USER MOD reduce.3.24.130724 H: found=0, std=0, add=935, rem=0, adj=17 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= -0.0264 X(o=-0.03,f=-0.14) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc=-0.00314 USER MOD Set 2.1: A 11 SER OG : rot 180:sc= 0.178 USER MOD Set 2.2: A 21 THR OG1 : rot -69:sc= 0.202 USER MOD Single : A 1 MET CE :methyl 175:sc= -0.181 (180deg=-0.21) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 ASN : amide:sc= 1.02 K(o=1,f=-0.66) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= -0.339 X(o=-0.34,f=-0.003) USER MOD Single : A 35 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HE2:sc= -0.877 X(o=-0.88,f=-0.95) USER MOD Single : A 48 TYR OH : rot 23:sc= 0.00943 USER MOD Single : A 49 GLN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : A 52 GLN : amide:sc= -2.65! K(o=-2.6!,f=-1.5) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl 180:sc= -0.295 (180deg=-0.295) USER MOD Single : C 1 MET N :NH3+ 133:sc= 0.0123 (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 11 SER OG : rot 180:sc= 0 USER MOD Single : C 21 THR OG1 : rot 180:sc=-0.00268 USER MOD Single : C 26 SER OG : rot 8:sc= 0.186 USER MOD Single : C 28 GLN : amide:sc= -0.515 K(o=-0.51,f=-3.9!) USER MOD Single : C 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 35 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HD1:sc= -0.944 X(o=-0.94,f=-0.67) USER MOD Single : C 48 TYR OH : rot 26:sc= 0.0244 USER MOD Single : C 49 GLN : amide:sc= 0.58 K(o=0.58,f=0) USER MOD Single : C 52 GLN : amide:sc= -3.4! K(o=-3.4!,f=-1.4) USER MOD Single : C 56 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.820 -7.861 -10.115 1.00 0.00 N ATOM 2 CA MET A 1 4.110 -6.851 -9.307 1.00 0.00 C ATOM 3 C MET A 1 2.765 -7.403 -8.858 1.00 0.00 C ATOM 4 O MET A 1 1.989 -7.869 -9.690 1.00 0.00 O ATOM 5 CB MET A 1 3.922 -5.559 -10.110 1.00 0.00 C ATOM 6 CG MET A 1 3.732 -4.371 -9.167 1.00 0.00 C ATOM 7 SD MET A 1 3.554 -2.771 -9.995 1.00 0.00 S ATOM 8 CE MET A 1 1.937 -3.006 -10.771 1.00 0.00 C ATOM 0 H1 MET A 1 5.738 -7.479 -10.419 1.00 0.00 H new ATOM 0 H2 MET A 1 4.973 -8.717 -9.545 1.00 0.00 H new ATOM 0 H3 MET A 1 4.250 -8.100 -10.951 1.00 0.00 H new ATOM 0 HA MET A 1 4.707 -6.619 -8.425 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.789 -5.390 -10.748 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.057 -5.653 -10.766 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.848 -4.548 -8.554 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.585 -4.322 -8.490 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.627 -2.079 -11.254 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.003 -3.799 -11.516 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.206 -3.282 -10.011 1.00 0.00 H new ATOM 20 N LEU A 2 2.476 -7.362 -7.554 1.00 0.00 N ATOM 21 CA LEU A 2 1.248 -7.927 -7.011 1.00 0.00 C ATOM 22 C LEU A 2 0.197 -6.814 -6.945 1.00 0.00 C ATOM 23 O LEU A 2 0.511 -5.698 -6.533 1.00 0.00 O ATOM 24 CB LEU A 2 1.586 -8.496 -5.621 1.00 0.00 C ATOM 25 CG LEU A 2 0.660 -9.605 -5.092 1.00 0.00 C ATOM 26 CD1 LEU A 2 0.676 -9.577 -3.569 1.00 0.00 C ATOM 27 CD2 LEU A 2 -0.781 -9.499 -5.561 1.00 0.00 C ATOM 0 H LEU A 2 3.085 -6.938 -6.854 1.00 0.00 H new ATOM 0 HA LEU A 2 0.843 -8.729 -7.628 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.604 -8.885 -5.650 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.579 -7.674 -4.905 1.00 0.00 H new ATOM 0 HG LEU A 2 1.049 -10.541 -5.494 1.00 0.00 H new ATOM 0 HD11 LEU A 2 0.022 -10.360 -3.184 1.00 0.00 H new ATOM 0 HD12 LEU A 2 1.692 -9.745 -3.213 1.00 0.00 H new ATOM 0 HD13 LEU A 2 0.325 -8.606 -3.219 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -1.362 -10.320 -5.141 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -1.202 -8.550 -5.230 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -0.814 -9.551 -6.649 1.00 0.00 H new ATOM 39 N ILE A 3 -1.048 -7.100 -7.341 1.00 0.00 N ATOM 40 CA ILE A 3 -2.140 -6.139 -7.302 1.00 0.00 C ATOM 41 C ILE A 3 -3.250 -6.666 -6.405 1.00 0.00 C ATOM 42 O ILE A 3 -3.543 -7.858 -6.408 1.00 0.00 O ATOM 43 CB ILE A 3 -2.686 -5.860 -8.718 1.00 0.00 C ATOM 44 CG1 ILE A 3 -1.741 -4.955 -9.512 1.00 0.00 C ATOM 45 CG2 ILE A 3 -4.028 -5.126 -8.640 1.00 0.00 C ATOM 46 CD1 ILE A 3 -0.639 -5.717 -10.245 1.00 0.00 C ATOM 0 H ILE A 3 -1.322 -8.015 -7.700 1.00 0.00 H new ATOM 0 HA ILE A 3 -1.761 -5.200 -6.899 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.789 -6.828 -9.208 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -2.321 -4.385 -10.237 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.284 -4.235 -8.833 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -4.399 -4.937 -9.648 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.747 -5.740 -8.098 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -3.894 -4.178 -8.119 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.008 -5.012 -10.786 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -0.034 -6.266 -9.523 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -1.088 -6.417 -10.950 1.00 0.00 H new ATOM 58 N LEU A 4 -3.863 -5.757 -5.643 1.00 0.00 N ATOM 59 CA LEU A 4 -4.958 -6.045 -4.733 1.00 0.00 C ATOM 60 C LEU A 4 -6.099 -5.073 -5.013 1.00 0.00 C ATOM 61 O LEU A 4 -5.934 -4.066 -5.704 1.00 0.00 O ATOM 62 CB LEU A 4 -4.503 -5.845 -3.277 1.00 0.00 C ATOM 63 CG LEU A 4 -3.867 -7.046 -2.566 1.00 0.00 C ATOM 64 CD1 LEU A 4 -4.844 -8.213 -2.443 1.00 0.00 C ATOM 65 CD2 LEU A 4 -2.611 -7.543 -3.265 1.00 0.00 C ATOM 0 H LEU A 4 -3.598 -4.772 -5.647 1.00 0.00 H new ATOM 0 HA LEU A 4 -5.280 -7.076 -4.879 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -3.787 -5.024 -3.258 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.368 -5.528 -2.694 1.00 0.00 H new ATOM 0 HG LEU A 4 -3.598 -6.683 -1.574 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -4.356 -9.044 -1.934 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.716 -7.898 -1.870 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.158 -8.531 -3.437 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -2.203 -8.394 -2.719 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -2.857 -7.849 -4.282 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -1.871 -6.743 -3.296 1.00 0.00 H new ATOM 77 N THR A 5 -7.264 -5.392 -4.454 1.00 0.00 N ATOM 78 CA THR A 5 -8.439 -4.549 -4.509 1.00 0.00 C ATOM 79 C THR A 5 -8.924 -4.378 -3.077 1.00 0.00 C ATOM 80 O THR A 5 -8.985 -5.343 -2.309 1.00 0.00 O ATOM 81 CB THR A 5 -9.490 -5.195 -5.414 1.00 0.00 C ATOM 82 OG1 THR A 5 -8.971 -5.287 -6.720 1.00 0.00 O ATOM 83 CG2 THR A 5 -10.782 -4.379 -5.473 1.00 0.00 C ATOM 0 H THR A 5 -7.413 -6.262 -3.942 1.00 0.00 H new ATOM 0 HA THR A 5 -8.226 -3.569 -4.935 1.00 0.00 H new ATOM 0 HB THR A 5 -9.722 -6.177 -5.001 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.636 -5.701 -7.308 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.497 -4.877 -6.127 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.204 -4.293 -4.472 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.566 -3.384 -5.862 1.00 0.00 H new ATOM 91 N ARG A 6 -9.262 -3.144 -2.711 1.00 0.00 N ATOM 92 CA ARG A 6 -9.535 -2.780 -1.331 1.00 0.00 C ATOM 93 C ARG A 6 -10.651 -1.742 -1.316 1.00 0.00 C ATOM 94 O ARG A 6 -11.058 -1.271 -2.376 1.00 0.00 O ATOM 95 CB ARG A 6 -8.227 -2.214 -0.765 1.00 0.00 C ATOM 96 CG ARG A 6 -8.128 -2.120 0.758 1.00 0.00 C ATOM 97 CD ARG A 6 -7.893 -3.480 1.421 1.00 0.00 C ATOM 98 NE ARG A 6 -9.117 -4.281 1.534 1.00 0.00 N ATOM 99 CZ ARG A 6 -9.180 -5.477 2.128 1.00 0.00 C ATOM 100 NH1 ARG A 6 -8.105 -6.022 2.693 1.00 0.00 N ATOM 101 NH2 ARG A 6 -10.330 -6.138 2.156 1.00 0.00 N ATOM 0 H ARG A 6 -9.353 -2.369 -3.368 1.00 0.00 H new ATOM 0 HA ARG A 6 -9.862 -3.626 -0.727 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -7.404 -2.833 -1.123 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -8.079 -1.217 -1.179 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -7.314 -1.446 1.024 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -9.046 -1.683 1.151 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -7.153 -4.036 0.845 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -7.473 -3.326 2.415 1.00 0.00 H new ATOM 0 HE ARG A 6 -9.975 -3.901 1.134 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -7.214 -5.526 2.677 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -8.172 -6.936 3.142 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -11.161 -5.733 1.725 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -10.383 -7.051 2.608 1.00 0.00 H new ATOM 115 N LYS A 7 -11.150 -1.375 -0.137 1.00 0.00 N ATOM 116 CA LYS A 7 -12.159 -0.331 -0.015 1.00 0.00 C ATOM 117 C LYS A 7 -11.800 0.606 1.127 1.00 0.00 C ATOM 118 O LYS A 7 -11.027 0.248 2.013 1.00 0.00 O ATOM 119 CB LYS A 7 -13.540 -0.937 0.235 1.00 0.00 C ATOM 120 CG LYS A 7 -13.856 -2.108 -0.699 1.00 0.00 C ATOM 121 CD LYS A 7 -15.350 -2.408 -0.608 1.00 0.00 C ATOM 122 CE LYS A 7 -15.702 -3.747 -1.259 1.00 0.00 C ATOM 123 NZ LYS A 7 -17.147 -4.010 -1.135 1.00 0.00 N ATOM 0 H LYS A 7 -10.868 -1.790 0.751 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.187 0.228 -0.950 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -13.600 -1.277 1.269 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.298 -0.164 0.109 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -13.581 -1.860 -1.724 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -13.275 -2.986 -0.416 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -15.655 -2.421 0.438 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -15.911 -1.609 -1.093 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -15.416 -3.734 -2.311 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -15.137 -4.550 -0.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -17.373 -4.922 -1.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -17.409 -4.042 -0.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -17.680 -3.252 -1.608 1.00 0.00 H new ATOM 137 N VAL A 8 -12.366 1.815 1.096 1.00 0.00 N ATOM 138 CA VAL A 8 -12.142 2.832 2.112 1.00 0.00 C ATOM 139 C VAL A 8 -12.400 2.256 3.499 1.00 0.00 C ATOM 140 O VAL A 8 -13.530 1.881 3.815 1.00 0.00 O ATOM 141 CB VAL A 8 -13.062 4.022 1.845 1.00 0.00 C ATOM 142 CG1 VAL A 8 -12.927 5.045 2.968 1.00 0.00 C ATOM 143 CG2 VAL A 8 -12.687 4.662 0.509 1.00 0.00 C ATOM 0 H VAL A 8 -12.999 2.113 0.354 1.00 0.00 H new ATOM 0 HA VAL A 8 -11.105 3.166 2.070 1.00 0.00 H new ATOM 0 HB VAL A 8 -14.096 3.679 1.804 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.586 5.891 2.771 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -13.203 4.583 3.916 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -11.895 5.393 3.021 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.342 5.512 0.316 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.652 5.003 0.546 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.799 3.929 -0.290 1.00 0.00 H new ATOM 153 N GLY A 9 -11.356 2.187 4.328 1.00 0.00 N ATOM 154 CA GLY A 9 -11.487 1.723 5.702 1.00 0.00 C ATOM 155 C GLY A 9 -10.865 0.348 5.924 1.00 0.00 C ATOM 156 O GLY A 9 -11.043 -0.238 6.990 1.00 0.00 O ATOM 0 H GLY A 9 -10.406 2.450 4.065 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -11.014 2.443 6.370 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.543 1.686 5.969 1.00 0.00 H new ATOM 160 N GLU A 10 -10.137 -0.168 4.932 1.00 0.00 N ATOM 161 CA GLU A 10 -9.502 -1.475 5.016 1.00 0.00 C ATOM 162 C GLU A 10 -7.988 -1.339 4.836 1.00 0.00 C ATOM 163 O GLU A 10 -7.488 -0.240 4.598 1.00 0.00 O ATOM 164 CB GLU A 10 -10.097 -2.411 3.967 1.00 0.00 C ATOM 165 CG GLU A 10 -11.611 -2.556 4.113 1.00 0.00 C ATOM 166 CD GLU A 10 -12.177 -3.510 3.063 1.00 0.00 C ATOM 167 OE1 GLU A 10 -11.715 -3.444 1.901 1.00 0.00 O ATOM 168 OE2 GLU A 10 -13.077 -4.304 3.427 1.00 0.00 O ATOM 0 H GLU A 10 -9.974 0.313 4.048 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.688 -1.902 6.001 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.865 -2.032 2.972 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.630 -3.392 4.052 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.849 -2.926 5.110 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.084 -1.579 4.014 1.00 0.00 H new ATOM 175 N SER A 11 -7.260 -2.456 4.949 1.00 0.00 N ATOM 176 CA SER A 11 -5.801 -2.424 4.984 1.00 0.00 C ATOM 177 C SER A 11 -5.173 -3.643 4.305 1.00 0.00 C ATOM 178 O SER A 11 -5.861 -4.613 3.979 1.00 0.00 O ATOM 179 CB SER A 11 -5.348 -2.333 6.444 1.00 0.00 C ATOM 180 OG SER A 11 -5.757 -1.110 7.009 1.00 0.00 O ATOM 0 H SER A 11 -7.661 -3.391 5.017 1.00 0.00 H new ATOM 0 HA SER A 11 -5.464 -1.551 4.425 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.767 -3.162 7.014 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.263 -2.423 6.501 1.00 0.00 H new ATOM 0 HG SER A 11 -5.462 -1.066 7.943 1.00 0.00 H new ATOM 186 N ILE A 12 -3.855 -3.577 4.094 1.00 0.00 N ATOM 187 CA ILE A 12 -3.020 -4.593 3.454 1.00 0.00 C ATOM 188 C ILE A 12 -1.732 -4.728 4.272 1.00 0.00 C ATOM 189 O ILE A 12 -1.451 -3.868 5.104 1.00 0.00 O ATOM 190 CB ILE A 12 -2.731 -4.157 2.007 1.00 0.00 C ATOM 191 CG1 ILE A 12 -4.012 -4.101 1.166 1.00 0.00 C ATOM 192 CG2 ILE A 12 -1.717 -5.077 1.321 1.00 0.00 C ATOM 193 CD1 ILE A 12 -4.682 -5.468 0.995 1.00 0.00 C ATOM 0 H ILE A 12 -3.312 -2.764 4.383 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.518 -5.562 3.420 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.305 -3.156 2.073 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.717 -3.414 1.635 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.776 -3.694 0.183 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.543 -4.731 0.302 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -0.778 -5.061 1.875 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -2.107 -6.095 1.298 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -5.582 -5.359 0.390 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.993 -6.152 0.499 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -4.948 -5.868 1.974 1.00 0.00 H new ATOM 205 N ASN A 13 -0.950 -5.786 4.054 1.00 0.00 N ATOM 206 CA ASN A 13 0.217 -6.072 4.881 1.00 0.00 C ATOM 207 C ASN A 13 1.436 -6.444 4.033 1.00 0.00 C ATOM 208 O ASN A 13 1.295 -7.022 2.958 1.00 0.00 O ATOM 209 CB ASN A 13 -0.155 -7.211 5.828 1.00 0.00 C ATOM 210 CG ASN A 13 0.727 -7.230 7.065 1.00 0.00 C ATOM 211 OD1 ASN A 13 1.909 -7.549 6.990 1.00 0.00 O ATOM 212 ND2 ASN A 13 0.148 -6.883 8.211 1.00 0.00 N ATOM 0 H ASN A 13 -1.107 -6.461 3.306 1.00 0.00 H new ATOM 0 HA ASN A 13 0.495 -5.181 5.444 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.198 -7.108 6.127 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.066 -8.163 5.304 1.00 0.00 H new ATOM 0 HD21 ASN A 13 0.691 -6.875 9.075 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.839 -6.625 8.226 1.00 0.00 H new ATOM 219 N ILE A 14 2.634 -6.106 4.529 1.00 0.00 N ATOM 220 CA ILE A 14 3.898 -6.381 3.853 1.00 0.00 C ATOM 221 C ILE A 14 4.961 -6.748 4.889 1.00 0.00 C ATOM 222 O ILE A 14 4.944 -6.251 6.016 1.00 0.00 O ATOM 223 CB ILE A 14 4.350 -5.145 3.059 1.00 0.00 C ATOM 224 CG1 ILE A 14 3.277 -4.724 2.045 1.00 0.00 C ATOM 225 CG2 ILE A 14 5.678 -5.425 2.344 1.00 0.00 C ATOM 226 CD1 ILE A 14 3.668 -3.465 1.274 1.00 0.00 C ATOM 0 H ILE A 14 2.748 -5.628 5.423 1.00 0.00 H new ATOM 0 HA ILE A 14 3.762 -7.213 3.163 1.00 0.00 H new ATOM 0 HB ILE A 14 4.497 -4.325 3.761 1.00 0.00 H new ATOM 0 HG12 ILE A 14 3.106 -5.539 1.342 1.00 0.00 H new ATOM 0 HG13 ILE A 14 2.336 -4.550 2.567 1.00 0.00 H new ATOM 0 HG21 ILE A 14 5.985 -4.540 1.786 1.00 0.00 H new ATOM 0 HG22 ILE A 14 6.443 -5.673 3.080 1.00 0.00 H new ATOM 0 HG23 ILE A 14 5.552 -6.261 1.657 1.00 0.00 H new ATOM 0 HD11 ILE A 14 2.876 -3.209 0.570 1.00 0.00 H new ATOM 0 HD12 ILE A 14 3.813 -2.641 1.973 1.00 0.00 H new ATOM 0 HD13 ILE A 14 4.594 -3.645 0.729 1.00 0.00 H new ATOM 238 N GLY A 15 5.895 -7.623 4.504 1.00 0.00 N ATOM 239 CA GLY A 15 6.984 -8.027 5.378 1.00 0.00 C ATOM 240 C GLY A 15 6.442 -8.653 6.657 1.00 0.00 C ATOM 241 O GLY A 15 5.520 -9.467 6.615 1.00 0.00 O ATOM 0 H GLY A 15 5.912 -8.064 3.584 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.626 -8.740 4.862 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.601 -7.162 5.623 1.00 0.00 H new ATOM 245 N ASP A 16 7.025 -8.263 7.792 1.00 0.00 N ATOM 246 CA ASP A 16 6.613 -8.742 9.103 1.00 0.00 C ATOM 247 C ASP A 16 6.408 -7.572 10.064 1.00 0.00 C ATOM 248 O ASP A 16 6.158 -7.785 11.249 1.00 0.00 O ATOM 249 CB ASP A 16 7.661 -9.722 9.640 1.00 0.00 C ATOM 250 CG ASP A 16 7.860 -10.913 8.710 1.00 0.00 C ATOM 251 OD1 ASP A 16 7.077 -11.880 8.824 1.00 0.00 O ATOM 252 OD2 ASP A 16 8.799 -10.845 7.886 1.00 0.00 O ATOM 0 H ASP A 16 7.801 -7.602 7.822 1.00 0.00 H new ATOM 0 HA ASP A 16 5.660 -9.263 9.013 1.00 0.00 H new ATOM 0 HB2 ASP A 16 8.610 -9.202 9.771 1.00 0.00 H new ATOM 0 HB3 ASP A 16 7.354 -10.078 10.624 1.00 0.00 H new ATOM 257 N ASP A 17 6.511 -6.338 9.560 1.00 0.00 N ATOM 258 CA ASP A 17 6.421 -5.139 10.389 1.00 0.00 C ATOM 259 C ASP A 17 5.736 -3.978 9.665 1.00 0.00 C ATOM 260 O ASP A 17 5.664 -2.882 10.224 1.00 0.00 O ATOM 261 CB ASP A 17 7.830 -4.711 10.811 1.00 0.00 C ATOM 262 CG ASP A 17 8.524 -5.768 11.667 1.00 0.00 C ATOM 263 OD1 ASP A 17 8.244 -5.790 12.888 1.00 0.00 O ATOM 264 OD2 ASP A 17 9.321 -6.537 11.093 1.00 0.00 O ATOM 0 H ASP A 17 6.659 -6.146 8.569 1.00 0.00 H new ATOM 0 HA ASP A 17 5.814 -5.386 11.260 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.430 -4.515 9.922 1.00 0.00 H new ATOM 0 HB3 ASP A 17 7.772 -3.776 11.368 1.00 0.00 H new ATOM 269 N ILE A 18 5.229 -4.176 8.441 1.00 0.00 N ATOM 270 CA ILE A 18 4.615 -3.097 7.680 1.00 0.00 C ATOM 271 C ILE A 18 3.141 -3.386 7.420 1.00 0.00 C ATOM 272 O ILE A 18 2.756 -4.523 7.152 1.00 0.00 O ATOM 273 CB ILE A 18 5.338 -2.893 6.340 1.00 0.00 C ATOM 274 CG1 ILE A 18 6.841 -2.627 6.500 1.00 0.00 C ATOM 275 CG2 ILE A 18 4.707 -1.712 5.596 1.00 0.00 C ATOM 276 CD1 ILE A 18 7.630 -3.934 6.458 1.00 0.00 C ATOM 0 H ILE A 18 5.235 -5.077 7.962 1.00 0.00 H new ATOM 0 HA ILE A 18 4.700 -2.187 8.274 1.00 0.00 H new ATOM 0 HB ILE A 18 5.227 -3.821 5.779 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.184 -1.964 5.706 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.026 -2.115 7.445 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.219 -1.566 4.645 1.00 0.00 H new ATOM 0 HG22 ILE A 18 3.653 -1.919 5.413 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.800 -0.810 6.200 1.00 0.00 H new ATOM 0 HD11 ILE A 18 8.693 -3.721 6.573 1.00 0.00 H new ATOM 0 HD12 ILE A 18 7.300 -4.584 7.268 1.00 0.00 H new ATOM 0 HD13 ILE A 18 7.461 -4.431 5.502 1.00 0.00 H new ATOM 288 N THR A 19 2.320 -2.339 7.498 1.00 0.00 N ATOM 289 CA THR A 19 0.905 -2.419 7.164 1.00 0.00 C ATOM 290 C THR A 19 0.526 -1.150 6.416 1.00 0.00 C ATOM 291 O THR A 19 1.105 -0.096 6.664 1.00 0.00 O ATOM 292 CB THR A 19 0.070 -2.585 8.442 1.00 0.00 C ATOM 293 OG1 THR A 19 0.655 -3.559 9.280 1.00 0.00 O ATOM 294 CG2 THR A 19 -1.346 -3.052 8.121 1.00 0.00 C ATOM 0 H THR A 19 2.622 -1.411 7.796 1.00 0.00 H new ATOM 0 HA THR A 19 0.707 -3.285 6.532 1.00 0.00 H new ATOM 0 HB THR A 19 0.037 -1.613 8.934 1.00 0.00 H new ATOM 0 HG1 THR A 19 0.117 -3.657 10.093 1.00 0.00 H new ATOM 0 HG21 THR A 19 -1.912 -3.160 9.046 1.00 0.00 H new ATOM 0 HG22 THR A 19 -1.835 -2.318 7.480 1.00 0.00 H new ATOM 0 HG23 THR A 19 -1.305 -4.012 7.607 1.00 0.00 H new ATOM 302 N ILE A 20 -0.442 -1.239 5.503 1.00 0.00 N ATOM 303 CA ILE A 20 -0.848 -0.125 4.652 1.00 0.00 C ATOM 304 C ILE A 20 -2.363 0.035 4.731 1.00 0.00 C ATOM 305 O ILE A 20 -3.066 -0.951 4.934 1.00 0.00 O ATOM 306 CB ILE A 20 -0.408 -0.397 3.205 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.062 -0.840 3.097 1.00 0.00 C ATOM 308 CG2 ILE A 20 -0.624 0.854 2.350 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.058 0.232 3.533 1.00 0.00 C ATOM 0 H ILE A 20 -0.970 -2.095 5.334 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.375 0.797 4.991 1.00 0.00 H new ATOM 0 HB ILE A 20 -1.023 -1.220 2.841 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.210 -1.731 3.707 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.273 -1.122 2.065 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.310 0.653 1.326 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.680 1.123 2.359 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -0.036 1.678 2.755 1.00 0.00 H new ATOM 0 HD11 ILE A 20 3.073 -0.151 3.430 1.00 0.00 H new ATOM 0 HD12 ILE A 20 1.938 1.116 2.907 1.00 0.00 H new ATOM 0 HD13 ILE A 20 1.874 0.497 4.574 1.00 0.00 H new ATOM 321 N THR A 21 -2.869 1.264 4.578 1.00 0.00 N ATOM 322 CA THR A 21 -4.290 1.548 4.771 1.00 0.00 C ATOM 323 C THR A 21 -4.814 2.521 3.720 1.00 0.00 C ATOM 324 O THR A 21 -4.073 3.377 3.235 1.00 0.00 O ATOM 325 CB THR A 21 -4.479 2.147 6.171 1.00 0.00 C ATOM 326 OG1 THR A 21 -3.848 1.342 7.141 1.00 0.00 O ATOM 327 CG2 THR A 21 -5.960 2.271 6.535 1.00 0.00 C ATOM 0 H THR A 21 -2.311 2.078 4.320 1.00 0.00 H new ATOM 0 HA THR A 21 -4.852 0.620 4.669 1.00 0.00 H new ATOM 0 HB THR A 21 -4.031 3.141 6.156 1.00 0.00 H new ATOM 0 HG1 THR A 21 -4.327 0.491 7.222 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.055 2.699 7.533 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.459 2.918 5.814 1.00 0.00 H new ATOM 0 HG23 THR A 21 -6.423 1.284 6.518 1.00 0.00 H new ATOM 335 N ILE A 22 -6.096 2.383 3.371 1.00 0.00 N ATOM 336 CA ILE A 22 -6.789 3.270 2.443 1.00 0.00 C ATOM 337 C ILE A 22 -7.792 4.096 3.240 1.00 0.00 C ATOM 338 O ILE A 22 -8.915 3.668 3.507 1.00 0.00 O ATOM 339 CB ILE A 22 -7.416 2.461 1.297 1.00 0.00 C ATOM 340 CG1 ILE A 22 -8.344 3.310 0.422 1.00 0.00 C ATOM 341 CG2 ILE A 22 -8.193 1.245 1.797 1.00 0.00 C ATOM 342 CD1 ILE A 22 -7.589 4.462 -0.241 1.00 0.00 C ATOM 0 H ILE A 22 -6.689 1.637 3.734 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.099 3.962 1.961 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.572 2.121 0.697 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.798 2.682 -0.345 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.156 3.708 1.030 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -8.615 0.709 0.947 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.521 0.585 2.346 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -8.997 1.573 2.455 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.278 5.043 -0.854 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.157 5.103 0.527 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.793 4.062 -0.869 1.00 0.00 H new ATOM 354 N LEU A 23 -7.368 5.301 3.625 1.00 0.00 N ATOM 355 CA LEU A 23 -8.125 6.167 4.512 1.00 0.00 C ATOM 356 C LEU A 23 -9.349 6.757 3.813 1.00 0.00 C ATOM 357 O LEU A 23 -10.319 7.120 4.478 1.00 0.00 O ATOM 358 CB LEU A 23 -7.216 7.295 5.000 1.00 0.00 C ATOM 359 CG LEU A 23 -5.902 6.759 5.571 1.00 0.00 C ATOM 360 CD1 LEU A 23 -5.019 7.935 5.956 1.00 0.00 C ATOM 361 CD2 LEU A 23 -6.135 5.884 6.798 1.00 0.00 C ATOM 0 H LEU A 23 -6.480 5.701 3.323 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.479 5.573 5.355 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.003 7.974 4.174 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.734 7.875 5.764 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.422 6.146 4.808 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.079 7.565 6.365 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.817 8.543 5.074 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.527 8.541 6.706 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.178 5.523 7.174 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -6.632 6.468 7.572 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.762 5.035 6.526 1.00 0.00 H new ATOM 373 N GLY A 24 -9.315 6.854 2.482 1.00 0.00 N ATOM 374 CA GLY A 24 -10.448 7.359 1.721 1.00 0.00 C ATOM 375 C GLY A 24 -10.090 7.719 0.285 1.00 0.00 C ATOM 376 O GLY A 24 -8.967 7.495 -0.167 1.00 0.00 O ATOM 0 H GLY A 24 -8.511 6.588 1.913 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.238 6.608 1.715 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -10.850 8.240 2.221 1.00 0.00 H new ATOM 380 N VAL A 25 -11.069 8.279 -0.427 1.00 0.00 N ATOM 381 CA VAL A 25 -10.922 8.666 -1.820 1.00 0.00 C ATOM 382 C VAL A 25 -11.418 10.095 -2.008 1.00 0.00 C ATOM 383 O VAL A 25 -12.197 10.600 -1.204 1.00 0.00 O ATOM 384 CB VAL A 25 -11.692 7.701 -2.735 1.00 0.00 C ATOM 385 CG1 VAL A 25 -11.163 6.275 -2.600 1.00 0.00 C ATOM 386 CG2 VAL A 25 -13.187 7.692 -2.404 1.00 0.00 C ATOM 0 H VAL A 25 -11.993 8.476 -0.044 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.868 8.617 -2.093 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.546 8.055 -3.756 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.726 5.614 -3.259 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -10.109 6.250 -2.876 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -11.276 5.941 -1.568 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -13.703 6.999 -3.069 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -13.329 7.376 -1.370 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -13.595 8.694 -2.536 1.00 0.00 H new ATOM 396 N SER A 26 -10.951 10.743 -3.079 1.00 0.00 N ATOM 397 CA SER A 26 -11.266 12.132 -3.379 1.00 0.00 C ATOM 398 C SER A 26 -11.289 12.312 -4.891 1.00 0.00 C ATOM 399 O SER A 26 -10.607 13.180 -5.431 1.00 0.00 O ATOM 400 CB SER A 26 -10.215 13.043 -2.736 1.00 0.00 C ATOM 401 OG SER A 26 -10.326 12.996 -1.327 1.00 0.00 O ATOM 0 H SER A 26 -10.337 10.308 -3.767 1.00 0.00 H new ATOM 0 HA SER A 26 -12.243 12.398 -2.975 1.00 0.00 H new ATOM 0 HB2 SER A 26 -9.216 12.730 -3.040 1.00 0.00 H new ATOM 0 HB3 SER A 26 -10.348 14.067 -3.085 1.00 0.00 H new ATOM 0 HG SER A 26 -9.649 13.580 -0.926 1.00 0.00 H new ATOM 407 N GLY A 27 -12.078 11.484 -5.580 1.00 0.00 N ATOM 408 CA GLY A 27 -12.128 11.514 -7.030 1.00 0.00 C ATOM 409 C GLY A 27 -10.859 10.880 -7.593 1.00 0.00 C ATOM 410 O GLY A 27 -10.496 9.766 -7.214 1.00 0.00 O ATOM 0 H GLY A 27 -12.688 10.788 -5.151 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -13.006 10.975 -7.386 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -12.221 12.542 -7.381 1.00 0.00 H new ATOM 414 N GLN A 28 -10.180 11.589 -8.496 1.00 0.00 N ATOM 415 CA GLN A 28 -8.919 11.127 -9.051 1.00 0.00 C ATOM 416 C GLN A 28 -7.811 11.179 -7.994 1.00 0.00 C ATOM 417 O GLN A 28 -6.720 10.661 -8.229 1.00 0.00 O ATOM 418 CB GLN A 28 -8.577 11.997 -10.268 1.00 0.00 C ATOM 419 CG GLN A 28 -7.310 11.524 -10.984 1.00 0.00 C ATOM 420 CD GLN A 28 -7.146 12.218 -12.328 1.00 0.00 C ATOM 421 OE1 GLN A 28 -7.264 11.590 -13.377 1.00 0.00 O ATOM 422 NE2 GLN A 28 -6.878 13.522 -12.308 1.00 0.00 N ATOM 0 H GLN A 28 -10.490 12.491 -8.857 1.00 0.00 H new ATOM 0 HA GLN A 28 -9.008 10.087 -9.366 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -9.413 11.984 -10.967 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -8.446 13.030 -9.947 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -6.440 11.725 -10.359 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -7.354 10.445 -11.132 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -6.787 14.010 -11.417 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -6.764 14.033 -13.184 1.00 0.00 H new ATOM 431 N GLN A 29 -8.078 11.791 -6.834 1.00 0.00 N ATOM 432 CA GLN A 29 -7.113 11.812 -5.744 1.00 0.00 C ATOM 433 C GLN A 29 -7.455 10.721 -4.735 1.00 0.00 C ATOM 434 O GLN A 29 -8.572 10.200 -4.720 1.00 0.00 O ATOM 435 CB GLN A 29 -7.105 13.164 -5.024 1.00 0.00 C ATOM 436 CG GLN A 29 -6.775 14.334 -5.947 1.00 0.00 C ATOM 437 CD GLN A 29 -6.645 15.609 -5.129 1.00 0.00 C ATOM 438 OE1 GLN A 29 -7.610 16.350 -4.961 1.00 0.00 O ATOM 439 NE2 GLN A 29 -5.449 15.873 -4.612 1.00 0.00 N ATOM 0 H GLN A 29 -8.953 12.275 -6.633 1.00 0.00 H new ATOM 0 HA GLN A 29 -6.126 11.641 -6.173 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -8.081 13.332 -4.569 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.377 13.132 -4.213 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.846 14.137 -6.482 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.557 14.450 -6.698 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.671 15.233 -4.773 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.309 16.715 -4.054 1.00 0.00 H new ATOM 448 N VAL A 30 -6.485 10.377 -3.886 1.00 0.00 N ATOM 449 CA VAL A 30 -6.604 9.294 -2.923 1.00 0.00 C ATOM 450 C VAL A 30 -5.858 9.652 -1.639 1.00 0.00 C ATOM 451 O VAL A 30 -4.828 10.322 -1.690 1.00 0.00 O ATOM 452 CB VAL A 30 -6.026 8.021 -3.559 1.00 0.00 C ATOM 453 CG1 VAL A 30 -5.979 6.873 -2.554 1.00 0.00 C ATOM 454 CG2 VAL A 30 -6.877 7.568 -4.744 1.00 0.00 C ATOM 0 H VAL A 30 -5.584 10.853 -3.852 1.00 0.00 H new ATOM 0 HA VAL A 30 -7.649 9.128 -2.663 1.00 0.00 H new ATOM 0 HB VAL A 30 -5.017 8.267 -3.891 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.565 5.986 -3.034 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -5.351 7.155 -1.709 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.987 6.657 -2.201 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.447 6.665 -5.177 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -7.892 7.360 -4.405 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -6.901 8.356 -5.497 1.00 0.00 H new ATOM 464 N ARG A 31 -6.380 9.204 -0.489 1.00 0.00 N ATOM 465 CA ARG A 31 -5.779 9.414 0.822 1.00 0.00 C ATOM 466 C ARG A 31 -5.420 8.047 1.393 1.00 0.00 C ATOM 467 O ARG A 31 -6.293 7.209 1.614 1.00 0.00 O ATOM 468 CB ARG A 31 -6.774 10.143 1.739 1.00 0.00 C ATOM 469 CG ARG A 31 -6.290 11.542 2.122 1.00 0.00 C ATOM 470 CD ARG A 31 -5.136 11.502 3.131 1.00 0.00 C ATOM 471 NE ARG A 31 -4.649 12.857 3.411 1.00 0.00 N ATOM 472 CZ ARG A 31 -5.299 13.759 4.159 1.00 0.00 C ATOM 473 NH1 ARG A 31 -6.434 13.459 4.783 1.00 0.00 N ATOM 474 NH2 ARG A 31 -4.815 14.989 4.293 1.00 0.00 N ATOM 0 H ARG A 31 -7.251 8.675 -0.451 1.00 0.00 H new ATOM 0 HA ARG A 31 -4.883 10.030 0.744 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -7.739 10.219 1.237 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -6.930 9.555 2.643 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -5.967 12.071 1.225 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -7.120 12.108 2.545 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -5.470 11.031 4.056 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -4.323 10.891 2.738 1.00 0.00 H new ATOM 0 HE ARG A 31 -3.753 13.132 3.008 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.830 12.523 4.699 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.908 14.165 5.346 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -3.946 15.249 3.826 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.312 15.673 4.863 1.00 0.00 H new ATOM 488 N ILE A 32 -4.124 7.829 1.628 1.00 0.00 N ATOM 489 CA ILE A 32 -3.600 6.542 2.065 1.00 0.00 C ATOM 490 C ILE A 32 -2.548 6.742 3.145 1.00 0.00 C ATOM 491 O ILE A 32 -1.935 7.803 3.248 1.00 0.00 O ATOM 492 CB ILE A 32 -2.996 5.774 0.881 1.00 0.00 C ATOM 493 CG1 ILE A 32 -2.190 6.722 -0.019 1.00 0.00 C ATOM 494 CG2 ILE A 32 -4.100 5.066 0.094 1.00 0.00 C ATOM 495 CD1 ILE A 32 -1.460 5.958 -1.123 1.00 0.00 C ATOM 0 H ILE A 32 -3.408 8.547 1.519 1.00 0.00 H new ATOM 0 HA ILE A 32 -4.424 5.958 2.475 1.00 0.00 H new ATOM 0 HB ILE A 32 -2.312 5.016 1.262 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.858 7.458 -0.465 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.467 7.272 0.584 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -3.660 4.525 -0.743 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.620 4.365 0.747 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.808 5.804 -0.283 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.900 6.659 -1.741 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -0.773 5.240 -0.675 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -2.186 5.429 -1.741 1.00 0.00 H new ATOM 507 N GLY A 33 -2.342 5.704 3.954 1.00 0.00 N ATOM 508 CA GLY A 33 -1.391 5.757 5.049 1.00 0.00 C ATOM 509 C GLY A 33 -0.463 4.552 5.015 1.00 0.00 C ATOM 510 O GLY A 33 -0.738 3.565 4.333 1.00 0.00 O ATOM 0 H GLY A 33 -2.828 4.812 3.865 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.806 6.674 4.985 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -1.924 5.785 5.999 1.00 0.00 H new ATOM 514 N ILE A 34 0.634 4.650 5.763 1.00 0.00 N ATOM 515 CA ILE A 34 1.669 3.636 5.813 1.00 0.00 C ATOM 516 C ILE A 34 2.021 3.422 7.279 1.00 0.00 C ATOM 517 O ILE A 34 2.123 4.376 8.050 1.00 0.00 O ATOM 518 CB ILE A 34 2.908 4.082 5.016 1.00 0.00 C ATOM 519 CG1 ILE A 34 2.614 4.301 3.528 1.00 0.00 C ATOM 520 CG2 ILE A 34 3.993 3.008 5.128 1.00 0.00 C ATOM 521 CD1 ILE A 34 2.150 5.728 3.222 1.00 0.00 C ATOM 0 H ILE A 34 0.826 5.454 6.360 1.00 0.00 H new ATOM 0 HA ILE A 34 1.316 2.707 5.364 1.00 0.00 H new ATOM 0 HB ILE A 34 3.231 5.032 5.442 1.00 0.00 H new ATOM 0 HG12 ILE A 34 3.511 4.083 2.948 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.847 3.597 3.206 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.873 3.319 4.565 1.00 0.00 H new ATOM 0 HG22 ILE A 34 4.262 2.871 6.175 1.00 0.00 H new ATOM 0 HG23 ILE A 34 3.618 2.068 4.724 1.00 0.00 H new ATOM 0 HD11 ILE A 34 1.956 5.826 2.154 1.00 0.00 H new ATOM 0 HD12 ILE A 34 1.237 5.941 3.778 1.00 0.00 H new ATOM 0 HD13 ILE A 34 2.926 6.434 3.516 1.00 0.00 H new ATOM 533 N ASN A 35 2.208 2.157 7.656 1.00 0.00 N ATOM 534 CA ASN A 35 2.461 1.774 9.031 1.00 0.00 C ATOM 535 C ASN A 35 3.637 0.802 9.078 1.00 0.00 C ATOM 536 O ASN A 35 3.565 -0.279 9.660 1.00 0.00 O ATOM 537 CB ASN A 35 1.172 1.214 9.631 1.00 0.00 C ATOM 538 CG ASN A 35 1.150 1.321 11.148 1.00 0.00 C ATOM 539 OD1 ASN A 35 2.185 1.315 11.810 1.00 0.00 O ATOM 540 ND2 ASN A 35 -0.046 1.422 11.717 1.00 0.00 N ATOM 0 H ASN A 35 2.187 1.370 7.007 1.00 0.00 H new ATOM 0 HA ASN A 35 2.748 2.631 9.640 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.318 1.751 9.218 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.062 0.169 9.341 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -0.124 1.497 12.731 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -0.887 1.424 11.140 1.00 0.00 H new ATOM 547 N ALA A 36 4.728 1.220 8.440 1.00 0.00 N ATOM 548 CA ALA A 36 6.035 0.594 8.545 1.00 0.00 C ATOM 549 C ALA A 36 6.715 1.170 9.779 1.00 0.00 C ATOM 550 O ALA A 36 6.334 2.244 10.249 1.00 0.00 O ATOM 551 CB ALA A 36 6.840 0.936 7.293 1.00 0.00 C ATOM 0 H ALA A 36 4.722 2.028 7.818 1.00 0.00 H new ATOM 0 HA ALA A 36 5.957 -0.490 8.630 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.825 0.473 7.356 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.319 0.562 6.412 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.952 2.018 7.216 1.00 0.00 H new ATOM 557 N PRO A 37 7.726 0.484 10.325 1.00 0.00 N ATOM 558 CA PRO A 37 8.416 0.960 11.501 1.00 0.00 C ATOM 559 C PRO A 37 9.211 2.199 11.122 1.00 0.00 C ATOM 560 O PRO A 37 9.658 2.330 9.987 1.00 0.00 O ATOM 561 CB PRO A 37 9.312 -0.197 11.941 1.00 0.00 C ATOM 562 CG PRO A 37 9.564 -0.959 10.637 1.00 0.00 C ATOM 563 CD PRO A 37 8.272 -0.772 9.853 1.00 0.00 C ATOM 0 HA PRO A 37 7.752 1.246 12.317 1.00 0.00 H new ATOM 0 HB2 PRO A 37 10.241 0.160 12.385 1.00 0.00 H new ATOM 0 HB3 PRO A 37 8.823 -0.824 12.686 1.00 0.00 H new ATOM 0 HG2 PRO A 37 10.421 -0.557 10.098 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.770 -2.013 10.823 1.00 0.00 H new ATOM 0 HD2 PRO A 37 8.462 -0.741 8.780 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.580 -1.595 10.031 1.00 0.00 H new ATOM 571 N LYS A 38 9.397 3.119 12.069 1.00 0.00 N ATOM 572 CA LYS A 38 10.149 4.335 11.800 1.00 0.00 C ATOM 573 C LYS A 38 11.630 4.011 11.614 1.00 0.00 C ATOM 574 O LYS A 38 12.440 4.901 11.359 1.00 0.00 O ATOM 575 CB LYS A 38 9.881 5.358 12.906 1.00 0.00 C ATOM 576 CG LYS A 38 8.367 5.567 13.002 1.00 0.00 C ATOM 577 CD LYS A 38 8.005 6.719 13.935 1.00 0.00 C ATOM 578 CE LYS A 38 6.482 6.808 14.048 1.00 0.00 C ATOM 579 NZ LYS A 38 6.078 7.910 14.941 1.00 0.00 N ATOM 0 H LYS A 38 9.039 3.043 13.021 1.00 0.00 H new ATOM 0 HA LYS A 38 9.819 4.787 10.865 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.278 5.003 13.857 1.00 0.00 H new ATOM 0 HB3 LYS A 38 10.382 6.300 12.683 1.00 0.00 H new ATOM 0 HG2 LYS A 38 7.965 5.766 12.008 1.00 0.00 H new ATOM 0 HG3 LYS A 38 7.897 4.651 13.359 1.00 0.00 H new ATOM 0 HD2 LYS A 38 8.447 6.560 14.919 1.00 0.00 H new ATOM 0 HD3 LYS A 38 8.410 7.656 13.551 1.00 0.00 H new ATOM 0 HE2 LYS A 38 6.049 6.960 13.059 1.00 0.00 H new ATOM 0 HE3 LYS A 38 6.087 5.865 14.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 5.040 7.947 14.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 6.472 7.750 15.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 6.436 8.811 14.565 1.00 0.00 H new ATOM 593 N ASP A 39 11.975 2.727 11.747 1.00 0.00 N ATOM 594 CA ASP A 39 13.306 2.208 11.482 1.00 0.00 C ATOM 595 C ASP A 39 13.543 2.025 9.981 1.00 0.00 C ATOM 596 O ASP A 39 14.686 1.796 9.582 1.00 0.00 O ATOM 597 CB ASP A 39 13.480 0.873 12.207 1.00 0.00 C ATOM 598 CG ASP A 39 13.359 1.048 13.717 1.00 0.00 C ATOM 599 OD1 ASP A 39 14.373 1.455 14.333 1.00 0.00 O ATOM 600 OD2 ASP A 39 12.257 0.774 14.249 1.00 0.00 O ATOM 0 H ASP A 39 11.317 2.009 12.049 1.00 0.00 H new ATOM 0 HA ASP A 39 14.039 2.927 11.849 1.00 0.00 H new ATOM 0 HB2 ASP A 39 12.728 0.166 11.858 1.00 0.00 H new ATOM 0 HB3 ASP A 39 14.454 0.448 11.964 1.00 0.00 H new ATOM 605 N VAL A 40 12.497 2.122 9.149 1.00 0.00 N ATOM 606 CA VAL A 40 12.663 2.088 7.699 1.00 0.00 C ATOM 607 C VAL A 40 12.093 3.354 7.065 1.00 0.00 C ATOM 608 O VAL A 40 11.105 3.918 7.533 1.00 0.00 O ATOM 609 CB VAL A 40 12.039 0.832 7.080 1.00 0.00 C ATOM 610 CG1 VAL A 40 12.643 -0.430 7.696 1.00 0.00 C ATOM 611 CG2 VAL A 40 10.523 0.807 7.245 1.00 0.00 C ATOM 0 H VAL A 40 11.531 2.224 9.460 1.00 0.00 H new ATOM 0 HA VAL A 40 13.732 2.048 7.491 1.00 0.00 H new ATOM 0 HB VAL A 40 12.263 0.858 6.014 1.00 0.00 H new ATOM 0 HG11 VAL A 40 12.187 -1.310 7.243 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.718 -0.445 7.515 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.456 -0.436 8.770 1.00 0.00 H new ATOM 0 HG21 VAL A 40 10.123 -0.100 6.792 1.00 0.00 H new ATOM 0 HG22 VAL A 40 10.272 0.824 8.306 1.00 0.00 H new ATOM 0 HG23 VAL A 40 10.089 1.679 6.755 1.00 0.00 H new ATOM 621 N ALA A 41 12.739 3.786 5.985 1.00 0.00 N ATOM 622 CA ALA A 41 12.370 4.993 5.263 1.00 0.00 C ATOM 623 C ALA A 41 11.007 4.843 4.595 1.00 0.00 C ATOM 624 O ALA A 41 10.655 3.755 4.139 1.00 0.00 O ATOM 625 CB ALA A 41 13.441 5.276 4.215 1.00 0.00 C ATOM 0 H ALA A 41 13.542 3.300 5.585 1.00 0.00 H new ATOM 0 HA ALA A 41 12.300 5.823 5.966 1.00 0.00 H new ATOM 0 HB1 ALA A 41 13.180 6.179 3.663 1.00 0.00 H new ATOM 0 HB2 ALA A 41 14.403 5.417 4.707 1.00 0.00 H new ATOM 0 HB3 ALA A 41 13.506 4.435 3.525 1.00 0.00 H new ATOM 631 N VAL A 42 10.248 5.937 4.540 1.00 0.00 N ATOM 632 CA VAL A 42 8.959 5.996 3.867 1.00 0.00 C ATOM 633 C VAL A 42 8.770 7.414 3.345 1.00 0.00 C ATOM 634 O VAL A 42 8.725 8.354 4.143 1.00 0.00 O ATOM 635 CB VAL A 42 7.832 5.659 4.846 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.480 5.744 4.156 1.00 0.00 C ATOM 637 CG2 VAL A 42 7.963 4.249 5.413 1.00 0.00 C ATOM 0 H VAL A 42 10.520 6.821 4.971 1.00 0.00 H new ATOM 0 HA VAL A 42 8.932 5.275 3.050 1.00 0.00 H new ATOM 0 HB VAL A 42 7.907 6.386 5.655 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.692 5.501 4.869 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.328 6.755 3.777 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.450 5.037 3.327 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.141 4.056 6.102 1.00 0.00 H new ATOM 0 HG22 VAL A 42 7.931 3.525 4.599 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.911 4.157 5.944 1.00 0.00 H new ATOM 647 N HIS A 43 8.662 7.569 2.020 1.00 0.00 N ATOM 648 CA HIS A 43 8.512 8.872 1.379 1.00 0.00 C ATOM 649 C HIS A 43 7.656 8.777 0.115 1.00 0.00 C ATOM 650 O HIS A 43 7.384 7.688 -0.390 1.00 0.00 O ATOM 651 CB HIS A 43 9.879 9.448 0.988 1.00 0.00 C ATOM 652 CG HIS A 43 10.937 9.416 2.065 1.00 0.00 C ATOM 653 ND1 HIS A 43 11.326 10.511 2.837 1.00 0.00 N ATOM 654 CD2 HIS A 43 11.673 8.329 2.431 1.00 0.00 C ATOM 655 CE1 HIS A 43 12.287 10.053 3.654 1.00 0.00 C ATOM 656 NE2 HIS A 43 12.515 8.747 3.433 1.00 0.00 N ATOM 0 H HIS A 43 8.677 6.788 1.364 1.00 0.00 H new ATOM 0 HA HIS A 43 8.023 9.524 2.102 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.250 8.898 0.123 1.00 0.00 H new ATOM 0 HB3 HIS A 43 9.740 10.482 0.672 1.00 0.00 H new ATOM 0 HD1 HIS A 43 10.957 11.461 2.790 1.00 0.00 H new ATOM 0 HD2 HIS A 43 11.607 7.334 2.015 1.00 0.00 H new ATOM 0 HE1 HIS A 43 12.806 10.652 4.388 1.00 0.00 H new ATOM 664 N ARG A 44 7.243 9.941 -0.392 1.00 0.00 N ATOM 665 CA ARG A 44 6.517 10.098 -1.647 1.00 0.00 C ATOM 666 C ARG A 44 7.455 9.836 -2.826 1.00 0.00 C ATOM 667 O ARG A 44 8.672 9.961 -2.687 1.00 0.00 O ATOM 668 CB ARG A 44 5.961 11.525 -1.679 1.00 0.00 C ATOM 669 CG ARG A 44 7.130 12.512 -1.770 1.00 0.00 C ATOM 670 CD ARG A 44 6.794 13.883 -1.181 1.00 0.00 C ATOM 671 NE ARG A 44 6.314 14.810 -2.204 1.00 0.00 N ATOM 672 CZ ARG A 44 6.242 16.134 -2.046 1.00 0.00 C ATOM 673 NH1 ARG A 44 6.608 16.709 -0.903 1.00 0.00 N ATOM 674 NH2 ARG A 44 5.797 16.902 -3.036 1.00 0.00 N ATOM 0 H ARG A 44 7.413 10.829 0.080 1.00 0.00 H new ATOM 0 HA ARG A 44 5.697 9.383 -1.722 1.00 0.00 H new ATOM 0 HB2 ARG A 44 5.294 11.651 -2.532 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.372 11.720 -0.783 1.00 0.00 H new ATOM 0 HG2 ARG A 44 7.991 12.098 -1.246 1.00 0.00 H new ATOM 0 HG3 ARG A 44 7.419 12.631 -2.814 1.00 0.00 H new ATOM 0 HD2 ARG A 44 6.034 13.770 -0.407 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.679 14.299 -0.700 1.00 0.00 H new ATOM 0 HE ARG A 44 6.014 14.420 -3.098 1.00 0.00 H new ATOM 0 HH11 ARG A 44 6.950 16.137 -0.131 1.00 0.00 H new ATOM 0 HH12 ARG A 44 6.547 17.722 -0.799 1.00 0.00 H new ATOM 0 HH21 ARG A 44 5.509 16.480 -3.919 1.00 0.00 H new ATOM 0 HH22 ARG A 44 5.743 17.913 -2.912 1.00 0.00 H new ATOM 688 N GLU A 45 6.919 9.474 -3.995 1.00 0.00 N ATOM 689 CA GLU A 45 7.769 9.086 -5.118 1.00 0.00 C ATOM 690 C GLU A 45 8.464 10.270 -5.787 1.00 0.00 C ATOM 691 O GLU A 45 9.530 10.091 -6.372 1.00 0.00 O ATOM 692 CB GLU A 45 6.954 8.277 -6.140 1.00 0.00 C ATOM 693 CG GLU A 45 5.920 9.113 -6.903 1.00 0.00 C ATOM 694 CD GLU A 45 6.499 9.849 -8.110 1.00 0.00 C ATOM 695 OE1 GLU A 45 7.353 9.253 -8.807 1.00 0.00 O ATOM 696 OE2 GLU A 45 6.086 11.007 -8.334 1.00 0.00 O ATOM 0 H GLU A 45 5.917 9.442 -4.185 1.00 0.00 H new ATOM 0 HA GLU A 45 8.566 8.462 -4.713 1.00 0.00 H new ATOM 0 HB2 GLU A 45 7.637 7.819 -6.855 1.00 0.00 H new ATOM 0 HB3 GLU A 45 6.442 7.465 -5.623 1.00 0.00 H new ATOM 0 HG2 GLU A 45 5.114 8.461 -7.238 1.00 0.00 H new ATOM 0 HG3 GLU A 45 5.479 9.841 -6.222 1.00 0.00 H new ATOM 703 N GLU A 46 7.893 11.477 -5.710 1.00 0.00 N ATOM 704 CA GLU A 46 8.500 12.647 -6.336 1.00 0.00 C ATOM 705 C GLU A 46 9.625 13.234 -5.483 1.00 0.00 C ATOM 706 O GLU A 46 10.193 14.264 -5.838 1.00 0.00 O ATOM 707 CB GLU A 46 7.453 13.717 -6.671 1.00 0.00 C ATOM 708 CG GLU A 46 6.688 14.233 -5.452 1.00 0.00 C ATOM 709 CD GLU A 46 5.395 13.448 -5.227 1.00 0.00 C ATOM 710 OE1 GLU A 46 5.481 12.300 -4.739 1.00 0.00 O ATOM 711 OE2 GLU A 46 4.321 14.005 -5.544 1.00 0.00 O ATOM 0 H GLU A 46 7.017 11.664 -5.223 1.00 0.00 H new ATOM 0 HA GLU A 46 8.942 12.306 -7.272 1.00 0.00 H new ATOM 0 HB2 GLU A 46 7.948 14.556 -7.160 1.00 0.00 H new ATOM 0 HB3 GLU A 46 6.742 13.305 -7.387 1.00 0.00 H new ATOM 0 HG2 GLU A 46 7.319 14.158 -4.567 1.00 0.00 H new ATOM 0 HG3 GLU A 46 6.455 15.289 -5.588 1.00 0.00 H new ATOM 718 N ILE A 47 9.956 12.593 -4.355 1.00 0.00 N ATOM 719 CA ILE A 47 11.045 13.035 -3.496 1.00 0.00 C ATOM 720 C ILE A 47 11.954 11.867 -3.141 1.00 0.00 C ATOM 721 O ILE A 47 13.130 12.080 -2.876 1.00 0.00 O ATOM 722 CB ILE A 47 10.475 13.735 -2.249 1.00 0.00 C ATOM 723 CG1 ILE A 47 10.082 15.171 -2.611 1.00 0.00 C ATOM 724 CG2 ILE A 47 11.449 13.733 -1.071 1.00 0.00 C ATOM 725 CD1 ILE A 47 9.900 16.048 -1.369 1.00 0.00 C ATOM 0 H ILE A 47 9.475 11.758 -4.019 1.00 0.00 H new ATOM 0 HA ILE A 47 11.659 13.761 -4.030 1.00 0.00 H new ATOM 0 HB ILE A 47 9.598 13.173 -1.927 1.00 0.00 H new ATOM 0 HG12 ILE A 47 10.849 15.606 -3.252 1.00 0.00 H new ATOM 0 HG13 ILE A 47 9.156 15.159 -3.185 1.00 0.00 H new ATOM 0 HG21 ILE A 47 10.993 14.240 -0.221 1.00 0.00 H new ATOM 0 HG22 ILE A 47 11.686 12.705 -0.796 1.00 0.00 H new ATOM 0 HG23 ILE A 47 12.364 14.253 -1.355 1.00 0.00 H new ATOM 0 HD11 ILE A 47 9.622 17.057 -1.674 1.00 0.00 H new ATOM 0 HD12 ILE A 47 9.114 15.629 -0.740 1.00 0.00 H new ATOM 0 HD13 ILE A 47 10.834 16.083 -0.808 1.00 0.00 H new ATOM 737 N TYR A 48 11.455 10.630 -3.124 1.00 0.00 N ATOM 738 CA TYR A 48 12.320 9.523 -2.757 1.00 0.00 C ATOM 739 C TYR A 48 13.463 9.400 -3.762 1.00 0.00 C ATOM 740 O TYR A 48 14.582 9.038 -3.407 1.00 0.00 O ATOM 741 CB TYR A 48 11.522 8.226 -2.709 1.00 0.00 C ATOM 742 CG TYR A 48 12.409 7.068 -2.342 1.00 0.00 C ATOM 743 CD1 TYR A 48 12.640 6.765 -0.993 1.00 0.00 C ATOM 744 CD2 TYR A 48 13.018 6.311 -3.352 1.00 0.00 C ATOM 745 CE1 TYR A 48 13.489 5.703 -0.648 1.00 0.00 C ATOM 746 CE2 TYR A 48 13.864 5.247 -3.017 1.00 0.00 C ATOM 747 CZ TYR A 48 14.092 4.927 -1.660 1.00 0.00 C ATOM 748 OH TYR A 48 14.897 3.875 -1.336 1.00 0.00 O ATOM 0 H TYR A 48 10.493 10.381 -3.352 1.00 0.00 H new ATOM 0 HA TYR A 48 12.737 9.714 -1.768 1.00 0.00 H new ATOM 0 HB2 TYR A 48 10.715 8.317 -1.982 1.00 0.00 H new ATOM 0 HB3 TYR A 48 11.059 8.042 -3.678 1.00 0.00 H new ATOM 0 HD1 TYR A 48 12.164 7.349 -0.219 1.00 0.00 H new ATOM 0 HD2 TYR A 48 12.835 6.549 -4.389 1.00 0.00 H new ATOM 0 HE1 TYR A 48 13.681 5.480 0.391 1.00 0.00 H new ATOM 0 HE2 TYR A 48 14.342 4.671 -3.796 1.00 0.00 H new ATOM 0 HH TYR A 48 14.678 3.561 -0.434 1.00 0.00 H new ATOM 758 N GLN A 49 13.172 9.707 -5.027 1.00 0.00 N ATOM 759 CA GLN A 49 14.142 9.607 -6.105 1.00 0.00 C ATOM 760 C GLN A 49 15.187 10.718 -6.015 1.00 0.00 C ATOM 761 O GLN A 49 16.229 10.633 -6.662 1.00 0.00 O ATOM 762 CB GLN A 49 13.398 9.652 -7.438 1.00 0.00 C ATOM 763 CG GLN A 49 12.338 8.549 -7.463 1.00 0.00 C ATOM 764 CD GLN A 49 11.591 8.500 -8.791 1.00 0.00 C ATOM 765 OE1 GLN A 49 12.160 8.158 -9.824 1.00 0.00 O ATOM 766 NE2 GLN A 49 10.307 8.845 -8.769 1.00 0.00 N ATOM 0 H GLN A 49 12.253 10.032 -5.328 1.00 0.00 H new ATOM 0 HA GLN A 49 14.680 8.663 -6.022 1.00 0.00 H new ATOM 0 HB2 GLN A 49 12.929 10.626 -7.573 1.00 0.00 H new ATOM 0 HB3 GLN A 49 14.098 9.518 -8.263 1.00 0.00 H new ATOM 0 HG2 GLN A 49 12.814 7.586 -7.280 1.00 0.00 H new ATOM 0 HG3 GLN A 49 11.627 8.712 -6.653 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.869 9.124 -7.891 1.00 0.00 H new ATOM 0 HE22 GLN A 49 9.760 8.831 -9.630 1.00 0.00 H new ATOM 775 N ARG A 50 14.920 11.757 -5.212 1.00 0.00 N ATOM 776 CA ARG A 50 15.874 12.830 -4.983 1.00 0.00 C ATOM 777 C ARG A 50 16.706 12.543 -3.735 1.00 0.00 C ATOM 778 O ARG A 50 17.828 13.029 -3.617 1.00 0.00 O ATOM 779 CB ARG A 50 15.133 14.171 -4.905 1.00 0.00 C ATOM 780 CG ARG A 50 14.971 14.693 -3.474 1.00 0.00 C ATOM 781 CD ARG A 50 14.082 15.935 -3.456 1.00 0.00 C ATOM 782 NE ARG A 50 14.619 17.014 -4.296 1.00 0.00 N ATOM 783 CZ ARG A 50 15.746 17.691 -4.065 1.00 0.00 C ATOM 784 NH1 ARG A 50 16.491 17.451 -2.986 1.00 0.00 N ATOM 785 NH2 ARG A 50 16.138 18.629 -4.925 1.00 0.00 N ATOM 0 H ARG A 50 14.040 11.869 -4.709 1.00 0.00 H new ATOM 0 HA ARG A 50 16.572 12.891 -5.818 1.00 0.00 H new ATOM 0 HB2 ARG A 50 15.673 14.911 -5.495 1.00 0.00 H new ATOM 0 HB3 ARG A 50 14.148 14.060 -5.357 1.00 0.00 H new ATOM 0 HG2 ARG A 50 14.535 13.917 -2.845 1.00 0.00 H new ATOM 0 HG3 ARG A 50 15.948 14.932 -3.055 1.00 0.00 H new ATOM 0 HD2 ARG A 50 13.083 15.670 -3.803 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.979 16.292 -2.431 1.00 0.00 H new ATOM 0 HE ARG A 50 14.085 17.268 -5.127 1.00 0.00 H new ATOM 0 HH11 ARG A 50 16.204 16.737 -2.316 1.00 0.00 H new ATOM 0 HH12 ARG A 50 17.349 17.981 -2.830 1.00 0.00 H new ATOM 0 HH21 ARG A 50 15.578 18.827 -5.754 1.00 0.00 H new ATOM 0 HH22 ARG A 50 16.998 19.150 -4.754 1.00 0.00 H new ATOM 799 N ILE A 51 16.161 11.755 -2.801 1.00 0.00 N ATOM 800 CA ILE A 51 16.876 11.335 -1.607 1.00 0.00 C ATOM 801 C ILE A 51 17.942 10.321 -2.006 1.00 0.00 C ATOM 802 O ILE A 51 19.109 10.460 -1.657 1.00 0.00 O ATOM 803 CB ILE A 51 15.900 10.707 -0.612 1.00 0.00 C ATOM 804 CG1 ILE A 51 14.914 11.755 -0.091 1.00 0.00 C ATOM 805 CG2 ILE A 51 16.645 10.107 0.584 1.00 0.00 C ATOM 806 CD1 ILE A 51 13.799 11.083 0.705 1.00 0.00 C ATOM 0 H ILE A 51 15.209 11.394 -2.859 1.00 0.00 H new ATOM 0 HA ILE A 51 17.348 12.196 -1.134 1.00 0.00 H new ATOM 0 HB ILE A 51 15.362 9.919 -1.139 1.00 0.00 H new ATOM 0 HG12 ILE A 51 15.437 12.475 0.539 1.00 0.00 H new ATOM 0 HG13 ILE A 51 14.489 12.312 -0.926 1.00 0.00 H new ATOM 0 HG21 ILE A 51 15.927 9.667 1.276 1.00 0.00 H new ATOM 0 HG22 ILE A 51 17.332 9.336 0.235 1.00 0.00 H new ATOM 0 HG23 ILE A 51 17.207 10.890 1.093 1.00 0.00 H new ATOM 0 HD11 ILE A 51 13.105 11.840 1.070 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.266 10.381 0.064 1.00 0.00 H new ATOM 0 HD13 ILE A 51 14.228 10.547 1.551 1.00 0.00 H new ATOM 818 N GLN A 52 17.526 9.291 -2.743 1.00 0.00 N ATOM 819 CA GLN A 52 18.402 8.198 -3.137 1.00 0.00 C ATOM 820 C GLN A 52 19.381 8.631 -4.224 1.00 0.00 C ATOM 821 O GLN A 52 20.129 7.804 -4.747 1.00 0.00 O ATOM 822 CB GLN A 52 17.554 6.993 -3.550 1.00 0.00 C ATOM 823 CG GLN A 52 16.758 6.494 -2.344 1.00 0.00 C ATOM 824 CD GLN A 52 17.626 6.389 -1.093 1.00 0.00 C ATOM 825 OE1 GLN A 52 18.615 5.662 -1.060 1.00 0.00 O ATOM 826 NE2 GLN A 52 17.252 7.125 -0.050 1.00 0.00 N ATOM 0 H GLN A 52 16.569 9.195 -3.082 1.00 0.00 H new ATOM 0 HA GLN A 52 19.017 7.902 -2.287 1.00 0.00 H new ATOM 0 HB2 GLN A 52 16.876 7.271 -4.357 1.00 0.00 H new ATOM 0 HB3 GLN A 52 18.194 6.198 -3.931 1.00 0.00 H new ATOM 0 HG2 GLN A 52 15.926 7.172 -2.153 1.00 0.00 H new ATOM 0 HG3 GLN A 52 16.329 5.518 -2.571 1.00 0.00 H new ATOM 0 HE21 GLN A 52 16.424 7.717 -0.114 1.00 0.00 H new ATOM 0 HE22 GLN A 52 17.793 7.097 0.814 1.00 0.00 H new ATOM 835 N ALA A 53 19.381 9.922 -4.570 1.00 0.00 N ATOM 836 CA ALA A 53 20.319 10.456 -5.539 1.00 0.00 C ATOM 837 C ALA A 53 21.735 10.493 -4.960 1.00 0.00 C ATOM 838 O ALA A 53 22.703 10.608 -5.712 1.00 0.00 O ATOM 839 CB ALA A 53 19.867 11.856 -5.953 1.00 0.00 C ATOM 0 H ALA A 53 18.735 10.612 -4.187 1.00 0.00 H new ATOM 0 HA ALA A 53 20.338 9.809 -6.416 1.00 0.00 H new ATOM 0 HB1 ALA A 53 20.568 12.264 -6.682 1.00 0.00 H new ATOM 0 HB2 ALA A 53 18.873 11.801 -6.397 1.00 0.00 H new ATOM 0 HB3 ALA A 53 19.838 12.503 -5.076 1.00 0.00 H new ATOM 845 N GLY A 54 21.866 10.399 -3.630 1.00 0.00 N ATOM 846 CA GLY A 54 23.168 10.374 -2.975 1.00 0.00 C ATOM 847 C GLY A 54 23.194 11.209 -1.697 1.00 0.00 C ATOM 848 O GLY A 54 24.271 11.498 -1.180 1.00 0.00 O ATOM 0 H GLY A 54 21.076 10.339 -2.988 1.00 0.00 H new ATOM 0 HA2 GLY A 54 23.432 9.344 -2.738 1.00 0.00 H new ATOM 0 HA3 GLY A 54 23.926 10.747 -3.664 1.00 0.00 H new ATOM 852 N LEU A 55 22.024 11.600 -1.184 1.00 0.00 N ATOM 853 CA LEU A 55 21.902 12.501 -0.048 1.00 0.00 C ATOM 854 C LEU A 55 20.802 12.037 0.908 1.00 0.00 C ATOM 855 O LEU A 55 20.276 10.933 0.772 1.00 0.00 O ATOM 856 CB LEU A 55 21.649 13.910 -0.595 1.00 0.00 C ATOM 857 CG LEU A 55 20.427 14.002 -1.519 1.00 0.00 C ATOM 858 CD1 LEU A 55 19.111 13.942 -0.747 1.00 0.00 C ATOM 859 CD2 LEU A 55 20.480 15.327 -2.265 1.00 0.00 C ATOM 0 H LEU A 55 21.126 11.292 -1.556 1.00 0.00 H new ATOM 0 HA LEU A 55 22.820 12.505 0.540 1.00 0.00 H new ATOM 0 HB2 LEU A 55 21.514 14.596 0.241 1.00 0.00 H new ATOM 0 HB3 LEU A 55 22.532 14.243 -1.141 1.00 0.00 H new ATOM 0 HG LEU A 55 20.461 13.151 -2.200 1.00 0.00 H new ATOM 0 HD11 LEU A 55 18.276 14.011 -1.445 1.00 0.00 H new ATOM 0 HD12 LEU A 55 19.052 13.000 -0.202 1.00 0.00 H new ATOM 0 HD13 LEU A 55 19.064 14.772 -0.042 1.00 0.00 H new ATOM 0 HD21 LEU A 55 19.617 15.407 -2.926 1.00 0.00 H new ATOM 0 HD22 LEU A 55 20.466 16.149 -1.549 1.00 0.00 H new ATOM 0 HD23 LEU A 55 21.395 15.376 -2.855 1.00 0.00 H new ATOM 871 N THR A 56 20.450 12.884 1.880 1.00 0.00 N ATOM 872 CA THR A 56 19.379 12.598 2.829 1.00 0.00 C ATOM 873 C THR A 56 18.561 13.866 3.085 1.00 0.00 C ATOM 874 O THR A 56 18.901 14.937 2.585 1.00 0.00 O ATOM 875 CB THR A 56 19.956 12.034 4.125 1.00 0.00 C ATOM 876 OG1 THR A 56 20.874 12.947 4.689 1.00 0.00 O ATOM 877 CG2 THR A 56 20.667 10.709 3.864 1.00 0.00 C ATOM 0 H THR A 56 20.902 13.786 2.028 1.00 0.00 H new ATOM 0 HA THR A 56 18.714 11.844 2.408 1.00 0.00 H new ATOM 0 HB THR A 56 19.131 11.869 4.818 1.00 0.00 H new ATOM 0 HG1 THR A 56 21.236 12.575 5.520 1.00 0.00 H new ATOM 0 HG21 THR A 56 21.072 10.323 4.800 1.00 0.00 H new ATOM 0 HG22 THR A 56 19.958 9.991 3.451 1.00 0.00 H new ATOM 0 HG23 THR A 56 21.480 10.866 3.155 1.00 0.00 H new ATOM 885 N ALA A 57 17.480 13.746 3.866 1.00 0.00 N ATOM 886 CA ALA A 57 16.590 14.862 4.157 1.00 0.00 C ATOM 887 C ALA A 57 17.368 16.079 4.666 1.00 0.00 C ATOM 888 O ALA A 57 18.416 15.934 5.293 1.00 0.00 O ATOM 889 CB ALA A 57 15.562 14.418 5.190 1.00 0.00 C ATOM 0 H ALA A 57 17.203 12.871 4.311 1.00 0.00 H new ATOM 0 HA ALA A 57 16.086 15.160 3.238 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.891 15.247 5.415 1.00 0.00 H new ATOM 0 HB2 ALA A 57 14.986 13.582 4.794 1.00 0.00 H new ATOM 0 HB3 ALA A 57 16.073 14.107 6.101 1.00 0.00 H new ATOM 895 N PRO A 58 16.855 17.291 4.400 1.00 0.00 N ATOM 896 CA PRO A 58 17.498 18.537 4.774 1.00 0.00 C ATOM 897 C PRO A 58 17.521 18.754 6.280 1.00 0.00 C ATOM 898 O PRO A 58 18.391 19.463 6.782 1.00 0.00 O ATOM 899 CB PRO A 58 16.689 19.637 4.084 1.00 0.00 C ATOM 900 CG PRO A 58 15.304 19.012 3.910 1.00 0.00 C ATOM 901 CD PRO A 58 15.609 17.533 3.703 1.00 0.00 C ATOM 0 HA PRO A 58 18.544 18.534 4.467 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.647 20.543 4.689 1.00 0.00 H new ATOM 0 HB3 PRO A 58 17.127 19.915 3.125 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.677 19.174 4.786 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.775 19.437 3.057 1.00 0.00 H new ATOM 0 HD2 PRO A 58 14.809 16.908 4.101 1.00 0.00 H new ATOM 0 HD3 PRO A 58 15.700 17.296 2.643 1.00 0.00 H new ATOM 909 N ASP A 59 16.575 18.153 7.007 1.00 0.00 N ATOM 910 CA ASP A 59 16.488 18.330 8.444 1.00 0.00 C ATOM 911 C ASP A 59 15.576 17.281 9.078 1.00 0.00 C ATOM 912 O ASP A 59 14.864 16.562 8.373 1.00 0.00 O ATOM 913 CB ASP A 59 15.983 19.746 8.727 1.00 0.00 C ATOM 914 CG ASP A 59 14.511 19.922 8.351 1.00 0.00 C ATOM 915 OD1 ASP A 59 13.661 19.657 9.230 1.00 0.00 O ATOM 916 OD2 ASP A 59 14.243 20.321 7.194 1.00 0.00 O ATOM 0 H ASP A 59 15.861 17.540 6.615 1.00 0.00 H new ATOM 0 HA ASP A 59 17.474 18.197 8.888 1.00 0.00 H new ATOM 0 HB2 ASP A 59 16.115 19.972 9.785 1.00 0.00 H new ATOM 0 HB3 ASP A 59 16.586 20.463 8.170 1.00 0.00 H new ATOM 1635 N MET C 1 1.593 7.045 12.619 1.00 0.00 N ATOM 1636 CA MET C 1 1.347 6.549 11.250 1.00 0.00 C ATOM 1637 C MET C 1 1.580 7.662 10.240 1.00 0.00 C ATOM 1638 O MET C 1 1.129 8.785 10.464 1.00 0.00 O ATOM 1639 CB MET C 1 -0.078 6.010 11.130 1.00 0.00 C ATOM 1640 CG MET C 1 -0.206 5.102 9.905 1.00 0.00 C ATOM 1641 SD MET C 1 -1.809 4.270 9.747 1.00 0.00 S ATOM 1642 CE MET C 1 -2.872 5.706 9.443 1.00 0.00 C ATOM 0 H1 MET C 1 0.812 6.751 13.240 1.00 0.00 H new ATOM 0 H2 MET C 1 2.487 6.651 12.976 1.00 0.00 H new ATOM 0 H3 MET C 1 1.653 8.083 12.606 1.00 0.00 H new ATOM 0 HA MET C 1 2.043 5.737 11.040 1.00 0.00 H new ATOM 0 HB2 MET C 1 -0.340 5.455 12.031 1.00 0.00 H new ATOM 0 HB3 MET C 1 -0.781 6.839 11.051 1.00 0.00 H new ATOM 0 HG2 MET C 1 -0.030 5.696 9.008 1.00 0.00 H new ATOM 0 HG3 MET C 1 0.578 4.346 9.946 1.00 0.00 H new ATOM 0 HE1 MET C 1 -3.904 5.376 9.321 1.00 0.00 H new ATOM 0 HE2 MET C 1 -2.808 6.391 10.288 1.00 0.00 H new ATOM 0 HE3 MET C 1 -2.545 6.216 8.537 1.00 0.00 H new ATOM 1654 N LEU C 2 2.273 7.369 9.139 1.00 0.00 N ATOM 1655 CA LEU C 2 2.574 8.360 8.113 1.00 0.00 C ATOM 1656 C LEU C 2 1.469 8.321 7.051 1.00 0.00 C ATOM 1657 O LEU C 2 1.100 7.242 6.593 1.00 0.00 O ATOM 1658 CB LEU C 2 3.944 8.008 7.510 1.00 0.00 C ATOM 1659 CG LEU C 2 4.722 9.172 6.874 1.00 0.00 C ATOM 1660 CD1 LEU C 2 5.734 8.601 5.887 1.00 0.00 C ATOM 1661 CD2 LEU C 2 3.862 10.195 6.145 1.00 0.00 C ATOM 0 H LEU C 2 2.640 6.439 8.936 1.00 0.00 H new ATOM 0 HA LEU C 2 2.613 9.369 8.524 1.00 0.00 H new ATOM 0 HB2 LEU C 2 4.562 7.570 8.294 1.00 0.00 H new ATOM 0 HB3 LEU C 2 3.798 7.238 6.752 1.00 0.00 H new ATOM 0 HG LEU C 2 5.194 9.704 7.700 1.00 0.00 H new ATOM 0 HD11 LEU C 2 6.294 9.416 5.428 1.00 0.00 H new ATOM 0 HD12 LEU C 2 6.422 7.939 6.413 1.00 0.00 H new ATOM 0 HD13 LEU C 2 5.211 8.039 5.113 1.00 0.00 H new ATOM 0 HD21 LEU C 2 4.499 10.977 5.731 1.00 0.00 H new ATOM 0 HD22 LEU C 2 3.318 9.704 5.338 1.00 0.00 H new ATOM 0 HD23 LEU C 2 3.152 10.638 6.844 1.00 0.00 H new ATOM 1673 N ILE C 3 0.939 9.485 6.663 1.00 0.00 N ATOM 1674 CA ILE C 3 -0.109 9.585 5.652 1.00 0.00 C ATOM 1675 C ILE C 3 0.400 10.439 4.502 1.00 0.00 C ATOM 1676 O ILE C 3 1.207 11.342 4.704 1.00 0.00 O ATOM 1677 CB ILE C 3 -1.400 10.187 6.244 1.00 0.00 C ATOM 1678 CG1 ILE C 3 -2.138 9.182 7.129 1.00 0.00 C ATOM 1679 CG2 ILE C 3 -2.386 10.583 5.140 1.00 0.00 C ATOM 1680 CD1 ILE C 3 -1.537 9.075 8.523 1.00 0.00 C ATOM 0 H ILE C 3 1.228 10.386 7.045 1.00 0.00 H new ATOM 0 HA ILE C 3 -0.353 8.586 5.290 1.00 0.00 H new ATOM 0 HB ILE C 3 -1.082 11.055 6.822 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -3.185 9.476 7.211 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -2.118 8.202 6.653 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -3.285 11.004 5.589 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -1.924 11.325 4.489 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -2.651 9.702 4.555 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -2.101 8.348 9.107 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -0.498 8.753 8.448 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -1.581 10.047 9.014 1.00 0.00 H new ATOM 1692 N LEU C 4 -0.082 10.146 3.297 1.00 0.00 N ATOM 1693 CA LEU C 4 0.253 10.889 2.097 1.00 0.00 C ATOM 1694 C LEU C 4 -0.980 10.953 1.204 1.00 0.00 C ATOM 1695 O LEU C 4 -1.965 10.243 1.422 1.00 0.00 O ATOM 1696 CB LEU C 4 1.415 10.205 1.363 1.00 0.00 C ATOM 1697 CG LEU C 4 2.724 10.228 2.166 1.00 0.00 C ATOM 1698 CD1 LEU C 4 3.797 9.419 1.441 1.00 0.00 C ATOM 1699 CD2 LEU C 4 3.259 11.651 2.311 1.00 0.00 C ATOM 0 H LEU C 4 -0.726 9.373 3.130 1.00 0.00 H new ATOM 0 HA LEU C 4 0.566 11.900 2.359 1.00 0.00 H new ATOM 0 HB2 LEU C 4 1.144 9.171 1.148 1.00 0.00 H new ATOM 0 HB3 LEU C 4 1.574 10.699 0.404 1.00 0.00 H new ATOM 0 HG LEU C 4 2.506 9.807 3.148 1.00 0.00 H new ATOM 0 HD11 LEU C 4 4.721 9.441 2.018 1.00 0.00 H new ATOM 0 HD12 LEU C 4 3.463 8.387 1.331 1.00 0.00 H new ATOM 0 HD13 LEU C 4 3.974 9.850 0.456 1.00 0.00 H new ATOM 0 HD21 LEU C 4 4.186 11.635 2.884 1.00 0.00 H new ATOM 0 HD22 LEU C 4 3.450 12.070 1.323 1.00 0.00 H new ATOM 0 HD23 LEU C 4 2.523 12.265 2.829 1.00 0.00 H new ATOM 1711 N THR C 5 -0.918 11.811 0.187 1.00 0.00 N ATOM 1712 CA THR C 5 -1.994 11.972 -0.778 1.00 0.00 C ATOM 1713 C THR C 5 -1.408 11.695 -2.151 1.00 0.00 C ATOM 1714 O THR C 5 -0.279 12.083 -2.448 1.00 0.00 O ATOM 1715 CB THR C 5 -2.600 13.373 -0.665 1.00 0.00 C ATOM 1716 OG1 THR C 5 -3.165 13.527 0.616 1.00 0.00 O ATOM 1717 CG2 THR C 5 -3.702 13.624 -1.695 1.00 0.00 C ATOM 0 H THR C 5 -0.115 12.415 0.012 1.00 0.00 H new ATOM 0 HA THR C 5 -2.811 11.275 -0.591 1.00 0.00 H new ATOM 0 HB THR C 5 -1.795 14.085 -0.845 1.00 0.00 H new ATOM 0 HG1 THR C 5 -3.554 14.423 0.696 1.00 0.00 H new ATOM 0 HG21 THR C 5 -4.095 14.633 -1.568 1.00 0.00 H new ATOM 0 HG22 THR C 5 -3.292 13.518 -2.699 1.00 0.00 H new ATOM 0 HG23 THR C 5 -4.505 12.901 -1.552 1.00 0.00 H new ATOM 1725 N ARG C 6 -2.193 11.017 -2.986 1.00 0.00 N ATOM 1726 CA ARG C 6 -1.723 10.485 -4.253 1.00 0.00 C ATOM 1727 C ARG C 6 -2.850 10.575 -5.271 1.00 0.00 C ATOM 1728 O ARG C 6 -3.972 10.923 -4.912 1.00 0.00 O ATOM 1729 CB ARG C 6 -1.314 9.029 -3.992 1.00 0.00 C ATOM 1730 CG ARG C 6 -0.427 8.384 -5.060 1.00 0.00 C ATOM 1731 CD ARG C 6 1.007 8.922 -5.021 1.00 0.00 C ATOM 1732 NE ARG C 6 1.123 10.269 -5.589 1.00 0.00 N ATOM 1733 CZ ARG C 6 2.189 11.057 -5.437 1.00 0.00 C ATOM 1734 NH1 ARG C 6 3.256 10.641 -4.768 1.00 0.00 N ATOM 1735 NH2 ARG C 6 2.182 12.276 -5.963 1.00 0.00 N ATOM 0 H ARG C 6 -3.176 10.823 -2.797 1.00 0.00 H new ATOM 0 HA ARG C 6 -0.874 11.042 -4.650 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -0.791 8.984 -3.037 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -2.219 8.430 -3.888 1.00 0.00 H new ATOM 0 HG2 ARG C 6 -0.412 7.304 -4.914 1.00 0.00 H new ATOM 0 HG3 ARG C 6 -0.856 8.567 -6.045 1.00 0.00 H new ATOM 0 HD2 ARG C 6 1.357 8.936 -3.989 1.00 0.00 H new ATOM 0 HD3 ARG C 6 1.660 8.243 -5.570 1.00 0.00 H new ATOM 0 HE ARG C 6 0.339 10.626 -6.135 1.00 0.00 H new ATOM 0 HH11 ARG C 6 3.270 9.706 -4.361 1.00 0.00 H new ATOM 0 HH12 ARG C 6 4.063 11.256 -4.661 1.00 0.00 H new ATOM 0 HH21 ARG C 6 1.366 12.604 -6.479 1.00 0.00 H new ATOM 0 HH22 ARG C 6 2.993 12.884 -5.851 1.00 0.00 H new ATOM 1749 N LYS C 7 -2.565 10.265 -6.538 1.00 0.00 N ATOM 1750 CA LYS C 7 -3.580 10.247 -7.578 1.00 0.00 C ATOM 1751 C LYS C 7 -3.379 9.031 -8.467 1.00 0.00 C ATOM 1752 O LYS C 7 -2.294 8.454 -8.505 1.00 0.00 O ATOM 1753 CB LYS C 7 -3.520 11.529 -8.415 1.00 0.00 C ATOM 1754 CG LYS C 7 -3.453 12.785 -7.545 1.00 0.00 C ATOM 1755 CD LYS C 7 -3.720 14.006 -8.425 1.00 0.00 C ATOM 1756 CE LYS C 7 -3.538 15.294 -7.621 1.00 0.00 C ATOM 1757 NZ LYS C 7 -3.826 16.472 -8.458 1.00 0.00 N ATOM 0 H LYS C 7 -1.629 10.022 -6.864 1.00 0.00 H new ATOM 0 HA LYS C 7 -4.562 10.192 -7.109 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -2.648 11.494 -9.067 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -4.398 11.582 -9.059 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -4.189 12.729 -6.743 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -2.474 12.866 -7.073 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -3.041 14.003 -9.277 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -4.733 13.959 -8.825 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -4.200 15.285 -6.755 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -2.518 15.351 -7.241 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 -3.697 17.337 -7.896 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -3.177 16.487 -9.271 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -4.807 16.424 -8.799 1.00 0.00 H new ATOM 1771 N VAL C 8 -4.433 8.650 -9.185 1.00 0.00 N ATOM 1772 CA VAL C 8 -4.412 7.506 -10.086 1.00 0.00 C ATOM 1773 C VAL C 8 -3.233 7.613 -11.048 1.00 0.00 C ATOM 1774 O VAL C 8 -3.190 8.525 -11.874 1.00 0.00 O ATOM 1775 CB VAL C 8 -5.739 7.450 -10.850 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -5.703 6.316 -11.875 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -6.888 7.216 -9.871 1.00 0.00 C ATOM 0 H VAL C 8 -5.331 9.132 -9.156 1.00 0.00 H new ATOM 0 HA VAL C 8 -4.291 6.587 -9.513 1.00 0.00 H new ATOM 0 HB VAL C 8 -5.891 8.397 -11.368 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -6.650 6.283 -12.414 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -4.890 6.489 -12.580 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -5.544 5.367 -11.363 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -7.830 7.177 -10.418 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -6.733 6.273 -9.347 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -6.922 8.031 -9.148 1.00 0.00 H new ATOM 1787 N GLY C 9 -2.278 6.685 -10.946 1.00 0.00 N ATOM 1788 CA GLY C 9 -1.136 6.641 -11.850 1.00 0.00 C ATOM 1789 C GLY C 9 0.160 7.089 -11.177 1.00 0.00 C ATOM 1790 O GLY C 9 1.160 7.304 -11.862 1.00 0.00 O ATOM 0 H GLY C 9 -2.278 5.950 -10.239 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -1.014 5.626 -12.227 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -1.334 7.279 -12.711 1.00 0.00 H new ATOM 1794 N GLU C 10 0.159 7.230 -9.849 1.00 0.00 N ATOM 1795 CA GLU C 10 1.339 7.649 -9.103 1.00 0.00 C ATOM 1796 C GLU C 10 1.698 6.605 -8.048 1.00 0.00 C ATOM 1797 O GLU C 10 0.994 5.605 -7.891 1.00 0.00 O ATOM 1798 CB GLU C 10 1.081 9.014 -8.468 1.00 0.00 C ATOM 1799 CG GLU C 10 0.732 10.085 -9.502 1.00 0.00 C ATOM 1800 CD GLU C 10 0.521 11.443 -8.838 1.00 0.00 C ATOM 1801 OE1 GLU C 10 -0.103 11.475 -7.752 1.00 0.00 O ATOM 1802 OE2 GLU C 10 0.988 12.451 -9.417 1.00 0.00 O ATOM 0 H GLU C 10 -0.660 7.056 -9.266 1.00 0.00 H new ATOM 0 HA GLU C 10 2.187 7.737 -9.782 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.266 8.928 -7.749 1.00 0.00 H new ATOM 0 HB3 GLU C 10 1.965 9.325 -7.912 1.00 0.00 H new ATOM 0 HG2 GLU C 10 1.532 10.158 -10.239 1.00 0.00 H new ATOM 0 HG3 GLU C 10 -0.171 9.795 -10.039 1.00 0.00 H new ATOM 1809 N SER C 11 2.794 6.832 -7.315 1.00 0.00 N ATOM 1810 CA SER C 11 3.333 5.839 -6.392 1.00 0.00 C ATOM 1811 C SER C 11 3.889 6.441 -5.108 1.00 0.00 C ATOM 1812 O SER C 11 3.956 7.656 -4.941 1.00 0.00 O ATOM 1813 CB SER C 11 4.417 5.024 -7.102 1.00 0.00 C ATOM 1814 OG SER C 11 5.342 5.866 -7.755 1.00 0.00 O ATOM 0 H SER C 11 3.325 7.702 -7.347 1.00 0.00 H new ATOM 0 HA SER C 11 2.503 5.198 -6.093 1.00 0.00 H new ATOM 0 HB2 SER C 11 4.939 4.399 -6.378 1.00 0.00 H new ATOM 0 HB3 SER C 11 3.956 4.354 -7.828 1.00 0.00 H new ATOM 0 HG SER C 11 6.024 5.320 -8.199 1.00 0.00 H new ATOM 1820 N ILE C 12 4.294 5.536 -4.211 1.00 0.00 N ATOM 1821 CA ILE C 12 4.878 5.809 -2.906 1.00 0.00 C ATOM 1822 C ILE C 12 6.015 4.801 -2.698 1.00 0.00 C ATOM 1823 O ILE C 12 6.085 3.810 -3.421 1.00 0.00 O ATOM 1824 CB ILE C 12 3.785 5.651 -1.835 1.00 0.00 C ATOM 1825 CG1 ILE C 12 2.638 6.654 -2.034 1.00 0.00 C ATOM 1826 CG2 ILE C 12 4.366 5.822 -0.430 1.00 0.00 C ATOM 1827 CD1 ILE C 12 3.082 8.110 -1.889 1.00 0.00 C ATOM 0 H ILE C 12 4.216 4.536 -4.393 1.00 0.00 H new ATOM 0 HA ILE C 12 5.274 6.822 -2.837 1.00 0.00 H new ATOM 0 HB ILE C 12 3.385 4.643 -1.943 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.205 6.509 -3.024 1.00 0.00 H new ATOM 0 HG13 ILE C 12 1.852 6.446 -1.308 1.00 0.00 H new ATOM 0 HG21 ILE C 12 3.573 5.706 0.308 1.00 0.00 H new ATOM 0 HG22 ILE C 12 5.134 5.067 -0.260 1.00 0.00 H new ATOM 0 HG23 ILE C 12 4.806 6.815 -0.337 1.00 0.00 H new ATOM 0 HD11 ILE C 12 2.226 8.768 -2.041 1.00 0.00 H new ATOM 0 HD12 ILE C 12 3.489 8.269 -0.890 1.00 0.00 H new ATOM 0 HD13 ILE C 12 3.847 8.333 -2.632 1.00 0.00 H new ATOM 1839 N ASN C 13 6.905 5.021 -1.725 1.00 0.00 N ATOM 1840 CA ASN C 13 8.056 4.150 -1.542 1.00 0.00 C ATOM 1841 C ASN C 13 8.316 3.849 -0.065 1.00 0.00 C ATOM 1842 O ASN C 13 8.008 4.665 0.804 1.00 0.00 O ATOM 1843 CB ASN C 13 9.268 4.816 -2.197 1.00 0.00 C ATOM 1844 CG ASN C 13 10.438 3.853 -2.319 1.00 0.00 C ATOM 1845 OD1 ASN C 13 11.174 3.630 -1.364 1.00 0.00 O ATOM 1846 ND2 ASN C 13 10.614 3.279 -3.503 1.00 0.00 N ATOM 0 H ASN C 13 6.846 5.791 -1.059 1.00 0.00 H new ATOM 0 HA ASN C 13 7.860 3.188 -2.015 1.00 0.00 H new ATOM 0 HB2 ASN C 13 8.992 5.182 -3.186 1.00 0.00 H new ATOM 0 HB3 ASN C 13 9.569 5.683 -1.609 1.00 0.00 H new ATOM 0 HD21 ASN C 13 11.384 2.625 -3.643 1.00 0.00 H new ATOM 0 HD22 ASN C 13 9.979 3.492 -4.272 1.00 0.00 H new ATOM 1853 N ILE C 14 8.883 2.669 0.206 1.00 0.00 N ATOM 1854 CA ILE C 14 9.201 2.192 1.548 1.00 0.00 C ATOM 1855 C ILE C 14 10.538 1.451 1.524 1.00 0.00 C ATOM 1856 O ILE C 14 10.885 0.814 0.527 1.00 0.00 O ATOM 1857 CB ILE C 14 8.092 1.252 2.052 1.00 0.00 C ATOM 1858 CG1 ILE C 14 6.744 1.987 2.091 1.00 0.00 C ATOM 1859 CG2 ILE C 14 8.446 0.698 3.440 1.00 0.00 C ATOM 1860 CD1 ILE C 14 5.600 1.081 2.540 1.00 0.00 C ATOM 0 H ILE C 14 9.139 2.004 -0.524 1.00 0.00 H new ATOM 0 HA ILE C 14 9.272 3.045 2.223 1.00 0.00 H new ATOM 0 HB ILE C 14 8.007 0.414 1.360 1.00 0.00 H new ATOM 0 HG12 ILE C 14 6.817 2.838 2.768 1.00 0.00 H new ATOM 0 HG13 ILE C 14 6.522 2.385 1.101 1.00 0.00 H new ATOM 0 HG21 ILE C 14 7.651 0.035 3.781 1.00 0.00 H new ATOM 0 HG22 ILE C 14 9.382 0.142 3.382 1.00 0.00 H new ATOM 0 HG23 ILE C 14 8.557 1.523 4.144 1.00 0.00 H new ATOM 0 HD11 ILE C 14 4.669 1.648 2.551 1.00 0.00 H new ATOM 0 HD12 ILE C 14 5.506 0.243 1.849 1.00 0.00 H new ATOM 0 HD13 ILE C 14 5.806 0.704 3.542 1.00 0.00 H new ATOM 1872 N GLY C 15 11.289 1.530 2.625 1.00 0.00 N ATOM 1873 CA GLY C 15 12.572 0.864 2.747 1.00 0.00 C ATOM 1874 C GLY C 15 13.498 1.270 1.605 1.00 0.00 C ATOM 1875 O GLY C 15 13.558 2.441 1.233 1.00 0.00 O ATOM 0 H GLY C 15 11.018 2.060 3.453 1.00 0.00 H new ATOM 0 HA2 GLY C 15 13.031 1.119 3.702 1.00 0.00 H new ATOM 0 HA3 GLY C 15 12.429 -0.217 2.740 1.00 0.00 H new ATOM 1879 N ASP C 16 14.212 0.288 1.057 1.00 0.00 N ATOM 1880 CA ASP C 16 15.090 0.480 -0.088 1.00 0.00 C ATOM 1881 C ASP C 16 14.815 -0.570 -1.168 1.00 0.00 C ATOM 1882 O ASP C 16 15.543 -0.647 -2.156 1.00 0.00 O ATOM 1883 CB ASP C 16 16.556 0.512 0.360 1.00 0.00 C ATOM 1884 CG ASP C 16 17.048 -0.826 0.911 1.00 0.00 C ATOM 1885 OD1 ASP C 16 16.415 -1.339 1.863 1.00 0.00 O ATOM 1886 OD2 ASP C 16 18.060 -1.329 0.374 1.00 0.00 O ATOM 0 H ASP C 16 14.195 -0.672 1.402 1.00 0.00 H new ATOM 0 HA ASP C 16 14.879 1.448 -0.542 1.00 0.00 H new ATOM 0 HB2 ASP C 16 17.181 0.801 -0.485 1.00 0.00 H new ATOM 0 HB3 ASP C 16 16.679 1.279 1.124 1.00 0.00 H new ATOM 1891 N ASP C 17 13.766 -1.384 -0.980 1.00 0.00 N ATOM 1892 CA ASP C 17 13.390 -2.445 -1.906 1.00 0.00 C ATOM 1893 C ASP C 17 11.871 -2.568 -2.066 1.00 0.00 C ATOM 1894 O ASP C 17 11.403 -3.546 -2.639 1.00 0.00 O ATOM 1895 CB ASP C 17 13.960 -3.785 -1.429 1.00 0.00 C ATOM 1896 CG ASP C 17 15.483 -3.827 -1.516 1.00 0.00 C ATOM 1897 OD1 ASP C 17 15.993 -3.739 -2.655 1.00 0.00 O ATOM 1898 OD2 ASP C 17 16.124 -3.948 -0.447 1.00 0.00 O ATOM 0 H ASP C 17 13.152 -1.317 -0.168 1.00 0.00 H new ATOM 0 HA ASP C 17 13.807 -2.183 -2.878 1.00 0.00 H new ATOM 0 HB2 ASP C 17 13.652 -3.963 -0.399 1.00 0.00 H new ATOM 0 HB3 ASP C 17 13.541 -4.591 -2.031 1.00 0.00 H new ATOM 1903 N ILE C 18 11.084 -1.600 -1.571 1.00 0.00 N ATOM 1904 CA ILE C 18 9.631 -1.684 -1.644 1.00 0.00 C ATOM 1905 C ILE C 18 9.061 -0.408 -2.255 1.00 0.00 C ATOM 1906 O ILE C 18 9.492 0.697 -1.927 1.00 0.00 O ATOM 1907 CB ILE C 18 9.061 -1.924 -0.241 1.00 0.00 C ATOM 1908 CG1 ILE C 18 9.614 -3.229 0.343 1.00 0.00 C ATOM 1909 CG2 ILE C 18 7.527 -1.965 -0.295 1.00 0.00 C ATOM 1910 CD1 ILE C 18 9.159 -3.428 1.790 1.00 0.00 C ATOM 0 H ILE C 18 11.435 -0.756 -1.119 1.00 0.00 H new ATOM 0 HA ILE C 18 9.346 -2.520 -2.283 1.00 0.00 H new ATOM 0 HB ILE C 18 9.365 -1.102 0.407 1.00 0.00 H new ATOM 0 HG12 ILE C 18 9.281 -4.071 -0.264 1.00 0.00 H new ATOM 0 HG13 ILE C 18 10.703 -3.216 0.301 1.00 0.00 H new ATOM 0 HG21 ILE C 18 7.132 -2.136 0.706 1.00 0.00 H new ATOM 0 HG22 ILE C 18 7.151 -1.016 -0.676 1.00 0.00 H new ATOM 0 HG23 ILE C 18 7.208 -2.773 -0.954 1.00 0.00 H new ATOM 0 HD11 ILE C 18 9.568 -4.362 2.175 1.00 0.00 H new ATOM 0 HD12 ILE C 18 9.514 -2.598 2.400 1.00 0.00 H new ATOM 0 HD13 ILE C 18 8.070 -3.466 1.827 1.00 0.00 H new ATOM 1922 N THR C 19 8.081 -0.567 -3.146 1.00 0.00 N ATOM 1923 CA THR C 19 7.396 0.546 -3.783 1.00 0.00 C ATOM 1924 C THR C 19 5.928 0.172 -3.938 1.00 0.00 C ATOM 1925 O THR C 19 5.604 -1.005 -4.075 1.00 0.00 O ATOM 1926 CB THR C 19 8.034 0.843 -5.144 1.00 0.00 C ATOM 1927 OG1 THR C 19 9.442 0.861 -5.038 1.00 0.00 O ATOM 1928 CG2 THR C 19 7.594 2.202 -5.685 1.00 0.00 C ATOM 0 H THR C 19 7.742 -1.481 -3.444 1.00 0.00 H new ATOM 0 HA THR C 19 7.480 1.447 -3.175 1.00 0.00 H new ATOM 0 HB THR C 19 7.708 0.054 -5.822 1.00 0.00 H new ATOM 0 HG1 THR C 19 9.834 1.051 -5.916 1.00 0.00 H new ATOM 0 HG21 THR C 19 8.066 2.379 -6.651 1.00 0.00 H new ATOM 0 HG22 THR C 19 6.510 2.213 -5.803 1.00 0.00 H new ATOM 0 HG23 THR C 19 7.891 2.985 -4.987 1.00 0.00 H new ATOM 1936 N ILE C 20 5.039 1.168 -3.918 1.00 0.00 N ATOM 1937 CA ILE C 20 3.594 0.951 -3.945 1.00 0.00 C ATOM 1938 C ILE C 20 2.980 1.894 -4.980 1.00 0.00 C ATOM 1939 O ILE C 20 3.508 2.984 -5.198 1.00 0.00 O ATOM 1940 CB ILE C 20 3.007 1.229 -2.552 1.00 0.00 C ATOM 1941 CG1 ILE C 20 3.798 0.557 -1.420 1.00 0.00 C ATOM 1942 CG2 ILE C 20 1.549 0.769 -2.501 1.00 0.00 C ATOM 1943 CD1 ILE C 20 3.737 -0.969 -1.445 1.00 0.00 C ATOM 0 H ILE C 20 5.305 2.152 -3.882 1.00 0.00 H new ATOM 0 HA ILE C 20 3.370 -0.081 -4.215 1.00 0.00 H new ATOM 0 HB ILE C 20 3.073 2.305 -2.393 1.00 0.00 H new ATOM 0 HG12 ILE C 20 4.840 0.870 -1.482 1.00 0.00 H new ATOM 0 HG13 ILE C 20 3.415 0.911 -0.463 1.00 0.00 H new ATOM 0 HG21 ILE C 20 1.139 0.969 -1.511 1.00 0.00 H new ATOM 0 HG22 ILE C 20 0.970 1.310 -3.250 1.00 0.00 H new ATOM 0 HG23 ILE C 20 1.497 -0.300 -2.706 1.00 0.00 H new ATOM 0 HD11 ILE C 20 4.319 -1.370 -0.615 1.00 0.00 H new ATOM 0 HD12 ILE C 20 2.701 -1.293 -1.351 1.00 0.00 H new ATOM 0 HD13 ILE C 20 4.148 -1.334 -2.386 1.00 0.00 H new ATOM 1955 N THR C 21 1.882 1.495 -5.620 1.00 0.00 N ATOM 1956 CA THR C 21 1.287 2.274 -6.700 1.00 0.00 C ATOM 1957 C THR C 21 -0.236 2.241 -6.603 1.00 0.00 C ATOM 1958 O THR C 21 -0.801 1.279 -6.087 1.00 0.00 O ATOM 1959 CB THR C 21 1.745 1.694 -8.041 1.00 0.00 C ATOM 1960 OG1 THR C 21 3.148 1.543 -8.045 1.00 0.00 O ATOM 1961 CG2 THR C 21 1.366 2.603 -9.211 1.00 0.00 C ATOM 0 H THR C 21 1.385 0.630 -5.406 1.00 0.00 H new ATOM 0 HA THR C 21 1.610 3.312 -6.620 1.00 0.00 H new ATOM 0 HB THR C 21 1.248 0.731 -8.161 1.00 0.00 H new ATOM 0 HG1 THR C 21 3.434 1.170 -8.905 1.00 0.00 H new ATOM 0 HG21 THR C 21 1.708 2.156 -10.144 1.00 0.00 H new ATOM 0 HG22 THR C 21 0.283 2.724 -9.242 1.00 0.00 H new ATOM 0 HG23 THR C 21 1.836 3.578 -9.081 1.00 0.00 H new ATOM 1969 N ILE C 22 -0.902 3.289 -7.098 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.355 3.381 -7.103 1.00 0.00 C ATOM 1971 C ILE C 22 -2.816 3.362 -8.559 1.00 0.00 C ATOM 1972 O ILE C 22 -2.763 4.365 -9.265 1.00 0.00 O ATOM 1973 CB ILE C 22 -2.783 4.594 -6.258 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -4.251 4.536 -5.813 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -2.497 5.938 -6.926 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -5.234 4.284 -6.950 1.00 0.00 C ATOM 0 H ILE C 22 -0.439 4.100 -7.508 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.851 2.535 -6.627 1.00 0.00 H new ATOM 0 HB ILE C 22 -2.156 4.525 -5.369 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -4.363 3.748 -5.068 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -4.509 5.476 -5.325 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -2.825 6.746 -6.272 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -1.427 6.032 -7.110 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -3.035 5.996 -7.872 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -6.249 4.257 -6.554 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -5.153 5.084 -7.685 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -5.004 3.330 -7.425 1.00 0.00 H new ATOM 1988 N LEU C 23 -3.279 2.191 -9.008 1.00 0.00 N ATOM 1989 CA LEU C 23 -3.599 1.960 -10.408 1.00 0.00 C ATOM 1990 C LEU C 23 -4.913 2.610 -10.819 1.00 0.00 C ATOM 1991 O LEU C 23 -5.089 2.953 -11.987 1.00 0.00 O ATOM 1992 CB LEU C 23 -3.690 0.458 -10.669 1.00 0.00 C ATOM 1993 CG LEU C 23 -2.446 -0.306 -10.212 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -2.603 -1.752 -10.653 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -1.163 0.292 -10.785 1.00 0.00 C ATOM 0 H LEU C 23 -3.440 1.382 -8.407 1.00 0.00 H new ATOM 0 HA LEU C 23 -2.802 2.411 -11.000 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -4.564 0.058 -10.155 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -3.842 0.289 -11.735 1.00 0.00 H new ATOM 0 HG LEU C 23 -2.360 -0.238 -9.128 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -1.729 -2.324 -10.341 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -3.497 -2.177 -10.196 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -2.695 -1.793 -11.738 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -0.306 -0.282 -10.434 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -1.201 0.259 -11.874 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -1.066 1.327 -10.457 1.00 0.00 H new ATOM 2007 N GLY C 24 -5.838 2.780 -9.872 1.00 0.00 N ATOM 2008 CA GLY C 24 -7.102 3.438 -10.153 1.00 0.00 C ATOM 2009 C GLY C 24 -8.097 3.321 -9.011 1.00 0.00 C ATOM 2010 O GLY C 24 -7.794 2.790 -7.943 1.00 0.00 O ATOM 0 H GLY C 24 -5.729 2.469 -8.907 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -6.918 4.492 -10.362 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -7.538 3.006 -11.054 1.00 0.00 H new ATOM 2014 N VAL C 25 -9.309 3.829 -9.247 1.00 0.00 N ATOM 2015 CA VAL C 25 -10.375 3.842 -8.258 1.00 0.00 C ATOM 2016 C VAL C 25 -11.654 3.276 -8.866 1.00 0.00 C ATOM 2017 O VAL C 25 -11.780 3.187 -10.086 1.00 0.00 O ATOM 2018 CB VAL C 25 -10.604 5.271 -7.741 1.00 0.00 C ATOM 2019 CG1 VAL C 25 -9.340 5.826 -7.085 1.00 0.00 C ATOM 2020 CG2 VAL C 25 -11.015 6.215 -8.869 1.00 0.00 C ATOM 0 H VAL C 25 -9.574 4.245 -10.140 1.00 0.00 H new ATOM 0 HA VAL C 25 -10.085 3.217 -7.414 1.00 0.00 H new ATOM 0 HB VAL C 25 -11.408 5.213 -7.007 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -9.530 6.838 -6.728 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -9.058 5.192 -6.245 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -8.530 5.844 -7.814 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -11.169 7.217 -8.467 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -10.229 6.243 -9.624 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -11.941 5.860 -9.322 1.00 0.00 H new ATOM 2030 N SER C 26 -12.598 2.895 -8.008 1.00 0.00 N ATOM 2031 CA SER C 26 -13.866 2.304 -8.416 1.00 0.00 C ATOM 2032 C SER C 26 -14.930 2.653 -7.380 1.00 0.00 C ATOM 2033 O SER C 26 -15.572 1.772 -6.811 1.00 0.00 O ATOM 2034 CB SER C 26 -13.698 0.787 -8.545 1.00 0.00 C ATOM 2035 OG SER C 26 -12.933 0.475 -9.691 1.00 0.00 O ATOM 0 H SER C 26 -12.500 2.990 -6.997 1.00 0.00 H new ATOM 0 HA SER C 26 -14.178 2.698 -9.383 1.00 0.00 H new ATOM 0 HB2 SER C 26 -13.210 0.391 -7.654 1.00 0.00 H new ATOM 0 HB3 SER C 26 -14.676 0.310 -8.611 1.00 0.00 H new ATOM 0 HG SER C 26 -12.571 1.300 -10.077 1.00 0.00 H new ATOM 2041 N GLY C 27 -15.117 3.953 -7.136 1.00 0.00 N ATOM 2042 CA GLY C 27 -16.060 4.416 -6.131 1.00 0.00 C ATOM 2043 C GLY C 27 -15.490 4.157 -4.741 1.00 0.00 C ATOM 2044 O GLY C 27 -14.368 4.566 -4.444 1.00 0.00 O ATOM 0 H GLY C 27 -14.624 4.700 -7.625 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -16.255 5.480 -6.263 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -17.013 3.900 -6.247 1.00 0.00 H new ATOM 2048 N GLN C 28 -16.262 3.474 -3.897 1.00 0.00 N ATOM 2049 CA GLN C 28 -15.819 3.104 -2.558 1.00 0.00 C ATOM 2050 C GLN C 28 -14.722 2.039 -2.623 1.00 0.00 C ATOM 2051 O GLN C 28 -14.090 1.747 -1.609 1.00 0.00 O ATOM 2052 CB GLN C 28 -17.036 2.606 -1.773 1.00 0.00 C ATOM 2053 CG GLN C 28 -16.786 2.415 -0.274 1.00 0.00 C ATOM 2054 CD GLN C 28 -16.634 3.735 0.481 1.00 0.00 C ATOM 2055 OE1 GLN C 28 -16.367 4.782 -0.101 1.00 0.00 O ATOM 2056 NE2 GLN C 28 -16.804 3.698 1.799 1.00 0.00 N ATOM 0 H GLN C 28 -17.207 3.164 -4.123 1.00 0.00 H new ATOM 0 HA GLN C 28 -15.389 3.969 -2.053 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -17.854 3.315 -1.905 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -17.364 1.658 -2.198 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -17.612 1.850 0.157 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -15.885 1.818 -0.135 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -17.025 2.816 2.260 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -16.713 4.552 2.349 1.00 0.00 H new ATOM 2065 N GLN C 29 -14.484 1.453 -3.805 1.00 0.00 N ATOM 2066 CA GLN C 29 -13.410 0.489 -3.982 1.00 0.00 C ATOM 2067 C GLN C 29 -12.183 1.180 -4.578 1.00 0.00 C ATOM 2068 O GLN C 29 -12.271 2.282 -5.120 1.00 0.00 O ATOM 2069 CB GLN C 29 -13.829 -0.641 -4.925 1.00 0.00 C ATOM 2070 CG GLN C 29 -15.074 -1.392 -4.469 1.00 0.00 C ATOM 2071 CD GLN C 29 -15.339 -2.549 -5.415 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -16.004 -2.390 -6.434 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -14.814 -3.727 -5.085 1.00 0.00 N ATOM 0 H GLN C 29 -15.027 1.636 -4.649 1.00 0.00 H new ATOM 0 HA GLN C 29 -13.177 0.072 -3.002 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -14.009 -0.226 -5.917 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -13.004 -1.347 -5.020 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -14.937 -1.762 -3.453 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -15.932 -0.719 -4.450 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -14.267 -3.820 -4.229 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -14.959 -4.537 -5.688 1.00 0.00 H new ATOM 2082 N VAL C 30 -11.034 0.514 -4.470 1.00 0.00 N ATOM 2083 CA VAL C 30 -9.751 1.043 -4.909 1.00 0.00 C ATOM 2084 C VAL C 30 -8.908 -0.089 -5.489 1.00 0.00 C ATOM 2085 O VAL C 30 -9.033 -1.238 -5.067 1.00 0.00 O ATOM 2086 CB VAL C 30 -9.050 1.698 -3.711 1.00 0.00 C ATOM 2087 CG1 VAL C 30 -7.616 2.089 -4.058 1.00 0.00 C ATOM 2088 CG2 VAL C 30 -9.795 2.957 -3.269 1.00 0.00 C ATOM 0 H VAL C 30 -10.971 -0.422 -4.069 1.00 0.00 H new ATOM 0 HA VAL C 30 -9.892 1.794 -5.686 1.00 0.00 H new ATOM 0 HB VAL C 30 -9.045 0.965 -2.904 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -7.145 2.551 -3.190 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -7.056 1.199 -4.345 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -7.622 2.797 -4.887 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.280 3.405 -2.419 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -9.824 3.671 -4.092 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -10.813 2.695 -2.980 1.00 0.00 H new ATOM 2098 N ARG C 31 -8.049 0.248 -6.459 1.00 0.00 N ATOM 2099 CA ARG C 31 -7.156 -0.699 -7.118 1.00 0.00 C ATOM 2100 C ARG C 31 -5.726 -0.217 -6.923 1.00 0.00 C ATOM 2101 O ARG C 31 -5.367 0.872 -7.368 1.00 0.00 O ATOM 2102 CB ARG C 31 -7.516 -0.763 -8.609 1.00 0.00 C ATOM 2103 CG ARG C 31 -8.002 -2.146 -9.041 1.00 0.00 C ATOM 2104 CD ARG C 31 -6.862 -3.165 -9.114 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.363 -4.450 -9.606 1.00 0.00 N ATOM 2106 CZ ARG C 31 -7.519 -4.752 -10.897 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -7.164 -3.899 -11.854 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -8.041 -5.919 -11.249 1.00 0.00 N ATOM 0 H ARG C 31 -7.957 1.201 -6.810 1.00 0.00 H new ATOM 0 HA ARG C 31 -7.257 -1.698 -6.695 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -8.291 -0.027 -8.823 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.643 -0.488 -9.201 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -8.758 -2.499 -8.339 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -8.483 -2.072 -10.016 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -6.076 -2.796 -9.773 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -6.416 -3.294 -8.128 1.00 0.00 H new ATOM 0 HE ARG C 31 -7.609 -5.161 -8.917 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -6.764 -2.994 -11.608 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -7.292 -4.150 -12.834 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -8.324 -6.588 -10.533 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -8.159 -6.148 -12.236 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.917 -1.035 -6.251 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.561 -0.670 -5.875 1.00 0.00 C ATOM 2124 C ILE C 32 -2.615 -1.838 -6.126 1.00 0.00 C ATOM 2125 O ILE C 32 -3.033 -2.992 -6.164 1.00 0.00 O ATOM 2126 CB ILE C 32 -3.510 -0.267 -4.393 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -4.349 -1.221 -3.532 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -3.974 1.184 -4.248 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -4.261 -0.871 -2.047 1.00 0.00 C ATOM 0 H ILE C 32 -5.189 -1.972 -5.953 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.248 0.179 -6.483 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.483 -0.342 -4.034 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.390 -1.181 -3.854 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -4.007 -2.245 -3.685 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -3.939 1.474 -3.198 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.318 1.835 -4.826 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -4.995 1.278 -4.617 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -4.869 -1.570 -1.472 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -3.224 -0.937 -1.719 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -4.628 0.143 -1.890 1.00 0.00 H new ATOM 2141 N GLY C 33 -1.330 -1.525 -6.294 1.00 0.00 N ATOM 2142 CA GLY C 33 -0.317 -2.523 -6.570 1.00 0.00 C ATOM 2143 C GLY C 33 0.876 -2.351 -5.642 1.00 0.00 C ATOM 2144 O GLY C 33 1.024 -1.320 -4.984 1.00 0.00 O ATOM 0 H GLY C 33 -0.971 -0.572 -6.241 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -0.739 -3.520 -6.446 1.00 0.00 H new ATOM 0 HA3 GLY C 33 0.008 -2.441 -7.607 1.00 0.00 H new ATOM 2148 N ILE C 34 1.725 -3.376 -5.599 1.00 0.00 N ATOM 2149 CA ILE C 34 2.864 -3.444 -4.699 1.00 0.00 C ATOM 2150 C ILE C 34 4.050 -3.993 -5.478 1.00 0.00 C ATOM 2151 O ILE C 34 3.898 -4.896 -6.298 1.00 0.00 O ATOM 2152 CB ILE C 34 2.526 -4.384 -3.533 1.00 0.00 C ATOM 2153 CG1 ILE C 34 1.353 -3.814 -2.730 1.00 0.00 C ATOM 2154 CG2 ILE C 34 3.744 -4.586 -2.622 1.00 0.00 C ATOM 2155 CD1 ILE C 34 0.858 -4.812 -1.689 1.00 0.00 C ATOM 0 H ILE C 34 1.635 -4.195 -6.201 1.00 0.00 H new ATOM 0 HA ILE C 34 3.103 -2.457 -4.303 1.00 0.00 H new ATOM 0 HB ILE C 34 2.244 -5.354 -3.941 1.00 0.00 H new ATOM 0 HG12 ILE C 34 1.661 -2.893 -2.236 1.00 0.00 H new ATOM 0 HG13 ILE C 34 0.538 -3.556 -3.406 1.00 0.00 H new ATOM 0 HG21 ILE C 34 3.479 -5.256 -1.804 1.00 0.00 H new ATOM 0 HG22 ILE C 34 4.561 -5.022 -3.198 1.00 0.00 H new ATOM 0 HG23 ILE C 34 4.059 -3.624 -2.217 1.00 0.00 H new ATOM 0 HD11 ILE C 34 0.025 -4.378 -1.136 1.00 0.00 H new ATOM 0 HD12 ILE C 34 0.527 -5.723 -2.187 1.00 0.00 H new ATOM 0 HD13 ILE C 34 1.668 -5.050 -0.999 1.00 0.00 H new ATOM 2167 N ASN C 35 5.231 -3.440 -5.214 1.00 0.00 N ATOM 2168 CA ASN C 35 6.446 -3.809 -5.920 1.00 0.00 C ATOM 2169 C ASN C 35 7.561 -4.042 -4.908 1.00 0.00 C ATOM 2170 O ASN C 35 8.487 -3.245 -4.761 1.00 0.00 O ATOM 2171 CB ASN C 35 6.768 -2.724 -6.943 1.00 0.00 C ATOM 2172 CG ASN C 35 7.639 -3.257 -8.071 1.00 0.00 C ATOM 2173 OD1 ASN C 35 8.538 -4.064 -7.857 1.00 0.00 O ATOM 2174 ND2 ASN C 35 7.372 -2.801 -9.290 1.00 0.00 N ATOM 0 H ASN C 35 5.368 -2.722 -4.502 1.00 0.00 H new ATOM 0 HA ASN C 35 6.324 -4.742 -6.471 1.00 0.00 H new ATOM 0 HB2 ASN C 35 5.841 -2.326 -7.356 1.00 0.00 H new ATOM 0 HB3 ASN C 35 7.278 -1.897 -6.449 1.00 0.00 H new ATOM 0 HD21 ASN C 35 7.923 -3.122 -10.086 1.00 0.00 H new ATOM 0 HD22 ASN C 35 6.616 -2.130 -9.429 1.00 0.00 H new ATOM 2181 N ALA C 36 7.434 -5.170 -4.221 1.00 0.00 N ATOM 2182 CA ALA C 36 8.398 -5.670 -3.258 1.00 0.00 C ATOM 2183 C ALA C 36 8.927 -7.011 -3.757 1.00 0.00 C ATOM 2184 O ALA C 36 8.282 -7.659 -4.583 1.00 0.00 O ATOM 2185 CB ALA C 36 7.690 -5.839 -1.911 1.00 0.00 C ATOM 0 H ALA C 36 6.625 -5.782 -4.326 1.00 0.00 H new ATOM 0 HA ALA C 36 9.233 -4.979 -3.139 1.00 0.00 H new ATOM 0 HB1 ALA C 36 8.398 -6.214 -1.172 1.00 0.00 H new ATOM 0 HB2 ALA C 36 7.299 -4.876 -1.582 1.00 0.00 H new ATOM 0 HB3 ALA C 36 6.868 -6.547 -2.018 1.00 0.00 H new ATOM 2191 N PRO C 37 10.094 -7.449 -3.275 1.00 0.00 N ATOM 2192 CA PRO C 37 10.671 -8.710 -3.677 1.00 0.00 C ATOM 2193 C PRO C 37 9.876 -9.837 -3.034 1.00 0.00 C ATOM 2194 O PRO C 37 9.274 -9.654 -1.978 1.00 0.00 O ATOM 2195 CB PRO C 37 12.106 -8.674 -3.154 1.00 0.00 C ATOM 2196 CG PRO C 37 12.005 -7.788 -1.916 1.00 0.00 C ATOM 2197 CD PRO C 37 10.944 -6.772 -2.311 1.00 0.00 C ATOM 0 HA PRO C 37 10.653 -8.871 -4.755 1.00 0.00 H new ATOM 0 HB2 PRO C 37 12.469 -9.671 -2.907 1.00 0.00 H new ATOM 0 HB3 PRO C 37 12.793 -8.258 -3.891 1.00 0.00 H new ATOM 0 HG2 PRO C 37 11.711 -8.358 -1.034 1.00 0.00 H new ATOM 0 HG3 PRO C 37 12.956 -7.309 -1.683 1.00 0.00 H new ATOM 0 HD2 PRO C 37 10.370 -6.447 -1.443 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.397 -5.881 -2.746 1.00 0.00 H new ATOM 2205 N LYS C 38 9.872 -11.011 -3.664 1.00 0.00 N ATOM 2206 CA LYS C 38 9.171 -12.161 -3.109 1.00 0.00 C ATOM 2207 C LYS C 38 9.928 -12.713 -1.901 1.00 0.00 C ATOM 2208 O LYS C 38 9.494 -13.680 -1.276 1.00 0.00 O ATOM 2209 CB LYS C 38 8.933 -13.200 -4.205 1.00 0.00 C ATOM 2210 CG LYS C 38 8.118 -12.506 -5.303 1.00 0.00 C ATOM 2211 CD LYS C 38 7.628 -13.461 -6.387 1.00 0.00 C ATOM 2212 CE LYS C 38 6.676 -14.511 -5.812 1.00 0.00 C ATOM 2213 NZ LYS C 38 6.131 -15.365 -6.881 1.00 0.00 N ATOM 0 H LYS C 38 10.343 -11.187 -4.551 1.00 0.00 H new ATOM 0 HA LYS C 38 8.190 -11.861 -2.741 1.00 0.00 H new ATOM 0 HB2 LYS C 38 9.879 -13.569 -4.600 1.00 0.00 H new ATOM 0 HB3 LYS C 38 8.395 -14.062 -3.810 1.00 0.00 H new ATOM 0 HG2 LYS C 38 7.259 -12.011 -4.850 1.00 0.00 H new ATOM 0 HG3 LYS C 38 8.729 -11.729 -5.762 1.00 0.00 H new ATOM 0 HD2 LYS C 38 7.121 -12.897 -7.170 1.00 0.00 H new ATOM 0 HD3 LYS C 38 8.481 -13.956 -6.852 1.00 0.00 H new ATOM 0 HE2 LYS C 38 7.203 -15.126 -5.083 1.00 0.00 H new ATOM 0 HE3 LYS C 38 5.860 -14.018 -5.283 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 5.488 -16.070 -6.468 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 5.609 -14.778 -7.563 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 6.911 -15.851 -7.368 1.00 0.00 H new ATOM 2227 N ASP C 39 11.066 -12.088 -1.577 1.00 0.00 N ATOM 2228 CA ASP C 39 11.811 -12.361 -0.364 1.00 0.00 C ATOM 2229 C ASP C 39 11.078 -11.798 0.857 1.00 0.00 C ATOM 2230 O ASP C 39 11.426 -12.138 1.983 1.00 0.00 O ATOM 2231 CB ASP C 39 13.209 -11.746 -0.471 1.00 0.00 C ATOM 2232 CG ASP C 39 14.018 -12.403 -1.589 1.00 0.00 C ATOM 2233 OD1 ASP C 39 14.588 -13.484 -1.325 1.00 0.00 O ATOM 2234 OD2 ASP C 39 14.056 -11.825 -2.697 1.00 0.00 O ATOM 0 H ASP C 39 11.492 -11.371 -2.164 1.00 0.00 H new ATOM 0 HA ASP C 39 11.901 -13.440 -0.241 1.00 0.00 H new ATOM 0 HB2 ASP C 39 13.125 -10.676 -0.660 1.00 0.00 H new ATOM 0 HB3 ASP C 39 13.734 -11.862 0.477 1.00 0.00 H new ATOM 2239 N VAL C 40 10.063 -10.947 0.642 1.00 0.00 N ATOM 2240 CA VAL C 40 9.192 -10.488 1.714 1.00 0.00 C ATOM 2241 C VAL C 40 7.731 -10.791 1.380 1.00 0.00 C ATOM 2242 O VAL C 40 7.305 -10.728 0.225 1.00 0.00 O ATOM 2243 CB VAL C 40 9.407 -8.999 2.010 1.00 0.00 C ATOM 2244 CG1 VAL C 40 10.873 -8.715 2.327 1.00 0.00 C ATOM 2245 CG2 VAL C 40 8.964 -8.108 0.853 1.00 0.00 C ATOM 0 H VAL C 40 9.831 -10.565 -0.275 1.00 0.00 H new ATOM 0 HA VAL C 40 9.450 -11.033 2.622 1.00 0.00 H new ATOM 0 HB VAL C 40 8.789 -8.764 2.877 1.00 0.00 H new ATOM 0 HG11 VAL C 40 11.001 -7.652 2.534 1.00 0.00 H new ATOM 0 HG12 VAL C 40 11.175 -9.294 3.200 1.00 0.00 H new ATOM 0 HG13 VAL C 40 11.491 -8.996 1.474 1.00 0.00 H new ATOM 0 HG21 VAL C 40 9.137 -7.063 1.112 1.00 0.00 H new ATOM 0 HG22 VAL C 40 9.536 -8.360 -0.040 1.00 0.00 H new ATOM 0 HG23 VAL C 40 7.903 -8.263 0.660 1.00 0.00 H new ATOM 2255 N ALA C 41 6.973 -11.128 2.421 1.00 0.00 N ATOM 2256 CA ALA C 41 5.580 -11.514 2.291 1.00 0.00 C ATOM 2257 C ALA C 41 4.711 -10.310 1.949 1.00 0.00 C ATOM 2258 O ALA C 41 5.002 -9.188 2.365 1.00 0.00 O ATOM 2259 CB ALA C 41 5.125 -12.137 3.607 1.00 0.00 C ATOM 0 H ALA C 41 7.315 -11.139 3.382 1.00 0.00 H new ATOM 0 HA ALA C 41 5.478 -12.235 1.480 1.00 0.00 H new ATOM 0 HB1 ALA C 41 4.079 -12.433 3.527 1.00 0.00 H new ATOM 0 HB2 ALA C 41 5.735 -13.014 3.824 1.00 0.00 H new ATOM 0 HB3 ALA C 41 5.236 -11.410 4.411 1.00 0.00 H new ATOM 2265 N VAL C 42 3.644 -10.550 1.188 1.00 0.00 N ATOM 2266 CA VAL C 42 2.686 -9.523 0.807 1.00 0.00 C ATOM 2267 C VAL C 42 1.314 -10.178 0.704 1.00 0.00 C ATOM 2268 O VAL C 42 1.109 -11.030 -0.159 1.00 0.00 O ATOM 2269 CB VAL C 42 3.082 -8.911 -0.540 1.00 0.00 C ATOM 2270 CG1 VAL C 42 2.063 -7.863 -0.962 1.00 0.00 C ATOM 2271 CG2 VAL C 42 4.440 -8.214 -0.475 1.00 0.00 C ATOM 0 H VAL C 42 3.422 -11.474 0.817 1.00 0.00 H new ATOM 0 HA VAL C 42 2.668 -8.725 1.550 1.00 0.00 H new ATOM 0 HB VAL C 42 3.126 -9.735 -1.252 1.00 0.00 H new ATOM 0 HG11 VAL C 42 2.356 -7.436 -1.921 1.00 0.00 H new ATOM 0 HG12 VAL C 42 1.081 -8.327 -1.057 1.00 0.00 H new ATOM 0 HG13 VAL C 42 2.020 -7.074 -0.211 1.00 0.00 H new ATOM 0 HG21 VAL C 42 4.681 -7.795 -1.452 1.00 0.00 H new ATOM 0 HG22 VAL C 42 4.403 -7.414 0.264 1.00 0.00 H new ATOM 0 HG23 VAL C 42 5.206 -8.936 -0.191 1.00 0.00 H new ATOM 2281 N HIS C 43 0.388 -9.776 1.583 1.00 0.00 N ATOM 2282 CA HIS C 43 -0.957 -10.346 1.650 1.00 0.00 C ATOM 2283 C HIS C 43 -1.952 -9.321 2.188 1.00 0.00 C ATOM 2284 O HIS C 43 -1.560 -8.281 2.719 1.00 0.00 O ATOM 2285 CB HIS C 43 -0.980 -11.550 2.599 1.00 0.00 C ATOM 2286 CG HIS C 43 -0.034 -12.665 2.248 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -0.376 -13.820 1.540 1.00 0.00 N ATOM 2288 CD2 HIS C 43 1.293 -12.715 2.574 1.00 0.00 C ATOM 2289 CE1 HIS C 43 0.757 -14.537 1.458 1.00 0.00 C ATOM 2290 NE2 HIS C 43 1.772 -13.898 2.067 1.00 0.00 N ATOM 0 H HIS C 43 0.555 -9.041 2.271 1.00 0.00 H new ATOM 0 HA HIS C 43 -1.233 -10.647 0.640 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -0.748 -11.202 3.606 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -1.993 -11.951 2.626 1.00 0.00 H new ATOM 0 HD2 HIS C 43 1.853 -11.972 3.122 1.00 0.00 H new ATOM 0 HE1 HIS C 43 0.842 -15.496 0.969 1.00 0.00 H new ATOM 0 HE2 HIS C 43 2.732 -14.234 2.140 1.00 0.00 H new ATOM 2298 N ARG C 44 -3.249 -9.617 2.052 1.00 0.00 N ATOM 2299 CA ARG C 44 -4.310 -8.820 2.655 1.00 0.00 C ATOM 2300 C ARG C 44 -4.358 -9.087 4.162 1.00 0.00 C ATOM 2301 O ARG C 44 -3.811 -10.083 4.636 1.00 0.00 O ATOM 2302 CB ARG C 44 -5.637 -9.159 1.978 1.00 0.00 C ATOM 2303 CG ARG C 44 -6.115 -10.555 2.394 1.00 0.00 C ATOM 2304 CD ARG C 44 -7.348 -10.994 1.613 1.00 0.00 C ATOM 2305 NE ARG C 44 -6.981 -11.436 0.266 1.00 0.00 N ATOM 2306 CZ ARG C 44 -7.474 -12.525 -0.328 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -8.434 -13.250 0.240 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -7.011 -12.905 -1.512 1.00 0.00 N ATOM 0 H ARG C 44 -3.588 -10.418 1.519 1.00 0.00 H new ATOM 0 HA ARG C 44 -4.116 -7.757 2.511 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -6.388 -8.417 2.247 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -5.520 -9.117 0.895 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -5.312 -11.275 2.237 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -6.342 -10.558 3.460 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -7.850 -11.804 2.142 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -8.056 -10.168 1.549 1.00 0.00 H new ATOM 0 HE ARG C 44 -6.305 -10.875 -0.252 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -8.809 -12.977 1.149 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -8.795 -14.078 -0.233 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -6.277 -12.365 -1.970 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -7.389 -13.737 -1.964 1.00 0.00 H new ATOM 2322 N GLU C 45 -5.005 -8.207 4.925 1.00 0.00 N ATOM 2323 CA GLU C 45 -5.036 -8.332 6.382 1.00 0.00 C ATOM 2324 C GLU C 45 -5.887 -9.506 6.840 1.00 0.00 C ATOM 2325 O GLU C 45 -5.520 -10.199 7.788 1.00 0.00 O ATOM 2326 CB GLU C 45 -5.637 -7.059 6.970 1.00 0.00 C ATOM 2327 CG GLU C 45 -4.630 -5.917 6.939 1.00 0.00 C ATOM 2328 CD GLU C 45 -3.690 -5.977 8.139 1.00 0.00 C ATOM 2329 OE1 GLU C 45 -2.672 -6.701 8.046 1.00 0.00 O ATOM 2330 OE2 GLU C 45 -3.998 -5.302 9.146 1.00 0.00 O ATOM 0 H GLU C 45 -5.514 -7.402 4.560 1.00 0.00 H new ATOM 0 HA GLU C 45 -4.013 -8.494 6.722 1.00 0.00 H new ATOM 0 HB2 GLU C 45 -6.528 -6.779 6.407 1.00 0.00 H new ATOM 0 HB3 GLU C 45 -5.953 -7.242 7.997 1.00 0.00 H new ATOM 0 HG2 GLU C 45 -4.050 -5.965 6.017 1.00 0.00 H new ATOM 0 HG3 GLU C 45 -5.158 -4.963 6.935 1.00 0.00 H new ATOM 2337 N GLU C 46 -7.023 -9.732 6.179 1.00 0.00 N ATOM 2338 CA GLU C 46 -7.928 -10.817 6.546 1.00 0.00 C ATOM 2339 C GLU C 46 -7.353 -12.198 6.213 1.00 0.00 C ATOM 2340 O GLU C 46 -8.048 -13.203 6.365 1.00 0.00 O ATOM 2341 CB GLU C 46 -9.318 -10.612 5.929 1.00 0.00 C ATOM 2342 CG GLU C 46 -9.314 -10.537 4.404 1.00 0.00 C ATOM 2343 CD GLU C 46 -9.232 -9.094 3.904 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -8.136 -8.501 3.997 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -10.272 -8.588 3.434 1.00 0.00 O ATOM 0 H GLU C 46 -7.337 -9.175 5.384 1.00 0.00 H new ATOM 0 HA GLU C 46 -8.039 -10.787 7.630 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -9.967 -11.430 6.241 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -9.749 -9.693 6.327 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -8.469 -11.105 4.015 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -10.218 -11.005 4.015 1.00 0.00 H new ATOM 2352 N ILE C 47 -6.096 -12.266 5.760 1.00 0.00 N ATOM 2353 CA ILE C 47 -5.416 -13.532 5.518 1.00 0.00 C ATOM 2354 C ILE C 47 -4.011 -13.506 6.113 1.00 0.00 C ATOM 2355 O ILE C 47 -3.481 -14.556 6.464 1.00 0.00 O ATOM 2356 CB ILE C 47 -5.389 -13.855 4.012 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -6.767 -14.386 3.600 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -4.301 -14.877 3.660 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -6.733 -15.048 2.221 1.00 0.00 C ATOM 0 H ILE C 47 -5.528 -11.445 5.553 1.00 0.00 H new ATOM 0 HA ILE C 47 -5.971 -14.328 6.014 1.00 0.00 H new ATOM 0 HB ILE C 47 -5.154 -12.941 3.466 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -7.115 -15.106 4.340 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.485 -13.566 3.592 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -4.320 -15.074 2.588 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -3.325 -14.480 3.939 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -4.484 -15.805 4.202 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.729 -15.411 1.967 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -6.411 -14.321 1.476 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -6.035 -15.885 2.236 1.00 0.00 H new ATOM 2371 N TYR C 48 -3.374 -12.342 6.247 1.00 0.00 N ATOM 2372 CA TYR C 48 -2.026 -12.337 6.792 1.00 0.00 C ATOM 2373 C TYR C 48 -2.051 -12.841 8.230 1.00 0.00 C ATOM 2374 O TYR C 48 -1.111 -13.489 8.689 1.00 0.00 O ATOM 2375 CB TYR C 48 -1.434 -10.934 6.738 1.00 0.00 C ATOM 2376 CG TYR C 48 -0.032 -10.940 7.295 1.00 0.00 C ATOM 2377 CD1 TYR C 48 1.053 -11.238 6.457 1.00 0.00 C ATOM 2378 CD2 TYR C 48 0.176 -10.669 8.654 1.00 0.00 C ATOM 2379 CE1 TYR C 48 2.350 -11.282 6.980 1.00 0.00 C ATOM 2380 CE2 TYR C 48 1.475 -10.707 9.184 1.00 0.00 C ATOM 2381 CZ TYR C 48 2.570 -11.004 8.344 1.00 0.00 C ATOM 2382 OH TYR C 48 3.833 -11.025 8.855 1.00 0.00 O ATOM 0 H TYR C 48 -3.754 -11.429 5.996 1.00 0.00 H new ATOM 0 HA TYR C 48 -1.401 -12.998 6.191 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -1.423 -10.575 5.709 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -2.057 -10.246 7.309 1.00 0.00 H new ATOM 0 HD1 TYR C 48 0.887 -11.433 5.408 1.00 0.00 H new ATOM 0 HD2 TYR C 48 -0.662 -10.431 9.293 1.00 0.00 H new ATOM 0 HE1 TYR C 48 3.183 -11.529 6.338 1.00 0.00 H new ATOM 0 HE2 TYR C 48 1.637 -10.509 10.233 1.00 0.00 H new ATOM 0 HH TYR C 48 4.478 -10.835 8.142 1.00 0.00 H new ATOM 2392 N GLN C 49 -3.138 -12.543 8.941 1.00 0.00 N ATOM 2393 CA GLN C 49 -3.283 -12.914 10.337 1.00 0.00 C ATOM 2394 C GLN C 49 -3.585 -14.402 10.487 1.00 0.00 C ATOM 2395 O GLN C 49 -3.483 -14.938 11.591 1.00 0.00 O ATOM 2396 CB GLN C 49 -4.395 -12.063 10.947 1.00 0.00 C ATOM 2397 CG GLN C 49 -4.046 -10.588 10.742 1.00 0.00 C ATOM 2398 CD GLN C 49 -5.099 -9.669 11.348 1.00 0.00 C ATOM 2399 OE1 GLN C 49 -5.164 -9.493 12.561 1.00 0.00 O ATOM 2400 NE2 GLN C 49 -5.932 -9.076 10.495 1.00 0.00 N ATOM 0 H GLN C 49 -3.939 -12.038 8.561 1.00 0.00 H new ATOM 0 HA GLN C 49 -2.346 -12.730 10.863 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -5.351 -12.295 10.477 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -4.501 -12.283 12.009 1.00 0.00 H new ATOM 0 HG2 GLN C 49 -3.076 -10.378 11.193 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -3.953 -10.381 9.676 1.00 0.00 H new ATOM 0 HE21 GLN C 49 -5.845 -9.249 9.494 1.00 0.00 H new ATOM 0 HE22 GLN C 49 -6.657 -8.449 10.843 1.00 0.00 H new ATOM 2409 N ARG C 50 -3.952 -15.070 9.384 1.00 0.00 N ATOM 2410 CA ARG C 50 -4.199 -16.507 9.396 1.00 0.00 C ATOM 2411 C ARG C 50 -2.931 -17.265 8.998 1.00 0.00 C ATOM 2412 O ARG C 50 -2.738 -18.400 9.420 1.00 0.00 O ATOM 2413 CB ARG C 50 -5.406 -16.850 8.507 1.00 0.00 C ATOM 2414 CG ARG C 50 -5.025 -17.342 7.108 1.00 0.00 C ATOM 2415 CD ARG C 50 -6.266 -17.444 6.221 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.180 -18.485 6.703 1.00 0.00 N ATOM 2417 CZ ARG C 50 -8.361 -18.750 6.139 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -8.780 -18.067 5.074 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -9.132 -19.710 6.636 1.00 0.00 N ATOM 0 H ARG C 50 -4.083 -14.631 8.473 1.00 0.00 H new ATOM 0 HA ARG C 50 -4.454 -16.826 10.407 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -6.003 -17.617 9.001 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -6.037 -15.967 8.412 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -4.305 -16.658 6.659 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -4.539 -18.315 7.178 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -6.782 -16.484 6.202 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -5.967 -17.665 5.197 1.00 0.00 H new ATOM 0 HE ARG C 50 -6.898 -19.037 7.513 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -8.196 -17.330 4.679 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -9.685 -18.281 4.654 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -8.822 -20.244 7.448 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -10.034 -19.913 6.206 1.00 0.00 H new ATOM 2433 N ILE C 51 -2.068 -16.637 8.191 1.00 0.00 N ATOM 2434 CA ILE C 51 -0.774 -17.193 7.815 1.00 0.00 C ATOM 2435 C ILE C 51 0.129 -17.193 9.037 1.00 0.00 C ATOM 2436 O ILE C 51 0.764 -18.193 9.358 1.00 0.00 O ATOM 2437 CB ILE C 51 -0.167 -16.334 6.701 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -1.013 -16.459 5.434 1.00 0.00 C ATOM 2439 CG2 ILE C 51 1.272 -16.741 6.375 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -0.609 -15.396 4.423 1.00 0.00 C ATOM 0 H ILE C 51 -2.254 -15.722 7.780 1.00 0.00 H new ATOM 0 HA ILE C 51 -0.885 -18.215 7.452 1.00 0.00 H new ATOM 0 HB ILE C 51 -0.156 -15.304 7.058 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -0.886 -17.451 5.000 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -2.069 -16.353 5.682 1.00 0.00 H new ATOM 0 HG21 ILE C 51 1.659 -16.104 5.580 1.00 0.00 H new ATOM 0 HG22 ILE C 51 1.892 -16.629 7.264 1.00 0.00 H new ATOM 0 HG23 ILE C 51 1.291 -17.781 6.048 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -1.219 -15.497 3.526 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -0.760 -14.407 4.855 1.00 0.00 H new ATOM 0 HD13 ILE C 51 0.442 -15.522 4.163 1.00 0.00 H new ATOM 2452 N GLN C 52 0.184 -16.052 9.728 1.00 0.00 N ATOM 2453 CA GLN C 52 1.034 -15.883 10.893 1.00 0.00 C ATOM 2454 C GLN C 52 0.451 -16.595 12.114 1.00 0.00 C ATOM 2455 O GLN C 52 0.988 -16.470 13.211 1.00 0.00 O ATOM 2456 CB GLN C 52 1.276 -14.390 11.130 1.00 0.00 C ATOM 2457 CG GLN C 52 2.018 -13.803 9.932 1.00 0.00 C ATOM 2458 CD GLN C 52 3.258 -14.616 9.581 1.00 0.00 C ATOM 2459 OE1 GLN C 52 4.220 -14.669 10.342 1.00 0.00 O ATOM 2460 NE2 GLN C 52 3.236 -15.259 8.419 1.00 0.00 N ATOM 0 H GLN C 52 -0.362 -15.224 9.490 1.00 0.00 H new ATOM 0 HA GLN C 52 2.001 -16.353 10.712 1.00 0.00 H new ATOM 0 HB2 GLN C 52 0.326 -13.874 11.273 1.00 0.00 H new ATOM 0 HB3 GLN C 52 1.858 -14.244 12.040 1.00 0.00 H new ATOM 0 HG2 GLN C 52 1.350 -13.769 9.071 1.00 0.00 H new ATOM 0 HG3 GLN C 52 2.307 -12.775 10.151 1.00 0.00 H new ATOM 0 HE21 GLN C 52 2.418 -15.190 7.814 1.00 0.00 H new ATOM 0 HE22 GLN C 52 4.037 -15.821 8.132 1.00 0.00 H new ATOM 2469 N ALA C 53 -0.646 -17.340 11.930 1.00 0.00 N ATOM 2470 CA ALA C 53 -1.239 -18.107 13.007 1.00 0.00 C ATOM 2471 C ALA C 53 -0.403 -19.346 13.339 1.00 0.00 C ATOM 2472 O ALA C 53 -0.564 -19.921 14.416 1.00 0.00 O ATOM 2473 CB ALA C 53 -2.660 -18.519 12.616 1.00 0.00 C ATOM 0 H ALA C 53 -1.135 -17.421 11.038 1.00 0.00 H new ATOM 0 HA ALA C 53 -1.269 -17.481 13.899 1.00 0.00 H new ATOM 0 HB1 ALA C 53 -3.107 -19.096 13.425 1.00 0.00 H new ATOM 0 HB2 ALA C 53 -3.260 -17.628 12.432 1.00 0.00 H new ATOM 0 HB3 ALA C 53 -2.627 -19.127 11.712 1.00 0.00 H new ATOM 2479 N GLY C 54 0.483 -19.763 12.426 1.00 0.00 N ATOM 2480 CA GLY C 54 1.339 -20.924 12.638 1.00 0.00 C ATOM 2481 C GLY C 54 1.367 -21.850 11.425 1.00 0.00 C ATOM 2482 O GLY C 54 1.770 -23.008 11.546 1.00 0.00 O ATOM 0 H GLY C 54 0.622 -19.304 11.526 1.00 0.00 H new ATOM 0 HA2 GLY C 54 2.352 -20.590 12.861 1.00 0.00 H new ATOM 0 HA3 GLY C 54 0.987 -21.478 13.508 1.00 0.00 H new ATOM 2486 N LEU C 55 0.946 -21.352 10.260 1.00 0.00 N ATOM 2487 CA LEU C 55 0.787 -22.143 9.051 1.00 0.00 C ATOM 2488 C LEU C 55 1.260 -21.359 7.824 1.00 0.00 C ATOM 2489 O LEU C 55 1.828 -20.279 7.956 1.00 0.00 O ATOM 2490 CB LEU C 55 -0.682 -22.576 8.949 1.00 0.00 C ATOM 2491 CG LEU C 55 -1.670 -21.395 8.953 1.00 0.00 C ATOM 2492 CD1 LEU C 55 -1.770 -20.729 7.583 1.00 0.00 C ATOM 2493 CD2 LEU C 55 -3.053 -21.911 9.324 1.00 0.00 C ATOM 0 H LEU C 55 0.703 -20.369 10.135 1.00 0.00 H new ATOM 0 HA LEU C 55 1.409 -23.037 9.093 1.00 0.00 H new ATOM 0 HB2 LEU C 55 -0.820 -23.153 8.034 1.00 0.00 H new ATOM 0 HB3 LEU C 55 -0.916 -23.239 9.782 1.00 0.00 H new ATOM 0 HG LEU C 55 -1.306 -20.661 9.672 1.00 0.00 H new ATOM 0 HD11 LEU C 55 -2.478 -19.901 7.632 1.00 0.00 H new ATOM 0 HD12 LEU C 55 -0.790 -20.352 7.289 1.00 0.00 H new ATOM 0 HD13 LEU C 55 -2.114 -21.457 6.849 1.00 0.00 H new ATOM 0 HD21 LEU C 55 -3.761 -21.082 9.330 1.00 0.00 H new ATOM 0 HD22 LEU C 55 -3.372 -22.655 8.594 1.00 0.00 H new ATOM 0 HD23 LEU C 55 -3.018 -22.365 10.314 1.00 0.00 H new ATOM 2505 N THR C 56 1.028 -21.898 6.625 1.00 0.00 N ATOM 2506 CA THR C 56 1.415 -21.238 5.385 1.00 0.00 C ATOM 2507 C THR C 56 0.328 -21.408 4.327 1.00 0.00 C ATOM 2508 O THR C 56 -0.655 -22.116 4.545 1.00 0.00 O ATOM 2509 CB THR C 56 2.755 -21.794 4.890 1.00 0.00 C ATOM 2510 OG1 THR C 56 2.661 -23.190 4.713 1.00 0.00 O ATOM 2511 CG2 THR C 56 3.858 -21.497 5.903 1.00 0.00 C ATOM 0 H THR C 56 0.569 -22.799 6.491 1.00 0.00 H new ATOM 0 HA THR C 56 1.534 -20.171 5.575 1.00 0.00 H new ATOM 0 HB THR C 56 2.996 -21.317 3.940 1.00 0.00 H new ATOM 0 HG1 THR C 56 3.520 -23.538 4.395 1.00 0.00 H new ATOM 0 HG21 THR C 56 4.804 -21.897 5.539 1.00 0.00 H new ATOM 0 HG22 THR C 56 3.948 -20.419 6.037 1.00 0.00 H new ATOM 0 HG23 THR C 56 3.611 -21.962 6.857 1.00 0.00 H new ATOM 2519 N ALA C 57 0.511 -20.756 3.173 1.00 0.00 N ATOM 2520 CA ALA C 57 -0.436 -20.807 2.071 1.00 0.00 C ATOM 2521 C ALA C 57 -0.720 -22.251 1.641 1.00 0.00 C ATOM 2522 O ALA C 57 0.115 -23.135 1.852 1.00 0.00 O ATOM 2523 CB ALA C 57 0.152 -20.016 0.904 1.00 0.00 C ATOM 0 H ALA C 57 1.329 -20.176 2.984 1.00 0.00 H new ATOM 0 HA ALA C 57 -1.384 -20.374 2.390 1.00 0.00 H new ATOM 0 HB1 ALA C 57 -0.541 -20.039 0.063 1.00 0.00 H new ATOM 0 HB2 ALA C 57 0.316 -18.983 1.211 1.00 0.00 H new ATOM 0 HB3 ALA C 57 1.101 -20.461 0.605 1.00 0.00 H new