USER MOD reduce.3.24.130724 H: found=0, std=0, add=884, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 880 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 6 LYS NZ :NH3+ 168:sc= 0.0379 (180deg=-0.107) USER MOD Set 1.2: A 12 THR OG1 : rot 180:sc= 0.0513 USER MOD Single : A 1 MET CE :methyl -170:sc= -0.142 (180deg=-0.188) USER MOD Single : A 1 MET N :NH3+ 173:sc= 1.01 (180deg=0.957) USER MOD Single : A 2 GLN : amide:sc= 0.58 K(o=0.58,f=-5.1!) USER MOD Single : A 7 THR OG1 : rot -13:sc= -0.637 USER MOD Single : A 9 THR OG1 : rot 154:sc= 1.2 USER MOD Single : A 11 LYS NZ :NH3+ -170:sc= 1.07 (180deg=0.825) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -90:sc= 0.0834 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.00505 USER MOD Single : A 25 ASN : amide:sc= 1.12 K(o=1.1,f=-0.41) USER MOD Single : A 27 LYS NZ :NH3+ 137:sc= 1.31 (180deg=0.893) USER MOD Single : A 29 LYS NZ :NH3+ -175:sc= 0.824 (180deg=0.808) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 LYS NZ :NH3+ -164:sc= 0.947 (180deg=0.792) USER MOD Single : A 40 GLN : amide:sc= 0.849 K(o=0.85,f=0) USER MOD Single : A 41 GLN : amide:sc= -0.116 K(o=-0.12,f=-6!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.15 K(o=-0.15,f=-6.5!) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0.0238 USER MOD Single : A 57 SER OG : rot 180:sc= -0.111 USER MOD Single : A 59 TYR OH : rot 100:sc= 0 USER MOD Single : A 60 ASN : amide:sc= -0.0571 X(o=-0.057,f=0) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 60:sc= 1.2 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HE2:sc= -0.506 K(o=-0.51,f=-2.4!) USER MOD Single : B -1 MET CE :methyl -167:sc= 0 (180deg=-0.0897) USER MOD Single : B -2 HIS : no HD1:sc= -0.0259 X(o=-0.026,f=-0.026) USER MOD Single : B -3 GLY N :NH3+ 134:sc= 0.0131 (180deg=0) USER MOD Single : B 681 SER OG : rot 180:sc= 0.0172 USER MOD Single : B 686 GLN : amide:sc= 1.11 K(o=1.1,f=0) USER MOD Single : B 689 TYR OH : rot 180:sc= 0 USER MOD Single : B 696 GLN : amide:sc= 0.31 X(o=0.31,f=-0.073) USER MOD Single : B 697 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 704 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 706 THR OG1 : rot 77:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.435 -1.541 -3.053 1.00 0.00 N ATOM 2 CA MET A 1 4.768 -1.612 -4.512 1.00 0.00 C ATOM 3 C MET A 1 4.488 -0.281 -5.215 1.00 0.00 C ATOM 4 O MET A 1 3.964 0.631 -4.591 1.00 0.00 O ATOM 5 CB MET A 1 4.057 -2.777 -5.252 1.00 0.00 C ATOM 6 CG MET A 1 2.546 -2.640 -5.514 1.00 0.00 C ATOM 7 SD MET A 1 1.834 -4.168 -6.173 1.00 0.00 S ATOM 8 CE MET A 1 0.274 -3.635 -6.932 1.00 0.00 C ATOM 0 H1 MET A 1 4.522 -2.487 -2.631 1.00 0.00 H new ATOM 0 H2 MET A 1 5.091 -0.888 -2.579 1.00 0.00 H new ATOM 0 H3 MET A 1 3.460 -1.198 -2.936 1.00 0.00 H new ATOM 0 HA MET A 1 5.837 -1.818 -4.559 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.553 -2.917 -6.213 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.216 -3.688 -4.675 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.039 -2.374 -4.586 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.372 -1.826 -6.217 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.316 -4.510 -7.203 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.286 -3.025 -6.223 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.486 -3.049 -7.826 1.00 0.00 H new ATOM 20 N GLN A 2 4.730 -0.174 -6.526 1.00 0.00 N ATOM 21 CA GLN A 2 4.414 0.999 -7.329 1.00 0.00 C ATOM 22 C GLN A 2 3.641 0.583 -8.569 1.00 0.00 C ATOM 23 O GLN A 2 3.750 -0.562 -8.998 1.00 0.00 O ATOM 24 CB GLN A 2 5.713 1.770 -7.658 1.00 0.00 C ATOM 25 CG GLN A 2 6.560 1.305 -8.865 1.00 0.00 C ATOM 26 CD GLN A 2 7.248 -0.062 -8.722 1.00 0.00 C ATOM 27 OE1 GLN A 2 6.637 -1.054 -8.345 1.00 0.00 O ATOM 28 NE2 GLN A 2 8.528 -0.160 -9.053 1.00 0.00 N ATOM 0 H GLN A 2 5.162 -0.923 -7.066 1.00 0.00 H new ATOM 0 HA GLN A 2 3.772 1.679 -6.770 1.00 0.00 H new ATOM 0 HB2 GLN A 2 5.446 2.814 -7.822 1.00 0.00 H new ATOM 0 HB3 GLN A 2 6.350 1.739 -6.774 1.00 0.00 H new ATOM 0 HG2 GLN A 2 5.917 1.275 -9.744 1.00 0.00 H new ATOM 0 HG3 GLN A 2 7.326 2.056 -9.056 1.00 0.00 H new ATOM 0 HE21 GLN A 2 9.038 0.665 -9.367 1.00 0.00 H new ATOM 0 HE22 GLN A 2 9.003 -1.061 -8.993 1.00 0.00 H new ATOM 37 N ILE A 3 2.900 1.506 -9.169 1.00 0.00 N ATOM 38 CA ILE A 3 2.229 1.284 -10.457 1.00 0.00 C ATOM 39 C ILE A 3 2.281 2.565 -11.269 1.00 0.00 C ATOM 40 O ILE A 3 2.459 3.636 -10.699 1.00 0.00 O ATOM 41 CB ILE A 3 0.773 0.821 -10.251 1.00 0.00 C ATOM 42 CG1 ILE A 3 0.041 1.808 -9.313 1.00 0.00 C ATOM 43 CG2 ILE A 3 0.740 -0.639 -9.751 1.00 0.00 C ATOM 44 CD1 ILE A 3 -1.466 1.794 -9.494 1.00 0.00 C ATOM 0 H ILE A 3 2.743 2.436 -8.780 1.00 0.00 H new ATOM 0 HA ILE A 3 2.746 0.492 -10.999 1.00 0.00 H new ATOM 0 HB ILE A 3 0.238 0.829 -11.200 1.00 0.00 H new ATOM 0 HG12 ILE A 3 0.279 1.561 -8.278 1.00 0.00 H new ATOM 0 HG13 ILE A 3 0.413 2.816 -9.494 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.295 -0.952 -9.610 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.218 -1.286 -10.486 1.00 0.00 H new ATOM 0 HG23 ILE A 3 1.273 -0.711 -8.803 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -1.922 2.508 -8.808 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.712 2.069 -10.520 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -1.848 0.795 -9.285 1.00 0.00 H new ATOM 56 N PHE A 4 2.099 2.449 -12.579 1.00 0.00 N ATOM 57 CA PHE A 4 2.285 3.527 -13.534 1.00 0.00 C ATOM 58 C PHE A 4 0.924 3.874 -14.122 1.00 0.00 C ATOM 59 O PHE A 4 0.427 3.216 -15.024 1.00 0.00 O ATOM 60 CB PHE A 4 3.288 3.104 -14.612 1.00 0.00 C ATOM 61 CG PHE A 4 4.476 2.307 -14.118 1.00 0.00 C ATOM 62 CD1 PHE A 4 5.287 2.847 -13.112 1.00 0.00 C ATOM 63 CD2 PHE A 4 4.762 1.028 -14.624 1.00 0.00 C ATOM 64 CE1 PHE A 4 6.365 2.114 -12.593 1.00 0.00 C ATOM 65 CE2 PHE A 4 5.891 0.332 -14.158 1.00 0.00 C ATOM 66 CZ PHE A 4 6.693 0.868 -13.142 1.00 0.00 C ATOM 0 H PHE A 4 1.809 1.574 -13.016 1.00 0.00 H new ATOM 0 HA PHE A 4 2.696 4.413 -13.050 1.00 0.00 H new ATOM 0 HB2 PHE A 4 2.762 2.513 -15.361 1.00 0.00 H new ATOM 0 HB3 PHE A 4 3.656 3.999 -15.113 1.00 0.00 H new ATOM 0 HD1 PHE A 4 5.081 3.837 -12.732 1.00 0.00 H new ATOM 0 HD2 PHE A 4 4.118 0.582 -15.367 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.942 2.511 -11.770 1.00 0.00 H new ATOM 0 HE2 PHE A 4 6.143 -0.626 -14.588 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.556 0.325 -12.785 1.00 0.00 H new ATOM 76 N VAL A 5 0.267 4.893 -13.601 1.00 0.00 N ATOM 77 CA VAL A 5 -1.065 5.261 -14.071 1.00 0.00 C ATOM 78 C VAL A 5 -0.863 6.219 -15.236 1.00 0.00 C ATOM 79 O VAL A 5 -0.471 7.366 -15.040 1.00 0.00 O ATOM 80 CB VAL A 5 -1.906 5.782 -12.898 1.00 0.00 C ATOM 81 CG1 VAL A 5 -3.289 6.232 -13.359 1.00 0.00 C ATOM 82 CG2 VAL A 5 -2.081 4.661 -11.862 1.00 0.00 C ATOM 0 H VAL A 5 0.629 5.483 -12.852 1.00 0.00 H new ATOM 0 HA VAL A 5 -1.648 4.420 -14.447 1.00 0.00 H new ATOM 0 HB VAL A 5 -1.385 6.636 -12.465 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.858 6.595 -12.503 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -3.186 7.032 -14.092 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -3.813 5.391 -13.812 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -2.678 5.027 -11.027 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.586 3.813 -12.325 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -1.103 4.346 -11.498 1.00 0.00 H new ATOM 92 N LYS A 6 -1.058 5.749 -16.469 1.00 0.00 N ATOM 93 CA LYS A 6 -0.974 6.611 -17.631 1.00 0.00 C ATOM 94 C LYS A 6 -2.197 7.491 -17.670 1.00 0.00 C ATOM 95 O LYS A 6 -3.308 6.969 -17.663 1.00 0.00 O ATOM 96 CB LYS A 6 -0.848 5.798 -18.925 1.00 0.00 C ATOM 97 CG LYS A 6 -0.238 6.729 -19.984 1.00 0.00 C ATOM 98 CD LYS A 6 -0.272 6.138 -21.393 1.00 0.00 C ATOM 99 CE LYS A 6 0.972 6.531 -22.216 1.00 0.00 C ATOM 100 NZ LYS A 6 2.231 5.890 -21.719 1.00 0.00 N ATOM 0 H LYS A 6 -1.275 4.775 -16.680 1.00 0.00 H new ATOM 0 HA LYS A 6 -0.078 7.227 -17.554 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -0.216 4.923 -18.771 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -1.823 5.434 -19.248 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -0.778 7.676 -19.981 1.00 0.00 H new ATOM 0 HG3 LYS A 6 0.795 6.950 -19.714 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -0.336 5.052 -21.329 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -1.170 6.480 -21.908 1.00 0.00 H new ATOM 0 HE2 LYS A 6 0.815 6.250 -23.257 1.00 0.00 H new ATOM 0 HE3 LYS A 6 1.089 7.614 -22.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 2.988 6.023 -22.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 2.511 6.328 -20.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 2.069 4.873 -21.574 1.00 0.00 H new ATOM 114 N THR A 7 -2.037 8.800 -17.715 1.00 0.00 N ATOM 115 CA THR A 7 -3.158 9.650 -17.995 1.00 0.00 C ATOM 116 C THR A 7 -3.392 9.729 -19.472 1.00 0.00 C ATOM 117 O THR A 7 -2.501 9.482 -20.288 1.00 0.00 O ATOM 118 CB THR A 7 -3.067 11.015 -17.356 1.00 0.00 C ATOM 119 OG1 THR A 7 -1.971 11.731 -17.866 1.00 0.00 O ATOM 120 CG2 THR A 7 -2.913 10.973 -15.852 1.00 0.00 C ATOM 0 H THR A 7 -1.152 9.284 -17.563 1.00 0.00 H new ATOM 0 HA THR A 7 -4.028 9.188 -17.528 1.00 0.00 H new ATOM 0 HB THR A 7 -4.013 11.501 -17.596 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.386 11.123 -18.364 1.00 0.00 H new ATOM 0 HG21 THR A 7 -2.854 11.990 -15.464 1.00 0.00 H new ATOM 0 HG22 THR A 7 -3.772 10.466 -15.412 1.00 0.00 H new ATOM 0 HG23 THR A 7 -2.002 10.433 -15.594 1.00 0.00 H new ATOM 128 N LEU A 8 -4.614 10.113 -19.811 1.00 0.00 N ATOM 129 CA LEU A 8 -5.007 10.162 -21.205 1.00 0.00 C ATOM 130 C LEU A 8 -4.140 11.121 -22.027 1.00 0.00 C ATOM 131 O LEU A 8 -4.151 10.983 -23.241 1.00 0.00 O ATOM 132 CB LEU A 8 -6.495 10.465 -21.396 1.00 0.00 C ATOM 133 CG LEU A 8 -7.518 9.380 -21.051 1.00 0.00 C ATOM 134 CD1 LEU A 8 -8.848 9.616 -21.763 1.00 0.00 C ATOM 135 CD2 LEU A 8 -7.013 7.969 -21.376 1.00 0.00 C ATOM 0 H LEU A 8 -5.338 10.391 -19.149 1.00 0.00 H new ATOM 0 HA LEU A 8 -4.835 9.156 -21.588 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -6.732 11.345 -20.798 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.645 10.740 -22.440 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.669 9.448 -19.974 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -9.550 8.826 -21.494 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -9.255 10.581 -21.462 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -8.690 9.609 -22.841 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -7.778 7.239 -21.112 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.795 7.897 -22.442 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.106 7.767 -20.806 1.00 0.00 H new ATOM 147 N THR A 9 -3.371 12.047 -21.438 1.00 0.00 N ATOM 148 CA THR A 9 -2.567 13.001 -22.203 1.00 0.00 C ATOM 149 C THR A 9 -1.311 12.327 -22.773 1.00 0.00 C ATOM 150 O THR A 9 -0.579 12.917 -23.568 1.00 0.00 O ATOM 151 CB THR A 9 -2.201 14.228 -21.351 1.00 0.00 C ATOM 152 OG1 THR A 9 -1.859 15.313 -22.180 1.00 0.00 O ATOM 153 CG2 THR A 9 -1.106 14.013 -20.308 1.00 0.00 C ATOM 0 H THR A 9 -3.291 12.153 -20.427 1.00 0.00 H new ATOM 0 HA THR A 9 -3.170 13.350 -23.042 1.00 0.00 H new ATOM 0 HB THR A 9 -3.103 14.438 -20.776 1.00 0.00 H new ATOM 0 HG1 THR A 9 -2.037 16.154 -21.709 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.931 14.943 -19.767 1.00 0.00 H new ATOM 0 HG22 THR A 9 -1.418 13.239 -19.607 1.00 0.00 H new ATOM 0 HG23 THR A 9 -0.186 13.703 -20.804 1.00 0.00 H new ATOM 161 N GLY A 10 -1.035 11.095 -22.335 1.00 0.00 N ATOM 162 CA GLY A 10 0.228 10.452 -22.616 1.00 0.00 C ATOM 163 C GLY A 10 1.238 10.826 -21.546 1.00 0.00 C ATOM 164 O GLY A 10 2.410 11.009 -21.875 1.00 0.00 O ATOM 0 H GLY A 10 -1.680 10.530 -21.783 1.00 0.00 H new ATOM 0 HA2 GLY A 10 0.098 9.370 -22.646 1.00 0.00 H new ATOM 0 HA3 GLY A 10 0.593 10.757 -23.597 1.00 0.00 H new ATOM 168 N LYS A 11 0.800 10.950 -20.281 1.00 0.00 N ATOM 169 CA LYS A 11 1.749 11.093 -19.175 1.00 0.00 C ATOM 170 C LYS A 11 1.612 9.822 -18.380 1.00 0.00 C ATOM 171 O LYS A 11 0.534 9.256 -18.382 1.00 0.00 O ATOM 172 CB LYS A 11 1.411 12.373 -18.386 1.00 0.00 C ATOM 173 CG LYS A 11 2.235 12.573 -17.107 1.00 0.00 C ATOM 174 CD LYS A 11 1.574 12.086 -15.808 1.00 0.00 C ATOM 175 CE LYS A 11 0.296 12.840 -15.406 1.00 0.00 C ATOM 176 NZ LYS A 11 0.515 14.279 -15.073 1.00 0.00 N ATOM 0 H LYS A 11 -0.183 10.954 -20.007 1.00 0.00 H new ATOM 0 HA LYS A 11 2.787 11.214 -19.484 1.00 0.00 H new ATOM 0 HB2 LYS A 11 1.560 13.235 -19.037 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.354 12.352 -18.122 1.00 0.00 H new ATOM 0 HG2 LYS A 11 3.187 12.056 -17.225 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.460 13.635 -17.003 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.335 11.028 -15.914 1.00 0.00 H new ATOM 0 HD3 LYS A 11 2.297 12.169 -14.997 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.424 12.773 -16.221 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.150 12.343 -14.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -0.350 14.674 -14.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 1.299 14.363 -14.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 0.749 14.804 -15.940 1.00 0.00 H new ATOM 190 N THR A 12 2.614 9.399 -17.640 1.00 0.00 N ATOM 191 CA THR A 12 2.500 8.258 -16.749 1.00 0.00 C ATOM 192 C THR A 12 2.939 8.692 -15.357 1.00 0.00 C ATOM 193 O THR A 12 4.090 9.069 -15.144 1.00 0.00 O ATOM 194 CB THR A 12 3.254 7.061 -17.350 1.00 0.00 C ATOM 195 OG1 THR A 12 3.180 7.038 -18.768 1.00 0.00 O ATOM 196 CG2 THR A 12 2.605 5.769 -16.874 1.00 0.00 C ATOM 0 H THR A 12 3.535 9.837 -17.637 1.00 0.00 H new ATOM 0 HA THR A 12 1.473 7.908 -16.641 1.00 0.00 H new ATOM 0 HB THR A 12 4.293 7.153 -17.034 1.00 0.00 H new ATOM 0 HG1 THR A 12 3.673 6.263 -19.109 1.00 0.00 H new ATOM 0 HG21 THR A 12 3.137 4.917 -17.298 1.00 0.00 H new ATOM 0 HG22 THR A 12 2.649 5.719 -15.786 1.00 0.00 H new ATOM 0 HG23 THR A 12 1.564 5.744 -17.197 1.00 0.00 H new ATOM 204 N ILE A 13 1.977 8.714 -14.427 1.00 0.00 N ATOM 205 CA ILE A 13 2.204 9.062 -13.038 1.00 0.00 C ATOM 206 C ILE A 13 2.410 7.755 -12.309 1.00 0.00 C ATOM 207 O ILE A 13 1.503 6.935 -12.217 1.00 0.00 O ATOM 208 CB ILE A 13 1.085 9.965 -12.456 1.00 0.00 C ATOM 209 CG1 ILE A 13 0.941 9.877 -10.916 1.00 0.00 C ATOM 210 CG2 ILE A 13 -0.311 9.899 -13.081 1.00 0.00 C ATOM 211 CD1 ILE A 13 -0.301 9.176 -10.342 1.00 0.00 C ATOM 0 H ILE A 13 1.005 8.485 -14.633 1.00 0.00 H new ATOM 0 HA ILE A 13 3.089 9.686 -12.918 1.00 0.00 H new ATOM 0 HB ILE A 13 1.487 10.933 -12.755 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.822 9.365 -10.528 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.963 10.893 -10.521 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -0.975 10.589 -12.561 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -0.252 10.176 -14.134 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -0.701 8.885 -12.994 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -0.259 9.195 -9.253 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -1.199 9.693 -10.679 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -0.327 8.142 -10.686 1.00 0.00 H new ATOM 223 N THR A 14 3.606 7.568 -11.788 1.00 0.00 N ATOM 224 CA THR A 14 3.905 6.430 -10.946 1.00 0.00 C ATOM 225 C THR A 14 3.387 6.767 -9.549 1.00 0.00 C ATOM 226 O THR A 14 3.504 7.908 -9.099 1.00 0.00 O ATOM 227 CB THR A 14 5.410 6.161 -10.953 1.00 0.00 C ATOM 228 OG1 THR A 14 5.887 6.125 -12.288 1.00 0.00 O ATOM 229 CG2 THR A 14 5.759 4.832 -10.246 1.00 0.00 C ATOM 0 H THR A 14 4.394 8.198 -11.936 1.00 0.00 H new ATOM 0 HA THR A 14 3.425 5.520 -11.305 1.00 0.00 H new ATOM 0 HB THR A 14 5.892 6.971 -10.406 1.00 0.00 H new ATOM 0 HG1 THR A 14 6.852 5.954 -12.286 1.00 0.00 H new ATOM 0 HG21 THR A 14 6.838 4.678 -10.273 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.424 4.872 -9.210 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.262 4.007 -10.756 1.00 0.00 H new ATOM 237 N LEU A 15 2.842 5.775 -8.844 1.00 0.00 N ATOM 238 CA LEU A 15 2.440 5.943 -7.461 1.00 0.00 C ATOM 239 C LEU A 15 2.685 4.678 -6.694 1.00 0.00 C ATOM 240 O LEU A 15 2.737 3.614 -7.297 1.00 0.00 O ATOM 241 CB LEU A 15 0.971 6.365 -7.364 1.00 0.00 C ATOM 242 CG LEU A 15 -0.080 5.341 -7.820 1.00 0.00 C ATOM 243 CD1 LEU A 15 -1.341 5.477 -6.973 1.00 0.00 C ATOM 244 CD2 LEU A 15 -0.483 5.559 -9.256 1.00 0.00 C ATOM 0 H LEU A 15 2.671 4.842 -9.219 1.00 0.00 H new ATOM 0 HA LEU A 15 3.042 6.738 -7.021 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.761 6.627 -6.327 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.839 7.272 -7.954 1.00 0.00 H new ATOM 0 HG LEU A 15 0.370 4.354 -7.710 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -2.081 4.748 -7.303 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -1.097 5.298 -5.926 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -1.748 6.482 -7.085 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.227 4.816 -9.542 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.906 6.557 -9.368 1.00 0.00 H new ATOM 0 HD23 LEU A 15 0.392 5.462 -9.898 1.00 0.00 H new ATOM 256 N GLU A 16 2.763 4.788 -5.375 1.00 0.00 N ATOM 257 CA GLU A 16 3.010 3.652 -4.513 1.00 0.00 C ATOM 258 C GLU A 16 1.696 3.201 -3.900 1.00 0.00 C ATOM 259 O GLU A 16 0.897 4.001 -3.404 1.00 0.00 O ATOM 260 CB GLU A 16 4.086 3.978 -3.469 1.00 0.00 C ATOM 261 CG GLU A 16 5.473 3.904 -4.112 1.00 0.00 C ATOM 262 CD GLU A 16 6.589 4.178 -3.087 1.00 0.00 C ATOM 263 OE1 GLU A 16 6.979 5.357 -2.904 1.00 0.00 O ATOM 264 OE2 GLU A 16 7.100 3.213 -2.468 1.00 0.00 O ATOM 0 H GLU A 16 2.656 5.671 -4.876 1.00 0.00 H new ATOM 0 HA GLU A 16 3.408 2.820 -5.094 1.00 0.00 H new ATOM 0 HB2 GLU A 16 3.918 4.974 -3.059 1.00 0.00 H new ATOM 0 HB3 GLU A 16 4.023 3.276 -2.637 1.00 0.00 H new ATOM 0 HG2 GLU A 16 5.618 2.918 -4.553 1.00 0.00 H new ATOM 0 HG3 GLU A 16 5.538 4.629 -4.923 1.00 0.00 H new ATOM 271 N VAL A 17 1.479 1.897 -4.000 1.00 0.00 N ATOM 272 CA VAL A 17 0.234 1.192 -3.702 1.00 0.00 C ATOM 273 C VAL A 17 0.573 -0.182 -3.110 1.00 0.00 C ATOM 274 O VAL A 17 1.739 -0.527 -2.916 1.00 0.00 O ATOM 275 CB VAL A 17 -0.588 1.037 -5.006 1.00 0.00 C ATOM 276 CG1 VAL A 17 -0.934 2.384 -5.648 1.00 0.00 C ATOM 277 CG2 VAL A 17 0.153 0.174 -6.046 1.00 0.00 C ATOM 0 H VAL A 17 2.213 1.260 -4.311 1.00 0.00 H new ATOM 0 HA VAL A 17 -0.359 1.754 -2.980 1.00 0.00 H new ATOM 0 HB VAL A 17 -1.513 0.543 -4.709 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.510 2.216 -6.558 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -1.523 2.979 -4.950 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -0.015 2.917 -5.893 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.455 0.088 -6.947 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.106 0.642 -6.294 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.333 -0.819 -5.633 1.00 0.00 H new ATOM 287 N GLU A 18 -0.445 -1.018 -2.939 1.00 0.00 N ATOM 288 CA GLU A 18 -0.336 -2.429 -2.597 1.00 0.00 C ATOM 289 C GLU A 18 -1.276 -3.161 -3.558 1.00 0.00 C ATOM 290 O GLU A 18 -2.226 -2.539 -4.038 1.00 0.00 O ATOM 291 CB GLU A 18 -0.777 -2.667 -1.144 1.00 0.00 C ATOM 292 CG GLU A 18 -0.007 -1.855 -0.095 1.00 0.00 C ATOM 293 CD GLU A 18 1.523 -2.075 -0.088 1.00 0.00 C ATOM 294 OE1 GLU A 18 2.020 -3.115 -0.584 1.00 0.00 O ATOM 295 OE2 GLU A 18 2.250 -1.202 0.449 1.00 0.00 O ATOM 0 H GLU A 18 -1.414 -0.715 -3.040 1.00 0.00 H new ATOM 0 HA GLU A 18 0.691 -2.783 -2.684 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.838 -2.431 -1.058 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -0.667 -3.727 -0.915 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -0.205 -0.796 -0.261 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.398 -2.102 0.892 1.00 0.00 H new ATOM 302 N PRO A 19 -1.082 -4.455 -3.852 1.00 0.00 N ATOM 303 CA PRO A 19 -2.050 -5.219 -4.635 1.00 0.00 C ATOM 304 C PRO A 19 -3.472 -5.163 -4.043 1.00 0.00 C ATOM 305 O PRO A 19 -4.465 -5.134 -4.765 1.00 0.00 O ATOM 306 CB PRO A 19 -1.499 -6.645 -4.688 1.00 0.00 C ATOM 307 CG PRO A 19 -0.026 -6.542 -4.301 1.00 0.00 C ATOM 308 CD PRO A 19 0.056 -5.268 -3.456 1.00 0.00 C ATOM 0 HA PRO A 19 -2.163 -4.798 -5.634 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.038 -7.297 -4.001 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -1.612 -7.070 -5.685 1.00 0.00 H new ATOM 0 HG2 PRO A 19 0.299 -7.416 -3.736 1.00 0.00 H new ATOM 0 HG3 PRO A 19 0.613 -6.477 -5.182 1.00 0.00 H new ATOM 0 HD2 PRO A 19 0.018 -5.502 -2.392 1.00 0.00 H new ATOM 0 HD3 PRO A 19 0.993 -4.741 -3.633 1.00 0.00 H new ATOM 316 N SER A 20 -3.580 -5.063 -2.723 1.00 0.00 N ATOM 317 CA SER A 20 -4.823 -5.014 -1.970 1.00 0.00 C ATOM 318 C SER A 20 -5.332 -3.584 -1.847 1.00 0.00 C ATOM 319 O SER A 20 -6.359 -3.355 -1.204 1.00 0.00 O ATOM 320 CB SER A 20 -4.569 -5.672 -0.603 1.00 0.00 C ATOM 321 OG SER A 20 -3.314 -5.259 -0.067 1.00 0.00 O ATOM 0 H SER A 20 -2.759 -5.011 -2.120 1.00 0.00 H new ATOM 0 HA SER A 20 -5.610 -5.562 -2.488 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.369 -5.407 0.088 1.00 0.00 H new ATOM 0 HB3 SER A 20 -4.585 -6.757 -0.708 1.00 0.00 H new ATOM 0 HG SER A 20 -2.613 -5.877 -0.362 1.00 0.00 H new ATOM 327 N ASP A 21 -4.641 -2.617 -2.461 1.00 0.00 N ATOM 328 CA ASP A 21 -5.097 -1.254 -2.423 1.00 0.00 C ATOM 329 C ASP A 21 -6.311 -1.131 -3.328 1.00 0.00 C ATOM 330 O ASP A 21 -6.332 -1.656 -4.452 1.00 0.00 O ATOM 331 CB ASP A 21 -4.007 -0.261 -2.828 1.00 0.00 C ATOM 332 CG ASP A 21 -4.314 1.166 -2.365 1.00 0.00 C ATOM 333 OD1 ASP A 21 -5.135 1.336 -1.437 1.00 0.00 O ATOM 334 OD2 ASP A 21 -3.663 2.105 -2.875 1.00 0.00 O ATOM 0 H ASP A 21 -3.776 -2.766 -2.980 1.00 0.00 H new ATOM 0 HA ASP A 21 -5.364 -1.002 -1.397 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -3.054 -0.580 -2.405 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.895 -0.272 -3.912 1.00 0.00 H new ATOM 339 N THR A 22 -7.349 -0.490 -2.816 1.00 0.00 N ATOM 340 CA THR A 22 -8.581 -0.301 -3.553 1.00 0.00 C ATOM 341 C THR A 22 -8.396 0.740 -4.630 1.00 0.00 C ATOM 342 O THR A 22 -7.699 1.741 -4.459 1.00 0.00 O ATOM 343 CB THR A 22 -9.783 0.081 -2.674 1.00 0.00 C ATOM 344 OG1 THR A 22 -9.404 1.038 -1.694 1.00 0.00 O ATOM 345 CG2 THR A 22 -10.365 -1.158 -2.004 1.00 0.00 C ATOM 0 H THR A 22 -7.358 -0.088 -1.879 1.00 0.00 H new ATOM 0 HA THR A 22 -8.811 -1.271 -3.994 1.00 0.00 H new ATOM 0 HB THR A 22 -10.547 0.525 -3.312 1.00 0.00 H new ATOM 0 HG1 THR A 22 -10.182 1.270 -1.145 1.00 0.00 H new ATOM 0 HG21 THR A 22 -11.215 -0.871 -1.385 1.00 0.00 H new ATOM 0 HG22 THR A 22 -10.693 -1.864 -2.767 1.00 0.00 H new ATOM 0 HG23 THR A 22 -9.603 -1.626 -1.380 1.00 0.00 H new ATOM 353 N ILE A 23 -9.118 0.533 -5.724 1.00 0.00 N ATOM 354 CA ILE A 23 -9.265 1.513 -6.792 1.00 0.00 C ATOM 355 C ILE A 23 -9.645 2.887 -6.223 1.00 0.00 C ATOM 356 O ILE A 23 -9.060 3.866 -6.665 1.00 0.00 O ATOM 357 CB ILE A 23 -10.295 1.009 -7.809 1.00 0.00 C ATOM 358 CG1 ILE A 23 -9.954 -0.372 -8.404 1.00 0.00 C ATOM 359 CG2 ILE A 23 -10.513 2.010 -8.959 1.00 0.00 C ATOM 360 CD1 ILE A 23 -8.479 -0.761 -8.532 1.00 0.00 C ATOM 0 H ILE A 23 -9.626 -0.335 -5.897 1.00 0.00 H new ATOM 0 HA ILE A 23 -8.311 1.637 -7.305 1.00 0.00 H new ATOM 0 HB ILE A 23 -11.216 0.907 -7.234 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -10.446 -1.128 -7.792 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -10.400 -0.426 -9.397 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -11.251 1.610 -9.655 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -10.871 2.957 -8.554 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -9.571 2.173 -9.483 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -8.402 -1.758 -8.966 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.968 -0.044 -9.175 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -8.015 -0.758 -7.546 1.00 0.00 H new ATOM 372 N GLU A 24 -10.557 2.984 -5.251 1.00 0.00 N ATOM 373 CA GLU A 24 -10.932 4.282 -4.681 1.00 0.00 C ATOM 374 C GLU A 24 -9.714 4.998 -4.099 1.00 0.00 C ATOM 375 O GLU A 24 -9.485 6.179 -4.358 1.00 0.00 O ATOM 376 CB GLU A 24 -11.994 4.086 -3.590 1.00 0.00 C ATOM 377 CG GLU A 24 -12.597 5.421 -3.137 1.00 0.00 C ATOM 378 CD GLU A 24 -13.721 5.199 -2.108 1.00 0.00 C ATOM 379 OE1 GLU A 24 -13.419 5.058 -0.898 1.00 0.00 O ATOM 380 OE2 GLU A 24 -14.913 5.175 -2.499 1.00 0.00 O ATOM 0 H GLU A 24 -11.046 2.186 -4.845 1.00 0.00 H new ATOM 0 HA GLU A 24 -11.342 4.900 -5.479 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -12.786 3.438 -3.966 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.547 3.580 -2.734 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -11.818 6.046 -2.701 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -12.990 5.958 -4.000 1.00 0.00 H new ATOM 387 N ASN A 25 -8.902 4.268 -3.333 1.00 0.00 N ATOM 388 CA ASN A 25 -7.757 4.861 -2.657 1.00 0.00 C ATOM 389 C ASN A 25 -6.642 5.154 -3.651 1.00 0.00 C ATOM 390 O ASN A 25 -5.943 6.154 -3.522 1.00 0.00 O ATOM 391 CB ASN A 25 -7.285 3.937 -1.538 1.00 0.00 C ATOM 392 CG ASN A 25 -6.209 4.600 -0.682 1.00 0.00 C ATOM 393 OD1 ASN A 25 -6.316 5.764 -0.303 1.00 0.00 O ATOM 394 ND2 ASN A 25 -5.175 3.860 -0.330 1.00 0.00 N ATOM 0 H ASN A 25 -9.019 3.268 -3.168 1.00 0.00 H new ATOM 0 HA ASN A 25 -8.053 5.811 -2.212 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -8.132 3.662 -0.910 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -6.893 3.015 -1.967 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -4.447 4.252 0.267 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -5.104 2.896 -0.655 1.00 0.00 H new ATOM 401 N VAL A 26 -6.517 4.348 -4.703 1.00 0.00 N ATOM 402 CA VAL A 26 -5.628 4.600 -5.819 1.00 0.00 C ATOM 403 C VAL A 26 -6.056 5.902 -6.488 1.00 0.00 C ATOM 404 O VAL A 26 -5.231 6.803 -6.612 1.00 0.00 O ATOM 405 CB VAL A 26 -5.692 3.372 -6.738 1.00 0.00 C ATOM 406 CG1 VAL A 26 -5.102 3.641 -8.120 1.00 0.00 C ATOM 407 CG2 VAL A 26 -5.012 2.151 -6.113 1.00 0.00 C ATOM 0 H VAL A 26 -7.047 3.482 -4.799 1.00 0.00 H new ATOM 0 HA VAL A 26 -4.588 4.734 -5.522 1.00 0.00 H new ATOM 0 HB VAL A 26 -6.753 3.155 -6.862 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.173 2.739 -8.728 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.655 4.448 -8.601 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -4.055 3.929 -8.019 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.081 1.306 -6.798 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -3.963 2.377 -5.921 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -5.507 1.899 -5.175 1.00 0.00 H new ATOM 417 N LYS A 27 -7.332 6.075 -6.857 1.00 0.00 N ATOM 418 CA LYS A 27 -7.801 7.341 -7.418 1.00 0.00 C ATOM 419 C LYS A 27 -7.518 8.508 -6.477 1.00 0.00 C ATOM 420 O LYS A 27 -7.176 9.587 -6.957 1.00 0.00 O ATOM 421 CB LYS A 27 -9.319 7.337 -7.676 1.00 0.00 C ATOM 422 CG LYS A 27 -9.902 6.437 -8.775 1.00 0.00 C ATOM 423 CD LYS A 27 -11.380 6.840 -8.922 1.00 0.00 C ATOM 424 CE LYS A 27 -12.247 5.868 -9.720 1.00 0.00 C ATOM 425 NZ LYS A 27 -13.672 6.327 -9.707 1.00 0.00 N ATOM 0 H LYS A 27 -8.051 5.357 -6.776 1.00 0.00 H new ATOM 0 HA LYS A 27 -7.260 7.458 -8.357 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -9.808 7.066 -6.740 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -9.613 8.361 -7.904 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -9.366 6.573 -9.714 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -9.811 5.385 -8.506 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -11.810 6.951 -7.926 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -11.427 7.819 -9.400 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.886 5.804 -10.746 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -12.174 4.868 -9.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -14.078 6.226 -10.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.217 5.750 -9.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.713 7.325 -9.418 1.00 0.00 H new ATOM 439 N ALA A 28 -7.638 8.326 -5.162 1.00 0.00 N ATOM 440 CA ALA A 28 -7.350 9.391 -4.202 1.00 0.00 C ATOM 441 C ALA A 28 -5.865 9.755 -4.233 1.00 0.00 C ATOM 442 O ALA A 28 -5.518 10.928 -4.111 1.00 0.00 O ATOM 443 CB ALA A 28 -7.789 8.977 -2.794 1.00 0.00 C ATOM 0 H ALA A 28 -7.934 7.448 -4.736 1.00 0.00 H new ATOM 0 HA ALA A 28 -7.918 10.277 -4.485 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.567 9.781 -2.093 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.861 8.778 -2.791 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.252 8.077 -2.495 1.00 0.00 H new ATOM 449 N LYS A 29 -4.974 8.795 -4.493 1.00 0.00 N ATOM 450 CA LYS A 29 -3.562 9.106 -4.731 1.00 0.00 C ATOM 451 C LYS A 29 -3.422 9.849 -6.053 1.00 0.00 C ATOM 452 O LYS A 29 -2.633 10.770 -6.147 1.00 0.00 O ATOM 453 CB LYS A 29 -2.714 7.835 -4.699 1.00 0.00 C ATOM 454 CG LYS A 29 -2.664 7.259 -3.281 1.00 0.00 C ATOM 455 CD LYS A 29 -2.044 5.859 -3.289 1.00 0.00 C ATOM 456 CE LYS A 29 -1.919 5.326 -1.853 1.00 0.00 C ATOM 457 NZ LYS A 29 -0.532 5.442 -1.317 1.00 0.00 N ATOM 0 H LYS A 29 -5.203 7.802 -4.544 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.194 9.753 -3.935 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.130 7.096 -5.384 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -1.704 8.056 -5.044 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -2.081 7.917 -2.636 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -3.671 7.214 -2.865 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -2.660 5.184 -3.883 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -1.061 5.891 -3.760 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -2.602 5.875 -1.205 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -2.228 4.281 -1.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -0.483 4.993 -0.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 0.131 4.968 -1.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -0.275 6.446 -1.233 1.00 0.00 H new ATOM 471 N ILE A 30 -4.224 9.544 -7.072 1.00 0.00 N ATOM 472 CA ILE A 30 -4.179 10.342 -8.302 1.00 0.00 C ATOM 473 C ILE A 30 -4.623 11.771 -8.015 1.00 0.00 C ATOM 474 O ILE A 30 -4.050 12.680 -8.568 1.00 0.00 O ATOM 475 CB ILE A 30 -5.017 9.750 -9.445 1.00 0.00 C ATOM 476 CG1 ILE A 30 -4.872 8.244 -9.666 1.00 0.00 C ATOM 477 CG2 ILE A 30 -4.647 10.488 -10.739 1.00 0.00 C ATOM 478 CD1 ILE A 30 -3.441 7.751 -9.755 1.00 0.00 C ATOM 0 H ILE A 30 -4.894 8.775 -7.076 1.00 0.00 H new ATOM 0 HA ILE A 30 -3.143 10.332 -8.640 1.00 0.00 H new ATOM 0 HB ILE A 30 -6.059 9.890 -9.157 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -5.372 7.721 -8.851 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -5.393 7.974 -10.585 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -5.230 10.085 -11.567 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -4.863 11.550 -10.626 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -3.585 10.353 -10.944 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -3.437 6.672 -9.912 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -2.939 8.241 -10.589 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -2.917 7.985 -8.828 1.00 0.00 H new ATOM 490 N GLN A 31 -5.590 12.012 -7.148 1.00 0.00 N ATOM 491 CA GLN A 31 -5.985 13.350 -6.714 1.00 0.00 C ATOM 492 C GLN A 31 -4.794 14.057 -6.074 1.00 0.00 C ATOM 493 O GLN A 31 -4.579 15.236 -6.326 1.00 0.00 O ATOM 494 CB GLN A 31 -7.168 13.287 -5.739 1.00 0.00 C ATOM 495 CG GLN A 31 -7.792 14.659 -5.399 1.00 0.00 C ATOM 496 CD GLN A 31 -8.190 14.725 -3.926 1.00 0.00 C ATOM 497 OE1 GLN A 31 -7.385 15.079 -3.069 1.00 0.00 O ATOM 498 NE2 GLN A 31 -9.421 14.357 -3.594 1.00 0.00 N ATOM 0 H GLN A 31 -6.138 11.270 -6.713 1.00 0.00 H new ATOM 0 HA GLN A 31 -6.307 13.918 -7.587 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -7.940 12.647 -6.165 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -6.836 12.814 -4.815 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -7.080 15.453 -5.624 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -8.668 14.830 -6.025 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -10.079 14.065 -4.317 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -9.710 14.366 -2.616 1.00 0.00 H new ATOM 507 N ASP A 32 -3.970 13.334 -5.318 1.00 0.00 N ATOM 508 CA ASP A 32 -2.724 13.896 -4.805 1.00 0.00 C ATOM 509 C ASP A 32 -1.772 14.271 -5.947 1.00 0.00 C ATOM 510 O ASP A 32 -1.124 15.320 -5.880 1.00 0.00 O ATOM 511 CB ASP A 32 -2.034 12.950 -3.814 1.00 0.00 C ATOM 512 CG ASP A 32 -0.606 13.434 -3.486 1.00 0.00 C ATOM 513 OD1 ASP A 32 -0.448 14.230 -2.528 1.00 0.00 O ATOM 514 OD2 ASP A 32 0.359 13.003 -4.165 1.00 0.00 O ATOM 0 H ASP A 32 -4.141 12.365 -5.049 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.985 14.806 -4.264 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -2.620 12.889 -2.897 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -1.993 11.945 -4.234 1.00 0.00 H new ATOM 519 N LYS A 33 -1.706 13.462 -7.016 1.00 0.00 N ATOM 520 CA LYS A 33 -0.674 13.625 -8.037 1.00 0.00 C ATOM 521 C LYS A 33 -1.100 14.544 -9.184 1.00 0.00 C ATOM 522 O LYS A 33 -0.262 15.196 -9.806 1.00 0.00 O ATOM 523 CB LYS A 33 -0.270 12.236 -8.532 1.00 0.00 C ATOM 524 CG LYS A 33 0.071 11.219 -7.410 1.00 0.00 C ATOM 525 CD LYS A 33 1.536 10.754 -7.364 1.00 0.00 C ATOM 526 CE LYS A 33 2.543 11.901 -7.205 1.00 0.00 C ATOM 527 NZ LYS A 33 2.595 12.435 -5.811 1.00 0.00 N ATOM 0 H LYS A 33 -2.354 12.694 -7.190 1.00 0.00 H new ATOM 0 HA LYS A 33 0.185 14.125 -7.591 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -1.082 11.831 -9.136 1.00 0.00 H new ATOM 0 HB3 LYS A 33 0.595 12.337 -9.187 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -0.181 11.667 -6.449 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -0.567 10.343 -7.531 1.00 0.00 H new ATOM 0 HD2 LYS A 33 1.660 10.056 -6.536 1.00 0.00 H new ATOM 0 HD3 LYS A 33 1.763 10.207 -8.279 1.00 0.00 H new ATOM 0 HE2 LYS A 33 3.534 11.551 -7.492 1.00 0.00 H new ATOM 0 HE3 LYS A 33 2.279 12.708 -7.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 3.070 13.360 -5.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 1.628 12.543 -5.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 3.123 11.775 -5.206 1.00 0.00 H new ATOM 541 N GLU A 34 -2.406 14.621 -9.424 1.00 0.00 N ATOM 542 CA GLU A 34 -3.038 15.239 -10.579 1.00 0.00 C ATOM 543 C GLU A 34 -4.034 16.334 -10.193 1.00 0.00 C ATOM 544 O GLU A 34 -4.152 17.330 -10.905 1.00 0.00 O ATOM 545 CB GLU A 34 -3.775 14.141 -11.362 1.00 0.00 C ATOM 546 CG GLU A 34 -2.833 13.081 -11.938 1.00 0.00 C ATOM 547 CD GLU A 34 -1.646 13.673 -12.711 1.00 0.00 C ATOM 548 OE1 GLU A 34 -1.851 14.505 -13.627 1.00 0.00 O ATOM 549 OE2 GLU A 34 -0.493 13.288 -12.422 1.00 0.00 O ATOM 0 H GLU A 34 -3.090 14.229 -8.777 1.00 0.00 H new ATOM 0 HA GLU A 34 -2.260 15.712 -11.179 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -4.498 13.658 -10.705 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.339 14.599 -12.175 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -2.454 12.462 -11.125 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -3.398 12.426 -12.601 1.00 0.00 H new ATOM 556 N GLY A 35 -4.745 16.153 -9.077 1.00 0.00 N ATOM 557 CA GLY A 35 -5.656 17.144 -8.506 1.00 0.00 C ATOM 558 C GLY A 35 -7.126 16.808 -8.755 1.00 0.00 C ATOM 559 O GLY A 35 -7.988 17.653 -8.518 1.00 0.00 O ATOM 0 H GLY A 35 -4.701 15.291 -8.533 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -5.481 17.216 -7.433 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -5.434 18.123 -8.932 1.00 0.00 H new ATOM 563 N ILE A 36 -7.433 15.595 -9.237 1.00 0.00 N ATOM 564 CA ILE A 36 -8.770 15.254 -9.715 1.00 0.00 C ATOM 565 C ILE A 36 -9.462 14.403 -8.656 1.00 0.00 C ATOM 566 O ILE A 36 -8.893 13.383 -8.277 1.00 0.00 O ATOM 567 CB ILE A 36 -8.629 14.467 -11.029 1.00 0.00 C ATOM 568 CG1 ILE A 36 -7.807 15.260 -12.073 1.00 0.00 C ATOM 569 CG2 ILE A 36 -10.019 14.154 -11.608 1.00 0.00 C ATOM 570 CD1 ILE A 36 -7.483 14.403 -13.291 1.00 0.00 C ATOM 0 H ILE A 36 -6.762 14.830 -9.304 1.00 0.00 H new ATOM 0 HA ILE A 36 -9.363 16.151 -9.895 1.00 0.00 H new ATOM 0 HB ILE A 36 -8.104 13.538 -10.806 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -8.366 16.142 -12.385 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -6.882 15.613 -11.618 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -9.909 13.597 -12.538 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -10.585 13.558 -10.893 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -10.550 15.086 -11.804 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -6.905 14.989 -14.005 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -6.902 13.534 -12.981 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.410 14.071 -13.759 1.00 0.00 H new ATOM 582 N PRO A 37 -10.688 14.731 -8.217 1.00 0.00 N ATOM 583 CA PRO A 37 -11.400 13.949 -7.219 1.00 0.00 C ATOM 584 C PRO A 37 -11.821 12.583 -7.767 1.00 0.00 C ATOM 585 O PRO A 37 -12.073 12.465 -8.962 1.00 0.00 O ATOM 586 CB PRO A 37 -12.599 14.802 -6.794 1.00 0.00 C ATOM 587 CG PRO A 37 -12.753 15.891 -7.856 1.00 0.00 C ATOM 588 CD PRO A 37 -11.462 15.878 -8.670 1.00 0.00 C ATOM 0 HA PRO A 37 -10.765 13.723 -6.362 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -13.502 14.196 -6.726 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -12.434 15.240 -5.810 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -13.616 15.695 -8.492 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -12.912 16.865 -7.394 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -11.678 15.801 -9.736 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -10.904 16.803 -8.524 1.00 0.00 H new ATOM 596 N PRO A 38 -11.963 11.547 -6.921 1.00 0.00 N ATOM 597 CA PRO A 38 -12.198 10.189 -7.399 1.00 0.00 C ATOM 598 C PRO A 38 -13.524 9.995 -8.104 1.00 0.00 C ATOM 599 O PRO A 38 -13.577 9.222 -9.053 1.00 0.00 O ATOM 600 CB PRO A 38 -12.119 9.292 -6.172 1.00 0.00 C ATOM 601 CG PRO A 38 -12.343 10.218 -4.984 1.00 0.00 C ATOM 602 CD PRO A 38 -11.782 11.551 -5.472 1.00 0.00 C ATOM 0 HA PRO A 38 -11.450 9.948 -8.154 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -12.876 8.508 -6.208 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -11.150 8.797 -6.108 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -13.399 10.295 -4.727 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -11.823 9.864 -4.094 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -12.308 12.389 -5.014 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -10.729 11.653 -5.209 1.00 0.00 H new ATOM 610 N ASP A 39 -14.573 10.709 -7.706 1.00 0.00 N ATOM 611 CA ASP A 39 -15.862 10.535 -8.386 1.00 0.00 C ATOM 612 C ASP A 39 -15.805 11.127 -9.791 1.00 0.00 C ATOM 613 O ASP A 39 -16.501 10.692 -10.707 1.00 0.00 O ATOM 614 CB ASP A 39 -16.995 11.181 -7.584 1.00 0.00 C ATOM 615 CG ASP A 39 -18.319 11.100 -8.366 1.00 0.00 C ATOM 616 OD1 ASP A 39 -18.761 9.968 -8.673 1.00 0.00 O ATOM 617 OD2 ASP A 39 -18.910 12.163 -8.663 1.00 0.00 O ATOM 0 H ASP A 39 -14.566 11.390 -6.946 1.00 0.00 H new ATOM 0 HA ASP A 39 -16.064 9.467 -8.462 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -17.101 10.678 -6.623 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -16.752 12.223 -7.374 1.00 0.00 H new ATOM 622 N GLN A 40 -14.894 12.081 -9.979 1.00 0.00 N ATOM 623 CA GLN A 40 -14.706 12.786 -11.241 1.00 0.00 C ATOM 624 C GLN A 40 -13.690 12.066 -12.126 1.00 0.00 C ATOM 625 O GLN A 40 -13.500 12.437 -13.278 1.00 0.00 O ATOM 626 CB GLN A 40 -14.246 14.203 -10.854 1.00 0.00 C ATOM 627 CG GLN A 40 -14.137 15.186 -12.021 1.00 0.00 C ATOM 628 CD GLN A 40 -14.189 16.640 -11.554 1.00 0.00 C ATOM 629 OE1 GLN A 40 -13.180 17.339 -11.525 1.00 0.00 O ATOM 630 NE2 GLN A 40 -15.363 17.122 -11.182 1.00 0.00 N ATOM 0 H GLN A 40 -14.256 12.389 -9.245 1.00 0.00 H new ATOM 0 HA GLN A 40 -15.622 12.824 -11.831 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -14.943 14.608 -10.121 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -13.274 14.133 -10.365 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -13.204 15.011 -12.556 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -14.948 15.003 -12.726 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -16.191 16.527 -11.212 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -15.440 18.088 -10.865 1.00 0.00 H new ATOM 639 N GLN A 41 -13.054 11.005 -11.641 1.00 0.00 N ATOM 640 CA GLN A 41 -11.911 10.363 -12.259 1.00 0.00 C ATOM 641 C GLN A 41 -12.290 8.912 -12.521 1.00 0.00 C ATOM 642 O GLN A 41 -12.854 8.282 -11.633 1.00 0.00 O ATOM 643 CB GLN A 41 -10.840 10.507 -11.170 1.00 0.00 C ATOM 644 CG GLN A 41 -9.416 10.112 -11.530 1.00 0.00 C ATOM 645 CD GLN A 41 -8.620 9.816 -10.266 1.00 0.00 C ATOM 646 OE1 GLN A 41 -8.063 8.741 -10.155 1.00 0.00 O ATOM 647 NE2 GLN A 41 -8.563 10.697 -9.278 1.00 0.00 N ATOM 0 H GLN A 41 -13.336 10.554 -10.771 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.576 10.774 -13.211 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.829 11.547 -10.845 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -11.149 9.908 -10.313 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.426 9.235 -12.177 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.938 10.915 -12.090 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -9.030 11.599 -9.371 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -8.052 10.473 -8.424 1.00 0.00 H new ATOM 656 N ARG A 42 -11.951 8.338 -13.677 1.00 0.00 N ATOM 657 CA ARG A 42 -12.117 6.887 -13.874 1.00 0.00 C ATOM 658 C ARG A 42 -10.769 6.217 -14.010 1.00 0.00 C ATOM 659 O ARG A 42 -9.793 6.852 -14.399 1.00 0.00 O ATOM 660 CB ARG A 42 -13.018 6.574 -15.089 1.00 0.00 C ATOM 661 CG ARG A 42 -14.292 5.823 -14.698 1.00 0.00 C ATOM 662 CD ARG A 42 -15.520 6.282 -15.491 1.00 0.00 C ATOM 663 NE ARG A 42 -16.771 5.790 -14.863 1.00 0.00 N ATOM 664 CZ ARG A 42 -17.906 5.472 -15.508 1.00 0.00 C ATOM 665 NH1 ARG A 42 -17.880 5.177 -16.793 1.00 0.00 N ATOM 666 NH2 ARG A 42 -19.061 5.437 -14.856 1.00 0.00 N ATOM 0 H ARG A 42 -11.567 8.838 -14.479 1.00 0.00 H new ATOM 0 HA ARG A 42 -12.617 6.485 -12.993 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -13.288 7.506 -15.586 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -12.457 5.979 -15.809 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -14.142 4.755 -14.856 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -14.479 5.964 -13.634 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -15.538 7.371 -15.543 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -15.454 5.915 -16.515 1.00 0.00 H new ATOM 0 HE ARG A 42 -16.769 5.683 -13.849 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -16.996 5.190 -17.301 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -18.744 4.936 -17.279 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -19.091 5.652 -13.859 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -19.919 5.195 -15.351 1.00 0.00 H new ATOM 680 N LEU A 43 -10.764 4.914 -13.747 1.00 0.00 N ATOM 681 CA LEU A 43 -9.583 4.074 -13.807 1.00 0.00 C ATOM 682 C LEU A 43 -9.905 2.929 -14.736 1.00 0.00 C ATOM 683 O LEU A 43 -10.913 2.246 -14.572 1.00 0.00 O ATOM 684 CB LEU A 43 -9.227 3.580 -12.391 1.00 0.00 C ATOM 685 CG LEU A 43 -7.747 3.795 -12.058 1.00 0.00 C ATOM 686 CD1 LEU A 43 -7.353 5.280 -12.104 1.00 0.00 C ATOM 687 CD2 LEU A 43 -7.472 3.281 -10.646 1.00 0.00 C ATOM 0 H LEU A 43 -11.606 4.404 -13.480 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.716 4.618 -14.182 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.842 4.104 -11.660 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -9.466 2.520 -12.307 1.00 0.00 H new ATOM 0 HG LEU A 43 -7.163 3.256 -12.804 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.295 5.384 -11.861 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.536 5.674 -13.104 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -7.948 5.837 -11.380 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.420 3.431 -10.403 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.091 3.826 -9.933 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.709 2.218 -10.593 1.00 0.00 H new ATOM 699 N ILE A 44 -9.058 2.746 -15.730 1.00 0.00 N ATOM 700 CA ILE A 44 -9.129 1.672 -16.718 1.00 0.00 C ATOM 701 C ILE A 44 -7.829 0.895 -16.598 1.00 0.00 C ATOM 702 O ILE A 44 -6.808 1.441 -16.184 1.00 0.00 O ATOM 703 CB ILE A 44 -9.421 2.284 -18.121 1.00 0.00 C ATOM 704 CG1 ILE A 44 -10.845 2.892 -18.068 1.00 0.00 C ATOM 705 CG2 ILE A 44 -9.335 1.307 -19.310 1.00 0.00 C ATOM 706 CD1 ILE A 44 -11.174 3.904 -19.150 1.00 0.00 C ATOM 0 H ILE A 44 -8.263 3.367 -15.883 1.00 0.00 H new ATOM 0 HA ILE A 44 -9.946 0.970 -16.553 1.00 0.00 H new ATOM 0 HB ILE A 44 -8.638 3.018 -18.310 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -11.569 2.079 -18.126 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -10.979 3.370 -17.098 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -9.556 1.839 -20.235 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -8.330 0.887 -19.364 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -10.057 0.502 -19.173 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -12.195 4.262 -19.015 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -10.483 4.744 -19.085 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -11.081 3.433 -20.129 1.00 0.00 H new ATOM 718 N PHE A 45 -7.862 -0.369 -16.987 1.00 0.00 N ATOM 719 CA PHE A 45 -6.685 -1.211 -17.036 1.00 0.00 C ATOM 720 C PHE A 45 -6.815 -2.051 -18.285 1.00 0.00 C ATOM 721 O PHE A 45 -7.809 -2.741 -18.441 1.00 0.00 O ATOM 722 CB PHE A 45 -6.649 -2.104 -15.793 1.00 0.00 C ATOM 723 CG PHE A 45 -5.551 -3.149 -15.805 1.00 0.00 C ATOM 724 CD1 PHE A 45 -4.213 -2.762 -16.010 1.00 0.00 C ATOM 725 CD2 PHE A 45 -5.864 -4.511 -15.647 1.00 0.00 C ATOM 726 CE1 PHE A 45 -3.187 -3.722 -15.988 1.00 0.00 C ATOM 727 CE2 PHE A 45 -4.838 -5.469 -15.593 1.00 0.00 C ATOM 728 CZ PHE A 45 -3.498 -5.072 -15.745 1.00 0.00 C ATOM 0 H PHE A 45 -8.717 -0.841 -17.280 1.00 0.00 H new ATOM 0 HA PHE A 45 -5.766 -0.625 -17.056 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -6.525 -1.475 -14.912 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -7.611 -2.606 -15.693 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -3.974 -1.723 -16.185 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -6.895 -4.821 -15.567 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -2.163 -3.424 -16.157 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -5.079 -6.510 -15.435 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.707 -5.804 -15.675 1.00 0.00 H new ATOM 738 N ALA A 46 -5.845 -1.959 -19.187 1.00 0.00 N ATOM 739 CA ALA A 46 -5.700 -2.852 -20.338 1.00 0.00 C ATOM 740 C ALA A 46 -6.993 -3.098 -21.135 1.00 0.00 C ATOM 741 O ALA A 46 -7.271 -4.203 -21.610 1.00 0.00 O ATOM 742 CB ALA A 46 -5.050 -4.142 -19.832 1.00 0.00 C ATOM 0 H ALA A 46 -5.118 -1.245 -19.140 1.00 0.00 H new ATOM 0 HA ALA A 46 -5.064 -2.367 -21.078 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -4.924 -4.836 -20.663 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -4.076 -3.913 -19.400 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -5.686 -4.596 -19.073 1.00 0.00 H new ATOM 748 N GLY A 47 -7.786 -2.037 -21.258 1.00 0.00 N ATOM 749 CA GLY A 47 -9.010 -2.010 -22.047 1.00 0.00 C ATOM 750 C GLY A 47 -10.261 -2.402 -21.260 1.00 0.00 C ATOM 751 O GLY A 47 -11.290 -2.658 -21.880 1.00 0.00 O ATOM 0 H GLY A 47 -7.588 -1.149 -20.798 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.147 -1.008 -22.453 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.899 -2.686 -22.895 1.00 0.00 H new ATOM 755 N LYS A 48 -10.218 -2.428 -19.919 1.00 0.00 N ATOM 756 CA LYS A 48 -11.402 -2.653 -19.079 1.00 0.00 C ATOM 757 C LYS A 48 -11.424 -1.660 -17.930 1.00 0.00 C ATOM 758 O LYS A 48 -10.400 -1.414 -17.313 1.00 0.00 O ATOM 759 CB LYS A 48 -11.474 -4.134 -18.651 1.00 0.00 C ATOM 760 CG LYS A 48 -10.575 -4.536 -17.465 1.00 0.00 C ATOM 761 CD LYS A 48 -10.393 -6.056 -17.321 1.00 0.00 C ATOM 762 CE LYS A 48 -9.496 -6.627 -18.433 1.00 0.00 C ATOM 763 NZ LYS A 48 -9.280 -8.095 -18.287 1.00 0.00 N ATOM 0 H LYS A 48 -9.359 -2.293 -19.386 1.00 0.00 H new ATOM 0 HA LYS A 48 -12.315 -2.466 -19.645 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -12.507 -4.368 -18.395 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.210 -4.753 -19.508 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -9.597 -4.071 -17.587 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -11.004 -4.140 -16.544 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -9.955 -6.280 -16.348 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -11.367 -6.544 -17.352 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -9.949 -6.423 -19.403 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -8.533 -6.117 -18.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -8.670 -8.435 -19.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -8.823 -8.289 -17.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -10.196 -8.586 -18.328 1.00 0.00 H new ATOM 777 N GLN A 49 -12.550 -1.011 -17.690 1.00 0.00 N ATOM 778 CA GLN A 49 -12.737 -0.095 -16.570 1.00 0.00 C ATOM 779 C GLN A 49 -12.727 -0.895 -15.269 1.00 0.00 C ATOM 780 O GLN A 49 -13.205 -2.030 -15.229 1.00 0.00 O ATOM 781 CB GLN A 49 -14.075 0.636 -16.765 1.00 0.00 C ATOM 782 CG GLN A 49 -14.145 1.969 -16.013 1.00 0.00 C ATOM 783 CD GLN A 49 -15.507 2.620 -16.196 1.00 0.00 C ATOM 784 OE1 GLN A 49 -15.654 3.511 -17.025 1.00 0.00 O ATOM 785 NE2 GLN A 49 -16.513 2.195 -15.449 1.00 0.00 N ATOM 0 H GLN A 49 -13.378 -1.105 -18.278 1.00 0.00 H new ATOM 0 HA GLN A 49 -11.935 0.642 -16.523 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -14.232 0.817 -17.828 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -14.887 -0.008 -16.428 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -13.955 1.804 -14.952 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -13.365 2.638 -16.376 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -16.363 1.452 -14.767 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -17.438 2.610 -15.556 1.00 0.00 H new ATOM 794 N LEU A 50 -12.212 -0.281 -14.202 1.00 0.00 N ATOM 795 CA LEU A 50 -12.275 -0.836 -12.849 1.00 0.00 C ATOM 796 C LEU A 50 -13.454 -0.178 -12.117 1.00 0.00 C ATOM 797 O LEU A 50 -14.135 0.667 -12.703 1.00 0.00 O ATOM 798 CB LEU A 50 -10.931 -0.607 -12.123 1.00 0.00 C ATOM 799 CG LEU A 50 -9.642 -0.829 -12.945 1.00 0.00 C ATOM 800 CD1 LEU A 50 -8.420 -0.806 -12.023 1.00 0.00 C ATOM 801 CD2 LEU A 50 -9.652 -2.130 -13.751 1.00 0.00 C ATOM 0 H LEU A 50 -11.737 0.620 -14.253 1.00 0.00 H new ATOM 0 HA LEU A 50 -12.439 -1.913 -12.874 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -10.920 0.416 -11.746 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -10.898 -1.267 -11.256 1.00 0.00 H new ATOM 0 HG LEU A 50 -9.591 -0.011 -13.664 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -7.517 -0.963 -12.612 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -8.362 0.159 -11.520 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -8.510 -1.598 -11.279 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -8.717 -2.222 -14.304 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -9.758 -2.977 -13.073 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -10.488 -2.118 -14.450 1.00 0.00 H new ATOM 813 N GLU A 51 -13.692 -0.502 -10.840 1.00 0.00 N ATOM 814 CA GLU A 51 -14.640 0.256 -10.020 1.00 0.00 C ATOM 815 C GLU A 51 -14.045 0.466 -8.635 1.00 0.00 C ATOM 816 O GLU A 51 -13.176 -0.290 -8.208 1.00 0.00 O ATOM 817 CB GLU A 51 -16.074 -0.324 -10.051 1.00 0.00 C ATOM 818 CG GLU A 51 -16.300 -1.579 -9.199 1.00 0.00 C ATOM 819 CD GLU A 51 -17.759 -2.085 -9.224 1.00 0.00 C ATOM 820 OE1 GLU A 51 -18.704 -1.274 -9.054 1.00 0.00 O ATOM 821 OE2 GLU A 51 -17.974 -3.316 -9.363 1.00 0.00 O ATOM 0 H GLU A 51 -13.243 -1.280 -10.356 1.00 0.00 H new ATOM 0 HA GLU A 51 -14.786 1.246 -10.453 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -16.767 0.449 -9.718 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -16.330 -0.557 -11.084 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -15.642 -2.373 -9.553 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -16.015 -1.365 -8.169 1.00 0.00 H new ATOM 828 N ASP A 52 -14.502 1.509 -7.943 1.00 0.00 N ATOM 829 CA ASP A 52 -13.919 2.039 -6.707 1.00 0.00 C ATOM 830 C ASP A 52 -13.818 0.995 -5.606 1.00 0.00 C ATOM 831 O ASP A 52 -12.834 0.978 -4.867 1.00 0.00 O ATOM 832 CB ASP A 52 -14.738 3.249 -6.229 1.00 0.00 C ATOM 833 CG ASP A 52 -14.371 4.519 -7.000 1.00 0.00 C ATOM 834 OD1 ASP A 52 -13.189 4.913 -6.978 1.00 0.00 O ATOM 835 OD2 ASP A 52 -15.229 5.095 -7.705 1.00 0.00 O ATOM 0 H ASP A 52 -15.325 2.032 -8.240 1.00 0.00 H new ATOM 0 HA ASP A 52 -12.898 2.347 -6.933 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -15.801 3.042 -6.354 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -14.567 3.407 -5.164 1.00 0.00 H new ATOM 840 N GLY A 53 -14.803 0.098 -5.539 1.00 0.00 N ATOM 841 CA GLY A 53 -14.925 -0.909 -4.497 1.00 0.00 C ATOM 842 C GLY A 53 -14.020 -2.126 -4.692 1.00 0.00 C ATOM 843 O GLY A 53 -14.164 -3.106 -3.962 1.00 0.00 O ATOM 0 H GLY A 53 -15.554 0.055 -6.228 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -14.696 -0.450 -3.535 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -15.961 -1.244 -4.451 1.00 0.00 H new ATOM 847 N ARG A 54 -13.127 -2.108 -5.687 1.00 0.00 N ATOM 848 CA ARG A 54 -12.295 -3.245 -6.068 1.00 0.00 C ATOM 849 C ARG A 54 -10.848 -2.915 -5.790 1.00 0.00 C ATOM 850 O ARG A 54 -10.551 -1.813 -5.352 1.00 0.00 O ATOM 851 CB ARG A 54 -12.524 -3.509 -7.552 1.00 0.00 C ATOM 852 CG ARG A 54 -13.965 -3.830 -7.941 1.00 0.00 C ATOM 853 CD ARG A 54 -14.584 -5.083 -7.324 1.00 0.00 C ATOM 854 NE ARG A 54 -15.847 -5.370 -8.024 1.00 0.00 N ATOM 855 CZ ARG A 54 -15.983 -6.058 -9.166 1.00 0.00 C ATOM 856 NH1 ARG A 54 -14.998 -6.811 -9.653 1.00 0.00 N ATOM 857 NH2 ARG A 54 -17.126 -5.947 -9.830 1.00 0.00 N ATOM 0 H ARG A 54 -12.962 -1.281 -6.261 1.00 0.00 H new ATOM 0 HA ARG A 54 -12.552 -4.137 -5.497 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -12.199 -2.634 -8.115 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -11.888 -4.339 -7.859 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -14.587 -2.976 -7.672 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -14.010 -3.928 -9.026 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -13.900 -5.927 -7.414 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -14.766 -4.932 -6.260 1.00 0.00 H new ATOM 0 HE ARG A 54 -16.701 -5.010 -7.599 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -14.111 -6.875 -9.154 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -15.131 -7.323 -10.525 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -17.870 -5.351 -9.468 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -17.261 -6.458 -10.703 1.00 0.00 H new ATOM 871 N THR A 55 -9.929 -3.826 -6.076 1.00 0.00 N ATOM 872 CA THR A 55 -8.523 -3.631 -5.788 1.00 0.00 C ATOM 873 C THR A 55 -7.687 -3.966 -7.000 1.00 0.00 C ATOM 874 O THR A 55 -8.170 -4.542 -7.973 1.00 0.00 O ATOM 875 CB THR A 55 -8.117 -4.529 -4.620 1.00 0.00 C ATOM 876 OG1 THR A 55 -8.417 -5.875 -4.944 1.00 0.00 O ATOM 877 CG2 THR A 55 -8.785 -4.165 -3.303 1.00 0.00 C ATOM 0 H THR A 55 -10.142 -4.722 -6.515 1.00 0.00 H new ATOM 0 HA THR A 55 -8.355 -2.586 -5.526 1.00 0.00 H new ATOM 0 HB THR A 55 -7.047 -4.385 -4.472 1.00 0.00 H new ATOM 0 HG1 THR A 55 -8.157 -6.456 -4.199 1.00 0.00 H new ATOM 0 HG21 THR A 55 -8.447 -4.847 -2.523 1.00 0.00 H new ATOM 0 HG22 THR A 55 -8.521 -3.143 -3.031 1.00 0.00 H new ATOM 0 HG23 THR A 55 -9.867 -4.244 -3.410 1.00 0.00 H new ATOM 885 N LEU A 56 -6.403 -3.637 -6.923 1.00 0.00 N ATOM 886 CA LEU A 56 -5.465 -3.959 -7.994 1.00 0.00 C ATOM 887 C LEU A 56 -5.417 -5.472 -8.222 1.00 0.00 C ATOM 888 O LEU A 56 -5.554 -5.928 -9.356 1.00 0.00 O ATOM 889 CB LEU A 56 -4.084 -3.353 -7.669 1.00 0.00 C ATOM 890 CG LEU A 56 -4.114 -1.846 -7.382 1.00 0.00 C ATOM 891 CD1 LEU A 56 -2.696 -1.302 -7.248 1.00 0.00 C ATOM 892 CD2 LEU A 56 -4.814 -1.067 -8.503 1.00 0.00 C ATOM 0 H LEU A 56 -5.987 -3.148 -6.131 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.800 -3.517 -8.932 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.667 -3.869 -6.804 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.411 -3.539 -8.506 1.00 0.00 H new ATOM 0 HG LEU A 56 -4.667 -1.714 -6.452 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -2.735 -0.232 -7.045 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -2.188 -1.809 -6.428 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.151 -1.476 -8.176 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -4.814 -0.004 -8.262 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.284 -1.226 -9.442 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.842 -1.417 -8.602 1.00 0.00 H new ATOM 904 N SER A 57 -5.349 -6.250 -7.143 1.00 0.00 N ATOM 905 CA SER A 57 -5.427 -7.703 -7.164 1.00 0.00 C ATOM 906 C SER A 57 -6.744 -8.216 -7.741 1.00 0.00 C ATOM 907 O SER A 57 -6.731 -9.271 -8.374 1.00 0.00 O ATOM 908 CB SER A 57 -5.278 -8.244 -5.743 1.00 0.00 C ATOM 909 OG SER A 57 -3.920 -8.291 -5.373 1.00 0.00 O ATOM 0 H SER A 57 -5.235 -5.871 -6.203 1.00 0.00 H new ATOM 0 HA SER A 57 -4.619 -8.053 -7.807 1.00 0.00 H new ATOM 0 HB2 SER A 57 -5.829 -7.611 -5.047 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.713 -9.241 -5.680 1.00 0.00 H new ATOM 0 HG SER A 57 -3.842 -8.638 -4.460 1.00 0.00 H new ATOM 915 N ASP A 58 -7.864 -7.496 -7.587 1.00 0.00 N ATOM 916 CA ASP A 58 -9.134 -7.944 -8.158 1.00 0.00 C ATOM 917 C ASP A 58 -9.074 -7.951 -9.690 1.00 0.00 C ATOM 918 O ASP A 58 -9.755 -8.746 -10.342 1.00 0.00 O ATOM 919 CB ASP A 58 -10.272 -7.055 -7.673 1.00 0.00 C ATOM 920 CG ASP A 58 -11.627 -7.650 -8.092 1.00 0.00 C ATOM 921 OD1 ASP A 58 -12.015 -8.712 -7.549 1.00 0.00 O ATOM 922 OD2 ASP A 58 -12.337 -7.029 -8.913 1.00 0.00 O ATOM 0 H ASP A 58 -7.913 -6.613 -7.078 1.00 0.00 H new ATOM 0 HA ASP A 58 -9.319 -8.965 -7.823 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -10.230 -6.957 -6.588 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -10.163 -6.053 -8.088 1.00 0.00 H new ATOM 927 N TYR A 59 -8.175 -7.129 -10.240 1.00 0.00 N ATOM 928 CA TYR A 59 -7.855 -7.041 -11.663 1.00 0.00 C ATOM 929 C TYR A 59 -6.495 -7.660 -12.000 1.00 0.00 C ATOM 930 O TYR A 59 -6.016 -7.545 -13.126 1.00 0.00 O ATOM 931 CB TYR A 59 -7.993 -5.582 -12.098 1.00 0.00 C ATOM 932 CG TYR A 59 -9.429 -5.124 -12.012 1.00 0.00 C ATOM 933 CD1 TYR A 59 -10.350 -5.560 -12.984 1.00 0.00 C ATOM 934 CD2 TYR A 59 -9.866 -4.345 -10.920 1.00 0.00 C ATOM 935 CE1 TYR A 59 -11.707 -5.224 -12.873 1.00 0.00 C ATOM 936 CE2 TYR A 59 -11.226 -4.030 -10.795 1.00 0.00 C ATOM 937 CZ TYR A 59 -12.157 -4.460 -11.776 1.00 0.00 C ATOM 938 OH TYR A 59 -13.481 -4.134 -11.709 1.00 0.00 O ATOM 0 H TYR A 59 -7.627 -6.478 -9.677 1.00 0.00 H new ATOM 0 HA TYR A 59 -8.562 -7.640 -12.237 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -7.368 -4.950 -11.467 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -7.632 -5.468 -13.120 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -10.010 -6.156 -13.818 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -9.157 -3.994 -10.185 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -12.408 -5.550 -13.627 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -11.568 -3.456 -9.946 1.00 0.00 H new ATOM 0 HH TYR A 59 -13.937 -4.743 -11.091 1.00 0.00 H new ATOM 948 N ASN A 60 -5.899 -8.368 -11.036 1.00 0.00 N ATOM 949 CA ASN A 60 -4.648 -9.115 -11.120 1.00 0.00 C ATOM 950 C ASN A 60 -3.435 -8.255 -11.500 1.00 0.00 C ATOM 951 O ASN A 60 -2.401 -8.774 -11.932 1.00 0.00 O ATOM 952 CB ASN A 60 -4.820 -10.366 -12.002 1.00 0.00 C ATOM 953 CG ASN A 60 -4.017 -11.527 -11.435 1.00 0.00 C ATOM 954 OD1 ASN A 60 -2.997 -11.944 -11.979 1.00 0.00 O ATOM 955 ND2 ASN A 60 -4.472 -12.063 -10.309 1.00 0.00 N ATOM 0 H ASN A 60 -6.314 -8.437 -10.107 1.00 0.00 H new ATOM 0 HA ASN A 60 -4.412 -9.458 -10.113 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -5.874 -10.637 -12.058 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -4.492 -10.150 -13.019 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -3.972 -12.839 -9.875 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -5.321 -11.698 -9.877 1.00 0.00 H new ATOM 962 N ILE A 61 -3.557 -6.944 -11.317 1.00 0.00 N ATOM 963 CA ILE A 61 -2.477 -5.972 -11.403 1.00 0.00 C ATOM 964 C ILE A 61 -1.497 -6.302 -10.270 1.00 0.00 C ATOM 965 O ILE A 61 -1.911 -6.656 -9.161 1.00 0.00 O ATOM 966 CB ILE A 61 -3.106 -4.575 -11.236 1.00 0.00 C ATOM 967 CG1 ILE A 61 -4.067 -4.225 -12.394 1.00 0.00 C ATOM 968 CG2 ILE A 61 -2.064 -3.451 -11.075 1.00 0.00 C ATOM 969 CD1 ILE A 61 -5.145 -3.247 -11.932 1.00 0.00 C ATOM 0 H ILE A 61 -4.454 -6.512 -11.094 1.00 0.00 H new ATOM 0 HA ILE A 61 -1.941 -5.997 -12.352 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.675 -4.636 -10.308 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -3.504 -3.789 -13.219 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.534 -5.135 -12.772 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.575 -2.495 -10.962 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.455 -3.643 -10.192 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -1.424 -3.419 -11.957 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.809 -3.017 -12.765 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -5.721 -3.696 -11.123 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.676 -2.329 -11.577 1.00 0.00 H new ATOM 981 N GLN A 62 -0.207 -6.130 -10.543 1.00 0.00 N ATOM 982 CA GLN A 62 0.881 -6.352 -9.600 1.00 0.00 C ATOM 983 C GLN A 62 1.721 -5.071 -9.550 1.00 0.00 C ATOM 984 O GLN A 62 1.297 -4.023 -10.036 1.00 0.00 O ATOM 985 CB GLN A 62 1.690 -7.587 -10.055 1.00 0.00 C ATOM 986 CG GLN A 62 0.830 -8.856 -10.155 1.00 0.00 C ATOM 987 CD GLN A 62 1.612 -10.061 -10.694 1.00 0.00 C ATOM 988 OE1 GLN A 62 2.703 -10.385 -10.227 1.00 0.00 O ATOM 989 NE2 GLN A 62 1.074 -10.744 -11.696 1.00 0.00 N ATOM 0 H GLN A 62 0.119 -5.822 -11.459 1.00 0.00 H new ATOM 0 HA GLN A 62 0.521 -6.561 -8.593 1.00 0.00 H new ATOM 0 HB2 GLN A 62 2.142 -7.382 -11.025 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.506 -7.760 -9.353 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.431 -9.098 -9.170 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -0.023 -8.661 -10.805 1.00 0.00 H new ATOM 0 HE21 GLN A 62 0.169 -10.466 -12.075 1.00 0.00 H new ATOM 0 HE22 GLN A 62 1.566 -11.547 -12.088 1.00 0.00 H new ATOM 998 N LYS A 63 2.902 -5.119 -8.936 1.00 0.00 N ATOM 999 CA LYS A 63 3.889 -4.057 -8.977 1.00 0.00 C ATOM 1000 C LYS A 63 4.295 -3.742 -10.404 1.00 0.00 C ATOM 1001 O LYS A 63 4.100 -4.555 -11.309 1.00 0.00 O ATOM 1002 CB LYS A 63 5.103 -4.538 -8.182 1.00 0.00 C ATOM 1003 CG LYS A 63 5.776 -5.741 -8.864 1.00 0.00 C ATOM 1004 CD LYS A 63 6.588 -6.586 -7.885 1.00 0.00 C ATOM 1005 CE LYS A 63 5.733 -7.511 -7.000 1.00 0.00 C ATOM 1006 NZ LYS A 63 6.570 -8.362 -6.108 1.00 0.00 N ATOM 0 H LYS A 63 3.201 -5.922 -8.383 1.00 0.00 H new ATOM 0 HA LYS A 63 3.474 -3.144 -8.550 1.00 0.00 H new ATOM 0 HB2 LYS A 63 5.821 -3.724 -8.083 1.00 0.00 H new ATOM 0 HB3 LYS A 63 4.794 -4.815 -7.174 1.00 0.00 H new ATOM 0 HG2 LYS A 63 5.013 -6.364 -9.331 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.429 -5.385 -9.661 1.00 0.00 H new ATOM 0 HD2 LYS A 63 7.299 -7.192 -8.447 1.00 0.00 H new ATOM 0 HD3 LYS A 63 7.170 -5.923 -7.245 1.00 0.00 H new ATOM 0 HE2 LYS A 63 5.055 -6.909 -6.395 1.00 0.00 H new ATOM 0 HE3 LYS A 63 5.115 -8.148 -7.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 5.955 -8.969 -5.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.199 -8.956 -6.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.141 -7.756 -5.486 1.00 0.00 H new ATOM 1020 N GLU A 64 4.922 -2.577 -10.537 1.00 0.00 N ATOM 1021 CA GLU A 64 5.513 -2.048 -11.751 1.00 0.00 C ATOM 1022 C GLU A 64 4.603 -2.334 -12.955 1.00 0.00 C ATOM 1023 O GLU A 64 5.027 -2.815 -14.006 1.00 0.00 O ATOM 1024 CB GLU A 64 7.007 -2.442 -11.840 1.00 0.00 C ATOM 1025 CG GLU A 64 7.356 -3.854 -12.316 1.00 0.00 C ATOM 1026 CD GLU A 64 8.827 -4.197 -12.013 1.00 0.00 C ATOM 1027 OE1 GLU A 64 9.720 -3.813 -12.806 1.00 0.00 O ATOM 1028 OE2 GLU A 64 9.107 -4.871 -10.993 1.00 0.00 O ATOM 0 H GLU A 64 5.035 -1.941 -9.747 1.00 0.00 H new ATOM 0 HA GLU A 64 5.560 -0.959 -11.745 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.499 -1.735 -12.508 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.447 -2.306 -10.852 1.00 0.00 H new ATOM 0 HG2 GLU A 64 6.703 -4.577 -11.827 1.00 0.00 H new ATOM 0 HG3 GLU A 64 7.175 -3.934 -13.388 1.00 0.00 H new ATOM 1035 N SER A 65 3.309 -2.063 -12.751 1.00 0.00 N ATOM 1036 CA SER A 65 2.263 -2.384 -13.725 1.00 0.00 C ATOM 1037 C SER A 65 1.547 -1.099 -14.099 1.00 0.00 C ATOM 1038 O SER A 65 1.478 -0.174 -13.292 1.00 0.00 O ATOM 1039 CB SER A 65 1.292 -3.430 -13.166 1.00 0.00 C ATOM 1040 OG SER A 65 1.921 -4.683 -12.971 1.00 0.00 O ATOM 0 H SER A 65 2.959 -1.614 -11.905 1.00 0.00 H new ATOM 0 HA SER A 65 2.709 -2.821 -14.618 1.00 0.00 H new ATOM 0 HB2 SER A 65 0.884 -3.077 -12.219 1.00 0.00 H new ATOM 0 HB3 SER A 65 0.452 -3.548 -13.850 1.00 0.00 H new ATOM 0 HG SER A 65 2.660 -4.583 -12.336 1.00 0.00 H new ATOM 1046 N THR A 66 1.018 -1.043 -15.315 1.00 0.00 N ATOM 1047 CA THR A 66 0.498 0.184 -15.897 1.00 0.00 C ATOM 1048 C THR A 66 -1.022 0.174 -15.834 1.00 0.00 C ATOM 1049 O THR A 66 -1.663 -0.860 -15.975 1.00 0.00 O ATOM 1050 CB THR A 66 1.028 0.365 -17.340 1.00 0.00 C ATOM 1051 OG1 THR A 66 2.435 0.181 -17.351 1.00 0.00 O ATOM 1052 CG2 THR A 66 0.709 1.734 -17.967 1.00 0.00 C ATOM 0 H THR A 66 0.938 -1.854 -15.928 1.00 0.00 H new ATOM 0 HA THR A 66 0.848 1.042 -15.323 1.00 0.00 H new ATOM 0 HB THR A 66 0.513 -0.384 -17.942 1.00 0.00 H new ATOM 0 HG1 THR A 66 2.773 0.294 -18.264 1.00 0.00 H new ATOM 0 HG21 THR A 66 1.116 1.775 -18.977 1.00 0.00 H new ATOM 0 HG22 THR A 66 -0.371 1.874 -18.005 1.00 0.00 H new ATOM 0 HG23 THR A 66 1.156 2.524 -17.363 1.00 0.00 H new ATOM 1060 N LEU A 67 -1.587 1.362 -15.644 1.00 0.00 N ATOM 1061 CA LEU A 67 -3.004 1.659 -15.554 1.00 0.00 C ATOM 1062 C LEU A 67 -3.334 2.799 -16.509 1.00 0.00 C ATOM 1063 O LEU A 67 -2.432 3.394 -17.087 1.00 0.00 O ATOM 1064 CB LEU A 67 -3.285 2.065 -14.096 1.00 0.00 C ATOM 1065 CG LEU A 67 -4.423 1.298 -13.448 1.00 0.00 C ATOM 1066 CD1 LEU A 67 -4.072 -0.179 -13.298 1.00 0.00 C ATOM 1067 CD2 LEU A 67 -4.689 1.868 -12.061 1.00 0.00 C ATOM 0 H LEU A 67 -1.019 2.203 -15.542 1.00 0.00 H new ATOM 0 HA LEU A 67 -3.618 0.801 -15.828 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.379 1.916 -13.508 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -3.514 3.130 -14.064 1.00 0.00 H new ATOM 0 HG LEU A 67 -5.303 1.395 -14.084 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.905 -0.705 -12.831 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.877 -0.608 -14.281 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -3.183 -0.280 -12.675 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.506 1.319 -11.593 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.791 1.773 -11.450 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.960 2.920 -12.146 1.00 0.00 H new ATOM 1079 N HIS A 68 -4.612 3.156 -16.616 1.00 0.00 N ATOM 1080 CA HIS A 68 -5.083 4.257 -17.462 1.00 0.00 C ATOM 1081 C HIS A 68 -5.957 5.179 -16.606 1.00 0.00 C ATOM 1082 O HIS A 68 -6.745 4.660 -15.811 1.00 0.00 O ATOM 1083 CB HIS A 68 -5.889 3.671 -18.634 1.00 0.00 C ATOM 1084 CG HIS A 68 -5.104 3.336 -19.879 1.00 0.00 C ATOM 1085 ND1 HIS A 68 -4.309 2.234 -20.125 1.00 0.00 N ATOM 1086 CD2 HIS A 68 -5.200 4.016 -21.057 1.00 0.00 C ATOM 1087 CE1 HIS A 68 -3.943 2.261 -21.424 1.00 0.00 C ATOM 1088 NE2 HIS A 68 -4.455 3.343 -22.024 1.00 0.00 N ATOM 0 H HIS A 68 -5.362 2.684 -16.112 1.00 0.00 H new ATOM 0 HA HIS A 68 -4.248 4.829 -17.866 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -6.387 2.765 -18.289 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -6.670 4.382 -18.902 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -4.044 1.523 -19.443 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -5.761 4.926 -21.215 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -3.327 1.518 -21.909 1.00 0.00 H new ATOM 1095 N LEU A 69 -5.885 6.507 -16.761 1.00 0.00 N ATOM 1096 CA LEU A 69 -6.655 7.462 -15.972 1.00 0.00 C ATOM 1097 C LEU A 69 -7.487 8.237 -16.964 1.00 0.00 C ATOM 1098 O LEU A 69 -6.920 8.688 -17.957 1.00 0.00 O ATOM 1099 CB LEU A 69 -5.642 8.419 -15.331 1.00 0.00 C ATOM 1100 CG LEU A 69 -6.077 9.369 -14.227 1.00 0.00 C ATOM 1101 CD1 LEU A 69 -6.843 10.593 -14.722 1.00 0.00 C ATOM 1102 CD2 LEU A 69 -6.840 8.611 -13.155 1.00 0.00 C ATOM 0 H LEU A 69 -5.278 6.950 -17.451 1.00 0.00 H new ATOM 0 HA LEU A 69 -7.276 6.991 -15.210 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -4.831 7.810 -14.932 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -5.220 9.026 -16.132 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.166 9.778 -13.790 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.117 11.219 -13.873 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -6.214 11.164 -15.406 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.746 10.272 -15.242 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -7.147 9.302 -12.369 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -7.723 8.148 -13.596 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -6.199 7.839 -12.729 1.00 0.00 H new ATOM 1114 N VAL A 70 -8.772 8.442 -16.699 1.00 0.00 N ATOM 1115 CA VAL A 70 -9.602 9.314 -17.530 1.00 0.00 C ATOM 1116 C VAL A 70 -10.356 10.275 -16.633 1.00 0.00 C ATOM 1117 O VAL A 70 -10.496 10.047 -15.433 1.00 0.00 O ATOM 1118 CB VAL A 70 -10.532 8.504 -18.464 1.00 0.00 C ATOM 1119 CG1 VAL A 70 -9.838 7.284 -19.074 1.00 0.00 C ATOM 1120 CG2 VAL A 70 -11.794 7.945 -17.812 1.00 0.00 C ATOM 0 H VAL A 70 -9.265 8.016 -15.914 1.00 0.00 H new ATOM 0 HA VAL A 70 -8.965 9.896 -18.197 1.00 0.00 H new ATOM 0 HB VAL A 70 -10.800 9.256 -19.207 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -10.537 6.753 -19.720 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -8.978 7.609 -19.659 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -9.504 6.619 -18.277 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -12.374 7.395 -18.554 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -11.517 7.275 -16.998 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -12.394 8.765 -17.418 1.00 0.00 H new ATOM 1130 N LEU A 71 -10.911 11.308 -17.245 1.00 0.00 N ATOM 1131 CA LEU A 71 -11.731 12.297 -16.582 1.00 0.00 C ATOM 1132 C LEU A 71 -13.149 11.994 -16.986 1.00 0.00 C ATOM 1133 O LEU A 71 -13.437 11.893 -18.174 1.00 0.00 O ATOM 1134 CB LEU A 71 -11.320 13.667 -17.130 1.00 0.00 C ATOM 1135 CG LEU A 71 -11.807 14.926 -16.409 1.00 0.00 C ATOM 1136 CD1 LEU A 71 -13.046 15.462 -17.131 1.00 0.00 C ATOM 1137 CD2 LEU A 71 -12.111 14.756 -14.921 1.00 0.00 C ATOM 0 H LEU A 71 -10.798 11.483 -18.244 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.624 12.288 -15.497 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.231 13.700 -17.153 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -11.662 13.725 -18.163 1.00 0.00 H new ATOM 0 HG LEU A 71 -10.975 15.630 -16.446 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -13.402 16.360 -16.625 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -12.790 15.704 -18.163 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -13.830 14.705 -17.120 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -12.448 15.707 -14.508 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -12.892 14.007 -14.793 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -11.210 14.433 -14.400 1.00 0.00 H new ATOM 1149 N ARG A 72 -14.034 11.914 -16.007 1.00 0.00 N ATOM 1150 CA ARG A 72 -15.424 11.527 -16.209 1.00 0.00 C ATOM 1151 C ARG A 72 -16.404 12.603 -15.771 1.00 0.00 C ATOM 1152 O ARG A 72 -17.560 12.296 -15.540 1.00 0.00 O ATOM 1153 CB ARG A 72 -15.669 10.111 -15.632 1.00 0.00 C ATOM 1154 CG ARG A 72 -16.090 10.012 -14.143 1.00 0.00 C ATOM 1155 CD ARG A 72 -17.533 9.486 -14.056 1.00 0.00 C ATOM 1156 NE ARG A 72 -18.075 9.433 -12.680 1.00 0.00 N ATOM 1157 CZ ARG A 72 -19.280 8.952 -12.345 1.00 0.00 C ATOM 1158 NH1 ARG A 72 -20.091 8.458 -13.277 1.00 0.00 N ATOM 1159 NH2 ARG A 72 -19.690 8.975 -11.085 1.00 0.00 N ATOM 0 H ARG A 72 -13.806 12.119 -15.034 1.00 0.00 H new ATOM 0 HA ARG A 72 -15.626 11.448 -17.277 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -16.441 9.631 -16.233 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -14.756 9.531 -15.763 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -15.415 9.346 -13.606 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -16.018 10.990 -13.667 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -18.177 10.121 -14.664 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -17.571 8.486 -14.489 1.00 0.00 H new ATOM 0 HE ARG A 72 -17.486 9.790 -11.928 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -19.797 8.444 -14.254 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -21.007 8.093 -13.015 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -19.086 9.361 -10.359 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -20.609 8.606 -10.841 1.00 0.00 H new ATOM 1173 N LEU A 73 -15.957 13.859 -15.675 1.00 0.00 N ATOM 1174 CA LEU A 73 -16.794 15.066 -15.484 1.00 0.00 C ATOM 1175 C LEU A 73 -17.607 15.201 -14.186 1.00 0.00 C ATOM 1176 O LEU A 73 -17.813 16.337 -13.758 1.00 0.00 O ATOM 1177 CB LEU A 73 -17.788 15.232 -16.665 1.00 0.00 C ATOM 1178 CG LEU A 73 -17.217 15.376 -18.079 1.00 0.00 C ATOM 1179 CD1 LEU A 73 -16.284 16.582 -18.149 1.00 0.00 C ATOM 1180 CD2 LEU A 73 -16.650 14.051 -18.632 1.00 0.00 C ATOM 0 H LEU A 73 -14.963 14.080 -15.729 1.00 0.00 H new ATOM 0 HA LEU A 73 -16.035 15.846 -15.427 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -18.455 14.370 -16.662 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -18.401 16.110 -16.463 1.00 0.00 H new ATOM 0 HG LEU A 73 -18.028 15.593 -18.774 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -15.884 16.674 -19.159 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -16.838 17.486 -17.894 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -15.463 16.448 -17.444 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -16.259 14.214 -19.637 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -15.848 13.700 -17.983 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -17.442 13.303 -18.667 1.00 0.00 H new ATOM 1192 N ARG A 74 -18.124 14.123 -13.588 1.00 0.00 N ATOM 1193 CA ARG A 74 -19.084 14.208 -12.479 1.00 0.00 C ATOM 1194 C ARG A 74 -18.429 14.785 -11.223 1.00 0.00 C ATOM 1195 O ARG A 74 -17.209 14.931 -11.169 1.00 0.00 O ATOM 1196 CB ARG A 74 -19.721 12.831 -12.204 1.00 0.00 C ATOM 1197 CG ARG A 74 -20.390 12.146 -13.419 1.00 0.00 C ATOM 1198 CD ARG A 74 -21.233 13.026 -14.350 1.00 0.00 C ATOM 1199 NE ARG A 74 -22.369 13.664 -13.665 1.00 0.00 N ATOM 1200 CZ ARG A 74 -23.289 14.442 -14.258 1.00 0.00 C ATOM 1201 NH1 ARG A 74 -23.248 14.668 -15.570 1.00 0.00 N ATOM 1202 NH2 ARG A 74 -24.249 15.004 -13.529 1.00 0.00 N ATOM 0 H ARG A 74 -17.890 13.167 -13.857 1.00 0.00 H new ATOM 0 HA ARG A 74 -19.881 14.892 -12.771 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -18.950 12.166 -11.814 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -20.468 12.947 -11.419 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -19.607 11.679 -14.016 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -21.027 11.344 -13.045 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -20.598 13.798 -14.785 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -21.607 12.419 -15.174 1.00 0.00 H new ATOM 0 HE ARG A 74 -22.465 13.503 -12.662 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -22.511 14.248 -16.137 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -23.953 15.261 -16.008 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -24.285 14.844 -12.522 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -24.949 15.595 -13.977 1.00 0.00 H new ATOM 1216 N GLY A 75 -19.222 15.117 -10.212 1.00 0.00 N ATOM 1217 CA GLY A 75 -18.728 15.663 -8.952 1.00 0.00 C ATOM 1218 C GLY A 75 -19.828 15.622 -7.888 1.00 0.00 C ATOM 1219 O GLY A 75 -20.041 16.613 -7.182 1.00 0.00 O ATOM 0 H GLY A 75 -20.236 15.014 -10.243 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -17.864 15.091 -8.614 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -18.393 16.690 -9.099 1.00 0.00 H new ATOM 1223 N GLY A 76 -20.574 14.518 -7.825 1.00 0.00 N ATOM 1224 CA GLY A 76 -21.723 14.350 -6.953 1.00 0.00 C ATOM 1225 C GLY A 76 -22.355 12.995 -7.239 1.00 0.00 C ATOM 1226 O GLY A 76 -22.868 12.817 -8.367 1.00 0.00 O ATOM 1227 OXT GLY A 76 -22.331 12.119 -6.345 1.00 0.00 O ATOM 0 H GLY A 76 -20.385 13.696 -8.398 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -21.418 14.412 -5.908 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -22.446 15.148 -7.122 1.00 0.00 H new TER 1231 GLY A 76 ATOM 1232 N GLY B -3 -12.655 27.122 -20.663 1.00 0.00 N ATOM 1233 CA GLY B -3 -13.162 25.730 -20.698 1.00 0.00 C ATOM 1234 C GLY B -3 -12.261 24.777 -19.911 1.00 0.00 C ATOM 1235 O GLY B -3 -11.040 24.950 -19.883 1.00 0.00 O ATOM 0 H1 GLY B -3 -12.683 27.526 -21.621 1.00 0.00 H new ATOM 0 H2 GLY B -3 -13.250 27.692 -20.029 1.00 0.00 H new ATOM 0 H3 GLY B -3 -11.675 27.126 -20.314 1.00 0.00 H new ATOM 0 HA2 GLY B -3 -14.171 25.700 -20.286 1.00 0.00 H new ATOM 0 HA3 GLY B -3 -13.230 25.394 -21.733 1.00 0.00 H new ATOM 1241 N HIS B -2 -12.856 23.762 -19.267 1.00 0.00 N ATOM 1242 CA HIS B -2 -12.170 22.878 -18.310 1.00 0.00 C ATOM 1243 C HIS B -2 -12.479 21.397 -18.582 1.00 0.00 C ATOM 1244 O HIS B -2 -12.325 20.553 -17.699 1.00 0.00 O ATOM 1245 CB HIS B -2 -12.553 23.298 -16.877 1.00 0.00 C ATOM 1246 CG HIS B -2 -12.287 24.753 -16.570 1.00 0.00 C ATOM 1247 ND1 HIS B -2 -11.055 25.353 -16.422 1.00 0.00 N ATOM 1248 CD2 HIS B -2 -13.232 25.730 -16.412 1.00 0.00 C ATOM 1249 CE1 HIS B -2 -11.250 26.661 -16.185 1.00 0.00 C ATOM 1250 NE2 HIS B -2 -12.568 26.946 -16.171 1.00 0.00 N ATOM 0 H HIS B -2 -13.840 23.528 -19.397 1.00 0.00 H new ATOM 0 HA HIS B -2 -11.092 22.985 -18.431 1.00 0.00 H new ATOM 0 HB2 HIS B -2 -13.612 23.092 -16.720 1.00 0.00 H new ATOM 0 HB3 HIS B -2 -12.000 22.681 -16.169 1.00 0.00 H new ATOM 0 HD2 HIS B -2 -14.302 25.591 -16.463 1.00 0.00 H new ATOM 0 HE1 HIS B -2 -10.462 27.383 -16.028 1.00 0.00 H new ATOM 0 HE2 HIS B -2 -12.997 27.859 -16.017 1.00 0.00 H new ATOM 1257 N MET B -1 -12.925 21.071 -19.802 1.00 0.00 N ATOM 1258 CA MET B -1 -13.314 19.724 -20.226 1.00 0.00 C ATOM 1259 C MET B -1 -12.462 19.375 -21.450 1.00 0.00 C ATOM 1260 O MET B -1 -12.207 20.247 -22.286 1.00 0.00 O ATOM 1261 CB MET B -1 -14.829 19.667 -20.505 1.00 0.00 C ATOM 1262 CG MET B -1 -15.663 19.815 -19.220 1.00 0.00 C ATOM 1263 SD MET B -1 -15.851 21.499 -18.562 1.00 0.00 S ATOM 1264 CE MET B -1 -16.069 21.129 -16.801 1.00 0.00 C ATOM 0 H MET B -1 -13.028 21.763 -20.545 1.00 0.00 H new ATOM 0 HA MET B -1 -13.132 18.985 -19.446 1.00 0.00 H new ATOM 0 HB2 MET B -1 -15.098 20.459 -21.204 1.00 0.00 H new ATOM 0 HB3 MET B -1 -15.073 18.720 -20.987 1.00 0.00 H new ATOM 0 HG2 MET B -1 -16.657 19.411 -19.410 1.00 0.00 H new ATOM 0 HG3 MET B -1 -15.210 19.195 -18.446 1.00 0.00 H new ATOM 0 HE1 MET B -1 -16.425 22.020 -16.283 1.00 0.00 H new ATOM 0 HE2 MET B -1 -16.797 20.326 -16.685 1.00 0.00 H new ATOM 0 HE3 MET B -1 -15.116 20.818 -16.374 1.00 0.00 H new ATOM 1274 N PHE B 679 -12.020 18.109 -21.540 1.00 0.00 N ATOM 1275 CA PHE B 679 -11.002 17.664 -22.505 1.00 0.00 C ATOM 1276 C PHE B 679 -9.792 18.632 -22.509 1.00 0.00 C ATOM 1277 O PHE B 679 -9.425 19.197 -23.543 1.00 0.00 O ATOM 1278 CB PHE B 679 -11.656 17.348 -23.854 1.00 0.00 C ATOM 1279 CG PHE B 679 -10.739 16.830 -24.945 1.00 0.00 C ATOM 1280 CD1 PHE B 679 -10.280 15.505 -24.896 1.00 0.00 C ATOM 1281 CD2 PHE B 679 -10.381 17.646 -26.036 1.00 0.00 C ATOM 1282 CE1 PHE B 679 -9.506 14.978 -25.947 1.00 0.00 C ATOM 1283 CE2 PHE B 679 -9.585 17.131 -27.075 1.00 0.00 C ATOM 1284 CZ PHE B 679 -9.155 15.791 -27.036 1.00 0.00 C ATOM 0 H PHE B 679 -12.363 17.360 -20.939 1.00 0.00 H new ATOM 0 HA PHE B 679 -10.557 16.715 -22.206 1.00 0.00 H new ATOM 0 HB2 PHE B 679 -12.440 16.610 -23.688 1.00 0.00 H new ATOM 0 HB3 PHE B 679 -12.142 18.253 -24.218 1.00 0.00 H new ATOM 0 HD1 PHE B 679 -10.522 14.885 -24.046 1.00 0.00 H new ATOM 0 HD2 PHE B 679 -10.719 18.671 -26.075 1.00 0.00 H new ATOM 0 HE1 PHE B 679 -9.182 13.948 -25.915 1.00 0.00 H new ATOM 0 HE2 PHE B 679 -9.303 17.764 -27.903 1.00 0.00 H new ATOM 0 HZ PHE B 679 -8.557 15.390 -27.841 1.00 0.00 H new ATOM 1294 N PRO B 680 -9.193 18.879 -21.322 1.00 0.00 N ATOM 1295 CA PRO B 680 -7.997 19.706 -21.184 1.00 0.00 C ATOM 1296 C PRO B 680 -6.759 18.939 -21.681 1.00 0.00 C ATOM 1297 O PRO B 680 -6.849 17.811 -22.168 1.00 0.00 O ATOM 1298 CB PRO B 680 -7.922 19.980 -19.674 1.00 0.00 C ATOM 1299 CG PRO B 680 -8.396 18.648 -19.099 1.00 0.00 C ATOM 1300 CD PRO B 680 -9.545 18.306 -20.023 1.00 0.00 C ATOM 0 HA PRO B 680 -8.033 20.624 -21.770 1.00 0.00 H new ATOM 0 HB2 PRO B 680 -6.911 20.229 -19.352 1.00 0.00 H new ATOM 0 HB3 PRO B 680 -8.565 20.808 -19.375 1.00 0.00 H new ATOM 0 HG2 PRO B 680 -7.613 17.890 -19.122 1.00 0.00 H new ATOM 0 HG3 PRO B 680 -8.719 18.741 -18.062 1.00 0.00 H new ATOM 0 HD2 PRO B 680 -9.681 17.227 -20.095 1.00 0.00 H new ATOM 0 HD3 PRO B 680 -10.482 18.722 -19.653 1.00 0.00 H new ATOM 1308 N SER B 681 -5.575 19.497 -21.416 1.00 0.00 N ATOM 1309 CA SER B 681 -4.253 18.891 -21.581 1.00 0.00 C ATOM 1310 C SER B 681 -4.029 17.618 -20.728 1.00 0.00 C ATOM 1311 O SER B 681 -2.890 17.201 -20.535 1.00 0.00 O ATOM 1312 CB SER B 681 -3.196 19.964 -21.269 1.00 0.00 C ATOM 1313 OG SER B 681 -3.527 21.209 -21.882 1.00 0.00 O ATOM 0 H SER B 681 -5.511 20.449 -21.056 1.00 0.00 H new ATOM 0 HA SER B 681 -4.168 18.546 -22.612 1.00 0.00 H new ATOM 0 HB2 SER B 681 -3.117 20.097 -20.190 1.00 0.00 H new ATOM 0 HB3 SER B 681 -2.220 19.630 -21.622 1.00 0.00 H new ATOM 0 HG SER B 681 -2.839 21.873 -21.666 1.00 0.00 H new ATOM 1319 N ASP B 682 -5.086 16.997 -20.190 1.00 0.00 N ATOM 1320 CA ASP B 682 -5.069 15.680 -19.543 1.00 0.00 C ATOM 1321 C ASP B 682 -5.439 14.567 -20.514 1.00 0.00 C ATOM 1322 O ASP B 682 -5.398 13.400 -20.134 1.00 0.00 O ATOM 1323 CB ASP B 682 -6.057 15.646 -18.384 1.00 0.00 C ATOM 1324 CG ASP B 682 -5.928 14.371 -17.525 1.00 0.00 C ATOM 1325 OD1 ASP B 682 -4.803 14.075 -17.054 1.00 0.00 O ATOM 1326 OD2 ASP B 682 -6.966 13.713 -17.270 1.00 0.00 O ATOM 0 H ASP B 682 -6.016 17.417 -20.194 1.00 0.00 H new ATOM 0 HA ASP B 682 -4.052 15.518 -19.185 1.00 0.00 H new ATOM 0 HB2 ASP B 682 -5.900 16.521 -17.753 1.00 0.00 H new ATOM 0 HB3 ASP B 682 -7.072 15.713 -18.776 1.00 0.00 H new ATOM 1331 N ILE B 683 -5.742 14.893 -21.772 1.00 0.00 N ATOM 1332 CA ILE B 683 -6.225 13.928 -22.738 1.00 0.00 C ATOM 1333 C ILE B 683 -5.496 14.143 -24.077 1.00 0.00 C ATOM 1334 O ILE B 683 -5.204 15.280 -24.457 1.00 0.00 O ATOM 1335 CB ILE B 683 -7.756 14.056 -22.897 1.00 0.00 C ATOM 1336 CG1 ILE B 683 -8.600 14.588 -21.700 1.00 0.00 C ATOM 1337 CG2 ILE B 683 -8.309 12.702 -23.287 1.00 0.00 C ATOM 1338 CD1 ILE B 683 -8.779 13.711 -20.459 1.00 0.00 C ATOM 0 H ILE B 683 -5.656 15.840 -22.142 1.00 0.00 H new ATOM 0 HA ILE B 683 -6.015 12.916 -22.390 1.00 0.00 H new ATOM 0 HB ILE B 683 -7.859 14.837 -23.650 1.00 0.00 H new ATOM 0 HG12 ILE B 683 -8.152 15.527 -21.375 1.00 0.00 H new ATOM 0 HG13 ILE B 683 -9.594 14.824 -22.080 1.00 0.00 H new ATOM 0 HG21 ILE B 683 -9.390 12.771 -23.404 1.00 0.00 H new ATOM 0 HG22 ILE B 683 -7.861 12.384 -24.228 1.00 0.00 H new ATOM 0 HG23 ILE B 683 -8.074 11.975 -22.509 1.00 0.00 H new ATOM 0 HD11 ILE B 683 -9.393 14.237 -19.727 1.00 0.00 H new ATOM 0 HD12 ILE B 683 -9.268 12.778 -20.740 1.00 0.00 H new ATOM 0 HD13 ILE B 683 -7.804 13.492 -20.024 1.00 0.00 H new ATOM 1350 N ASP B 684 -5.200 13.045 -24.776 1.00 0.00 N ATOM 1351 CA ASP B 684 -4.461 12.981 -26.039 1.00 0.00 C ATOM 1352 C ASP B 684 -4.955 11.748 -26.808 1.00 0.00 C ATOM 1353 O ASP B 684 -5.162 10.705 -26.175 1.00 0.00 O ATOM 1354 CB ASP B 684 -2.952 12.840 -25.786 1.00 0.00 C ATOM 1355 CG ASP B 684 -2.179 12.683 -27.103 1.00 0.00 C ATOM 1356 OD1 ASP B 684 -2.044 11.535 -27.588 1.00 0.00 O ATOM 1357 OD2 ASP B 684 -1.694 13.706 -27.643 1.00 0.00 O ATOM 0 H ASP B 684 -5.487 12.120 -24.456 1.00 0.00 H new ATOM 0 HA ASP B 684 -4.629 13.897 -26.605 1.00 0.00 H new ATOM 0 HB2 ASP B 684 -2.587 13.716 -25.250 1.00 0.00 H new ATOM 0 HB3 ASP B 684 -2.767 11.976 -25.148 1.00 0.00 H new ATOM 1362 N PRO B 685 -5.163 11.831 -28.140 1.00 0.00 N ATOM 1363 CA PRO B 685 -5.659 10.731 -28.964 1.00 0.00 C ATOM 1364 C PRO B 685 -4.988 9.375 -28.734 1.00 0.00 C ATOM 1365 O PRO B 685 -5.687 8.369 -28.780 1.00 0.00 O ATOM 1366 CB PRO B 685 -5.489 11.191 -30.415 1.00 0.00 C ATOM 1367 CG PRO B 685 -5.687 12.698 -30.305 1.00 0.00 C ATOM 1368 CD PRO B 685 -5.045 13.032 -28.962 1.00 0.00 C ATOM 0 HA PRO B 685 -6.696 10.536 -28.692 1.00 0.00 H new ATOM 0 HB2 PRO B 685 -4.505 10.938 -30.809 1.00 0.00 H new ATOM 0 HB3 PRO B 685 -6.224 10.732 -31.076 1.00 0.00 H new ATOM 0 HG2 PRO B 685 -5.205 13.229 -31.126 1.00 0.00 H new ATOM 0 HG3 PRO B 685 -6.743 12.969 -30.326 1.00 0.00 H new ATOM 0 HD2 PRO B 685 -4.000 13.314 -29.090 1.00 0.00 H new ATOM 0 HD3 PRO B 685 -5.547 13.877 -28.490 1.00 0.00 H new ATOM 1376 N GLN B 686 -3.677 9.303 -28.483 1.00 0.00 N ATOM 1377 CA GLN B 686 -2.958 8.026 -28.468 1.00 0.00 C ATOM 1378 C GLN B 686 -3.489 7.131 -27.339 1.00 0.00 C ATOM 1379 O GLN B 686 -3.939 6.006 -27.574 1.00 0.00 O ATOM 1380 CB GLN B 686 -1.450 8.282 -28.310 1.00 0.00 C ATOM 1381 CG GLN B 686 -0.856 9.013 -29.529 1.00 0.00 C ATOM 1382 CD GLN B 686 0.504 9.632 -29.200 1.00 0.00 C ATOM 1383 OE1 GLN B 686 1.557 9.105 -29.555 1.00 0.00 O ATOM 1384 NE2 GLN B 686 0.508 10.755 -28.496 1.00 0.00 N ATOM 0 H GLN B 686 -3.092 10.115 -28.287 1.00 0.00 H new ATOM 0 HA GLN B 686 -3.123 7.507 -29.412 1.00 0.00 H new ATOM 0 HB2 GLN B 686 -1.275 8.874 -27.412 1.00 0.00 H new ATOM 0 HB3 GLN B 686 -0.934 7.332 -28.171 1.00 0.00 H new ATOM 0 HG2 GLN B 686 -0.748 8.313 -30.358 1.00 0.00 H new ATOM 0 HG3 GLN B 686 -1.543 9.793 -29.858 1.00 0.00 H new ATOM 0 HE21 GLN B 686 -0.374 11.180 -28.209 1.00 0.00 H new ATOM 0 HE22 GLN B 686 1.393 11.194 -28.241 1.00 0.00 H new ATOM 1393 N VAL B 687 -3.505 7.646 -26.109 1.00 0.00 N ATOM 1394 CA VAL B 687 -3.976 6.884 -24.955 1.00 0.00 C ATOM 1395 C VAL B 687 -5.484 6.677 -25.063 1.00 0.00 C ATOM 1396 O VAL B 687 -6.016 5.607 -24.791 1.00 0.00 O ATOM 1397 CB VAL B 687 -3.667 7.651 -23.666 1.00 0.00 C ATOM 1398 CG1 VAL B 687 -3.870 6.744 -22.452 1.00 0.00 C ATOM 1399 CG2 VAL B 687 -2.254 8.249 -23.657 1.00 0.00 C ATOM 0 H VAL B 687 -3.195 8.592 -25.887 1.00 0.00 H new ATOM 0 HA VAL B 687 -3.471 5.918 -24.934 1.00 0.00 H new ATOM 0 HB VAL B 687 -4.364 8.488 -23.616 1.00 0.00 H new ATOM 0 HG11 VAL B 687 -3.647 7.300 -21.541 1.00 0.00 H new ATOM 0 HG12 VAL B 687 -4.904 6.400 -22.424 1.00 0.00 H new ATOM 0 HG13 VAL B 687 -3.204 5.885 -22.524 1.00 0.00 H new ATOM 0 HG21 VAL B 687 -2.090 8.781 -22.720 1.00 0.00 H new ATOM 0 HG22 VAL B 687 -1.520 7.449 -23.753 1.00 0.00 H new ATOM 0 HG23 VAL B 687 -2.147 8.942 -24.491 1.00 0.00 H new ATOM 1409 N PHE B 688 -6.179 7.726 -25.479 1.00 0.00 N ATOM 1410 CA PHE B 688 -7.602 7.755 -25.698 1.00 0.00 C ATOM 1411 C PHE B 688 -8.035 6.732 -26.768 1.00 0.00 C ATOM 1412 O PHE B 688 -9.198 6.339 -26.775 1.00 0.00 O ATOM 1413 CB PHE B 688 -7.910 9.214 -26.006 1.00 0.00 C ATOM 1414 CG PHE B 688 -9.372 9.555 -26.284 1.00 0.00 C ATOM 1415 CD1 PHE B 688 -10.385 9.289 -25.341 1.00 0.00 C ATOM 1416 CD2 PHE B 688 -9.730 10.115 -27.525 1.00 0.00 C ATOM 1417 CE1 PHE B 688 -11.736 9.567 -25.641 1.00 0.00 C ATOM 1418 CE2 PHE B 688 -11.077 10.400 -27.823 1.00 0.00 C ATOM 1419 CZ PHE B 688 -12.081 10.122 -26.882 1.00 0.00 C ATOM 0 H PHE B 688 -5.734 8.622 -25.681 1.00 0.00 H new ATOM 0 HA PHE B 688 -8.188 7.436 -24.836 1.00 0.00 H new ATOM 0 HB2 PHE B 688 -7.572 9.819 -25.165 1.00 0.00 H new ATOM 0 HB3 PHE B 688 -7.319 9.513 -26.872 1.00 0.00 H new ATOM 0 HD1 PHE B 688 -10.125 8.869 -24.381 1.00 0.00 H new ATOM 0 HD2 PHE B 688 -8.964 10.328 -28.256 1.00 0.00 H new ATOM 0 HE1 PHE B 688 -12.505 9.352 -24.914 1.00 0.00 H new ATOM 0 HE2 PHE B 688 -11.338 10.833 -28.777 1.00 0.00 H new ATOM 0 HZ PHE B 688 -13.114 10.335 -27.113 1.00 0.00 H new ATOM 1429 N TYR B 689 -7.117 6.235 -27.613 1.00 0.00 N ATOM 1430 CA TYR B 689 -7.351 5.161 -28.573 1.00 0.00 C ATOM 1431 C TYR B 689 -6.967 3.784 -27.997 1.00 0.00 C ATOM 1432 O TYR B 689 -7.601 2.785 -28.338 1.00 0.00 O ATOM 1433 CB TYR B 689 -6.558 5.453 -29.857 1.00 0.00 C ATOM 1434 CG TYR B 689 -7.006 4.637 -31.053 1.00 0.00 C ATOM 1435 CD1 TYR B 689 -8.053 5.115 -31.864 1.00 0.00 C ATOM 1436 CD2 TYR B 689 -6.387 3.407 -31.352 1.00 0.00 C ATOM 1437 CE1 TYR B 689 -8.488 4.366 -32.971 1.00 0.00 C ATOM 1438 CE2 TYR B 689 -6.820 2.652 -32.456 1.00 0.00 C ATOM 1439 CZ TYR B 689 -7.875 3.126 -33.273 1.00 0.00 C ATOM 1440 OH TYR B 689 -8.305 2.408 -34.350 1.00 0.00 O ATOM 0 H TYR B 689 -6.160 6.587 -27.642 1.00 0.00 H new ATOM 0 HA TYR B 689 -8.417 5.124 -28.799 1.00 0.00 H new ATOM 0 HB2 TYR B 689 -6.650 6.512 -30.097 1.00 0.00 H new ATOM 0 HB3 TYR B 689 -5.501 5.259 -29.672 1.00 0.00 H new ATOM 0 HD1 TYR B 689 -8.523 6.060 -31.635 1.00 0.00 H new ATOM 0 HD2 TYR B 689 -5.580 3.044 -30.733 1.00 0.00 H new ATOM 0 HE1 TYR B 689 -9.290 4.737 -33.592 1.00 0.00 H new ATOM 0 HE2 TYR B 689 -6.347 1.708 -32.682 1.00 0.00 H new ATOM 0 HH TYR B 689 -7.783 1.582 -34.422 1.00 0.00 H new ATOM 1450 N GLU B 690 -5.974 3.719 -27.101 1.00 0.00 N ATOM 1451 CA GLU B 690 -5.654 2.517 -26.305 1.00 0.00 C ATOM 1452 C GLU B 690 -6.866 2.095 -25.450 1.00 0.00 C ATOM 1453 O GLU B 690 -7.065 0.929 -25.109 1.00 0.00 O ATOM 1454 CB GLU B 690 -4.441 2.825 -25.412 1.00 0.00 C ATOM 1455 CG GLU B 690 -3.701 1.576 -24.918 1.00 0.00 C ATOM 1456 CD GLU B 690 -3.063 0.772 -26.064 1.00 0.00 C ATOM 1457 OE1 GLU B 690 -1.960 1.141 -26.535 1.00 0.00 O ATOM 1458 OE2 GLU B 690 -3.654 -0.243 -26.502 1.00 0.00 O ATOM 0 H GLU B 690 -5.359 4.508 -26.902 1.00 0.00 H new ATOM 0 HA GLU B 690 -5.415 1.689 -26.972 1.00 0.00 H new ATOM 0 HB2 GLU B 690 -3.744 3.453 -25.967 1.00 0.00 H new ATOM 0 HB3 GLU B 690 -4.774 3.403 -24.550 1.00 0.00 H new ATOM 0 HG2 GLU B 690 -2.925 1.874 -24.213 1.00 0.00 H new ATOM 0 HG3 GLU B 690 -4.397 0.937 -24.375 1.00 0.00 H new ATOM 1465 N LEU B 691 -7.681 3.089 -25.117 1.00 0.00 N ATOM 1466 CA LEU B 691 -8.876 3.047 -24.299 1.00 0.00 C ATOM 1467 C LEU B 691 -9.994 2.160 -24.884 1.00 0.00 C ATOM 1468 O LEU B 691 -10.097 2.041 -26.107 1.00 0.00 O ATOM 1469 CB LEU B 691 -9.343 4.517 -24.206 1.00 0.00 C ATOM 1470 CG LEU B 691 -9.775 5.016 -22.837 1.00 0.00 C ATOM 1471 CD1 LEU B 691 -8.678 4.796 -21.794 1.00 0.00 C ATOM 1472 CD2 LEU B 691 -10.134 6.490 -22.919 1.00 0.00 C ATOM 0 H LEU B 691 -7.498 4.036 -25.449 1.00 0.00 H new ATOM 0 HA LEU B 691 -8.654 2.602 -23.329 1.00 0.00 H new ATOM 0 HB2 LEU B 691 -8.532 5.154 -24.559 1.00 0.00 H new ATOM 0 HB3 LEU B 691 -10.177 4.652 -24.895 1.00 0.00 H new ATOM 0 HG LEU B 691 -10.650 4.446 -22.525 1.00 0.00 H new ATOM 0 HD11 LEU B 691 -9.018 5.163 -20.826 1.00 0.00 H new ATOM 0 HD12 LEU B 691 -8.454 3.732 -21.720 1.00 0.00 H new ATOM 0 HD13 LEU B 691 -7.779 5.336 -22.092 1.00 0.00 H new ATOM 0 HD21 LEU B 691 -10.443 6.844 -21.936 1.00 0.00 H new ATOM 0 HD22 LEU B 691 -9.266 7.058 -23.253 1.00 0.00 H new ATOM 0 HD23 LEU B 691 -10.951 6.627 -23.627 1.00 0.00 H new ATOM 1484 N PRO B 692 -10.900 1.604 -24.050 1.00 0.00 N ATOM 1485 CA PRO B 692 -12.117 0.925 -24.504 1.00 0.00 C ATOM 1486 C PRO B 692 -13.049 1.885 -25.233 1.00 0.00 C ATOM 1487 O PRO B 692 -12.984 3.092 -25.016 1.00 0.00 O ATOM 1488 CB PRO B 692 -12.794 0.401 -23.235 1.00 0.00 C ATOM 1489 CG PRO B 692 -12.318 1.396 -22.178 1.00 0.00 C ATOM 1490 CD PRO B 692 -10.871 1.599 -22.599 1.00 0.00 C ATOM 0 HA PRO B 692 -11.879 0.126 -25.206 1.00 0.00 H new ATOM 0 HB2 PRO B 692 -13.880 0.394 -23.327 1.00 0.00 H new ATOM 0 HB3 PRO B 692 -12.487 -0.618 -23.001 1.00 0.00 H new ATOM 0 HG2 PRO B 692 -12.888 2.325 -22.200 1.00 0.00 H new ATOM 0 HG3 PRO B 692 -12.401 0.995 -21.168 1.00 0.00 H new ATOM 0 HD2 PRO B 692 -10.474 2.536 -22.209 1.00 0.00 H new ATOM 0 HD3 PRO B 692 -10.234 0.800 -22.220 1.00 0.00 H new ATOM 1498 N GLU B 693 -13.957 1.361 -26.055 1.00 0.00 N ATOM 1499 CA GLU B 693 -14.896 2.173 -26.826 1.00 0.00 C ATOM 1500 C GLU B 693 -15.936 2.814 -25.906 1.00 0.00 C ATOM 1501 O GLU B 693 -16.157 4.021 -25.976 1.00 0.00 O ATOM 1502 CB GLU B 693 -15.526 1.270 -27.903 1.00 0.00 C ATOM 1503 CG GLU B 693 -16.478 2.014 -28.845 1.00 0.00 C ATOM 1504 CD GLU B 693 -17.002 1.084 -29.956 1.00 0.00 C ATOM 1505 OE1 GLU B 693 -18.015 0.376 -29.739 1.00 0.00 O ATOM 1506 OE2 GLU B 693 -16.413 1.066 -31.065 1.00 0.00 O ATOM 0 H GLU B 693 -14.062 0.358 -26.205 1.00 0.00 H new ATOM 0 HA GLU B 693 -14.385 3.000 -27.318 1.00 0.00 H new ATOM 0 HB2 GLU B 693 -14.731 0.811 -28.491 1.00 0.00 H new ATOM 0 HB3 GLU B 693 -16.069 0.461 -27.415 1.00 0.00 H new ATOM 0 HG2 GLU B 693 -17.317 2.414 -28.276 1.00 0.00 H new ATOM 0 HG3 GLU B 693 -15.962 2.864 -29.292 1.00 0.00 H new ATOM 1513 N ALA B 694 -16.546 2.038 -25.006 1.00 0.00 N ATOM 1514 CA ALA B 694 -17.700 2.491 -24.228 1.00 0.00 C ATOM 1515 C ALA B 694 -17.345 3.669 -23.314 1.00 0.00 C ATOM 1516 O ALA B 694 -18.085 4.654 -23.237 1.00 0.00 O ATOM 1517 CB ALA B 694 -18.261 1.314 -23.419 1.00 0.00 C ATOM 0 H ALA B 694 -16.255 1.083 -24.798 1.00 0.00 H new ATOM 0 HA ALA B 694 -18.463 2.850 -24.918 1.00 0.00 H new ATOM 0 HB1 ALA B 694 -19.121 1.648 -22.838 1.00 0.00 H new ATOM 0 HB2 ALA B 694 -18.569 0.519 -24.099 1.00 0.00 H new ATOM 0 HB3 ALA B 694 -17.492 0.937 -22.745 1.00 0.00 H new ATOM 1523 N VAL B 695 -16.182 3.610 -22.651 1.00 0.00 N ATOM 1524 CA VAL B 695 -15.790 4.699 -21.756 1.00 0.00 C ATOM 1525 C VAL B 695 -15.449 5.939 -22.590 1.00 0.00 C ATOM 1526 O VAL B 695 -15.757 7.047 -22.159 1.00 0.00 O ATOM 1527 CB VAL B 695 -14.669 4.309 -20.764 1.00 0.00 C ATOM 1528 CG1 VAL B 695 -14.667 5.319 -19.603 1.00 0.00 C ATOM 1529 CG2 VAL B 695 -14.810 2.898 -20.167 1.00 0.00 C ATOM 0 H VAL B 695 -15.515 2.841 -22.716 1.00 0.00 H new ATOM 0 HA VAL B 695 -16.639 4.933 -21.113 1.00 0.00 H new ATOM 0 HB VAL B 695 -13.741 4.319 -21.335 1.00 0.00 H new ATOM 0 HG11 VAL B 695 -13.881 5.057 -18.894 1.00 0.00 H new ATOM 0 HG12 VAL B 695 -14.485 6.321 -19.992 1.00 0.00 H new ATOM 0 HG13 VAL B 695 -15.633 5.295 -19.099 1.00 0.00 H new ATOM 0 HG21 VAL B 695 -13.983 2.708 -19.483 1.00 0.00 H new ATOM 0 HG22 VAL B 695 -15.753 2.825 -19.625 1.00 0.00 H new ATOM 0 HG23 VAL B 695 -14.794 2.160 -20.969 1.00 0.00 H new ATOM 1539 N GLN B 696 -14.895 5.787 -23.806 1.00 0.00 N ATOM 1540 CA GLN B 696 -14.663 6.944 -24.673 1.00 0.00 C ATOM 1541 C GLN B 696 -15.996 7.626 -24.991 1.00 0.00 C ATOM 1542 O GLN B 696 -16.064 8.846 -24.917 1.00 0.00 O ATOM 1543 CB GLN B 696 -13.988 6.566 -26.003 1.00 0.00 C ATOM 1544 CG GLN B 696 -12.527 6.131 -25.912 1.00 0.00 C ATOM 1545 CD GLN B 696 -12.076 5.580 -27.274 1.00 0.00 C ATOM 1546 OE1 GLN B 696 -12.047 6.288 -28.277 1.00 0.00 O ATOM 1547 NE2 GLN B 696 -11.788 4.289 -27.363 1.00 0.00 N ATOM 0 H GLN B 696 -14.606 4.892 -24.200 1.00 0.00 H new ATOM 0 HA GLN B 696 -13.995 7.612 -24.130 1.00 0.00 H new ATOM 0 HB2 GLN B 696 -14.559 5.758 -26.461 1.00 0.00 H new ATOM 0 HB3 GLN B 696 -14.051 7.422 -26.675 1.00 0.00 H new ATOM 0 HG2 GLN B 696 -11.901 6.976 -25.623 1.00 0.00 H new ATOM 0 HG3 GLN B 696 -12.410 5.369 -25.141 1.00 0.00 H new ATOM 0 HE21 GLN B 696 -11.813 3.702 -26.529 1.00 0.00 H new ATOM 0 HE22 GLN B 696 -11.542 3.882 -28.265 1.00 0.00 H new ATOM 1556 N LYS B 697 -17.060 6.869 -25.312 1.00 0.00 N ATOM 1557 CA LYS B 697 -18.386 7.452 -25.564 1.00 0.00 C ATOM 1558 C LYS B 697 -18.840 8.291 -24.369 1.00 0.00 C ATOM 1559 O LYS B 697 -19.342 9.395 -24.579 1.00 0.00 O ATOM 1560 CB LYS B 697 -19.459 6.391 -25.893 1.00 0.00 C ATOM 1561 CG LYS B 697 -19.633 6.012 -27.374 1.00 0.00 C ATOM 1562 CD LYS B 697 -18.581 5.043 -27.942 1.00 0.00 C ATOM 1563 CE LYS B 697 -17.317 5.712 -28.516 1.00 0.00 C ATOM 1564 NZ LYS B 697 -17.517 6.205 -29.914 1.00 0.00 N ATOM 0 H LYS B 697 -17.026 5.854 -25.403 1.00 0.00 H new ATOM 0 HA LYS B 697 -18.279 8.087 -26.443 1.00 0.00 H new ATOM 0 HB2 LYS B 697 -19.221 5.484 -25.337 1.00 0.00 H new ATOM 0 HB3 LYS B 697 -20.418 6.751 -25.520 1.00 0.00 H new ATOM 0 HG2 LYS B 697 -20.619 5.565 -27.502 1.00 0.00 H new ATOM 0 HG3 LYS B 697 -19.617 6.926 -27.968 1.00 0.00 H new ATOM 0 HD2 LYS B 697 -18.281 4.353 -27.153 1.00 0.00 H new ATOM 0 HD3 LYS B 697 -19.046 4.447 -28.727 1.00 0.00 H new ATOM 0 HE2 LYS B 697 -17.029 6.547 -27.877 1.00 0.00 H new ATOM 0 HE3 LYS B 697 -16.493 4.999 -28.500 1.00 0.00 H new ATOM 0 HZ1 LYS B 697 -16.639 6.646 -30.255 1.00 0.00 H new ATOM 0 HZ2 LYS B 697 -17.766 5.406 -30.532 1.00 0.00 H new ATOM 0 HZ3 LYS B 697 -18.285 6.906 -29.928 1.00 0.00 H new ATOM 1578 N GLU B 698 -18.639 7.802 -23.140 1.00 0.00 N ATOM 1579 CA GLU B 698 -19.016 8.570 -21.946 1.00 0.00 C ATOM 1580 C GLU B 698 -18.269 9.892 -21.947 1.00 0.00 C ATOM 1581 O GLU B 698 -18.860 10.961 -21.824 1.00 0.00 O ATOM 1582 CB GLU B 698 -18.704 7.847 -20.616 1.00 0.00 C ATOM 1583 CG GLU B 698 -19.902 8.045 -19.675 1.00 0.00 C ATOM 1584 CD GLU B 698 -19.744 7.302 -18.342 1.00 0.00 C ATOM 1585 OE1 GLU B 698 -19.969 6.068 -18.307 1.00 0.00 O ATOM 1586 OE2 GLU B 698 -19.405 7.943 -17.318 1.00 0.00 O ATOM 0 H GLU B 698 -18.223 6.891 -22.946 1.00 0.00 H new ATOM 0 HA GLU B 698 -20.096 8.706 -21.999 1.00 0.00 H new ATOM 0 HB2 GLU B 698 -18.529 6.786 -20.791 1.00 0.00 H new ATOM 0 HB3 GLU B 698 -17.796 8.250 -20.167 1.00 0.00 H new ATOM 0 HG2 GLU B 698 -20.031 9.109 -19.479 1.00 0.00 H new ATOM 0 HG3 GLU B 698 -20.809 7.700 -20.172 1.00 0.00 H new ATOM 1593 N LEU B 699 -16.955 9.775 -22.122 1.00 0.00 N ATOM 1594 CA LEU B 699 -16.005 10.861 -22.034 1.00 0.00 C ATOM 1595 C LEU B 699 -16.349 11.929 -23.042 1.00 0.00 C ATOM 1596 O LEU B 699 -16.648 13.029 -22.629 1.00 0.00 O ATOM 1597 CB LEU B 699 -14.608 10.285 -22.275 1.00 0.00 C ATOM 1598 CG LEU B 699 -13.838 9.870 -21.018 1.00 0.00 C ATOM 1599 CD1 LEU B 699 -14.708 9.385 -19.848 1.00 0.00 C ATOM 1600 CD2 LEU B 699 -12.844 8.785 -21.449 1.00 0.00 C ATOM 0 H LEU B 699 -16.513 8.881 -22.337 1.00 0.00 H new ATOM 0 HA LEU B 699 -16.036 11.327 -21.049 1.00 0.00 H new ATOM 0 HB2 LEU B 699 -14.700 9.416 -22.926 1.00 0.00 H new ATOM 0 HB3 LEU B 699 -14.017 11.026 -22.814 1.00 0.00 H new ATOM 0 HG LEU B 699 -13.343 10.755 -20.618 1.00 0.00 H new ATOM 0 HD11 LEU B 699 -14.069 9.115 -19.007 1.00 0.00 H new ATOM 0 HD12 LEU B 699 -15.388 10.181 -19.546 1.00 0.00 H new ATOM 0 HD13 LEU B 699 -15.285 8.514 -20.160 1.00 0.00 H new ATOM 0 HD21 LEU B 699 -12.268 8.455 -20.584 1.00 0.00 H new ATOM 0 HD22 LEU B 699 -13.388 7.938 -21.867 1.00 0.00 H new ATOM 0 HD23 LEU B 699 -12.168 9.190 -22.202 1.00 0.00 H new ATOM 1612 N LEU B 700 -16.352 11.625 -24.335 1.00 0.00 N ATOM 1613 CA LEU B 700 -16.565 12.635 -25.367 1.00 0.00 C ATOM 1614 C LEU B 700 -17.930 13.301 -25.242 1.00 0.00 C ATOM 1615 O LEU B 700 -18.021 14.513 -25.443 1.00 0.00 O ATOM 1616 CB LEU B 700 -16.307 12.078 -26.779 1.00 0.00 C ATOM 1617 CG LEU B 700 -17.202 10.884 -27.161 1.00 0.00 C ATOM 1618 CD1 LEU B 700 -18.389 11.283 -28.037 1.00 0.00 C ATOM 1619 CD2 LEU B 700 -16.372 9.819 -27.881 1.00 0.00 C ATOM 0 H LEU B 700 -16.209 10.682 -24.696 1.00 0.00 H new ATOM 0 HA LEU B 700 -15.825 13.419 -25.204 1.00 0.00 H new ATOM 0 HB2 LEU B 700 -16.457 12.877 -27.505 1.00 0.00 H new ATOM 0 HB3 LEU B 700 -15.263 11.773 -26.852 1.00 0.00 H new ATOM 0 HG LEU B 700 -17.607 10.486 -26.231 1.00 0.00 H new ATOM 0 HD11 LEU B 700 -18.981 10.399 -28.272 1.00 0.00 H new ATOM 0 HD12 LEU B 700 -19.009 12.003 -27.504 1.00 0.00 H new ATOM 0 HD13 LEU B 700 -18.025 11.732 -28.961 1.00 0.00 H new ATOM 0 HD21 LEU B 700 -17.012 8.978 -28.148 1.00 0.00 H new ATOM 0 HD22 LEU B 700 -15.938 10.246 -28.785 1.00 0.00 H new ATOM 0 HD23 LEU B 700 -15.574 9.474 -27.224 1.00 0.00 H new ATOM 1631 N ALA B 701 -18.976 12.542 -24.900 1.00 0.00 N ATOM 1632 CA ALA B 701 -20.321 13.086 -24.804 1.00 0.00 C ATOM 1633 C ALA B 701 -20.411 14.015 -23.601 1.00 0.00 C ATOM 1634 O ALA B 701 -20.776 15.177 -23.753 1.00 0.00 O ATOM 1635 CB ALA B 701 -21.325 11.938 -24.735 1.00 0.00 C ATOM 0 H ALA B 701 -18.910 11.547 -24.686 1.00 0.00 H new ATOM 0 HA ALA B 701 -20.560 13.678 -25.687 1.00 0.00 H new ATOM 0 HB1 ALA B 701 -22.335 12.342 -24.663 1.00 0.00 H new ATOM 0 HB2 ALA B 701 -21.242 11.327 -25.634 1.00 0.00 H new ATOM 0 HB3 ALA B 701 -21.116 11.324 -23.859 1.00 0.00 H new ATOM 1641 N GLU B 702 -20.011 13.551 -22.419 1.00 0.00 N ATOM 1642 CA GLU B 702 -19.984 14.382 -21.231 1.00 0.00 C ATOM 1643 C GLU B 702 -19.037 15.548 -21.432 1.00 0.00 C ATOM 1644 O GLU B 702 -19.388 16.648 -21.018 1.00 0.00 O ATOM 1645 CB GLU B 702 -19.556 13.580 -20.000 1.00 0.00 C ATOM 1646 CG GLU B 702 -20.541 12.561 -19.461 1.00 0.00 C ATOM 1647 CD GLU B 702 -21.780 13.229 -18.833 1.00 0.00 C ATOM 1648 OE1 GLU B 702 -21.759 13.527 -17.612 1.00 0.00 O ATOM 1649 OE2 GLU B 702 -22.785 13.445 -19.554 1.00 0.00 O ATOM 0 H GLU B 702 -19.699 12.592 -22.264 1.00 0.00 H new ATOM 0 HA GLU B 702 -20.994 14.756 -21.063 1.00 0.00 H new ATOM 0 HB2 GLU B 702 -18.629 13.059 -20.241 1.00 0.00 H new ATOM 0 HB3 GLU B 702 -19.327 14.285 -19.200 1.00 0.00 H new ATOM 0 HG2 GLU B 702 -20.856 11.900 -20.268 1.00 0.00 H new ATOM 0 HG3 GLU B 702 -20.047 11.939 -18.714 1.00 0.00 H new ATOM 1656 N TRP B 703 -17.879 15.376 -22.072 1.00 0.00 N ATOM 1657 CA TRP B 703 -16.902 16.451 -22.175 1.00 0.00 C ATOM 1658 C TRP B 703 -17.548 17.632 -22.915 1.00 0.00 C ATOM 1659 O TRP B 703 -17.495 18.760 -22.425 1.00 0.00 O ATOM 1660 CB TRP B 703 -15.590 16.012 -22.887 1.00 0.00 C ATOM 1661 CG TRP B 703 -14.610 15.027 -22.265 1.00 0.00 C ATOM 1662 CD1 TRP B 703 -14.409 14.745 -20.954 1.00 0.00 C ATOM 1663 CD2 TRP B 703 -13.664 14.148 -22.963 1.00 0.00 C ATOM 1664 NE1 TRP B 703 -13.485 13.728 -20.806 1.00 0.00 N ATOM 1665 CE2 TRP B 703 -12.928 13.380 -22.009 1.00 0.00 C ATOM 1666 CE3 TRP B 703 -13.357 13.924 -24.320 1.00 0.00 C ATOM 1667 CZ2 TRP B 703 -11.931 12.457 -22.367 1.00 0.00 C ATOM 1668 CZ3 TRP B 703 -12.416 12.951 -24.703 1.00 0.00 C ATOM 1669 CH2 TRP B 703 -11.712 12.218 -23.731 1.00 0.00 C ATOM 0 H TRP B 703 -17.599 14.505 -22.524 1.00 0.00 H new ATOM 0 HA TRP B 703 -16.613 16.743 -21.165 1.00 0.00 H new ATOM 0 HB2 TRP B 703 -15.883 15.594 -23.850 1.00 0.00 H new ATOM 0 HB3 TRP B 703 -15.028 16.923 -23.093 1.00 0.00 H new ATOM 0 HD1 TRP B 703 -14.904 15.247 -20.136 1.00 0.00 H new ATOM 0 HE1 TRP B 703 -13.248 13.292 -19.915 1.00 0.00 H new ATOM 0 HE3 TRP B 703 -13.853 14.510 -25.080 1.00 0.00 H new ATOM 0 HZ2 TRP B 703 -11.350 11.946 -21.613 1.00 0.00 H new ATOM 0 HZ3 TRP B 703 -12.233 12.766 -25.751 1.00 0.00 H new ATOM 0 HH2 TRP B 703 -10.999 11.467 -24.037 1.00 0.00 H new ATOM 1680 N LYS B 704 -18.229 17.383 -24.044 1.00 0.00 N ATOM 1681 CA LYS B 704 -18.863 18.457 -24.819 1.00 0.00 C ATOM 1682 C LYS B 704 -20.198 18.922 -24.229 1.00 0.00 C ATOM 1683 O LYS B 704 -20.585 20.065 -24.458 1.00 0.00 O ATOM 1684 CB LYS B 704 -18.988 18.060 -26.297 1.00 0.00 C ATOM 1685 CG LYS B 704 -20.062 17.004 -26.582 1.00 0.00 C ATOM 1686 CD LYS B 704 -20.032 16.593 -28.058 1.00 0.00 C ATOM 1687 CE LYS B 704 -20.966 15.393 -28.265 1.00 0.00 C ATOM 1688 NZ LYS B 704 -21.142 15.061 -29.707 1.00 0.00 N ATOM 0 H LYS B 704 -18.354 16.451 -24.438 1.00 0.00 H new ATOM 0 HA LYS B 704 -18.205 19.324 -24.756 1.00 0.00 H new ATOM 0 HB2 LYS B 704 -19.209 18.952 -26.883 1.00 0.00 H new ATOM 0 HB3 LYS B 704 -18.025 17.683 -26.642 1.00 0.00 H new ATOM 0 HG2 LYS B 704 -19.898 16.130 -25.952 1.00 0.00 H new ATOM 0 HG3 LYS B 704 -21.046 17.399 -26.328 1.00 0.00 H new ATOM 0 HD2 LYS B 704 -20.346 17.426 -28.687 1.00 0.00 H new ATOM 0 HD3 LYS B 704 -19.016 16.334 -28.356 1.00 0.00 H new ATOM 0 HE2 LYS B 704 -20.563 14.526 -27.741 1.00 0.00 H new ATOM 0 HE3 LYS B 704 -21.938 15.610 -27.822 1.00 0.00 H new ATOM 0 HZ1 LYS B 704 -21.780 14.245 -29.800 1.00 0.00 H new ATOM 0 HZ2 LYS B 704 -21.550 15.878 -30.204 1.00 0.00 H new ATOM 0 HZ3 LYS B 704 -20.219 14.828 -30.125 1.00 0.00 H new ATOM 1702 N ARG B 705 -20.916 18.071 -23.478 1.00 0.00 N ATOM 1703 CA ARG B 705 -22.174 18.466 -22.838 1.00 0.00 C ATOM 1704 C ARG B 705 -21.872 19.400 -21.679 1.00 0.00 C ATOM 1705 O ARG B 705 -22.553 20.405 -21.480 1.00 0.00 O ATOM 1706 CB ARG B 705 -22.900 17.232 -22.267 1.00 0.00 C ATOM 1707 CG ARG B 705 -23.712 16.444 -23.300 1.00 0.00 C ATOM 1708 CD ARG B 705 -24.898 17.221 -23.889 1.00 0.00 C ATOM 1709 NE ARG B 705 -25.739 16.357 -24.741 1.00 0.00 N ATOM 1710 CZ ARG B 705 -26.791 15.618 -24.353 1.00 0.00 C ATOM 1711 NH1 ARG B 705 -27.170 15.579 -23.076 1.00 0.00 N ATOM 1712 NH2 ARG B 705 -27.469 14.913 -25.253 1.00 0.00 N ATOM 0 H ARG B 705 -20.643 17.104 -23.301 1.00 0.00 H new ATOM 0 HA ARG B 705 -22.802 18.953 -23.584 1.00 0.00 H new ATOM 0 HB2 ARG B 705 -22.163 16.567 -21.818 1.00 0.00 H new ATOM 0 HB3 ARG B 705 -23.567 17.555 -21.468 1.00 0.00 H new ATOM 0 HG2 ARG B 705 -23.051 16.141 -24.112 1.00 0.00 H new ATOM 0 HG3 ARG B 705 -24.084 15.531 -22.834 1.00 0.00 H new ATOM 0 HD2 ARG B 705 -25.501 17.635 -23.081 1.00 0.00 H new ATOM 0 HD3 ARG B 705 -24.529 18.063 -24.475 1.00 0.00 H new ATOM 0 HE ARG B 705 -25.495 16.317 -25.731 1.00 0.00 H new ATOM 0 HH11 ARG B 705 -26.659 16.116 -22.376 1.00 0.00 H new ATOM 0 HH12 ARG B 705 -27.972 15.012 -22.799 1.00 0.00 H new ATOM 0 HH21 ARG B 705 -27.190 14.935 -26.234 1.00 0.00 H new ATOM 0 HH22 ARG B 705 -28.269 14.350 -24.963 1.00 0.00 H new ATOM 1726 N THR B 706 -20.877 19.011 -20.893 1.00 0.00 N ATOM 1727 CA THR B 706 -20.551 19.640 -19.638 1.00 0.00 C ATOM 1728 C THR B 706 -19.729 20.914 -19.905 1.00 0.00 C ATOM 1729 O THR B 706 -19.832 21.881 -19.146 1.00 0.00 O ATOM 1730 CB THR B 706 -19.784 18.612 -18.790 1.00 0.00 C ATOM 1731 OG1 THR B 706 -20.490 17.386 -18.720 1.00 0.00 O ATOM 1732 CG2 THR B 706 -19.585 19.032 -17.353 1.00 0.00 C ATOM 0 H THR B 706 -20.264 18.229 -21.124 1.00 0.00 H new ATOM 0 HA THR B 706 -21.443 19.947 -19.093 1.00 0.00 H new ATOM 0 HB THR B 706 -18.820 18.522 -19.291 1.00 0.00 H new ATOM 0 HG1 THR B 706 -20.377 16.895 -19.560 1.00 0.00 H new ATOM 0 HG21 THR B 706 -19.037 18.256 -16.820 1.00 0.00 H new ATOM 0 HG22 THR B 706 -19.019 19.963 -17.321 1.00 0.00 H new ATOM 0 HG23 THR B 706 -20.556 19.181 -16.880 1.00 0.00 H new ATOM 1740 N GLY B 707 -18.936 20.905 -20.986 1.00 0.00 N ATOM 1741 CA GLY B 707 -18.191 22.036 -21.509 1.00 0.00 C ATOM 1742 C GLY B 707 -19.067 23.282 -21.648 1.00 0.00 C ATOM 1743 O GLY B 707 -20.169 23.179 -22.232 1.00 0.00 O ATOM 1744 OXT GLY B 707 -18.638 24.366 -21.190 1.00 0.00 O ATOM 0 H GLY B 707 -18.797 20.060 -21.540 1.00 0.00 H new ATOM 0 HA2 GLY B 707 -17.352 22.254 -20.849 1.00 0.00 H new ATOM 0 HA3 GLY B 707 -17.772 21.776 -22.481 1.00 0.00 H new TER 1748 GLY B 707