34.022 21.906 23.966 1.00 0.00 H new ATOM 0 HB3 ARG A 42 33.067 20.437 23.965 1.00 0.00 H new ATOM 0 HG2 ARG A 42 34.652 19.584 22.120 1.00 0.00 H new ATOM 0 HG3 ARG A 42 35.674 20.953 22.510 1.00 0.00 H new ATOM 0 HD2 ARG A 42 34.767 19.277 24.828 1.00 0.00 H new ATOM 0 HD3 ARG A 42 35.916 18.536 23.731 1.00 0.00 H new ATOM 0 HE ARG A 42 37.141 20.878 24.008 1.00 0.00 H new ATOM 0 HH11 ARG A 42 35.589 19.070 26.715 1.00 0.00 H new ATOM 0 HH12 ARG A 42 36.695 19.790 27.890 1.00 0.00 H new ATOM 0 HH21 ARG A 42 38.458 21.727 25.538 1.00 0.00 H new ATOM 0 HH22 ARG A 42 38.288 21.267 27.235 1.00 0.00 H new ATOM 680 N LEU A 43 30.439 21.399 22.802 1.00 0.00 N ATOM 681 CA LEU A 43 29.054 21.843 22.925 1.00 0.00 C ATOM 682 C LEU A 43 28.419 21.140 24.128 1.00 0.00 C ATOM 683 O LEU A 43 28.418 19.914 24.130 1.00 0.00 O ATOM 684 CB LEU A 43 28.264 21.728 21.626 1.00 0.00 C ATOM 685 CG LEU A 43 28.623 22.892 20.693 1.00 0.00 C ATOM 686 CD1 LEU A 43 29.585 22.427 19.602 1.00 0.00 C ATOM 687 CD2 LEU A 43 27.351 23.343 19.978 1.00 0.00 C ATOM 0 H LEU A 43 30.525 20.390 22.679 1.00 0.00 H new ATOM 0 HA LEU A 43 29.033 22.916 23.118 1.00 0.00 H new ATOM 0 HB2 LEU A 43 28.485 20.778 21.139 1.00 0.00 H new ATOM 0 HB3 LEU A 43 27.195 21.737 21.838 1.00 0.00 H new ATOM 0 HG LEU A 43 29.075 23.686 21.287 1.00 0.00 H new ATOM 0 HD11 LEU A 43 29.828 23.266 18.950 1.00 0.00 H new ATOM 0 HD12 LEU A 43 30.498 22.047 20.060 1.00 0.00 H new ATOM 0 HD13 LEU A 43 29.116 21.636 19.016 1.00 0.00 H new ATOM 0 HD21 LEU A 43 27.584 24.171 19.309 1.00 0.00 H new ATOM 0 HD22 LEU A 43 26.944 22.513 19.400 1.00 0.00 H new ATOM 0 HD23 LEU A 43 26.615 23.667 20.714 1.00 0.00 H new ATOM 699 N ILE A 44 27.985 21.920 25.111 1.00 0.00 N ATOM 700 CA ILE A 44 27.460 21.509 26.405 1.00 0.00 C ATOM 701 C ILE A 44 26.032 21.998 26.600 1.00 0.00 C ATOM 702 O ILE A 44 25.740 23.186 26.465 1.00 0.00 O ATOM 703 CB ILE A 44 28.401 22.006 27.499 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.889 21.658 27.350 1.00 0.00 C ATOM 705 CG2 ILE A 44 27.976 21.757 28.948 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.211 20.172 27.206 1.00 0.00 C ATOM 0 H ILE A 44 27.992 22.935 25.015 1.00 0.00 H new ATOM 0 HA ILE A 44 27.414 20.421 26.457 1.00 0.00 H new ATOM 0 HB ILE A 44 28.289 23.072 27.301 1.00 0.00 H new ATOM 0 HG12 ILE A 44 30.280 22.182 26.478 1.00 0.00 H new ATOM 0 HG13 ILE A 44 30.422 22.044 28.219 1.00 0.00 H new ATOM 0 HG21 ILE A 44 28.732 22.159 29.623 1.00 0.00 H new ATOM 0 HG22 ILE A 44 27.022 22.249 29.137 1.00 0.00 H new ATOM 0 HG23 ILE A 44 27.871 20.685 29.117 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.289 20.041 27.108 1.00 0.00 H new ATOM 0 HD12 ILE A 44 29.859 19.636 28.088 1.00 0.00 H new ATOM 0 HD13 ILE A 44 29.715 19.776 26.320 1.00 0.00 H new ATOM 718 N PHE A 45 25.197 21.129 27.157 1.00 0.00 N ATOM 719 CA PHE A 45 23.839 21.382 27.614 1.00 0.00 C ATOM 720 C PHE A 45 23.580 20.804 29.000 1.00 0.00 C ATOM 721 O PHE A 45 23.477 19.598 29.207 1.00 0.00 O ATOM 722 CB PHE A 45 22.857 20.906 26.538 1.00 0.00 C ATOM 723 CG PHE A 45 21.471 21.477 26.698 1.00 0.00 C ATOM 724 CD1 PHE A 45 21.291 22.861 26.836 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.324 20.721 26.419 1.00 0.00 C ATOM 726 CE1 PHE A 45 20.009 23.430 26.876 1.00 0.00 C ATOM 727 CE2 PHE A 45 19.050 21.286 26.480 1.00 0.00 C ATOM 728 CZ PHE A 45 18.854 22.656 26.655 1.00 0.00 C ATOM 0 H PHE A 45 25.473 20.159 27.312 1.00 0.00 H new ATOM 0 HA PHE A 45 23.687 22.453 27.746 1.00 0.00 H new ATOM 0 HB2 PHE A 45 23.244 21.180 25.557 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.799 19.818 26.565 1.00 0.00 H new ATOM 0 HD1 PHE A 45 22.157 23.502 26.913 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.429 19.680 26.151 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.906 24.485 27.081 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.188 20.642 26.389 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.870 23.099 26.623 1.00 0.00 H new ATOM 738 N ALA A 46 23.631 21.693 29.996 1.00 0.00 N ATOM 739 CA ALA A 46 23.775 21.322 31.397 1.00 0.00 C ATOM 740 C ALA A 46 25.131 20.651 31.607 1.00 0.00 C ATOM 741 O ALA A 46 26.107 21.359 31.828 1.00 0.00 O ATOM 742 CB ALA A 46 22.630 20.515 31.986 1.00 0.00 C ATOM 0 H ALA A 46 23.572 22.700 29.845 1.00 0.00 H new ATOM 0 HA ALA A 46 23.729 22.252 31.964 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.841 20.294 33.032 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.706 21.089 31.916 1.00 0.00 H new ATOM 0 HB3 ALA A 46 22.520 19.582 31.433 1.00 0.00 H new ATOM 748 N GLY A 47 25.166 19.319 31.549 1.00 0.00 N ATOM 749 CA GLY A 47 26.401 18.564 31.490 1.00 0.00 C ATOM 750 C GLY A 47 26.508 17.619 30.293 1.00 0.00 C ATOM 751 O GLY A 47 27.398 16.775 30.352 1.00 0.00 O ATOM 0 H GLY A 47 24.328 18.737 31.542 1.00 0.00 H new ATOM 0 HA2 GLY A 47 27.238 19.262 31.462 1.00 0.00 H new ATOM 0 HA3 GLY A 47 26.501 17.982 32.406 1.00 0.00 H new ATOM 755 N LYS A 48 25.557 17.598 29.352 1.00 0.00 N ATOM 756 CA LYS A 48 25.552 16.658 28.254 1.00 0.00 C ATOM 757 C LYS A 48 26.394 17.318 27.162 1.00 0.00 C ATOM 758 O LYS A 48 26.106 18.435 26.744 1.00 0.00 O ATOM 759 CB LYS A 48 24.144 16.512 27.687 1.00 0.00 C ATOM 760 CG LYS A 48 23.054 16.072 28.665 1.00 0.00 C ATOM 761 CD LYS A 48 21.656 16.075 28.039 1.00 0.00 C ATOM 762 CE LYS A 48 20.521 15.590 28.924 1.00 0.00 C ATOM 763 NZ LYS A 48 19.361 15.291 28.074 1.00 0.00 N ATOM 0 H LYS A 48 24.768 18.244 29.342 1.00 0.00 H new ATOM 0 HA LYS A 48 25.917 15.683 28.577 1.00 0.00 H new ATOM 0 HB2 LYS A 48 23.849 17.469 27.256 1.00 0.00 H new ATOM 0 HB3 LYS A 48 24.179 15.792 26.869 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.282 15.070 29.029 1.00 0.00 H new ATOM 0 HG3 LYS A 48 23.061 16.734 29.531 1.00 0.00 H new ATOM 0 HD2 LYS A 48 21.428 17.091 27.716 1.00 0.00 H new ATOM 0 HD3 LYS A 48 21.681 15.454 27.144 1.00 0.00 H new ATOM 0 HE2 LYS A 48 20.825 14.701 29.476 1.00 0.00 H new ATOM 0 HE3 LYS A 48 20.264 16.351 29.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 18.574 14.957 28.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 19.072 16.151 27.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 19.615 14.553 27.387 1.00 0.00 H new ATOM 777 N GLN A 49 27.336 16.535 26.616 1.00 0.00 N ATOM 778 CA GLN A 49 28.287 16.697 25.544 1.00 0.00 C ATOM 779 C GLN A 49 27.531 16.342 24.268 1.00 0.00 C ATOM 780 O GLN A 49 26.896 15.288 24.217 1.00 0.00 O ATOM 781 CB GLN A 49 29.443 15.706 25.627 1.00 0.00 C ATOM 782 CG GLN A 49 30.497 15.918 26.728 1.00 0.00 C ATOM 783 CD GLN A 49 29.967 15.914 28.156 1.00 0.00 C ATOM 784 OE1 GLN A 49 29.116 15.119 28.558 1.00 0.00 O ATOM 785 NE2 GLN A 49 30.562 16.785 28.961 1.00 0.00 N ATOM 0 H GLN A 49 27.452 15.600 27.007 1.00 0.00 H new ATOM 0 HA GLN A 49 28.691 17.709 25.584 1.00 0.00 H new ATOM 0 HB2 GLN A 49 29.020 14.710 25.756 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.958 15.712 24.666 1.00 0.00 H new ATOM 0 HG2 GLN A 49 31.253 15.138 26.638 1.00 0.00 H new ATOM 0 HG3 GLN A 49 30.998 16.869 26.548 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.262 17.427 28.589 1.00 0.00 H new ATOM 0 HE22 GLN A 49 30.319 16.812 29.951 1.00 0.00 H new ATOM 794 N LEU A 50 27.535 17.283 23.335 1.00 0.00 N ATOM 795 CA LEU A 50 26.716 17.104 22.146 1.00 0.00 C ATOM 796 C LEU A 50 27.585 16.646 20.983 1.00 0.00 C ATOM 797 O LEU A 50 28.801 16.851 20.965 1.00 0.00 O ATOM 798 CB LEU A 50 26.046 18.442 21.822 1.00 0.00 C ATOM 799 CG LEU A 50 25.123 18.995 22.909 1.00 0.00 C ATOM 800 CD1 LEU A 50 24.692 20.447 22.720 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.934 18.054 23.038 1.00 0.00 C ATOM 0 H LEU A 50 28.075 18.148 23.373 1.00 0.00 H new ATOM 0 HA LEU A 50 25.955 16.343 22.319 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.824 19.179 21.620 1.00 0.00 H new ATOM 0 HB3 LEU A 50 25.470 18.327 20.904 1.00 0.00 H new ATOM 0 HG LEU A 50 25.693 19.030 23.837 1.00 0.00 H new ATOM 0 HD11 LEU A 50 24.041 20.743 23.542 1.00 0.00 H new ATOM 0 HD12 LEU A 50 25.573 21.089 22.706 1.00 0.00 H new ATOM 0 HD13 LEU A 50 24.155 20.547 21.777 1.00 0.00 H new ATOM 0 HD21 LEU A 50 23.258 18.425 23.808 1.00 0.00 H new ATOM 0 HD22 LEU A 50 23.406 18.002 22.086 1.00 0.00 H new ATOM 0 HD23 LEU A 50 24.285 17.059 23.312 1.00 0.00 H new ATOM 813 N GLU A 51 26.940 16.007 20.009 1.00 0.00 N ATOM 814 CA GLU A 51 27.500 15.654 18.721 1.00 0.00 C ATOM 815 C GLU A 51 26.512 16.131 17.647 1.00 0.00 C ATOM 816 O GLU A 51 25.317 15.939 17.862 1.00 0.00 O ATOM 817 CB GLU A 51 27.558 14.126 18.742 1.00 0.00 C ATOM 818 CG GLU A 51 28.428 13.744 17.549 1.00 0.00 C ATOM 819 CD GLU A 51 28.102 12.374 16.965 1.00 0.00 C ATOM 820 OE1 GLU A 51 26.924 11.976 17.115 1.00 0.00 O ATOM 821 OE2 GLU A 51 28.920 11.674 16.334 1.00 0.00 O ATOM 0 H GLU A 51 25.969 15.711 20.108 1.00 0.00 H new ATOM 0 HA GLU A 51 28.478 16.092 18.520 1.00 0.00 H new ATOM 0 HB2 GLU A 51 27.987 13.761 19.675 1.00 0.00 H new ATOM 0 HB3 GLU A 51 26.561 13.693 18.658 1.00 0.00 H new ATOM 0 HG2 GLU A 51 28.312 14.498 16.770 1.00 0.00 H new ATOM 0 HG3 GLU A 51 29.474 13.759 17.854 1.00 0.00 H new ATOM 828 N ASP A 52 27.081 16.773 16.631 1.00 0.00 N ATOM 829 CA ASP A 52 26.309 17.412 15.574 1.00 0.00 C ATOM 830 C ASP A 52 25.619 16.392 14.667 1.00 0.00 C ATOM 831 O ASP A 52 25.629 15.212 14.982 1.00 0.00 O ATOM 832 CB ASP A 52 27.130 18.513 14.893 1.00 0.00 C ATOM 833 CG ASP A 52 28.409 18.165 14.150 1.00 0.00 C ATOM 834 OD1 ASP A 52 28.372 17.359 13.198 1.00 0.00 O ATOM 835 OD2 ASP A 52 29.443 18.749 14.566 1.00 0.00 O ATOM 0 H ASP A 52 28.091 16.864 16.519 1.00 0.00 H new ATOM 0 HA ASP A 52 25.462 17.946 16.004 1.00 0.00 H new ATOM 0 HB2 ASP A 52 26.471 19.016 14.185 1.00 0.00 H new ATOM 0 HB3 ASP A 52 27.390 19.243 15.660 1.00 0.00 H new ATOM 840 N GLY A 53 25.052 16.753 13.517 1.00 0.00 N ATOM 841 CA GLY A 53 24.280 15.923 12.604 1.00 0.00 C ATOM 842 C GLY A 53 22.760 15.925 12.643 1.00 0.00 C ATOM 843 O GLY A 53 22.127 15.216 11.864 1.00 0.00 O ATOM 0 H GLY A 53 25.129 17.711 13.176 1.00 0.00 H new ATOM 0 HA2 GLY A 53 24.574 16.202 11.592 1.00 0.00 H new ATOM 0 HA3 GLY A 53 24.602 14.893 12.758 1.00 0.00 H new ATOM 847 N ARG A 54 22.170 16.743 13.521 1.00 0.00 N ATOM 848 CA ARG A 54 20.889 16.585 14.187 1.00 0.00 C ATOM 849 C ARG A 54 20.239 17.942 14.437 1.00 0.00 C ATOM 850 O ARG A 54 20.989 18.918 14.473 1.00 0.00 O ATOM 851 CB ARG A 54 21.153 15.711 15.416 1.00 0.00 C ATOM 852 CG ARG A 54 21.232 14.220 15.089 1.00 0.00 C ATOM 853 CD ARG A 54 21.123 13.428 16.395 1.00 0.00 C ATOM 854 NE ARG A 54 21.636 12.063 16.280 1.00 0.00 N ATOM 855 CZ ARG A 54 20.900 10.949 16.360 1.00 0.00 C ATOM 856 NH1 ARG A 54 19.569 11.041 16.505 1.00 0.00 N ATOM 857 NH2 ARG A 54 21.489 9.781 16.097 1.00 0.00 N ATOM 0 H ARG A 54 22.626 17.610 13.804 1.00 0.00 H new ATOM 0 HA ARG A 54 20.140 16.075 13.581 1.00 0.00 H new ATOM 0 HB2 ARG A 54 22.087 16.024 15.882 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.361 15.875 16.147 1.00 0.00 H new ATOM 0 HG2 ARG A 54 20.429 13.939 14.408 1.00 0.00 H new ATOM 0 HG3 ARG A 54 22.172 13.992 14.585 1.00 0.00 H new ATOM 0 HD2 ARG A 54 21.672 13.952 17.178 1.00 0.00 H new ATOM 0 HD3 ARG A 54 20.079 13.393 16.706 1.00 0.00 H new ATOM 0 HE ARG A 54 22.638 11.951 16.126 1.00 0.00 H new ATOM 0 HH11 ARG A 54 19.123 11.957 16.554 1.00 0.00 H new ATOM 0 HH12 ARG A 54 19.003 10.195 16.567 1.00 0.00 H new ATOM 0 HH21 ARG A 54 22.476 9.754 15.843 1.00 0.00 H new ATOM 0 HH22 ARG A 54 20.952 8.916 16.150 1.00 0.00 H new ATOM 871 N THR A 55 18.934 18.063 14.650 1.00 0.00 N ATOM 872 CA THR A 55 18.135 19.251 14.900 1.00 0.00 C ATOM 873 C THR A 55 18.186 19.647 16.380 1.00 0.00 C ATOM 874 O THR A 55 18.774 18.917 17.179 1.00 0.00 O ATOM 875 CB THR A 55 16.705 18.992 14.428 1.00 0.00 C ATOM 876 OG1 THR A 55 16.028 18.035 15.227 1.00 0.00 O ATOM 877 CG2 THR A 55 16.457 18.651 12.962 1.00 0.00 C ATOM 0 H THR A 55 18.344 17.231 14.651 1.00 0.00 H new ATOM 0 HA THR A 55 18.543 20.093 14.340 1.00 0.00 H new ATOM 0 HB THR A 55 16.297 19.995 14.550 1.00 0.00 H new ATOM 0 HG1 THR A 55 16.244 17.133 14.910 1.00 0.00 H new ATOM 0 HG21 THR A 55 15.390 18.498 12.799 1.00 0.00 H new ATOM 0 HG22 THR A 55 16.806 19.470 12.334 1.00 0.00 H new ATOM 0 HG23 THR A 55 16.997 17.740 12.704 1.00 0.00 H new ATOM 885 N LEU A 56 17.558 20.752 16.752 1.00 0.00 N ATOM 886 CA LEU A 56 17.248 21.229 18.086 1.00 0.00 C ATOM 887 C LEU A 56 16.251 20.302 18.789 1.00 0.00 C ATOM 888 O LEU A 56 16.330 20.077 19.988 1.00 0.00 O ATOM 889 CB LEU A 56 16.721 22.661 18.016 1.00 0.00 C ATOM 890 CG LEU A 56 17.798 23.697 17.713 1.00 0.00 C ATOM 891 CD1 LEU A 56 17.293 25.111 17.978 1.00 0.00 C ATOM 892 CD2 LEU A 56 19.184 23.593 18.345 1.00 0.00 C ATOM 0 H LEU A 56 17.217 21.406 16.047 1.00 0.00 H new ATOM 0 HA LEU A 56 18.163 21.225 18.679 1.00 0.00 H new ATOM 0 HB2 LEU A 56 15.949 22.717 17.249 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.246 22.911 18.965 1.00 0.00 H new ATOM 0 HG LEU A 56 17.971 23.457 16.664 1.00 0.00 H new ATOM 0 HD11 LEU A 56 18.083 25.828 17.753 1.00 0.00 H new ATOM 0 HD12 LEU A 56 16.429 25.313 17.345 1.00 0.00 H new ATOM 0 HD13 LEU A 56 17.006 25.204 19.025 1.00 0.00 H new ATOM 0 HD21 LEU A 56 19.803 24.423 18.004 1.00 0.00 H new ATOM 0 HD22 LEU A 56 19.093 23.631 19.431 1.00 0.00 H new ATOM 0 HD23 LEU A 56 19.648 22.651 18.052 1.00 0.00 H new ATOM 904 N SER A 57 15.317 19.682 18.067 1.00 0.00 N ATOM 905 CA SER A 57 14.426 18.753 18.721 1.00 0.00 C ATOM 906 C SER A 57 15.024 17.352 18.814 1.00 0.00 C ATOM 907 O SER A 57 14.553 16.558 19.629 1.00 0.00 O ATOM 908 CB SER A 57 13.260 18.582 17.754 1.00 0.00 C ATOM 909 OG SER A 57 12.258 17.661 18.132 1.00 0.00 O ATOM 0 H SER A 57 15.168 19.806 17.066 1.00 0.00 H new ATOM 0 HA SER A 57 14.189 19.128 19.717 1.00 0.00 H new ATOM 0 HB2 SER A 57 12.792 19.555 17.609 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.660 18.274 16.788 1.00 0.00 H new ATOM 0 HG SER A 57 11.562 17.633 17.442 1.00 0.00 H new ATOM 915 N ASP A 58 16.134 17.166 18.103 1.00 0.00 N ATOM 916 CA ASP A 58 16.891 15.950 18.300 1.00 0.00 C ATOM 917 C ASP A 58 17.482 15.923 19.720 1.00 0.00 C ATOM 918 O ASP A 58 17.731 14.853 20.261 1.00 0.00 O ATOM 919 CB ASP A 58 18.006 15.776 17.276 1.00 0.00 C ATOM 920 CG ASP A 58 17.531 15.028 16.034 1.00 0.00 C ATOM 921 OD1 ASP A 58 17.516 13.780 16.053 1.00 0.00 O ATOM 922 OD2 ASP A 58 17.169 15.676 15.028 1.00 0.00 O ATOM 0 H ASP A 58 16.511 17.817 17.414 1.00 0.00 H new ATOM 0 HA ASP A 58 16.198 15.120 18.166 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.387 16.755 16.986 1.00 0.00 H new ATOM 0 HB3 ASP A 58 18.835 15.233 17.731 1.00 0.00 H new ATOM 927 N TYR A 59 17.769 17.057 20.349 1.00 0.00 N ATOM 928 CA TYR A 59 18.402 17.116 21.643 1.00 0.00 C ATOM 929 C TYR A 59 17.586 17.879 22.689 1.00 0.00 C ATOM 930 O TYR A 59 18.150 18.190 23.743 1.00 0.00 O ATOM 931 CB TYR A 59 19.888 17.509 21.631 1.00 0.00 C ATOM 932 CG TYR A 59 20.822 16.654 20.811 1.00 0.00 C ATOM 933 CD1 TYR A 59 20.918 15.289 21.092 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.625 17.232 19.816 1.00 0.00 C ATOM 935 CE1 TYR A 59 21.768 14.519 20.292 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.507 16.499 19.025 1.00 0.00 C ATOM 937 CZ TYR A 59 22.552 15.128 19.309 1.00 0.00 C ATOM 938 OH TYR A 59 23.499 14.351 18.714 1.00 0.00 O ATOM 0 H TYR A 59 17.560 17.975 19.958 1.00 0.00 H new ATOM 0 HA TYR A 59 18.410 16.075 21.967 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.963 18.534 21.269 1.00 0.00 H new ATOM 0 HB3 TYR A 59 20.246 17.508 22.661 1.00 0.00 H new ATOM 0 HD1 TYR A 59 20.355 14.844 21.899 1.00 0.00 H new ATOM 0 HD2 TYR A 59 21.556 18.298 19.655 1.00 0.00 H new ATOM 0 HE1 TYR A 59 21.819 13.450 20.435 1.00 0.00 H new ATOM 0 HE2 TYR A 59 23.110 16.953 18.252 1.00 0.00 H new ATOM 0 HH TYR A 59 24.036 14.899 18.104 1.00 0.00 H new ATOM 948 N ASN A 60 16.287 18.118 22.491 1.00 0.00 N ATOM 949 CA ASN A 60 15.388 18.901 23.296 1.00 0.00 C ATOM 950 C ASN A 60 15.758 20.352 23.642 1.00 0.00 C ATOM 951 O ASN A 60 15.506 20.838 24.731 1.00 0.00 O ATOM 952 CB ASN A 60 15.230 18.151 24.622 1.00 0.00 C ATOM 953 CG ASN A 60 13.892 18.276 25.328 1.00 0.00 C ATOM 954 OD1 ASN A 60 12.818 17.993 24.815 1.00 0.00 O ATOM 955 ND2 ASN A 60 13.847 18.765 26.565 1.00 0.00 N ATOM 0 H ASN A 60 15.807 17.724 21.682 1.00 0.00 H new ATOM 0 HA ASN A 60 14.498 19.006 22.676 1.00 0.00 H new ATOM 0 HB2 ASN A 60 15.419 17.093 24.438 1.00 0.00 H new ATOM 0 HB3 ASN A 60 16.006 18.499 25.303 1.00 0.00 H new ATOM 0 HD21 ASN A 60 12.949 18.885 27.033 1.00 0.00 H new ATOM 0 HD22 ASN A 60 14.711 19.019 27.045 1.00 0.00 H new ATOM 962 N ILE A 61 16.309 21.052 22.652 1.00 0.00 N ATOM 963 CA ILE A 61 16.592 22.465 22.738 1.00 0.00 C ATOM 964 C ILE A 61 15.267 23.121 22.327 1.00 0.00 C ATOM 965 O ILE A 61 15.039 23.416 21.160 1.00 0.00 O ATOM 966 CB ILE A 61 17.846 22.816 21.941 1.00 0.00 C ATOM 967 CG1 ILE A 61 19.021 22.012 22.487 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.178 24.306 22.023 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.156 21.763 21.486 1.00 0.00 C ATOM 0 H ILE A 61 16.572 20.638 21.758 1.00 0.00 H new ATOM 0 HA ILE A 61 16.868 22.838 23.724 1.00 0.00 H new ATOM 0 HB ILE A 61 17.660 22.572 20.895 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.428 22.534 23.353 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.651 21.050 22.840 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.077 24.511 21.442 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.347 24.887 21.623 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.347 24.584 23.063 1.00 0.00 H new ATOM 0 HD11 ILE A 61 20.945 21.184 21.967 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.771 21.210 20.629 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.560 22.718 21.150 1.00 0.00 H new ATOM 981 N GLN A 62 14.308 23.216 23.239 1.00 0.00 N ATOM 982 CA GLN A 62 12.890 23.448 23.015 1.00 0.00 C ATOM 983 C GLN A 62 12.506 24.897 23.319 1.00 0.00 C ATOM 984 O GLN A 62 11.363 25.185 23.685 1.00 0.00 O ATOM 985 CB GLN A 62 12.110 22.549 23.971 1.00 0.00 C ATOM 986 CG GLN A 62 12.236 21.036 23.840 1.00 0.00 C ATOM 987 CD GLN A 62 11.628 20.388 22.615 1.00 0.00 C ATOM 988 OE1 GLN A 62 11.699 20.895 21.491 1.00 0.00 O ATOM 989 NE2 GLN A 62 11.081 19.176 22.625 1.00 0.00 N ATOM 0 H GLN A 62 14.520 23.125 24.233 1.00 0.00 H new ATOM 0 HA GLN A 62 12.663 23.236 21.970 1.00 0.00 H new ATOM 0 HB2 GLN A 62 12.405 22.816 24.986 1.00 0.00 H new ATOM 0 HB3 GLN A 62 11.054 22.800 23.869 1.00 0.00 H new ATOM 0 HG2 GLN A 62 13.296 20.783 23.863 1.00 0.00 H new ATOM 0 HG3 GLN A 62 11.781 20.583 24.721 1.00 0.00 H new ATOM 0 HE21 GLN A 62 10.976 18.671 23.505 1.00 0.00 H new ATOM 0 HE22 GLN A 62 10.766 18.751 21.753 1.00 0.00 H new ATOM 998 N LYS A 63 13.411 25.809 22.990 1.00 0.00 N ATOM 999 CA LYS A 63 13.303 27.229 22.684 1.00 0.00 C ATOM 1000 C LYS A 63 13.628 27.961 23.987 1.00 0.00 C ATOM 1001 O LYS A 63 13.145 27.646 25.075 1.00 0.00 O ATOM 1002 CB LYS A 63 12.032 27.763 22.030 1.00 0.00 C ATOM 1003 CG LYS A 63 11.766 27.212 20.626 1.00 0.00 C ATOM 1004 CD LYS A 63 10.900 28.019 19.660 1.00 0.00 C ATOM 1005 CE LYS A 63 9.399 27.801 19.876 1.00 0.00 C ATOM 1006 NZ LYS A 63 9.004 26.441 19.478 1.00 0.00 N ATOM 0 H LYS A 63 14.387 25.522 22.922 1.00 0.00 H new ATOM 0 HA LYS A 63 14.004 27.417 21.871 1.00 0.00 H new ATOM 0 HB2 LYS A 63 11.181 27.525 22.668 1.00 0.00 H new ATOM 0 HB3 LYS A 63 12.095 28.850 21.975 1.00 0.00 H new ATOM 0 HG2 LYS A 63 12.732 27.055 20.147 1.00 0.00 H new ATOM 0 HG3 LYS A 63 11.303 26.232 20.741 1.00 0.00 H new ATOM 0 HD2 LYS A 63 11.128 29.079 19.775 1.00 0.00 H new ATOM 0 HD3 LYS A 63 11.157 27.747 18.636 1.00 0.00 H new ATOM 0 HE2 LYS A 63 9.151 27.964 20.925 1.00 0.00 H new ATOM 0 HE3 LYS A 63 8.834 28.532 19.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 7.981 26.417 19.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 9.520 26.167 18.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 9.231 25.775 20.244 1.00 0.00 H new ATOM 1020 N GLU A 64 14.492 28.969 23.939 1.00 0.00 N ATOM 1021 CA GLU A 64 14.944 29.870 24.974 1.00 0.00 C ATOM 1022 C GLU A 64 15.891 29.140 25.919 1.00 0.00 C ATOM 1023 O GLU A 64 16.136 29.580 27.042 1.00 0.00 O ATOM 1024 CB GLU A 64 13.884 30.820 25.558 1.00 0.00 C ATOM 1025 CG GLU A 64 13.614 32.083 24.735 1.00 0.00 C ATOM 1026 CD GLU A 64 12.811 31.947 23.441 1.00 0.00 C ATOM 1027 OE1 GLU A 64 11.700 31.369 23.464 1.00 0.00 O ATOM 1028 OE2 GLU A 64 13.175 32.557 22.417 1.00 0.00 O ATOM 0 H GLU A 64 14.946 29.195 23.054 1.00 0.00 H new ATOM 0 HA GLU A 64 15.555 30.649 24.519 1.00 0.00 H new ATOM 0 HB2 GLU A 64 12.949 30.271 25.668 1.00 0.00 H new ATOM 0 HB3 GLU A 64 14.198 31.118 26.558 1.00 0.00 H new ATOM 0 HG2 GLU A 64 13.092 32.793 25.377 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.577 32.528 24.484 1.00 0.00 H new ATOM 1035 N SER A 65 16.514 28.071 25.439 1.00 0.00 N ATOM 1036 CA SER A 65 17.584 27.289 26.037 1.00 0.00 C ATOM 1037 C SER A 65 18.867 28.120 26.057 1.00 0.00 C ATOM 1038 O SER A 65 19.134 28.840 25.097 1.00 0.00 O ATOM 1039 CB SER A 65 17.755 25.961 25.285 1.00 0.00 C ATOM 1040 OG SER A 65 16.575 25.205 25.317 1.00 0.00 O ATOM 0 H SER A 65 16.254 27.694 24.528 1.00 0.00 H new ATOM 0 HA SER A 65 17.335 27.037 27.068 1.00 0.00 H new ATOM 0 HB2 SER A 65 18.035 26.159 24.250 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.569 25.389 25.731 1.00 0.00 H new ATOM 0 HG SER A 65 16.348 24.914 24.409 1.00 0.00 H new ATOM 1046 N THR A 66 19.612 27.956 27.142 1.00 0.00 N ATOM 1047 CA THR A 66 20.968 28.447 27.300 1.00 0.00 C ATOM 1048 C THR A 66 21.885 27.289 26.916 1.00 0.00 C ATOM 1049 O THR A 66 21.940 26.283 27.624 1.00 0.00 O ATOM 1050 CB THR A 66 21.154 28.790 28.789 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.327 29.878 29.115 1.00 0.00 O ATOM 1052 CG2 THR A 66 22.531 29.188 29.314 1.00 0.00 C ATOM 0 H THR A 66 19.273 27.458 27.965 1.00 0.00 H new ATOM 0 HA THR A 66 21.182 29.325 26.691 1.00 0.00 H new ATOM 0 HB THR A 66 20.926 27.830 29.252 1.00 0.00 H new ATOM 0 HG1 THR A 66 20.439 30.101 30.063 1.00 0.00 H new ATOM 0 HG21 THR A 66 22.468 29.393 30.383 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.235 28.374 29.141 1.00 0.00 H new ATOM 0 HG23 THR A 66 22.875 30.082 28.793 1.00 0.00 H new ATOM 1060 N LEU A 67 22.727 27.422 25.898 1.00 0.00 N ATOM 1061 CA LEU A 67 23.719 26.456 25.466 1.00 0.00 C ATOM 1062 C LEU A 67 25.073 27.061 25.832 1.00 0.00 C ATOM 1063 O LEU A 67 25.310 28.242 25.577 1.00 0.00 O ATOM 1064 CB LEU A 67 23.592 26.274 23.954 1.00 0.00 C ATOM 1065 CG LEU A 67 22.539 25.319 23.377 1.00 0.00 C ATOM 1066 CD1 LEU A 67 22.874 23.866 23.706 1.00 0.00 C ATOM 1067 CD2 LEU A 67 21.158 25.549 24.011 1.00 0.00 C ATOM 0 H LEU A 67 22.732 28.261 25.319 1.00 0.00 H new ATOM 0 HA LEU A 67 23.595 25.479 25.934 1.00 0.00 H new ATOM 0 HB2 LEU A 67 23.405 27.258 23.525 1.00 0.00 H new ATOM 0 HB3 LEU A 67 24.563 25.945 23.585 1.00 0.00 H new ATOM 0 HG LEU A 67 22.531 25.511 22.304 1.00 0.00 H new ATOM 0 HD11 LEU A 67 22.111 23.212 23.284 1.00 0.00 H new ATOM 0 HD12 LEU A 67 23.845 23.611 23.281 1.00 0.00 H new ATOM 0 HD13 LEU A 67 22.906 23.736 24.788 1.00 0.00 H new ATOM 0 HD21 LEU A 67 20.438 24.855 23.577 1.00 0.00 H new ATOM 0 HD22 LEU A 67 21.219 25.383 25.087 1.00 0.00 H new ATOM 0 HD23 LEU A 67 20.835 26.572 23.819 1.00 0.00 H new ATOM 1079 N HIS A 68 25.963 26.231 26.370 1.00 0.00 N ATOM 1080 CA HIS A 68 27.324 26.535 26.779 1.00 0.00 C ATOM 1081 C HIS A 68 28.258 25.935 25.728 1.00 0.00 C ATOM 1082 O HIS A 68 28.161 24.788 25.292 1.00 0.00 O ATOM 1083 CB HIS A 68 27.611 25.952 28.160 1.00 0.00 C ATOM 1084 CG HIS A 68 28.917 25.971 28.900 1.00 0.00 C ATOM 1085 ND1 HIS A 68 30.104 25.560 28.301 1.00 0.00 N ATOM 1086 CD2 HIS A 68 29.145 26.410 30.184 1.00 0.00 C ATOM 1087 CE1 HIS A 68 31.025 25.703 29.254 1.00 0.00 C ATOM 1088 NE2 HIS A 68 30.505 26.260 30.360 1.00 0.00 N ATOM 0 H HIS A 68 25.729 25.253 26.543 1.00 0.00 H new ATOM 0 HA HIS A 68 27.475 27.612 26.849 1.00 0.00 H new ATOM 0 HB2 HIS A 68 26.894 26.428 28.829 1.00 0.00 H new ATOM 0 HB3 HIS A 68 27.333 24.900 28.092 1.00 0.00 H new ATOM 0 HD2 HIS A 68 28.423 26.787 30.893 1.00 0.00 H new ATOM 0 HE1 HIS A 68 32.059 25.408 29.150 1.00 0.00 H new ATOM 0 HE2 HIS A 68 31.029 26.528 31.193 1.00 0.00 H new ATOM 1096 N LEU A 69 29.009 26.882 25.170 1.00 0.00 N ATOM 1097 CA LEU A 69 30.170 26.584 24.359 1.00 0.00 C ATOM 1098 C LEU A 69 31.416 26.577 25.251 1.00 0.00 C ATOM 1099 O LEU A 69 31.764 27.616 25.794 1.00 0.00 O ATOM 1100 CB LEU A 69 30.273 27.677 23.295 1.00 0.00 C ATOM 1101 CG LEU A 69 31.540 27.819 22.462 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.914 26.521 21.739 1.00 0.00 C ATOM 1103 CD2 LEU A 69 31.469 28.994 21.499 1.00 0.00 C ATOM 0 H LEU A 69 28.822 27.879 25.273 1.00 0.00 H new ATOM 0 HA LEU A 69 30.087 25.607 23.883 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.445 27.532 22.601 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.106 28.631 23.795 1.00 0.00 H new ATOM 0 HG LEU A 69 32.343 28.031 23.168 1.00 0.00 H new ATOM 0 HD11 LEU A 69 32.824 26.676 21.160 1.00 0.00 H new ATOM 0 HD12 LEU A 69 32.081 25.731 22.472 1.00 0.00 H new ATOM 0 HD13 LEU A 69 31.104 26.230 21.071 1.00 0.00 H new ATOM 0 HD21 LEU A 69 32.396 29.053 20.928 1.00 0.00 H new ATOM 0 HD22 LEU A 69 30.631 28.855 20.817 1.00 0.00 H new ATOM 0 HD23 LEU A 69 31.330 29.917 22.061 1.00 0.00 H new ATOM 1115 N VAL A 70 32.045 25.403 25.368 1.00 0.00 N ATOM 1116 CA VAL A 70 33.424 25.307 25.797 1.00 0.00 C ATOM 1117 C VAL A 70 34.257 25.770 24.598 1.00 0.00 C ATOM 1118 O VAL A 70 34.403 25.101 23.574 1.00 0.00 O ATOM 1119 CB VAL A 70 33.774 23.841 26.066 1.00 0.00 C ATOM 1120 CG1 VAL A 70 35.215 23.468 26.416 1.00 0.00 C ATOM 1121 CG2 VAL A 70 32.867 23.165 27.096 1.00 0.00 C ATOM 0 H VAL A 70 31.607 24.504 25.167 1.00 0.00 H new ATOM 0 HA VAL A 70 33.604 25.894 26.698 1.00 0.00 H new ATOM 0 HB VAL A 70 33.606 23.464 25.057 1.00 0.00 H new ATOM 0 HG11 VAL A 70 35.284 22.392 26.574 1.00 0.00 H new ATOM 0 HG12 VAL A 70 35.875 23.757 25.598 1.00 0.00 H new ATOM 0 HG13 VAL A 70 35.515 23.989 27.326 1.00 0.00 H new ATOM 0 HG21 VAL A 70 33.179 22.129 27.231 1.00 0.00 H new ATOM 0 HG22 VAL A 70 32.940 23.693 28.047 1.00 0.00 H new ATOM 0 HG23 VAL A 70 31.835 23.190 26.745 1.00 0.00 H new ATOM 1131 N LEU A 71 34.877 26.938 24.714 1.00 0.00 N ATOM 1132 CA LEU A 71 35.931 27.473 23.875 1.00 0.00 C ATOM 1133 C LEU A 71 37.179 26.733 24.358 1.00 0.00 C ATOM 1134 O LEU A 71 37.404 26.748 25.555 1.00 0.00 O ATOM 1135 CB LEU A 71 36.044 28.979 24.126 1.00 0.00 C ATOM 1136 CG LEU A 71 36.156 29.882 22.896 1.00 0.00 C ATOM 1137 CD1 LEU A 71 37.273 29.356 21.999 1.00 0.00 C ATOM 1138 CD2 LEU A 71 34.817 30.057 22.167 1.00 0.00 C ATOM 0 H LEU A 71 34.631 27.586 25.462 1.00 0.00 H new ATOM 0 HA LEU A 71 35.767 27.341 22.806 1.00 0.00 H new ATOM 0 HB2 LEU A 71 35.171 29.293 24.699 1.00 0.00 H new ATOM 0 HB3 LEU A 71 36.917 29.153 24.755 1.00 0.00 H new ATOM 0 HG LEU A 71 36.419 30.891 23.214 1.00 0.00 H new ATOM 0 HD11 LEU A 71 37.362 29.992 21.118 1.00 0.00 H new ATOM 0 HD12 LEU A 71 38.214 29.363 22.548 1.00 0.00 H new ATOM 0 HD13 LEU A 71 37.041 28.337 21.689 1.00 0.00 H new ATOM 0 HD21 LEU A 71 34.955 30.707 21.303 1.00 0.00 H new ATOM 0 HD22 LEU A 71 34.454 29.084 21.835 1.00 0.00 H new ATOM 0 HD23 LEU A 71 34.090 30.504 22.844 1.00 0.00 H new