USER MOD reduce.3.24.130724 H: found=0, std=0, add=935, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 933 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: C 13 ASN : amide:sc= 1.03 K(o=1,f=-1.1) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc=-0.00857 USER MOD Set 2.1: C 11 SER OG : rot 180:sc= 0.771 USER MOD Set 2.2: C 21 THR OG1 : rot -69:sc= 0.892 USER MOD Set 3.1: A 13 ASN : amide:sc= 0 X(o=-0.0083,f=-0.23) USER MOD Set 3.2: A 19 THR OG1 : rot 180:sc=-0.00827 USER MOD Set 4.1: A 11 SER OG : rot 180:sc= 0.588 USER MOD Set 4.2: A 21 THR OG1 : rot -69:sc= 0.663 USER MOD Single : A 1 MET CE :methyl 180:sc= -0.0597 (180deg=-0.0597) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 174:sc=-0.00721 (180deg=-0.059) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 29 GLN : amide:sc= -0.0741 X(o=-0.074,f=0) USER MOD Single : A 35 ASN : amide:sc= -0.0325 K(o=-0.033,f=-1.8!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -1.2 K(o=-1.2,f=-0.7) USER MOD Single : A 48 TYR OH : rot 50:sc= 0.0472 USER MOD Single : A 49 GLN : amide:sc= 0.66 K(o=0.66,f=0) USER MOD Single : A 52 GLN : amide:sc= -2.91! K(o=-2.9!,f=-1.5) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl -119:sc= 0 (180deg=-0.0349) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= -0.327 K(o=-0.33,f=-2) USER MOD Single : C 29 GLN : amide:sc= -0.344 X(o=-0.34,f=-0.31) USER MOD Single : C 35 ASN : amide:sc= -0.042 X(o=-0.042,f=-0.15) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HD1:sc= -0.773 X(o=-0.77,f=-0.46) USER MOD Single : C 48 TYR OH : rot 37:sc= 0.618 USER MOD Single : C 49 GLN : amide:sc= 1.05 K(o=1.1,f=0) USER MOD Single : C 52 GLN : amide:sc= -3.16! K(o=-3.2!,f=-1.4) USER MOD Single : C 56 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.768 -7.859 -10.153 1.00 0.00 N ATOM 2 CA MET A 1 4.028 -6.855 -9.376 1.00 0.00 C ATOM 3 C MET A 1 2.741 -7.464 -8.843 1.00 0.00 C ATOM 4 O MET A 1 1.869 -7.838 -9.625 1.00 0.00 O ATOM 5 CB MET A 1 3.720 -5.631 -10.250 1.00 0.00 C ATOM 6 CG MET A 1 3.393 -4.404 -9.399 1.00 0.00 C ATOM 7 SD MET A 1 3.132 -2.878 -10.340 1.00 0.00 S ATOM 8 CE MET A 1 1.477 -3.202 -10.980 1.00 0.00 C ATOM 0 H1 MET A 1 5.647 -7.438 -10.516 1.00 0.00 H new ATOM 0 H2 MET A 1 4.998 -8.670 -9.543 1.00 0.00 H new ATOM 0 H3 MET A 1 4.183 -8.181 -10.951 1.00 0.00 H new ATOM 0 HA MET A 1 4.640 -6.532 -8.534 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.576 -5.414 -10.889 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.880 -5.854 -10.907 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.497 -4.612 -8.815 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.205 -4.243 -8.690 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.151 -2.359 -11.589 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.493 -4.105 -11.590 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.785 -3.338 -10.148 1.00 0.00 H new ATOM 20 N LEU A 2 2.597 -7.580 -7.518 1.00 0.00 N ATOM 21 CA LEU A 2 1.359 -8.103 -6.960 1.00 0.00 C ATOM 22 C LEU A 2 0.340 -6.969 -6.981 1.00 0.00 C ATOM 23 O LEU A 2 0.693 -5.814 -6.750 1.00 0.00 O ATOM 24 CB LEU A 2 1.579 -8.608 -5.526 1.00 0.00 C ATOM 25 CG LEU A 2 0.650 -9.759 -5.085 1.00 0.00 C ATOM 26 CD1 LEU A 2 0.446 -9.698 -3.577 1.00 0.00 C ATOM 27 CD2 LEU A 2 -0.743 -9.766 -5.698 1.00 0.00 C ATOM 0 H LEU A 2 3.307 -7.324 -6.832 1.00 0.00 H new ATOM 0 HA LEU A 2 1.003 -8.950 -7.546 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.613 -8.939 -5.429 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.447 -7.772 -4.839 1.00 0.00 H new ATOM 0 HG LEU A 2 1.164 -10.656 -5.431 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -0.210 -10.511 -3.265 1.00 0.00 H new ATOM 0 HD12 LEU A 2 1.409 -9.796 -3.075 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -0.007 -8.743 -3.309 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -1.305 -10.618 -5.315 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -1.261 -8.843 -5.436 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -0.663 -9.842 -6.782 1.00 0.00 H new ATOM 39 N ILE A 3 -0.921 -7.290 -7.255 1.00 0.00 N ATOM 40 CA ILE A 3 -2.001 -6.325 -7.242 1.00 0.00 C ATOM 41 C ILE A 3 -3.100 -6.845 -6.338 1.00 0.00 C ATOM 42 O ILE A 3 -3.437 -8.023 -6.375 1.00 0.00 O ATOM 43 CB ILE A 3 -2.504 -6.096 -8.668 1.00 0.00 C ATOM 44 CG1 ILE A 3 -1.398 -5.360 -9.421 1.00 0.00 C ATOM 45 CG2 ILE A 3 -3.809 -5.297 -8.691 1.00 0.00 C ATOM 46 CD1 ILE A 3 -1.739 -5.119 -10.879 1.00 0.00 C ATOM 0 H ILE A 3 -1.218 -8.236 -7.493 1.00 0.00 H new ATOM 0 HA ILE A 3 -1.656 -5.365 -6.857 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.728 -7.051 -9.142 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.208 -4.403 -8.934 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -0.476 -5.938 -9.359 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -4.132 -5.157 -9.723 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.578 -5.840 -8.141 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -3.648 -4.325 -8.226 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.916 -4.593 -11.363 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.901 -6.075 -11.377 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.645 -4.516 -10.946 1.00 0.00 H new ATOM 58 N LEU A 4 -3.654 -5.947 -5.530 1.00 0.00 N ATOM 59 CA LEU A 4 -4.732 -6.263 -4.618 1.00 0.00 C ATOM 60 C LEU A 4 -5.749 -5.130 -4.704 1.00 0.00 C ATOM 61 O LEU A 4 -5.446 -4.043 -5.196 1.00 0.00 O ATOM 62 CB LEU A 4 -4.181 -6.441 -3.195 1.00 0.00 C ATOM 63 CG LEU A 4 -3.245 -7.655 -3.037 1.00 0.00 C ATOM 64 CD1 LEU A 4 -2.768 -7.751 -1.588 1.00 0.00 C ATOM 65 CD2 LEU A 4 -3.971 -8.961 -3.346 1.00 0.00 C ATOM 0 H LEU A 4 -3.360 -4.971 -5.494 1.00 0.00 H new ATOM 0 HA LEU A 4 -5.217 -7.202 -4.884 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -3.641 -5.538 -2.909 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.016 -6.546 -2.503 1.00 0.00 H new ATOM 0 HG LEU A 4 -2.415 -7.514 -3.729 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -2.106 -8.610 -1.479 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -2.229 -6.842 -1.321 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -3.628 -7.869 -0.929 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -3.283 -9.797 -3.225 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -4.811 -9.081 -2.662 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -4.339 -8.939 -4.372 1.00 0.00 H new ATOM 77 N THR A 5 -6.966 -5.387 -4.225 1.00 0.00 N ATOM 78 CA THR A 5 -8.070 -4.453 -4.360 1.00 0.00 C ATOM 79 C THR A 5 -8.688 -4.224 -2.997 1.00 0.00 C ATOM 80 O THR A 5 -8.819 -5.154 -2.200 1.00 0.00 O ATOM 81 CB THR A 5 -9.083 -5.032 -5.351 1.00 0.00 C ATOM 82 OG1 THR A 5 -8.474 -5.138 -6.620 1.00 0.00 O ATOM 83 CG2 THR A 5 -10.328 -4.159 -5.495 1.00 0.00 C ATOM 0 H THR A 5 -7.208 -6.248 -3.735 1.00 0.00 H new ATOM 0 HA THR A 5 -7.728 -3.491 -4.742 1.00 0.00 H new ATOM 0 HB THR A 5 -9.392 -6.004 -4.967 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.116 -5.510 -7.261 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.012 -4.616 -6.209 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.822 -4.067 -4.528 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.040 -3.170 -5.851 1.00 0.00 H new ATOM 91 N ARG A 6 -9.071 -2.975 -2.733 1.00 0.00 N ATOM 92 CA ARG A 6 -9.597 -2.576 -1.440 1.00 0.00 C ATOM 93 C ARG A 6 -10.719 -1.567 -1.612 1.00 0.00 C ATOM 94 O ARG A 6 -10.979 -1.089 -2.713 1.00 0.00 O ATOM 95 CB ARG A 6 -8.471 -1.934 -0.617 1.00 0.00 C ATOM 96 CG ARG A 6 -7.335 -2.897 -0.254 1.00 0.00 C ATOM 97 CD ARG A 6 -7.586 -3.618 1.071 1.00 0.00 C ATOM 98 NE ARG A 6 -8.764 -4.487 1.035 1.00 0.00 N ATOM 99 CZ ARG A 6 -8.808 -5.729 1.521 1.00 0.00 C ATOM 100 NH1 ARG A 6 -7.762 -6.257 2.149 1.00 0.00 N ATOM 101 NH2 ARG A 6 -9.908 -6.456 1.376 1.00 0.00 N ATOM 0 H ARG A 6 -9.023 -2.216 -3.413 1.00 0.00 H new ATOM 0 HA ARG A 6 -9.986 -3.457 -0.930 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -8.057 -1.096 -1.178 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -8.894 -1.525 0.301 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -7.218 -3.633 -1.049 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -6.398 -2.343 -0.192 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -6.709 -4.214 1.326 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -7.710 -2.879 1.863 1.00 0.00 H new ATOM 0 HE ARG A 6 -9.613 -4.116 0.607 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -6.908 -5.711 2.266 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -7.813 -7.208 2.514 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -10.718 -6.065 0.894 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -9.944 -7.406 1.747 1.00 0.00 H new ATOM 115 N LYS A 7 -11.380 -1.246 -0.500 1.00 0.00 N ATOM 116 CA LYS A 7 -12.380 -0.197 -0.429 1.00 0.00 C ATOM 117 C LYS A 7 -11.968 0.750 0.686 1.00 0.00 C ATOM 118 O LYS A 7 -11.198 0.373 1.568 1.00 0.00 O ATOM 119 CB LYS A 7 -13.775 -0.772 -0.161 1.00 0.00 C ATOM 120 CG LYS A 7 -14.411 -1.449 -1.378 1.00 0.00 C ATOM 121 CD LYS A 7 -13.889 -2.847 -1.726 1.00 0.00 C ATOM 122 CE LYS A 7 -14.033 -3.830 -0.566 1.00 0.00 C ATOM 123 NZ LYS A 7 -15.436 -3.972 -0.125 1.00 0.00 N ATOM 0 H LYS A 7 -11.228 -1.721 0.390 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.435 0.330 -1.382 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -13.709 -1.495 0.652 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.429 0.031 0.179 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -15.486 -1.517 -1.209 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -14.265 -0.804 -2.244 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -14.431 -3.229 -2.591 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -12.839 -2.779 -2.012 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -13.649 -4.804 -0.868 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -13.423 -3.492 0.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -15.500 -4.722 0.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -15.764 -3.073 0.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -16.032 -4.221 -0.940 1.00 0.00 H new ATOM 137 N VAL A 8 -12.482 1.981 0.644 1.00 0.00 N ATOM 138 CA VAL A 8 -12.131 3.004 1.614 1.00 0.00 C ATOM 139 C VAL A 8 -12.296 2.472 3.040 1.00 0.00 C ATOM 140 O VAL A 8 -13.409 2.169 3.466 1.00 0.00 O ATOM 141 CB VAL A 8 -13.018 4.234 1.389 1.00 0.00 C ATOM 142 CG1 VAL A 8 -12.746 5.279 2.470 1.00 0.00 C ATOM 143 CG2 VAL A 8 -12.736 4.833 0.013 1.00 0.00 C ATOM 0 H VAL A 8 -13.150 2.290 -0.063 1.00 0.00 H new ATOM 0 HA VAL A 8 -11.086 3.285 1.482 1.00 0.00 H new ATOM 0 HB VAL A 8 -14.063 3.930 1.441 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.380 6.149 2.302 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -12.964 4.854 3.450 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -11.699 5.580 2.430 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.370 5.707 -0.140 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.689 5.129 -0.047 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.948 4.091 -0.757 1.00 0.00 H new ATOM 153 N GLY A 9 -11.181 2.364 3.768 1.00 0.00 N ATOM 154 CA GLY A 9 -11.167 1.923 5.153 1.00 0.00 C ATOM 155 C GLY A 9 -10.409 0.607 5.339 1.00 0.00 C ATOM 156 O GLY A 9 -9.950 0.321 6.445 1.00 0.00 O ATOM 0 H GLY A 9 -10.255 2.585 3.402 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -10.708 2.694 5.772 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.192 1.801 5.503 1.00 0.00 H new ATOM 160 N GLU A 10 -10.275 -0.194 4.278 1.00 0.00 N ATOM 161 CA GLU A 10 -9.580 -1.475 4.361 1.00 0.00 C ATOM 162 C GLU A 10 -8.058 -1.291 4.342 1.00 0.00 C ATOM 163 O GLU A 10 -7.566 -0.169 4.224 1.00 0.00 O ATOM 164 CB GLU A 10 -10.026 -2.375 3.209 1.00 0.00 C ATOM 165 CG GLU A 10 -11.528 -2.655 3.286 1.00 0.00 C ATOM 166 CD GLU A 10 -11.964 -3.636 2.203 1.00 0.00 C ATOM 167 OE1 GLU A 10 -11.371 -3.584 1.101 1.00 0.00 O ATOM 168 OE2 GLU A 10 -12.887 -4.429 2.485 1.00 0.00 O ATOM 0 H GLU A 10 -10.641 0.026 3.351 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.839 -1.946 5.309 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.789 -1.899 2.257 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.475 -3.315 3.242 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.775 -3.060 4.267 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.080 -1.722 3.178 1.00 0.00 H new ATOM 175 N SER A 11 -7.308 -2.393 4.460 1.00 0.00 N ATOM 176 CA SER A 11 -5.852 -2.349 4.573 1.00 0.00 C ATOM 177 C SER A 11 -5.174 -3.530 3.873 1.00 0.00 C ATOM 178 O SER A 11 -5.824 -4.493 3.463 1.00 0.00 O ATOM 179 CB SER A 11 -5.464 -2.337 6.054 1.00 0.00 C ATOM 180 OG SER A 11 -5.924 -1.152 6.672 1.00 0.00 O ATOM 0 H SER A 11 -7.696 -3.336 4.479 1.00 0.00 H new ATOM 0 HA SER A 11 -5.508 -1.441 4.078 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.890 -3.206 6.556 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.381 -2.411 6.154 1.00 0.00 H new ATOM 0 HG SER A 11 -5.671 -1.157 7.619 1.00 0.00 H new ATOM 186 N ILE A 12 -3.847 -3.429 3.744 1.00 0.00 N ATOM 187 CA ILE A 12 -2.969 -4.416 3.123 1.00 0.00 C ATOM 188 C ILE A 12 -1.747 -4.560 4.033 1.00 0.00 C ATOM 189 O ILE A 12 -1.519 -3.707 4.889 1.00 0.00 O ATOM 190 CB ILE A 12 -2.571 -3.927 1.718 1.00 0.00 C ATOM 191 CG1 ILE A 12 -3.788 -3.781 0.795 1.00 0.00 C ATOM 192 CG2 ILE A 12 -1.546 -4.851 1.049 1.00 0.00 C ATOM 193 CD1 ILE A 12 -4.455 -5.126 0.487 1.00 0.00 C ATOM 0 H ILE A 12 -3.335 -2.616 4.088 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.459 -5.383 3.007 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.116 -2.948 1.867 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.516 -3.116 1.261 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.478 -3.311 -0.138 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.297 -4.464 0.061 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -0.644 -4.895 1.659 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.967 -5.851 0.951 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -5.310 -4.966 -0.170 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.738 -5.784 -0.005 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -4.792 -5.586 1.416 1.00 0.00 H new ATOM 205 N ASN A 13 -0.953 -5.625 3.874 1.00 0.00 N ATOM 206 CA ASN A 13 0.182 -5.864 4.755 1.00 0.00 C ATOM 207 C ASN A 13 1.409 -6.304 3.961 1.00 0.00 C ATOM 208 O ASN A 13 1.283 -6.967 2.932 1.00 0.00 O ATOM 209 CB ASN A 13 -0.229 -6.917 5.791 1.00 0.00 C ATOM 210 CG ASN A 13 0.775 -7.002 6.932 1.00 0.00 C ATOM 211 OD1 ASN A 13 1.860 -7.554 6.783 1.00 0.00 O ATOM 212 ND2 ASN A 13 0.411 -6.447 8.085 1.00 0.00 N ATOM 0 H ASN A 13 -1.079 -6.328 3.146 1.00 0.00 H new ATOM 0 HA ASN A 13 0.459 -4.942 5.266 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.213 -6.671 6.189 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.314 -7.890 5.307 1.00 0.00 H new ATOM 0 HD21 ASN A 13 1.043 -6.471 8.885 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.501 -5.997 8.169 1.00 0.00 H new ATOM 219 N ILE A 14 2.598 -5.922 4.447 1.00 0.00 N ATOM 220 CA ILE A 14 3.871 -6.161 3.776 1.00 0.00 C ATOM 221 C ILE A 14 4.912 -6.614 4.800 1.00 0.00 C ATOM 222 O ILE A 14 4.882 -6.191 5.958 1.00 0.00 O ATOM 223 CB ILE A 14 4.365 -4.872 3.100 1.00 0.00 C ATOM 224 CG1 ILE A 14 3.304 -4.159 2.247 1.00 0.00 C ATOM 225 CG2 ILE A 14 5.612 -5.161 2.254 1.00 0.00 C ATOM 226 CD1 ILE A 14 2.931 -4.931 0.982 1.00 0.00 C ATOM 0 H ILE A 14 2.697 -5.429 5.335 1.00 0.00 H new ATOM 0 HA ILE A 14 3.729 -6.934 3.021 1.00 0.00 H new ATOM 0 HB ILE A 14 4.607 -4.186 3.912 1.00 0.00 H new ATOM 0 HG12 ILE A 14 2.408 -4.004 2.848 1.00 0.00 H new ATOM 0 HG13 ILE A 14 3.675 -3.173 1.967 1.00 0.00 H new ATOM 0 HG21 ILE A 14 5.952 -4.240 1.781 1.00 0.00 H new ATOM 0 HG22 ILE A 14 6.403 -5.553 2.894 1.00 0.00 H new ATOM 0 HG23 ILE A 14 5.369 -5.895 1.486 1.00 0.00 H new ATOM 0 HD11 ILE A 14 2.178 -4.374 0.425 1.00 0.00 H new ATOM 0 HD12 ILE A 14 3.818 -5.063 0.362 1.00 0.00 H new ATOM 0 HD13 ILE A 14 2.531 -5.907 1.256 1.00 0.00 H new ATOM 238 N GLY A 15 5.840 -7.475 4.373 1.00 0.00 N ATOM 239 CA GLY A 15 6.924 -7.948 5.225 1.00 0.00 C ATOM 240 C GLY A 15 6.388 -8.572 6.508 1.00 0.00 C ATOM 241 O GLY A 15 5.448 -9.366 6.478 1.00 0.00 O ATOM 0 H GLY A 15 5.857 -7.860 3.429 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.521 -8.681 4.683 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.585 -7.117 5.471 1.00 0.00 H new ATOM 245 N ASP A 16 6.997 -8.201 7.637 1.00 0.00 N ATOM 246 CA ASP A 16 6.598 -8.674 8.955 1.00 0.00 C ATOM 247 C ASP A 16 6.438 -7.502 9.926 1.00 0.00 C ATOM 248 O ASP A 16 6.200 -7.703 11.117 1.00 0.00 O ATOM 249 CB ASP A 16 7.632 -9.694 9.447 1.00 0.00 C ATOM 250 CG ASP A 16 7.226 -10.360 10.759 1.00 0.00 C ATOM 251 OD1 ASP A 16 6.086 -10.870 10.826 1.00 0.00 O ATOM 252 OD2 ASP A 16 8.060 -10.353 11.694 1.00 0.00 O ATOM 0 H ASP A 16 7.788 -7.557 7.657 1.00 0.00 H new ATOM 0 HA ASP A 16 5.626 -9.164 8.897 1.00 0.00 H new ATOM 0 HB2 ASP A 16 7.772 -10.460 8.684 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.593 -9.196 9.579 1.00 0.00 H new ATOM 257 N ASP A 17 6.570 -6.266 9.427 1.00 0.00 N ATOM 258 CA ASP A 17 6.541 -5.064 10.251 1.00 0.00 C ATOM 259 C ASP A 17 5.907 -3.877 9.515 1.00 0.00 C ATOM 260 O ASP A 17 6.031 -2.743 9.978 1.00 0.00 O ATOM 261 CB ASP A 17 7.970 -4.704 10.663 1.00 0.00 C ATOM 262 CG ASP A 17 8.621 -5.787 11.518 1.00 0.00 C ATOM 263 OD1 ASP A 17 8.315 -5.822 12.732 1.00 0.00 O ATOM 264 OD2 ASP A 17 9.415 -6.573 10.958 1.00 0.00 O ATOM 0 H ASP A 17 6.700 -6.077 8.433 1.00 0.00 H new ATOM 0 HA ASP A 17 5.930 -5.273 11.129 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.572 -4.540 9.769 1.00 0.00 H new ATOM 0 HB3 ASP A 17 7.960 -3.765 11.217 1.00 0.00 H new ATOM 269 N ILE A 18 5.233 -4.103 8.380 1.00 0.00 N ATOM 270 CA ILE A 18 4.682 -3.010 7.587 1.00 0.00 C ATOM 271 C ILE A 18 3.219 -3.282 7.247 1.00 0.00 C ATOM 272 O ILE A 18 2.837 -4.412 6.949 1.00 0.00 O ATOM 273 CB ILE A 18 5.529 -2.848 6.315 1.00 0.00 C ATOM 274 CG1 ILE A 18 6.985 -2.519 6.680 1.00 0.00 C ATOM 275 CG2 ILE A 18 4.926 -1.762 5.415 1.00 0.00 C ATOM 276 CD1 ILE A 18 7.897 -2.526 5.454 1.00 0.00 C ATOM 0 H ILE A 18 5.059 -5.032 7.996 1.00 0.00 H new ATOM 0 HA ILE A 18 4.715 -2.083 8.159 1.00 0.00 H new ATOM 0 HB ILE A 18 5.525 -3.788 5.764 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.027 -1.540 7.158 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.349 -3.244 7.407 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.534 -1.655 4.517 1.00 0.00 H new ATOM 0 HG22 ILE A 18 3.911 -2.044 5.135 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.904 -0.814 5.953 1.00 0.00 H new ATOM 0 HD11 ILE A 18 8.917 -2.289 5.758 1.00 0.00 H new ATOM 0 HD12 ILE A 18 7.877 -3.513 4.991 1.00 0.00 H new ATOM 0 HD13 ILE A 18 7.549 -1.782 4.738 1.00 0.00 H new ATOM 288 N THR A 19 2.401 -2.224 7.290 1.00 0.00 N ATOM 289 CA THR A 19 0.983 -2.302 6.968 1.00 0.00 C ATOM 290 C THR A 19 0.576 -1.018 6.252 1.00 0.00 C ATOM 291 O THR A 19 1.174 0.029 6.490 1.00 0.00 O ATOM 292 CB THR A 19 0.169 -2.489 8.257 1.00 0.00 C ATOM 293 OG1 THR A 19 0.752 -3.486 9.066 1.00 0.00 O ATOM 294 CG2 THR A 19 -1.264 -2.921 7.951 1.00 0.00 C ATOM 0 H THR A 19 2.712 -1.288 7.551 1.00 0.00 H new ATOM 0 HA THR A 19 0.788 -3.154 6.317 1.00 0.00 H new ATOM 0 HB THR A 19 0.163 -1.529 8.772 1.00 0.00 H new ATOM 0 HG1 THR A 19 0.224 -3.594 9.884 1.00 0.00 H new ATOM 0 HG21 THR A 19 -1.814 -3.045 8.884 1.00 0.00 H new ATOM 0 HG22 THR A 19 -1.751 -2.160 7.341 1.00 0.00 H new ATOM 0 HG23 THR A 19 -1.251 -3.867 7.409 1.00 0.00 H new ATOM 302 N ILE A 20 -0.435 -1.093 5.381 1.00 0.00 N ATOM 303 CA ILE A 20 -0.845 0.015 4.528 1.00 0.00 C ATOM 304 C ILE A 20 -2.370 0.120 4.552 1.00 0.00 C ATOM 305 O ILE A 20 -3.048 -0.889 4.747 1.00 0.00 O ATOM 306 CB ILE A 20 -0.353 -0.222 3.093 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.116 -0.661 3.014 1.00 0.00 C ATOM 308 CG2 ILE A 20 -0.539 1.048 2.256 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.103 0.424 3.436 1.00 0.00 C ATOM 0 H ILE A 20 -0.995 -1.936 5.251 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.410 0.945 4.895 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.957 -1.039 2.698 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.259 -1.536 3.647 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.340 -0.967 1.992 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.187 0.869 1.240 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.595 1.317 2.232 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.033 1.863 2.700 1.00 0.00 H new ATOM 0 HD11 ILE A 20 3.121 0.042 3.354 1.00 0.00 H new ATOM 0 HD12 ILE A 20 1.988 1.292 2.787 1.00 0.00 H new ATOM 0 HD13 ILE A 20 1.906 0.714 4.468 1.00 0.00 H new ATOM 321 N THR A 21 -2.913 1.323 4.359 1.00 0.00 N ATOM 322 CA THR A 21 -4.352 1.549 4.455 1.00 0.00 C ATOM 323 C THR A 21 -4.820 2.511 3.372 1.00 0.00 C ATOM 324 O THR A 21 -4.053 3.362 2.921 1.00 0.00 O ATOM 325 CB THR A 21 -4.663 2.119 5.845 1.00 0.00 C ATOM 326 OG1 THR A 21 -4.208 1.221 6.834 1.00 0.00 O ATOM 327 CG2 THR A 21 -6.158 2.356 6.062 1.00 0.00 C ATOM 0 H THR A 21 -2.373 2.158 4.134 1.00 0.00 H new ATOM 0 HA THR A 21 -4.880 0.606 4.312 1.00 0.00 H new ATOM 0 HB THR A 21 -4.153 3.080 5.916 1.00 0.00 H new ATOM 0 HG1 THR A 21 -4.757 0.409 6.817 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.321 2.760 7.061 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.525 3.065 5.320 1.00 0.00 H new ATOM 0 HG23 THR A 21 -6.695 1.413 5.960 1.00 0.00 H new ATOM 335 N ILE A 22 -6.086 2.381 2.952 1.00 0.00 N ATOM 336 CA ILE A 22 -6.702 3.249 1.960 1.00 0.00 C ATOM 337 C ILE A 22 -7.730 4.124 2.672 1.00 0.00 C ATOM 338 O ILE A 22 -8.907 3.780 2.778 1.00 0.00 O ATOM 339 CB ILE A 22 -7.257 2.419 0.787 1.00 0.00 C ATOM 340 CG1 ILE A 22 -8.077 3.259 -0.196 1.00 0.00 C ATOM 341 CG2 ILE A 22 -8.124 1.252 1.268 1.00 0.00 C ATOM 342 CD1 ILE A 22 -7.235 4.356 -0.847 1.00 0.00 C ATOM 0 H ILE A 22 -6.713 1.657 3.302 1.00 0.00 H new ATOM 0 HA ILE A 22 -5.975 3.918 1.499 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.377 2.033 0.272 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.491 2.612 -0.969 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -8.920 3.710 0.327 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -8.494 0.695 0.407 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.529 0.592 1.899 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -8.968 1.637 1.840 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.854 4.929 -1.537 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -6.842 5.019 -0.076 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.407 3.904 -1.393 1.00 0.00 H new ATOM 354 N LEU A 23 -7.263 5.272 3.170 1.00 0.00 N ATOM 355 CA LEU A 23 -8.058 6.173 3.992 1.00 0.00 C ATOM 356 C LEU A 23 -9.202 6.806 3.208 1.00 0.00 C ATOM 357 O LEU A 23 -10.193 7.222 3.805 1.00 0.00 O ATOM 358 CB LEU A 23 -7.150 7.276 4.537 1.00 0.00 C ATOM 359 CG LEU A 23 -5.979 6.734 5.356 1.00 0.00 C ATOM 360 CD1 LEU A 23 -5.059 7.896 5.703 1.00 0.00 C ATOM 361 CD2 LEU A 23 -6.441 6.061 6.645 1.00 0.00 C ATOM 0 H LEU A 23 -6.311 5.601 3.009 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.495 5.592 4.804 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -6.763 7.865 3.705 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.739 7.951 5.158 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.463 5.982 4.759 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.216 7.530 6.288 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.692 8.356 4.786 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.610 8.636 6.284 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.574 5.692 7.193 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -6.979 6.783 7.260 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.100 5.227 6.404 1.00 0.00 H new ATOM 373 N GLY A 24 -9.087 6.888 1.880 1.00 0.00 N ATOM 374 CA GLY A 24 -10.154 7.427 1.060 1.00 0.00 C ATOM 375 C GLY A 24 -9.733 7.702 -0.379 1.00 0.00 C ATOM 376 O GLY A 24 -8.615 7.384 -0.788 1.00 0.00 O ATOM 0 H GLY A 24 -8.264 6.586 1.358 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -10.990 6.727 1.059 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -10.514 8.353 1.508 1.00 0.00 H new ATOM 380 N VAL A 25 -10.649 8.300 -1.146 1.00 0.00 N ATOM 381 CA VAL A 25 -10.452 8.616 -2.551 1.00 0.00 C ATOM 382 C VAL A 25 -11.131 9.948 -2.865 1.00 0.00 C ATOM 383 O VAL A 25 -12.100 10.329 -2.208 1.00 0.00 O ATOM 384 CB VAL A 25 -11.003 7.466 -3.408 1.00 0.00 C ATOM 385 CG1 VAL A 25 -12.501 7.272 -3.183 1.00 0.00 C ATOM 386 CG2 VAL A 25 -10.756 7.710 -4.894 1.00 0.00 C ATOM 0 H VAL A 25 -11.564 8.581 -0.794 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.392 8.722 -2.781 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.472 6.566 -3.098 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -12.859 6.451 -3.804 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.684 7.040 -2.134 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -13.030 8.187 -3.450 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -11.158 6.877 -5.471 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.249 8.634 -5.198 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -9.685 7.793 -5.076 1.00 0.00 H new ATOM 396 N SER A 26 -10.615 10.653 -3.877 1.00 0.00 N ATOM 397 CA SER A 26 -11.074 11.982 -4.251 1.00 0.00 C ATOM 398 C SER A 26 -10.908 12.168 -5.756 1.00 0.00 C ATOM 399 O SER A 26 -10.128 13.006 -6.205 1.00 0.00 O ATOM 400 CB SER A 26 -10.282 13.048 -3.486 1.00 0.00 C ATOM 401 OG SER A 26 -10.483 12.905 -2.095 1.00 0.00 O ATOM 0 H SER A 26 -9.856 10.306 -4.464 1.00 0.00 H new ATOM 0 HA SER A 26 -12.128 12.089 -3.993 1.00 0.00 H new ATOM 0 HB2 SER A 26 -9.221 12.958 -3.718 1.00 0.00 H new ATOM 0 HB3 SER A 26 -10.595 14.042 -3.805 1.00 0.00 H new ATOM 0 HG SER A 26 -9.970 13.591 -1.618 1.00 0.00 H new ATOM 407 N GLY A 27 -11.647 11.378 -6.542 1.00 0.00 N ATOM 408 CA GLY A 27 -11.546 11.450 -7.987 1.00 0.00 C ATOM 409 C GLY A 27 -10.252 10.789 -8.440 1.00 0.00 C ATOM 410 O GLY A 27 -9.952 9.665 -8.034 1.00 0.00 O ATOM 0 H GLY A 27 -12.315 10.689 -6.196 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -12.401 10.954 -8.447 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -11.569 12.490 -8.312 1.00 0.00 H new ATOM 414 N GLN A 28 -9.479 11.480 -9.281 1.00 0.00 N ATOM 415 CA GLN A 28 -8.197 10.970 -9.738 1.00 0.00 C ATOM 416 C GLN A 28 -7.177 10.972 -8.595 1.00 0.00 C ATOM 417 O GLN A 28 -6.086 10.425 -8.748 1.00 0.00 O ATOM 418 CB GLN A 28 -7.722 11.818 -10.924 1.00 0.00 C ATOM 419 CG GLN A 28 -6.516 11.182 -11.625 1.00 0.00 C ATOM 420 CD GLN A 28 -6.105 11.948 -12.877 1.00 0.00 C ATOM 421 OE1 GLN A 28 -6.772 12.890 -13.295 1.00 0.00 O ATOM 422 NE2 GLN A 28 -4.998 11.541 -13.490 1.00 0.00 N ATOM 0 H GLN A 28 -9.725 12.396 -9.657 1.00 0.00 H new ATOM 0 HA GLN A 28 -8.304 9.936 -10.066 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -8.538 11.936 -11.637 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -7.456 12.816 -10.575 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -5.675 11.143 -10.933 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -6.755 10.153 -11.893 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -4.467 10.754 -13.115 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -4.679 12.015 -14.335 1.00 0.00 H new ATOM 431 N GLN A 29 -7.510 11.575 -7.446 1.00 0.00 N ATOM 432 CA GLN A 29 -6.618 11.573 -6.292 1.00 0.00 C ATOM 433 C GLN A 29 -7.034 10.482 -5.310 1.00 0.00 C ATOM 434 O GLN A 29 -8.168 10.003 -5.332 1.00 0.00 O ATOM 435 CB GLN A 29 -6.624 12.932 -5.584 1.00 0.00 C ATOM 436 CG GLN A 29 -6.245 14.078 -6.527 1.00 0.00 C ATOM 437 CD GLN A 29 -6.179 15.405 -5.787 1.00 0.00 C ATOM 438 OE1 GLN A 29 -6.855 16.361 -6.145 1.00 0.00 O ATOM 439 NE2 GLN A 29 -5.360 15.472 -4.737 1.00 0.00 N ATOM 0 H GLN A 29 -8.390 12.068 -7.297 1.00 0.00 H new ATOM 0 HA GLN A 29 -5.607 11.376 -6.650 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.614 13.119 -5.168 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -5.926 12.907 -4.747 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.280 13.868 -6.988 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -6.976 14.145 -7.333 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.811 14.656 -4.466 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.283 16.339 -4.205 1.00 0.00 H new ATOM 448 N VAL A 30 -6.095 10.097 -4.442 1.00 0.00 N ATOM 449 CA VAL A 30 -6.254 9.004 -3.490 1.00 0.00 C ATOM 450 C VAL A 30 -5.546 9.358 -2.188 1.00 0.00 C ATOM 451 O VAL A 30 -4.545 10.074 -2.203 1.00 0.00 O ATOM 452 CB VAL A 30 -5.660 7.727 -4.103 1.00 0.00 C ATOM 453 CG1 VAL A 30 -5.580 6.608 -3.070 1.00 0.00 C ATOM 454 CG2 VAL A 30 -6.517 7.249 -5.273 1.00 0.00 C ATOM 0 H VAL A 30 -5.183 10.550 -4.383 1.00 0.00 H new ATOM 0 HA VAL A 30 -7.309 8.839 -3.273 1.00 0.00 H new ATOM 0 HB VAL A 30 -4.656 7.969 -4.451 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.156 5.716 -3.532 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.947 6.923 -2.240 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.580 6.384 -2.699 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.082 6.343 -5.696 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -7.527 7.037 -4.922 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -6.554 8.025 -6.038 1.00 0.00 H new ATOM 464 N ARG A 31 -6.065 8.854 -1.066 1.00 0.00 N ATOM 465 CA ARG A 31 -5.538 9.139 0.263 1.00 0.00 C ATOM 466 C ARG A 31 -5.221 7.815 0.945 1.00 0.00 C ATOM 467 O ARG A 31 -6.115 7.002 1.181 1.00 0.00 O ATOM 468 CB ARG A 31 -6.583 9.937 1.046 1.00 0.00 C ATOM 469 CG ARG A 31 -6.008 11.169 1.746 1.00 0.00 C ATOM 470 CD ARG A 31 -5.043 10.856 2.894 1.00 0.00 C ATOM 471 NE ARG A 31 -4.764 12.080 3.649 1.00 0.00 N ATOM 472 CZ ARG A 31 -5.348 12.385 4.814 1.00 0.00 C ATOM 473 NH1 ARG A 31 -6.191 11.540 5.400 1.00 0.00 N ATOM 474 NH2 ARG A 31 -5.098 13.546 5.402 1.00 0.00 N ATOM 0 H ARG A 31 -6.872 8.230 -1.059 1.00 0.00 H new ATOM 0 HA ARG A 31 -4.625 9.732 0.211 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -7.374 10.251 0.365 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -7.043 9.287 1.790 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -5.489 11.781 1.008 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -6.832 11.768 2.134 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -5.476 10.102 3.551 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -4.116 10.440 2.500 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.086 12.738 3.265 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.401 10.643 4.962 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.627 11.788 6.288 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.459 14.211 4.967 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.545 13.775 6.290 1.00 0.00 H new ATOM 488 N ILE A 32 -3.947 7.599 1.261 1.00 0.00 N ATOM 489 CA ILE A 32 -3.465 6.339 1.807 1.00 0.00 C ATOM 490 C ILE A 32 -2.541 6.587 2.989 1.00 0.00 C ATOM 491 O ILE A 32 -1.948 7.656 3.122 1.00 0.00 O ATOM 492 CB ILE A 32 -2.731 5.527 0.728 1.00 0.00 C ATOM 493 CG1 ILE A 32 -1.716 6.404 -0.015 1.00 0.00 C ATOM 494 CG2 ILE A 32 -3.746 4.917 -0.241 1.00 0.00 C ATOM 495 CD1 ILE A 32 -0.955 5.617 -1.082 1.00 0.00 C ATOM 0 H ILE A 32 -3.216 8.301 1.143 1.00 0.00 H new ATOM 0 HA ILE A 32 -4.327 5.767 2.150 1.00 0.00 H new ATOM 0 HB ILE A 32 -2.179 4.718 1.207 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.234 7.242 -0.482 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.008 6.825 0.699 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -3.221 4.342 -1.004 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.422 4.260 0.306 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.319 5.713 -0.717 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.247 6.276 -1.584 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -0.415 4.795 -0.612 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -1.660 5.218 -1.812 1.00 0.00 H new ATOM 507 N GLY A 33 -2.421 5.582 3.855 1.00 0.00 N ATOM 508 CA GLY A 33 -1.575 5.664 5.030 1.00 0.00 C ATOM 509 C GLY A 33 -0.588 4.506 5.043 1.00 0.00 C ATOM 510 O GLY A 33 -0.788 3.501 4.361 1.00 0.00 O ATOM 0 H GLY A 33 -2.909 4.692 3.756 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -1.036 6.612 5.035 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -2.187 5.641 5.931 1.00 0.00 H new ATOM 514 N ILE A 34 0.480 4.661 5.824 1.00 0.00 N ATOM 515 CA ILE A 34 1.560 3.693 5.898 1.00 0.00 C ATOM 516 C ILE A 34 1.913 3.515 7.368 1.00 0.00 C ATOM 517 O ILE A 34 2.044 4.492 8.107 1.00 0.00 O ATOM 518 CB ILE A 34 2.797 4.175 5.120 1.00 0.00 C ATOM 519 CG1 ILE A 34 2.542 4.327 3.614 1.00 0.00 C ATOM 520 CG2 ILE A 34 3.930 3.159 5.294 1.00 0.00 C ATOM 521 CD1 ILE A 34 2.007 5.715 3.250 1.00 0.00 C ATOM 0 H ILE A 34 0.616 5.472 6.427 1.00 0.00 H new ATOM 0 HA ILE A 34 1.241 2.751 5.451 1.00 0.00 H new ATOM 0 HB ILE A 34 3.054 5.154 5.524 1.00 0.00 H new ATOM 0 HG12 ILE A 34 3.469 4.144 3.071 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.828 3.569 3.291 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.809 3.496 4.744 1.00 0.00 H new ATOM 0 HG22 ILE A 34 4.177 3.067 6.352 1.00 0.00 H new ATOM 0 HG23 ILE A 34 3.612 2.190 4.910 1.00 0.00 H new ATOM 0 HD11 ILE A 34 1.843 5.771 2.174 1.00 0.00 H new ATOM 0 HD12 ILE A 34 1.065 5.890 3.770 1.00 0.00 H new ATOM 0 HD13 ILE A 34 2.731 6.473 3.547 1.00 0.00 H new ATOM 533 N ASN A 35 2.066 2.262 7.793 1.00 0.00 N ATOM 534 CA ASN A 35 2.318 1.918 9.175 1.00 0.00 C ATOM 535 C ASN A 35 3.523 0.994 9.255 1.00 0.00 C ATOM 536 O ASN A 35 3.419 -0.210 9.483 1.00 0.00 O ATOM 537 CB ASN A 35 1.057 1.312 9.784 1.00 0.00 C ATOM 538 CG ASN A 35 1.071 1.375 11.300 1.00 0.00 C ATOM 539 OD1 ASN A 35 2.120 1.273 11.931 1.00 0.00 O ATOM 540 ND2 ASN A 35 -0.103 1.544 11.901 1.00 0.00 N ATOM 0 H ASN A 35 2.016 1.454 7.173 1.00 0.00 H new ATOM 0 HA ASN A 35 2.559 2.806 9.759 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.182 1.842 9.407 1.00 0.00 H new ATOM 0 HB3 ASN A 35 0.963 0.274 9.465 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -0.153 1.593 12.919 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -0.954 1.625 11.344 1.00 0.00 H new ATOM 547 N ALA A 36 4.685 1.611 9.052 1.00 0.00 N ATOM 548 CA ALA A 36 5.992 0.978 9.141 1.00 0.00 C ATOM 549 C ALA A 36 6.777 1.673 10.247 1.00 0.00 C ATOM 550 O ALA A 36 6.462 2.811 10.601 1.00 0.00 O ATOM 551 CB ALA A 36 6.700 1.130 7.795 1.00 0.00 C ATOM 0 H ALA A 36 4.741 2.601 8.813 1.00 0.00 H new ATOM 0 HA ALA A 36 5.906 -0.084 9.373 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.682 0.660 7.845 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.108 0.650 7.016 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.816 2.189 7.562 1.00 0.00 H new ATOM 557 N PRO A 37 7.798 1.012 10.804 1.00 0.00 N ATOM 558 CA PRO A 37 8.602 1.589 11.856 1.00 0.00 C ATOM 559 C PRO A 37 9.494 2.667 11.257 1.00 0.00 C ATOM 560 O PRO A 37 9.831 2.613 10.076 1.00 0.00 O ATOM 561 CB PRO A 37 9.420 0.423 12.409 1.00 0.00 C ATOM 562 CG PRO A 37 9.573 -0.501 11.201 1.00 0.00 C ATOM 563 CD PRO A 37 8.250 -0.322 10.468 1.00 0.00 C ATOM 0 HA PRO A 37 8.016 2.061 12.645 1.00 0.00 H new ATOM 0 HB2 PRO A 37 10.387 0.754 12.788 1.00 0.00 H new ATOM 0 HB3 PRO A 37 8.907 -0.073 13.233 1.00 0.00 H new ATOM 0 HG2 PRO A 37 10.422 -0.216 10.579 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.732 -1.537 11.502 1.00 0.00 H new ATOM 0 HD2 PRO A 37 8.380 -0.433 9.391 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.524 -1.073 10.780 1.00 0.00 H new ATOM 571 N LYS A 38 9.885 3.652 12.065 1.00 0.00 N ATOM 572 CA LYS A 38 10.769 4.700 11.586 1.00 0.00 C ATOM 573 C LYS A 38 12.179 4.154 11.390 1.00 0.00 C ATOM 574 O LYS A 38 13.080 4.876 10.969 1.00 0.00 O ATOM 575 CB LYS A 38 10.711 5.898 12.534 1.00 0.00 C ATOM 576 CG LYS A 38 9.252 6.369 12.552 1.00 0.00 C ATOM 577 CD LYS A 38 9.056 7.672 13.324 1.00 0.00 C ATOM 578 CE LYS A 38 9.818 8.820 12.663 1.00 0.00 C ATOM 579 NZ LYS A 38 9.549 10.099 13.349 1.00 0.00 N ATOM 0 H LYS A 38 9.605 3.742 13.042 1.00 0.00 H new ATOM 0 HA LYS A 38 10.438 5.052 10.609 1.00 0.00 H new ATOM 0 HB2 LYS A 38 11.040 5.617 13.534 1.00 0.00 H new ATOM 0 HB3 LYS A 38 11.372 6.695 12.193 1.00 0.00 H new ATOM 0 HG2 LYS A 38 8.907 6.505 11.527 1.00 0.00 H new ATOM 0 HG3 LYS A 38 8.630 5.592 12.997 1.00 0.00 H new ATOM 0 HD2 LYS A 38 7.994 7.915 13.371 1.00 0.00 H new ATOM 0 HD3 LYS A 38 9.400 7.546 14.351 1.00 0.00 H new ATOM 0 HE2 LYS A 38 10.887 8.610 12.683 1.00 0.00 H new ATOM 0 HE3 LYS A 38 9.528 8.898 11.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 10.078 10.862 12.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 8.531 10.308 13.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 9.848 10.030 14.343 1.00 0.00 H new ATOM 593 N ASP A 39 12.367 2.865 11.700 1.00 0.00 N ATOM 594 CA ASP A 39 13.592 2.141 11.411 1.00 0.00 C ATOM 595 C ASP A 39 13.719 1.887 9.906 1.00 0.00 C ATOM 596 O ASP A 39 14.792 1.504 9.441 1.00 0.00 O ATOM 597 CB ASP A 39 13.605 0.816 12.172 1.00 0.00 C ATOM 598 CG ASP A 39 13.636 1.039 13.683 1.00 0.00 C ATOM 599 OD1 ASP A 39 14.752 1.241 14.214 1.00 0.00 O ATOM 600 OD2 ASP A 39 12.542 1.007 14.293 1.00 0.00 O ATOM 0 H ASP A 39 11.658 2.297 12.164 1.00 0.00 H new ATOM 0 HA ASP A 39 14.441 2.744 11.733 1.00 0.00 H new ATOM 0 HB2 ASP A 39 12.722 0.234 11.907 1.00 0.00 H new ATOM 0 HB3 ASP A 39 14.474 0.231 11.871 1.00 0.00 H new ATOM 605 N VAL A 40 12.637 2.098 9.141 1.00 0.00 N ATOM 606 CA VAL A 40 12.692 2.035 7.691 1.00 0.00 C ATOM 607 C VAL A 40 12.164 3.329 7.078 1.00 0.00 C ATOM 608 O VAL A 40 11.233 3.958 7.584 1.00 0.00 O ATOM 609 CB VAL A 40 11.940 0.812 7.149 1.00 0.00 C ATOM 610 CG1 VAL A 40 12.482 -0.475 7.770 1.00 0.00 C ATOM 611 CG2 VAL A 40 10.435 0.901 7.389 1.00 0.00 C ATOM 0 H VAL A 40 11.713 2.314 9.515 1.00 0.00 H new ATOM 0 HA VAL A 40 13.736 1.922 7.400 1.00 0.00 H new ATOM 0 HB VAL A 40 12.106 0.797 6.072 1.00 0.00 H new ATOM 0 HG11 VAL A 40 11.935 -1.330 7.372 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.540 -0.578 7.529 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.358 -0.437 8.852 1.00 0.00 H new ATOM 0 HG21 VAL A 40 9.949 0.012 6.987 1.00 0.00 H new ATOM 0 HG22 VAL A 40 10.241 0.968 8.459 1.00 0.00 H new ATOM 0 HG23 VAL A 40 10.039 1.787 6.892 1.00 0.00 H new ATOM 621 N ALA A 41 12.786 3.714 5.964 1.00 0.00 N ATOM 622 CA ALA A 41 12.469 4.944 5.257 1.00 0.00 C ATOM 623 C ALA A 41 11.135 4.809 4.528 1.00 0.00 C ATOM 624 O ALA A 41 10.780 3.727 4.068 1.00 0.00 O ATOM 625 CB ALA A 41 13.585 5.244 4.261 1.00 0.00 C ATOM 0 H ALA A 41 13.531 3.172 5.527 1.00 0.00 H new ATOM 0 HA ALA A 41 12.385 5.763 5.972 1.00 0.00 H new ATOM 0 HB1 ALA A 41 13.357 6.165 3.725 1.00 0.00 H new ATOM 0 HB2 ALA A 41 14.528 5.359 4.795 1.00 0.00 H new ATOM 0 HB3 ALA A 41 13.669 4.422 3.550 1.00 0.00 H new ATOM 631 N VAL A 42 10.402 5.916 4.426 1.00 0.00 N ATOM 632 CA VAL A 42 9.130 5.967 3.722 1.00 0.00 C ATOM 633 C VAL A 42 8.996 7.350 3.094 1.00 0.00 C ATOM 634 O VAL A 42 8.916 8.346 3.810 1.00 0.00 O ATOM 635 CB VAL A 42 7.983 5.718 4.707 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.636 5.805 4.000 1.00 0.00 C ATOM 637 CG2 VAL A 42 8.075 4.336 5.351 1.00 0.00 C ATOM 0 H VAL A 42 10.680 6.808 4.834 1.00 0.00 H new ATOM 0 HA VAL A 42 9.089 5.200 2.949 1.00 0.00 H new ATOM 0 HB VAL A 42 8.067 6.486 5.475 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.836 5.625 4.718 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.517 6.797 3.565 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.590 5.055 3.210 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.243 4.201 6.042 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.032 3.570 4.577 1.00 0.00 H new ATOM 0 HG23 VAL A 42 9.016 4.250 5.894 1.00 0.00 H new ATOM 647 N HIS A 43 8.970 7.414 1.761 1.00 0.00 N ATOM 648 CA HIS A 43 8.871 8.680 1.050 1.00 0.00 C ATOM 649 C HIS A 43 8.203 8.496 -0.306 1.00 0.00 C ATOM 650 O HIS A 43 8.086 7.375 -0.802 1.00 0.00 O ATOM 651 CB HIS A 43 10.262 9.283 0.825 1.00 0.00 C ATOM 652 CG HIS A 43 11.090 9.458 2.066 1.00 0.00 C ATOM 653 ND1 HIS A 43 11.174 10.631 2.819 1.00 0.00 N ATOM 654 CD2 HIS A 43 11.888 8.504 2.637 1.00 0.00 C ATOM 655 CE1 HIS A 43 12.022 10.358 3.821 1.00 0.00 C ATOM 656 NE2 HIS A 43 12.464 9.089 3.741 1.00 0.00 N ATOM 0 H HIS A 43 9.017 6.596 1.154 1.00 0.00 H new ATOM 0 HA HIS A 43 8.269 9.349 1.665 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.809 8.646 0.129 1.00 0.00 H new ATOM 0 HB3 HIS A 43 10.146 10.254 0.344 1.00 0.00 H new ATOM 0 HD2 HIS A 43 12.036 7.492 2.290 1.00 0.00 H new ATOM 0 HE1 HIS A 43 12.311 11.061 4.588 1.00 0.00 H new ATOM 0 HE2 HIS A 43 13.113 8.639 4.387 1.00 0.00 H new ATOM 664 N ARG A 44 7.765 9.604 -0.903 1.00 0.00 N ATOM 665 CA ARG A 44 7.221 9.608 -2.253 1.00 0.00 C ATOM 666 C ARG A 44 8.354 9.398 -3.261 1.00 0.00 C ATOM 667 O ARG A 44 9.520 9.594 -2.930 1.00 0.00 O ATOM 668 CB ARG A 44 6.485 10.932 -2.481 1.00 0.00 C ATOM 669 CG ARG A 44 7.483 12.080 -2.606 1.00 0.00 C ATOM 670 CD ARG A 44 6.766 13.429 -2.679 1.00 0.00 C ATOM 671 NE ARG A 44 6.319 13.859 -1.356 1.00 0.00 N ATOM 672 CZ ARG A 44 6.409 15.116 -0.916 1.00 0.00 C ATOM 673 NH1 ARG A 44 6.840 16.097 -1.702 1.00 0.00 N ATOM 674 NH2 ARG A 44 6.064 15.414 0.325 1.00 0.00 N ATOM 0 H ARG A 44 7.779 10.523 -0.461 1.00 0.00 H new ATOM 0 HA ARG A 44 6.509 8.794 -2.388 1.00 0.00 H new ATOM 0 HB2 ARG A 44 5.879 10.868 -3.385 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.802 11.123 -1.653 1.00 0.00 H new ATOM 0 HG2 ARG A 44 8.161 12.071 -1.752 1.00 0.00 H new ATOM 0 HG3 ARG A 44 8.093 11.940 -3.499 1.00 0.00 H new ATOM 0 HD2 ARG A 44 7.436 14.178 -3.101 1.00 0.00 H new ATOM 0 HD3 ARG A 44 5.910 13.353 -3.349 1.00 0.00 H new ATOM 0 HE ARG A 44 5.915 13.159 -0.733 1.00 0.00 H new ATOM 0 HH11 ARG A 44 7.111 15.897 -2.665 1.00 0.00 H new ATOM 0 HH12 ARG A 44 6.900 17.050 -1.342 1.00 0.00 H new ATOM 0 HH21 ARG A 44 5.727 14.682 0.951 1.00 0.00 H new ATOM 0 HH22 ARG A 44 6.134 16.376 0.657 1.00 0.00 H new ATOM 688 N GLU A 45 8.023 8.999 -4.488 1.00 0.00 N ATOM 689 CA GLU A 45 9.032 8.699 -5.501 1.00 0.00 C ATOM 690 C GLU A 45 9.752 9.947 -5.995 1.00 0.00 C ATOM 691 O GLU A 45 10.960 9.916 -6.216 1.00 0.00 O ATOM 692 CB GLU A 45 8.353 8.049 -6.702 1.00 0.00 C ATOM 693 CG GLU A 45 7.985 6.597 -6.417 1.00 0.00 C ATOM 694 CD GLU A 45 9.197 5.680 -6.565 1.00 0.00 C ATOM 695 OE1 GLU A 45 9.963 5.564 -5.585 1.00 0.00 O ATOM 696 OE2 GLU A 45 9.346 5.096 -7.662 1.00 0.00 O ATOM 0 H GLU A 45 7.061 8.876 -4.805 1.00 0.00 H new ATOM 0 HA GLU A 45 9.765 8.038 -5.039 1.00 0.00 H new ATOM 0 HB2 GLU A 45 7.454 8.609 -6.961 1.00 0.00 H new ATOM 0 HB3 GLU A 45 9.017 8.095 -7.565 1.00 0.00 H new ATOM 0 HG2 GLU A 45 7.583 6.513 -5.407 1.00 0.00 H new ATOM 0 HG3 GLU A 45 7.199 6.278 -7.101 1.00 0.00 H new ATOM 703 N GLU A 46 9.020 11.046 -6.172 1.00 0.00 N ATOM 704 CA GLU A 46 9.604 12.296 -6.648 1.00 0.00 C ATOM 705 C GLU A 46 10.526 12.952 -5.613 1.00 0.00 C ATOM 706 O GLU A 46 11.032 14.046 -5.853 1.00 0.00 O ATOM 707 CB GLU A 46 8.512 13.265 -7.121 1.00 0.00 C ATOM 708 CG GLU A 46 7.494 13.623 -6.040 1.00 0.00 C ATOM 709 CD GLU A 46 6.260 12.725 -6.091 1.00 0.00 C ATOM 710 OE1 GLU A 46 6.370 11.548 -5.682 1.00 0.00 O ATOM 711 OE2 GLU A 46 5.207 13.225 -6.543 1.00 0.00 O ATOM 0 H GLU A 46 8.017 11.094 -5.992 1.00 0.00 H new ATOM 0 HA GLU A 46 10.233 12.046 -7.502 1.00 0.00 H new ATOM 0 HB2 GLU A 46 8.983 14.180 -7.481 1.00 0.00 H new ATOM 0 HB3 GLU A 46 7.988 12.822 -7.968 1.00 0.00 H new ATOM 0 HG2 GLU A 46 7.963 13.539 -5.060 1.00 0.00 H new ATOM 0 HG3 GLU A 46 7.190 14.663 -6.159 1.00 0.00 H new ATOM 718 N ILE A 47 10.756 12.300 -4.466 1.00 0.00 N ATOM 719 CA ILE A 47 11.700 12.783 -3.471 1.00 0.00 C ATOM 720 C ILE A 47 12.618 11.659 -3.009 1.00 0.00 C ATOM 721 O ILE A 47 13.753 11.928 -2.624 1.00 0.00 O ATOM 722 CB ILE A 47 10.952 13.434 -2.296 1.00 0.00 C ATOM 723 CG1 ILE A 47 10.457 14.819 -2.726 1.00 0.00 C ATOM 724 CG2 ILE A 47 11.837 13.566 -1.049 1.00 0.00 C ATOM 725 CD1 ILE A 47 10.044 15.677 -1.532 1.00 0.00 C ATOM 0 H ILE A 47 10.292 11.429 -4.210 1.00 0.00 H new ATOM 0 HA ILE A 47 12.330 13.548 -3.924 1.00 0.00 H new ATOM 0 HB ILE A 47 10.112 12.791 -2.032 1.00 0.00 H new ATOM 0 HG12 ILE A 47 11.244 15.328 -3.283 1.00 0.00 H new ATOM 0 HG13 ILE A 47 9.609 14.707 -3.402 1.00 0.00 H new ATOM 0 HG21 ILE A 47 11.266 14.031 -0.245 1.00 0.00 H new ATOM 0 HG22 ILE A 47 12.170 12.577 -0.733 1.00 0.00 H new ATOM 0 HG23 ILE A 47 12.704 14.183 -1.282 1.00 0.00 H new ATOM 0 HD11 ILE A 47 9.700 16.649 -1.884 1.00 0.00 H new ATOM 0 HD12 ILE A 47 9.239 15.182 -0.990 1.00 0.00 H new ATOM 0 HD13 ILE A 47 10.898 15.813 -0.869 1.00 0.00 H new ATOM 737 N TYR A 48 12.180 10.399 -3.032 1.00 0.00 N ATOM 738 CA TYR A 48 13.037 9.333 -2.545 1.00 0.00 C ATOM 739 C TYR A 48 14.289 9.236 -3.410 1.00 0.00 C ATOM 740 O TYR A 48 15.378 8.944 -2.918 1.00 0.00 O ATOM 741 CB TYR A 48 12.297 8.001 -2.559 1.00 0.00 C ATOM 742 CG TYR A 48 13.188 6.900 -2.039 1.00 0.00 C ATOM 743 CD1 TYR A 48 13.266 6.666 -0.660 1.00 0.00 C ATOM 744 CD2 TYR A 48 13.943 6.129 -2.934 1.00 0.00 C ATOM 745 CE1 TYR A 48 14.109 5.663 -0.166 1.00 0.00 C ATOM 746 CE2 TYR A 48 14.796 5.129 -2.448 1.00 0.00 C ATOM 747 CZ TYR A 48 14.868 4.880 -1.062 1.00 0.00 C ATOM 748 OH TYR A 48 15.674 3.891 -0.586 1.00 0.00 O ATOM 0 H TYR A 48 11.265 10.104 -3.373 1.00 0.00 H new ATOM 0 HA TYR A 48 13.324 9.562 -1.519 1.00 0.00 H new ATOM 0 HB2 TYR A 48 11.398 8.070 -1.946 1.00 0.00 H new ATOM 0 HB3 TYR A 48 11.974 7.768 -3.574 1.00 0.00 H new ATOM 0 HD1 TYR A 48 12.676 7.259 0.022 1.00 0.00 H new ATOM 0 HD2 TYR A 48 13.867 6.306 -3.997 1.00 0.00 H new ATOM 0 HE1 TYR A 48 14.178 5.489 0.898 1.00 0.00 H new ATOM 0 HE2 TYR A 48 15.397 4.550 -3.134 1.00 0.00 H new ATOM 0 HH TYR A 48 15.166 3.323 0.030 1.00 0.00 H new ATOM 758 N GLN A 49 14.128 9.489 -4.707 1.00 0.00 N ATOM 759 CA GLN A 49 15.212 9.398 -5.661 1.00 0.00 C ATOM 760 C GLN A 49 16.174 10.575 -5.509 1.00 0.00 C ATOM 761 O GLN A 49 17.289 10.526 -6.025 1.00 0.00 O ATOM 762 CB GLN A 49 14.617 9.358 -7.070 1.00 0.00 C ATOM 763 CG GLN A 49 13.628 8.195 -7.160 1.00 0.00 C ATOM 764 CD GLN A 49 13.017 8.085 -8.546 1.00 0.00 C ATOM 765 OE1 GLN A 49 13.626 7.535 -9.462 1.00 0.00 O ATOM 766 NE2 GLN A 49 11.805 8.610 -8.712 1.00 0.00 N ATOM 0 H GLN A 49 13.236 9.763 -5.119 1.00 0.00 H new ATOM 0 HA GLN A 49 15.785 8.489 -5.478 1.00 0.00 H new ATOM 0 HB2 GLN A 49 14.113 10.299 -7.293 1.00 0.00 H new ATOM 0 HB3 GLN A 49 15.408 9.237 -7.810 1.00 0.00 H new ATOM 0 HG2 GLN A 49 14.137 7.264 -6.912 1.00 0.00 H new ATOM 0 HG3 GLN A 49 12.837 8.332 -6.423 1.00 0.00 H new ATOM 0 HE21 GLN A 49 11.332 9.058 -7.928 1.00 0.00 H new ATOM 0 HE22 GLN A 49 11.350 8.564 -9.624 1.00 0.00 H new ATOM 775 N ARG A 50 15.744 11.630 -4.804 1.00 0.00 N ATOM 776 CA ARG A 50 16.596 12.780 -4.520 1.00 0.00 C ATOM 777 C ARG A 50 17.281 12.598 -3.167 1.00 0.00 C ATOM 778 O ARG A 50 18.346 13.166 -2.942 1.00 0.00 O ATOM 779 CB ARG A 50 15.780 14.078 -4.607 1.00 0.00 C ATOM 780 CG ARG A 50 15.387 14.646 -3.240 1.00 0.00 C ATOM 781 CD ARG A 50 14.365 15.773 -3.405 1.00 0.00 C ATOM 782 NE ARG A 50 14.914 16.889 -4.188 1.00 0.00 N ATOM 783 CZ ARG A 50 14.442 17.300 -5.369 1.00 0.00 C ATOM 784 NH1 ARG A 50 13.397 16.707 -5.943 1.00 0.00 N ATOM 785 NH2 ARG A 50 15.020 18.326 -5.987 1.00 0.00 N ATOM 0 H ARG A 50 14.802 11.705 -4.419 1.00 0.00 H new ATOM 0 HA ARG A 50 17.384 12.853 -5.270 1.00 0.00 H new ATOM 0 HB2 ARG A 50 16.359 14.826 -5.149 1.00 0.00 H new ATOM 0 HB3 ARG A 50 14.876 13.891 -5.187 1.00 0.00 H new ATOM 0 HG2 ARG A 50 14.969 13.855 -2.617 1.00 0.00 H new ATOM 0 HG3 ARG A 50 16.272 15.021 -2.727 1.00 0.00 H new ATOM 0 HD2 ARG A 50 13.472 15.387 -3.897 1.00 0.00 H new ATOM 0 HD3 ARG A 50 14.057 16.133 -2.423 1.00 0.00 H new ATOM 0 HE ARG A 50 15.715 17.387 -3.801 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.939 15.921 -5.481 1.00 0.00 H new ATOM 0 HH12 ARG A 50 13.054 17.038 -6.845 1.00 0.00 H new ATOM 0 HH21 ARG A 50 15.819 18.795 -5.560 1.00 0.00 H new ATOM 0 HH22 ARG A 50 14.664 18.644 -6.888 1.00 0.00 H new ATOM 799 N ILE A 51 16.674 11.816 -2.268 1.00 0.00 N ATOM 800 CA ILE A 51 17.278 11.484 -0.984 1.00 0.00 C ATOM 801 C ILE A 51 18.432 10.520 -1.228 1.00 0.00 C ATOM 802 O ILE A 51 19.551 10.736 -0.765 1.00 0.00 O ATOM 803 CB ILE A 51 16.231 10.837 -0.066 1.00 0.00 C ATOM 804 CG1 ILE A 51 15.159 11.858 0.310 1.00 0.00 C ATOM 805 CG2 ILE A 51 16.865 10.322 1.231 1.00 0.00 C ATOM 806 CD1 ILE A 51 13.980 11.176 0.999 1.00 0.00 C ATOM 0 H ILE A 51 15.754 11.400 -2.414 1.00 0.00 H new ATOM 0 HA ILE A 51 17.648 12.387 -0.499 1.00 0.00 H new ATOM 0 HB ILE A 51 15.795 10.002 -0.614 1.00 0.00 H new ATOM 0 HG12 ILE A 51 15.585 12.613 0.971 1.00 0.00 H new ATOM 0 HG13 ILE A 51 14.813 12.376 -0.585 1.00 0.00 H new ATOM 0 HG21 ILE A 51 16.096 9.870 1.858 1.00 0.00 H new ATOM 0 HG22 ILE A 51 17.624 9.577 0.994 1.00 0.00 H new ATOM 0 HG23 ILE A 51 17.326 11.153 1.765 1.00 0.00 H new ATOM 0 HD11 ILE A 51 13.229 11.922 1.258 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.542 10.439 0.326 1.00 0.00 H new ATOM 0 HD13 ILE A 51 14.326 10.680 1.906 1.00 0.00 H new ATOM 818 N GLN A 52 18.155 9.440 -1.962 1.00 0.00 N ATOM 819 CA GLN A 52 19.131 8.397 -2.226 1.00 0.00 C ATOM 820 C GLN A 52 20.184 8.855 -3.231 1.00 0.00 C ATOM 821 O GLN A 52 21.027 8.060 -3.645 1.00 0.00 O ATOM 822 CB GLN A 52 18.398 7.124 -2.668 1.00 0.00 C ATOM 823 CG GLN A 52 17.505 6.634 -1.526 1.00 0.00 C ATOM 824 CD GLN A 52 18.237 6.622 -0.194 1.00 0.00 C ATOM 825 OE1 GLN A 52 19.254 5.956 -0.028 1.00 0.00 O ATOM 826 NE2 GLN A 52 17.713 7.369 0.776 1.00 0.00 N ATOM 0 H GLN A 52 17.244 9.270 -2.388 1.00 0.00 H new ATOM 0 HA GLN A 52 19.680 8.172 -1.312 1.00 0.00 H new ATOM 0 HB2 GLN A 52 17.797 7.326 -3.555 1.00 0.00 H new ATOM 0 HB3 GLN A 52 19.118 6.352 -2.940 1.00 0.00 H new ATOM 0 HG2 GLN A 52 16.627 7.276 -1.451 1.00 0.00 H new ATOM 0 HG3 GLN A 52 17.147 5.630 -1.752 1.00 0.00 H new ATOM 0 HE21 GLN A 52 16.866 7.910 0.602 1.00 0.00 H new ATOM 0 HE22 GLN A 52 18.159 7.400 1.693 1.00 0.00 H new ATOM 835 N ALA A 53 20.144 10.133 -3.626 1.00 0.00 N ATOM 836 CA ALA A 53 21.124 10.680 -4.545 1.00 0.00 C ATOM 837 C ALA A 53 22.487 10.852 -3.864 1.00 0.00 C ATOM 838 O ALA A 53 23.496 11.006 -4.548 1.00 0.00 O ATOM 839 CB ALA A 53 20.619 12.023 -5.073 1.00 0.00 C ATOM 0 H ALA A 53 19.438 10.801 -3.317 1.00 0.00 H new ATOM 0 HA ALA A 53 21.256 9.985 -5.374 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.351 12.440 -5.765 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.671 11.877 -5.592 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.474 12.710 -4.240 1.00 0.00 H new ATOM 845 N GLY A 54 22.527 10.831 -2.525 1.00 0.00 N ATOM 846 CA GLY A 54 23.768 10.966 -1.776 1.00 0.00 C ATOM 847 C GLY A 54 23.619 11.865 -0.548 1.00 0.00 C ATOM 848 O GLY A 54 24.625 12.281 0.029 1.00 0.00 O ATOM 0 H GLY A 54 21.699 10.720 -1.939 1.00 0.00 H new ATOM 0 HA2 GLY A 54 24.107 9.979 -1.460 1.00 0.00 H new ATOM 0 HA3 GLY A 54 24.540 11.374 -2.429 1.00 0.00 H new ATOM 852 N LEU A 55 22.380 12.170 -0.151 1.00 0.00 N ATOM 853 CA LEU A 55 22.080 13.100 0.930 1.00 0.00 C ATOM 854 C LEU A 55 20.953 12.558 1.812 1.00 0.00 C ATOM 855 O LEU A 55 20.562 11.400 1.684 1.00 0.00 O ATOM 856 CB LEU A 55 21.744 14.462 0.309 1.00 0.00 C ATOM 857 CG LEU A 55 20.593 14.403 -0.704 1.00 0.00 C ATOM 858 CD1 LEU A 55 19.232 14.259 -0.029 1.00 0.00 C ATOM 859 CD2 LEU A 55 20.592 15.697 -1.509 1.00 0.00 C ATOM 0 H LEU A 55 21.547 11.769 -0.582 1.00 0.00 H new ATOM 0 HA LEU A 55 22.942 13.220 1.586 1.00 0.00 H new ATOM 0 HB2 LEU A 55 21.483 15.161 1.104 1.00 0.00 H new ATOM 0 HB3 LEU A 55 22.632 14.857 -0.184 1.00 0.00 H new ATOM 0 HG LEU A 55 20.750 13.529 -1.337 1.00 0.00 H new ATOM 0 HD11 LEU A 55 18.451 14.222 -0.789 1.00 0.00 H new ATOM 0 HD12 LEU A 55 19.212 13.340 0.557 1.00 0.00 H new ATOM 0 HD13 LEU A 55 19.059 15.112 0.627 1.00 0.00 H new ATOM 0 HD21 LEU A 55 19.779 15.673 -2.235 1.00 0.00 H new ATOM 0 HD22 LEU A 55 20.453 16.544 -0.837 1.00 0.00 H new ATOM 0 HD23 LEU A 55 21.543 15.801 -2.032 1.00 0.00 H new ATOM 871 N THR A 56 20.428 13.396 2.709 1.00 0.00 N ATOM 872 CA THR A 56 19.306 13.026 3.563 1.00 0.00 C ATOM 873 C THR A 56 18.328 14.192 3.685 1.00 0.00 C ATOM 874 O THR A 56 18.625 15.305 3.251 1.00 0.00 O ATOM 875 CB THR A 56 19.814 12.591 4.941 1.00 0.00 C ATOM 876 OG1 THR A 56 20.568 13.628 5.533 1.00 0.00 O ATOM 877 CG2 THR A 56 20.695 11.349 4.812 1.00 0.00 C ATOM 0 H THR A 56 20.770 14.345 2.860 1.00 0.00 H new ATOM 0 HA THR A 56 18.778 12.186 3.112 1.00 0.00 H new ATOM 0 HB THR A 56 18.951 12.363 5.567 1.00 0.00 H new ATOM 0 HG1 THR A 56 20.886 13.339 6.414 1.00 0.00 H new ATOM 0 HG21 THR A 56 21.049 11.050 5.799 1.00 0.00 H new ATOM 0 HG22 THR A 56 20.116 10.536 4.373 1.00 0.00 H new ATOM 0 HG23 THR A 56 21.549 11.573 4.172 1.00 0.00 H new ATOM 885 N ALA A 57 17.159 13.935 4.281 1.00 0.00 N ATOM 886 CA ALA A 57 16.123 14.940 4.479 1.00 0.00 C ATOM 887 C ALA A 57 16.679 16.192 5.162 1.00 0.00 C ATOM 888 O ALA A 57 17.608 16.096 5.968 1.00 0.00 O ATOM 889 CB ALA A 57 15.028 14.322 5.340 1.00 0.00 C ATOM 0 H ALA A 57 16.908 13.014 4.641 1.00 0.00 H new ATOM 0 HA ALA A 57 15.729 15.247 3.510 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.238 15.054 5.504 1.00 0.00 H new ATOM 0 HB2 ALA A 57 14.615 13.450 4.833 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.447 14.019 6.299 1.00 0.00 H new ATOM 895 N PRO A 58 16.119 17.371 4.851 1.00 0.00 N ATOM 896 CA PRO A 58 16.456 18.631 5.498 1.00 0.00 C ATOM 897 C PRO A 58 16.426 18.571 7.020 1.00 0.00 C ATOM 898 O PRO A 58 17.129 19.337 7.673 1.00 0.00 O ATOM 899 CB PRO A 58 15.377 19.601 5.045 1.00 0.00 C ATOM 900 CG PRO A 58 14.969 19.078 3.671 1.00 0.00 C ATOM 901 CD PRO A 58 15.106 17.566 3.832 1.00 0.00 C ATOM 0 HA PRO A 58 17.473 18.913 5.226 1.00 0.00 H new ATOM 0 HB2 PRO A 58 14.534 19.612 5.735 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.755 20.622 4.988 1.00 0.00 H new ATOM 0 HG2 PRO A 58 13.950 19.367 3.414 1.00 0.00 H new ATOM 0 HG3 PRO A 58 15.617 19.462 2.883 1.00 0.00 H new ATOM 0 HD2 PRO A 58 14.159 17.116 4.130 1.00 0.00 H new ATOM 0 HD3 PRO A 58 15.400 17.097 2.893 1.00 0.00 H new ATOM 909 N ASP A 59 15.612 17.665 7.569 1.00 0.00 N ATOM 910 CA ASP A 59 15.464 17.425 8.996 1.00 0.00 C ATOM 911 C ASP A 59 14.843 18.597 9.762 1.00 0.00 C ATOM 912 O ASP A 59 14.439 18.434 10.913 1.00 0.00 O ATOM 913 CB ASP A 59 16.842 17.067 9.549 1.00 0.00 C ATOM 914 CG ASP A 59 16.764 16.501 10.966 1.00 0.00 C ATOM 915 OD1 ASP A 59 16.125 15.437 11.137 1.00 0.00 O ATOM 916 OD2 ASP A 59 17.348 17.137 11.873 1.00 0.00 O ATOM 0 H ASP A 59 15.018 17.058 7.004 1.00 0.00 H new ATOM 0 HA ASP A 59 14.759 16.605 9.136 1.00 0.00 H new ATOM 0 HB2 ASP A 59 17.317 16.337 8.893 1.00 0.00 H new ATOM 0 HB3 ASP A 59 17.474 17.955 9.548 1.00 0.00 H new ATOM 1635 N MET C 1 1.751 7.024 12.564 1.00 0.00 N ATOM 1636 CA MET C 1 1.425 6.514 11.222 1.00 0.00 C ATOM 1637 C MET C 1 1.630 7.609 10.184 1.00 0.00 C ATOM 1638 O MET C 1 1.059 8.688 10.311 1.00 0.00 O ATOM 1639 CB MET C 1 -0.012 5.988 11.178 1.00 0.00 C ATOM 1640 CG MET C 1 -0.242 5.155 9.916 1.00 0.00 C ATOM 1641 SD MET C 1 -1.847 4.328 9.823 1.00 0.00 S ATOM 1642 CE MET C 1 -2.904 5.770 9.542 1.00 0.00 C ATOM 0 H1 MET C 1 1.608 6.270 13.266 1.00 0.00 H new ATOM 0 H2 MET C 1 2.743 7.334 12.586 1.00 0.00 H new ATOM 0 H3 MET C 1 1.132 7.829 12.789 1.00 0.00 H new ATOM 0 HA MET C 1 2.094 5.685 10.991 1.00 0.00 H new ATOM 0 HB2 MET C 1 -0.210 5.381 12.062 1.00 0.00 H new ATOM 0 HB3 MET C 1 -0.712 6.823 11.201 1.00 0.00 H new ATOM 0 HG2 MET C 1 -0.134 5.804 9.047 1.00 0.00 H new ATOM 0 HG3 MET C 1 0.542 4.401 9.850 1.00 0.00 H new ATOM 0 HE1 MET C 1 -3.619 5.862 10.360 1.00 0.00 H new ATOM 0 HE2 MET C 1 -2.289 6.669 9.495 1.00 0.00 H new ATOM 0 HE3 MET C 1 -3.442 5.649 8.602 1.00 0.00 H new ATOM 1654 N LEU C 2 2.439 7.336 9.160 1.00 0.00 N ATOM 1655 CA LEU C 2 2.709 8.306 8.106 1.00 0.00 C ATOM 1656 C LEU C 2 1.578 8.230 7.079 1.00 0.00 C ATOM 1657 O LEU C 2 1.140 7.137 6.727 1.00 0.00 O ATOM 1658 CB LEU C 2 4.068 7.950 7.479 1.00 0.00 C ATOM 1659 CG LEU C 2 4.826 9.111 6.811 1.00 0.00 C ATOM 1660 CD1 LEU C 2 5.825 8.532 5.817 1.00 0.00 C ATOM 1661 CD2 LEU C 2 3.953 10.125 6.081 1.00 0.00 C ATOM 0 H LEU C 2 2.920 6.444 9.041 1.00 0.00 H new ATOM 0 HA LEU C 2 2.753 9.325 8.489 1.00 0.00 H new ATOM 0 HB2 LEU C 2 4.704 7.526 8.256 1.00 0.00 H new ATOM 0 HB3 LEU C 2 3.909 7.169 6.735 1.00 0.00 H new ATOM 0 HG LEU C 2 5.304 9.658 7.624 1.00 0.00 H new ATOM 0 HD11 LEU C 2 6.370 9.343 5.335 1.00 0.00 H new ATOM 0 HD12 LEU C 2 6.527 7.884 6.342 1.00 0.00 H new ATOM 0 HD13 LEU C 2 5.293 7.953 5.062 1.00 0.00 H new ATOM 0 HD21 LEU C 2 4.583 10.901 5.646 1.00 0.00 H new ATOM 0 HD22 LEU C 2 3.397 9.623 5.289 1.00 0.00 H new ATOM 0 HD23 LEU C 2 3.254 10.577 6.785 1.00 0.00 H new ATOM 1673 N ILE C 3 1.099 9.373 6.594 1.00 0.00 N ATOM 1674 CA ILE C 3 0.045 9.434 5.591 1.00 0.00 C ATOM 1675 C ILE C 3 0.511 10.277 4.417 1.00 0.00 C ATOM 1676 O ILE C 3 1.270 11.228 4.590 1.00 0.00 O ATOM 1677 CB ILE C 3 -1.235 9.994 6.218 1.00 0.00 C ATOM 1678 CG1 ILE C 3 -1.796 8.908 7.143 1.00 0.00 C ATOM 1679 CG2 ILE C 3 -2.273 10.392 5.165 1.00 0.00 C ATOM 1680 CD1 ILE C 3 -3.030 9.370 7.902 1.00 0.00 C ATOM 0 H ILE C 3 1.436 10.289 6.890 1.00 0.00 H new ATOM 0 HA ILE C 3 -0.177 8.433 5.221 1.00 0.00 H new ATOM 0 HB ILE C 3 -1.002 10.905 6.770 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -2.045 8.026 6.553 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.027 8.608 7.855 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -3.162 10.783 5.660 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -1.854 11.158 4.513 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -2.543 9.518 4.572 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -3.387 8.563 8.542 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -2.777 10.235 8.515 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -3.812 9.644 7.193 1.00 0.00 H new ATOM 1692 N LEU C 4 0.048 9.915 3.220 1.00 0.00 N ATOM 1693 CA LEU C 4 0.389 10.600 1.989 1.00 0.00 C ATOM 1694 C LEU C 4 -0.823 10.592 1.067 1.00 0.00 C ATOM 1695 O LEU C 4 -1.805 9.890 1.307 1.00 0.00 O ATOM 1696 CB LEU C 4 1.578 9.900 1.317 1.00 0.00 C ATOM 1697 CG LEU C 4 2.863 9.973 2.149 1.00 0.00 C ATOM 1698 CD1 LEU C 4 3.973 9.154 1.495 1.00 0.00 C ATOM 1699 CD2 LEU C 4 3.366 11.411 2.262 1.00 0.00 C ATOM 0 H LEU C 4 -0.583 9.125 3.085 1.00 0.00 H new ATOM 0 HA LEU C 4 0.672 11.631 2.203 1.00 0.00 H new ATOM 0 HB2 LEU C 4 1.325 8.855 1.140 1.00 0.00 H new ATOM 0 HB3 LEU C 4 1.756 10.354 0.342 1.00 0.00 H new ATOM 0 HG LEU C 4 2.623 9.580 3.137 1.00 0.00 H new ATOM 0 HD11 LEU C 4 4.877 9.218 2.100 1.00 0.00 H new ATOM 0 HD12 LEU C 4 3.660 8.113 1.419 1.00 0.00 H new ATOM 0 HD13 LEU C 4 4.175 9.546 0.498 1.00 0.00 H new ATOM 0 HD21 LEU C 4 4.279 11.431 2.858 1.00 0.00 H new ATOM 0 HD22 LEU C 4 3.574 11.803 1.266 1.00 0.00 H new ATOM 0 HD23 LEU C 4 2.605 12.026 2.743 1.00 0.00 H new ATOM 1711 N THR C 5 -0.745 11.385 0.002 1.00 0.00 N ATOM 1712 CA THR C 5 -1.809 11.507 -0.976 1.00 0.00 C ATOM 1713 C THR C 5 -1.179 11.289 -2.347 1.00 0.00 C ATOM 1714 O THR C 5 -0.074 11.764 -2.607 1.00 0.00 O ATOM 1715 CB THR C 5 -2.455 12.890 -0.808 1.00 0.00 C ATOM 1716 OG1 THR C 5 -2.835 13.025 0.541 1.00 0.00 O ATOM 1717 CG2 THR C 5 -3.714 13.077 -1.653 1.00 0.00 C ATOM 0 H THR C 5 0.069 11.964 -0.204 1.00 0.00 H new ATOM 0 HA THR C 5 -2.603 10.771 -0.850 1.00 0.00 H new ATOM 0 HB THR C 5 -1.723 13.631 -1.129 1.00 0.00 H new ATOM 0 HG1 THR C 5 -3.250 13.902 0.678 1.00 0.00 H new ATOM 0 HG21 THR C 5 -4.119 14.075 -1.486 1.00 0.00 H new ATOM 0 HG22 THR C 5 -3.465 12.958 -2.708 1.00 0.00 H new ATOM 0 HG23 THR C 5 -4.457 12.332 -1.369 1.00 0.00 H new ATOM 1725 N ARG C 6 -1.878 10.570 -3.221 1.00 0.00 N ATOM 1726 CA ARG C 6 -1.325 10.098 -4.482 1.00 0.00 C ATOM 1727 C ARG C 6 -2.400 10.201 -5.560 1.00 0.00 C ATOM 1728 O ARG C 6 -3.545 10.517 -5.241 1.00 0.00 O ATOM 1729 CB ARG C 6 -0.866 8.651 -4.255 1.00 0.00 C ATOM 1730 CG ARG C 6 0.108 8.098 -5.298 1.00 0.00 C ATOM 1731 CD ARG C 6 1.513 8.698 -5.175 1.00 0.00 C ATOM 1732 NE ARG C 6 1.634 10.024 -5.789 1.00 0.00 N ATOM 1733 CZ ARG C 6 2.783 10.703 -5.886 1.00 0.00 C ATOM 1734 NH1 ARG C 6 3.920 10.193 -5.430 1.00 0.00 N ATOM 1735 NH2 ARG C 6 2.794 11.908 -6.443 1.00 0.00 N ATOM 0 H ARG C 6 -2.850 10.298 -3.071 1.00 0.00 H new ATOM 0 HA ARG C 6 -0.475 10.694 -4.815 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -0.395 8.587 -3.274 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -1.746 8.009 -4.229 1.00 0.00 H new ATOM 0 HG2 ARG C 6 0.170 7.015 -5.193 1.00 0.00 H new ATOM 0 HG3 ARG C 6 -0.282 8.299 -6.296 1.00 0.00 H new ATOM 0 HD2 ARG C 6 1.779 8.768 -4.120 1.00 0.00 H new ATOM 0 HD3 ARG C 6 2.231 8.023 -5.641 1.00 0.00 H new ATOM 0 HE ARG C 6 0.790 10.456 -6.166 1.00 0.00 H new ATOM 0 HH11 ARG C 6 3.927 9.269 -4.997 1.00 0.00 H new ATOM 0 HH12 ARG C 6 4.787 10.725 -5.512 1.00 0.00 H new ATOM 0 HH21 ARG C 6 1.928 12.315 -6.796 1.00 0.00 H new ATOM 0 HH22 ARG C 6 3.669 12.427 -6.518 1.00 0.00 H new ATOM 1749 N LYS C 7 -2.057 9.943 -6.821 1.00 0.00 N ATOM 1750 CA LYS C 7 -3.013 10.031 -7.912 1.00 0.00 C ATOM 1751 C LYS C 7 -2.819 8.859 -8.864 1.00 0.00 C ATOM 1752 O LYS C 7 -1.720 8.314 -8.952 1.00 0.00 O ATOM 1753 CB LYS C 7 -2.832 11.365 -8.650 1.00 0.00 C ATOM 1754 CG LYS C 7 -2.712 12.524 -7.653 1.00 0.00 C ATOM 1755 CD LYS C 7 -2.639 13.862 -8.383 1.00 0.00 C ATOM 1756 CE LYS C 7 -2.287 14.954 -7.375 1.00 0.00 C ATOM 1757 NZ LYS C 7 -2.085 16.255 -8.043 1.00 0.00 N ATOM 0 H LYS C 7 -1.117 9.670 -7.109 1.00 0.00 H new ATOM 0 HA LYS C 7 -4.027 9.988 -7.513 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -1.940 11.322 -9.275 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -3.679 11.537 -9.315 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -3.568 12.519 -6.978 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -1.821 12.391 -7.039 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -1.888 13.821 -9.172 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -3.593 14.083 -8.862 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -3.084 15.042 -6.637 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -1.382 14.676 -6.835 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 -1.847 16.977 -7.333 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -1.308 16.176 -8.730 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -2.957 16.530 -8.538 1.00 0.00 H new ATOM 1771 N VAL C 8 -3.885 8.477 -9.571 1.00 0.00 N ATOM 1772 CA VAL C 8 -3.870 7.348 -10.495 1.00 0.00 C ATOM 1773 C VAL C 8 -2.687 7.472 -11.450 1.00 0.00 C ATOM 1774 O VAL C 8 -2.638 8.397 -12.256 1.00 0.00 O ATOM 1775 CB VAL C 8 -5.191 7.302 -11.265 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -5.170 6.153 -12.269 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -6.355 7.096 -10.291 1.00 0.00 C ATOM 0 H VAL C 8 -4.788 8.948 -9.516 1.00 0.00 H new ATOM 0 HA VAL C 8 -3.759 6.419 -9.936 1.00 0.00 H new ATOM 0 HB VAL C 8 -5.320 8.246 -11.795 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -6.114 6.128 -12.813 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -4.350 6.299 -12.972 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -5.030 5.210 -11.740 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -7.293 7.064 -10.846 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -6.219 6.157 -9.755 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -6.383 7.920 -9.578 1.00 0.00 H new ATOM 1787 N GLY C 9 -1.735 6.540 -11.357 1.00 0.00 N ATOM 1788 CA GLY C 9 -0.580 6.528 -12.239 1.00 0.00 C ATOM 1789 C GLY C 9 0.703 6.967 -11.536 1.00 0.00 C ATOM 1790 O GLY C 9 1.699 7.246 -12.206 1.00 0.00 O ATOM 0 H GLY C 9 -1.748 5.783 -10.674 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -0.444 5.523 -12.640 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -0.769 7.187 -13.087 1.00 0.00 H new ATOM 1794 N GLU C 10 0.697 7.032 -10.203 1.00 0.00 N ATOM 1795 CA GLU C 10 1.859 7.452 -9.427 1.00 0.00 C ATOM 1796 C GLU C 10 2.215 6.394 -8.383 1.00 0.00 C ATOM 1797 O GLU C 10 1.518 5.386 -8.255 1.00 0.00 O ATOM 1798 CB GLU C 10 1.575 8.796 -8.759 1.00 0.00 C ATOM 1799 CG GLU C 10 1.225 9.890 -9.770 1.00 0.00 C ATOM 1800 CD GLU C 10 0.976 11.226 -9.074 1.00 0.00 C ATOM 1801 OE1 GLU C 10 0.395 11.204 -7.965 1.00 0.00 O ATOM 1802 OE2 GLU C 10 1.369 12.263 -9.654 1.00 0.00 O ATOM 0 H GLU C 10 -0.115 6.794 -9.634 1.00 0.00 H new ATOM 0 HA GLU C 10 2.712 7.566 -10.097 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.752 8.681 -8.054 1.00 0.00 H new ATOM 0 HB3 GLU C 10 2.448 9.104 -8.183 1.00 0.00 H new ATOM 0 HG2 GLU C 10 2.037 9.997 -10.489 1.00 0.00 H new ATOM 0 HG3 GLU C 10 0.338 9.599 -10.332 1.00 0.00 H new ATOM 1809 N SER C 11 3.299 6.619 -7.632 1.00 0.00 N ATOM 1810 CA SER C 11 3.850 5.605 -6.743 1.00 0.00 C ATOM 1811 C SER C 11 4.443 6.205 -5.466 1.00 0.00 C ATOM 1812 O SER C 11 4.618 7.417 -5.352 1.00 0.00 O ATOM 1813 CB SER C 11 4.934 4.835 -7.500 1.00 0.00 C ATOM 1814 OG SER C 11 4.372 4.111 -8.571 1.00 0.00 O ATOM 0 H SER C 11 3.810 7.502 -7.627 1.00 0.00 H new ATOM 0 HA SER C 11 3.039 4.944 -6.437 1.00 0.00 H new ATOM 0 HB2 SER C 11 5.685 5.529 -7.878 1.00 0.00 H new ATOM 0 HB3 SER C 11 5.444 4.152 -6.821 1.00 0.00 H new ATOM 0 HG SER C 11 5.079 3.626 -9.045 1.00 0.00 H new ATOM 1820 N ILE C 12 4.748 5.323 -4.509 1.00 0.00 N ATOM 1821 CA ILE C 12 5.328 5.631 -3.203 1.00 0.00 C ATOM 1822 C ILE C 12 6.428 4.598 -2.937 1.00 0.00 C ATOM 1823 O ILE C 12 6.498 3.590 -3.636 1.00 0.00 O ATOM 1824 CB ILE C 12 4.227 5.582 -2.125 1.00 0.00 C ATOM 1825 CG1 ILE C 12 3.158 6.662 -2.354 1.00 0.00 C ATOM 1826 CG2 ILE C 12 4.797 5.749 -0.710 1.00 0.00 C ATOM 1827 CD1 ILE C 12 3.704 8.084 -2.227 1.00 0.00 C ATOM 0 H ILE C 12 4.588 4.323 -4.633 1.00 0.00 H new ATOM 0 HA ILE C 12 5.757 6.633 -3.181 1.00 0.00 H new ATOM 0 HB ILE C 12 3.771 4.596 -2.211 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.726 6.532 -3.346 1.00 0.00 H new ATOM 0 HG13 ILE C 12 2.351 6.524 -1.635 1.00 0.00 H new ATOM 0 HG21 ILE C 12 3.985 5.708 0.016 1.00 0.00 H new ATOM 0 HG22 ILE C 12 5.507 4.947 -0.507 1.00 0.00 H new ATOM 0 HG23 ILE C 12 5.304 6.711 -0.633 1.00 0.00 H new ATOM 0 HD11 ILE C 12 2.900 8.799 -2.400 1.00 0.00 H new ATOM 0 HD12 ILE C 12 4.110 8.230 -1.226 1.00 0.00 H new ATOM 0 HD13 ILE C 12 4.492 8.239 -2.964 1.00 0.00 H new ATOM 1839 N ASN C 13 7.289 4.826 -1.943 1.00 0.00 N ATOM 1840 CA ASN C 13 8.454 3.983 -1.723 1.00 0.00 C ATOM 1841 C ASN C 13 8.633 3.678 -0.238 1.00 0.00 C ATOM 1842 O ASN C 13 8.299 4.500 0.615 1.00 0.00 O ATOM 1843 CB ASN C 13 9.667 4.726 -2.293 1.00 0.00 C ATOM 1844 CG ASN C 13 10.839 3.805 -2.584 1.00 0.00 C ATOM 1845 OD1 ASN C 13 11.410 3.196 -1.684 1.00 0.00 O ATOM 1846 ND2 ASN C 13 11.206 3.698 -3.858 1.00 0.00 N ATOM 0 H ASN C 13 7.196 5.593 -1.277 1.00 0.00 H new ATOM 0 HA ASN C 13 8.334 3.022 -2.223 1.00 0.00 H new ATOM 0 HB2 ASN C 13 9.376 5.237 -3.211 1.00 0.00 H new ATOM 0 HB3 ASN C 13 9.981 5.494 -1.587 1.00 0.00 H new ATOM 0 HD21 ASN C 13 11.987 3.094 -4.115 1.00 0.00 H new ATOM 0 HD22 ASN C 13 10.707 4.220 -4.578 1.00 0.00 H new ATOM 1853 N ILE C 14 9.162 2.489 0.075 1.00 0.00 N ATOM 1854 CA ILE C 14 9.382 2.038 1.440 1.00 0.00 C ATOM 1855 C ILE C 14 10.685 1.247 1.528 1.00 0.00 C ATOM 1856 O ILE C 14 11.061 0.531 0.596 1.00 0.00 O ATOM 1857 CB ILE C 14 8.205 1.160 1.898 1.00 0.00 C ATOM 1858 CG1 ILE C 14 6.879 1.930 1.780 1.00 0.00 C ATOM 1859 CG2 ILE C 14 8.427 0.703 3.346 1.00 0.00 C ATOM 1860 CD1 ILE C 14 5.671 1.088 2.194 1.00 0.00 C ATOM 0 H ILE C 14 9.451 1.809 -0.628 1.00 0.00 H new ATOM 0 HA ILE C 14 9.453 2.909 2.092 1.00 0.00 H new ATOM 0 HB ILE C 14 8.151 0.283 1.253 1.00 0.00 H new ATOM 0 HG12 ILE C 14 6.925 2.823 2.403 1.00 0.00 H new ATOM 0 HG13 ILE C 14 6.748 2.265 0.751 1.00 0.00 H new ATOM 0 HG21 ILE C 14 7.590 0.082 3.664 1.00 0.00 H new ATOM 0 HG22 ILE C 14 9.350 0.127 3.408 1.00 0.00 H new ATOM 0 HG23 ILE C 14 8.499 1.575 3.996 1.00 0.00 H new ATOM 0 HD11 ILE C 14 4.762 1.681 2.091 1.00 0.00 H new ATOM 0 HD12 ILE C 14 5.605 0.208 1.554 1.00 0.00 H new ATOM 0 HD13 ILE C 14 5.784 0.775 3.232 1.00 0.00 H new ATOM 1872 N GLY C 15 11.381 1.382 2.662 1.00 0.00 N ATOM 1873 CA GLY C 15 12.621 0.675 2.914 1.00 0.00 C ATOM 1874 C GLY C 15 13.648 0.971 1.832 1.00 0.00 C ATOM 1875 O GLY C 15 13.826 2.118 1.426 1.00 0.00 O ATOM 0 H GLY C 15 11.091 1.990 3.428 1.00 0.00 H new ATOM 0 HA2 GLY C 15 13.018 0.966 3.886 1.00 0.00 H new ATOM 0 HA3 GLY C 15 12.430 -0.397 2.955 1.00 0.00 H new ATOM 1879 N ASP C 16 14.317 -0.083 1.364 1.00 0.00 N ATOM 1880 CA ASP C 16 15.333 -0.011 0.326 1.00 0.00 C ATOM 1881 C ASP C 16 15.049 -1.062 -0.754 1.00 0.00 C ATOM 1882 O ASP C 16 15.864 -1.269 -1.653 1.00 0.00 O ATOM 1883 CB ASP C 16 16.718 -0.228 0.937 1.00 0.00 C ATOM 1884 CG ASP C 16 17.061 0.846 1.970 1.00 0.00 C ATOM 1885 OD1 ASP C 16 16.731 0.636 3.159 1.00 0.00 O ATOM 1886 OD2 ASP C 16 17.653 1.869 1.563 1.00 0.00 O ATOM 0 H ASP C 16 14.160 -1.031 1.707 1.00 0.00 H new ATOM 0 HA ASP C 16 15.308 0.977 -0.135 1.00 0.00 H new ATOM 0 HB2 ASP C 16 16.757 -1.210 1.408 1.00 0.00 H new ATOM 0 HB3 ASP C 16 17.468 -0.224 0.146 1.00 0.00 H new ATOM 1891 N ASP C 17 13.891 -1.729 -0.662 1.00 0.00 N ATOM 1892 CA ASP C 17 13.546 -2.846 -1.533 1.00 0.00 C ATOM 1893 C ASP C 17 12.054 -2.914 -1.858 1.00 0.00 C ATOM 1894 O ASP C 17 11.611 -3.900 -2.439 1.00 0.00 O ATOM 1895 CB ASP C 17 14.003 -4.148 -0.863 1.00 0.00 C ATOM 1896 CG ASP C 17 13.158 -4.498 0.363 1.00 0.00 C ATOM 1897 OD1 ASP C 17 13.151 -3.683 1.315 1.00 0.00 O ATOM 1898 OD2 ASP C 17 12.528 -5.578 0.335 1.00 0.00 O ATOM 0 H ASP C 17 13.169 -1.504 0.023 1.00 0.00 H new ATOM 0 HA ASP C 17 14.057 -2.699 -2.484 1.00 0.00 H new ATOM 0 HB2 ASP C 17 13.948 -4.964 -1.584 1.00 0.00 H new ATOM 0 HB3 ASP C 17 15.048 -4.054 -0.567 1.00 0.00 H new ATOM 1903 N ILE C 18 11.275 -1.887 -1.497 1.00 0.00 N ATOM 1904 CA ILE C 18 9.831 -1.923 -1.689 1.00 0.00 C ATOM 1905 C ILE C 18 9.334 -0.623 -2.319 1.00 0.00 C ATOM 1906 O ILE C 18 9.806 0.468 -1.991 1.00 0.00 O ATOM 1907 CB ILE C 18 9.157 -2.149 -0.330 1.00 0.00 C ATOM 1908 CG1 ILE C 18 9.602 -3.489 0.264 1.00 0.00 C ATOM 1909 CG2 ILE C 18 7.632 -2.125 -0.464 1.00 0.00 C ATOM 1910 CD1 ILE C 18 9.268 -3.566 1.750 1.00 0.00 C ATOM 0 H ILE C 18 11.624 -1.027 -1.073 1.00 0.00 H new ATOM 0 HA ILE C 18 9.578 -2.738 -2.367 1.00 0.00 H new ATOM 0 HB ILE C 18 9.459 -1.340 0.336 1.00 0.00 H new ATOM 0 HG12 ILE C 18 9.112 -4.306 -0.265 1.00 0.00 H new ATOM 0 HG13 ILE C 18 10.675 -3.615 0.122 1.00 0.00 H new ATOM 0 HG21 ILE C 18 7.178 -2.288 0.514 1.00 0.00 H new ATOM 0 HG22 ILE C 18 7.316 -1.157 -0.854 1.00 0.00 H new ATOM 0 HG23 ILE C 18 7.314 -2.913 -1.147 1.00 0.00 H new ATOM 0 HD11 ILE C 18 9.594 -4.527 2.147 1.00 0.00 H new ATOM 0 HD12 ILE C 18 9.779 -2.762 2.280 1.00 0.00 H new ATOM 0 HD13 ILE C 18 8.191 -3.464 1.887 1.00 0.00 H new ATOM 1922 N THR C 19 8.377 -0.751 -3.234 1.00 0.00 N ATOM 1923 CA THR C 19 7.748 0.374 -3.909 1.00 0.00 C ATOM 1924 C THR C 19 6.288 0.013 -4.134 1.00 0.00 C ATOM 1925 O THR C 19 5.967 -1.161 -4.297 1.00 0.00 O ATOM 1926 CB THR C 19 8.468 0.660 -5.233 1.00 0.00 C ATOM 1927 OG1 THR C 19 9.865 0.696 -5.035 1.00 0.00 O ATOM 1928 CG2 THR C 19 8.049 2.002 -5.822 1.00 0.00 C ATOM 0 H THR C 19 8.012 -1.656 -3.530 1.00 0.00 H new ATOM 0 HA THR C 19 7.812 1.281 -3.307 1.00 0.00 H new ATOM 0 HB THR C 19 8.195 -0.141 -5.920 1.00 0.00 H new ATOM 0 HG1 THR C 19 10.312 0.878 -5.888 1.00 0.00 H new ATOM 0 HG21 THR C 19 8.580 2.170 -6.759 1.00 0.00 H new ATOM 0 HG22 THR C 19 6.975 1.998 -6.009 1.00 0.00 H new ATOM 0 HG23 THR C 19 8.292 2.799 -5.120 1.00 0.00 H new ATOM 1936 N ILE C 20 5.400 1.009 -4.143 1.00 0.00 N ATOM 1937 CA ILE C 20 3.956 0.799 -4.200 1.00 0.00 C ATOM 1938 C ILE C 20 3.354 1.737 -5.244 1.00 0.00 C ATOM 1939 O ILE C 20 3.913 2.800 -5.506 1.00 0.00 O ATOM 1940 CB ILE C 20 3.347 1.070 -2.817 1.00 0.00 C ATOM 1941 CG1 ILE C 20 4.096 0.346 -1.692 1.00 0.00 C ATOM 1942 CG2 ILE C 20 1.874 0.659 -2.791 1.00 0.00 C ATOM 1943 CD1 ILE C 20 3.989 -1.177 -1.767 1.00 0.00 C ATOM 0 H ILE C 20 5.668 1.993 -4.111 1.00 0.00 H new ATOM 0 HA ILE C 20 3.738 -0.231 -4.482 1.00 0.00 H new ATOM 0 HB ILE C 20 3.438 2.142 -2.642 1.00 0.00 H new ATOM 0 HG12 ILE C 20 5.148 0.630 -1.726 1.00 0.00 H new ATOM 0 HG13 ILE C 20 3.705 0.682 -0.732 1.00 0.00 H new ATOM 0 HG21 ILE C 20 1.458 0.858 -1.803 1.00 0.00 H new ATOM 0 HG22 ILE C 20 1.324 1.230 -3.538 1.00 0.00 H new ATOM 0 HG23 ILE C 20 1.789 -0.405 -3.013 1.00 0.00 H new ATOM 0 HD11 ILE C 20 4.543 -1.622 -0.940 1.00 0.00 H new ATOM 0 HD12 ILE C 20 2.942 -1.472 -1.703 1.00 0.00 H new ATOM 0 HD13 ILE C 20 4.406 -1.525 -2.712 1.00 0.00 H new ATOM 1955 N THR C 21 2.223 1.351 -5.841 1.00 0.00 N ATOM 1956 CA THR C 21 1.627 2.111 -6.936 1.00 0.00 C ATOM 1957 C THR C 21 0.107 2.130 -6.828 1.00 0.00 C ATOM 1958 O THR C 21 -0.498 1.217 -6.270 1.00 0.00 O ATOM 1959 CB THR C 21 2.059 1.466 -8.259 1.00 0.00 C ATOM 1960 OG1 THR C 21 3.467 1.411 -8.323 1.00 0.00 O ATOM 1961 CG2 THR C 21 1.575 2.249 -9.480 1.00 0.00 C ATOM 0 H THR C 21 1.702 0.513 -5.581 1.00 0.00 H new ATOM 0 HA THR C 21 1.969 3.145 -6.890 1.00 0.00 H new ATOM 0 HB THR C 21 1.614 0.471 -8.280 1.00 0.00 H new ATOM 0 HG1 THR C 21 3.826 2.319 -8.410 1.00 0.00 H new ATOM 0 HG21 THR C 21 1.909 1.748 -10.389 1.00 0.00 H new ATOM 0 HG22 THR C 21 0.486 2.299 -9.472 1.00 0.00 H new ATOM 0 HG23 THR C 21 1.985 3.259 -9.451 1.00 0.00 H new ATOM 1969 N ILE C 22 -0.515 3.184 -7.369 1.00 0.00 N ATOM 1970 CA ILE C 22 -1.962 3.308 -7.453 1.00 0.00 C ATOM 1971 C ILE C 22 -2.356 3.158 -8.917 1.00 0.00 C ATOM 1972 O ILE C 22 -2.080 4.025 -9.744 1.00 0.00 O ATOM 1973 CB ILE C 22 -2.421 4.637 -6.827 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -3.899 4.938 -7.111 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -1.582 5.823 -7.300 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -4.812 3.876 -6.499 1.00 0.00 C ATOM 0 H ILE C 22 -0.015 3.981 -7.764 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.465 2.527 -6.883 1.00 0.00 H new ATOM 0 HB ILE C 22 -2.283 4.507 -5.754 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -4.156 5.917 -6.708 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -4.062 4.984 -8.188 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -1.946 6.737 -6.830 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -0.539 5.664 -7.025 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -1.661 5.916 -8.383 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -5.852 4.119 -6.719 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -4.570 2.901 -6.922 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -4.666 3.849 -5.419 1.00 0.00 H new ATOM 1988 N LEU C 23 -3.008 2.041 -9.244 1.00 0.00 N ATOM 1989 CA LEU C 23 -3.293 1.692 -10.626 1.00 0.00 C ATOM 1990 C LEU C 23 -4.601 2.319 -11.095 1.00 0.00 C ATOM 1991 O LEU C 23 -4.786 2.536 -12.293 1.00 0.00 O ATOM 1992 CB LEU C 23 -3.373 0.171 -10.745 1.00 0.00 C ATOM 1993 CG LEU C 23 -2.111 -0.499 -10.190 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -2.272 -2.007 -10.307 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -0.850 -0.076 -10.939 1.00 0.00 C ATOM 0 H LEU C 23 -3.348 1.363 -8.562 1.00 0.00 H new ATOM 0 HA LEU C 23 -2.493 2.077 -11.259 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -4.247 -0.192 -10.205 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -3.505 -0.108 -11.790 1.00 0.00 H new ATOM 0 HG LEU C 23 -1.996 -0.189 -9.151 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -1.382 -2.499 -9.916 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -3.143 -2.325 -9.735 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -2.406 -2.278 -11.354 1.00 0.00 H new ATOM 0 HD21 LEU C 23 0.016 -0.578 -10.507 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -0.942 -0.350 -11.990 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -0.722 1.003 -10.856 1.00 0.00 H new ATOM 2007 N GLY C 24 -5.508 2.617 -10.161 1.00 0.00 N ATOM 2008 CA GLY C 24 -6.738 3.310 -10.505 1.00 0.00 C ATOM 2009 C GLY C 24 -7.783 3.240 -9.402 1.00 0.00 C ATOM 2010 O GLY C 24 -7.508 2.767 -8.300 1.00 0.00 O ATOM 0 H GLY C 24 -5.410 2.389 -9.172 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -6.513 4.355 -10.720 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -7.150 2.878 -11.417 1.00 0.00 H new ATOM 2014 N VAL C 25 -8.987 3.720 -9.714 1.00 0.00 N ATOM 2015 CA VAL C 25 -10.089 3.783 -8.762 1.00 0.00 C ATOM 2016 C VAL C 25 -11.355 3.213 -9.394 1.00 0.00 C ATOM 2017 O VAL C 25 -11.443 3.075 -10.614 1.00 0.00 O ATOM 2018 CB VAL C 25 -10.314 5.231 -8.300 1.00 0.00 C ATOM 2019 CG1 VAL C 25 -9.058 5.801 -7.635 1.00 0.00 C ATOM 2020 CG2 VAL C 25 -10.695 6.135 -9.472 1.00 0.00 C ATOM 0 H VAL C 25 -9.223 4.077 -10.640 1.00 0.00 H new ATOM 0 HA VAL C 25 -9.838 3.183 -7.887 1.00 0.00 H new ATOM 0 HB VAL C 25 -11.131 5.207 -7.579 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -9.247 6.827 -7.319 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -8.799 5.195 -6.767 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -8.232 5.787 -8.346 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -10.847 7.153 -9.112 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -9.895 6.128 -10.212 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -11.615 5.770 -9.929 1.00 0.00 H new ATOM 2030 N SER C 26 -12.336 2.884 -8.556 1.00 0.00 N ATOM 2031 CA SER C 26 -13.602 2.310 -8.986 1.00 0.00 C ATOM 2032 C SER C 26 -14.685 2.714 -7.995 1.00 0.00 C ATOM 2033 O SER C 26 -15.314 1.871 -7.356 1.00 0.00 O ATOM 2034 CB SER C 26 -13.470 0.789 -9.088 1.00 0.00 C ATOM 2035 OG SER C 26 -14.632 0.238 -9.668 1.00 0.00 O ATOM 0 H SER C 26 -12.269 3.012 -7.546 1.00 0.00 H new ATOM 0 HA SER C 26 -13.877 2.685 -9.972 1.00 0.00 H new ATOM 0 HB2 SER C 26 -12.598 0.532 -9.689 1.00 0.00 H new ATOM 0 HB3 SER C 26 -13.312 0.363 -8.097 1.00 0.00 H new ATOM 0 HG SER C 26 -14.537 -0.735 -9.730 1.00 0.00 H new ATOM 2041 N GLY C 27 -14.907 4.026 -7.864 1.00 0.00 N ATOM 2042 CA GLY C 27 -15.888 4.540 -6.925 1.00 0.00 C ATOM 2043 C GLY C 27 -15.377 4.367 -5.500 1.00 0.00 C ATOM 2044 O GLY C 27 -14.248 4.746 -5.195 1.00 0.00 O ATOM 0 H GLY C 27 -14.418 4.744 -8.399 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -16.081 5.594 -7.127 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -16.834 4.013 -7.048 1.00 0.00 H new ATOM 2048 N GLN C 28 -16.208 3.790 -4.627 1.00 0.00 N ATOM 2049 CA GLN C 28 -15.850 3.523 -3.240 1.00 0.00 C ATOM 2050 C GLN C 28 -14.770 2.435 -3.142 1.00 0.00 C ATOM 2051 O GLN C 28 -14.333 2.101 -2.040 1.00 0.00 O ATOM 2052 CB GLN C 28 -17.127 3.118 -2.493 1.00 0.00 C ATOM 2053 CG GLN C 28 -16.994 3.180 -0.966 1.00 0.00 C ATOM 2054 CD GLN C 28 -16.797 4.597 -0.441 1.00 0.00 C ATOM 2055 OE1 GLN C 28 -16.804 5.568 -1.194 1.00 0.00 O ATOM 2056 NE2 GLN C 28 -16.617 4.731 0.871 1.00 0.00 N ATOM 0 H GLN C 28 -17.154 3.495 -4.869 1.00 0.00 H new ATOM 0 HA GLN C 28 -15.425 4.418 -2.785 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -17.942 3.771 -2.805 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -17.402 2.104 -2.784 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -17.887 2.751 -0.512 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -16.151 2.563 -0.655 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -16.616 3.907 1.472 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -16.480 5.658 1.275 1.00 0.00 H new ATOM 2065 N GLN C 29 -14.332 1.882 -4.280 1.00 0.00 N ATOM 2066 CA GLN C 29 -13.307 0.847 -4.296 1.00 0.00 C ATOM 2067 C GLN C 29 -12.080 1.318 -5.078 1.00 0.00 C ATOM 2068 O GLN C 29 -12.146 2.301 -5.812 1.00 0.00 O ATOM 2069 CB GLN C 29 -13.855 -0.471 -4.856 1.00 0.00 C ATOM 2070 CG GLN C 29 -15.361 -0.671 -4.635 1.00 0.00 C ATOM 2071 CD GLN C 29 -15.743 -2.148 -4.722 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -16.568 -2.622 -3.943 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -15.153 -2.887 -5.657 1.00 0.00 N ATOM 0 H GLN C 29 -14.678 2.141 -5.204 1.00 0.00 H new ATOM 0 HA GLN C 29 -13.000 0.658 -3.267 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -13.647 -0.513 -5.925 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -13.318 -1.300 -4.395 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -15.643 -0.277 -3.659 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -15.919 -0.104 -5.381 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -14.473 -2.463 -6.288 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -15.381 -3.877 -5.743 1.00 0.00 H new ATOM 2082 N VAL C 30 -10.958 0.611 -4.917 1.00 0.00 N ATOM 2083 CA VAL C 30 -9.659 1.039 -5.425 1.00 0.00 C ATOM 2084 C VAL C 30 -8.792 -0.166 -5.776 1.00 0.00 C ATOM 2085 O VAL C 30 -8.872 -1.195 -5.105 1.00 0.00 O ATOM 2086 CB VAL C 30 -8.971 1.861 -4.320 1.00 0.00 C ATOM 2087 CG1 VAL C 30 -7.510 2.152 -4.651 1.00 0.00 C ATOM 2088 CG2 VAL C 30 -9.677 3.199 -4.100 1.00 0.00 C ATOM 0 H VAL C 30 -10.929 -0.282 -4.425 1.00 0.00 H new ATOM 0 HA VAL C 30 -9.794 1.633 -6.329 1.00 0.00 H new ATOM 0 HB VAL C 30 -9.027 1.253 -3.417 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -7.063 2.734 -3.845 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -6.968 1.213 -4.764 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -7.453 2.717 -5.581 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.166 3.755 -3.314 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -9.658 3.777 -5.024 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -10.711 3.021 -3.805 1.00 0.00 H new ATOM 2098 N ARG C 31 -7.964 -0.042 -6.825 1.00 0.00 N ATOM 2099 CA ARG C 31 -6.975 -1.058 -7.165 1.00 0.00 C ATOM 2100 C ARG C 31 -5.584 -0.442 -7.082 1.00 0.00 C ATOM 2101 O ARG C 31 -5.322 0.632 -7.622 1.00 0.00 O ATOM 2102 CB ARG C 31 -7.230 -1.673 -8.551 1.00 0.00 C ATOM 2103 CG ARG C 31 -6.037 -2.572 -8.920 1.00 0.00 C ATOM 2104 CD ARG C 31 -6.219 -3.385 -10.204 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.162 -4.488 -10.013 1.00 0.00 N ATOM 2106 CZ ARG C 31 -7.841 -5.080 -11.000 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -7.618 -4.768 -12.273 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -8.761 -5.995 -10.717 1.00 0.00 N ATOM 0 H ARG C 31 -7.966 0.762 -7.453 1.00 0.00 H new ATOM 0 HA ARG C 31 -7.055 -1.876 -6.449 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -8.152 -2.254 -8.543 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -7.355 -0.887 -9.296 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -5.149 -1.949 -9.024 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -5.849 -3.259 -8.095 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -6.577 -2.733 -11.001 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -5.255 -3.781 -10.525 1.00 0.00 H new ATOM 0 HE ARG C 31 -7.311 -4.828 -9.063 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -6.918 -4.065 -12.511 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -8.147 -5.231 -13.012 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -8.949 -6.246 -9.746 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -9.279 -6.447 -11.470 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.700 -1.155 -6.386 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.337 -0.741 -6.096 1.00 0.00 C ATOM 2124 C ILE C 32 -2.382 -1.897 -6.367 1.00 0.00 C ATOM 2125 O ILE C 32 -2.782 -3.058 -6.348 1.00 0.00 O ATOM 2126 CB ILE C 32 -3.233 -0.291 -4.633 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -3.986 -1.267 -3.713 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -3.797 1.124 -4.503 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -3.843 -0.878 -2.243 1.00 0.00 C ATOM 0 H ILE C 32 -4.926 -2.070 -5.996 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.066 0.096 -6.739 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.187 -0.288 -4.327 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.041 -1.283 -3.985 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -3.603 -2.277 -3.862 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -3.726 1.450 -3.465 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.226 1.803 -5.136 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -4.842 1.129 -4.814 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -4.388 -1.590 -1.623 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -2.789 -0.887 -1.965 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -4.250 0.122 -2.090 1.00 0.00 H new ATOM 2141 N GLY C 33 -1.113 -1.572 -6.617 1.00 0.00 N ATOM 2142 CA GLY C 33 -0.107 -2.565 -6.940 1.00 0.00 C ATOM 2143 C GLY C 33 1.075 -2.451 -5.989 1.00 0.00 C ATOM 2144 O GLY C 33 1.234 -1.447 -5.296 1.00 0.00 O ATOM 0 H GLY C 33 -0.762 -0.614 -6.600 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -0.539 -3.564 -6.876 1.00 0.00 H new ATOM 0 HA3 GLY C 33 0.230 -2.429 -7.968 1.00 0.00 H new ATOM 2148 N ILE C 34 1.903 -3.498 -5.966 1.00 0.00 N ATOM 2149 CA ILE C 34 3.036 -3.599 -5.057 1.00 0.00 C ATOM 2150 C ILE C 34 4.239 -4.136 -5.819 1.00 0.00 C ATOM 2151 O ILE C 34 4.128 -5.102 -6.574 1.00 0.00 O ATOM 2152 CB ILE C 34 2.704 -4.537 -3.885 1.00 0.00 C ATOM 2153 CG1 ILE C 34 1.563 -4.012 -3.002 1.00 0.00 C ATOM 2154 CG2 ILE C 34 3.943 -4.708 -2.995 1.00 0.00 C ATOM 2155 CD1 ILE C 34 0.192 -4.502 -3.477 1.00 0.00 C ATOM 0 H ILE C 34 1.801 -4.303 -6.584 1.00 0.00 H new ATOM 0 HA ILE C 34 3.261 -2.611 -4.656 1.00 0.00 H new ATOM 0 HB ILE C 34 2.389 -5.483 -4.327 1.00 0.00 H new ATOM 0 HG12 ILE C 34 1.725 -4.333 -1.973 1.00 0.00 H new ATOM 0 HG13 ILE C 34 1.578 -2.922 -3.002 1.00 0.00 H new ATOM 0 HG21 ILE C 34 3.706 -5.373 -2.165 1.00 0.00 H new ATOM 0 HG22 ILE C 34 4.756 -5.136 -3.582 1.00 0.00 H new ATOM 0 HG23 ILE C 34 4.248 -3.737 -2.606 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -0.583 -4.105 -2.822 1.00 0.00 H new ATOM 0 HD12 ILE C 34 0.016 -4.159 -4.497 1.00 0.00 H new ATOM 0 HD13 ILE C 34 0.166 -5.591 -3.451 1.00 0.00 H new ATOM 2167 N ASN C 35 5.391 -3.502 -5.604 1.00 0.00 N ATOM 2168 CA ASN C 35 6.637 -3.826 -6.274 1.00 0.00 C ATOM 2169 C ASN C 35 7.687 -4.183 -5.224 1.00 0.00 C ATOM 2170 O ASN C 35 8.591 -3.400 -4.932 1.00 0.00 O ATOM 2171 CB ASN C 35 7.082 -2.655 -7.147 1.00 0.00 C ATOM 2172 CG ASN C 35 6.050 -2.295 -8.206 1.00 0.00 C ATOM 2173 OD1 ASN C 35 5.011 -1.717 -7.903 1.00 0.00 O ATOM 2174 ND2 ASN C 35 6.332 -2.635 -9.461 1.00 0.00 N ATOM 0 H ASN C 35 5.479 -2.731 -4.942 1.00 0.00 H new ATOM 0 HA ASN C 35 6.500 -4.686 -6.930 1.00 0.00 H new ATOM 0 HB2 ASN C 35 7.270 -1.786 -6.516 1.00 0.00 H new ATOM 0 HB3 ASN C 35 8.025 -2.906 -7.633 1.00 0.00 H new ATOM 0 HD21 ASN C 35 5.674 -2.416 -10.209 1.00 0.00 H new ATOM 0 HD22 ASN C 35 7.206 -3.115 -9.675 1.00 0.00 H new ATOM 2181 N ALA C 36 7.549 -5.382 -4.659 1.00 0.00 N ATOM 2182 CA ALA C 36 8.489 -5.925 -3.696 1.00 0.00 C ATOM 2183 C ALA C 36 8.933 -7.304 -4.177 1.00 0.00 C ATOM 2184 O ALA C 36 8.207 -7.954 -4.927 1.00 0.00 O ATOM 2185 CB ALA C 36 7.807 -6.023 -2.329 1.00 0.00 C ATOM 0 H ALA C 36 6.769 -6.007 -4.864 1.00 0.00 H new ATOM 0 HA ALA C 36 9.362 -5.279 -3.603 1.00 0.00 H new ATOM 0 HB1 ALA C 36 8.508 -6.430 -1.601 1.00 0.00 H new ATOM 0 HB2 ALA C 36 7.488 -5.031 -2.010 1.00 0.00 H new ATOM 0 HB3 ALA C 36 6.938 -6.678 -2.402 1.00 0.00 H new ATOM 2191 N PRO C 37 10.118 -7.768 -3.758 1.00 0.00 N ATOM 2192 CA PRO C 37 10.608 -9.084 -4.110 1.00 0.00 C ATOM 2193 C PRO C 37 9.868 -10.114 -3.265 1.00 0.00 C ATOM 2194 O PRO C 37 9.403 -9.800 -2.173 1.00 0.00 O ATOM 2195 CB PRO C 37 12.094 -9.051 -3.758 1.00 0.00 C ATOM 2196 CG PRO C 37 12.149 -8.084 -2.576 1.00 0.00 C ATOM 2197 CD PRO C 37 11.067 -7.064 -2.916 1.00 0.00 C ATOM 0 HA PRO C 37 10.456 -9.344 -5.158 1.00 0.00 H new ATOM 0 HB2 PRO C 37 12.466 -10.039 -3.488 1.00 0.00 H new ATOM 0 HB3 PRO C 37 12.699 -8.700 -4.594 1.00 0.00 H new ATOM 0 HG2 PRO C 37 11.945 -8.589 -1.632 1.00 0.00 H new ATOM 0 HG3 PRO C 37 13.129 -7.616 -2.482 1.00 0.00 H new ATOM 0 HD2 PRO C 37 10.586 -6.687 -2.013 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.489 -6.203 -3.435 1.00 0.00 H new ATOM 2205 N LYS C 38 9.751 -11.349 -3.753 1.00 0.00 N ATOM 2206 CA LYS C 38 9.094 -12.403 -2.994 1.00 0.00 C ATOM 2207 C LYS C 38 9.931 -12.824 -1.794 1.00 0.00 C ATOM 2208 O LYS C 38 9.544 -13.723 -1.048 1.00 0.00 O ATOM 2209 CB LYS C 38 8.700 -13.553 -3.922 1.00 0.00 C ATOM 2210 CG LYS C 38 7.536 -13.013 -4.752 1.00 0.00 C ATOM 2211 CD LYS C 38 6.873 -14.059 -5.642 1.00 0.00 C ATOM 2212 CE LYS C 38 7.798 -14.447 -6.794 1.00 0.00 C ATOM 2213 NZ LYS C 38 7.109 -15.352 -7.736 1.00 0.00 N ATOM 0 H LYS C 38 10.102 -11.639 -4.666 1.00 0.00 H new ATOM 0 HA LYS C 38 8.165 -12.023 -2.569 1.00 0.00 H new ATOM 0 HB2 LYS C 38 9.534 -13.850 -4.558 1.00 0.00 H new ATOM 0 HB3 LYS C 38 8.403 -14.435 -3.354 1.00 0.00 H new ATOM 0 HG2 LYS C 38 6.787 -12.595 -4.080 1.00 0.00 H new ATOM 0 HG3 LYS C 38 7.896 -12.195 -5.376 1.00 0.00 H new ATOM 0 HD2 LYS C 38 6.626 -14.942 -5.053 1.00 0.00 H new ATOM 0 HD3 LYS C 38 5.936 -13.667 -6.037 1.00 0.00 H new ATOM 0 HE2 LYS C 38 8.128 -13.551 -7.319 1.00 0.00 H new ATOM 0 HE3 LYS C 38 8.691 -14.934 -6.402 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 7.755 -15.603 -8.511 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 6.815 -16.215 -7.236 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 6.271 -14.875 -8.125 1.00 0.00 H new ATOM 2227 N ASP C 39 11.083 -12.178 -1.605 1.00 0.00 N ATOM 2228 CA ASP C 39 11.885 -12.315 -0.401 1.00 0.00 C ATOM 2229 C ASP C 39 11.173 -11.630 0.769 1.00 0.00 C ATOM 2230 O ASP C 39 11.545 -11.843 1.924 1.00 0.00 O ATOM 2231 CB ASP C 39 13.267 -11.705 -0.628 1.00 0.00 C ATOM 2232 CG ASP C 39 14.059 -12.489 -1.673 1.00 0.00 C ATOM 2233 OD1 ASP C 39 14.615 -13.546 -1.301 1.00 0.00 O ATOM 2234 OD2 ASP C 39 14.100 -12.028 -2.836 1.00 0.00 O ATOM 0 H ASP C 39 11.484 -11.541 -2.293 1.00 0.00 H new ATOM 0 HA ASP C 39 12.011 -13.371 -0.162 1.00 0.00 H new ATOM 0 HB2 ASP C 39 13.160 -10.670 -0.952 1.00 0.00 H new ATOM 0 HB3 ASP C 39 13.818 -11.690 0.312 1.00 0.00 H new ATOM 2239 N VAL C 40 10.154 -10.813 0.475 1.00 0.00 N ATOM 2240 CA VAL C 40 9.278 -10.229 1.481 1.00 0.00 C ATOM 2241 C VAL C 40 7.828 -10.475 1.078 1.00 0.00 C ATOM 2242 O VAL C 40 7.479 -10.465 -0.103 1.00 0.00 O ATOM 2243 CB VAL C 40 9.569 -8.738 1.679 1.00 0.00 C ATOM 2244 CG1 VAL C 40 11.042 -8.529 2.034 1.00 0.00 C ATOM 2245 CG2 VAL C 40 9.238 -7.917 0.436 1.00 0.00 C ATOM 0 H VAL C 40 9.918 -10.540 -0.479 1.00 0.00 H new ATOM 0 HA VAL C 40 9.464 -10.707 2.443 1.00 0.00 H new ATOM 0 HB VAL C 40 8.932 -8.396 2.494 1.00 0.00 H new ATOM 0 HG11 VAL C 40 11.236 -7.465 2.172 1.00 0.00 H new ATOM 0 HG12 VAL C 40 11.273 -9.063 2.956 1.00 0.00 H new ATOM 0 HG13 VAL C 40 11.668 -8.910 1.227 1.00 0.00 H new ATOM 0 HG21 VAL C 40 9.461 -6.867 0.624 1.00 0.00 H new ATOM 0 HG22 VAL C 40 9.837 -8.270 -0.403 1.00 0.00 H new ATOM 0 HG23 VAL C 40 8.180 -8.027 0.199 1.00 0.00 H new ATOM 2255 N ALA C 41 6.972 -10.696 2.070 1.00 0.00 N ATOM 2256 CA ALA C 41 5.586 -11.061 1.838 1.00 0.00 C ATOM 2257 C ALA C 41 4.703 -9.844 1.570 1.00 0.00 C ATOM 2258 O ALA C 41 4.983 -8.745 2.039 1.00 0.00 O ATOM 2259 CB ALA C 41 5.072 -11.814 3.065 1.00 0.00 C ATOM 0 H ALA C 41 7.223 -10.626 3.056 1.00 0.00 H new ATOM 0 HA ALA C 41 5.541 -11.689 0.948 1.00 0.00 H new ATOM 0 HB1 ALA C 41 4.031 -12.097 2.909 1.00 0.00 H new ATOM 0 HB2 ALA C 41 5.672 -12.711 3.219 1.00 0.00 H new ATOM 0 HB3 ALA C 41 5.146 -11.172 3.943 1.00 0.00 H new ATOM 2265 N VAL C 42 3.631 -10.061 0.806 1.00 0.00 N ATOM 2266 CA VAL C 42 2.560 -9.089 0.637 1.00 0.00 C ATOM 2267 C VAL C 42 1.269 -9.863 0.421 1.00 0.00 C ATOM 2268 O VAL C 42 1.173 -10.692 -0.489 1.00 0.00 O ATOM 2269 CB VAL C 42 2.821 -8.094 -0.506 1.00 0.00 C ATOM 2270 CG1 VAL C 42 3.444 -8.735 -1.738 1.00 0.00 C ATOM 2271 CG2 VAL C 42 1.530 -7.416 -0.960 1.00 0.00 C ATOM 0 H VAL C 42 3.485 -10.925 0.284 1.00 0.00 H new ATOM 0 HA VAL C 42 2.494 -8.472 1.533 1.00 0.00 H new ATOM 0 HB VAL C 42 3.521 -7.372 -0.086 1.00 0.00 H new ATOM 0 HG11 VAL C 42 3.600 -7.975 -2.504 1.00 0.00 H new ATOM 0 HG12 VAL C 42 4.401 -9.183 -1.471 1.00 0.00 H new ATOM 0 HG13 VAL C 42 2.777 -9.507 -2.123 1.00 0.00 H new ATOM 0 HG21 VAL C 42 1.750 -6.719 -1.769 1.00 0.00 H new ATOM 0 HG22 VAL C 42 0.827 -8.171 -1.313 1.00 0.00 H new ATOM 0 HG23 VAL C 42 1.090 -6.873 -0.123 1.00 0.00 H new ATOM 2281 N HIS C 43 0.281 -9.572 1.270 1.00 0.00 N ATOM 2282 CA HIS C 43 -1.042 -10.188 1.226 1.00 0.00 C ATOM 2283 C HIS C 43 -2.112 -9.205 1.700 1.00 0.00 C ATOM 2284 O HIS C 43 -1.810 -8.172 2.294 1.00 0.00 O ATOM 2285 CB HIS C 43 -1.111 -11.418 2.139 1.00 0.00 C ATOM 2286 CG HIS C 43 -0.068 -12.474 1.895 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -0.290 -13.681 1.233 1.00 0.00 N ATOM 2288 CD2 HIS C 43 1.237 -12.417 2.294 1.00 0.00 C ATOM 2289 CE1 HIS C 43 0.890 -14.323 1.241 1.00 0.00 C ATOM 2290 NE2 HIS C 43 1.825 -13.586 1.868 1.00 0.00 N ATOM 0 H HIS C 43 0.382 -8.889 2.020 1.00 0.00 H new ATOM 0 HA HIS C 43 -1.220 -10.479 0.191 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -1.028 -11.084 3.173 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -2.095 -11.874 2.029 1.00 0.00 H new ATOM 0 HD2 HIS C 43 1.713 -11.614 2.836 1.00 0.00 H new ATOM 0 HE1 HIS C 43 1.064 -15.296 0.805 1.00 0.00 H new ATOM 0 HE2 HIS C 43 2.801 -13.848 2.004 1.00 0.00 H new ATOM 2298 N ARG C 44 -3.375 -9.540 1.431 1.00 0.00 N ATOM 2299 CA ARG C 44 -4.542 -8.804 1.903 1.00 0.00 C ATOM 2300 C ARG C 44 -4.646 -8.939 3.427 1.00 0.00 C ATOM 2301 O ARG C 44 -4.234 -9.956 3.986 1.00 0.00 O ATOM 2302 CB ARG C 44 -5.764 -9.379 1.183 1.00 0.00 C ATOM 2303 CG ARG C 44 -5.963 -10.840 1.592 1.00 0.00 C ATOM 2304 CD ARG C 44 -6.808 -11.619 0.587 1.00 0.00 C ATOM 2305 NE ARG C 44 -8.231 -11.395 0.822 1.00 0.00 N ATOM 2306 CZ ARG C 44 -9.222 -12.124 0.308 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -8.974 -13.180 -0.458 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -10.486 -11.796 0.557 1.00 0.00 N ATOM 0 H ARG C 44 -3.617 -10.352 0.864 1.00 0.00 H new ATOM 0 HA ARG C 44 -4.469 -7.739 1.683 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -6.652 -8.797 1.432 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -5.629 -9.309 0.104 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -4.990 -11.321 1.694 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -6.441 -10.878 2.571 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -6.550 -11.313 -0.427 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -6.585 -12.683 0.665 1.00 0.00 H new ATOM 0 HE ARG C 44 -8.488 -10.617 1.429 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -8.011 -13.447 -0.663 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -9.747 -13.725 -0.842 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -10.697 -10.987 1.141 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -11.244 -12.353 0.164 1.00 0.00 H new ATOM 2322 N GLU C 45 -5.188 -7.932 4.114 1.00 0.00 N ATOM 2323 CA GLU C 45 -5.183 -7.923 5.576 1.00 0.00 C ATOM 2324 C GLU C 45 -6.122 -8.960 6.195 1.00 0.00 C ATOM 2325 O GLU C 45 -5.903 -9.363 7.335 1.00 0.00 O ATOM 2326 CB GLU C 45 -5.484 -6.512 6.090 1.00 0.00 C ATOM 2327 CG GLU C 45 -6.950 -6.096 5.934 1.00 0.00 C ATOM 2328 CD GLU C 45 -7.827 -6.553 7.100 1.00 0.00 C ATOM 2329 OE1 GLU C 45 -7.409 -6.334 8.256 1.00 0.00 O ATOM 2330 OE2 GLU C 45 -8.906 -7.119 6.823 1.00 0.00 O ATOM 0 H GLU C 45 -5.632 -7.120 3.686 1.00 0.00 H new ATOM 0 HA GLU C 45 -4.182 -8.215 5.895 1.00 0.00 H new ATOM 0 HB2 GLU C 45 -5.210 -6.453 7.143 1.00 0.00 H new ATOM 0 HB3 GLU C 45 -4.855 -5.799 5.556 1.00 0.00 H new ATOM 0 HG2 GLU C 45 -7.007 -5.011 5.847 1.00 0.00 H new ATOM 0 HG3 GLU C 45 -7.343 -6.511 5.006 1.00 0.00 H new ATOM 2337 N GLU C 46 -7.163 -9.400 5.473 1.00 0.00 N ATOM 2338 CA GLU C 46 -8.111 -10.371 6.008 1.00 0.00 C ATOM 2339 C GLU C 46 -7.586 -11.802 5.876 1.00 0.00 C ATOM 2340 O GLU C 46 -8.285 -12.749 6.228 1.00 0.00 O ATOM 2341 CB GLU C 46 -9.492 -10.229 5.354 1.00 0.00 C ATOM 2342 CG GLU C 46 -9.529 -10.623 3.876 1.00 0.00 C ATOM 2343 CD GLU C 46 -9.290 -9.438 2.951 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -8.288 -8.722 3.154 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -10.117 -9.252 2.029 1.00 0.00 O ATOM 0 H GLU C 46 -7.364 -9.096 4.520 1.00 0.00 H new ATOM 0 HA GLU C 46 -8.224 -10.157 7.071 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -10.206 -10.845 5.901 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -9.823 -9.195 5.451 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -8.773 -11.385 3.687 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -10.496 -11.070 3.646 1.00 0.00 H new ATOM 2352 N ILE C 47 -6.359 -11.965 5.369 1.00 0.00 N ATOM 2353 CA ILE C 47 -5.723 -13.264 5.227 1.00 0.00 C ATOM 2354 C ILE C 47 -4.312 -13.224 5.805 1.00 0.00 C ATOM 2355 O ILE C 47 -3.791 -14.262 6.204 1.00 0.00 O ATOM 2356 CB ILE C 47 -5.729 -13.682 3.745 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -7.076 -14.333 3.399 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -4.575 -14.618 3.385 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -6.997 -15.148 2.106 1.00 0.00 C ATOM 0 H ILE C 47 -5.782 -11.189 5.046 1.00 0.00 H new ATOM 0 HA ILE C 47 -6.282 -14.013 5.788 1.00 0.00 H new ATOM 0 HB ILE C 47 -5.589 -12.778 3.152 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -7.388 -14.980 4.218 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.838 -13.560 3.296 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -4.633 -14.877 2.328 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -3.626 -14.120 3.585 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -4.642 -15.525 3.985 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.970 -15.592 1.896 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -6.711 -14.495 1.281 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -6.254 -15.938 2.218 1.00 0.00 H new ATOM 2371 N TYR C 48 -3.667 -12.056 5.869 1.00 0.00 N ATOM 2372 CA TYR C 48 -2.317 -12.017 6.404 1.00 0.00 C ATOM 2373 C TYR C 48 -2.320 -12.455 7.862 1.00 0.00 C ATOM 2374 O TYR C 48 -1.365 -13.059 8.345 1.00 0.00 O ATOM 2375 CB TYR C 48 -1.740 -10.612 6.275 1.00 0.00 C ATOM 2376 CG TYR C 48 -0.338 -10.570 6.826 1.00 0.00 C ATOM 2377 CD1 TYR C 48 0.750 -10.863 5.994 1.00 0.00 C ATOM 2378 CD2 TYR C 48 -0.135 -10.252 8.177 1.00 0.00 C ATOM 2379 CE1 TYR C 48 2.050 -10.855 6.516 1.00 0.00 C ATOM 2380 CE2 TYR C 48 1.158 -10.242 8.705 1.00 0.00 C ATOM 2381 CZ TYR C 48 2.261 -10.530 7.872 1.00 0.00 C ATOM 2382 OH TYR C 48 3.524 -10.506 8.383 1.00 0.00 O ATOM 0 H TYR C 48 -4.046 -11.158 5.567 1.00 0.00 H new ATOM 0 HA TYR C 48 -1.692 -12.704 5.833 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -1.736 -10.308 5.228 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -2.370 -9.902 6.811 1.00 0.00 H new ATOM 0 HD1 TYR C 48 0.587 -11.095 4.952 1.00 0.00 H new ATOM 0 HD2 TYR C 48 -0.978 -10.015 8.809 1.00 0.00 H new ATOM 0 HE1 TYR C 48 2.889 -11.097 5.881 1.00 0.00 H new ATOM 0 HE2 TYR C 48 1.314 -10.014 9.749 1.00 0.00 H new ATOM 0 HH TYR C 48 4.142 -10.151 7.710 1.00 0.00 H new ATOM 2392 N GLN C 49 -3.409 -12.142 8.568 1.00 0.00 N ATOM 2393 CA GLN C 49 -3.549 -12.457 9.977 1.00 0.00 C ATOM 2394 C GLN C 49 -3.808 -13.944 10.189 1.00 0.00 C ATOM 2395 O GLN C 49 -3.695 -14.432 11.315 1.00 0.00 O ATOM 2396 CB GLN C 49 -4.686 -11.610 10.555 1.00 0.00 C ATOM 2397 CG GLN C 49 -4.388 -10.131 10.291 1.00 0.00 C ATOM 2398 CD GLN C 49 -5.470 -9.228 10.873 1.00 0.00 C ATOM 2399 OE1 GLN C 49 -5.646 -9.153 12.086 1.00 0.00 O ATOM 2400 NE2 GLN C 49 -6.200 -8.538 10.006 1.00 0.00 N ATOM 0 H GLN C 49 -4.216 -11.662 8.170 1.00 0.00 H new ATOM 0 HA GLN C 49 -2.619 -12.223 10.495 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -5.635 -11.891 10.098 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -4.783 -11.790 11.626 1.00 0.00 H new ATOM 0 HG2 GLN C 49 -3.423 -9.870 10.726 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -4.310 -9.961 9.217 1.00 0.00 H new ATOM 0 HE21 GLN C 49 -6.023 -8.627 9.005 1.00 0.00 H new ATOM 0 HE22 GLN C 49 -6.938 -7.918 10.340 1.00 0.00 H new ATOM 2409 N ARG C 50 -4.153 -14.666 9.116 1.00 0.00 N ATOM 2410 CA ARG C 50 -4.359 -16.106 9.172 1.00 0.00 C ATOM 2411 C ARG C 50 -3.070 -16.837 8.797 1.00 0.00 C ATOM 2412 O ARG C 50 -2.851 -17.955 9.251 1.00 0.00 O ATOM 2413 CB ARG C 50 -5.552 -16.499 8.286 1.00 0.00 C ATOM 2414 CG ARG C 50 -5.152 -17.083 6.925 1.00 0.00 C ATOM 2415 CD ARG C 50 -6.388 -17.242 6.039 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.307 -18.255 6.574 1.00 0.00 N ATOM 2417 CZ ARG C 50 -8.473 -18.583 6.003 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -8.875 -17.989 4.886 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -9.248 -19.511 6.555 1.00 0.00 N ATOM 0 H ARG C 50 -4.295 -14.263 8.190 1.00 0.00 H new ATOM 0 HA ARG C 50 -4.606 -16.408 10.190 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -6.162 -17.229 8.818 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -6.176 -15.620 8.124 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -4.428 -16.430 6.439 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -4.667 -18.049 7.063 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -6.905 -16.286 5.959 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -6.081 -17.523 5.032 1.00 0.00 H new ATOM 0 HE ARG C 50 -7.041 -18.738 7.432 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -8.293 -17.273 4.452 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -9.766 -18.249 4.462 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -8.955 -19.975 7.415 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -10.136 -19.760 6.119 1.00 0.00 H new ATOM 2433 N ILE C 51 -2.219 -16.212 7.977 1.00 0.00 N ATOM 2434 CA ILE C 51 -0.910 -16.747 7.629 1.00 0.00 C ATOM 2435 C ILE C 51 -0.002 -16.689 8.850 1.00 0.00 C ATOM 2436 O ILE C 51 0.638 -17.671 9.208 1.00 0.00 O ATOM 2437 CB ILE C 51 -0.316 -15.916 6.484 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -1.160 -16.092 5.222 1.00 0.00 C ATOM 2439 CG2 ILE C 51 1.125 -16.329 6.173 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -0.768 -15.066 4.166 1.00 0.00 C ATOM 0 H ILE C 51 -2.426 -15.316 7.536 1.00 0.00 H new ATOM 0 HA ILE C 51 -1.003 -17.784 7.306 1.00 0.00 H new ATOM 0 HB ILE C 51 -0.318 -14.873 6.802 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -1.026 -17.099 4.826 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -2.217 -15.984 5.467 1.00 0.00 H new ATOM 0 HG21 ILE C 51 1.511 -15.718 5.357 1.00 0.00 H new ATOM 0 HG22 ILE C 51 1.744 -16.184 7.058 1.00 0.00 H new ATOM 0 HG23 ILE C 51 1.148 -17.379 5.882 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -1.380 -15.208 3.276 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -0.926 -14.061 4.558 1.00 0.00 H new ATOM 0 HD13 ILE C 51 0.283 -15.193 3.908 1.00 0.00 H new ATOM 2452 N GLN C 52 0.044 -15.521 9.492 1.00 0.00 N ATOM 2453 CA GLN C 52 0.905 -15.305 10.644 1.00 0.00 C ATOM 2454 C GLN C 52 0.350 -15.980 11.894 1.00 0.00 C ATOM 2455 O GLN C 52 0.899 -15.818 12.984 1.00 0.00 O ATOM 2456 CB GLN C 52 1.127 -13.798 10.831 1.00 0.00 C ATOM 2457 CG GLN C 52 1.849 -13.233 9.607 1.00 0.00 C ATOM 2458 CD GLN C 52 3.093 -14.041 9.257 1.00 0.00 C ATOM 2459 OE1 GLN C 52 4.058 -14.083 10.014 1.00 0.00 O ATOM 2460 NE2 GLN C 52 3.071 -14.695 8.099 1.00 0.00 N ATOM 0 H GLN C 52 -0.511 -14.707 9.227 1.00 0.00 H new ATOM 0 HA GLN C 52 1.874 -15.772 10.466 1.00 0.00 H new ATOM 0 HB2 GLN C 52 0.171 -13.293 10.968 1.00 0.00 H new ATOM 0 HB3 GLN C 52 1.715 -13.615 11.730 1.00 0.00 H new ATOM 0 HG2 GLN C 52 1.169 -13.227 8.755 1.00 0.00 H new ATOM 0 HG3 GLN C 52 2.131 -12.197 9.798 1.00 0.00 H new ATOM 0 HE21 GLN C 52 2.251 -14.636 7.496 1.00 0.00 H new ATOM 0 HE22 GLN C 52 3.874 -15.255 7.814 1.00 0.00 H new ATOM 2469 N ALA C 53 -0.742 -16.741 11.747 1.00 0.00 N ATOM 2470 CA ALA C 53 -1.326 -17.471 12.858 1.00 0.00 C ATOM 2471 C ALA C 53 -0.452 -18.667 13.257 1.00 0.00 C ATOM 2472 O ALA C 53 -0.622 -19.209 14.351 1.00 0.00 O ATOM 2473 CB ALA C 53 -2.728 -17.940 12.475 1.00 0.00 C ATOM 0 H ALA C 53 -1.234 -16.862 10.862 1.00 0.00 H new ATOM 0 HA ALA C 53 -1.387 -16.806 13.719 1.00 0.00 H new ATOM 0 HB1 ALA C 53 -3.168 -18.488 13.308 1.00 0.00 H new ATOM 0 HB2 ALA C 53 -3.349 -17.076 12.241 1.00 0.00 H new ATOM 0 HB3 ALA C 53 -2.668 -18.591 11.603 1.00 0.00 H new ATOM 2479 N GLY C 54 0.473 -19.082 12.384 1.00 0.00 N ATOM 2480 CA GLY C 54 1.371 -20.198 12.652 1.00 0.00 C ATOM 2481 C GLY C 54 1.417 -21.187 11.489 1.00 0.00 C ATOM 2482 O GLY C 54 1.859 -22.322 11.664 1.00 0.00 O ATOM 0 H GLY C 54 0.616 -18.649 11.472 1.00 0.00 H new ATOM 0 HA2 GLY C 54 2.374 -19.818 12.845 1.00 0.00 H new ATOM 0 HA3 GLY C 54 1.047 -20.715 13.555 1.00 0.00 H new ATOM 2486 N LEU C 55 0.960 -20.765 10.308 1.00 0.00 N ATOM 2487 CA LEU C 55 0.831 -21.626 9.142 1.00 0.00 C ATOM 2488 C LEU C 55 1.296 -20.894 7.878 1.00 0.00 C ATOM 2489 O LEU C 55 1.836 -19.794 7.959 1.00 0.00 O ATOM 2490 CB LEU C 55 -0.622 -22.102 9.052 1.00 0.00 C ATOM 2491 CG LEU C 55 -1.640 -20.955 8.975 1.00 0.00 C ATOM 2492 CD1 LEU C 55 -1.725 -20.353 7.570 1.00 0.00 C ATOM 2493 CD2 LEU C 55 -3.014 -21.505 9.347 1.00 0.00 C ATOM 0 H LEU C 55 0.667 -19.803 10.138 1.00 0.00 H new ATOM 0 HA LEU C 55 1.474 -22.501 9.237 1.00 0.00 H new ATOM 0 HB2 LEU C 55 -0.734 -22.736 8.173 1.00 0.00 H new ATOM 0 HB3 LEU C 55 -0.848 -22.720 9.921 1.00 0.00 H new ATOM 0 HG LEU C 55 -1.318 -20.171 9.660 1.00 0.00 H new ATOM 0 HD11 LEU C 55 -2.457 -19.546 7.564 1.00 0.00 H new ATOM 0 HD12 LEU C 55 -0.750 -19.960 7.283 1.00 0.00 H new ATOM 0 HD13 LEU C 55 -2.029 -21.124 6.862 1.00 0.00 H new ATOM 0 HD21 LEU C 55 -3.752 -20.704 9.298 1.00 0.00 H new ATOM 0 HD22 LEU C 55 -3.290 -22.296 8.650 1.00 0.00 H new ATOM 0 HD23 LEU C 55 -2.983 -21.908 10.359 1.00 0.00 H new ATOM 2505 N THR C 56 1.091 -21.505 6.710 1.00 0.00 N ATOM 2506 CA THR C 56 1.469 -20.915 5.433 1.00 0.00 C ATOM 2507 C THR C 56 0.388 -21.177 4.386 1.00 0.00 C ATOM 2508 O THR C 56 -0.577 -21.897 4.649 1.00 0.00 O ATOM 2509 CB THR C 56 2.821 -21.468 4.973 1.00 0.00 C ATOM 2510 OG1 THR C 56 2.777 -22.878 4.886 1.00 0.00 O ATOM 2511 CG2 THR C 56 3.920 -21.069 5.957 1.00 0.00 C ATOM 0 H THR C 56 0.657 -22.424 6.627 1.00 0.00 H new ATOM 0 HA THR C 56 1.566 -19.837 5.558 1.00 0.00 H new ATOM 0 HB THR C 56 3.038 -21.050 3.990 1.00 0.00 H new ATOM 0 HG1 THR C 56 3.648 -23.215 4.589 1.00 0.00 H new ATOM 0 HG21 THR C 56 4.875 -21.469 5.617 1.00 0.00 H new ATOM 0 HG22 THR C 56 3.981 -19.982 6.013 1.00 0.00 H new ATOM 0 HG23 THR C 56 3.689 -21.471 6.943 1.00 0.00 H new ATOM 2519 N ALA C 57 0.550 -20.589 3.197 1.00 0.00 N ATOM 2520 CA ALA C 57 -0.406 -20.725 2.108 1.00 0.00 C ATOM 2521 C ALA C 57 -0.686 -22.193 1.775 1.00 0.00 C ATOM 2522 O ALA C 57 0.163 -23.056 2.008 1.00 0.00 O ATOM 2523 CB ALA C 57 0.157 -20.003 0.886 1.00 0.00 C ATOM 0 H ALA C 57 1.353 -20.004 2.968 1.00 0.00 H new ATOM 0 HA ALA C 57 -1.355 -20.283 2.412 1.00 0.00 H new ATOM 0 HB1 ALA C 57 -0.544 -20.092 0.056 1.00 0.00 H new ATOM 0 HB2 ALA C 57 0.307 -18.950 1.123 1.00 0.00 H new ATOM 0 HB3 ALA C 57 1.110 -20.451 0.606 1.00 0.00 H new