USER MOD reduce.3.24.130724 H: found=0, std=0, add=935, rem=0, adj=18 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= 0.884 K(o=0.87,f=-1.7) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc= -0.0131 USER MOD Set 2.1: A 13 ASN : amide:sc= -0.0126 K(o=-0.017,f=-0.6) USER MOD Set 2.2: A 19 THR OG1 : rot 180:sc=-0.00425 USER MOD Set 3.1: A 11 SER OG : rot -89:sc= 0.367 USER MOD Set 3.2: A 21 THR OG1 : rot 180:sc= 0.331 USER MOD Single : A 1 MET CE :methyl 179:sc= -0.207 (180deg=-0.217) USER MOD Single : A 1 MET N :NH3+ 158:sc= 0.0012 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.00673 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.515 K(o=-0.51,f=-3.6!) USER MOD Single : A 29 GLN : amide:sc= -0.127 X(o=-0.13,f=-0.06) USER MOD Single : A 35 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 38 LYS NZ :NH3+ 167:sc= -0.0113 (180deg=-0.191) USER MOD Single : A 43 HIS : no HD1:sc= -0.598 X(o=-0.6,f=-0.33) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0.722 K(o=0.72,f=0) USER MOD Single : A 52 GLN : amide:sc= -2.57! K(o=-2.6!,f=-1.4) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl 175:sc= -0.133 (180deg=-0.165) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 11 SER OG : rot 180:sc= -0.187 USER MOD Single : C 21 THR OG1 : rot 180:sc=-0.00617 USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : C 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 35 ASN : amide:sc= -0.0416 K(o=-0.042,f=-1.8!) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HD1:sc= -0.998 X(o=-1,f=-1.2) USER MOD Single : C 48 TYR OH : rot 33:sc= 0.184 USER MOD Single : C 49 GLN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : C 52 GLN : amide:sc= -2.79! K(o=-2.8!,f=-1.2) USER MOD Single : C 56 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.709 -8.111 -10.394 1.00 0.00 N ATOM 2 CA MET A 1 4.127 -7.146 -9.444 1.00 0.00 C ATOM 3 C MET A 1 2.785 -7.659 -8.938 1.00 0.00 C ATOM 4 O MET A 1 1.966 -8.104 -9.739 1.00 0.00 O ATOM 5 CB MET A 1 3.960 -5.776 -10.106 1.00 0.00 C ATOM 6 CG MET A 1 3.822 -4.689 -9.039 1.00 0.00 C ATOM 7 SD MET A 1 3.797 -2.996 -9.679 1.00 0.00 S ATOM 8 CE MET A 1 2.232 -3.043 -10.580 1.00 0.00 C ATOM 0 H1 MET A 1 5.398 -7.626 -11.003 1.00 0.00 H new ATOM 0 H2 MET A 1 5.187 -8.871 -9.868 1.00 0.00 H new ATOM 0 H3 MET A 1 3.954 -8.518 -10.981 1.00 0.00 H new ATOM 0 HA MET A 1 4.804 -7.036 -8.597 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.819 -5.564 -10.743 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.080 -5.779 -10.749 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.904 -4.864 -8.479 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.648 -4.784 -8.335 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.042 -2.069 -11.030 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.285 -3.800 -11.363 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.423 -3.289 -9.892 1.00 0.00 H new ATOM 20 N LEU A 2 2.555 -7.603 -7.621 1.00 0.00 N ATOM 21 CA LEU A 2 1.323 -8.105 -7.023 1.00 0.00 C ATOM 22 C LEU A 2 0.301 -6.966 -6.966 1.00 0.00 C ATOM 23 O LEU A 2 0.632 -5.868 -6.523 1.00 0.00 O ATOM 24 CB LEU A 2 1.669 -8.640 -5.622 1.00 0.00 C ATOM 25 CG LEU A 2 0.715 -9.701 -5.049 1.00 0.00 C ATOM 26 CD1 LEU A 2 0.837 -9.701 -3.528 1.00 0.00 C ATOM 27 CD2 LEU A 2 -0.749 -9.508 -5.420 1.00 0.00 C ATOM 0 H LEU A 2 3.215 -7.211 -6.949 1.00 0.00 H new ATOM 0 HA LEU A 2 0.884 -8.912 -7.609 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.673 -9.063 -5.655 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.700 -7.798 -4.931 1.00 0.00 H new ATOM 0 HG LEU A 2 1.018 -10.650 -5.491 1.00 0.00 H new ATOM 0 HD11 LEU A 2 0.165 -10.450 -3.109 1.00 0.00 H new ATOM 0 HD12 LEU A 2 1.863 -9.936 -3.245 1.00 0.00 H new ATOM 0 HD13 LEU A 2 0.570 -8.717 -3.142 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -1.346 -10.302 -4.972 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -1.094 -8.542 -5.050 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -0.857 -9.541 -6.504 1.00 0.00 H new ATOM 39 N ILE A 3 -0.936 -7.221 -7.405 1.00 0.00 N ATOM 40 CA ILE A 3 -2.009 -6.233 -7.394 1.00 0.00 C ATOM 41 C ILE A 3 -3.149 -6.765 -6.539 1.00 0.00 C ATOM 42 O ILE A 3 -3.361 -7.971 -6.452 1.00 0.00 O ATOM 43 CB ILE A 3 -2.504 -5.934 -8.820 1.00 0.00 C ATOM 44 CG1 ILE A 3 -1.513 -5.042 -9.570 1.00 0.00 C ATOM 45 CG2 ILE A 3 -3.831 -5.167 -8.804 1.00 0.00 C ATOM 46 CD1 ILE A 3 -0.321 -5.810 -10.119 1.00 0.00 C ATOM 0 H ILE A 3 -1.218 -8.127 -7.780 1.00 0.00 H new ATOM 0 HA ILE A 3 -1.633 -5.299 -6.977 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.617 -6.903 -9.307 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -2.029 -4.546 -10.392 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.157 -4.260 -8.899 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -4.151 -4.973 -9.828 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.589 -5.761 -8.293 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -3.698 -4.221 -8.280 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.346 -5.123 -10.640 1.00 0.00 H new ATOM 0 HD12 ILE A 3 0.216 -6.284 -9.297 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.669 -6.575 -10.813 1.00 0.00 H new ATOM 58 N LEU A 4 -3.883 -5.852 -5.901 1.00 0.00 N ATOM 59 CA LEU A 4 -5.012 -6.191 -5.055 1.00 0.00 C ATOM 60 C LEU A 4 -6.103 -5.137 -5.215 1.00 0.00 C ATOM 61 O LEU A 4 -5.842 -4.032 -5.691 1.00 0.00 O ATOM 62 CB LEU A 4 -4.543 -6.270 -3.593 1.00 0.00 C ATOM 63 CG LEU A 4 -3.534 -7.406 -3.357 1.00 0.00 C ATOM 64 CD1 LEU A 4 -2.947 -7.299 -1.952 1.00 0.00 C ATOM 65 CD2 LEU A 4 -4.202 -8.772 -3.474 1.00 0.00 C ATOM 0 H LEU A 4 -3.703 -4.850 -5.962 1.00 0.00 H new ATOM 0 HA LEU A 4 -5.420 -7.159 -5.347 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -4.089 -5.321 -3.309 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.407 -6.416 -2.945 1.00 0.00 H new ATOM 0 HG LEU A 4 -2.756 -7.311 -4.114 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -2.233 -8.107 -1.793 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -2.440 -6.340 -1.842 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -3.748 -7.373 -1.216 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -3.463 -9.554 -3.302 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -4.996 -8.853 -2.732 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -4.625 -8.886 -4.472 1.00 0.00 H new ATOM 77 N THR A 5 -7.326 -5.485 -4.817 1.00 0.00 N ATOM 78 CA THR A 5 -8.474 -4.595 -4.912 1.00 0.00 C ATOM 79 C THR A 5 -9.153 -4.551 -3.555 1.00 0.00 C ATOM 80 O THR A 5 -9.513 -5.590 -3.004 1.00 0.00 O ATOM 81 CB THR A 5 -9.429 -5.097 -5.999 1.00 0.00 C ATOM 82 OG1 THR A 5 -8.752 -5.128 -7.235 1.00 0.00 O ATOM 83 CG2 THR A 5 -10.649 -4.189 -6.147 1.00 0.00 C ATOM 0 H THR A 5 -7.546 -6.398 -4.418 1.00 0.00 H new ATOM 0 HA THR A 5 -8.162 -3.588 -5.188 1.00 0.00 H new ATOM 0 HB THR A 5 -9.766 -6.092 -5.707 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.360 -5.451 -7.933 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.301 -4.580 -6.928 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.193 -4.154 -5.203 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.324 -3.184 -6.415 1.00 0.00 H new ATOM 91 N ARG A 6 -9.324 -3.342 -3.019 1.00 0.00 N ATOM 92 CA ARG A 6 -9.868 -3.121 -1.687 1.00 0.00 C ATOM 93 C ARG A 6 -10.677 -1.829 -1.691 1.00 0.00 C ATOM 94 O ARG A 6 -10.704 -1.120 -2.700 1.00 0.00 O ATOM 95 CB ARG A 6 -8.726 -3.057 -0.660 1.00 0.00 C ATOM 96 CG ARG A 6 -7.966 -4.379 -0.538 1.00 0.00 C ATOM 97 CD ARG A 6 -8.837 -5.537 -0.033 1.00 0.00 C ATOM 98 NE ARG A 6 -8.971 -5.528 1.427 1.00 0.00 N ATOM 99 CZ ARG A 6 -9.698 -6.420 2.106 1.00 0.00 C ATOM 100 NH1 ARG A 6 -10.367 -7.379 1.469 1.00 0.00 N ATOM 101 NH2 ARG A 6 -9.758 -6.351 3.428 1.00 0.00 N ATOM 0 H ARG A 6 -9.084 -2.480 -3.508 1.00 0.00 H new ATOM 0 HA ARG A 6 -10.523 -3.946 -1.408 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -8.030 -2.268 -0.945 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -9.134 -2.786 0.314 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -7.552 -4.643 -1.511 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -7.124 -4.244 0.141 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -9.825 -5.472 -0.488 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -8.401 -6.484 -0.351 1.00 0.00 H new ATOM 0 HE ARG A 6 -8.483 -4.802 1.952 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -10.328 -7.439 0.451 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -10.919 -8.054 1.999 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -9.250 -5.619 3.924 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -10.312 -7.030 3.950 1.00 0.00 H new ATOM 115 N LYS A 7 -11.332 -1.517 -0.577 1.00 0.00 N ATOM 116 CA LYS A 7 -12.196 -0.350 -0.482 1.00 0.00 C ATOM 117 C LYS A 7 -11.751 0.557 0.649 1.00 0.00 C ATOM 118 O LYS A 7 -10.932 0.173 1.482 1.00 0.00 O ATOM 119 CB LYS A 7 -13.649 -0.793 -0.273 1.00 0.00 C ATOM 120 CG LYS A 7 -14.055 -1.926 -1.219 1.00 0.00 C ATOM 121 CD LYS A 7 -15.577 -2.047 -1.212 1.00 0.00 C ATOM 122 CE LYS A 7 -16.034 -3.370 -1.824 1.00 0.00 C ATOM 123 NZ LYS A 7 -17.499 -3.508 -1.720 1.00 0.00 N ATOM 0 H LYS A 7 -11.278 -2.065 0.281 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.127 0.212 -1.413 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -13.782 -1.119 0.758 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.311 0.059 -0.426 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -13.697 -1.723 -2.228 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -13.600 -2.864 -0.902 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -15.945 -1.972 -0.189 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -16.012 -1.217 -1.769 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -15.732 -3.417 -2.870 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -15.547 -4.201 -1.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -17.793 -4.413 -2.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -17.780 -3.484 -0.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -17.958 -2.725 -2.227 1.00 0.00 H new ATOM 137 N VAL A 8 -12.302 1.771 0.676 1.00 0.00 N ATOM 138 CA VAL A 8 -11.984 2.771 1.684 1.00 0.00 C ATOM 139 C VAL A 8 -12.124 2.180 3.086 1.00 0.00 C ATOM 140 O VAL A 8 -13.225 1.816 3.501 1.00 0.00 O ATOM 141 CB VAL A 8 -12.924 3.967 1.509 1.00 0.00 C ATOM 142 CG1 VAL A 8 -12.659 5.001 2.600 1.00 0.00 C ATOM 143 CG2 VAL A 8 -12.682 4.610 0.141 1.00 0.00 C ATOM 0 H VAL A 8 -12.988 2.086 -0.010 1.00 0.00 H new ATOM 0 HA VAL A 8 -10.952 3.098 1.560 1.00 0.00 H new ATOM 0 HB VAL A 8 -13.956 3.622 1.579 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.331 5.849 2.469 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -12.830 4.550 3.578 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -11.626 5.343 2.534 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.351 5.461 0.016 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.648 4.948 0.076 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.875 3.879 -0.644 1.00 0.00 H new ATOM 153 N GLY A 9 -11.007 2.086 3.807 1.00 0.00 N ATOM 154 CA GLY A 9 -10.985 1.619 5.188 1.00 0.00 C ATOM 155 C GLY A 9 -10.243 0.290 5.344 1.00 0.00 C ATOM 156 O GLY A 9 -9.884 -0.077 6.462 1.00 0.00 O ATOM 0 H GLY A 9 -10.087 2.334 3.444 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -10.510 2.373 5.816 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.008 1.505 5.546 1.00 0.00 H new ATOM 160 N GLU A 10 -10.006 -0.437 4.245 1.00 0.00 N ATOM 161 CA GLU A 10 -9.310 -1.719 4.292 1.00 0.00 C ATOM 162 C GLU A 10 -7.792 -1.515 4.256 1.00 0.00 C ATOM 163 O GLU A 10 -7.316 -0.396 4.062 1.00 0.00 O ATOM 164 CB GLU A 10 -9.777 -2.596 3.129 1.00 0.00 C ATOM 165 CG GLU A 10 -11.251 -2.962 3.317 1.00 0.00 C ATOM 166 CD GLU A 10 -11.776 -3.909 2.239 1.00 0.00 C ATOM 167 OE1 GLU A 10 -11.409 -3.707 1.062 1.00 0.00 O ATOM 168 OE2 GLU A 10 -12.540 -4.833 2.604 1.00 0.00 O ATOM 0 H GLU A 10 -10.290 -0.152 3.308 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.550 -2.222 5.229 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.641 -2.068 2.185 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.172 -3.501 3.078 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.382 -3.426 4.295 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.849 -2.051 3.314 1.00 0.00 H new ATOM 175 N SER A 11 -7.031 -2.598 4.436 1.00 0.00 N ATOM 176 CA SER A 11 -5.579 -2.527 4.556 1.00 0.00 C ATOM 177 C SER A 11 -4.887 -3.678 3.830 1.00 0.00 C ATOM 178 O SER A 11 -5.524 -4.644 3.409 1.00 0.00 O ATOM 179 CB SER A 11 -5.188 -2.567 6.037 1.00 0.00 C ATOM 180 OG SER A 11 -5.755 -1.482 6.741 1.00 0.00 O ATOM 0 H SER A 11 -7.406 -3.544 4.502 1.00 0.00 H new ATOM 0 HA SER A 11 -5.256 -1.593 4.096 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.521 -3.506 6.479 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.102 -2.538 6.131 1.00 0.00 H new ATOM 0 HG SER A 11 -5.145 -0.716 6.708 1.00 0.00 H new ATOM 186 N ILE A 12 -3.565 -3.550 3.695 1.00 0.00 N ATOM 187 CA ILE A 12 -2.669 -4.490 3.037 1.00 0.00 C ATOM 188 C ILE A 12 -1.471 -4.689 3.971 1.00 0.00 C ATOM 189 O ILE A 12 -1.265 -3.875 4.870 1.00 0.00 O ATOM 190 CB ILE A 12 -2.223 -3.902 1.688 1.00 0.00 C ATOM 191 CG1 ILE A 12 -3.409 -3.524 0.792 1.00 0.00 C ATOM 192 CG2 ILE A 12 -1.300 -4.868 0.937 1.00 0.00 C ATOM 193 CD1 ILE A 12 -4.238 -4.727 0.347 1.00 0.00 C ATOM 0 H ILE A 12 -3.068 -2.740 4.065 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.155 -5.446 2.841 1.00 0.00 H new ATOM 0 HB ILE A 12 -1.674 -2.990 1.922 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.053 -2.827 1.328 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.037 -3.002 -0.090 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.002 -4.423 -0.012 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -0.413 -5.066 1.539 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.827 -5.803 0.750 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -5.060 -4.389 -0.284 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.608 -5.415 -0.217 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -4.639 -5.237 1.223 1.00 0.00 H new ATOM 205 N ASN A 13 -0.674 -5.744 3.780 1.00 0.00 N ATOM 206 CA ASN A 13 0.447 -6.013 4.667 1.00 0.00 C ATOM 207 C ASN A 13 1.664 -6.511 3.888 1.00 0.00 C ATOM 208 O ASN A 13 1.521 -7.193 2.873 1.00 0.00 O ATOM 209 CB ASN A 13 -0.002 -7.029 5.721 1.00 0.00 C ATOM 210 CG ASN A 13 0.998 -7.134 6.866 1.00 0.00 C ATOM 211 OD1 ASN A 13 2.069 -7.708 6.715 1.00 0.00 O ATOM 212 ND2 ASN A 13 0.644 -6.575 8.019 1.00 0.00 N ATOM 0 H ASN A 13 -0.788 -6.418 3.023 1.00 0.00 H new ATOM 0 HA ASN A 13 0.754 -5.091 5.161 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -0.976 -6.739 6.114 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.125 -8.007 5.255 1.00 0.00 H new ATOM 0 HD21 ASN A 13 1.274 -6.615 8.820 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.258 -6.106 8.103 1.00 0.00 H new ATOM 219 N ILE A 14 2.859 -6.162 4.373 1.00 0.00 N ATOM 220 CA ILE A 14 4.123 -6.540 3.762 1.00 0.00 C ATOM 221 C ILE A 14 5.121 -6.929 4.853 1.00 0.00 C ATOM 222 O ILE A 14 5.121 -6.360 5.943 1.00 0.00 O ATOM 223 CB ILE A 14 4.678 -5.378 2.915 1.00 0.00 C ATOM 224 CG1 ILE A 14 3.763 -5.009 1.737 1.00 0.00 C ATOM 225 CG2 ILE A 14 6.042 -5.764 2.343 1.00 0.00 C ATOM 226 CD1 ILE A 14 2.750 -3.921 2.098 1.00 0.00 C ATOM 0 H ILE A 14 2.970 -5.599 5.216 1.00 0.00 H new ATOM 0 HA ILE A 14 3.962 -7.394 3.105 1.00 0.00 H new ATOM 0 HB ILE A 14 4.749 -4.517 3.579 1.00 0.00 H new ATOM 0 HG12 ILE A 14 4.373 -4.669 0.900 1.00 0.00 H new ATOM 0 HG13 ILE A 14 3.231 -5.899 1.402 1.00 0.00 H new ATOM 0 HG21 ILE A 14 6.432 -4.941 1.745 1.00 0.00 H new ATOM 0 HG22 ILE A 14 6.732 -5.978 3.160 1.00 0.00 H new ATOM 0 HG23 ILE A 14 5.936 -6.650 1.716 1.00 0.00 H new ATOM 0 HD11 ILE A 14 2.130 -3.699 1.230 1.00 0.00 H new ATOM 0 HD12 ILE A 14 2.119 -4.269 2.916 1.00 0.00 H new ATOM 0 HD13 ILE A 14 3.279 -3.019 2.406 1.00 0.00 H new ATOM 238 N GLY A 15 5.983 -7.906 4.554 1.00 0.00 N ATOM 239 CA GLY A 15 7.012 -8.344 5.481 1.00 0.00 C ATOM 240 C GLY A 15 6.405 -8.817 6.798 1.00 0.00 C ATOM 241 O GLY A 15 5.409 -9.536 6.810 1.00 0.00 O ATOM 0 H GLY A 15 5.981 -8.408 3.666 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.589 -9.153 5.032 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.706 -7.525 5.671 1.00 0.00 H new ATOM 245 N ASP A 16 7.018 -8.397 7.908 1.00 0.00 N ATOM 246 CA ASP A 16 6.556 -8.715 9.256 1.00 0.00 C ATOM 247 C ASP A 16 6.485 -7.443 10.102 1.00 0.00 C ATOM 248 O ASP A 16 6.218 -7.504 11.303 1.00 0.00 O ATOM 249 CB ASP A 16 7.500 -9.761 9.863 1.00 0.00 C ATOM 250 CG ASP A 16 7.028 -10.247 11.232 1.00 0.00 C ATOM 251 OD1 ASP A 16 5.861 -10.690 11.324 1.00 0.00 O ATOM 252 OD2 ASP A 16 7.840 -10.175 12.184 1.00 0.00 O ATOM 0 H ASP A 16 7.859 -7.820 7.892 1.00 0.00 H new ATOM 0 HA ASP A 16 5.550 -9.133 9.227 1.00 0.00 H new ATOM 0 HB2 ASP A 16 7.579 -10.612 9.186 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.499 -9.334 9.956 1.00 0.00 H new ATOM 257 N ASP A 17 6.723 -6.284 9.480 1.00 0.00 N ATOM 258 CA ASP A 17 6.782 -5.007 10.177 1.00 0.00 C ATOM 259 C ASP A 17 6.179 -3.865 9.353 1.00 0.00 C ATOM 260 O ASP A 17 6.353 -2.705 9.713 1.00 0.00 O ATOM 261 CB ASP A 17 8.238 -4.684 10.523 1.00 0.00 C ATOM 262 CG ASP A 17 8.850 -5.707 11.474 1.00 0.00 C ATOM 263 OD1 ASP A 17 8.580 -5.601 12.693 1.00 0.00 O ATOM 264 OD2 ASP A 17 9.588 -6.592 10.980 1.00 0.00 O ATOM 0 H ASP A 17 6.880 -6.211 8.475 1.00 0.00 H new ATOM 0 HA ASP A 17 6.188 -5.098 11.086 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.827 -4.646 9.606 1.00 0.00 H new ATOM 0 HB3 ASP A 17 8.290 -3.694 10.976 1.00 0.00 H new ATOM 269 N ILE A 18 5.477 -4.160 8.250 1.00 0.00 N ATOM 270 CA ILE A 18 4.914 -3.114 7.408 1.00 0.00 C ATOM 271 C ILE A 18 3.440 -3.395 7.121 1.00 0.00 C ATOM 272 O ILE A 18 3.055 -4.528 6.846 1.00 0.00 O ATOM 273 CB ILE A 18 5.706 -3.031 6.095 1.00 0.00 C ATOM 274 CG1 ILE A 18 7.186 -2.735 6.368 1.00 0.00 C ATOM 275 CG2 ILE A 18 5.109 -1.954 5.189 1.00 0.00 C ATOM 276 CD1 ILE A 18 8.018 -2.854 5.090 1.00 0.00 C ATOM 0 H ILE A 18 5.290 -5.110 7.928 1.00 0.00 H new ATOM 0 HA ILE A 18 4.984 -2.160 7.931 1.00 0.00 H new ATOM 0 HB ILE A 18 5.639 -3.995 5.591 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.289 -1.731 6.780 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.566 -3.428 7.118 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.678 -1.903 4.261 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.071 -2.201 4.966 1.00 0.00 H new ATOM 0 HG23 ILE A 18 5.152 -0.989 5.694 1.00 0.00 H new ATOM 0 HD11 ILE A 18 9.063 -2.639 5.315 1.00 0.00 H new ATOM 0 HD12 ILE A 18 7.933 -3.866 4.693 1.00 0.00 H new ATOM 0 HD13 ILE A 18 7.652 -2.142 4.350 1.00 0.00 H new ATOM 288 N THR A 19 2.622 -2.345 7.189 1.00 0.00 N ATOM 289 CA THR A 19 1.198 -2.425 6.896 1.00 0.00 C ATOM 290 C THR A 19 0.778 -1.135 6.196 1.00 0.00 C ATOM 291 O THR A 19 1.352 -0.082 6.455 1.00 0.00 O ATOM 292 CB THR A 19 0.405 -2.623 8.195 1.00 0.00 C ATOM 293 OG1 THR A 19 1.005 -3.616 9.001 1.00 0.00 O ATOM 294 CG2 THR A 19 -1.030 -3.057 7.904 1.00 0.00 C ATOM 0 H THR A 19 2.935 -1.410 7.451 1.00 0.00 H new ATOM 0 HA THR A 19 0.993 -3.276 6.246 1.00 0.00 H new ATOM 0 HB THR A 19 0.403 -1.665 8.716 1.00 0.00 H new ATOM 0 HG1 THR A 19 0.486 -3.727 9.825 1.00 0.00 H new ATOM 0 HG21 THR A 19 -1.568 -3.190 8.843 1.00 0.00 H new ATOM 0 HG22 THR A 19 -1.527 -2.293 7.306 1.00 0.00 H new ATOM 0 HG23 THR A 19 -1.021 -3.999 7.355 1.00 0.00 H new ATOM 302 N ILE A 20 -0.217 -1.215 5.311 1.00 0.00 N ATOM 303 CA ILE A 20 -0.644 -0.094 4.480 1.00 0.00 C ATOM 304 C ILE A 20 -2.170 -0.014 4.499 1.00 0.00 C ATOM 305 O ILE A 20 -2.833 -1.036 4.669 1.00 0.00 O ATOM 306 CB ILE A 20 -0.146 -0.296 3.038 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.325 -0.728 2.960 1.00 0.00 C ATOM 308 CG2 ILE A 20 -0.344 0.986 2.229 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.301 0.350 3.416 1.00 0.00 C ATOM 0 H ILE A 20 -0.752 -2.068 5.151 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.225 0.834 4.869 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.741 -1.107 2.617 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.467 -1.618 3.573 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.559 -1.008 1.933 1.00 0.00 H new ATOM 0 HG21 ILE A 20 0.012 0.832 1.210 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.403 1.243 2.209 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.218 1.798 2.691 1.00 0.00 H new ATOM 0 HD11 ILE A 20 3.321 -0.025 3.334 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.187 1.233 2.788 1.00 0.00 H new ATOM 0 HD13 ILE A 20 2.094 0.614 4.453 1.00 0.00 H new ATOM 321 N THR A 21 -2.735 1.184 4.326 1.00 0.00 N ATOM 322 CA THR A 21 -4.179 1.377 4.408 1.00 0.00 C ATOM 323 C THR A 21 -4.642 2.398 3.374 1.00 0.00 C ATOM 324 O THR A 21 -3.880 3.274 2.973 1.00 0.00 O ATOM 325 CB THR A 21 -4.539 1.850 5.824 1.00 0.00 C ATOM 326 OG1 THR A 21 -3.965 0.985 6.781 1.00 0.00 O ATOM 327 CG2 THR A 21 -6.047 1.869 6.066 1.00 0.00 C ATOM 0 H THR A 21 -2.209 2.035 4.128 1.00 0.00 H new ATOM 0 HA THR A 21 -4.683 0.434 4.198 1.00 0.00 H new ATOM 0 HB THR A 21 -4.152 2.865 5.920 1.00 0.00 H new ATOM 0 HG1 THR A 21 -4.197 1.293 7.682 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.248 2.211 7.081 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.521 2.545 5.355 1.00 0.00 H new ATOM 0 HG23 THR A 21 -6.449 0.864 5.935 1.00 0.00 H new ATOM 335 N ILE A 22 -5.903 2.283 2.944 1.00 0.00 N ATOM 336 CA ILE A 22 -6.520 3.207 2.004 1.00 0.00 C ATOM 337 C ILE A 22 -7.558 4.025 2.766 1.00 0.00 C ATOM 338 O ILE A 22 -8.688 3.586 2.972 1.00 0.00 O ATOM 339 CB ILE A 22 -7.088 2.434 0.797 1.00 0.00 C ATOM 340 CG1 ILE A 22 -7.971 3.308 -0.099 1.00 0.00 C ATOM 341 CG2 ILE A 22 -7.899 1.200 1.215 1.00 0.00 C ATOM 342 CD1 ILE A 22 -7.199 4.494 -0.666 1.00 0.00 C ATOM 0 H ILE A 22 -6.526 1.534 3.246 1.00 0.00 H new ATOM 0 HA ILE A 22 -5.795 3.903 1.583 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.210 2.115 0.236 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.367 2.707 -0.917 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -8.825 3.670 0.473 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -8.275 0.694 0.326 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.261 0.519 1.778 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -8.738 1.510 1.838 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.859 5.090 -1.296 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -6.825 5.109 0.152 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.360 4.132 -1.260 1.00 0.00 H new ATOM 354 N LEU A 23 -7.164 5.228 3.195 1.00 0.00 N ATOM 355 CA LEU A 23 -7.990 6.024 4.090 1.00 0.00 C ATOM 356 C LEU A 23 -9.191 6.622 3.366 1.00 0.00 C ATOM 357 O LEU A 23 -10.227 6.866 3.982 1.00 0.00 O ATOM 358 CB LEU A 23 -7.156 7.150 4.697 1.00 0.00 C ATOM 359 CG LEU A 23 -5.870 6.662 5.369 1.00 0.00 C ATOM 360 CD1 LEU A 23 -5.294 7.817 6.168 1.00 0.00 C ATOM 361 CD2 LEU A 23 -6.105 5.462 6.279 1.00 0.00 C ATOM 0 H LEU A 23 -6.280 5.665 2.935 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.359 5.364 4.875 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -6.899 7.864 3.914 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.760 7.684 5.430 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.176 6.332 4.596 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.375 7.497 6.659 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -5.077 8.650 5.499 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.016 8.134 6.921 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.161 5.157 6.730 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -6.811 5.733 7.064 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.512 4.636 5.695 1.00 0.00 H new ATOM 373 N GLY A 24 -9.056 6.862 2.061 1.00 0.00 N ATOM 374 CA GLY A 24 -10.173 7.336 1.258 1.00 0.00 C ATOM 375 C GLY A 24 -9.756 7.764 -0.142 1.00 0.00 C ATOM 376 O GLY A 24 -8.612 7.579 -0.553 1.00 0.00 O ATOM 0 H GLY A 24 -8.186 6.735 1.544 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -10.921 6.547 1.184 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -10.646 8.177 1.764 1.00 0.00 H new ATOM 380 N VAL A 25 -10.711 8.344 -0.873 1.00 0.00 N ATOM 381 CA VAL A 25 -10.530 8.765 -2.255 1.00 0.00 C ATOM 382 C VAL A 25 -11.162 10.141 -2.467 1.00 0.00 C ATOM 383 O VAL A 25 -12.082 10.529 -1.747 1.00 0.00 O ATOM 384 CB VAL A 25 -11.135 7.697 -3.183 1.00 0.00 C ATOM 385 CG1 VAL A 25 -12.638 7.529 -2.945 1.00 0.00 C ATOM 386 CG2 VAL A 25 -10.916 8.037 -4.654 1.00 0.00 C ATOM 0 H VAL A 25 -11.645 8.535 -0.511 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.470 8.860 -2.491 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.621 6.765 -2.946 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -13.030 6.767 -3.618 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.811 7.225 -1.913 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -13.144 8.475 -3.134 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -11.357 7.259 -5.277 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.387 8.994 -4.880 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -9.847 8.102 -4.857 1.00 0.00 H new ATOM 396 N SER A 26 -10.660 10.869 -3.465 1.00 0.00 N ATOM 397 CA SER A 26 -11.074 12.233 -3.775 1.00 0.00 C ATOM 398 C SER A 26 -10.993 12.437 -5.284 1.00 0.00 C ATOM 399 O SER A 26 -10.254 13.295 -5.767 1.00 0.00 O ATOM 400 CB SER A 26 -10.170 13.222 -3.037 1.00 0.00 C ATOM 401 OG SER A 26 -10.262 13.033 -1.643 1.00 0.00 O ATOM 0 H SER A 26 -9.938 10.516 -4.093 1.00 0.00 H new ATOM 0 HA SER A 26 -12.100 12.404 -3.449 1.00 0.00 H new ATOM 0 HB2 SER A 26 -9.137 13.090 -3.360 1.00 0.00 H new ATOM 0 HB3 SER A 26 -10.455 14.243 -3.291 1.00 0.00 H new ATOM 0 HG SER A 26 -9.676 13.673 -1.187 1.00 0.00 H new ATOM 407 N GLY A 27 -11.766 11.642 -6.033 1.00 0.00 N ATOM 408 CA GLY A 27 -11.741 11.704 -7.483 1.00 0.00 C ATOM 409 C GLY A 27 -10.469 11.042 -7.993 1.00 0.00 C ATOM 410 O GLY A 27 -10.163 9.915 -7.607 1.00 0.00 O ATOM 0 H GLY A 27 -12.413 10.952 -5.651 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -12.616 11.202 -7.895 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -11.783 12.741 -7.815 1.00 0.00 H new ATOM 414 N GLN A 28 -9.730 11.747 -8.854 1.00 0.00 N ATOM 415 CA GLN A 28 -8.466 11.249 -9.370 1.00 0.00 C ATOM 416 C GLN A 28 -7.396 11.244 -8.269 1.00 0.00 C ATOM 417 O GLN A 28 -6.322 10.672 -8.460 1.00 0.00 O ATOM 418 CB GLN A 28 -8.043 12.144 -10.542 1.00 0.00 C ATOM 419 CG GLN A 28 -6.905 11.565 -11.392 1.00 0.00 C ATOM 420 CD GLN A 28 -7.335 10.374 -12.239 1.00 0.00 C ATOM 421 OE1 GLN A 28 -8.365 9.750 -11.992 1.00 0.00 O ATOM 422 NE2 GLN A 28 -6.543 10.044 -13.257 1.00 0.00 N ATOM 0 H GLN A 28 -9.993 12.668 -9.206 1.00 0.00 H new ATOM 0 HA GLN A 28 -8.581 10.221 -9.713 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -8.908 12.319 -11.182 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -7.734 13.114 -10.152 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -6.515 12.345 -12.045 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -6.089 11.261 -10.736 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -5.694 10.580 -13.438 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -6.785 9.255 -13.856 1.00 0.00 H new ATOM 431 N GLN A 29 -7.676 11.869 -7.118 1.00 0.00 N ATOM 432 CA GLN A 29 -6.742 11.892 -6.001 1.00 0.00 C ATOM 433 C GLN A 29 -7.148 10.854 -4.956 1.00 0.00 C ATOM 434 O GLN A 29 -8.289 10.388 -4.933 1.00 0.00 O ATOM 435 CB GLN A 29 -6.690 13.280 -5.364 1.00 0.00 C ATOM 436 CG GLN A 29 -6.368 14.363 -6.397 1.00 0.00 C ATOM 437 CD GLN A 29 -6.158 15.715 -5.729 1.00 0.00 C ATOM 438 OE1 GLN A 29 -6.853 16.680 -6.029 1.00 0.00 O ATOM 439 NE2 GLN A 29 -5.193 15.796 -4.815 1.00 0.00 N ATOM 0 H GLN A 29 -8.549 12.366 -6.942 1.00 0.00 H new ATOM 0 HA GLN A 29 -5.749 11.650 -6.380 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.647 13.500 -4.892 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -5.936 13.292 -4.577 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.472 14.085 -6.952 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.181 14.434 -7.119 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.634 14.973 -4.590 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.013 16.681 -4.340 1.00 0.00 H new ATOM 448 N VAL A 30 -6.198 10.495 -4.087 1.00 0.00 N ATOM 449 CA VAL A 30 -6.361 9.434 -3.100 1.00 0.00 C ATOM 450 C VAL A 30 -5.533 9.754 -1.857 1.00 0.00 C ATOM 451 O VAL A 30 -4.483 10.383 -1.969 1.00 0.00 O ATOM 452 CB VAL A 30 -5.863 8.120 -3.727 1.00 0.00 C ATOM 453 CG1 VAL A 30 -5.780 6.992 -2.703 1.00 0.00 C ATOM 454 CG2 VAL A 30 -6.778 7.652 -4.858 1.00 0.00 C ATOM 0 H VAL A 30 -5.282 10.943 -4.053 1.00 0.00 H new ATOM 0 HA VAL A 30 -7.408 9.345 -2.810 1.00 0.00 H new ATOM 0 HB VAL A 30 -4.868 8.340 -4.115 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.424 6.084 -3.190 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -5.089 7.272 -1.908 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.768 6.813 -2.278 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.394 6.721 -5.276 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -7.783 7.487 -4.469 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -6.811 8.413 -5.638 1.00 0.00 H new ATOM 464 N ARG A 31 -5.996 9.327 -0.674 1.00 0.00 N ATOM 465 CA ARG A 31 -5.199 9.406 0.544 1.00 0.00 C ATOM 466 C ARG A 31 -5.014 8.000 1.095 1.00 0.00 C ATOM 467 O ARG A 31 -5.963 7.226 1.234 1.00 0.00 O ATOM 468 CB ARG A 31 -5.820 10.341 1.594 1.00 0.00 C ATOM 469 CG ARG A 31 -5.027 10.211 2.904 1.00 0.00 C ATOM 470 CD ARG A 31 -5.464 11.174 4.009 1.00 0.00 C ATOM 471 NE ARG A 31 -4.940 12.528 3.791 1.00 0.00 N ATOM 472 CZ ARG A 31 -5.417 13.617 4.404 1.00 0.00 C ATOM 473 NH1 ARG A 31 -6.365 13.527 5.330 1.00 0.00 N ATOM 474 NH2 ARG A 31 -4.941 14.814 4.088 1.00 0.00 N ATOM 0 H ARG A 31 -6.923 8.923 -0.541 1.00 0.00 H new ATOM 0 HA ARG A 31 -4.229 9.839 0.299 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -5.799 11.372 1.241 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -6.866 10.082 1.759 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -5.122 9.189 3.272 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.971 10.376 2.692 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -6.553 11.208 4.052 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -5.119 10.801 4.973 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.168 12.645 3.135 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.743 12.615 5.586 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.715 14.370 5.785 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.213 14.902 3.379 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.303 15.646 4.554 1.00 0.00 H new ATOM 488 N ILE A 32 -3.758 7.685 1.406 1.00 0.00 N ATOM 489 CA ILE A 32 -3.317 6.377 1.860 1.00 0.00 C ATOM 490 C ILE A 32 -2.361 6.558 3.028 1.00 0.00 C ATOM 491 O ILE A 32 -1.740 7.610 3.176 1.00 0.00 O ATOM 492 CB ILE A 32 -2.618 5.637 0.709 1.00 0.00 C ATOM 493 CG1 ILE A 32 -1.690 6.586 -0.068 1.00 0.00 C ATOM 494 CG2 ILE A 32 -3.667 5.017 -0.215 1.00 0.00 C ATOM 495 CD1 ILE A 32 -0.949 5.862 -1.189 1.00 0.00 C ATOM 0 H ILE A 32 -2.996 8.361 1.345 1.00 0.00 H new ATOM 0 HA ILE A 32 -4.174 5.786 2.182 1.00 0.00 H new ATOM 0 HB ILE A 32 -2.000 4.840 1.123 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.276 7.404 -0.488 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -0.968 7.030 0.617 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -3.169 4.493 -1.031 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.278 4.313 0.349 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.302 5.803 -0.623 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.304 6.567 -1.714 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -0.343 5.061 -0.766 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -1.670 5.440 -1.889 1.00 0.00 H new ATOM 507 N GLY A 33 -2.245 5.525 3.861 1.00 0.00 N ATOM 508 CA GLY A 33 -1.405 5.577 5.039 1.00 0.00 C ATOM 509 C GLY A 33 -0.431 4.408 5.044 1.00 0.00 C ATOM 510 O GLY A 33 -0.648 3.404 4.374 1.00 0.00 O ATOM 0 H GLY A 33 -2.731 4.637 3.733 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.855 6.518 5.061 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -2.023 5.548 5.936 1.00 0.00 H new ATOM 514 N ILE A 34 0.640 4.562 5.820 1.00 0.00 N ATOM 515 CA ILE A 34 1.710 3.587 5.907 1.00 0.00 C ATOM 516 C ILE A 34 2.048 3.396 7.378 1.00 0.00 C ATOM 517 O ILE A 34 2.137 4.362 8.132 1.00 0.00 O ATOM 518 CB ILE A 34 2.955 4.063 5.142 1.00 0.00 C ATOM 519 CG1 ILE A 34 2.710 4.217 3.635 1.00 0.00 C ATOM 520 CG2 ILE A 34 4.076 3.037 5.326 1.00 0.00 C ATOM 521 CD1 ILE A 34 2.191 5.606 3.261 1.00 0.00 C ATOM 0 H ILE A 34 0.785 5.380 6.411 1.00 0.00 H new ATOM 0 HA ILE A 34 1.387 2.648 5.458 1.00 0.00 H new ATOM 0 HB ILE A 34 3.219 5.040 5.546 1.00 0.00 H new ATOM 0 HG12 ILE A 34 3.639 4.024 3.098 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.991 3.465 3.309 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.964 3.367 4.786 1.00 0.00 H new ATOM 0 HG22 ILE A 34 4.311 2.941 6.386 1.00 0.00 H new ATOM 0 HG23 ILE A 34 3.753 2.071 4.937 1.00 0.00 H new ATOM 0 HD11 ILE A 34 2.035 5.658 2.183 1.00 0.00 H new ATOM 0 HD12 ILE A 34 1.247 5.792 3.773 1.00 0.00 H new ATOM 0 HD13 ILE A 34 2.920 6.359 3.559 1.00 0.00 H new ATOM 533 N ASN A 35 2.237 2.140 7.776 1.00 0.00 N ATOM 534 CA ASN A 35 2.483 1.780 9.157 1.00 0.00 C ATOM 535 C ASN A 35 3.695 0.858 9.229 1.00 0.00 C ATOM 536 O ASN A 35 3.590 -0.352 9.430 1.00 0.00 O ATOM 537 CB ASN A 35 1.221 1.168 9.751 1.00 0.00 C ATOM 538 CG ASN A 35 1.195 1.278 11.267 1.00 0.00 C ATOM 539 OD1 ASN A 35 2.208 1.096 11.933 1.00 0.00 O ATOM 540 ND2 ASN A 35 0.021 1.578 11.822 1.00 0.00 N ATOM 0 H ASN A 35 2.222 1.343 7.139 1.00 0.00 H new ATOM 0 HA ASN A 35 2.719 2.659 9.756 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.346 1.668 9.336 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.156 0.119 9.462 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -0.057 1.664 12.835 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -0.799 1.722 11.233 1.00 0.00 H new ATOM 547 N ALA A 36 4.852 1.486 9.052 1.00 0.00 N ATOM 548 CA ALA A 36 6.165 0.878 9.146 1.00 0.00 C ATOM 549 C ALA A 36 6.928 1.583 10.262 1.00 0.00 C ATOM 550 O ALA A 36 6.589 2.711 10.623 1.00 0.00 O ATOM 551 CB ALA A 36 6.879 1.054 7.805 1.00 0.00 C ATOM 0 H ALA A 36 4.897 2.480 8.829 1.00 0.00 H new ATOM 0 HA ALA A 36 6.099 -0.187 9.370 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.869 0.602 7.858 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.301 0.569 7.018 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.977 2.116 7.581 1.00 0.00 H new ATOM 557 N PRO A 37 7.961 0.944 10.818 1.00 0.00 N ATOM 558 CA PRO A 37 8.725 1.519 11.902 1.00 0.00 C ATOM 559 C PRO A 37 9.519 2.697 11.368 1.00 0.00 C ATOM 560 O PRO A 37 9.926 2.699 10.207 1.00 0.00 O ATOM 561 CB PRO A 37 9.629 0.394 12.401 1.00 0.00 C ATOM 562 CG PRO A 37 9.810 -0.488 11.166 1.00 0.00 C ATOM 563 CD PRO A 37 8.470 -0.364 10.455 1.00 0.00 C ATOM 0 HA PRO A 37 8.108 1.896 12.717 1.00 0.00 H new ATOM 0 HB2 PRO A 37 10.583 0.776 12.765 1.00 0.00 H new ATOM 0 HB3 PRO A 37 9.171 -0.155 13.223 1.00 0.00 H new ATOM 0 HG2 PRO A 37 10.632 -0.141 10.540 1.00 0.00 H new ATOM 0 HG3 PRO A 37 10.029 -1.521 11.437 1.00 0.00 H new ATOM 0 HD2 PRO A 37 8.588 -0.454 9.375 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.785 -1.153 10.767 1.00 0.00 H new ATOM 571 N LYS A 38 9.742 3.704 12.210 1.00 0.00 N ATOM 572 CA LYS A 38 10.499 4.879 11.809 1.00 0.00 C ATOM 573 C LYS A 38 11.970 4.517 11.596 1.00 0.00 C ATOM 574 O LYS A 38 12.776 5.365 11.218 1.00 0.00 O ATOM 575 CB LYS A 38 10.298 5.992 12.839 1.00 0.00 C ATOM 576 CG LYS A 38 8.795 6.242 12.990 1.00 0.00 C ATOM 577 CD LYS A 38 8.518 7.468 13.857 1.00 0.00 C ATOM 578 CE LYS A 38 7.015 7.679 14.042 1.00 0.00 C ATOM 579 NZ LYS A 38 6.390 6.582 14.809 1.00 0.00 N ATOM 0 H LYS A 38 9.408 3.726 13.173 1.00 0.00 H new ATOM 0 HA LYS A 38 10.133 5.253 10.853 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.733 5.706 13.797 1.00 0.00 H new ATOM 0 HB3 LYS A 38 10.804 6.902 12.518 1.00 0.00 H new ATOM 0 HG2 LYS A 38 8.347 6.382 12.006 1.00 0.00 H new ATOM 0 HG3 LYS A 38 8.322 5.366 13.434 1.00 0.00 H new ATOM 0 HD2 LYS A 38 8.994 7.345 14.830 1.00 0.00 H new ATOM 0 HD3 LYS A 38 8.959 8.352 13.395 1.00 0.00 H new ATOM 0 HE2 LYS A 38 6.843 8.624 14.556 1.00 0.00 H new ATOM 0 HE3 LYS A 38 6.537 7.756 13.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 5.432 6.864 15.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 6.335 5.730 14.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 6.963 6.378 15.653 1.00 0.00 H new ATOM 593 N ASP A 39 12.312 3.251 11.846 1.00 0.00 N ATOM 594 CA ASP A 39 13.629 2.695 11.597 1.00 0.00 C ATOM 595 C ASP A 39 13.829 2.388 10.108 1.00 0.00 C ATOM 596 O ASP A 39 14.965 2.166 9.688 1.00 0.00 O ATOM 597 CB ASP A 39 13.805 1.413 12.412 1.00 0.00 C ATOM 598 CG ASP A 39 13.725 1.696 13.913 1.00 0.00 C ATOM 599 OD1 ASP A 39 14.766 2.086 14.484 1.00 0.00 O ATOM 600 OD2 ASP A 39 12.619 1.524 14.473 1.00 0.00 O ATOM 0 H ASP A 39 11.658 2.573 12.237 1.00 0.00 H new ATOM 0 HA ASP A 39 14.374 3.432 11.897 1.00 0.00 H new ATOM 0 HB2 ASP A 39 13.035 0.693 12.133 1.00 0.00 H new ATOM 0 HB3 ASP A 39 14.767 0.958 12.176 1.00 0.00 H new ATOM 605 N VAL A 40 12.758 2.381 9.302 1.00 0.00 N ATOM 606 CA VAL A 40 12.885 2.234 7.857 1.00 0.00 C ATOM 607 C VAL A 40 12.321 3.462 7.153 1.00 0.00 C ATOM 608 O VAL A 40 11.346 4.070 7.598 1.00 0.00 O ATOM 609 CB VAL A 40 12.217 0.948 7.355 1.00 0.00 C ATOM 610 CG1 VAL A 40 12.798 -0.279 8.058 1.00 0.00 C ATOM 611 CG2 VAL A 40 10.704 0.969 7.546 1.00 0.00 C ATOM 0 H VAL A 40 11.798 2.476 9.632 1.00 0.00 H new ATOM 0 HA VAL A 40 13.945 2.153 7.617 1.00 0.00 H new ATOM 0 HB VAL A 40 12.424 0.890 6.286 1.00 0.00 H new ATOM 0 HG11 VAL A 40 12.308 -1.178 7.685 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.868 -0.340 7.859 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.633 -0.195 9.132 1.00 0.00 H new ATOM 0 HG21 VAL A 40 10.277 0.037 7.175 1.00 0.00 H new ATOM 0 HG22 VAL A 40 10.473 1.078 8.606 1.00 0.00 H new ATOM 0 HG23 VAL A 40 10.279 1.807 6.994 1.00 0.00 H new ATOM 621 N ALA A 41 12.958 3.824 6.042 1.00 0.00 N ATOM 622 CA ALA A 41 12.602 5.000 5.267 1.00 0.00 C ATOM 623 C ALA A 41 11.259 4.800 4.572 1.00 0.00 C ATOM 624 O ALA A 41 10.941 3.699 4.131 1.00 0.00 O ATOM 625 CB ALA A 41 13.694 5.255 4.230 1.00 0.00 C ATOM 0 H ALA A 41 13.743 3.301 5.654 1.00 0.00 H new ATOM 0 HA ALA A 41 12.514 5.858 5.934 1.00 0.00 H new ATOM 0 HB1 ALA A 41 13.438 6.136 3.641 1.00 0.00 H new ATOM 0 HB2 ALA A 41 14.645 5.420 4.736 1.00 0.00 H new ATOM 0 HB3 ALA A 41 13.779 4.391 3.571 1.00 0.00 H new ATOM 631 N VAL A 42 10.476 5.879 4.483 1.00 0.00 N ATOM 632 CA VAL A 42 9.189 5.884 3.800 1.00 0.00 C ATOM 633 C VAL A 42 8.970 7.273 3.214 1.00 0.00 C ATOM 634 O VAL A 42 8.882 8.250 3.964 1.00 0.00 O ATOM 635 CB VAL A 42 8.063 5.572 4.795 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.711 5.592 4.089 1.00 0.00 C ATOM 637 CG2 VAL A 42 8.220 4.196 5.441 1.00 0.00 C ATOM 0 H VAL A 42 10.725 6.781 4.889 1.00 0.00 H new ATOM 0 HA VAL A 42 9.183 5.128 3.015 1.00 0.00 H new ATOM 0 HB VAL A 42 8.119 6.339 5.567 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.922 5.369 4.807 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.541 6.578 3.657 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.703 4.843 3.297 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.398 4.025 6.136 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.208 3.428 4.668 1.00 0.00 H new ATOM 0 HG23 VAL A 42 9.166 4.153 5.980 1.00 0.00 H new ATOM 647 N HIS A 43 8.883 7.358 1.882 1.00 0.00 N ATOM 648 CA HIS A 43 8.667 8.610 1.166 1.00 0.00 C ATOM 649 C HIS A 43 7.882 8.357 -0.117 1.00 0.00 C ATOM 650 O HIS A 43 7.739 7.217 -0.559 1.00 0.00 O ATOM 651 CB HIS A 43 10.003 9.262 0.772 1.00 0.00 C ATOM 652 CG HIS A 43 11.022 9.399 1.871 1.00 0.00 C ATOM 653 ND1 HIS A 43 11.281 10.576 2.578 1.00 0.00 N ATOM 654 CD2 HIS A 43 11.845 8.411 2.327 1.00 0.00 C ATOM 655 CE1 HIS A 43 12.259 10.268 3.444 1.00 0.00 C ATOM 656 NE2 HIS A 43 12.619 8.976 3.315 1.00 0.00 N ATOM 0 H HIS A 43 8.962 6.547 1.268 1.00 0.00 H new ATOM 0 HA HIS A 43 8.114 9.271 1.834 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.445 8.678 -0.035 1.00 0.00 H new ATOM 0 HB3 HIS A 43 9.796 10.254 0.371 1.00 0.00 H new ATOM 0 HD2 HIS A 43 11.882 7.388 1.981 1.00 0.00 H new ATOM 0 HE1 HIS A 43 12.697 10.960 4.147 1.00 0.00 H new ATOM 0 HE2 HIS A 43 13.340 8.499 3.856 1.00 0.00 H new ATOM 664 N ARG A 44 7.372 9.432 -0.717 1.00 0.00 N ATOM 665 CA ARG A 44 6.738 9.404 -2.033 1.00 0.00 C ATOM 666 C ARG A 44 7.807 9.173 -3.102 1.00 0.00 C ATOM 667 O ARG A 44 8.948 9.593 -2.927 1.00 0.00 O ATOM 668 CB ARG A 44 6.039 10.756 -2.238 1.00 0.00 C ATOM 669 CG ARG A 44 7.084 11.876 -2.240 1.00 0.00 C ATOM 670 CD ARG A 44 6.556 13.193 -1.680 1.00 0.00 C ATOM 671 NE ARG A 44 5.777 13.948 -2.659 1.00 0.00 N ATOM 672 CZ ARG A 44 4.981 14.968 -2.330 1.00 0.00 C ATOM 673 NH1 ARG A 44 4.889 15.375 -1.068 1.00 0.00 N ATOM 674 NH2 ARG A 44 4.267 15.592 -3.262 1.00 0.00 N ATOM 0 H ARG A 44 7.388 10.361 -0.295 1.00 0.00 H new ATOM 0 HA ARG A 44 6.008 8.598 -2.107 1.00 0.00 H new ATOM 0 HB2 ARG A 44 5.490 10.755 -3.180 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.311 10.925 -1.445 1.00 0.00 H new ATOM 0 HG2 ARG A 44 7.947 11.560 -1.654 1.00 0.00 H new ATOM 0 HG3 ARG A 44 7.433 12.036 -3.260 1.00 0.00 H new ATOM 0 HD2 ARG A 44 5.936 12.990 -0.807 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.394 13.802 -1.341 1.00 0.00 H new ATOM 0 HE ARG A 44 5.845 13.683 -3.642 1.00 0.00 H new ATOM 0 HH11 ARG A 44 5.430 14.907 -0.341 1.00 0.00 H new ATOM 0 HH12 ARG A 44 4.278 16.155 -0.827 1.00 0.00 H new ATOM 0 HH21 ARG A 44 4.325 15.292 -4.235 1.00 0.00 H new ATOM 0 HH22 ARG A 44 3.661 16.371 -3.004 1.00 0.00 H new ATOM 688 N GLU A 45 7.463 8.515 -4.212 1.00 0.00 N ATOM 689 CA GLU A 45 8.418 8.319 -5.302 1.00 0.00 C ATOM 690 C GLU A 45 8.752 9.646 -5.966 1.00 0.00 C ATOM 691 O GLU A 45 9.814 9.811 -6.561 1.00 0.00 O ATOM 692 CB GLU A 45 7.789 7.408 -6.348 1.00 0.00 C ATOM 693 CG GLU A 45 7.798 5.970 -5.856 1.00 0.00 C ATOM 694 CD GLU A 45 9.110 5.282 -6.224 1.00 0.00 C ATOM 695 OE1 GLU A 45 10.067 5.400 -5.429 1.00 0.00 O ATOM 696 OE2 GLU A 45 9.149 4.645 -7.300 1.00 0.00 O ATOM 0 H GLU A 45 6.540 8.113 -4.378 1.00 0.00 H new ATOM 0 HA GLU A 45 9.329 7.880 -4.895 1.00 0.00 H new ATOM 0 HB2 GLU A 45 6.766 7.725 -6.551 1.00 0.00 H new ATOM 0 HB3 GLU A 45 8.339 7.484 -7.286 1.00 0.00 H new ATOM 0 HG2 GLU A 45 7.662 5.950 -4.775 1.00 0.00 H new ATOM 0 HG3 GLU A 45 6.961 5.426 -6.293 1.00 0.00 H new ATOM 703 N GLU A 46 7.817 10.590 -5.853 1.00 0.00 N ATOM 704 CA GLU A 46 7.948 11.944 -6.374 1.00 0.00 C ATOM 705 C GLU A 46 9.109 12.696 -5.710 1.00 0.00 C ATOM 706 O GLU A 46 9.479 13.782 -6.163 1.00 0.00 O ATOM 707 CB GLU A 46 6.607 12.649 -6.150 1.00 0.00 C ATOM 708 CG GLU A 46 6.522 14.026 -6.809 1.00 0.00 C ATOM 709 CD GLU A 46 5.123 14.617 -6.660 1.00 0.00 C ATOM 710 OE1 GLU A 46 4.460 14.276 -5.650 1.00 0.00 O ATOM 711 OE2 GLU A 46 4.725 15.400 -7.550 1.00 0.00 O ATOM 0 H GLU A 46 6.926 10.426 -5.384 1.00 0.00 H new ATOM 0 HA GLU A 46 8.185 11.920 -7.438 1.00 0.00 H new ATOM 0 HB2 GLU A 46 5.806 12.020 -6.538 1.00 0.00 H new ATOM 0 HB3 GLU A 46 6.437 12.757 -5.079 1.00 0.00 H new ATOM 0 HG2 GLU A 46 7.254 14.695 -6.357 1.00 0.00 H new ATOM 0 HG3 GLU A 46 6.775 13.944 -7.866 1.00 0.00 H new ATOM 718 N ILE A 47 9.685 12.133 -4.644 1.00 0.00 N ATOM 719 CA ILE A 47 10.795 12.743 -3.919 1.00 0.00 C ATOM 720 C ILE A 47 11.852 11.713 -3.547 1.00 0.00 C ATOM 721 O ILE A 47 13.012 12.075 -3.380 1.00 0.00 O ATOM 722 CB ILE A 47 10.236 13.455 -2.674 1.00 0.00 C ATOM 723 CG1 ILE A 47 9.652 14.817 -3.066 1.00 0.00 C ATOM 724 CG2 ILE A 47 11.265 13.624 -1.555 1.00 0.00 C ATOM 725 CD1 ILE A 47 9.413 15.700 -1.843 1.00 0.00 C ATOM 0 H ILE A 47 9.390 11.235 -4.260 1.00 0.00 H new ATOM 0 HA ILE A 47 11.290 13.472 -4.561 1.00 0.00 H new ATOM 0 HB ILE A 47 9.451 12.812 -2.275 1.00 0.00 H new ATOM 0 HG12 ILE A 47 10.333 15.321 -3.752 1.00 0.00 H new ATOM 0 HG13 ILE A 47 8.712 14.671 -3.599 1.00 0.00 H new ATOM 0 HG21 ILE A 47 10.803 14.133 -0.709 1.00 0.00 H new ATOM 0 HG22 ILE A 47 11.622 12.644 -1.238 1.00 0.00 H new ATOM 0 HG23 ILE A 47 12.105 14.215 -1.919 1.00 0.00 H new ATOM 0 HD11 ILE A 47 8.999 16.657 -2.160 1.00 0.00 H new ATOM 0 HD12 ILE A 47 8.712 15.207 -1.169 1.00 0.00 H new ATOM 0 HD13 ILE A 47 10.357 15.867 -1.325 1.00 0.00 H new ATOM 737 N TYR A 48 11.500 10.434 -3.411 1.00 0.00 N ATOM 738 CA TYR A 48 12.473 9.451 -2.961 1.00 0.00 C ATOM 739 C TYR A 48 13.635 9.347 -3.946 1.00 0.00 C ATOM 740 O TYR A 48 14.779 9.125 -3.554 1.00 0.00 O ATOM 741 CB TYR A 48 11.810 8.086 -2.810 1.00 0.00 C ATOM 742 CG TYR A 48 12.788 7.041 -2.342 1.00 0.00 C ATOM 743 CD1 TYR A 48 13.001 6.854 -0.968 1.00 0.00 C ATOM 744 CD2 TYR A 48 13.494 6.271 -3.277 1.00 0.00 C ATOM 745 CE1 TYR A 48 13.923 5.894 -0.527 1.00 0.00 C ATOM 746 CE2 TYR A 48 14.417 5.314 -2.844 1.00 0.00 C ATOM 747 CZ TYR A 48 14.626 5.106 -1.463 1.00 0.00 C ATOM 748 OH TYR A 48 15.504 4.155 -1.038 1.00 0.00 O ATOM 0 H TYR A 48 10.569 10.065 -3.602 1.00 0.00 H new ATOM 0 HA TYR A 48 12.860 9.775 -1.995 1.00 0.00 H new ATOM 0 HB2 TYR A 48 10.986 8.158 -2.100 1.00 0.00 H new ATOM 0 HB3 TYR A 48 11.381 7.782 -3.765 1.00 0.00 H new ATOM 0 HD1 TYR A 48 12.455 7.449 -0.251 1.00 0.00 H new ATOM 0 HD2 TYR A 48 13.325 6.417 -4.334 1.00 0.00 H new ATOM 0 HE1 TYR A 48 14.095 5.758 0.530 1.00 0.00 H new ATOM 0 HE2 TYR A 48 14.971 4.733 -3.567 1.00 0.00 H new ATOM 0 HH TYR A 48 15.900 3.705 -1.814 1.00 0.00 H new ATOM 758 N GLN A 49 13.329 9.511 -5.232 1.00 0.00 N ATOM 759 CA GLN A 49 14.321 9.411 -6.286 1.00 0.00 C ATOM 760 C GLN A 49 15.247 10.628 -6.271 1.00 0.00 C ATOM 761 O GLN A 49 16.296 10.616 -6.914 1.00 0.00 O ATOM 762 CB GLN A 49 13.597 9.272 -7.626 1.00 0.00 C ATOM 763 CG GLN A 49 12.636 8.087 -7.546 1.00 0.00 C ATOM 764 CD GLN A 49 11.907 7.872 -8.865 1.00 0.00 C ATOM 765 OE1 GLN A 49 12.460 7.307 -9.808 1.00 0.00 O ATOM 766 NE2 GLN A 49 10.656 8.321 -8.944 1.00 0.00 N ATOM 0 H GLN A 49 12.387 9.716 -5.566 1.00 0.00 H new ATOM 0 HA GLN A 49 14.947 8.533 -6.127 1.00 0.00 H new ATOM 0 HB2 GLN A 49 13.050 10.186 -7.856 1.00 0.00 H new ATOM 0 HB3 GLN A 49 14.317 9.120 -8.430 1.00 0.00 H new ATOM 0 HG2 GLN A 49 13.189 7.185 -7.283 1.00 0.00 H new ATOM 0 HG3 GLN A 49 11.910 8.259 -6.751 1.00 0.00 H new ATOM 0 HE21 GLN A 49 10.229 8.785 -8.142 1.00 0.00 H new ATOM 0 HE22 GLN A 49 10.125 8.201 -9.806 1.00 0.00 H new ATOM 775 N ARG A 50 14.857 11.679 -5.540 1.00 0.00 N ATOM 776 CA ARG A 50 15.679 12.871 -5.368 1.00 0.00 C ATOM 777 C ARG A 50 16.502 12.756 -4.085 1.00 0.00 C ATOM 778 O ARG A 50 17.559 13.370 -3.977 1.00 0.00 O ATOM 779 CB ARG A 50 14.779 14.118 -5.399 1.00 0.00 C ATOM 780 CG ARG A 50 14.571 14.771 -4.030 1.00 0.00 C ATOM 781 CD ARG A 50 13.484 15.839 -4.121 1.00 0.00 C ATOM 782 NE ARG A 50 13.891 16.961 -4.976 1.00 0.00 N ATOM 783 CZ ARG A 50 13.150 18.046 -5.187 1.00 0.00 C ATOM 784 NH1 ARG A 50 11.953 18.179 -4.622 1.00 0.00 N ATOM 785 NH2 ARG A 50 13.603 19.013 -5.978 1.00 0.00 N ATOM 0 H ARG A 50 13.962 11.722 -5.053 1.00 0.00 H new ATOM 0 HA ARG A 50 16.392 12.967 -6.187 1.00 0.00 H new ATOM 0 HB2 ARG A 50 15.215 14.851 -6.077 1.00 0.00 H new ATOM 0 HB3 ARG A 50 13.808 13.842 -5.810 1.00 0.00 H new ATOM 0 HG2 ARG A 50 14.290 14.015 -3.296 1.00 0.00 H new ATOM 0 HG3 ARG A 50 15.504 15.218 -3.686 1.00 0.00 H new ATOM 0 HD2 ARG A 50 12.570 15.395 -4.515 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.253 16.209 -3.122 1.00 0.00 H new ATOM 0 HE ARG A 50 14.799 16.905 -5.437 1.00 0.00 H new ATOM 0 HH11 ARG A 50 11.590 17.443 -4.016 1.00 0.00 H new ATOM 0 HH12 ARG A 50 11.398 19.017 -4.794 1.00 0.00 H new ATOM 0 HH21 ARG A 50 14.517 18.923 -6.422 1.00 0.00 H new ATOM 0 HH22 ARG A 50 13.037 19.846 -6.141 1.00 0.00 H new ATOM 799 N ILE A 51 16.020 11.976 -3.110 1.00 0.00 N ATOM 800 CA ILE A 51 16.747 11.728 -1.871 1.00 0.00 C ATOM 801 C ILE A 51 17.928 10.810 -2.165 1.00 0.00 C ATOM 802 O ILE A 51 19.064 11.104 -1.800 1.00 0.00 O ATOM 803 CB ILE A 51 15.817 11.060 -0.850 1.00 0.00 C ATOM 804 CG1 ILE A 51 14.692 12.011 -0.449 1.00 0.00 C ATOM 805 CG2 ILE A 51 16.586 10.660 0.415 1.00 0.00 C ATOM 806 CD1 ILE A 51 13.662 11.290 0.413 1.00 0.00 C ATOM 0 H ILE A 51 15.118 11.503 -3.163 1.00 0.00 H new ATOM 0 HA ILE A 51 17.106 12.672 -1.461 1.00 0.00 H new ATOM 0 HB ILE A 51 15.403 10.169 -1.322 1.00 0.00 H new ATOM 0 HG12 ILE A 51 15.103 12.859 0.099 1.00 0.00 H new ATOM 0 HG13 ILE A 51 14.211 12.411 -1.342 1.00 0.00 H new ATOM 0 HG21 ILE A 51 15.903 10.189 1.122 1.00 0.00 H new ATOM 0 HG22 ILE A 51 17.378 9.958 0.153 1.00 0.00 H new ATOM 0 HG23 ILE A 51 17.024 11.548 0.871 1.00 0.00 H new ATOM 0 HD11 ILE A 51 12.868 11.984 0.689 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.237 10.457 -0.148 1.00 0.00 H new ATOM 0 HD13 ILE A 51 14.143 10.912 1.315 1.00 0.00 H new ATOM 818 N GLN A 52 17.650 9.688 -2.831 1.00 0.00 N ATOM 819 CA GLN A 52 18.644 8.671 -3.134 1.00 0.00 C ATOM 820 C GLN A 52 19.591 9.126 -4.240 1.00 0.00 C ATOM 821 O GLN A 52 20.430 8.350 -4.697 1.00 0.00 O ATOM 822 CB GLN A 52 17.940 7.350 -3.465 1.00 0.00 C ATOM 823 CG GLN A 52 17.154 6.868 -2.246 1.00 0.00 C ATOM 824 CD GLN A 52 17.975 6.962 -0.968 1.00 0.00 C ATOM 825 OE1 GLN A 52 19.047 6.373 -0.859 1.00 0.00 O ATOM 826 NE2 GLN A 52 17.475 7.713 0.010 1.00 0.00 N ATOM 0 H GLN A 52 16.717 9.463 -3.176 1.00 0.00 H new ATOM 0 HA GLN A 52 19.269 8.508 -2.256 1.00 0.00 H new ATOM 0 HB2 GLN A 52 17.268 7.487 -4.313 1.00 0.00 H new ATOM 0 HB3 GLN A 52 18.674 6.599 -3.758 1.00 0.00 H new ATOM 0 HG2 GLN A 52 16.247 7.464 -2.140 1.00 0.00 H new ATOM 0 HG3 GLN A 52 16.841 5.836 -2.401 1.00 0.00 H new ATOM 0 HE21 GLN A 52 16.581 8.187 -0.117 1.00 0.00 H new ATOM 0 HE22 GLN A 52 17.986 7.814 0.887 1.00 0.00 H new ATOM 835 N ALA A 53 19.462 10.380 -4.676 1.00 0.00 N ATOM 836 CA ALA A 53 20.336 10.930 -5.694 1.00 0.00 C ATOM 837 C ALA A 53 21.741 11.168 -5.137 1.00 0.00 C ATOM 838 O ALA A 53 22.689 11.304 -5.907 1.00 0.00 O ATOM 839 CB ALA A 53 19.740 12.237 -6.211 1.00 0.00 C ATOM 0 H ALA A 53 18.755 11.031 -4.333 1.00 0.00 H new ATOM 0 HA ALA A 53 20.420 10.217 -6.514 1.00 0.00 H new ATOM 0 HB1 ALA A 53 20.392 12.656 -6.977 1.00 0.00 H new ATOM 0 HB2 ALA A 53 18.756 12.044 -6.638 1.00 0.00 H new ATOM 0 HB3 ALA A 53 19.646 12.945 -5.387 1.00 0.00 H new ATOM 845 N GLY A 54 21.884 11.220 -3.804 1.00 0.00 N ATOM 846 CA GLY A 54 23.180 11.412 -3.165 1.00 0.00 C ATOM 847 C GLY A 54 23.108 12.389 -1.991 1.00 0.00 C ATOM 848 O GLY A 54 24.143 12.879 -1.542 1.00 0.00 O ATOM 0 H GLY A 54 21.107 11.130 -3.149 1.00 0.00 H new ATOM 0 HA2 GLY A 54 23.555 10.451 -2.813 1.00 0.00 H new ATOM 0 HA3 GLY A 54 23.894 11.783 -3.900 1.00 0.00 H new ATOM 852 N LEU A 55 21.900 12.674 -1.496 1.00 0.00 N ATOM 853 CA LEU A 55 21.669 13.672 -0.465 1.00 0.00 C ATOM 854 C LEU A 55 20.666 13.167 0.572 1.00 0.00 C ATOM 855 O LEU A 55 20.280 11.998 0.551 1.00 0.00 O ATOM 856 CB LEU A 55 21.203 14.963 -1.146 1.00 0.00 C ATOM 857 CG LEU A 55 19.953 14.780 -2.020 1.00 0.00 C ATOM 858 CD1 LEU A 55 18.682 14.609 -1.192 1.00 0.00 C ATOM 859 CD2 LEU A 55 19.799 16.006 -2.907 1.00 0.00 C ATOM 0 H LEU A 55 21.048 12.208 -1.809 1.00 0.00 H new ATOM 0 HA LEU A 55 22.590 13.873 0.082 1.00 0.00 H new ATOM 0 HB2 LEU A 55 20.996 15.712 -0.382 1.00 0.00 H new ATOM 0 HB3 LEU A 55 22.013 15.352 -1.762 1.00 0.00 H new ATOM 0 HG LEU A 55 20.087 13.873 -2.609 1.00 0.00 H new ATOM 0 HD11 LEU A 55 17.828 14.483 -1.858 1.00 0.00 H new ATOM 0 HD12 LEU A 55 18.778 13.730 -0.555 1.00 0.00 H new ATOM 0 HD13 LEU A 55 18.531 15.492 -0.571 1.00 0.00 H new ATOM 0 HD21 LEU A 55 18.915 15.892 -3.535 1.00 0.00 H new ATOM 0 HD22 LEU A 55 19.690 16.894 -2.284 1.00 0.00 H new ATOM 0 HD23 LEU A 55 20.681 16.111 -3.538 1.00 0.00 H new ATOM 871 N THR A 56 20.246 14.048 1.482 1.00 0.00 N ATOM 872 CA THR A 56 19.257 13.727 2.504 1.00 0.00 C ATOM 873 C THR A 56 18.292 14.898 2.685 1.00 0.00 C ATOM 874 O THR A 56 18.482 15.960 2.089 1.00 0.00 O ATOM 875 CB THR A 56 19.957 13.371 3.822 1.00 0.00 C ATOM 876 OG1 THR A 56 20.770 14.447 4.242 1.00 0.00 O ATOM 877 CG2 THR A 56 20.835 12.131 3.641 1.00 0.00 C ATOM 0 H THR A 56 20.586 15.008 1.528 1.00 0.00 H new ATOM 0 HA THR A 56 18.679 12.860 2.186 1.00 0.00 H new ATOM 0 HB THR A 56 19.192 13.169 4.572 1.00 0.00 H new ATOM 0 HG1 THR A 56 21.212 14.213 5.085 1.00 0.00 H new ATOM 0 HG21 THR A 56 21.325 11.891 4.585 1.00 0.00 H new ATOM 0 HG22 THR A 56 20.216 11.290 3.329 1.00 0.00 H new ATOM 0 HG23 THR A 56 21.590 12.328 2.880 1.00 0.00 H new ATOM 885 N ALA A 57 17.252 14.708 3.505 1.00 0.00 N ATOM 886 CA ALA A 57 16.196 15.693 3.690 1.00 0.00 C ATOM 887 C ALA A 57 16.750 17.087 4.018 1.00 0.00 C ATOM 888 O ALA A 57 17.719 17.203 4.767 1.00 0.00 O ATOM 889 CB ALA A 57 15.273 15.215 4.809 1.00 0.00 C ATOM 0 H ALA A 57 17.125 13.861 4.058 1.00 0.00 H new ATOM 0 HA ALA A 57 15.645 15.786 2.754 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.476 15.943 4.959 1.00 0.00 H new ATOM 0 HB2 ALA A 57 14.839 14.253 4.537 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.844 15.107 5.731 1.00 0.00 H new ATOM 895 N PRO A 58 16.136 18.141 3.459 1.00 0.00 N ATOM 896 CA PRO A 58 16.501 19.529 3.697 1.00 0.00 C ATOM 897 C PRO A 58 16.674 19.875 5.171 1.00 0.00 C ATOM 898 O PRO A 58 17.651 20.538 5.513 1.00 0.00 O ATOM 899 CB PRO A 58 15.374 20.354 3.073 1.00 0.00 C ATOM 900 CG PRO A 58 14.867 19.462 1.943 1.00 0.00 C ATOM 901 CD PRO A 58 15.026 18.059 2.529 1.00 0.00 C ATOM 0 HA PRO A 58 17.475 19.738 3.256 1.00 0.00 H new ATOM 0 HB2 PRO A 58 14.588 20.572 3.796 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.737 21.311 2.698 1.00 0.00 H new ATOM 0 HG2 PRO A 58 13.830 19.680 1.689 1.00 0.00 H new ATOM 0 HG3 PRO A 58 15.452 19.590 1.032 1.00 0.00 H new ATOM 0 HD2 PRO A 58 14.115 17.741 3.035 1.00 0.00 H new ATOM 0 HD3 PRO A 58 15.226 17.328 1.745 1.00 0.00 H new ATOM 909 N ASP A 59 15.727 19.415 6.005 1.00 0.00 N ATOM 910 CA ASP A 59 15.624 19.640 7.448 1.00 0.00 C ATOM 911 C ASP A 59 14.166 19.917 7.835 1.00 0.00 C ATOM 912 O ASP A 59 13.767 19.650 8.969 1.00 0.00 O ATOM 913 CB ASP A 59 16.534 20.782 7.913 1.00 0.00 C ATOM 914 CG ASP A 59 16.288 21.158 9.373 1.00 0.00 C ATOM 915 OD1 ASP A 59 16.605 20.317 10.246 1.00 0.00 O ATOM 916 OD2 ASP A 59 15.785 22.277 9.608 1.00 0.00 O ATOM 0 H ASP A 59 14.962 18.836 5.660 1.00 0.00 H new ATOM 0 HA ASP A 59 15.960 18.734 7.952 1.00 0.00 H new ATOM 0 HB2 ASP A 59 17.576 20.489 7.786 1.00 0.00 H new ATOM 0 HB3 ASP A 59 16.369 21.655 7.282 1.00 0.00 H new ATOM 1635 N MET C 1 1.880 7.053 12.473 1.00 0.00 N ATOM 1636 CA MET C 1 1.530 6.523 11.141 1.00 0.00 C ATOM 1637 C MET C 1 1.745 7.599 10.084 1.00 0.00 C ATOM 1638 O MET C 1 1.186 8.685 10.195 1.00 0.00 O ATOM 1639 CB MET C 1 0.081 6.024 11.120 1.00 0.00 C ATOM 1640 CG MET C 1 -0.151 5.136 9.898 1.00 0.00 C ATOM 1641 SD MET C 1 -1.786 4.363 9.810 1.00 0.00 S ATOM 1642 CE MET C 1 -2.783 5.828 9.437 1.00 0.00 C ATOM 0 H1 MET C 1 1.731 6.315 13.190 1.00 0.00 H new ATOM 0 H2 MET C 1 2.878 7.346 12.479 1.00 0.00 H new ATOM 0 H3 MET C 1 1.278 7.873 12.690 1.00 0.00 H new ATOM 0 HA MET C 1 2.179 5.676 10.918 1.00 0.00 H new ATOM 0 HB2 MET C 1 -0.133 5.465 12.031 1.00 0.00 H new ATOM 0 HB3 MET C 1 -0.604 6.872 11.098 1.00 0.00 H new ATOM 0 HG2 MET C 1 -0.000 5.734 8.999 1.00 0.00 H new ATOM 0 HG3 MET C 1 0.606 4.351 9.889 1.00 0.00 H new ATOM 0 HE1 MET C 1 -3.816 5.529 9.259 1.00 0.00 H new ATOM 0 HE2 MET C 1 -2.745 6.518 10.280 1.00 0.00 H new ATOM 0 HE3 MET C 1 -2.389 6.320 8.548 1.00 0.00 H new ATOM 1654 N LEU C 2 2.546 7.302 9.060 1.00 0.00 N ATOM 1655 CA LEU C 2 2.848 8.265 8.010 1.00 0.00 C ATOM 1656 C LEU C 2 1.744 8.180 6.951 1.00 0.00 C ATOM 1657 O LEU C 2 1.426 7.091 6.482 1.00 0.00 O ATOM 1658 CB LEU C 2 4.228 7.928 7.426 1.00 0.00 C ATOM 1659 CG LEU C 2 4.947 9.078 6.698 1.00 0.00 C ATOM 1660 CD1 LEU C 2 5.989 8.488 5.758 1.00 0.00 C ATOM 1661 CD2 LEU C 2 4.035 9.993 5.892 1.00 0.00 C ATOM 0 H LEU C 2 2.998 6.396 8.939 1.00 0.00 H new ATOM 0 HA LEU C 2 2.880 9.285 8.392 1.00 0.00 H new ATOM 0 HB2 LEU C 2 4.869 7.579 8.236 1.00 0.00 H new ATOM 0 HB3 LEU C 2 4.114 7.097 6.729 1.00 0.00 H new ATOM 0 HG LEU C 2 5.389 9.697 7.479 1.00 0.00 H new ATOM 0 HD11 LEU C 2 6.506 9.293 5.236 1.00 0.00 H new ATOM 0 HD12 LEU C 2 6.710 7.907 6.333 1.00 0.00 H new ATOM 0 HD13 LEU C 2 5.498 7.841 5.031 1.00 0.00 H new ATOM 0 HD21 LEU C 2 4.630 10.772 5.415 1.00 0.00 H new ATOM 0 HD22 LEU C 2 3.520 9.411 5.128 1.00 0.00 H new ATOM 0 HD23 LEU C 2 3.301 10.452 6.555 1.00 0.00 H new ATOM 1673 N ILE C 3 1.165 9.321 6.574 1.00 0.00 N ATOM 1674 CA ILE C 3 0.106 9.387 5.575 1.00 0.00 C ATOM 1675 C ILE C 3 0.558 10.277 4.431 1.00 0.00 C ATOM 1676 O ILE C 3 1.342 11.201 4.633 1.00 0.00 O ATOM 1677 CB ILE C 3 -1.171 9.912 6.241 1.00 0.00 C ATOM 1678 CG1 ILE C 3 -1.616 8.850 7.253 1.00 0.00 C ATOM 1679 CG2 ILE C 3 -2.285 10.207 5.231 1.00 0.00 C ATOM 1680 CD1 ILE C 3 -2.826 9.277 8.056 1.00 0.00 C ATOM 0 H ILE C 3 1.422 10.230 6.958 1.00 0.00 H new ATOM 0 HA ILE C 3 -0.108 8.400 5.165 1.00 0.00 H new ATOM 0 HB ILE C 3 -0.963 10.864 6.730 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -1.844 7.924 6.725 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -0.792 8.634 7.933 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -3.165 10.576 5.758 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -1.943 10.962 4.523 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -2.540 9.294 4.693 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -3.096 8.486 8.756 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -2.593 10.187 8.609 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -3.662 9.466 7.382 1.00 0.00 H new ATOM 1692 N LEU C 4 0.060 10.002 3.223 1.00 0.00 N ATOM 1693 CA LEU C 4 0.398 10.771 2.042 1.00 0.00 C ATOM 1694 C LEU C 4 -0.828 10.852 1.142 1.00 0.00 C ATOM 1695 O LEU C 4 -1.831 10.178 1.372 1.00 0.00 O ATOM 1696 CB LEU C 4 1.557 10.101 1.291 1.00 0.00 C ATOM 1697 CG LEU C 4 2.868 10.078 2.086 1.00 0.00 C ATOM 1698 CD1 LEU C 4 3.903 9.237 1.344 1.00 0.00 C ATOM 1699 CD2 LEU C 4 3.438 11.486 2.253 1.00 0.00 C ATOM 0 H LEU C 4 -0.590 9.236 3.045 1.00 0.00 H new ATOM 0 HA LEU C 4 0.709 11.774 2.333 1.00 0.00 H new ATOM 0 HB2 LEU C 4 1.275 9.078 1.041 1.00 0.00 H new ATOM 0 HB3 LEU C 4 1.721 10.625 0.350 1.00 0.00 H new ATOM 0 HG LEU C 4 2.653 9.656 3.068 1.00 0.00 H new ATOM 0 HD11 LEU C 4 4.834 9.222 1.911 1.00 0.00 H new ATOM 0 HD12 LEU C 4 3.531 8.219 1.231 1.00 0.00 H new ATOM 0 HD13 LEU C 4 4.085 9.669 0.360 1.00 0.00 H new ATOM 0 HD21 LEU C 4 4.367 11.437 2.821 1.00 0.00 H new ATOM 0 HD22 LEU C 4 3.634 11.918 1.272 1.00 0.00 H new ATOM 0 HD23 LEU C 4 2.719 12.109 2.786 1.00 0.00 H new ATOM 1711 N THR C 5 -0.732 11.683 0.109 1.00 0.00 N ATOM 1712 CA THR C 5 -1.800 11.884 -0.851 1.00 0.00 C ATOM 1713 C THR C 5 -1.189 11.681 -2.227 1.00 0.00 C ATOM 1714 O THR C 5 -0.097 12.170 -2.507 1.00 0.00 O ATOM 1715 CB THR C 5 -2.395 13.280 -0.652 1.00 0.00 C ATOM 1716 OG1 THR C 5 -2.884 13.376 0.669 1.00 0.00 O ATOM 1717 CG2 THR C 5 -3.556 13.572 -1.599 1.00 0.00 C ATOM 0 H THR C 5 0.101 12.240 -0.083 1.00 0.00 H new ATOM 0 HA THR C 5 -2.624 11.181 -0.726 1.00 0.00 H new ATOM 0 HB THR C 5 -1.603 14.000 -0.856 1.00 0.00 H new ATOM 0 HG1 THR C 5 -3.267 14.267 0.812 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.936 14.576 -1.410 1.00 0.00 H new ATOM 0 HG22 THR C 5 -3.210 13.503 -2.630 1.00 0.00 H new ATOM 0 HG23 THR C 5 -4.352 12.846 -1.434 1.00 0.00 H new ATOM 1725 N ARG C 6 -1.898 10.956 -3.089 1.00 0.00 N ATOM 1726 CA ARG C 6 -1.357 10.505 -4.360 1.00 0.00 C ATOM 1727 C ARG C 6 -2.464 10.525 -5.406 1.00 0.00 C ATOM 1728 O ARG C 6 -3.621 10.769 -5.066 1.00 0.00 O ATOM 1729 CB ARG C 6 -0.805 9.090 -4.128 1.00 0.00 C ATOM 1730 CG ARG C 6 0.249 8.633 -5.139 1.00 0.00 C ATOM 1731 CD ARG C 6 1.543 9.448 -5.056 1.00 0.00 C ATOM 1732 NE ARG C 6 1.481 10.682 -5.847 1.00 0.00 N ATOM 1733 CZ ARG C 6 2.273 11.744 -5.674 1.00 0.00 C ATOM 1734 NH1 ARG C 6 3.201 11.774 -4.721 1.00 0.00 N ATOM 1735 NH2 ARG C 6 2.136 12.800 -6.466 1.00 0.00 N ATOM 0 H ARG C 6 -2.862 10.667 -2.923 1.00 0.00 H new ATOM 0 HA ARG C 6 -0.558 11.150 -4.726 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -0.372 9.045 -3.129 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -1.636 8.384 -4.148 1.00 0.00 H new ATOM 0 HG2 ARG C 6 0.476 7.581 -4.969 1.00 0.00 H new ATOM 0 HG3 ARG C 6 -0.161 8.712 -6.146 1.00 0.00 H new ATOM 0 HD2 ARG C 6 1.745 9.698 -4.014 1.00 0.00 H new ATOM 0 HD3 ARG C 6 2.376 8.838 -5.405 1.00 0.00 H new ATOM 0 HE ARG C 6 0.779 10.733 -6.586 1.00 0.00 H new ATOM 0 HH11 ARG C 6 3.321 10.973 -4.101 1.00 0.00 H new ATOM 0 HH12 ARG C 6 3.792 12.598 -4.611 1.00 0.00 H new ATOM 0 HH21 ARG C 6 1.429 12.798 -7.201 1.00 0.00 H new ATOM 0 HH22 ARG C 6 2.737 13.614 -6.339 1.00 0.00 H new ATOM 1749 N LYS C 7 -2.135 10.273 -6.674 1.00 0.00 N ATOM 1750 CA LYS C 7 -3.136 10.235 -7.730 1.00 0.00 C ATOM 1751 C LYS C 7 -2.937 9.010 -8.600 1.00 0.00 C ATOM 1752 O LYS C 7 -1.856 8.430 -8.629 1.00 0.00 O ATOM 1753 CB LYS C 7 -3.065 11.503 -8.580 1.00 0.00 C ATOM 1754 CG LYS C 7 -2.989 12.774 -7.727 1.00 0.00 C ATOM 1755 CD LYS C 7 -3.218 13.983 -8.634 1.00 0.00 C ATOM 1756 CE LYS C 7 -3.029 15.293 -7.868 1.00 0.00 C ATOM 1757 NZ LYS C 7 -3.275 16.446 -8.752 1.00 0.00 N ATOM 0 H LYS C 7 -1.182 10.093 -6.990 1.00 0.00 H new ATOM 0 HA LYS C 7 -4.122 10.181 -7.269 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -2.192 11.453 -9.231 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -3.942 11.554 -9.226 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -3.740 12.745 -6.937 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -2.017 12.845 -7.240 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -2.525 13.947 -9.474 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -4.225 13.944 -9.049 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -3.711 15.326 -7.018 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -2.017 15.344 -7.467 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 -3.143 17.328 -8.217 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -2.607 16.421 -9.549 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -4.249 16.404 -9.115 1.00 0.00 H new ATOM 1771 N VAL C 8 -3.996 8.622 -9.318 1.00 0.00 N ATOM 1772 CA VAL C 8 -3.983 7.462 -10.195 1.00 0.00 C ATOM 1773 C VAL C 8 -2.793 7.534 -11.144 1.00 0.00 C ATOM 1774 O VAL C 8 -2.717 8.444 -11.972 1.00 0.00 O ATOM 1775 CB VAL C 8 -5.293 7.409 -10.979 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -5.228 6.299 -12.025 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -6.451 7.149 -10.018 1.00 0.00 C ATOM 0 H VAL C 8 -4.890 9.113 -9.302 1.00 0.00 H new ATOM 0 HA VAL C 8 -3.887 6.555 -9.598 1.00 0.00 H new ATOM 0 HB VAL C 8 -5.450 8.362 -11.484 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -6.165 6.267 -12.580 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -4.405 6.495 -12.713 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -5.067 5.341 -11.530 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -7.386 7.111 -10.577 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -6.294 6.198 -9.508 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -6.500 7.952 -9.282 1.00 0.00 H new ATOM 1787 N GLY C 9 -1.869 6.579 -11.028 1.00 0.00 N ATOM 1788 CA GLY C 9 -0.729 6.486 -11.930 1.00 0.00 C ATOM 1789 C GLY C 9 0.586 6.884 -11.263 1.00 0.00 C ATOM 1790 O GLY C 9 1.603 6.999 -11.948 1.00 0.00 O ATOM 0 H GLY C 9 -1.892 5.855 -10.310 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -0.648 5.465 -12.302 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -0.902 7.127 -12.794 1.00 0.00 H new ATOM 1794 N GLU C 10 0.576 7.095 -9.945 1.00 0.00 N ATOM 1795 CA GLU C 10 1.759 7.498 -9.196 1.00 0.00 C ATOM 1796 C GLU C 10 2.058 6.471 -8.106 1.00 0.00 C ATOM 1797 O GLU C 10 1.310 5.508 -7.947 1.00 0.00 O ATOM 1798 CB GLU C 10 1.543 8.896 -8.623 1.00 0.00 C ATOM 1799 CG GLU C 10 1.300 9.922 -9.732 1.00 0.00 C ATOM 1800 CD GLU C 10 1.071 11.315 -9.151 1.00 0.00 C ATOM 1801 OE1 GLU C 10 0.279 11.414 -8.189 1.00 0.00 O ATOM 1802 OE2 GLU C 10 1.683 12.272 -9.670 1.00 0.00 O ATOM 0 H GLU C 10 -0.259 6.990 -9.368 1.00 0.00 H new ATOM 0 HA GLU C 10 2.627 7.536 -9.855 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.691 8.885 -7.943 1.00 0.00 H new ATOM 0 HB3 GLU C 10 2.414 9.190 -8.038 1.00 0.00 H new ATOM 0 HG2 GLU C 10 2.156 9.942 -10.407 1.00 0.00 H new ATOM 0 HG3 GLU C 10 0.434 9.624 -10.324 1.00 0.00 H new ATOM 1809 N SER C 11 3.142 6.659 -7.346 1.00 0.00 N ATOM 1810 CA SER C 11 3.608 5.631 -6.430 1.00 0.00 C ATOM 1811 C SER C 11 4.321 6.182 -5.196 1.00 0.00 C ATOM 1812 O SER C 11 4.618 7.373 -5.101 1.00 0.00 O ATOM 1813 CB SER C 11 4.521 4.669 -7.187 1.00 0.00 C ATOM 1814 OG SER C 11 5.341 5.369 -8.100 1.00 0.00 O ATOM 0 H SER C 11 3.705 7.510 -7.352 1.00 0.00 H new ATOM 0 HA SER C 11 2.727 5.112 -6.053 1.00 0.00 H new ATOM 0 HB2 SER C 11 5.143 4.119 -6.481 1.00 0.00 H new ATOM 0 HB3 SER C 11 3.919 3.934 -7.721 1.00 0.00 H new ATOM 0 HG SER C 11 5.919 4.735 -8.573 1.00 0.00 H new ATOM 1820 N ILE C 12 4.589 5.275 -4.252 1.00 0.00 N ATOM 1821 CA ILE C 12 5.189 5.527 -2.947 1.00 0.00 C ATOM 1822 C ILE C 12 6.312 4.507 -2.737 1.00 0.00 C ATOM 1823 O ILE C 12 6.381 3.525 -3.471 1.00 0.00 O ATOM 1824 CB ILE C 12 4.103 5.383 -1.870 1.00 0.00 C ATOM 1825 CG1 ILE C 12 2.894 6.297 -2.126 1.00 0.00 C ATOM 1826 CG2 ILE C 12 4.668 5.655 -0.473 1.00 0.00 C ATOM 1827 CD1 ILE C 12 3.242 7.785 -2.081 1.00 0.00 C ATOM 0 H ILE C 12 4.378 4.287 -4.391 1.00 0.00 H new ATOM 0 HA ILE C 12 5.604 6.533 -2.886 1.00 0.00 H new ATOM 0 HB ILE C 12 3.758 4.350 -1.923 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.468 6.060 -3.101 1.00 0.00 H new ATOM 0 HG13 ILE C 12 2.125 6.088 -1.382 1.00 0.00 H new ATOM 0 HG21 ILE C 12 3.876 5.545 0.268 1.00 0.00 H new ATOM 0 HG22 ILE C 12 5.466 4.944 -0.259 1.00 0.00 H new ATOM 0 HG23 ILE C 12 5.065 6.669 -0.432 1.00 0.00 H new ATOM 0 HD11 ILE C 12 2.345 8.374 -2.270 1.00 0.00 H new ATOM 0 HD12 ILE C 12 3.641 8.036 -1.098 1.00 0.00 H new ATOM 0 HD13 ILE C 12 3.989 8.007 -2.843 1.00 0.00 H new ATOM 1839 N ASN C 13 7.194 4.712 -1.754 1.00 0.00 N ATOM 1840 CA ASN C 13 8.347 3.845 -1.555 1.00 0.00 C ATOM 1841 C ASN C 13 8.592 3.565 -0.070 1.00 0.00 C ATOM 1842 O ASN C 13 8.310 4.409 0.780 1.00 0.00 O ATOM 1843 CB ASN C 13 9.555 4.536 -2.190 1.00 0.00 C ATOM 1844 CG ASN C 13 10.699 3.566 -2.462 1.00 0.00 C ATOM 1845 OD1 ASN C 13 11.277 2.991 -1.544 1.00 0.00 O ATOM 1846 ND2 ASN C 13 11.032 3.386 -3.736 1.00 0.00 N ATOM 0 H ASN C 13 7.126 5.477 -1.083 1.00 0.00 H new ATOM 0 HA ASN C 13 8.170 2.877 -2.024 1.00 0.00 H new ATOM 0 HB2 ASN C 13 9.251 5.008 -3.125 1.00 0.00 H new ATOM 0 HB3 ASN C 13 9.904 5.331 -1.531 1.00 0.00 H new ATOM 0 HD21 ASN C 13 11.792 2.751 -3.980 1.00 0.00 H new ATOM 0 HD22 ASN C 13 10.527 3.883 -4.470 1.00 0.00 H new ATOM 1853 N ILE C 14 9.119 2.373 0.231 1.00 0.00 N ATOM 1854 CA ILE C 14 9.450 1.949 1.589 1.00 0.00 C ATOM 1855 C ILE C 14 10.769 1.181 1.584 1.00 0.00 C ATOM 1856 O ILE C 14 11.058 0.418 0.660 1.00 0.00 O ATOM 1857 CB ILE C 14 8.337 1.057 2.163 1.00 0.00 C ATOM 1858 CG1 ILE C 14 6.992 1.801 2.150 1.00 0.00 C ATOM 1859 CG2 ILE C 14 8.709 0.623 3.588 1.00 0.00 C ATOM 1860 CD1 ILE C 14 5.840 0.941 2.676 1.00 0.00 C ATOM 0 H ILE C 14 9.329 1.668 -0.475 1.00 0.00 H new ATOM 0 HA ILE C 14 9.547 2.836 2.215 1.00 0.00 H new ATOM 0 HB ILE C 14 8.233 0.168 1.541 1.00 0.00 H new ATOM 0 HG12 ILE C 14 7.074 2.703 2.756 1.00 0.00 H new ATOM 0 HG13 ILE C 14 6.767 2.120 1.132 1.00 0.00 H new ATOM 0 HG21 ILE C 14 7.919 -0.009 3.994 1.00 0.00 H new ATOM 0 HG22 ILE C 14 9.645 0.065 3.566 1.00 0.00 H new ATOM 0 HG23 ILE C 14 8.827 1.505 4.218 1.00 0.00 H new ATOM 0 HD11 ILE C 14 4.914 1.515 2.645 1.00 0.00 H new ATOM 0 HD12 ILE C 14 5.737 0.052 2.054 1.00 0.00 H new ATOM 0 HD13 ILE C 14 6.048 0.643 3.704 1.00 0.00 H new ATOM 1872 N GLY C 15 11.572 1.384 2.632 1.00 0.00 N ATOM 1873 CA GLY C 15 12.847 0.708 2.780 1.00 0.00 C ATOM 1874 C GLY C 15 13.757 0.997 1.592 1.00 0.00 C ATOM 1875 O GLY C 15 13.879 2.143 1.161 1.00 0.00 O ATOM 0 H GLY C 15 11.350 2.022 3.396 1.00 0.00 H new ATOM 0 HA2 GLY C 15 13.331 1.033 3.701 1.00 0.00 H new ATOM 0 HA3 GLY C 15 12.686 -0.366 2.867 1.00 0.00 H new ATOM 1879 N ASP C 16 14.392 -0.051 1.073 1.00 0.00 N ATOM 1880 CA ASP C 16 15.291 0.034 -0.067 1.00 0.00 C ATOM 1881 C ASP C 16 14.920 -1.015 -1.116 1.00 0.00 C ATOM 1882 O ASP C 16 15.634 -1.173 -2.106 1.00 0.00 O ATOM 1883 CB ASP C 16 16.735 -0.147 0.402 1.00 0.00 C ATOM 1884 CG ASP C 16 17.163 0.943 1.379 1.00 0.00 C ATOM 1885 OD1 ASP C 16 16.951 0.752 2.597 1.00 0.00 O ATOM 1886 OD2 ASP C 16 17.705 1.966 0.902 1.00 0.00 O ATOM 0 H ASP C 16 14.292 -0.997 1.441 1.00 0.00 H new ATOM 0 HA ASP C 16 15.196 1.017 -0.528 1.00 0.00 H new ATOM 0 HB2 ASP C 16 16.841 -1.122 0.878 1.00 0.00 H new ATOM 0 HB3 ASP C 16 17.400 -0.140 -0.462 1.00 0.00 H new ATOM 1891 N ASP C 17 13.812 -1.731 -0.906 1.00 0.00 N ATOM 1892 CA ASP C 17 13.423 -2.846 -1.762 1.00 0.00 C ATOM 1893 C ASP C 17 11.907 -2.931 -1.971 1.00 0.00 C ATOM 1894 O ASP C 17 11.441 -3.908 -2.553 1.00 0.00 O ATOM 1895 CB ASP C 17 13.931 -4.157 -1.142 1.00 0.00 C ATOM 1896 CG ASP C 17 15.452 -4.193 -1.045 1.00 0.00 C ATOM 1897 OD1 ASP C 17 16.092 -4.473 -2.086 1.00 0.00 O ATOM 1898 OD2 ASP C 17 15.968 -3.938 0.066 1.00 0.00 O ATOM 0 H ASP C 17 13.164 -1.552 -0.139 1.00 0.00 H new ATOM 0 HA ASP C 17 13.872 -2.681 -2.741 1.00 0.00 H new ATOM 0 HB2 ASP C 17 13.502 -4.278 -0.147 1.00 0.00 H new ATOM 0 HB3 ASP C 17 13.586 -4.999 -1.742 1.00 0.00 H new ATOM 1903 N ILE C 18 11.124 -1.942 -1.517 1.00 0.00 N ATOM 1904 CA ILE C 18 9.677 -1.991 -1.692 1.00 0.00 C ATOM 1905 C ILE C 18 9.154 -0.691 -2.289 1.00 0.00 C ATOM 1906 O ILE C 18 9.639 0.395 -1.972 1.00 0.00 O ATOM 1907 CB ILE C 18 8.980 -2.274 -0.349 1.00 0.00 C ATOM 1908 CG1 ILE C 18 9.476 -3.569 0.302 1.00 0.00 C ATOM 1909 CG2 ILE C 18 7.467 -2.378 -0.565 1.00 0.00 C ATOM 1910 CD1 ILE C 18 10.584 -3.262 1.310 1.00 0.00 C ATOM 0 H ILE C 18 11.468 -1.112 -1.033 1.00 0.00 H new ATOM 0 HA ILE C 18 9.451 -2.802 -2.384 1.00 0.00 H new ATOM 0 HB ILE C 18 9.220 -1.446 0.319 1.00 0.00 H new ATOM 0 HG12 ILE C 18 8.649 -4.073 0.802 1.00 0.00 H new ATOM 0 HG13 ILE C 18 9.849 -4.250 -0.463 1.00 0.00 H new ATOM 0 HG21 ILE C 18 6.976 -2.578 0.388 1.00 0.00 H new ATOM 0 HG22 ILE C 18 7.093 -1.440 -0.976 1.00 0.00 H new ATOM 0 HG23 ILE C 18 7.254 -3.190 -1.261 1.00 0.00 H new ATOM 0 HD11 ILE C 18 10.928 -4.190 1.766 1.00 0.00 H new ATOM 0 HD12 ILE C 18 11.416 -2.778 0.799 1.00 0.00 H new ATOM 0 HD13 ILE C 18 10.198 -2.599 2.084 1.00 0.00 H new ATOM 1922 N THR C 19 8.152 -0.817 -3.158 1.00 0.00 N ATOM 1923 CA THR C 19 7.492 0.312 -3.795 1.00 0.00 C ATOM 1924 C THR C 19 6.013 -0.026 -3.938 1.00 0.00 C ATOM 1925 O THR C 19 5.670 -1.193 -4.114 1.00 0.00 O ATOM 1926 CB THR C 19 8.131 0.578 -5.165 1.00 0.00 C ATOM 1927 OG1 THR C 19 9.539 0.532 -5.073 1.00 0.00 O ATOM 1928 CG2 THR C 19 7.747 1.955 -5.691 1.00 0.00 C ATOM 0 H THR C 19 7.774 -1.721 -3.441 1.00 0.00 H new ATOM 0 HA THR C 19 7.602 1.215 -3.194 1.00 0.00 H new ATOM 0 HB THR C 19 7.767 -0.194 -5.843 1.00 0.00 H new ATOM 0 HG1 THR C 19 9.930 0.702 -5.955 1.00 0.00 H new ATOM 0 HG21 THR C 19 8.214 2.116 -6.663 1.00 0.00 H new ATOM 0 HG22 THR C 19 6.664 2.016 -5.794 1.00 0.00 H new ATOM 0 HG23 THR C 19 8.089 2.719 -4.993 1.00 0.00 H new ATOM 1936 N ILE C 20 5.135 0.977 -3.860 1.00 0.00 N ATOM 1937 CA ILE C 20 3.687 0.777 -3.876 1.00 0.00 C ATOM 1938 C ILE C 20 3.076 1.726 -4.903 1.00 0.00 C ATOM 1939 O ILE C 20 3.612 2.810 -5.125 1.00 0.00 O ATOM 1940 CB ILE C 20 3.113 1.060 -2.475 1.00 0.00 C ATOM 1941 CG1 ILE C 20 3.904 0.382 -1.344 1.00 0.00 C ATOM 1942 CG2 ILE C 20 1.647 0.615 -2.417 1.00 0.00 C ATOM 1943 CD1 ILE C 20 3.841 -1.144 -1.376 1.00 0.00 C ATOM 0 H ILE C 20 5.412 1.956 -3.784 1.00 0.00 H new ATOM 0 HA ILE C 20 3.450 -0.252 -4.146 1.00 0.00 H new ATOM 0 HB ILE C 20 3.194 2.135 -2.315 1.00 0.00 H new ATOM 0 HG12 ILE C 20 4.946 0.695 -1.404 1.00 0.00 H new ATOM 0 HG13 ILE C 20 3.521 0.732 -0.385 1.00 0.00 H new ATOM 0 HG21 ILE C 20 1.245 0.817 -1.424 1.00 0.00 H new ATOM 0 HG22 ILE C 20 1.070 1.164 -3.161 1.00 0.00 H new ATOM 0 HG23 ILE C 20 1.583 -0.453 -2.624 1.00 0.00 H new ATOM 0 HD11 ILE C 20 4.422 -1.550 -0.548 1.00 0.00 H new ATOM 0 HD12 ILE C 20 2.804 -1.467 -1.284 1.00 0.00 H new ATOM 0 HD13 ILE C 20 4.251 -1.505 -2.319 1.00 0.00 H new ATOM 1955 N THR C 21 1.964 1.342 -5.533 1.00 0.00 N ATOM 1956 CA THR C 21 1.399 2.127 -6.624 1.00 0.00 C ATOM 1957 C THR C 21 -0.124 2.170 -6.551 1.00 0.00 C ATOM 1958 O THR C 21 -0.755 1.240 -6.057 1.00 0.00 O ATOM 1959 CB THR C 21 1.846 1.508 -7.954 1.00 0.00 C ATOM 1960 OG1 THR C 21 3.246 1.316 -7.949 1.00 0.00 O ATOM 1961 CG2 THR C 21 1.496 2.407 -9.140 1.00 0.00 C ATOM 0 H THR C 21 1.442 0.496 -5.305 1.00 0.00 H new ATOM 0 HA THR C 21 1.758 3.153 -6.544 1.00 0.00 H new ATOM 0 HB THR C 21 1.323 0.557 -8.060 1.00 0.00 H new ATOM 0 HG1 THR C 21 3.525 0.919 -8.801 1.00 0.00 H new ATOM 0 HG21 THR C 21 1.828 1.935 -10.065 1.00 0.00 H new ATOM 0 HG22 THR C 21 0.417 2.557 -9.177 1.00 0.00 H new ATOM 0 HG23 THR C 21 1.993 3.370 -9.025 1.00 0.00 H new ATOM 1969 N ILE C 22 -0.713 3.265 -7.051 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.156 3.456 -7.130 1.00 0.00 C ATOM 1971 C ILE C 22 -2.565 3.382 -8.599 1.00 0.00 C ATOM 1972 O ILE C 22 -2.551 4.373 -9.326 1.00 0.00 O ATOM 1973 CB ILE C 22 -2.565 4.767 -6.433 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -4.035 5.135 -6.674 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -1.681 5.945 -6.853 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -4.977 4.064 -6.126 1.00 0.00 C ATOM 0 H ILE C 22 -0.183 4.055 -7.418 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.690 2.670 -6.597 1.00 0.00 H new ATOM 0 HB ILE C 22 -2.426 4.577 -5.369 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -4.254 6.091 -6.199 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -4.209 5.262 -7.742 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -2.007 6.847 -6.336 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -0.644 5.733 -6.593 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -1.762 6.095 -7.930 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -6.010 4.357 -6.314 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -4.774 3.114 -6.620 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -4.820 3.956 -5.053 1.00 0.00 H new ATOM 1988 N LEU C 23 -2.919 2.171 -9.031 1.00 0.00 N ATOM 1989 CA LEU C 23 -3.182 1.877 -10.431 1.00 0.00 C ATOM 1990 C LEU C 23 -4.482 2.511 -10.918 1.00 0.00 C ATOM 1991 O LEU C 23 -4.640 2.743 -12.114 1.00 0.00 O ATOM 1992 CB LEU C 23 -3.249 0.360 -10.606 1.00 0.00 C ATOM 1993 CG LEU C 23 -2.025 -0.343 -10.017 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -2.209 -1.847 -10.182 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -0.726 0.068 -10.704 1.00 0.00 C ATOM 0 H LEU C 23 -3.030 1.367 -8.414 1.00 0.00 H new ATOM 0 HA LEU C 23 -2.375 2.300 -11.028 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -4.151 -0.020 -10.126 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -3.328 0.121 -11.667 1.00 0.00 H new ATOM 0 HG LEU C 23 -1.948 -0.056 -8.968 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -1.345 -2.367 -9.768 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -3.110 -2.163 -9.656 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -2.304 -2.088 -11.241 1.00 0.00 H new ATOM 0 HD21 LEU C 23 0.110 -0.461 -10.247 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -0.779 -0.184 -11.763 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -0.580 1.143 -10.593 1.00 0.00 H new ATOM 2007 N GLY C 24 -5.412 2.792 -10.002 1.00 0.00 N ATOM 2008 CA GLY C 24 -6.661 3.445 -10.361 1.00 0.00 C ATOM 2009 C GLY C 24 -7.697 3.403 -9.249 1.00 0.00 C ATOM 2010 O GLY C 24 -7.427 2.939 -8.142 1.00 0.00 O ATOM 0 H GLY C 24 -5.319 2.576 -9.010 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -6.459 4.484 -10.622 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -7.072 2.967 -11.250 1.00 0.00 H new ATOM 2014 N VAL C 25 -8.898 3.895 -9.561 1.00 0.00 N ATOM 2015 CA VAL C 25 -10.007 3.968 -8.620 1.00 0.00 C ATOM 2016 C VAL C 25 -11.270 3.416 -9.274 1.00 0.00 C ATOM 2017 O VAL C 25 -11.367 3.369 -10.501 1.00 0.00 O ATOM 2018 CB VAL C 25 -10.221 5.412 -8.147 1.00 0.00 C ATOM 2019 CG1 VAL C 25 -8.979 5.950 -7.441 1.00 0.00 C ATOM 2020 CG2 VAL C 25 -10.554 6.340 -9.319 1.00 0.00 C ATOM 0 H VAL C 25 -9.126 4.257 -10.487 1.00 0.00 H new ATOM 0 HA VAL C 25 -9.772 3.363 -7.744 1.00 0.00 H new ATOM 0 HB VAL C 25 -11.059 5.392 -7.451 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -9.160 6.975 -7.117 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -8.756 5.329 -6.573 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -8.133 5.931 -8.128 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -10.700 7.355 -8.949 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -9.733 6.329 -10.036 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -11.467 5.997 -9.807 1.00 0.00 H new ATOM 2030 N SER C 26 -12.227 3.001 -8.443 1.00 0.00 N ATOM 2031 CA SER C 26 -13.471 2.387 -8.883 1.00 0.00 C ATOM 2032 C SER C 26 -14.576 2.748 -7.894 1.00 0.00 C ATOM 2033 O SER C 26 -15.273 1.875 -7.381 1.00 0.00 O ATOM 2034 CB SER C 26 -13.287 0.868 -8.964 1.00 0.00 C ATOM 2035 OG SER C 26 -12.384 0.542 -10.002 1.00 0.00 O ATOM 0 H SER C 26 -12.154 3.086 -7.429 1.00 0.00 H new ATOM 0 HA SER C 26 -13.747 2.754 -9.872 1.00 0.00 H new ATOM 0 HB2 SER C 26 -12.913 0.488 -8.013 1.00 0.00 H new ATOM 0 HB3 SER C 26 -14.248 0.387 -9.143 1.00 0.00 H new ATOM 0 HG SER C 26 -12.272 -0.431 -10.045 1.00 0.00 H new ATOM 2041 N GLY C 27 -14.743 4.046 -7.628 1.00 0.00 N ATOM 2042 CA GLY C 27 -15.722 4.508 -6.663 1.00 0.00 C ATOM 2043 C GLY C 27 -15.214 4.224 -5.257 1.00 0.00 C ATOM 2044 O GLY C 27 -14.088 4.595 -4.919 1.00 0.00 O ATOM 0 H GLY C 27 -14.207 4.791 -8.073 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -15.899 5.576 -6.790 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -16.676 4.006 -6.826 1.00 0.00 H new ATOM 2048 N GLN C 28 -16.037 3.565 -4.435 1.00 0.00 N ATOM 2049 CA GLN C 28 -15.643 3.173 -3.089 1.00 0.00 C ATOM 2050 C GLN C 28 -14.554 2.091 -3.142 1.00 0.00 C ATOM 2051 O GLN C 28 -13.934 1.792 -2.124 1.00 0.00 O ATOM 2052 CB GLN C 28 -16.884 2.687 -2.334 1.00 0.00 C ATOM 2053 CG GLN C 28 -16.589 2.485 -0.844 1.00 0.00 C ATOM 2054 CD GLN C 28 -17.837 2.120 -0.050 1.00 0.00 C ATOM 2055 OE1 GLN C 28 -18.963 2.259 -0.518 1.00 0.00 O ATOM 2056 NE2 GLN C 28 -17.640 1.644 1.177 1.00 0.00 N ATOM 0 H GLN C 28 -16.987 3.293 -4.687 1.00 0.00 H new ATOM 0 HA GLN C 28 -15.221 4.027 -2.560 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -17.690 3.411 -2.452 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -17.232 1.749 -2.768 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -15.844 1.698 -0.727 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -16.155 3.398 -0.435 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -16.692 1.540 1.538 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -18.437 1.383 1.757 1.00 0.00 H new ATOM 2065 N GLN C 29 -14.319 1.503 -4.324 1.00 0.00 N ATOM 2066 CA GLN C 29 -13.279 0.504 -4.513 1.00 0.00 C ATOM 2067 C GLN C 29 -12.031 1.164 -5.091 1.00 0.00 C ATOM 2068 O GLN C 29 -12.095 2.257 -5.654 1.00 0.00 O ATOM 2069 CB GLN C 29 -13.756 -0.592 -5.470 1.00 0.00 C ATOM 2070 CG GLN C 29 -15.021 -1.310 -5.001 1.00 0.00 C ATOM 2071 CD GLN C 29 -15.321 -2.477 -5.926 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -15.994 -2.329 -6.942 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -14.818 -3.657 -5.577 1.00 0.00 N ATOM 0 H GLN C 29 -14.849 1.712 -5.170 1.00 0.00 H new ATOM 0 HA GLN C 29 -13.048 0.057 -3.546 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -13.941 -0.151 -6.450 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -12.959 -1.324 -5.596 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -14.890 -1.668 -3.980 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -15.862 -0.616 -4.991 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -14.263 -3.743 -4.726 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -14.987 -4.476 -6.161 1.00 0.00 H new ATOM 2082 N VAL C 30 -10.889 0.487 -4.947 1.00 0.00 N ATOM 2083 CA VAL C 30 -9.592 0.997 -5.378 1.00 0.00 C ATOM 2084 C VAL C 30 -8.718 -0.136 -5.914 1.00 0.00 C ATOM 2085 O VAL C 30 -8.816 -1.274 -5.453 1.00 0.00 O ATOM 2086 CB VAL C 30 -8.908 1.686 -4.190 1.00 0.00 C ATOM 2087 CG1 VAL C 30 -7.512 2.160 -4.565 1.00 0.00 C ATOM 2088 CG2 VAL C 30 -9.706 2.910 -3.727 1.00 0.00 C ATOM 0 H VAL C 30 -10.842 -0.440 -4.523 1.00 0.00 H new ATOM 0 HA VAL C 30 -9.736 1.717 -6.184 1.00 0.00 H new ATOM 0 HB VAL C 30 -8.854 0.949 -3.389 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -7.049 2.645 -3.705 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -6.907 1.306 -4.869 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -7.578 2.870 -5.390 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.198 3.378 -2.884 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -9.784 3.625 -4.546 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -10.705 2.599 -3.421 1.00 0.00 H new ATOM 2098 N ARG C 31 -7.858 0.184 -6.887 1.00 0.00 N ATOM 2099 CA ARG C 31 -6.911 -0.741 -7.495 1.00 0.00 C ATOM 2100 C ARG C 31 -5.500 -0.269 -7.166 1.00 0.00 C ATOM 2101 O ARG C 31 -5.092 0.820 -7.562 1.00 0.00 O ATOM 2102 CB ARG C 31 -7.130 -0.768 -9.015 1.00 0.00 C ATOM 2103 CG ARG C 31 -7.710 -2.102 -9.496 1.00 0.00 C ATOM 2104 CD ARG C 31 -6.653 -3.209 -9.519 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.251 -4.495 -9.906 1.00 0.00 N ATOM 2106 CZ ARG C 31 -7.604 -4.833 -11.149 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -7.361 -4.036 -12.183 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -8.215 -5.992 -11.378 1.00 0.00 N ATOM 0 H ARG C 31 -7.805 1.123 -7.281 1.00 0.00 H new ATOM 0 HA ARG C 31 -7.056 -1.749 -7.107 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -7.804 0.041 -9.297 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.182 -0.584 -9.520 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -8.531 -2.398 -8.843 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -8.127 -1.977 -10.495 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -5.860 -2.946 -10.219 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -6.192 -3.299 -8.535 1.00 0.00 H new ATOM 0 HE ARG C 31 -7.408 -5.182 -9.169 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -6.894 -3.141 -12.038 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -7.641 -4.319 -13.122 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -8.415 -6.625 -10.603 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -8.484 -6.248 -12.328 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.750 -1.099 -6.439 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.409 -0.770 -5.978 1.00 0.00 C ATOM 2124 C ILE C 32 -2.489 -1.968 -6.164 1.00 0.00 C ATOM 2125 O ILE C 32 -2.948 -3.103 -6.254 1.00 0.00 O ATOM 2126 CB ILE C 32 -3.428 -0.351 -4.502 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -4.350 -1.266 -3.678 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -3.859 1.111 -4.386 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -4.215 -0.969 -2.187 1.00 0.00 C ATOM 0 H ILE C 32 -5.064 -2.027 -6.153 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.037 0.067 -6.569 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.422 -0.454 -4.096 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.385 -1.123 -3.990 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -4.100 -2.310 -3.870 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -3.871 1.405 -3.336 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.157 1.742 -4.931 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -4.857 1.231 -4.808 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -4.876 -1.628 -1.624 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -3.184 -1.136 -1.875 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -4.488 0.069 -1.997 1.00 0.00 H new ATOM 2141 N GLY C 33 -1.182 -1.707 -6.220 1.00 0.00 N ATOM 2142 CA GLY C 33 -0.196 -2.751 -6.420 1.00 0.00 C ATOM 2143 C GLY C 33 0.978 -2.588 -5.466 1.00 0.00 C ATOM 2144 O GLY C 33 1.136 -1.549 -4.827 1.00 0.00 O ATOM 0 H GLY C 33 -0.787 -0.771 -6.128 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -0.659 -3.726 -6.268 1.00 0.00 H new ATOM 0 HA3 GLY C 33 0.162 -2.725 -7.449 1.00 0.00 H new ATOM 2148 N ILE C 34 1.801 -3.634 -5.379 1.00 0.00 N ATOM 2149 CA ILE C 34 2.936 -3.699 -4.477 1.00 0.00 C ATOM 2150 C ILE C 34 4.112 -4.272 -5.262 1.00 0.00 C ATOM 2151 O ILE C 34 3.937 -5.175 -6.077 1.00 0.00 O ATOM 2152 CB ILE C 34 2.620 -4.614 -3.276 1.00 0.00 C ATOM 2153 CG1 ILE C 34 1.451 -4.098 -2.424 1.00 0.00 C ATOM 2154 CG2 ILE C 34 3.856 -4.717 -2.380 1.00 0.00 C ATOM 2155 CD1 ILE C 34 0.098 -4.617 -2.918 1.00 0.00 C ATOM 0 H ILE C 34 1.689 -4.473 -5.948 1.00 0.00 H new ATOM 0 HA ILE C 34 3.168 -2.706 -4.093 1.00 0.00 H new ATOM 0 HB ILE C 34 2.337 -5.585 -3.683 1.00 0.00 H new ATOM 0 HG12 ILE C 34 1.598 -4.402 -1.388 1.00 0.00 H new ATOM 0 HG13 ILE C 34 1.447 -3.008 -2.439 1.00 0.00 H new ATOM 0 HG21 ILE C 34 3.636 -5.363 -1.530 1.00 0.00 H new ATOM 0 HG22 ILE C 34 4.685 -5.137 -2.950 1.00 0.00 H new ATOM 0 HG23 ILE C 34 4.129 -3.725 -2.021 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -0.696 -4.224 -2.283 1.00 0.00 H new ATOM 0 HD12 ILE C 34 -0.064 -4.291 -3.945 1.00 0.00 H new ATOM 0 HD13 ILE C 34 0.089 -5.706 -2.878 1.00 0.00 H new ATOM 2167 N ASN C 35 5.308 -3.739 -5.013 1.00 0.00 N ATOM 2168 CA ASN C 35 6.504 -4.133 -5.730 1.00 0.00 C ATOM 2169 C ASN C 35 7.631 -4.373 -4.736 1.00 0.00 C ATOM 2170 O ASN C 35 8.564 -3.582 -4.603 1.00 0.00 O ATOM 2171 CB ASN C 35 6.839 -3.072 -6.773 1.00 0.00 C ATOM 2172 CG ASN C 35 7.763 -3.607 -7.858 1.00 0.00 C ATOM 2173 OD1 ASN C 35 8.625 -4.445 -7.604 1.00 0.00 O ATOM 2174 ND2 ASN C 35 7.587 -3.123 -9.082 1.00 0.00 N ATOM 0 H ASN C 35 5.467 -3.021 -4.306 1.00 0.00 H new ATOM 0 HA ASN C 35 6.348 -5.069 -6.266 1.00 0.00 H new ATOM 0 HB2 ASN C 35 5.918 -2.709 -7.229 1.00 0.00 H new ATOM 0 HB3 ASN C 35 7.310 -2.220 -6.284 1.00 0.00 H new ATOM 0 HD21 ASN C 35 8.178 -3.446 -9.848 1.00 0.00 H new ATOM 0 HD22 ASN C 35 6.861 -2.428 -9.256 1.00 0.00 H new ATOM 2181 N ALA C 36 7.506 -5.501 -4.043 1.00 0.00 N ATOM 2182 CA ALA C 36 8.470 -6.019 -3.084 1.00 0.00 C ATOM 2183 C ALA C 36 8.990 -7.350 -3.626 1.00 0.00 C ATOM 2184 O ALA C 36 8.339 -7.963 -4.472 1.00 0.00 O ATOM 2185 CB ALA C 36 7.765 -6.221 -1.744 1.00 0.00 C ATOM 0 H ALA C 36 6.690 -6.106 -4.141 1.00 0.00 H new ATOM 0 HA ALA C 36 9.303 -5.331 -2.939 1.00 0.00 H new ATOM 0 HB1 ALA C 36 8.475 -6.609 -1.014 1.00 0.00 H new ATOM 0 HB2 ALA C 36 7.369 -5.268 -1.394 1.00 0.00 H new ATOM 0 HB3 ALA C 36 6.947 -6.930 -1.867 1.00 0.00 H new ATOM 2191 N PRO C 37 10.153 -7.811 -3.155 1.00 0.00 N ATOM 2192 CA PRO C 37 10.714 -9.070 -3.594 1.00 0.00 C ATOM 2193 C PRO C 37 9.896 -10.202 -2.994 1.00 0.00 C ATOM 2194 O PRO C 37 9.303 -10.050 -1.927 1.00 0.00 O ATOM 2195 CB PRO C 37 12.151 -9.065 -3.070 1.00 0.00 C ATOM 2196 CG PRO C 37 12.059 -8.210 -1.808 1.00 0.00 C ATOM 2197 CD PRO C 37 11.006 -7.171 -2.173 1.00 0.00 C ATOM 0 HA PRO C 37 10.700 -9.204 -4.676 1.00 0.00 H new ATOM 0 HB2 PRO C 37 12.503 -10.073 -2.849 1.00 0.00 H new ATOM 0 HB3 PRO C 37 12.843 -8.638 -3.796 1.00 0.00 H new ATOM 0 HG2 PRO C 37 11.760 -8.800 -0.942 1.00 0.00 H new ATOM 0 HG3 PRO C 37 13.015 -7.747 -1.564 1.00 0.00 H new ATOM 0 HD2 PRO C 37 10.435 -6.867 -1.296 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.467 -6.272 -2.581 1.00 0.00 H new ATOM 2205 N LYS C 38 9.854 -11.351 -3.671 1.00 0.00 N ATOM 2206 CA LYS C 38 9.132 -12.502 -3.151 1.00 0.00 C ATOM 2207 C LYS C 38 9.868 -13.099 -1.954 1.00 0.00 C ATOM 2208 O LYS C 38 9.404 -14.065 -1.356 1.00 0.00 O ATOM 2209 CB LYS C 38 8.888 -13.513 -4.271 1.00 0.00 C ATOM 2210 CG LYS C 38 8.056 -12.794 -5.340 1.00 0.00 C ATOM 2211 CD LYS C 38 7.562 -13.722 -6.446 1.00 0.00 C ATOM 2212 CE LYS C 38 6.652 -14.818 -5.881 1.00 0.00 C ATOM 2213 NZ LYS C 38 6.082 -15.644 -6.959 1.00 0.00 N ATOM 0 H LYS C 38 10.308 -11.504 -4.571 1.00 0.00 H new ATOM 0 HA LYS C 38 8.154 -12.190 -2.785 1.00 0.00 H new ATOM 0 HB2 LYS C 38 9.832 -13.865 -4.687 1.00 0.00 H new ATOM 0 HB3 LYS C 38 8.360 -14.389 -3.894 1.00 0.00 H new ATOM 0 HG2 LYS C 38 7.198 -12.319 -4.864 1.00 0.00 H new ATOM 0 HG3 LYS C 38 8.656 -11.999 -5.783 1.00 0.00 H new ATOM 0 HD2 LYS C 38 7.019 -13.144 -7.194 1.00 0.00 H new ATOM 0 HD3 LYS C 38 8.414 -14.177 -6.951 1.00 0.00 H new ATOM 0 HE2 LYS C 38 7.220 -15.449 -5.197 1.00 0.00 H new ATOM 0 HE3 LYS C 38 5.847 -14.364 -5.303 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 5.470 -16.378 -6.548 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 5.522 -15.044 -7.597 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 6.851 -16.095 -7.495 1.00 0.00 H new ATOM 2227 N ASP C 39 11.018 -12.516 -1.608 1.00 0.00 N ATOM 2228 CA ASP C 39 11.752 -12.843 -0.396 1.00 0.00 C ATOM 2229 C ASP C 39 11.020 -12.302 0.833 1.00 0.00 C ATOM 2230 O ASP C 39 11.349 -12.685 1.954 1.00 0.00 O ATOM 2231 CB ASP C 39 13.163 -12.261 -0.481 1.00 0.00 C ATOM 2232 CG ASP C 39 13.957 -12.899 -1.616 1.00 0.00 C ATOM 2233 OD1 ASP C 39 14.501 -14.004 -1.390 1.00 0.00 O ATOM 2234 OD2 ASP C 39 14.011 -12.275 -2.699 1.00 0.00 O ATOM 0 H ASP C 39 11.467 -11.795 -2.173 1.00 0.00 H new ATOM 0 HA ASP C 39 11.820 -13.927 -0.299 1.00 0.00 H new ATOM 0 HB2 ASP C 39 13.106 -11.183 -0.635 1.00 0.00 H new ATOM 0 HB3 ASP C 39 13.682 -12.421 0.464 1.00 0.00 H new ATOM 2239 N VAL C 40 10.033 -11.416 0.638 1.00 0.00 N ATOM 2240 CA VAL C 40 9.185 -10.955 1.724 1.00 0.00 C ATOM 2241 C VAL C 40 7.710 -11.161 1.381 1.00 0.00 C ATOM 2242 O VAL C 40 7.286 -11.038 0.230 1.00 0.00 O ATOM 2243 CB VAL C 40 9.475 -9.491 2.083 1.00 0.00 C ATOM 2244 CG1 VAL C 40 10.956 -9.300 2.420 1.00 0.00 C ATOM 2245 CG2 VAL C 40 9.090 -8.532 0.957 1.00 0.00 C ATOM 0 H VAL C 40 9.809 -11.008 -0.270 1.00 0.00 H new ATOM 0 HA VAL C 40 9.415 -11.554 2.605 1.00 0.00 H new ATOM 0 HB VAL C 40 8.863 -9.257 2.954 1.00 0.00 H new ATOM 0 HG11 VAL C 40 11.140 -8.256 2.672 1.00 0.00 H new ATOM 0 HG12 VAL C 40 11.220 -9.930 3.270 1.00 0.00 H new ATOM 0 HG13 VAL C 40 11.564 -9.578 1.559 1.00 0.00 H new ATOM 0 HG21 VAL C 40 9.314 -7.509 1.258 1.00 0.00 H new ATOM 0 HG22 VAL C 40 9.657 -8.778 0.059 1.00 0.00 H new ATOM 0 HG23 VAL C 40 8.024 -8.624 0.749 1.00 0.00 H new ATOM 2255 N ALA C 41 6.929 -11.482 2.413 1.00 0.00 N ATOM 2256 CA ALA C 41 5.510 -11.761 2.292 1.00 0.00 C ATOM 2257 C ALA C 41 4.728 -10.510 1.902 1.00 0.00 C ATOM 2258 O ALA C 41 5.066 -9.405 2.327 1.00 0.00 O ATOM 2259 CB ALA C 41 5.012 -12.301 3.630 1.00 0.00 C ATOM 0 H ALA C 41 7.277 -11.555 3.369 1.00 0.00 H new ATOM 0 HA ALA C 41 5.354 -12.498 1.504 1.00 0.00 H new ATOM 0 HB1 ALA C 41 3.946 -12.518 3.561 1.00 0.00 H new ATOM 0 HB2 ALA C 41 5.553 -13.215 3.878 1.00 0.00 H new ATOM 0 HB3 ALA C 41 5.181 -11.557 4.408 1.00 0.00 H new ATOM 2265 N VAL C 42 3.685 -10.691 1.089 1.00 0.00 N ATOM 2266 CA VAL C 42 2.783 -9.626 0.680 1.00 0.00 C ATOM 2267 C VAL C 42 1.390 -10.226 0.503 1.00 0.00 C ATOM 2268 O VAL C 42 1.194 -11.072 -0.370 1.00 0.00 O ATOM 2269 CB VAL C 42 3.264 -9.007 -0.639 1.00 0.00 C ATOM 2270 CG1 VAL C 42 2.325 -7.887 -1.066 1.00 0.00 C ATOM 2271 CG2 VAL C 42 4.665 -8.406 -0.525 1.00 0.00 C ATOM 0 H VAL C 42 3.444 -11.599 0.693 1.00 0.00 H new ATOM 0 HA VAL C 42 2.760 -8.841 1.435 1.00 0.00 H new ATOM 0 HB VAL C 42 3.279 -9.817 -1.369 1.00 0.00 H new ATOM 0 HG11 VAL C 42 2.676 -7.455 -2.003 1.00 0.00 H new ATOM 0 HG12 VAL C 42 1.321 -8.287 -1.205 1.00 0.00 H new ATOM 0 HG13 VAL C 42 2.305 -7.116 -0.296 1.00 0.00 H new ATOM 0 HG21 VAL C 42 4.958 -7.981 -1.485 1.00 0.00 H new ATOM 0 HG22 VAL C 42 4.664 -7.623 0.233 1.00 0.00 H new ATOM 0 HG23 VAL C 42 5.373 -9.185 -0.242 1.00 0.00 H new ATOM 2281 N HIS C 43 0.440 -9.779 1.332 1.00 0.00 N ATOM 2282 CA HIS C 43 -0.924 -10.304 1.372 1.00 0.00 C ATOM 2283 C HIS C 43 -1.896 -9.199 1.784 1.00 0.00 C ATOM 2284 O HIS C 43 -1.464 -8.089 2.101 1.00 0.00 O ATOM 2285 CB HIS C 43 -1.005 -11.436 2.400 1.00 0.00 C ATOM 2286 CG HIS C 43 -0.011 -12.552 2.207 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -0.273 -13.761 1.564 1.00 0.00 N ATOM 2288 CD2 HIS C 43 1.286 -12.549 2.641 1.00 0.00 C ATOM 2289 CE1 HIS C 43 0.872 -14.457 1.626 1.00 0.00 C ATOM 2290 NE2 HIS C 43 1.824 -13.758 2.266 1.00 0.00 N ATOM 0 H HIS C 43 0.603 -9.029 2.004 1.00 0.00 H new ATOM 0 HA HIS C 43 -1.188 -10.676 0.382 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -0.863 -11.013 3.394 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -2.010 -11.858 2.374 1.00 0.00 H new ATOM 0 HD2 HIS C 43 1.788 -11.755 3.173 1.00 0.00 H new ATOM 0 HE1 HIS C 43 1.010 -15.447 1.216 1.00 0.00 H new ATOM 0 HE2 HIS C 43 2.779 -14.069 2.443 1.00 0.00 H new ATOM 2298 N ARG C 44 -3.205 -9.486 1.785 1.00 0.00 N ATOM 2299 CA ARG C 44 -4.191 -8.503 2.221 1.00 0.00 C ATOM 2300 C ARG C 44 -4.584 -8.743 3.678 1.00 0.00 C ATOM 2301 O ARG C 44 -4.463 -9.860 4.171 1.00 0.00 O ATOM 2302 CB ARG C 44 -5.389 -8.440 1.264 1.00 0.00 C ATOM 2303 CG ARG C 44 -6.566 -9.392 1.504 1.00 0.00 C ATOM 2304 CD ARG C 44 -6.404 -10.785 0.896 1.00 0.00 C ATOM 2305 NE ARG C 44 -7.702 -11.474 0.878 1.00 0.00 N ATOM 2306 CZ ARG C 44 -8.032 -12.474 0.056 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -7.165 -12.951 -0.836 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -9.249 -13.003 0.132 1.00 0.00 N ATOM 0 H ARG C 44 -3.597 -10.381 1.492 1.00 0.00 H new ATOM 0 HA ARG C 44 -3.737 -7.513 2.182 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -5.777 -7.421 1.284 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -5.017 -8.620 0.255 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -6.716 -9.496 2.579 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -7.470 -8.938 1.098 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -6.010 -10.706 -0.117 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -5.683 -11.363 1.474 1.00 0.00 H new ATOM 0 HE ARG C 44 -8.407 -11.164 1.547 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -6.228 -12.552 -0.901 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -7.438 -13.715 -1.454 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -9.919 -12.645 0.813 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -9.513 -13.767 -0.490 1.00 0.00 H new ATOM 2322 N GLU C 45 -5.054 -7.704 4.376 1.00 0.00 N ATOM 2323 CA GLU C 45 -5.328 -7.792 5.810 1.00 0.00 C ATOM 2324 C GLU C 45 -6.413 -8.814 6.134 1.00 0.00 C ATOM 2325 O GLU C 45 -6.470 -9.333 7.247 1.00 0.00 O ATOM 2326 CB GLU C 45 -5.678 -6.405 6.363 1.00 0.00 C ATOM 2327 CG GLU C 45 -7.070 -5.911 5.951 1.00 0.00 C ATOM 2328 CD GLU C 45 -8.186 -6.477 6.832 1.00 0.00 C ATOM 2329 OE1 GLU C 45 -8.044 -6.398 8.072 1.00 0.00 O ATOM 2330 OE2 GLU C 45 -9.173 -6.989 6.257 1.00 0.00 O ATOM 0 H GLU C 45 -5.252 -6.791 3.968 1.00 0.00 H new ATOM 0 HA GLU C 45 -4.422 -8.147 6.301 1.00 0.00 H new ATOM 0 HB2 GLU C 45 -5.619 -6.432 7.451 1.00 0.00 H new ATOM 0 HB3 GLU C 45 -4.932 -5.688 6.021 1.00 0.00 H new ATOM 0 HG2 GLU C 45 -7.093 -4.822 5.999 1.00 0.00 H new ATOM 0 HG3 GLU C 45 -7.256 -6.189 4.914 1.00 0.00 H new ATOM 2337 N GLU C 46 -7.274 -9.108 5.156 1.00 0.00 N ATOM 2338 CA GLU C 46 -8.346 -10.083 5.283 1.00 0.00 C ATOM 2339 C GLU C 46 -7.786 -11.497 5.439 1.00 0.00 C ATOM 2340 O GLU C 46 -8.522 -12.421 5.775 1.00 0.00 O ATOM 2341 CB GLU C 46 -9.199 -9.979 4.018 1.00 0.00 C ATOM 2342 CG GLU C 46 -10.483 -10.803 4.048 1.00 0.00 C ATOM 2343 CD GLU C 46 -11.189 -10.671 2.703 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -11.863 -9.636 2.500 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -11.045 -11.610 1.886 1.00 0.00 O ATOM 0 H GLU C 46 -7.240 -8.663 4.239 1.00 0.00 H new ATOM 0 HA GLU C 46 -8.943 -9.879 6.172 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -9.458 -8.933 3.855 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -8.600 -10.295 3.164 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -10.254 -11.849 4.252 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -11.134 -10.457 4.851 1.00 0.00 H new ATOM 2352 N ILE C 47 -6.482 -11.676 5.191 1.00 0.00 N ATOM 2353 CA ILE C 47 -5.860 -12.985 5.181 1.00 0.00 C ATOM 2354 C ILE C 47 -4.514 -12.978 5.897 1.00 0.00 C ATOM 2355 O ILE C 47 -4.089 -14.019 6.384 1.00 0.00 O ATOM 2356 CB ILE C 47 -5.715 -13.429 3.717 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -6.986 -14.169 3.286 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -4.465 -14.278 3.475 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -6.803 -14.844 1.929 1.00 0.00 C ATOM 0 H ILE C 47 -5.838 -10.910 4.993 1.00 0.00 H new ATOM 0 HA ILE C 47 -6.486 -13.692 5.725 1.00 0.00 H new ATOM 0 HB ILE C 47 -5.588 -12.536 3.105 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -7.245 -14.918 4.035 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.818 -13.467 3.236 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -4.416 -14.562 2.424 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -3.578 -13.702 3.737 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -4.510 -15.176 4.092 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.722 -15.360 1.652 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -6.569 -14.091 1.177 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -5.987 -15.564 1.988 1.00 0.00 H new ATOM 2371 N TYR C 48 -3.817 -11.843 5.982 1.00 0.00 N ATOM 2372 CA TYR C 48 -2.503 -11.857 6.600 1.00 0.00 C ATOM 2373 C TYR C 48 -2.603 -12.277 8.064 1.00 0.00 C ATOM 2374 O TYR C 48 -1.701 -12.910 8.606 1.00 0.00 O ATOM 2375 CB TYR C 48 -1.856 -10.483 6.481 1.00 0.00 C ATOM 2376 CG TYR C 48 -0.490 -10.484 7.119 1.00 0.00 C ATOM 2377 CD1 TYR C 48 0.638 -10.826 6.359 1.00 0.00 C ATOM 2378 CD2 TYR C 48 -0.362 -10.160 8.477 1.00 0.00 C ATOM 2379 CE1 TYR C 48 1.902 -10.851 6.958 1.00 0.00 C ATOM 2380 CE2 TYR C 48 0.899 -10.181 9.081 1.00 0.00 C ATOM 2381 CZ TYR C 48 2.040 -10.514 8.320 1.00 0.00 C ATOM 2382 OH TYR C 48 3.272 -10.514 8.897 1.00 0.00 O ATOM 0 H TYR C 48 -4.132 -10.935 5.642 1.00 0.00 H new ATOM 0 HA TYR C 48 -1.880 -12.584 6.080 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -1.773 -10.204 5.431 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -2.487 -9.735 6.961 1.00 0.00 H new ATOM 0 HD1 TYR C 48 0.531 -11.070 5.312 1.00 0.00 H new ATOM 0 HD2 TYR C 48 -1.235 -9.895 9.055 1.00 0.00 H new ATOM 0 HE1 TYR C 48 2.770 -11.128 6.378 1.00 0.00 H new ATOM 0 HE2 TYR C 48 1.000 -9.942 10.129 1.00 0.00 H new ATOM 0 HH TYR C 48 3.942 -10.241 8.237 1.00 0.00 H new ATOM 2392 N GLN C 49 -3.715 -11.915 8.703 1.00 0.00 N ATOM 2393 CA GLN C 49 -3.948 -12.218 10.103 1.00 0.00 C ATOM 2394 C GLN C 49 -4.270 -13.698 10.294 1.00 0.00 C ATOM 2395 O GLN C 49 -4.247 -14.193 11.417 1.00 0.00 O ATOM 2396 CB GLN C 49 -5.086 -11.331 10.606 1.00 0.00 C ATOM 2397 CG GLN C 49 -4.731 -9.869 10.338 1.00 0.00 C ATOM 2398 CD GLN C 49 -5.816 -8.928 10.844 1.00 0.00 C ATOM 2399 OE1 GLN C 49 -5.918 -8.671 12.040 1.00 0.00 O ATOM 2400 NE2 GLN C 49 -6.637 -8.409 9.931 1.00 0.00 N ATOM 0 H GLN C 49 -4.477 -11.403 8.258 1.00 0.00 H new ATOM 0 HA GLN C 49 -3.047 -12.014 10.681 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -6.017 -11.591 10.102 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -5.245 -11.491 11.672 1.00 0.00 H new ATOM 0 HG2 GLN C 49 -3.785 -9.629 10.823 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -4.588 -9.719 9.268 1.00 0.00 H new ATOM 0 HE21 GLN C 49 -6.520 -8.647 8.946 1.00 0.00 H new ATOM 0 HE22 GLN C 49 -7.382 -7.774 10.217 1.00 0.00 H new ATOM 2409 N ARG C 50 -4.569 -14.405 9.197 1.00 0.00 N ATOM 2410 CA ARG C 50 -4.834 -15.839 9.236 1.00 0.00 C ATOM 2411 C ARG C 50 -3.552 -16.617 8.953 1.00 0.00 C ATOM 2412 O ARG C 50 -3.405 -17.743 9.418 1.00 0.00 O ATOM 2413 CB ARG C 50 -5.974 -16.183 8.265 1.00 0.00 C ATOM 2414 CG ARG C 50 -5.508 -16.815 6.948 1.00 0.00 C ATOM 2415 CD ARG C 50 -6.689 -16.949 5.990 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.673 -17.927 6.474 1.00 0.00 N ATOM 2417 CZ ARG C 50 -8.816 -18.209 5.849 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -9.143 -17.608 4.712 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -9.650 -19.109 6.366 1.00 0.00 N ATOM 0 H ARG C 50 -4.633 -13.997 8.264 1.00 0.00 H new ATOM 0 HA ARG C 50 -5.164 -16.133 10.232 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -6.663 -16.867 8.760 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -6.533 -15.274 8.041 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -4.729 -16.201 6.495 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -5.071 -17.795 7.139 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -7.170 -15.979 5.868 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -6.328 -17.252 5.007 1.00 0.00 H new ATOM 0 HE ARG C 50 -7.469 -18.421 7.343 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -8.515 -16.917 4.302 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -10.022 -17.837 4.248 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -9.414 -19.581 7.239 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -10.525 -19.326 5.889 1.00 0.00 H new ATOM 2433 N ILE C 51 -2.625 -16.017 8.199 1.00 0.00 N ATOM 2434 CA ILE C 51 -1.321 -16.608 7.921 1.00 0.00 C ATOM 2435 C ILE C 51 -0.487 -16.580 9.195 1.00 0.00 C ATOM 2436 O ILE C 51 0.096 -17.583 9.595 1.00 0.00 O ATOM 2437 CB ILE C 51 -0.635 -15.799 6.819 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -1.426 -15.925 5.515 1.00 0.00 C ATOM 2439 CG2 ILE C 51 0.800 -16.281 6.577 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -0.905 -14.939 4.479 1.00 0.00 C ATOM 0 H ILE C 51 -2.763 -15.104 7.765 1.00 0.00 H new ATOM 0 HA ILE C 51 -1.432 -17.640 7.589 1.00 0.00 H new ATOM 0 HB ILE C 51 -0.602 -14.759 7.144 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -1.346 -16.942 5.131 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -2.483 -15.738 5.704 1.00 0.00 H new ATOM 0 HG21 ILE C 51 1.256 -15.684 5.788 1.00 0.00 H new ATOM 0 HG22 ILE C 51 1.379 -16.174 7.494 1.00 0.00 H new ATOM 0 HG23 ILE C 51 0.786 -17.329 6.277 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -1.479 -15.042 3.558 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -1.009 -13.923 4.859 1.00 0.00 H new ATOM 0 HD13 ILE C 51 0.146 -15.145 4.277 1.00 0.00 H new ATOM 2452 N GLN C 52 -0.434 -15.410 9.836 1.00 0.00 N ATOM 2453 CA GLN C 52 0.358 -15.212 11.035 1.00 0.00 C ATOM 2454 C GLN C 52 -0.296 -15.870 12.248 1.00 0.00 C ATOM 2455 O GLN C 52 0.181 -15.716 13.367 1.00 0.00 O ATOM 2456 CB GLN C 52 0.614 -13.716 11.225 1.00 0.00 C ATOM 2457 CG GLN C 52 1.424 -13.192 10.042 1.00 0.00 C ATOM 2458 CD GLN C 52 2.651 -14.050 9.765 1.00 0.00 C ATOM 2459 OE1 GLN C 52 3.561 -14.145 10.586 1.00 0.00 O ATOM 2460 NE2 GLN C 52 2.685 -14.691 8.599 1.00 0.00 N ATOM 0 H GLN C 52 -0.941 -14.579 9.532 1.00 0.00 H new ATOM 0 HA GLN C 52 1.324 -15.704 10.925 1.00 0.00 H new ATOM 0 HB2 GLN C 52 -0.332 -13.179 11.300 1.00 0.00 H new ATOM 0 HB3 GLN C 52 1.153 -13.542 12.156 1.00 0.00 H new ATOM 0 HG2 GLN C 52 0.793 -13.165 9.154 1.00 0.00 H new ATOM 0 HG3 GLN C 52 1.736 -12.167 10.242 1.00 0.00 H new ATOM 0 HE21 GLN C 52 1.913 -14.591 7.939 1.00 0.00 H new ATOM 0 HE22 GLN C 52 3.483 -15.282 8.365 1.00 0.00 H new ATOM 2469 N ALA C 53 -1.397 -16.599 12.029 1.00 0.00 N ATOM 2470 CA ALA C 53 -2.071 -17.312 13.096 1.00 0.00 C ATOM 2471 C ALA C 53 -1.266 -18.540 13.531 1.00 0.00 C ATOM 2472 O ALA C 53 -1.499 -19.067 14.617 1.00 0.00 O ATOM 2473 CB ALA C 53 -3.463 -17.734 12.627 1.00 0.00 C ATOM 0 H ALA C 53 -1.834 -16.704 11.114 1.00 0.00 H new ATOM 0 HA ALA C 53 -2.161 -16.648 13.956 1.00 0.00 H new ATOM 0 HB1 ALA C 53 -3.970 -18.270 13.429 1.00 0.00 H new ATOM 0 HB2 ALA C 53 -4.041 -16.849 12.360 1.00 0.00 H new ATOM 0 HB3 ALA C 53 -3.372 -18.384 11.757 1.00 0.00 H new ATOM 2479 N GLY C 54 -0.326 -19.000 12.696 1.00 0.00 N ATOM 2480 CA GLY C 54 0.498 -20.158 13.011 1.00 0.00 C ATOM 2481 C GLY C 54 0.589 -21.138 11.840 1.00 0.00 C ATOM 2482 O GLY C 54 0.966 -22.293 12.039 1.00 0.00 O ATOM 0 H GLY C 54 -0.121 -18.578 11.790 1.00 0.00 H new ATOM 0 HA2 GLY C 54 1.500 -19.826 13.283 1.00 0.00 H new ATOM 0 HA3 GLY C 54 0.085 -20.670 13.880 1.00 0.00 H new ATOM 2486 N LEU C 55 0.249 -20.693 10.627 1.00 0.00 N ATOM 2487 CA LEU C 55 0.176 -21.540 9.445 1.00 0.00 C ATOM 2488 C LEU C 55 0.744 -20.825 8.219 1.00 0.00 C ATOM 2489 O LEU C 55 1.310 -19.741 8.340 1.00 0.00 O ATOM 2490 CB LEU C 55 -1.286 -21.971 9.257 1.00 0.00 C ATOM 2491 CG LEU C 55 -2.260 -20.787 9.143 1.00 0.00 C ATOM 2492 CD1 LEU C 55 -2.243 -20.156 7.752 1.00 0.00 C ATOM 2493 CD2 LEU C 55 -3.671 -21.299 9.409 1.00 0.00 C ATOM 0 H LEU C 55 0.014 -19.718 10.441 1.00 0.00 H new ATOM 0 HA LEU C 55 0.790 -22.431 9.575 1.00 0.00 H new ATOM 0 HB2 LEU C 55 -1.364 -22.584 8.359 1.00 0.00 H new ATOM 0 HB3 LEU C 55 -1.584 -22.598 10.098 1.00 0.00 H new ATOM 0 HG LEU C 55 -1.953 -20.031 9.866 1.00 0.00 H new ATOM 0 HD11 LEU C 55 -2.947 -19.324 7.721 1.00 0.00 H new ATOM 0 HD12 LEU C 55 -1.240 -19.791 7.530 1.00 0.00 H new ATOM 0 HD13 LEU C 55 -2.530 -20.902 7.011 1.00 0.00 H new ATOM 0 HD21 LEU C 55 -4.378 -20.473 9.333 1.00 0.00 H new ATOM 0 HD22 LEU C 55 -3.925 -22.063 8.675 1.00 0.00 H new ATOM 0 HD23 LEU C 55 -3.720 -21.727 10.410 1.00 0.00 H new ATOM 2505 N THR C 56 0.594 -21.429 7.037 1.00 0.00 N ATOM 2506 CA THR C 56 1.086 -20.848 5.793 1.00 0.00 C ATOM 2507 C THR C 56 0.075 -21.066 4.668 1.00 0.00 C ATOM 2508 O THR C 56 -0.921 -21.764 4.854 1.00 0.00 O ATOM 2509 CB THR C 56 2.454 -21.442 5.434 1.00 0.00 C ATOM 2510 OG1 THR C 56 2.364 -22.846 5.305 1.00 0.00 O ATOM 2511 CG2 THR C 56 3.478 -21.105 6.518 1.00 0.00 C ATOM 0 H THR C 56 0.130 -22.330 6.920 1.00 0.00 H new ATOM 0 HA THR C 56 1.210 -19.774 5.929 1.00 0.00 H new ATOM 0 HB THR C 56 2.772 -21.012 4.485 1.00 0.00 H new ATOM 0 HG1 THR C 56 3.244 -23.210 5.074 1.00 0.00 H new ATOM 0 HG21 THR C 56 4.445 -21.532 6.251 1.00 0.00 H new ATOM 0 HG22 THR C 56 3.572 -20.023 6.606 1.00 0.00 H new ATOM 0 HG23 THR C 56 3.149 -21.519 7.471 1.00 0.00 H new ATOM 2519 N ALA C 57 0.335 -20.463 3.503 1.00 0.00 N ATOM 2520 CA ALA C 57 -0.572 -20.516 2.364 1.00 0.00 C ATOM 2521 C ALA C 57 -0.916 -21.953 1.952 1.00 0.00 C ATOM 2522 O ALA C 57 -0.075 -22.850 2.049 1.00 0.00 O ATOM 2523 CB ALA C 57 0.066 -19.781 1.194 1.00 0.00 C ATOM 0 H ALA C 57 1.184 -19.925 3.329 1.00 0.00 H new ATOM 0 HA ALA C 57 -1.507 -20.038 2.656 1.00 0.00 H new ATOM 0 HB1 ALA C 57 -0.604 -19.814 0.335 1.00 0.00 H new ATOM 0 HB2 ALA C 57 0.249 -18.743 1.472 1.00 0.00 H new ATOM 0 HB3 ALA C 57 1.011 -20.259 0.936 1.00 0.00 H new