USER MOD reduce.3.24.130724 H: found=0, std=0, add=1239, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1245 hydrogens (5 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: B 46 TYR OH : rot 180:sc= 1.01 USER MOD Set 1.2: B 79 ASN : amide:sc= 1.89 K(o=3.4,f=1.6) USER MOD Set 1.3: B 80 SER OG : rot 147:sc= 0.545 USER MOD Set 2.1: B 7 ASN : amide:sc= 0.193 K(o=-1.1,f=-13!) USER MOD Set 2.2: B 10 THR OG1 : rot 180:sc= 0.0699 USER MOD Set 2.3: B 14 TYR OH : rot -133:sc= 1.15 USER MOD Set 2.4: B 36 CYS SG : rot -101:sc= -2.51! USER MOD Set 3.1: A 68 HIS : no HD1:sc= -0.19 K(o=-0.19,f=-5.2!) USER MOD Set 3.2: B 4 THR OG1 : rot -160:sc=0.000236 USER MOD Set 4.1: A 55 THR OG1 : rot 20:sc= 0.36 USER MOD Set 4.2: A 57 SER OG : rot -86:sc= 0.524 USER MOD Set 5.1: A 22 THR OG1 : rot 180:sc= 0.0746 USER MOD Set 5.2: A 25 ASN : amide:sc= 1.13 K(o=1.2,f=-0.8) USER MOD Set 6.1: A 7 THR OG1 : rot 126:sc= 0.761 USER MOD Set 6.2: A 9 THR OG1 : rot 180:sc= 0.967 USER MOD Single : A 1 MET CE :methyl 152:sc= -0.448 (180deg=-0.603) USER MOD Single : A 1 MET N :NH3+ 148:sc= 2.4 (180deg=1.1) USER MOD Single : A 2 GLN : amide:sc= 0.589 K(o=0.59,f=-0.67) USER MOD Single : A 6 LYS NZ :NH3+ -127:sc= 1.85 (180deg=-0.89) USER MOD Single : A 11 LYS NZ :NH3+ -167:sc= 1.22 (180deg=1.06) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0932 USER MOD Single : A 27 LYS NZ :NH3+ -152:sc= 0.529 (180deg=-0.272) USER MOD Single : A 29 LYS NZ :NH3+ 162:sc= 1.23 (180deg=-0.00119!) USER MOD Single : A 31 GLN : amide:sc=-0.000795 X(o=-0.0008,f=-0.39) USER MOD Single : A 33 LYS NZ :NH3+ -174:sc= 0.338 (180deg=0.274) USER MOD Single : A 40 GLN : amide:sc= -0.028 K(o=-0.028,f=-1.8) USER MOD Single : A 41 GLN : amide:sc= -0.451 K(o=-0.45,f=-4.8!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 TYR OH : rot 60:sc= 0.0942 USER MOD Single : A 60 ASN : amide:sc= -0.0223 K(o=-0.022,f=-1.1) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 95:sc= 1.22 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 6 SER OG : rot -170:sc= 0 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 23 MET CE :methyl -169:sc= -0.188 (180deg=-0.328) USER MOD Single : B 26 THR OG1 : rot 180:sc= 0.136 USER MOD Single : B 33 GLN : amide:sc= -1.11 K(o=-1.1,f=-4.5!) USER MOD Single : B 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 THR OG1 : rot 71:sc= 1.3 USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 HIS : no HD1:sc= -0.131 K(o=-0.13,f=-1.2) USER MOD Single : B 47 TYR OH : rot 87:sc= 1.24 USER MOD Single : B 48 ASN : amide:sc= 0.236 X(o=0.24,f=0) USER MOD Single : B 49 MET CE :methyl -162:sc= -0.0605 (180deg=-0.471) USER MOD Single : B 54 SER OG : rot 180:sc= 0.0161 USER MOD Single : B 55 ASN : amide:sc=-0.00549 X(o=-0.0055,f=-0.08) USER MOD Single : B 57 THR OG1 : rot -46:sc= 0.182 USER MOD Single : B 58 GLN : amide:sc= 0.617 K(o=0.62,f=-8.6!) USER MOD Single : B 59 SER OG : rot 93:sc= 1.22 USER MOD Single : B 61 LYS NZ :NH3+ -118:sc= 1.29 (180deg=-0.132) USER MOD Single : B 66 LYS NZ :NH3+ 160:sc= 1.74 (180deg=1.52) USER MOD Single : B 67 THR OG1 : rot 51:sc= 1.24 USER MOD Single : B 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 78 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -20.259 7.108 -9.229 1.00 0.00 N ATOM 2 CA MET A 1 -18.851 7.435 -9.553 1.00 0.00 C ATOM 3 C MET A 1 -17.998 6.175 -9.534 1.00 0.00 C ATOM 4 O MET A 1 -18.366 5.177 -8.917 1.00 0.00 O ATOM 5 CB MET A 1 -18.297 8.470 -8.568 1.00 0.00 C ATOM 6 CG MET A 1 -18.187 7.979 -7.131 1.00 0.00 C ATOM 7 SD MET A 1 -17.629 9.276 -6.005 1.00 0.00 S ATOM 8 CE MET A 1 -17.298 8.328 -4.523 1.00 0.00 C ATOM 0 H1 MET A 1 -20.694 7.908 -8.727 1.00 0.00 H new ATOM 0 H2 MET A 1 -20.784 6.924 -10.108 1.00 0.00 H new ATOM 0 H3 MET A 1 -20.289 6.262 -8.624 1.00 0.00 H new ATOM 0 HA MET A 1 -18.818 7.863 -10.555 1.00 0.00 H new ATOM 0 HB2 MET A 1 -17.310 8.784 -8.908 1.00 0.00 H new ATOM 0 HB3 MET A 1 -18.937 9.352 -8.589 1.00 0.00 H new ATOM 0 HG2 MET A 1 -19.157 7.607 -6.801 1.00 0.00 H new ATOM 0 HG3 MET A 1 -17.492 7.140 -7.088 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.523 8.825 -3.939 1.00 0.00 H new ATOM 0 HE2 MET A 1 -18.209 8.252 -3.929 1.00 0.00 H new ATOM 0 HE3 MET A 1 -16.960 7.329 -4.798 1.00 0.00 H new ATOM 20 N GLN A 2 -16.860 6.218 -10.211 1.00 0.00 N ATOM 21 CA GLN A 2 -15.974 5.066 -10.269 1.00 0.00 C ATOM 22 C GLN A 2 -14.737 5.281 -9.403 1.00 0.00 C ATOM 23 O GLN A 2 -14.125 6.351 -9.436 1.00 0.00 O ATOM 24 CB GLN A 2 -15.535 4.796 -11.711 1.00 0.00 C ATOM 25 CG GLN A 2 -16.681 4.710 -12.709 1.00 0.00 C ATOM 26 CD GLN A 2 -17.624 3.556 -12.433 1.00 0.00 C ATOM 27 OE1 GLN A 2 -17.238 2.544 -11.849 1.00 0.00 O ATOM 28 NE2 GLN A 2 -18.869 3.691 -12.872 1.00 0.00 N ATOM 0 H GLN A 2 -16.530 7.034 -10.726 1.00 0.00 H new ATOM 0 HA GLN A 2 -16.528 4.207 -9.890 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -14.854 5.587 -12.025 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -14.974 3.862 -11.739 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -17.243 5.644 -12.689 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -16.273 4.605 -13.714 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -19.151 4.546 -13.352 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -19.544 2.940 -12.730 1.00 0.00 H new ATOM 37 N ILE A 3 -14.389 4.272 -8.617 1.00 0.00 N ATOM 38 CA ILE A 3 -13.209 4.333 -7.763 1.00 0.00 C ATOM 39 C ILE A 3 -12.338 3.108 -8.009 1.00 0.00 C ATOM 40 O ILE A 3 -12.818 2.098 -8.533 1.00 0.00 O ATOM 41 CB ILE A 3 -13.560 4.411 -6.260 1.00 0.00 C ATOM 42 CG1 ILE A 3 -14.449 3.235 -5.849 1.00 0.00 C ATOM 43 CG2 ILE A 3 -14.241 5.732 -5.935 1.00 0.00 C ATOM 44 CD1 ILE A 3 -14.520 3.020 -4.353 1.00 0.00 C ATOM 0 H ILE A 3 -14.909 3.397 -8.552 1.00 0.00 H new ATOM 0 HA ILE A 3 -12.675 5.247 -8.022 1.00 0.00 H new ATOM 0 HB ILE A 3 -12.632 4.354 -5.692 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -15.456 3.401 -6.231 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -14.075 2.326 -6.320 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -14.480 5.766 -4.872 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -13.573 6.557 -6.184 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -15.159 5.821 -6.516 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -15.168 2.170 -4.138 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -13.520 2.822 -3.966 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -14.923 3.913 -3.876 1.00 0.00 H new ATOM 56 N PHE A 4 -11.074 3.191 -7.634 1.00 0.00 N ATOM 57 CA PHE A 4 -10.152 2.086 -7.840 1.00 0.00 C ATOM 58 C PHE A 4 -9.631 1.565 -6.511 1.00 0.00 C ATOM 59 O PHE A 4 -9.406 2.338 -5.581 1.00 0.00 O ATOM 60 CB PHE A 4 -8.973 2.530 -8.715 1.00 0.00 C ATOM 61 CG PHE A 4 -9.377 3.145 -10.022 1.00 0.00 C ATOM 62 CD1 PHE A 4 -9.889 2.360 -11.042 1.00 0.00 C ATOM 63 CD2 PHE A 4 -9.247 4.510 -10.229 1.00 0.00 C ATOM 64 CE1 PHE A 4 -10.260 2.927 -12.247 1.00 0.00 C ATOM 65 CE2 PHE A 4 -9.615 5.083 -11.430 1.00 0.00 C ATOM 66 CZ PHE A 4 -10.124 4.288 -12.439 1.00 0.00 C ATOM 0 H PHE A 4 -10.662 4.010 -7.186 1.00 0.00 H new ATOM 0 HA PHE A 4 -10.693 1.286 -8.345 1.00 0.00 H new ATOM 0 HB2 PHE A 4 -8.372 3.249 -8.158 1.00 0.00 H new ATOM 0 HB3 PHE A 4 -8.337 1.668 -8.913 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -9.999 1.296 -10.895 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -8.853 5.133 -9.440 1.00 0.00 H new ATOM 0 HE1 PHE A 4 -10.656 2.306 -13.037 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -9.506 6.147 -11.580 1.00 0.00 H new ATOM 0 HZ PHE A 4 -10.416 4.732 -13.379 1.00 0.00 H new ATOM 76 N VAL A 5 -9.452 0.260 -6.418 1.00 0.00 N ATOM 77 CA VAL A 5 -8.945 -0.354 -5.202 1.00 0.00 C ATOM 78 C VAL A 5 -7.715 -1.194 -5.510 1.00 0.00 C ATOM 79 O VAL A 5 -7.753 -2.083 -6.362 1.00 0.00 O ATOM 80 CB VAL A 5 -10.020 -1.230 -4.517 1.00 0.00 C ATOM 81 CG1 VAL A 5 -9.449 -1.945 -3.301 1.00 0.00 C ATOM 82 CG2 VAL A 5 -11.225 -0.391 -4.122 1.00 0.00 C ATOM 0 H VAL A 5 -9.651 -0.398 -7.172 1.00 0.00 H new ATOM 0 HA VAL A 5 -8.674 0.448 -4.515 1.00 0.00 H new ATOM 0 HB VAL A 5 -10.343 -1.985 -5.234 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -10.226 -2.554 -2.839 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -8.623 -2.585 -3.610 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -9.089 -1.209 -2.582 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -11.969 -1.026 -3.642 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -10.913 0.390 -3.429 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -11.658 0.066 -5.012 1.00 0.00 H new ATOM 92 N LYS A 6 -6.622 -0.885 -4.833 1.00 0.00 N ATOM 93 CA LYS A 6 -5.376 -1.613 -5.014 1.00 0.00 C ATOM 94 C LYS A 6 -5.243 -2.690 -3.948 1.00 0.00 C ATOM 95 O LYS A 6 -5.304 -2.393 -2.753 1.00 0.00 O ATOM 96 CB LYS A 6 -4.182 -0.656 -4.935 1.00 0.00 C ATOM 97 CG LYS A 6 -3.879 0.061 -6.239 1.00 0.00 C ATOM 98 CD LYS A 6 -3.126 -0.835 -7.212 1.00 0.00 C ATOM 99 CE LYS A 6 -2.498 -0.027 -8.337 1.00 0.00 C ATOM 100 NZ LYS A 6 -1.457 0.912 -7.833 1.00 0.00 N ATOM 0 H LYS A 6 -6.572 -0.130 -4.149 1.00 0.00 H new ATOM 0 HA LYS A 6 -5.387 -2.081 -5.998 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -4.375 0.086 -4.160 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -3.300 -1.217 -4.627 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -4.811 0.393 -6.697 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -3.288 0.954 -6.035 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -2.350 -1.383 -6.678 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -3.808 -1.575 -7.630 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -2.053 -0.704 -9.066 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -3.274 0.536 -8.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -1.663 1.873 -8.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -1.457 0.905 -6.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -0.523 0.614 -8.181 1.00 0.00 H new ATOM 114 N THR A 7 -5.078 -3.929 -4.383 1.00 0.00 N ATOM 115 CA THR A 7 -4.934 -5.048 -3.465 1.00 0.00 C ATOM 116 C THR A 7 -3.469 -5.244 -3.086 1.00 0.00 C ATOM 117 O THR A 7 -2.589 -4.543 -3.587 1.00 0.00 O ATOM 118 CB THR A 7 -5.473 -6.359 -4.079 1.00 0.00 C ATOM 119 OG1 THR A 7 -4.647 -6.765 -5.182 1.00 0.00 O ATOM 120 CG2 THR A 7 -6.915 -6.192 -4.553 1.00 0.00 C ATOM 0 H THR A 7 -5.040 -4.186 -5.369 1.00 0.00 H new ATOM 0 HA THR A 7 -5.518 -4.811 -2.576 1.00 0.00 H new ATOM 0 HB THR A 7 -5.450 -7.127 -3.305 1.00 0.00 H new ATOM 0 HG1 THR A 7 -4.339 -7.684 -5.039 1.00 0.00 H new ATOM 0 HG21 THR A 7 -7.268 -7.130 -4.981 1.00 0.00 H new ATOM 0 HG22 THR A 7 -7.546 -5.918 -3.708 1.00 0.00 H new ATOM 0 HG23 THR A 7 -6.961 -5.408 -5.309 1.00 0.00 H new ATOM 128 N LEU A 8 -3.215 -6.215 -2.218 1.00 0.00 N ATOM 129 CA LEU A 8 -1.856 -6.522 -1.786 1.00 0.00 C ATOM 130 C LEU A 8 -1.164 -7.422 -2.807 1.00 0.00 C ATOM 131 O LEU A 8 -0.072 -7.933 -2.571 1.00 0.00 O ATOM 132 CB LEU A 8 -1.870 -7.194 -0.410 1.00 0.00 C ATOM 133 CG LEU A 8 -2.324 -6.297 0.748 1.00 0.00 C ATOM 134 CD1 LEU A 8 -2.173 -7.027 2.071 1.00 0.00 C ATOM 135 CD2 LEU A 8 -1.539 -4.991 0.769 1.00 0.00 C ATOM 0 H LEU A 8 -3.933 -6.805 -1.798 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.299 -5.588 -1.710 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.526 -8.063 -0.454 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -0.867 -7.562 -0.192 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.376 -6.056 0.598 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -2.499 -6.378 2.884 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -2.784 -7.930 2.060 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -1.128 -7.298 2.220 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -1.881 -4.374 1.600 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.477 -5.206 0.890 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -1.696 -4.457 -0.168 1.00 0.00 H new ATOM 147 N THR A 9 -1.823 -7.607 -3.941 1.00 0.00 N ATOM 148 CA THR A 9 -1.297 -8.431 -5.014 1.00 0.00 C ATOM 149 C THR A 9 -1.034 -7.593 -6.259 1.00 0.00 C ATOM 150 O THR A 9 -0.744 -8.122 -7.328 1.00 0.00 O ATOM 151 CB THR A 9 -2.282 -9.560 -5.358 1.00 0.00 C ATOM 152 OG1 THR A 9 -3.555 -9.290 -4.740 1.00 0.00 O ATOM 153 CG2 THR A 9 -1.747 -10.911 -4.894 1.00 0.00 C ATOM 0 H THR A 9 -2.733 -7.192 -4.141 1.00 0.00 H new ATOM 0 HA THR A 9 -0.357 -8.865 -4.673 1.00 0.00 H new ATOM 0 HB THR A 9 -2.404 -9.601 -6.440 1.00 0.00 H new ATOM 0 HG1 THR A 9 -4.184 -10.008 -4.960 1.00 0.00 H new ATOM 0 HG21 THR A 9 -2.462 -11.693 -5.149 1.00 0.00 H new ATOM 0 HG22 THR A 9 -0.796 -11.114 -5.387 1.00 0.00 H new ATOM 0 HG23 THR A 9 -1.600 -10.893 -3.814 1.00 0.00 H new ATOM 161 N GLY A 10 -1.153 -6.278 -6.109 1.00 0.00 N ATOM 162 CA GLY A 10 -0.922 -5.375 -7.222 1.00 0.00 C ATOM 163 C GLY A 10 -2.096 -5.312 -8.181 1.00 0.00 C ATOM 164 O GLY A 10 -1.976 -4.777 -9.283 1.00 0.00 O ATOM 0 H GLY A 10 -1.406 -5.820 -5.233 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -0.719 -4.376 -6.837 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -0.032 -5.694 -7.765 1.00 0.00 H new ATOM 168 N LYS A 11 -3.233 -5.851 -7.761 1.00 0.00 N ATOM 169 CA LYS A 11 -4.430 -5.849 -8.589 1.00 0.00 C ATOM 170 C LYS A 11 -5.208 -4.562 -8.384 1.00 0.00 C ATOM 171 O LYS A 11 -5.144 -3.956 -7.313 1.00 0.00 O ATOM 172 CB LYS A 11 -5.334 -7.041 -8.251 1.00 0.00 C ATOM 173 CG LYS A 11 -4.660 -8.396 -8.381 1.00 0.00 C ATOM 174 CD LYS A 11 -5.469 -9.488 -7.693 1.00 0.00 C ATOM 175 CE LYS A 11 -6.831 -9.688 -8.345 1.00 0.00 C ATOM 176 NZ LYS A 11 -7.667 -10.672 -7.603 1.00 0.00 N ATOM 0 H LYS A 11 -3.351 -6.296 -6.851 1.00 0.00 H new ATOM 0 HA LYS A 11 -4.115 -5.927 -9.630 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -5.699 -6.927 -7.230 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.205 -7.018 -8.906 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.536 -8.643 -9.435 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -3.662 -8.351 -7.945 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -4.912 -10.425 -7.723 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -5.605 -9.231 -6.642 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -7.353 -8.733 -8.393 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -6.695 -10.029 -9.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -8.483 -10.944 -8.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -7.099 -11.516 -7.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -8.003 -10.244 -6.717 1.00 0.00 H new HETATM 190 CAC 3X9 A 12 -3.098 2.073 -13.376 1.00 0.00 C HETATM 191 CAS 3X9 A 12 -3.115 2.987 -12.148 1.00 0.00 C HETATM 192 CAD 3X9 A 12 -2.036 2.600 -11.131 1.00 0.00 C HETATM 193 NAQ 3X9 A 12 -2.967 4.394 -12.536 1.00 0.00 N HETATM 194 OAH 3X9 A 12 -2.575 5.183 -11.368 1.00 0.00 O HETATM 195 CAR 3X9 A 12 -4.307 4.795 -12.991 1.00 0.00 C HETATM 196 CAA 3X9 A 12 -4.983 4.029 -14.128 1.00 0.00 C HETATM 197 CAB 3X9 A 12 -4.664 6.257 -12.718 1.00 0.00 C HETATM 198 CAI 3X9 A 12 -5.082 4.164 -11.828 1.00 0.00 C HETATM 199 CAO 3X9 A 12 -4.501 3.008 -11.508 1.00 0.00 C HETATM 200 CAJ 3X9 A 12 -5.039 1.875 -10.631 1.00 0.00 C HETATM 201 SAL 3X9 A 12 -6.311 0.917 -11.529 1.00 0.00 S HETATM 202 N 3X9 A 12 -5.936 -4.144 -9.404 1.00 0.00 N HETATM 203 CA 3X9 A 12 -6.738 -2.936 -9.313 1.00 0.00 C HETATM 204 CB 3X9 A 12 -6.140 -1.798 -10.141 1.00 0.00 C HETATM 205 SG 3X9 A 12 -7.140 -0.275 -10.098 1.00 0.00 S HETATM 206 C 3X9 A 12 -8.157 -3.209 -9.792 1.00 0.00 C HETATM 207 O 3X9 A 12 -8.389 -3.412 -10.986 1.00 0.00 O ATOM 213 N ILE A 13 -9.098 -3.228 -8.865 1.00 0.00 N ATOM 214 CA ILE A 13 -10.487 -3.472 -9.210 1.00 0.00 C ATOM 215 C ILE A 13 -11.263 -2.164 -9.199 1.00 0.00 C ATOM 216 O ILE A 13 -11.050 -1.311 -8.336 1.00 0.00 O ATOM 217 CB ILE A 13 -11.154 -4.489 -8.256 1.00 0.00 C ATOM 218 CG1 ILE A 13 -11.098 -4.001 -6.804 1.00 0.00 C ATOM 219 CG2 ILE A 13 -10.484 -5.848 -8.392 1.00 0.00 C ATOM 220 CD1 ILE A 13 -11.795 -4.926 -5.825 1.00 0.00 C ATOM 0 H ILE A 13 -8.927 -3.078 -7.871 1.00 0.00 H new ATOM 0 HA ILE A 13 -10.504 -3.902 -10.211 1.00 0.00 H new ATOM 0 HB ILE A 13 -12.204 -4.585 -8.534 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -10.055 -3.890 -6.507 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -11.553 -3.012 -6.744 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -10.961 -6.558 -7.716 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -10.583 -6.201 -9.418 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -9.427 -5.760 -8.139 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -11.715 -4.517 -4.818 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -12.847 -5.018 -6.097 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -11.325 -5.909 -5.856 1.00 0.00 H new ATOM 232 N THR A 14 -12.133 -1.989 -10.179 1.00 0.00 N ATOM 233 CA THR A 14 -12.939 -0.790 -10.271 1.00 0.00 C ATOM 234 C THR A 14 -14.296 -1.041 -9.628 1.00 0.00 C ATOM 235 O THR A 14 -14.967 -2.024 -9.942 1.00 0.00 O ATOM 236 CB THR A 14 -13.128 -0.365 -11.736 1.00 0.00 C ATOM 237 OG1 THR A 14 -11.897 -0.549 -12.454 1.00 0.00 O ATOM 238 CG2 THR A 14 -13.562 1.091 -11.831 1.00 0.00 C ATOM 0 H THR A 14 -12.297 -2.667 -10.923 1.00 0.00 H new ATOM 0 HA THR A 14 -12.425 0.015 -9.746 1.00 0.00 H new ATOM 0 HB THR A 14 -13.909 -0.986 -12.176 1.00 0.00 H new ATOM 0 HG1 THR A 14 -12.020 -0.279 -13.388 1.00 0.00 H new ATOM 0 HG21 THR A 14 -13.688 1.365 -12.878 1.00 0.00 H new ATOM 0 HG22 THR A 14 -14.507 1.224 -11.304 1.00 0.00 H new ATOM 0 HG23 THR A 14 -12.802 1.728 -11.378 1.00 0.00 H new ATOM 246 N LEU A 15 -14.680 -0.179 -8.706 1.00 0.00 N ATOM 247 CA LEU A 15 -15.951 -0.337 -8.021 1.00 0.00 C ATOM 248 C LEU A 15 -16.856 0.856 -8.272 1.00 0.00 C ATOM 249 O LEU A 15 -16.427 2.009 -8.162 1.00 0.00 O ATOM 250 CB LEU A 15 -15.729 -0.498 -6.516 1.00 0.00 C ATOM 251 CG LEU A 15 -14.889 -1.708 -6.101 1.00 0.00 C ATOM 252 CD1 LEU A 15 -14.581 -1.647 -4.617 1.00 0.00 C ATOM 253 CD2 LEU A 15 -15.609 -3.004 -6.437 1.00 0.00 C ATOM 0 H LEU A 15 -14.135 0.633 -8.415 1.00 0.00 H new ATOM 0 HA LEU A 15 -16.432 -1.232 -8.415 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -15.247 0.404 -6.139 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -16.701 -0.568 -6.028 1.00 0.00 H new ATOM 0 HG LEU A 15 -13.952 -1.683 -6.657 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -13.983 -2.513 -4.334 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -14.026 -0.735 -4.398 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -15.513 -1.649 -4.052 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -14.994 -3.851 -6.133 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -16.561 -3.039 -5.908 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -15.789 -3.052 -7.511 1.00 0.00 H new ATOM 265 N GLU A 16 -18.097 0.578 -8.626 1.00 0.00 N ATOM 266 CA GLU A 16 -19.062 1.626 -8.864 1.00 0.00 C ATOM 267 C GLU A 16 -19.755 1.969 -7.560 1.00 0.00 C ATOM 268 O GLU A 16 -20.490 1.156 -6.994 1.00 0.00 O ATOM 269 CB GLU A 16 -20.083 1.197 -9.912 1.00 0.00 C ATOM 270 CG GLU A 16 -20.987 2.328 -10.362 1.00 0.00 C ATOM 271 CD GLU A 16 -21.624 2.059 -11.704 1.00 0.00 C ATOM 272 OE1 GLU A 16 -20.914 1.599 -12.624 1.00 0.00 O ATOM 273 OE2 GLU A 16 -22.836 2.320 -11.858 1.00 0.00 O ATOM 0 H GLU A 16 -18.457 -0.368 -8.754 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.545 2.507 -9.245 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -19.558 0.794 -10.778 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -20.694 0.391 -9.506 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -21.768 2.483 -9.617 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.410 3.251 -10.416 1.00 0.00 H new ATOM 280 N VAL A 17 -19.491 3.162 -7.072 1.00 0.00 N ATOM 281 CA VAL A 17 -20.066 3.627 -5.823 1.00 0.00 C ATOM 282 C VAL A 17 -20.595 5.043 -5.981 1.00 0.00 C ATOM 283 O VAL A 17 -20.539 5.612 -7.069 1.00 0.00 O ATOM 284 CB VAL A 17 -19.022 3.604 -4.686 1.00 0.00 C ATOM 285 CG1 VAL A 17 -18.572 2.183 -4.387 1.00 0.00 C ATOM 286 CG2 VAL A 17 -17.830 4.479 -5.045 1.00 0.00 C ATOM 0 H VAL A 17 -18.875 3.836 -7.526 1.00 0.00 H new ATOM 0 HA VAL A 17 -20.884 2.954 -5.566 1.00 0.00 H new ATOM 0 HB VAL A 17 -19.490 4.004 -3.786 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -17.837 2.196 -3.582 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -19.432 1.585 -4.084 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -18.125 1.747 -5.280 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -17.102 4.453 -4.234 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -17.368 4.107 -5.959 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -18.165 5.505 -5.199 1.00 0.00 H new ATOM 296 N GLU A 18 -21.093 5.607 -4.896 1.00 0.00 N ATOM 297 CA GLU A 18 -21.616 6.965 -4.898 1.00 0.00 C ATOM 298 C GLU A 18 -21.243 7.645 -3.585 1.00 0.00 C ATOM 299 O GLU A 18 -20.909 6.963 -2.626 1.00 0.00 O ATOM 300 CB GLU A 18 -23.133 6.947 -5.094 1.00 0.00 C ATOM 301 CG GLU A 18 -23.549 6.984 -6.556 1.00 0.00 C ATOM 302 CD GLU A 18 -23.141 8.272 -7.250 1.00 0.00 C ATOM 303 OE1 GLU A 18 -21.994 8.360 -7.737 1.00 0.00 O ATOM 304 OE2 GLU A 18 -23.969 9.202 -7.311 1.00 0.00 O ATOM 0 H GLU A 18 -21.147 5.140 -3.991 1.00 0.00 H new ATOM 0 HA GLU A 18 -21.180 7.526 -5.724 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -23.542 6.050 -4.629 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -23.570 7.801 -4.577 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -23.102 6.138 -7.078 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -24.630 6.866 -6.625 1.00 0.00 H new ATOM 311 N PRO A 19 -21.281 8.986 -3.516 1.00 0.00 N ATOM 312 CA PRO A 19 -20.933 9.724 -2.291 1.00 0.00 C ATOM 313 C PRO A 19 -21.686 9.228 -1.053 1.00 0.00 C ATOM 314 O PRO A 19 -21.113 9.125 0.033 1.00 0.00 O ATOM 315 CB PRO A 19 -21.343 11.161 -2.625 1.00 0.00 C ATOM 316 CG PRO A 19 -21.253 11.250 -4.105 1.00 0.00 C ATOM 317 CD PRO A 19 -21.640 9.894 -4.625 1.00 0.00 C ATOM 0 HA PRO A 19 -19.880 9.604 -2.035 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -22.354 11.374 -2.277 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -20.682 11.882 -2.145 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -21.920 12.021 -4.491 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -20.244 11.515 -4.419 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -22.703 9.842 -4.859 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -21.100 9.645 -5.539 1.00 0.00 H new ATOM 325 N SER A 20 -22.960 8.896 -1.236 1.00 0.00 N ATOM 326 CA SER A 20 -23.806 8.428 -0.143 1.00 0.00 C ATOM 327 C SER A 20 -23.660 6.924 0.106 1.00 0.00 C ATOM 328 O SER A 20 -24.439 6.340 0.862 1.00 0.00 O ATOM 329 CB SER A 20 -25.263 8.762 -0.462 1.00 0.00 C ATOM 330 OG SER A 20 -25.383 9.308 -1.769 1.00 0.00 O ATOM 0 H SER A 20 -23.433 8.943 -2.139 1.00 0.00 H new ATOM 0 HA SER A 20 -23.487 8.935 0.768 1.00 0.00 H new ATOM 0 HB2 SER A 20 -25.873 7.862 -0.382 1.00 0.00 H new ATOM 0 HB3 SER A 20 -25.646 9.473 0.270 1.00 0.00 H new ATOM 0 HG SER A 20 -26.324 9.513 -1.953 1.00 0.00 H new ATOM 336 N ASP A 21 -22.671 6.299 -0.517 1.00 0.00 N ATOM 337 CA ASP A 21 -22.463 4.867 -0.333 1.00 0.00 C ATOM 338 C ASP A 21 -21.690 4.611 0.955 1.00 0.00 C ATOM 339 O ASP A 21 -20.700 5.290 1.252 1.00 0.00 O ATOM 340 CB ASP A 21 -21.720 4.257 -1.524 1.00 0.00 C ATOM 341 CG ASP A 21 -21.981 2.766 -1.680 1.00 0.00 C ATOM 342 OD1 ASP A 21 -22.827 2.219 -0.939 1.00 0.00 O ATOM 343 OD2 ASP A 21 -21.355 2.136 -2.562 1.00 0.00 O ATOM 0 H ASP A 21 -22.008 6.752 -1.146 1.00 0.00 H new ATOM 0 HA ASP A 21 -23.441 4.390 -0.265 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -22.021 4.771 -2.437 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -20.650 4.423 -1.403 1.00 0.00 H new ATOM 348 N THR A 22 -22.153 3.642 1.722 1.00 0.00 N ATOM 349 CA THR A 22 -21.526 3.289 2.982 1.00 0.00 C ATOM 350 C THR A 22 -20.231 2.519 2.746 1.00 0.00 C ATOM 351 O THR A 22 -20.142 1.727 1.804 1.00 0.00 O ATOM 352 CB THR A 22 -22.480 2.429 3.829 1.00 0.00 C ATOM 353 OG1 THR A 22 -23.831 2.626 3.388 1.00 0.00 O ATOM 354 CG2 THR A 22 -22.372 2.778 5.305 1.00 0.00 C ATOM 0 H THR A 22 -22.971 3.079 1.490 1.00 0.00 H new ATOM 0 HA THR A 22 -21.298 4.213 3.514 1.00 0.00 H new ATOM 0 HB THR A 22 -22.197 1.384 3.702 1.00 0.00 H new ATOM 0 HG1 THR A 22 -24.435 2.075 3.929 1.00 0.00 H new ATOM 0 HG21 THR A 22 -23.058 2.154 5.878 1.00 0.00 H new ATOM 0 HG22 THR A 22 -21.352 2.604 5.646 1.00 0.00 H new ATOM 0 HG23 THR A 22 -22.629 3.827 5.451 1.00 0.00 H new ATOM 362 N ILE A 23 -19.236 2.749 3.595 1.00 0.00 N ATOM 363 CA ILE A 23 -17.960 2.053 3.481 1.00 0.00 C ATOM 364 C ILE A 23 -18.190 0.547 3.582 1.00 0.00 C ATOM 365 O ILE A 23 -17.508 -0.248 2.930 1.00 0.00 O ATOM 366 CB ILE A 23 -16.966 2.506 4.573 1.00 0.00 C ATOM 367 CG1 ILE A 23 -16.687 4.009 4.461 1.00 0.00 C ATOM 368 CG2 ILE A 23 -15.665 1.713 4.493 1.00 0.00 C ATOM 369 CD1 ILE A 23 -16.007 4.422 3.171 1.00 0.00 C ATOM 0 H ILE A 23 -19.288 3.411 4.369 1.00 0.00 H new ATOM 0 HA ILE A 23 -17.525 2.298 2.512 1.00 0.00 H new ATOM 0 HB ILE A 23 -17.422 2.311 5.544 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -17.629 4.549 4.551 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -16.063 4.315 5.301 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -14.983 2.052 5.273 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -15.876 0.653 4.632 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -15.205 1.867 3.517 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -15.846 5.500 3.173 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -15.047 3.912 3.086 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -16.638 4.151 2.324 1.00 0.00 H new ATOM 381 N GLU A 24 -19.177 0.170 4.390 1.00 0.00 N ATOM 382 CA GLU A 24 -19.537 -1.231 4.574 1.00 0.00 C ATOM 383 C GLU A 24 -19.933 -1.855 3.236 1.00 0.00 C ATOM 384 O GLU A 24 -19.593 -3.004 2.947 1.00 0.00 O ATOM 385 CB GLU A 24 -20.704 -1.347 5.557 1.00 0.00 C ATOM 386 CG GLU A 24 -20.972 -2.770 6.014 1.00 0.00 C ATOM 387 CD GLU A 24 -22.388 -2.958 6.510 1.00 0.00 C ATOM 388 OE1 GLU A 24 -22.788 -2.253 7.458 1.00 0.00 O ATOM 389 OE2 GLU A 24 -23.106 -3.818 5.955 1.00 0.00 O ATOM 0 H GLU A 24 -19.745 0.822 4.931 1.00 0.00 H new ATOM 0 HA GLU A 24 -18.674 -1.762 4.974 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -20.497 -0.727 6.429 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -21.604 -0.949 5.089 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -20.785 -3.456 5.187 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -20.274 -3.031 6.809 1.00 0.00 H new ATOM 396 N ASN A 25 -20.638 -1.072 2.420 1.00 0.00 N ATOM 397 CA ASN A 25 -21.082 -1.529 1.105 1.00 0.00 C ATOM 398 C ASN A 25 -19.881 -1.758 0.209 1.00 0.00 C ATOM 399 O ASN A 25 -19.844 -2.714 -0.560 1.00 0.00 O ATOM 400 CB ASN A 25 -22.020 -0.513 0.454 1.00 0.00 C ATOM 401 CG ASN A 25 -23.348 -0.381 1.174 1.00 0.00 C ATOM 402 OD1 ASN A 25 -23.751 -1.258 1.937 1.00 0.00 O ATOM 403 ND2 ASN A 25 -24.040 0.718 0.926 1.00 0.00 N ATOM 0 H ASN A 25 -20.914 -0.117 2.648 1.00 0.00 H new ATOM 0 HA ASN A 25 -21.627 -2.463 1.237 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -21.530 0.460 0.428 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -22.202 -0.806 -0.580 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -24.945 0.863 1.374 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -23.669 1.421 0.286 1.00 0.00 H new ATOM 410 N VAL A 26 -18.890 -0.876 0.329 1.00 0.00 N ATOM 411 CA VAL A 26 -17.668 -0.981 -0.454 1.00 0.00 C ATOM 412 C VAL A 26 -16.959 -2.289 -0.118 1.00 0.00 C ATOM 413 O VAL A 26 -16.504 -3.011 -1.009 1.00 0.00 O ATOM 414 CB VAL A 26 -16.714 0.211 -0.192 1.00 0.00 C ATOM 415 CG1 VAL A 26 -15.491 0.130 -1.093 1.00 0.00 C ATOM 416 CG2 VAL A 26 -17.441 1.532 -0.398 1.00 0.00 C ATOM 0 H VAL A 26 -18.914 -0.079 0.965 1.00 0.00 H new ATOM 0 HA VAL A 26 -17.942 -0.963 -1.509 1.00 0.00 H new ATOM 0 HB VAL A 26 -16.379 0.159 0.844 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -14.835 0.977 -0.892 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -14.955 -0.799 -0.897 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -15.806 0.154 -2.136 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -16.755 2.358 -0.210 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -17.806 1.590 -1.423 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -18.283 1.595 0.291 1.00 0.00 H new ATOM 426 N LYS A 27 -16.904 -2.601 1.176 1.00 0.00 N ATOM 427 CA LYS A 27 -16.276 -3.833 1.649 1.00 0.00 C ATOM 428 C LYS A 27 -17.009 -5.043 1.082 1.00 0.00 C ATOM 429 O LYS A 27 -16.391 -6.031 0.678 1.00 0.00 O ATOM 430 CB LYS A 27 -16.299 -3.890 3.181 1.00 0.00 C ATOM 431 CG LYS A 27 -15.753 -2.641 3.858 1.00 0.00 C ATOM 432 CD LYS A 27 -14.266 -2.764 4.162 1.00 0.00 C ATOM 433 CE LYS A 27 -14.006 -3.655 5.370 1.00 0.00 C ATOM 434 NZ LYS A 27 -14.486 -3.043 6.637 1.00 0.00 N ATOM 0 H LYS A 27 -17.288 -2.015 1.917 1.00 0.00 H new ATOM 0 HA LYS A 27 -15.240 -3.846 1.309 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -17.325 -4.051 3.512 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -15.719 -4.752 3.510 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -15.922 -1.777 3.216 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -16.299 -2.462 4.784 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -13.750 -3.171 3.293 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -13.849 -1.773 4.345 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -14.500 -4.615 5.223 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -12.937 -3.855 5.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -13.913 -3.394 7.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.399 -2.008 6.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -15.483 -3.298 6.790 1.00 0.00 H new ATOM 448 N ALA A 28 -18.332 -4.949 1.056 1.00 0.00 N ATOM 449 CA ALA A 28 -19.173 -6.015 0.534 1.00 0.00 C ATOM 450 C ALA A 28 -18.965 -6.176 -0.967 1.00 0.00 C ATOM 451 O ALA A 28 -18.946 -7.291 -1.484 1.00 0.00 O ATOM 452 CB ALA A 28 -20.636 -5.737 0.844 1.00 0.00 C ATOM 0 H ALA A 28 -18.848 -4.137 1.394 1.00 0.00 H new ATOM 0 HA ALA A 28 -18.888 -6.948 1.021 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -21.252 -6.544 0.447 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -20.773 -5.673 1.923 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -20.933 -4.794 0.384 1.00 0.00 H new ATOM 458 N LYS A 29 -18.797 -5.056 -1.655 1.00 0.00 N ATOM 459 CA LYS A 29 -18.578 -5.066 -3.093 1.00 0.00 C ATOM 460 C LYS A 29 -17.263 -5.770 -3.420 1.00 0.00 C ATOM 461 O LYS A 29 -17.167 -6.502 -4.404 1.00 0.00 O ATOM 462 CB LYS A 29 -18.596 -3.640 -3.649 1.00 0.00 C ATOM 463 CG LYS A 29 -19.995 -3.043 -3.691 1.00 0.00 C ATOM 464 CD LYS A 29 -19.995 -1.577 -4.099 1.00 0.00 C ATOM 465 CE LYS A 29 -21.418 -1.035 -4.158 1.00 0.00 C ATOM 466 NZ LYS A 29 -21.476 0.406 -4.530 1.00 0.00 N ATOM 0 H LYS A 29 -18.808 -4.125 -1.238 1.00 0.00 H new ATOM 0 HA LYS A 29 -19.388 -5.619 -3.569 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -17.954 -3.007 -3.036 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -18.176 -3.641 -4.655 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -20.607 -3.611 -4.391 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -20.458 -3.143 -2.709 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -19.408 -0.996 -3.387 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -19.517 -1.465 -5.072 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -21.992 -1.615 -4.881 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -21.894 -1.174 -3.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -22.437 0.644 -4.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -21.233 0.988 -3.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -20.799 0.594 -5.297 1.00 0.00 H new ATOM 480 N ILE A 30 -16.257 -5.561 -2.576 1.00 0.00 N ATOM 481 CA ILE A 30 -14.975 -6.218 -2.767 1.00 0.00 C ATOM 482 C ILE A 30 -15.123 -7.698 -2.430 1.00 0.00 C ATOM 483 O ILE A 30 -14.513 -8.560 -3.058 1.00 0.00 O ATOM 484 CB ILE A 30 -13.863 -5.589 -1.897 1.00 0.00 C ATOM 485 CG1 ILE A 30 -13.776 -4.082 -2.154 1.00 0.00 C ATOM 486 CG2 ILE A 30 -12.528 -6.257 -2.194 1.00 0.00 C ATOM 487 CD1 ILE A 30 -12.895 -3.337 -1.171 1.00 0.00 C ATOM 0 H ILE A 30 -16.306 -4.948 -1.762 1.00 0.00 H new ATOM 0 HA ILE A 30 -14.679 -6.091 -3.808 1.00 0.00 H new ATOM 0 HB ILE A 30 -14.106 -5.746 -0.846 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -13.397 -3.917 -3.163 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -14.780 -3.659 -2.118 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -11.751 -5.807 -1.576 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -12.597 -7.322 -1.972 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -12.279 -6.121 -3.246 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -12.886 -2.276 -1.422 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -13.285 -3.468 -0.161 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -11.880 -3.730 -1.222 1.00 0.00 H new ATOM 499 N GLN A 31 -15.975 -7.981 -1.454 1.00 0.00 N ATOM 500 CA GLN A 31 -16.243 -9.348 -1.035 1.00 0.00 C ATOM 501 C GLN A 31 -16.965 -10.104 -2.152 1.00 0.00 C ATOM 502 O GLN A 31 -16.752 -11.293 -2.358 1.00 0.00 O ATOM 503 CB GLN A 31 -17.097 -9.353 0.234 1.00 0.00 C ATOM 504 CG GLN A 31 -17.444 -10.748 0.733 1.00 0.00 C ATOM 505 CD GLN A 31 -18.765 -10.789 1.471 1.00 0.00 C ATOM 506 OE1 GLN A 31 -19.162 -9.820 2.115 1.00 0.00 O ATOM 507 NE2 GLN A 31 -19.459 -11.913 1.382 1.00 0.00 N ATOM 0 H GLN A 31 -16.496 -7.275 -0.934 1.00 0.00 H new ATOM 0 HA GLN A 31 -15.295 -9.843 -0.824 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -16.566 -8.817 1.021 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -18.020 -8.805 0.042 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -17.483 -11.434 -0.113 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -16.652 -11.102 1.393 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -19.095 -12.695 0.838 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -20.357 -11.997 1.858 1.00 0.00 H new ATOM 516 N ASP A 32 -17.808 -9.387 -2.875 1.00 0.00 N ATOM 517 CA ASP A 32 -18.577 -9.952 -3.977 1.00 0.00 C ATOM 518 C ASP A 32 -17.680 -10.259 -5.176 1.00 0.00 C ATOM 519 O ASP A 32 -17.909 -11.229 -5.899 1.00 0.00 O ATOM 520 CB ASP A 32 -19.693 -8.972 -4.365 1.00 0.00 C ATOM 521 CG ASP A 32 -20.227 -9.181 -5.769 1.00 0.00 C ATOM 522 OD1 ASP A 32 -21.071 -10.079 -5.970 1.00 0.00 O ATOM 523 OD2 ASP A 32 -19.827 -8.423 -6.673 1.00 0.00 O ATOM 0 H ASP A 32 -17.981 -8.394 -2.716 1.00 0.00 H new ATOM 0 HA ASP A 32 -19.020 -10.895 -3.656 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -20.514 -9.071 -3.655 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -19.316 -7.953 -4.277 1.00 0.00 H new ATOM 528 N LYS A 33 -16.642 -9.455 -5.363 1.00 0.00 N ATOM 529 CA LYS A 33 -15.731 -9.636 -6.491 1.00 0.00 C ATOM 530 C LYS A 33 -14.527 -10.519 -6.143 1.00 0.00 C ATOM 531 O LYS A 33 -14.261 -11.508 -6.827 1.00 0.00 O ATOM 532 CB LYS A 33 -15.248 -8.277 -7.009 1.00 0.00 C ATOM 533 CG LYS A 33 -16.348 -7.441 -7.646 1.00 0.00 C ATOM 534 CD LYS A 33 -15.772 -6.263 -8.418 1.00 0.00 C ATOM 535 CE LYS A 33 -16.846 -5.541 -9.218 1.00 0.00 C ATOM 536 NZ LYS A 33 -16.282 -4.439 -10.048 1.00 0.00 N ATOM 0 H LYS A 33 -16.408 -8.673 -4.752 1.00 0.00 H new ATOM 0 HA LYS A 33 -16.294 -10.149 -7.271 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -14.811 -7.717 -6.182 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -14.456 -8.437 -7.740 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -16.939 -8.064 -8.317 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -17.024 -7.076 -6.873 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -15.304 -5.566 -7.723 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -14.991 -6.615 -9.091 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -17.358 -6.255 -9.864 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -17.593 -5.135 -8.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -17.057 -3.910 -10.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -15.729 -3.797 -9.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -15.665 -4.839 -10.784 1.00 0.00 H new ATOM 550 N GLU A 34 -13.803 -10.164 -5.086 1.00 0.00 N ATOM 551 CA GLU A 34 -12.613 -10.911 -4.683 1.00 0.00 C ATOM 552 C GLU A 34 -12.955 -12.117 -3.811 1.00 0.00 C ATOM 553 O GLU A 34 -12.278 -13.144 -3.868 1.00 0.00 O ATOM 554 CB GLU A 34 -11.642 -9.996 -3.938 1.00 0.00 C ATOM 555 CG GLU A 34 -11.096 -8.858 -4.788 1.00 0.00 C ATOM 556 CD GLU A 34 -10.187 -9.342 -5.899 1.00 0.00 C ATOM 557 OE1 GLU A 34 -9.005 -9.623 -5.623 1.00 0.00 O ATOM 558 OE2 GLU A 34 -10.652 -9.446 -7.054 1.00 0.00 O ATOM 0 H GLU A 34 -14.019 -9.363 -4.492 1.00 0.00 H new ATOM 0 HA GLU A 34 -12.144 -11.283 -5.594 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -12.147 -9.577 -3.068 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -10.808 -10.592 -3.566 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -11.928 -8.302 -5.221 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -10.547 -8.165 -4.151 1.00 0.00 H new ATOM 565 N GLY A 35 -13.997 -11.991 -3.005 1.00 0.00 N ATOM 566 CA GLY A 35 -14.396 -13.086 -2.138 1.00 0.00 C ATOM 567 C GLY A 35 -13.797 -12.983 -0.750 1.00 0.00 C ATOM 568 O GLY A 35 -13.874 -13.920 0.043 1.00 0.00 O ATOM 0 H GLY A 35 -14.574 -11.153 -2.933 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -15.483 -13.104 -2.059 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -14.094 -14.030 -2.590 1.00 0.00 H new ATOM 572 N ILE A 36 -13.200 -11.837 -0.457 1.00 0.00 N ATOM 573 CA ILE A 36 -12.581 -11.602 0.840 1.00 0.00 C ATOM 574 C ILE A 36 -13.602 -11.035 1.826 1.00 0.00 C ATOM 575 O ILE A 36 -14.254 -10.036 1.533 1.00 0.00 O ATOM 576 CB ILE A 36 -11.393 -10.622 0.718 1.00 0.00 C ATOM 577 CG1 ILE A 36 -10.423 -11.100 -0.367 1.00 0.00 C ATOM 578 CG2 ILE A 36 -10.672 -10.483 2.054 1.00 0.00 C ATOM 579 CD1 ILE A 36 -9.424 -10.044 -0.794 1.00 0.00 C ATOM 0 H ILE A 36 -13.131 -11.051 -1.104 1.00 0.00 H new ATOM 0 HA ILE A 36 -12.213 -12.560 1.208 1.00 0.00 H new ATOM 0 HB ILE A 36 -11.779 -9.643 0.435 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -9.883 -11.973 -0.001 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -10.994 -11.421 -1.238 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -9.839 -9.789 1.947 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -11.366 -10.104 2.804 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -10.295 -11.457 2.367 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -8.770 -10.452 -1.564 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -9.956 -9.179 -1.191 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.827 -9.740 0.065 1.00 0.00 H new ATOM 591 N PRO A 37 -13.768 -11.676 2.995 1.00 0.00 N ATOM 592 CA PRO A 37 -14.714 -11.217 4.021 1.00 0.00 C ATOM 593 C PRO A 37 -14.372 -9.819 4.540 1.00 0.00 C ATOM 594 O PRO A 37 -13.211 -9.525 4.829 1.00 0.00 O ATOM 595 CB PRO A 37 -14.564 -12.251 5.142 1.00 0.00 C ATOM 596 CG PRO A 37 -13.926 -13.437 4.510 1.00 0.00 C ATOM 597 CD PRO A 37 -13.064 -12.905 3.403 1.00 0.00 C ATOM 0 HA PRO A 37 -15.728 -11.140 3.630 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -13.950 -11.862 5.954 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -15.533 -12.509 5.570 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -13.331 -13.992 5.235 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -14.678 -14.124 4.122 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -12.051 -12.695 3.746 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -12.981 -13.615 2.580 1.00 0.00 H new ATOM 605 N PRO A 38 -15.386 -8.936 4.655 1.00 0.00 N ATOM 606 CA PRO A 38 -15.207 -7.553 5.142 1.00 0.00 C ATOM 607 C PRO A 38 -14.492 -7.472 6.491 1.00 0.00 C ATOM 608 O PRO A 38 -13.801 -6.490 6.778 1.00 0.00 O ATOM 609 CB PRO A 38 -16.642 -7.042 5.278 1.00 0.00 C ATOM 610 CG PRO A 38 -17.433 -7.851 4.314 1.00 0.00 C ATOM 611 CD PRO A 38 -16.792 -9.210 4.292 1.00 0.00 C ATOM 0 HA PRO A 38 -14.581 -6.973 4.464 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -17.011 -7.169 6.296 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -16.706 -5.979 5.046 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -18.476 -7.916 4.623 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -17.422 -7.398 3.323 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -17.265 -9.888 5.003 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -16.869 -9.674 3.309 1.00 0.00 H new ATOM 619 N ASP A 39 -14.660 -8.504 7.313 1.00 0.00 N ATOM 620 CA ASP A 39 -14.036 -8.546 8.635 1.00 0.00 C ATOM 621 C ASP A 39 -12.520 -8.667 8.522 1.00 0.00 C ATOM 622 O ASP A 39 -11.792 -8.375 9.470 1.00 0.00 O ATOM 623 CB ASP A 39 -14.581 -9.717 9.450 1.00 0.00 C ATOM 624 CG ASP A 39 -16.083 -9.642 9.656 1.00 0.00 C ATOM 625 OD1 ASP A 39 -16.529 -8.885 10.541 1.00 0.00 O ATOM 626 OD2 ASP A 39 -16.821 -10.343 8.933 1.00 0.00 O ATOM 0 H ASP A 39 -15.223 -9.324 7.088 1.00 0.00 H new ATOM 0 HA ASP A 39 -14.277 -7.612 9.143 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -14.334 -10.651 8.945 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -14.086 -9.739 10.421 1.00 0.00 H new ATOM 631 N GLN A 40 -12.045 -9.098 7.361 1.00 0.00 N ATOM 632 CA GLN A 40 -10.614 -9.256 7.126 1.00 0.00 C ATOM 633 C GLN A 40 -10.112 -8.215 6.134 1.00 0.00 C ATOM 634 O GLN A 40 -9.054 -8.383 5.524 1.00 0.00 O ATOM 635 CB GLN A 40 -10.309 -10.662 6.597 1.00 0.00 C ATOM 636 CG GLN A 40 -10.374 -11.746 7.662 1.00 0.00 C ATOM 637 CD GLN A 40 -10.391 -13.145 7.069 1.00 0.00 C ATOM 638 OE1 GLN A 40 -10.985 -13.379 6.017 1.00 0.00 O ATOM 639 NE2 GLN A 40 -9.727 -14.077 7.732 1.00 0.00 N ATOM 0 H GLN A 40 -12.631 -9.346 6.564 1.00 0.00 H new ATOM 0 HA GLN A 40 -10.099 -9.113 8.076 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -11.016 -10.903 5.803 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -9.315 -10.664 6.150 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -9.517 -11.648 8.328 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -11.268 -11.601 8.269 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -9.248 -13.841 8.601 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -9.694 -15.032 7.374 1.00 0.00 H new ATOM 648 N GLN A 41 -10.863 -7.132 5.991 1.00 0.00 N ATOM 649 CA GLN A 41 -10.501 -6.070 5.061 1.00 0.00 C ATOM 650 C GLN A 41 -10.285 -4.738 5.770 1.00 0.00 C ATOM 651 O GLN A 41 -11.131 -4.286 6.543 1.00 0.00 O ATOM 652 CB GLN A 41 -11.594 -5.891 4.011 1.00 0.00 C ATOM 653 CG GLN A 41 -11.617 -6.958 2.936 1.00 0.00 C ATOM 654 CD GLN A 41 -12.659 -6.659 1.879 1.00 0.00 C ATOM 655 OE1 GLN A 41 -12.418 -5.889 0.960 1.00 0.00 O ATOM 656 NE2 GLN A 41 -13.823 -7.276 1.996 1.00 0.00 N ATOM 0 H GLN A 41 -11.727 -6.965 6.507 1.00 0.00 H new ATOM 0 HA GLN A 41 -9.565 -6.368 4.589 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -12.562 -5.878 4.512 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -11.467 -4.918 3.536 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -10.634 -7.028 2.470 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.824 -7.928 3.389 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -13.987 -7.912 2.777 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -14.557 -7.116 1.305 1.00 0.00 H new ATOM 665 N ARG A 42 -9.145 -4.121 5.499 1.00 0.00 N ATOM 666 CA ARG A 42 -8.803 -2.821 6.058 1.00 0.00 C ATOM 667 C ARG A 42 -8.603 -1.839 4.910 1.00 0.00 C ATOM 668 O ARG A 42 -7.725 -2.032 4.075 1.00 0.00 O ATOM 669 CB ARG A 42 -7.528 -2.900 6.904 1.00 0.00 C ATOM 670 CG ARG A 42 -7.763 -3.296 8.355 1.00 0.00 C ATOM 671 CD ARG A 42 -6.490 -3.149 9.179 1.00 0.00 C ATOM 672 NE ARG A 42 -6.727 -3.360 10.609 1.00 0.00 N ATOM 673 CZ ARG A 42 -5.763 -3.370 11.529 1.00 0.00 C ATOM 674 NH1 ARG A 42 -4.499 -3.135 11.187 1.00 0.00 N ATOM 675 NH2 ARG A 42 -6.065 -3.601 12.799 1.00 0.00 N ATOM 0 H ARG A 42 -8.429 -4.508 4.884 1.00 0.00 H new ATOM 0 HA ARG A 42 -9.612 -2.488 6.708 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -6.848 -3.620 6.449 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.029 -1.931 6.880 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -8.550 -2.674 8.782 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -8.112 -4.327 8.401 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -5.747 -3.864 8.827 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -6.073 -2.154 9.025 1.00 0.00 H new ATOM 0 HE ARG A 42 -7.687 -3.508 10.919 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -4.261 -2.945 10.214 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -3.768 -3.145 11.898 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.034 -3.771 13.070 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -5.329 -3.609 13.505 1.00 0.00 H new ATOM 689 N LEU A 43 -9.415 -0.796 4.863 1.00 0.00 N ATOM 690 CA LEU A 43 -9.313 0.182 3.790 1.00 0.00 C ATOM 691 C LEU A 43 -8.603 1.446 4.251 1.00 0.00 C ATOM 692 O LEU A 43 -9.078 2.160 5.139 1.00 0.00 O ATOM 693 CB LEU A 43 -10.700 0.530 3.246 1.00 0.00 C ATOM 694 CG LEU A 43 -11.283 -0.483 2.259 1.00 0.00 C ATOM 695 CD1 LEU A 43 -12.746 -0.178 1.980 1.00 0.00 C ATOM 696 CD2 LEU A 43 -10.487 -0.481 0.959 1.00 0.00 C ATOM 0 H LEU A 43 -10.146 -0.604 5.548 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.720 -0.267 2.994 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -11.387 0.633 4.086 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -10.648 1.502 2.756 1.00 0.00 H new ATOM 0 HG LEU A 43 -11.215 -1.474 2.708 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -13.142 -0.910 1.276 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -13.312 -0.226 2.910 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -12.834 0.821 1.553 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -10.916 -1.207 0.269 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -10.525 0.512 0.511 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -9.450 -0.746 1.167 1.00 0.00 H new ATOM 708 N ILE A 44 -7.455 1.709 3.648 1.00 0.00 N ATOM 709 CA ILE A 44 -6.674 2.894 3.969 1.00 0.00 C ATOM 710 C ILE A 44 -6.727 3.886 2.814 1.00 0.00 C ATOM 711 O ILE A 44 -6.444 3.535 1.667 1.00 0.00 O ATOM 712 CB ILE A 44 -5.193 2.550 4.285 1.00 0.00 C ATOM 713 CG1 ILE A 44 -5.079 1.868 5.657 1.00 0.00 C ATOM 714 CG2 ILE A 44 -4.312 3.800 4.233 1.00 0.00 C ATOM 715 CD1 ILE A 44 -3.647 1.671 6.134 1.00 0.00 C ATOM 0 H ILE A 44 -7.041 1.115 2.930 1.00 0.00 H new ATOM 0 HA ILE A 44 -7.114 3.337 4.862 1.00 0.00 H new ATOM 0 HB ILE A 44 -4.839 1.857 3.521 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -5.617 2.464 6.393 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -5.572 0.897 5.611 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -3.281 3.528 4.458 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.362 4.239 3.237 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -4.665 4.525 4.967 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -3.652 1.184 7.109 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -3.108 1.048 5.420 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -3.154 2.640 6.215 1.00 0.00 H new ATOM 727 N PHE A 45 -7.114 5.113 3.113 1.00 0.00 N ATOM 728 CA PHE A 45 -7.182 6.156 2.107 1.00 0.00 C ATOM 729 C PHE A 45 -6.411 7.375 2.591 1.00 0.00 C ATOM 730 O PHE A 45 -6.834 8.050 3.534 1.00 0.00 O ATOM 731 CB PHE A 45 -8.637 6.527 1.802 1.00 0.00 C ATOM 732 CG PHE A 45 -8.786 7.547 0.707 1.00 0.00 C ATOM 733 CD1 PHE A 45 -8.317 7.289 -0.568 1.00 0.00 C ATOM 734 CD2 PHE A 45 -9.394 8.766 0.962 1.00 0.00 C ATOM 735 CE1 PHE A 45 -8.453 8.224 -1.575 1.00 0.00 C ATOM 736 CE2 PHE A 45 -9.534 9.706 -0.040 1.00 0.00 C ATOM 737 CZ PHE A 45 -9.061 9.436 -1.311 1.00 0.00 C ATOM 0 H PHE A 45 -7.387 5.412 4.049 1.00 0.00 H new ATOM 0 HA PHE A 45 -6.733 5.788 1.185 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -9.181 5.625 1.522 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -9.102 6.911 2.710 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -7.838 6.344 -0.779 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -9.762 8.983 1.954 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -8.085 8.008 -2.567 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -10.013 10.651 0.169 1.00 0.00 H new ATOM 0 HZ PHE A 45 -9.167 10.171 -2.095 1.00 0.00 H new ATOM 747 N ALA A 46 -5.253 7.622 1.972 1.00 0.00 N ATOM 748 CA ALA A 46 -4.397 8.751 2.332 1.00 0.00 C ATOM 749 C ALA A 46 -3.899 8.608 3.770 1.00 0.00 C ATOM 750 O ALA A 46 -3.651 9.597 4.462 1.00 0.00 O ATOM 751 CB ALA A 46 -5.139 10.072 2.143 1.00 0.00 C ATOM 0 H ALA A 46 -4.886 7.048 1.213 1.00 0.00 H new ATOM 0 HA ALA A 46 -3.531 8.752 1.670 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -4.484 10.899 2.416 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -5.438 10.175 1.100 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -6.025 10.086 2.778 1.00 0.00 H new ATOM 757 N GLY A 47 -3.766 7.361 4.213 1.00 0.00 N ATOM 758 CA GLY A 47 -3.309 7.092 5.561 1.00 0.00 C ATOM 759 C GLY A 47 -4.443 7.010 6.563 1.00 0.00 C ATOM 760 O GLY A 47 -4.231 6.673 7.728 1.00 0.00 O ATOM 0 H GLY A 47 -3.968 6.530 3.658 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -2.754 6.154 5.571 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.616 7.876 5.867 1.00 0.00 H new ATOM 764 N LYS A 48 -5.647 7.319 6.112 1.00 0.00 N ATOM 765 CA LYS A 48 -6.810 7.289 6.984 1.00 0.00 C ATOM 766 C LYS A 48 -7.564 5.976 6.839 1.00 0.00 C ATOM 767 O LYS A 48 -7.827 5.522 5.728 1.00 0.00 O ATOM 768 CB LYS A 48 -7.744 8.460 6.665 1.00 0.00 C ATOM 769 CG LYS A 48 -7.043 9.812 6.616 1.00 0.00 C ATOM 770 CD LYS A 48 -8.036 10.964 6.543 1.00 0.00 C ATOM 771 CE LYS A 48 -8.531 11.198 5.127 1.00 0.00 C ATOM 772 NZ LYS A 48 -9.235 12.499 5.000 1.00 0.00 N ATOM 0 H LYS A 48 -5.845 7.593 5.150 1.00 0.00 H new ATOM 0 HA LYS A 48 -6.462 7.378 8.013 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -8.226 8.277 5.705 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -8.533 8.498 7.416 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -6.416 9.928 7.500 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.382 9.847 5.750 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -8.885 10.753 7.194 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.565 11.873 6.918 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -7.687 11.172 4.437 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -9.204 10.390 4.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -9.559 12.624 4.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -10.055 12.514 5.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -8.585 13.271 5.251 1.00 0.00 H new ATOM 786 N GLN A 49 -7.895 5.363 7.965 1.00 0.00 N ATOM 787 CA GLN A 49 -8.635 4.115 7.962 1.00 0.00 C ATOM 788 C GLN A 49 -10.130 4.415 7.958 1.00 0.00 C ATOM 789 O GLN A 49 -10.625 5.152 8.814 1.00 0.00 O ATOM 790 CB GLN A 49 -8.252 3.258 9.169 1.00 0.00 C ATOM 791 CG GLN A 49 -8.879 1.874 9.163 1.00 0.00 C ATOM 792 CD GLN A 49 -8.202 0.924 10.126 1.00 0.00 C ATOM 793 OE1 GLN A 49 -7.256 0.222 9.762 1.00 0.00 O ATOM 794 NE2 GLN A 49 -8.672 0.891 11.363 1.00 0.00 N ATOM 0 H GLN A 49 -7.661 5.712 8.894 1.00 0.00 H new ATOM 0 HA GLN A 49 -8.385 3.550 7.064 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -7.167 3.155 9.200 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -8.549 3.777 10.080 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -9.935 1.956 9.422 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -8.829 1.461 8.156 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -9.457 1.487 11.627 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -8.250 0.269 12.053 1.00 0.00 H new ATOM 803 N LEU A 50 -10.839 3.854 6.991 1.00 0.00 N ATOM 804 CA LEU A 50 -12.274 4.087 6.868 1.00 0.00 C ATOM 805 C LEU A 50 -13.079 3.077 7.682 1.00 0.00 C ATOM 806 O LEU A 50 -12.775 1.884 7.687 1.00 0.00 O ATOM 807 CB LEU A 50 -12.707 4.011 5.398 1.00 0.00 C ATOM 808 CG LEU A 50 -11.676 4.489 4.371 1.00 0.00 C ATOM 809 CD1 LEU A 50 -12.175 4.237 2.962 1.00 0.00 C ATOM 810 CD2 LEU A 50 -11.353 5.966 4.557 1.00 0.00 C ATOM 0 H LEU A 50 -10.448 3.235 6.281 1.00 0.00 H new ATOM 0 HA LEU A 50 -12.473 5.085 7.258 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -12.967 2.978 5.169 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -13.614 4.603 5.276 1.00 0.00 H new ATOM 0 HG LEU A 50 -10.760 3.920 4.530 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -11.430 4.583 2.245 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -12.346 3.170 2.822 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -13.108 4.777 2.804 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -10.618 6.274 3.813 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -12.262 6.555 4.436 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -10.947 6.127 5.556 1.00 0.00 H new ATOM 822 N GLU A 51 -14.103 3.567 8.369 1.00 0.00 N ATOM 823 CA GLU A 51 -14.973 2.710 9.167 1.00 0.00 C ATOM 824 C GLU A 51 -16.195 2.307 8.352 1.00 0.00 C ATOM 825 O GLU A 51 -16.723 3.108 7.580 1.00 0.00 O ATOM 826 CB GLU A 51 -15.418 3.416 10.447 1.00 0.00 C ATOM 827 CG GLU A 51 -14.266 3.876 11.325 1.00 0.00 C ATOM 828 CD GLU A 51 -14.736 4.562 12.591 1.00 0.00 C ATOM 829 OE1 GLU A 51 -15.204 5.716 12.503 1.00 0.00 O ATOM 830 OE2 GLU A 51 -14.632 3.953 13.678 1.00 0.00 O ATOM 0 H GLU A 51 -14.353 4.556 8.390 1.00 0.00 H new ATOM 0 HA GLU A 51 -14.409 1.819 9.444 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -16.028 4.280 10.181 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -16.053 2.742 11.021 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -13.650 3.017 11.589 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -13.633 4.560 10.759 1.00 0.00 H new ATOM 837 N ASP A 52 -16.643 1.071 8.533 1.00 0.00 N ATOM 838 CA ASP A 52 -17.796 0.538 7.805 1.00 0.00 C ATOM 839 C ASP A 52 -19.050 1.380 8.005 1.00 0.00 C ATOM 840 O ASP A 52 -19.829 1.573 7.070 1.00 0.00 O ATOM 841 CB ASP A 52 -18.090 -0.894 8.250 1.00 0.00 C ATOM 842 CG ASP A 52 -16.943 -1.841 7.988 1.00 0.00 C ATOM 843 OD1 ASP A 52 -15.921 -1.752 8.701 1.00 0.00 O ATOM 844 OD2 ASP A 52 -17.055 -2.687 7.073 1.00 0.00 O ATOM 0 H ASP A 52 -16.222 0.409 9.185 1.00 0.00 H new ATOM 0 HA ASP A 52 -17.534 0.562 6.747 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -18.321 -0.897 9.315 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -18.978 -1.255 7.731 1.00 0.00 H new ATOM 849 N GLY A 53 -19.227 1.898 9.216 1.00 0.00 N ATOM 850 CA GLY A 53 -20.402 2.695 9.528 1.00 0.00 C ATOM 851 C GLY A 53 -20.307 4.139 9.065 1.00 0.00 C ATOM 852 O GLY A 53 -21.009 5.006 9.585 1.00 0.00 O ATOM 0 H GLY A 53 -18.575 1.780 9.991 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -21.275 2.233 9.068 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -20.564 2.679 10.606 1.00 0.00 H new ATOM 856 N ARG A 54 -19.445 4.411 8.098 1.00 0.00 N ATOM 857 CA ARG A 54 -19.287 5.759 7.577 1.00 0.00 C ATOM 858 C ARG A 54 -19.584 5.768 6.088 1.00 0.00 C ATOM 859 O ARG A 54 -19.702 4.708 5.467 1.00 0.00 O ATOM 860 CB ARG A 54 -17.865 6.268 7.820 1.00 0.00 C ATOM 861 CG ARG A 54 -17.382 6.093 9.244 1.00 0.00 C ATOM 862 CD ARG A 54 -17.928 7.170 10.163 1.00 0.00 C ATOM 863 NE ARG A 54 -17.278 7.118 11.470 1.00 0.00 N ATOM 864 CZ ARG A 54 -17.597 7.894 12.500 1.00 0.00 C ATOM 865 NH1 ARG A 54 -18.592 8.766 12.413 1.00 0.00 N ATOM 866 NH2 ARG A 54 -16.916 7.777 13.628 1.00 0.00 N ATOM 0 H ARG A 54 -18.843 3.715 7.658 1.00 0.00 H new ATOM 0 HA ARG A 54 -19.985 6.416 8.095 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -17.183 5.745 7.149 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -17.819 7.325 7.559 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -17.686 5.113 9.613 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -16.292 6.117 9.263 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -17.772 8.151 9.714 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -19.004 7.041 10.282 1.00 0.00 H new ATOM 0 HE ARG A 54 -16.528 6.439 11.601 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -19.124 8.848 11.547 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -18.825 9.355 13.212 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -16.158 7.098 13.698 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -17.149 8.366 14.428 1.00 0.00 H new ATOM 880 N THR A 55 -19.707 6.953 5.524 1.00 0.00 N ATOM 881 CA THR A 55 -19.971 7.101 4.106 1.00 0.00 C ATOM 882 C THR A 55 -18.734 7.651 3.398 1.00 0.00 C ATOM 883 O THR A 55 -17.830 8.186 4.046 1.00 0.00 O ATOM 884 CB THR A 55 -21.187 8.025 3.853 1.00 0.00 C ATOM 885 OG1 THR A 55 -21.255 9.062 4.848 1.00 0.00 O ATOM 886 CG2 THR A 55 -22.484 7.230 3.869 1.00 0.00 C ATOM 0 H THR A 55 -19.628 7.835 6.031 1.00 0.00 H new ATOM 0 HA THR A 55 -20.208 6.117 3.702 1.00 0.00 H new ATOM 0 HB THR A 55 -21.057 8.478 2.870 1.00 0.00 H new ATOM 0 HG1 THR A 55 -20.377 9.168 5.271 1.00 0.00 H new ATOM 0 HG21 THR A 55 -23.324 7.901 3.689 1.00 0.00 H new ATOM 0 HG22 THR A 55 -22.454 6.469 3.089 1.00 0.00 H new ATOM 0 HG23 THR A 55 -22.605 6.750 4.840 1.00 0.00 H new ATOM 894 N LEU A 56 -18.687 7.511 2.080 1.00 0.00 N ATOM 895 CA LEU A 56 -17.550 7.992 1.296 1.00 0.00 C ATOM 896 C LEU A 56 -17.404 9.507 1.410 1.00 0.00 C ATOM 897 O LEU A 56 -16.292 10.040 1.387 1.00 0.00 O ATOM 898 CB LEU A 56 -17.707 7.578 -0.169 1.00 0.00 C ATOM 899 CG LEU A 56 -17.610 6.075 -0.426 1.00 0.00 C ATOM 900 CD1 LEU A 56 -18.123 5.748 -1.814 1.00 0.00 C ATOM 901 CD2 LEU A 56 -16.170 5.600 -0.268 1.00 0.00 C ATOM 0 H LEU A 56 -19.422 7.068 1.528 1.00 0.00 H new ATOM 0 HA LEU A 56 -16.644 7.538 1.696 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -18.673 7.932 -0.530 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -16.942 8.083 -0.758 1.00 0.00 H new ATOM 0 HG LEU A 56 -18.227 5.556 0.307 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -18.049 4.674 -1.986 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -19.164 6.058 -1.899 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -17.525 6.276 -2.557 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -16.118 4.527 -0.454 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -15.534 6.123 -0.982 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -15.827 5.809 0.745 1.00 0.00 H new ATOM 913 N SER A 57 -18.527 10.195 1.563 1.00 0.00 N ATOM 914 CA SER A 57 -18.525 11.646 1.689 1.00 0.00 C ATOM 915 C SER A 57 -17.884 12.096 3.004 1.00 0.00 C ATOM 916 O SER A 57 -17.383 13.215 3.105 1.00 0.00 O ATOM 917 CB SER A 57 -19.956 12.161 1.597 1.00 0.00 C ATOM 918 OG SER A 57 -20.868 11.213 2.135 1.00 0.00 O ATOM 0 H SER A 57 -19.454 9.770 1.603 1.00 0.00 H new ATOM 0 HA SER A 57 -17.930 12.062 0.876 1.00 0.00 H new ATOM 0 HB2 SER A 57 -20.044 13.104 2.137 1.00 0.00 H new ATOM 0 HB3 SER A 57 -20.208 12.365 0.556 1.00 0.00 H new ATOM 0 HG SER A 57 -21.113 10.565 1.442 1.00 0.00 H new ATOM 924 N ASP A 58 -17.879 11.209 4.000 1.00 0.00 N ATOM 925 CA ASP A 58 -17.306 11.523 5.310 1.00 0.00 C ATOM 926 C ASP A 58 -15.807 11.783 5.210 1.00 0.00 C ATOM 927 O ASP A 58 -15.263 12.636 5.908 1.00 0.00 O ATOM 928 CB ASP A 58 -17.548 10.378 6.298 1.00 0.00 C ATOM 929 CG ASP A 58 -18.975 10.338 6.805 1.00 0.00 C ATOM 930 OD1 ASP A 58 -19.501 11.396 7.197 1.00 0.00 O ATOM 931 OD2 ASP A 58 -19.573 9.245 6.815 1.00 0.00 O ATOM 0 H ASP A 58 -18.265 10.268 3.925 1.00 0.00 H new ATOM 0 HA ASP A 58 -17.800 12.425 5.670 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -17.311 9.430 5.815 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -16.869 10.483 7.144 1.00 0.00 H new ATOM 936 N TYR A 59 -15.144 11.045 4.337 1.00 0.00 N ATOM 937 CA TYR A 59 -13.707 11.190 4.158 1.00 0.00 C ATOM 938 C TYR A 59 -13.402 12.012 2.914 1.00 0.00 C ATOM 939 O TYR A 59 -12.259 12.075 2.463 1.00 0.00 O ATOM 940 CB TYR A 59 -13.044 9.814 4.069 1.00 0.00 C ATOM 941 CG TYR A 59 -13.323 8.935 5.267 1.00 0.00 C ATOM 942 CD1 TYR A 59 -12.571 9.056 6.427 1.00 0.00 C ATOM 943 CD2 TYR A 59 -14.336 7.981 5.236 1.00 0.00 C ATOM 944 CE1 TYR A 59 -12.819 8.252 7.526 1.00 0.00 C ATOM 945 CE2 TYR A 59 -14.591 7.175 6.330 1.00 0.00 C ATOM 946 CZ TYR A 59 -13.829 7.314 7.471 1.00 0.00 C ATOM 947 OH TYR A 59 -14.078 6.510 8.561 1.00 0.00 O ATOM 0 H TYR A 59 -15.576 10.339 3.741 1.00 0.00 H new ATOM 0 HA TYR A 59 -13.301 11.717 5.022 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -13.392 9.309 3.168 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -11.967 9.944 3.966 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -11.779 9.789 6.473 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -14.933 7.869 4.343 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -12.225 8.358 8.422 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -15.382 6.441 6.291 1.00 0.00 H new ATOM 0 HH TYR A 59 -14.312 7.068 9.332 1.00 0.00 H new ATOM 957 N ASN A 60 -14.450 12.638 2.372 1.00 0.00 N ATOM 958 CA ASN A 60 -14.345 13.487 1.181 1.00 0.00 C ATOM 959 C ASN A 60 -13.814 12.703 -0.012 1.00 0.00 C ATOM 960 O ASN A 60 -13.073 13.237 -0.841 1.00 0.00 O ATOM 961 CB ASN A 60 -13.451 14.708 1.451 1.00 0.00 C ATOM 962 CG ASN A 60 -14.132 15.767 2.305 1.00 0.00 C ATOM 963 OD1 ASN A 60 -15.351 15.937 2.258 1.00 0.00 O ATOM 964 ND2 ASN A 60 -13.346 16.486 3.096 1.00 0.00 N ATOM 0 H ASN A 60 -15.396 12.571 2.747 1.00 0.00 H new ATOM 0 HA ASN A 60 -15.349 13.837 0.942 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -12.538 14.380 1.948 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -13.154 15.151 0.500 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -13.747 17.209 3.693 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -12.340 16.316 3.107 1.00 0.00 H new ATOM 971 N ILE A 61 -14.199 11.439 -0.102 1.00 0.00 N ATOM 972 CA ILE A 61 -13.759 10.590 -1.197 1.00 0.00 C ATOM 973 C ILE A 61 -14.584 10.866 -2.448 1.00 0.00 C ATOM 974 O ILE A 61 -15.778 10.566 -2.502 1.00 0.00 O ATOM 975 CB ILE A 61 -13.855 9.092 -0.828 1.00 0.00 C ATOM 976 CG1 ILE A 61 -13.099 8.827 0.479 1.00 0.00 C ATOM 977 CG2 ILE A 61 -13.296 8.220 -1.950 1.00 0.00 C ATOM 978 CD1 ILE A 61 -13.326 7.445 1.053 1.00 0.00 C ATOM 0 H ILE A 61 -14.814 10.980 0.569 1.00 0.00 H new ATOM 0 HA ILE A 61 -12.713 10.825 -1.394 1.00 0.00 H new ATOM 0 HB ILE A 61 -14.905 8.835 -0.690 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -12.032 8.966 0.304 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -13.400 9.570 1.218 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -13.374 7.170 -1.668 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -13.865 8.394 -2.863 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -12.250 8.473 -2.121 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -12.757 7.337 1.976 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -14.387 7.308 1.262 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -12.998 6.694 0.334 1.00 0.00 H new ATOM 990 N GLN A 62 -13.940 11.464 -3.442 1.00 0.00 N ATOM 991 CA GLN A 62 -14.602 11.792 -4.697 1.00 0.00 C ATOM 992 C GLN A 62 -14.326 10.718 -5.746 1.00 0.00 C ATOM 993 O GLN A 62 -13.782 9.658 -5.434 1.00 0.00 O ATOM 994 CB GLN A 62 -14.135 13.162 -5.195 1.00 0.00 C ATOM 995 CG GLN A 62 -14.522 14.305 -4.270 1.00 0.00 C ATOM 996 CD GLN A 62 -13.688 15.553 -4.499 1.00 0.00 C ATOM 997 OE1 GLN A 62 -14.052 16.426 -5.291 1.00 0.00 O ATOM 998 NE2 GLN A 62 -12.569 15.648 -3.800 1.00 0.00 N ATOM 0 H GLN A 62 -12.957 11.732 -3.403 1.00 0.00 H new ATOM 0 HA GLN A 62 -15.678 11.831 -4.525 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -13.051 13.148 -5.310 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -14.558 13.345 -6.183 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -15.575 14.545 -4.417 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -14.410 13.983 -3.235 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -12.305 14.903 -3.156 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -11.970 16.467 -3.905 1.00 0.00 H new ATOM 1007 N LYS A 63 -14.699 11.002 -6.984 1.00 0.00 N ATOM 1008 CA LYS A 63 -14.511 10.067 -8.080 1.00 0.00 C ATOM 1009 C LYS A 63 -13.035 9.943 -8.461 1.00 0.00 C ATOM 1010 O LYS A 63 -12.224 10.823 -8.149 1.00 0.00 O ATOM 1011 CB LYS A 63 -15.325 10.516 -9.296 1.00 0.00 C ATOM 1012 CG LYS A 63 -14.881 11.853 -9.868 1.00 0.00 C ATOM 1013 CD LYS A 63 -15.747 12.269 -11.041 1.00 0.00 C ATOM 1014 CE LYS A 63 -15.215 13.526 -11.707 1.00 0.00 C ATOM 1015 NZ LYS A 63 -16.200 14.104 -12.656 1.00 0.00 N ATOM 0 H LYS A 63 -15.138 11.882 -7.255 1.00 0.00 H new ATOM 0 HA LYS A 63 -14.859 9.088 -7.749 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -15.250 9.755 -10.073 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -16.376 10.582 -9.015 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -14.927 12.616 -9.091 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -13.841 11.786 -10.187 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -15.788 11.459 -11.770 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -16.767 12.441 -10.698 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -14.967 14.265 -10.945 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -14.292 13.294 -12.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -15.802 14.961 -13.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -16.417 13.408 -13.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -17.072 14.349 -12.145 1.00 0.00 H new ATOM 1029 N GLU A 64 -12.702 8.829 -9.121 1.00 0.00 N ATOM 1030 CA GLU A 64 -11.339 8.549 -9.583 1.00 0.00 C ATOM 1031 C GLU A 64 -10.345 8.470 -8.427 1.00 0.00 C ATOM 1032 O GLU A 64 -9.164 8.787 -8.583 1.00 0.00 O ATOM 1033 CB GLU A 64 -10.895 9.607 -10.602 1.00 0.00 C ATOM 1034 CG GLU A 64 -11.799 9.687 -11.823 1.00 0.00 C ATOM 1035 CD GLU A 64 -11.364 10.759 -12.795 1.00 0.00 C ATOM 1036 OE1 GLU A 64 -11.232 11.926 -12.377 1.00 0.00 O ATOM 1037 OE2 GLU A 64 -11.148 10.438 -13.986 1.00 0.00 O ATOM 0 H GLU A 64 -13.372 8.095 -9.350 1.00 0.00 H new ATOM 0 HA GLU A 64 -11.352 7.571 -10.065 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -10.868 10.582 -10.114 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -9.878 9.385 -10.926 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -11.806 8.722 -12.330 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -12.822 9.885 -11.502 1.00 0.00 H new ATOM 1044 N SER A 65 -10.822 8.047 -7.269 1.00 0.00 N ATOM 1045 CA SER A 65 -9.966 7.912 -6.104 1.00 0.00 C ATOM 1046 C SER A 65 -9.494 6.470 -5.967 1.00 0.00 C ATOM 1047 O SER A 65 -10.268 5.535 -6.175 1.00 0.00 O ATOM 1048 CB SER A 65 -10.707 8.352 -4.841 1.00 0.00 C ATOM 1049 OG SER A 65 -11.145 9.695 -4.952 1.00 0.00 O ATOM 0 H SER A 65 -11.797 7.791 -7.111 1.00 0.00 H new ATOM 0 HA SER A 65 -9.096 8.556 -6.233 1.00 0.00 H new ATOM 0 HB2 SER A 65 -11.563 7.699 -4.671 1.00 0.00 H new ATOM 0 HB3 SER A 65 -10.052 8.250 -3.976 1.00 0.00 H new ATOM 0 HG SER A 65 -12.072 9.712 -5.271 1.00 0.00 H new ATOM 1055 N THR A 66 -8.221 6.293 -5.644 1.00 0.00 N ATOM 1056 CA THR A 66 -7.655 4.964 -5.481 1.00 0.00 C ATOM 1057 C THR A 66 -7.451 4.644 -3.998 1.00 0.00 C ATOM 1058 O THR A 66 -6.736 5.357 -3.292 1.00 0.00 O ATOM 1059 CB THR A 66 -6.319 4.843 -6.238 1.00 0.00 C ATOM 1060 OG1 THR A 66 -6.442 5.475 -7.519 1.00 0.00 O ATOM 1061 CG2 THR A 66 -5.928 3.384 -6.425 1.00 0.00 C ATOM 0 H THR A 66 -7.561 7.055 -5.490 1.00 0.00 H new ATOM 0 HA THR A 66 -8.357 4.244 -5.901 1.00 0.00 H new ATOM 0 HB THR A 66 -5.542 5.333 -5.652 1.00 0.00 H new ATOM 0 HG1 THR A 66 -5.593 5.401 -8.003 1.00 0.00 H new ATOM 0 HG21 THR A 66 -4.981 3.327 -6.962 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.821 2.908 -5.450 1.00 0.00 H new ATOM 0 HG23 THR A 66 -6.701 2.871 -6.997 1.00 0.00 H new ATOM 1069 N LEU A 67 -8.091 3.581 -3.537 1.00 0.00 N ATOM 1070 CA LEU A 67 -8.003 3.173 -2.142 1.00 0.00 C ATOM 1071 C LEU A 67 -6.962 2.076 -1.948 1.00 0.00 C ATOM 1072 O LEU A 67 -6.648 1.327 -2.879 1.00 0.00 O ATOM 1073 CB LEU A 67 -9.368 2.675 -1.647 1.00 0.00 C ATOM 1074 CG LEU A 67 -10.365 3.763 -1.237 1.00 0.00 C ATOM 1075 CD1 LEU A 67 -11.004 4.408 -2.459 1.00 0.00 C ATOM 1076 CD2 LEU A 67 -11.429 3.176 -0.326 1.00 0.00 C ATOM 0 H LEU A 67 -8.681 2.981 -4.113 1.00 0.00 H new ATOM 0 HA LEU A 67 -7.698 4.044 -1.562 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -9.821 2.071 -2.434 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -9.206 2.017 -0.794 1.00 0.00 H new ATOM 0 HG LEU A 67 -9.824 4.539 -0.695 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -11.707 5.177 -2.139 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -10.230 4.860 -3.079 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -11.533 3.650 -3.036 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -12.134 3.957 -0.039 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -11.960 2.383 -0.851 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -10.958 2.767 0.568 1.00 0.00 H new ATOM 1088 N HIS A 68 -6.432 1.991 -0.735 1.00 0.00 N ATOM 1089 CA HIS A 68 -5.443 0.980 -0.389 1.00 0.00 C ATOM 1090 C HIS A 68 -6.112 -0.136 0.404 1.00 0.00 C ATOM 1091 O HIS A 68 -6.562 0.085 1.531 1.00 0.00 O ATOM 1092 CB HIS A 68 -4.309 1.596 0.442 1.00 0.00 C ATOM 1093 CG HIS A 68 -3.189 2.156 -0.376 1.00 0.00 C ATOM 1094 ND1 HIS A 68 -2.715 3.445 -0.234 1.00 0.00 N ATOM 1095 CD2 HIS A 68 -2.436 1.590 -1.344 1.00 0.00 C ATOM 1096 CE1 HIS A 68 -1.721 3.639 -1.075 1.00 0.00 C ATOM 1097 NE2 HIS A 68 -1.526 2.530 -1.762 1.00 0.00 N ATOM 0 H HIS A 68 -6.674 2.617 0.033 1.00 0.00 H new ATOM 0 HA HIS A 68 -5.020 0.575 -1.308 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -4.720 2.389 1.067 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -3.910 0.835 1.113 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -2.532 0.582 -1.721 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -1.158 4.554 -1.184 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -0.818 2.393 -2.483 1.00 0.00 H new ATOM 1106 N LEU A 69 -6.198 -1.321 -0.184 1.00 0.00 N ATOM 1107 CA LEU A 69 -6.828 -2.449 0.485 1.00 0.00 C ATOM 1108 C LEU A 69 -5.799 -3.291 1.230 1.00 0.00 C ATOM 1109 O LEU A 69 -4.895 -3.872 0.627 1.00 0.00 O ATOM 1110 CB LEU A 69 -7.586 -3.318 -0.521 1.00 0.00 C ATOM 1111 CG LEU A 69 -8.197 -4.602 0.056 1.00 0.00 C ATOM 1112 CD1 LEU A 69 -9.304 -4.279 1.046 1.00 0.00 C ATOM 1113 CD2 LEU A 69 -8.715 -5.494 -1.059 1.00 0.00 C ATOM 0 H LEU A 69 -5.842 -1.525 -1.118 1.00 0.00 H new ATOM 0 HA LEU A 69 -7.536 -2.050 1.211 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.384 -2.722 -0.963 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -6.906 -3.589 -1.328 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.415 -5.141 0.591 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.721 -5.206 1.441 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.898 -3.686 1.865 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -10.088 -3.714 0.543 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.145 -6.400 -0.631 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -9.480 -4.962 -1.625 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -7.893 -5.761 -1.723 1.00 0.00 H new ATOM 1125 N VAL A 70 -5.943 -3.341 2.543 1.00 0.00 N ATOM 1126 CA VAL A 70 -5.053 -4.112 3.396 1.00 0.00 C ATOM 1127 C VAL A 70 -5.802 -5.336 3.919 1.00 0.00 C ATOM 1128 O VAL A 70 -6.981 -5.243 4.255 1.00 0.00 O ATOM 1129 CB VAL A 70 -4.543 -3.264 4.582 1.00 0.00 C ATOM 1130 CG1 VAL A 70 -3.505 -4.028 5.387 1.00 0.00 C ATOM 1131 CG2 VAL A 70 -3.965 -1.947 4.084 1.00 0.00 C ATOM 0 H VAL A 70 -6.680 -2.849 3.048 1.00 0.00 H new ATOM 0 HA VAL A 70 -4.188 -4.423 2.810 1.00 0.00 H new ATOM 0 HB VAL A 70 -5.389 -3.049 5.235 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -3.161 -3.410 6.217 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -3.949 -4.944 5.777 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.660 -4.278 4.746 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -3.610 -1.361 4.932 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -3.134 -2.147 3.408 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -4.737 -1.388 3.555 1.00 0.00 H new ATOM 1141 N LEU A 71 -5.130 -6.475 3.973 1.00 0.00 N ATOM 1142 CA LEU A 71 -5.755 -7.704 4.446 1.00 0.00 C ATOM 1143 C LEU A 71 -5.463 -7.940 5.924 1.00 0.00 C ATOM 1144 O LEU A 71 -4.563 -7.329 6.500 1.00 0.00 O ATOM 1145 CB LEU A 71 -5.269 -8.896 3.619 1.00 0.00 C ATOM 1146 CG LEU A 71 -5.465 -8.760 2.107 1.00 0.00 C ATOM 1147 CD1 LEU A 71 -4.869 -9.960 1.383 1.00 0.00 C ATOM 1148 CD2 LEU A 71 -6.939 -8.619 1.770 1.00 0.00 C ATOM 0 H LEU A 71 -4.154 -6.576 3.696 1.00 0.00 H new ATOM 0 HA LEU A 71 -6.833 -7.600 4.326 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.209 -9.050 3.820 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.791 -9.791 3.958 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.947 -7.861 1.774 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.017 -9.847 0.309 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -3.802 -10.021 1.598 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.361 -10.871 1.723 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.058 -8.524 0.691 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.478 -9.500 2.118 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.341 -7.732 2.259 1.00 0.00 H new ATOM 1160 N ARG A 72 -6.242 -8.823 6.530 1.00 0.00 N ATOM 1161 CA ARG A 72 -6.085 -9.160 7.936 1.00 0.00 C ATOM 1162 C ARG A 72 -5.535 -10.576 8.070 1.00 0.00 C ATOM 1163 O ARG A 72 -6.278 -11.526 8.327 1.00 0.00 O ATOM 1164 CB ARG A 72 -7.437 -9.040 8.640 1.00 0.00 C ATOM 1165 CG ARG A 72 -7.365 -9.091 10.156 1.00 0.00 C ATOM 1166 CD ARG A 72 -8.754 -9.042 10.768 1.00 0.00 C ATOM 1167 NE ARG A 72 -8.748 -8.458 12.108 1.00 0.00 N ATOM 1168 CZ ARG A 72 -9.764 -7.766 12.627 1.00 0.00 C ATOM 1169 NH1 ARG A 72 -10.868 -7.561 11.919 1.00 0.00 N ATOM 1170 NH2 ARG A 72 -9.680 -7.276 13.858 1.00 0.00 N ATOM 0 H ARG A 72 -6.998 -9.324 6.063 1.00 0.00 H new ATOM 0 HA ARG A 72 -5.381 -8.471 8.402 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -7.905 -8.102 8.343 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -8.086 -9.844 8.293 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -6.858 -10.003 10.469 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -6.772 -8.254 10.524 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -9.413 -8.460 10.123 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -9.164 -10.051 10.815 1.00 0.00 H new ATOM 0 HE ARG A 72 -7.915 -8.588 12.682 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -10.943 -7.933 10.972 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -11.641 -7.031 12.322 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -8.836 -7.428 14.411 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -10.459 -6.748 14.251 1.00 0.00 H new ATOM 1184 N LEU A 73 -4.234 -10.716 7.872 1.00 0.00 N ATOM 1185 CA LEU A 73 -3.587 -12.018 7.956 1.00 0.00 C ATOM 1186 C LEU A 73 -3.030 -12.268 9.351 1.00 0.00 C ATOM 1187 O LEU A 73 -2.673 -11.334 10.069 1.00 0.00 O ATOM 1188 CB LEU A 73 -2.470 -12.127 6.917 1.00 0.00 C ATOM 1189 CG LEU A 73 -2.910 -11.906 5.465 1.00 0.00 C ATOM 1190 CD1 LEU A 73 -1.730 -12.057 4.518 1.00 0.00 C ATOM 1191 CD2 LEU A 73 -4.019 -12.883 5.091 1.00 0.00 C ATOM 0 H LEU A 73 -3.604 -9.945 7.652 1.00 0.00 H new ATOM 0 HA LEU A 73 -4.340 -12.779 7.749 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -1.696 -11.399 7.161 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -2.016 -13.115 6.997 1.00 0.00 H new ATOM 0 HG LEU A 73 -3.295 -10.890 5.374 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -2.063 -11.896 3.493 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -0.965 -11.323 4.770 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -1.315 -13.060 4.611 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -4.320 -12.713 4.057 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -3.656 -13.905 5.200 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -4.875 -12.730 5.748 1.00 0.00 H new ATOM 1203 N ARG A 74 -2.964 -13.537 9.730 1.00 0.00 N ATOM 1204 CA ARG A 74 -2.457 -13.917 11.040 1.00 0.00 C ATOM 1205 C ARG A 74 -0.937 -14.027 11.025 1.00 0.00 C ATOM 1206 O ARG A 74 -0.285 -13.866 12.056 1.00 0.00 O ATOM 1207 CB ARG A 74 -3.077 -15.245 11.483 1.00 0.00 C ATOM 1208 CG ARG A 74 -4.595 -15.208 11.583 1.00 0.00 C ATOM 1209 CD ARG A 74 -5.061 -14.169 12.586 1.00 0.00 C ATOM 1210 NE ARG A 74 -6.518 -14.031 12.601 1.00 0.00 N ATOM 1211 CZ ARG A 74 -7.180 -13.246 13.449 1.00 0.00 C ATOM 1212 NH1 ARG A 74 -6.515 -12.513 14.333 1.00 0.00 N ATOM 1213 NH2 ARG A 74 -8.506 -13.193 13.408 1.00 0.00 N ATOM 0 H ARG A 74 -3.256 -14.322 9.147 1.00 0.00 H new ATOM 0 HA ARG A 74 -2.737 -13.140 11.751 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -2.787 -16.024 10.778 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -2.664 -15.523 12.453 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -5.020 -14.986 10.604 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -4.965 -16.190 11.876 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -4.713 -14.446 13.581 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -4.609 -13.207 12.347 1.00 0.00 H new ATOM 0 HE ARG A 74 -7.058 -14.568 11.922 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -5.496 -12.551 14.363 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -7.023 -11.912 14.982 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -9.018 -13.754 12.727 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -9.013 -12.592 14.058 1.00 0.00 H new ATOM 1227 N GLY A 75 -0.380 -14.306 9.855 1.00 0.00 N ATOM 1228 CA GLY A 75 1.057 -14.427 9.731 1.00 0.00 C ATOM 1229 C GLY A 75 1.474 -15.112 8.447 1.00 0.00 C ATOM 1230 O GLY A 75 0.639 -15.370 7.571 1.00 0.00 O ATOM 0 H GLY A 75 -0.899 -14.451 8.989 1.00 0.00 H new ATOM 0 HA2 GLY A 75 1.506 -13.435 9.772 1.00 0.00 H new ATOM 0 HA3 GLY A 75 1.446 -14.988 10.581 1.00 0.00 H new ATOM 1234 N GLY A 76 2.760 -15.408 8.340 1.00 0.00 N ATOM 1235 CA GLY A 76 3.294 -16.061 7.167 1.00 0.00 C ATOM 1236 C GLY A 76 4.659 -16.647 7.439 1.00 0.00 C ATOM 1237 O GLY A 76 5.205 -17.342 6.561 1.00 0.00 O ATOM 1238 OXT GLY A 76 5.185 -16.425 8.551 1.00 0.00 O ATOM 0 H GLY A 76 3.453 -15.202 9.060 1.00 0.00 H new ATOM 0 HA2 GLY A 76 2.614 -16.850 6.846 1.00 0.00 H new ATOM 0 HA3 GLY A 76 3.360 -15.345 6.348 1.00 0.00 H new TER 1242 GLY A 76 ATOM 1243 N ASP B 2 1.182 8.890 -0.253 1.00 0.00 N ATOM 1244 CA ASP B 2 0.820 7.724 0.583 1.00 0.00 C ATOM 1245 C ASP B 2 1.558 6.483 0.097 1.00 0.00 C ATOM 1246 O ASP B 2 1.604 6.211 -1.099 1.00 0.00 O ATOM 1247 CB ASP B 2 -0.699 7.488 0.538 1.00 0.00 C ATOM 1248 CG ASP B 2 -1.155 6.349 1.436 1.00 0.00 C ATOM 1249 OD1 ASP B 2 -0.424 6.006 2.389 1.00 0.00 O ATOM 1250 OD2 ASP B 2 -2.258 5.802 1.194 1.00 0.00 O ATOM 0 HA ASP B 2 1.112 7.927 1.613 1.00 0.00 H new ATOM 0 HB2 ASP B 2 -1.211 8.403 0.835 1.00 0.00 H new ATOM 0 HB3 ASP B 2 -0.997 7.274 -0.489 1.00 0.00 H new ATOM 1255 N LEU B 3 2.156 5.754 1.025 1.00 0.00 N ATOM 1256 CA LEU B 3 2.877 4.534 0.703 1.00 0.00 C ATOM 1257 C LEU B 3 2.635 3.513 1.800 1.00 0.00 C ATOM 1258 O LEU B 3 3.295 3.528 2.840 1.00 0.00 O ATOM 1259 CB LEU B 3 4.380 4.793 0.545 1.00 0.00 C ATOM 1260 CG LEU B 3 5.198 3.595 0.059 1.00 0.00 C ATOM 1261 CD1 LEU B 3 4.923 3.316 -1.411 1.00 0.00 C ATOM 1262 CD2 LEU B 3 6.686 3.830 0.290 1.00 0.00 C ATOM 0 H LEU B 3 2.156 5.990 2.017 1.00 0.00 H new ATOM 0 HA LEU B 3 2.509 4.154 -0.250 1.00 0.00 H new ATOM 0 HB2 LEU B 3 4.519 5.616 -0.156 1.00 0.00 H new ATOM 0 HB3 LEU B 3 4.779 5.120 1.505 1.00 0.00 H new ATOM 0 HG LEU B 3 4.895 2.721 0.635 1.00 0.00 H new ATOM 0 HD11 LEU B 3 5.515 2.460 -1.736 1.00 0.00 H new ATOM 0 HD12 LEU B 3 3.864 3.098 -1.548 1.00 0.00 H new ATOM 0 HD13 LEU B 3 5.193 4.190 -2.004 1.00 0.00 H new ATOM 0 HD21 LEU B 3 7.250 2.966 -0.062 1.00 0.00 H new ATOM 0 HD22 LEU B 3 7.003 4.718 -0.257 1.00 0.00 H new ATOM 0 HD23 LEU B 3 6.871 3.974 1.355 1.00 0.00 H new ATOM 1274 N THR B 4 1.663 2.653 1.571 1.00 0.00 N ATOM 1275 CA THR B 4 1.306 1.635 2.534 1.00 0.00 C ATOM 1276 C THR B 4 2.203 0.405 2.404 1.00 0.00 C ATOM 1277 O THR B 4 2.351 -0.164 1.320 1.00 0.00 O ATOM 1278 CB THR B 4 -0.165 1.221 2.357 1.00 0.00 C ATOM 1279 OG1 THR B 4 -0.925 2.343 1.882 1.00 0.00 O ATOM 1280 CG2 THR B 4 -0.755 0.721 3.667 1.00 0.00 C ATOM 0 H THR B 4 1.103 2.641 0.718 1.00 0.00 H new ATOM 0 HA THR B 4 1.446 2.060 3.528 1.00 0.00 H new ATOM 0 HB THR B 4 -0.209 0.409 1.631 1.00 0.00 H new ATOM 0 HG1 THR B 4 -1.876 2.195 2.066 1.00 0.00 H new ATOM 0 HG21 THR B 4 -1.795 0.435 3.512 1.00 0.00 H new ATOM 0 HG22 THR B 4 -0.189 -0.144 4.014 1.00 0.00 H new ATOM 0 HG23 THR B 4 -0.704 1.512 4.415 1.00 0.00 H new ATOM 1288 N ILE B 5 2.808 0.011 3.516 1.00 0.00 N ATOM 1289 CA ILE B 5 3.675 -1.151 3.551 1.00 0.00 C ATOM 1290 C ILE B 5 3.068 -2.194 4.480 1.00 0.00 C ATOM 1291 O ILE B 5 2.678 -1.879 5.605 1.00 0.00 O ATOM 1292 CB ILE B 5 5.098 -0.781 4.026 1.00 0.00 C ATOM 1293 CG1 ILE B 5 5.674 0.342 3.149 1.00 0.00 C ATOM 1294 CG2 ILE B 5 6.002 -2.006 4.003 1.00 0.00 C ATOM 1295 CD1 ILE B 5 7.155 0.593 3.350 1.00 0.00 C ATOM 0 H ILE B 5 2.710 0.487 4.413 1.00 0.00 H new ATOM 0 HA ILE B 5 3.760 -1.553 2.541 1.00 0.00 H new ATOM 0 HB ILE B 5 5.043 -0.421 5.053 1.00 0.00 H new ATOM 0 HG12 ILE B 5 5.498 0.096 2.102 1.00 0.00 H new ATOM 0 HG13 ILE B 5 5.130 1.264 3.356 1.00 0.00 H new ATOM 0 HG21 ILE B 5 7.000 -1.728 4.340 1.00 0.00 H new ATOM 0 HG22 ILE B 5 5.595 -2.771 4.665 1.00 0.00 H new ATOM 0 HG23 ILE B 5 6.058 -2.398 2.987 1.00 0.00 H new ATOM 0 HD11 ILE B 5 7.480 1.400 2.693 1.00 0.00 H new ATOM 0 HD12 ILE B 5 7.339 0.873 4.387 1.00 0.00 H new ATOM 0 HD13 ILE B 5 7.713 -0.313 3.114 1.00 0.00 H new ATOM 1307 N SER B 6 2.970 -3.426 4.006 1.00 0.00 N ATOM 1308 CA SER B 6 2.388 -4.492 4.802 1.00 0.00 C ATOM 1309 C SER B 6 3.401 -5.590 5.108 1.00 0.00 C ATOM 1310 O SER B 6 4.096 -6.089 4.213 1.00 0.00 O ATOM 1311 CB SER B 6 1.180 -5.083 4.075 1.00 0.00 C ATOM 1312 OG SER B 6 0.276 -4.062 3.676 1.00 0.00 O ATOM 0 H SER B 6 3.285 -3.711 3.078 1.00 0.00 H new ATOM 0 HA SER B 6 2.071 -4.062 5.752 1.00 0.00 H new ATOM 0 HB2 SER B 6 1.515 -5.640 3.200 1.00 0.00 H new ATOM 0 HB3 SER B 6 0.669 -5.791 4.727 1.00 0.00 H new ATOM 0 HG SER B 6 -0.557 -4.469 3.357 1.00 0.00 H new ATOM 1318 N ASN B 7 3.495 -5.950 6.380 1.00 0.00 N ATOM 1319 CA ASN B 7 4.389 -7.011 6.816 1.00 0.00 C ATOM 1320 C ASN B 7 3.574 -8.285 7.001 1.00 0.00 C ATOM 1321 O ASN B 7 3.039 -8.539 8.081 1.00 0.00 O ATOM 1322 CB ASN B 7 5.087 -6.627 8.128 1.00 0.00 C ATOM 1323 CG ASN B 7 6.202 -7.587 8.507 1.00 0.00 C ATOM 1324 OD1 ASN B 7 6.114 -8.794 8.280 1.00 0.00 O ATOM 1325 ND2 ASN B 7 7.256 -7.055 9.100 1.00 0.00 N ATOM 0 H ASN B 7 2.958 -5.519 7.133 1.00 0.00 H new ATOM 0 HA ASN B 7 5.162 -7.171 6.064 1.00 0.00 H new ATOM 0 HB2 ASN B 7 5.496 -5.621 8.035 1.00 0.00 H new ATOM 0 HB3 ASN B 7 4.350 -6.598 8.931 1.00 0.00 H new ATOM 0 HD21 ASN B 7 8.034 -7.649 9.387 1.00 0.00 H new ATOM 0 HD22 ASN B 7 7.292 -6.050 9.271 1.00 0.00 H new ATOM 1332 N GLU B 8 3.492 -9.080 5.937 1.00 0.00 N ATOM 1333 CA GLU B 8 2.714 -10.320 5.935 1.00 0.00 C ATOM 1334 C GLU B 8 3.426 -11.444 6.686 1.00 0.00 C ATOM 1335 O GLU B 8 3.027 -12.605 6.596 1.00 0.00 O ATOM 1336 CB GLU B 8 2.431 -10.751 4.493 1.00 0.00 C ATOM 1337 CG GLU B 8 2.067 -9.594 3.573 1.00 0.00 C ATOM 1338 CD GLU B 8 0.600 -9.594 3.186 1.00 0.00 C ATOM 1339 OE1 GLU B 8 -0.214 -9.027 3.935 1.00 0.00 O ATOM 1340 OE2 GLU B 8 0.267 -10.163 2.115 1.00 0.00 O ATOM 0 H GLU B 8 3.961 -8.885 5.053 1.00 0.00 H new ATOM 0 HA GLU B 8 1.775 -10.124 6.453 1.00 0.00 H new ATOM 0 HB2 GLU B 8 3.310 -11.259 4.095 1.00 0.00 H new ATOM 0 HB3 GLU B 8 1.617 -11.475 4.492 1.00 0.00 H new ATOM 0 HG2 GLU B 8 2.308 -8.653 4.067 1.00 0.00 H new ATOM 0 HG3 GLU B 8 2.677 -9.647 2.671 1.00 0.00 H new ATOM 1347 N LEU B 9 4.481 -11.104 7.411 1.00 0.00 N ATOM 1348 CA LEU B 9 5.226 -12.089 8.180 1.00 0.00 C ATOM 1349 C LEU B 9 4.840 -12.004 9.652 1.00 0.00 C ATOM 1350 O LEU B 9 4.244 -12.933 10.201 1.00 0.00 O ATOM 1351 CB LEU B 9 6.731 -11.882 8.020 1.00 0.00 C ATOM 1352 CG LEU B 9 7.220 -11.796 6.575 1.00 0.00 C ATOM 1353 CD1 LEU B 9 8.636 -11.249 6.530 1.00 0.00 C ATOM 1354 CD2 LEU B 9 7.151 -13.161 5.898 1.00 0.00 C ATOM 0 H LEU B 9 4.841 -10.152 7.483 1.00 0.00 H new ATOM 0 HA LEU B 9 4.975 -13.080 7.801 1.00 0.00 H new ATOM 0 HB2 LEU B 9 7.014 -10.966 8.539 1.00 0.00 H new ATOM 0 HB3 LEU B 9 7.250 -12.702 8.515 1.00 0.00 H new ATOM 0 HG LEU B 9 6.566 -11.115 6.031 1.00 0.00 H new ATOM 0 HD11 LEU B 9 8.972 -11.193 5.494 1.00 0.00 H new ATOM 0 HD12 LEU B 9 8.655 -10.253 6.972 1.00 0.00 H new ATOM 0 HD13 LEU B 9 9.299 -11.908 7.091 1.00 0.00 H new ATOM 0 HD21 LEU B 9 7.504 -13.076 4.870 1.00 0.00 H new ATOM 0 HD22 LEU B 9 7.779 -13.868 6.440 1.00 0.00 H new ATOM 0 HD23 LEU B 9 6.120 -13.516 5.899 1.00 0.00 H new ATOM 1366 N THR B 10 5.178 -10.886 10.289 1.00 0.00 N ATOM 1367 CA THR B 10 4.856 -10.677 11.693 1.00 0.00 C ATOM 1368 C THR B 10 3.418 -10.186 11.852 1.00 0.00 C ATOM 1369 O THR B 10 2.813 -10.330 12.917 1.00 0.00 O ATOM 1370 CB THR B 10 5.809 -9.652 12.335 1.00 0.00 C ATOM 1371 OG1 THR B 10 6.745 -9.182 11.358 1.00 0.00 O ATOM 1372 CG2 THR B 10 6.558 -10.261 13.509 1.00 0.00 C ATOM 0 H THR B 10 5.676 -10.111 9.852 1.00 0.00 H new ATOM 0 HA THR B 10 4.971 -11.636 12.198 1.00 0.00 H new ATOM 0 HB THR B 10 5.213 -8.818 12.704 1.00 0.00 H new ATOM 0 HG1 THR B 10 7.348 -8.529 11.770 1.00 0.00 H new ATOM 0 HG21 THR B 10 7.223 -9.515 13.943 1.00 0.00 H new ATOM 0 HG22 THR B 10 5.844 -10.593 14.263 1.00 0.00 H new ATOM 0 HG23 THR B 10 7.144 -11.113 13.164 1.00 0.00 H new ATOM 1380 N GLY B 11 2.872 -9.614 10.786 1.00 0.00 N ATOM 1381 CA GLY B 11 1.514 -9.112 10.826 1.00 0.00 C ATOM 1382 C GLY B 11 1.445 -7.663 11.266 1.00 0.00 C ATOM 1383 O GLY B 11 0.502 -7.257 11.947 1.00 0.00 O ATOM 0 H GLY B 11 3.348 -9.489 9.893 1.00 0.00 H new ATOM 0 HA2 GLY B 11 1.064 -9.210 9.838 1.00 0.00 H new ATOM 0 HA3 GLY B 11 0.923 -9.724 11.508 1.00 0.00 H new ATOM 1387 N GLU B 12 2.445 -6.883 10.884 1.00 0.00 N ATOM 1388 CA GLU B 12 2.487 -5.473 11.242 1.00 0.00 C ATOM 1389 C GLU B 12 2.013 -4.608 10.079 1.00 0.00 C ATOM 1390 O GLU B 12 2.472 -4.766 8.946 1.00 0.00 O ATOM 1391 CB GLU B 12 3.902 -5.056 11.639 1.00 0.00 C ATOM 1392 CG GLU B 12 4.466 -5.831 12.818 1.00 0.00 C ATOM 1393 CD GLU B 12 5.864 -5.389 13.181 1.00 0.00 C ATOM 1394 OE1 GLU B 12 6.697 -5.225 12.268 1.00 0.00 O ATOM 1395 OE2 GLU B 12 6.136 -5.220 14.389 1.00 0.00 O ATOM 0 H GLU B 12 3.238 -7.202 10.327 1.00 0.00 H new ATOM 0 HA GLU B 12 1.821 -5.327 12.092 1.00 0.00 H new ATOM 0 HB2 GLU B 12 4.562 -5.187 10.782 1.00 0.00 H new ATOM 0 HB3 GLU B 12 3.902 -3.993 11.882 1.00 0.00 H new ATOM 0 HG2 GLU B 12 3.812 -5.703 13.680 1.00 0.00 H new ATOM 0 HG3 GLU B 12 4.474 -6.895 12.580 1.00 0.00 H new ATOM 1402 N ILE B 13 1.091 -3.706 10.364 1.00 0.00 N ATOM 1403 CA ILE B 13 0.556 -2.808 9.352 1.00 0.00 C ATOM 1404 C ILE B 13 1.125 -1.411 9.550 1.00 0.00 C ATOM 1405 O ILE B 13 0.966 -0.816 10.619 1.00 0.00 O ATOM 1406 CB ILE B 13 -0.992 -2.742 9.401 1.00 0.00 C ATOM 1407 CG1 ILE B 13 -1.595 -4.153 9.349 1.00 0.00 C ATOM 1408 CG2 ILE B 13 -1.527 -1.885 8.260 1.00 0.00 C ATOM 1409 CD1 ILE B 13 -1.197 -4.950 8.122 1.00 0.00 C ATOM 0 H ILE B 13 0.694 -3.574 11.294 1.00 0.00 H new ATOM 0 HA ILE B 13 0.848 -3.199 8.377 1.00 0.00 H new ATOM 0 HB ILE B 13 -1.287 -2.280 10.343 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -1.289 -4.701 10.240 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -2.682 -4.074 9.381 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -2.615 -1.850 8.310 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -1.127 -0.875 8.346 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -1.222 -2.316 7.307 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -1.664 -5.934 8.160 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -1.528 -4.426 7.225 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -0.113 -5.063 8.097 1.00 0.00 H new ATOM 1421 N TYR B 14 1.804 -0.900 8.536 1.00 0.00 N ATOM 1422 CA TYR B 14 2.390 0.427 8.609 1.00 0.00 C ATOM 1423 C TYR B 14 1.455 1.427 7.940 1.00 0.00 C ATOM 1424 O TYR B 14 0.724 1.072 7.016 1.00 0.00 O ATOM 1425 CB TYR B 14 3.780 0.417 7.966 1.00 0.00 C ATOM 1426 CG TYR B 14 4.618 -0.764 8.426 1.00 0.00 C ATOM 1427 CD1 TYR B 14 5.052 -0.862 9.743 1.00 0.00 C ATOM 1428 CD2 TYR B 14 4.950 -1.792 7.552 1.00 0.00 C ATOM 1429 CE1 TYR B 14 5.794 -1.950 10.174 1.00 0.00 C ATOM 1430 CE2 TYR B 14 5.686 -2.882 7.976 1.00 0.00 C ATOM 1431 CZ TYR B 14 6.109 -2.957 9.286 1.00 0.00 C ATOM 1432 OH TYR B 14 6.847 -4.046 9.704 1.00 0.00 O ATOM 0 H TYR B 14 1.963 -1.385 7.653 1.00 0.00 H new ATOM 0 HA TYR B 14 2.515 0.729 9.649 1.00 0.00 H new ATOM 0 HB2 TYR B 14 3.676 0.386 6.881 1.00 0.00 H new ATOM 0 HB3 TYR B 14 4.298 1.345 8.210 1.00 0.00 H new ATOM 0 HD1 TYR B 14 4.807 -0.077 10.442 1.00 0.00 H new ATOM 0 HD2 TYR B 14 4.627 -1.738 6.523 1.00 0.00 H new ATOM 0 HE1 TYR B 14 6.124 -2.009 11.201 1.00 0.00 H new ATOM 0 HE2 TYR B 14 5.929 -3.673 7.283 1.00 0.00 H new ATOM 0 HH TYR B 14 7.565 -4.221 9.061 1.00 0.00 H new ATOM 1442 N GLY B 15 1.461 2.661 8.424 1.00 0.00 N ATOM 1443 CA GLY B 15 0.573 3.677 7.885 1.00 0.00 C ATOM 1444 C GLY B 15 1.084 4.344 6.622 1.00 0.00 C ATOM 1445 O GLY B 15 1.782 3.724 5.819 1.00 0.00 O ATOM 0 H GLY B 15 2.065 2.979 9.182 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -0.396 3.223 7.676 1.00 0.00 H new ATOM 0 HA3 GLY B 15 0.410 4.441 8.645 1.00 0.00 H new ATOM 1449 N PRO B 16 0.755 5.633 6.430 1.00 0.00 N ATOM 1450 CA PRO B 16 1.144 6.391 5.237 1.00 0.00 C ATOM 1451 C PRO B 16 2.581 6.909 5.268 1.00 0.00 C ATOM 1452 O PRO B 16 2.838 8.044 5.681 1.00 0.00 O ATOM 1453 CB PRO B 16 0.169 7.564 5.263 1.00 0.00 C ATOM 1454 CG PRO B 16 -0.067 7.813 6.711 1.00 0.00 C ATOM 1455 CD PRO B 16 -0.028 6.459 7.373 1.00 0.00 C ATOM 0 HA PRO B 16 1.106 5.770 4.342 1.00 0.00 H new ATOM 0 HB2 PRO B 16 0.589 8.442 4.772 1.00 0.00 H new ATOM 0 HB3 PRO B 16 -0.759 7.322 4.744 1.00 0.00 H new ATOM 0 HG2 PRO B 16 0.697 8.472 7.124 1.00 0.00 H new ATOM 0 HG3 PRO B 16 -1.029 8.299 6.872 1.00 0.00 H new ATOM 0 HD2 PRO B 16 0.446 6.506 8.354 1.00 0.00 H new ATOM 0 HD3 PRO B 16 -1.030 6.057 7.522 1.00 0.00 H new ATOM 1463 N ILE B 17 3.519 6.078 4.847 1.00 0.00 N ATOM 1464 CA ILE B 17 4.915 6.485 4.797 1.00 0.00 C ATOM 1465 C ILE B 17 5.132 7.349 3.564 1.00 0.00 C ATOM 1466 O ILE B 17 5.344 6.841 2.467 1.00 0.00 O ATOM 1467 CB ILE B 17 5.868 5.273 4.760 1.00 0.00 C ATOM 1468 CG1 ILE B 17 5.607 4.360 5.961 1.00 0.00 C ATOM 1469 CG2 ILE B 17 7.319 5.740 4.747 1.00 0.00 C ATOM 1470 CD1 ILE B 17 6.370 3.056 5.906 1.00 0.00 C ATOM 0 H ILE B 17 3.342 5.123 4.536 1.00 0.00 H new ATOM 0 HA ILE B 17 5.140 7.048 5.703 1.00 0.00 H new ATOM 0 HB ILE B 17 5.681 4.707 3.847 1.00 0.00 H new ATOM 0 HG12 ILE B 17 5.875 4.890 6.875 1.00 0.00 H new ATOM 0 HG13 ILE B 17 4.540 4.145 6.018 1.00 0.00 H new ATOM 0 HG21 ILE B 17 7.980 4.874 4.721 1.00 0.00 H new ATOM 0 HG22 ILE B 17 7.495 6.357 3.866 1.00 0.00 H new ATOM 0 HG23 ILE B 17 7.521 6.324 5.645 1.00 0.00 H new ATOM 0 HD11 ILE B 17 6.136 2.460 6.788 1.00 0.00 H new ATOM 0 HD12 ILE B 17 6.084 2.505 5.010 1.00 0.00 H new ATOM 0 HD13 ILE B 17 7.440 3.261 5.880 1.00 0.00 H new ATOM 1482 N GLU B 18 5.047 8.659 3.740 1.00 0.00 N ATOM 1483 CA GLU B 18 5.193 9.582 2.625 1.00 0.00 C ATOM 1484 C GLU B 18 6.599 9.555 2.046 1.00 0.00 C ATOM 1485 O GLU B 18 7.593 9.600 2.777 1.00 0.00 O ATOM 1486 CB GLU B 18 4.825 11.005 3.039 1.00 0.00 C ATOM 1487 CG GLU B 18 4.346 11.851 1.873 1.00 0.00 C ATOM 1488 CD GLU B 18 3.164 11.230 1.150 1.00 0.00 C ATOM 1489 OE1 GLU B 18 3.355 10.223 0.440 1.00 0.00 O ATOM 1490 OE2 GLU B 18 2.039 11.756 1.285 1.00 0.00 O ATOM 0 H GLU B 18 4.878 9.106 4.641 1.00 0.00 H new ATOM 0 HA GLU B 18 4.503 9.251 1.848 1.00 0.00 H new ATOM 0 HB2 GLU B 18 4.045 10.967 3.799 1.00 0.00 H new ATOM 0 HB3 GLU B 18 5.692 11.482 3.496 1.00 0.00 H new ATOM 0 HG2 GLU B 18 4.066 12.840 2.237 1.00 0.00 H new ATOM 0 HG3 GLU B 18 5.166 11.990 1.169 1.00 0.00 H new ATOM 1497 N VAL B 19 6.663 9.479 0.727 1.00 0.00 N ATOM 1498 CA VAL B 19 7.925 9.450 0.012 1.00 0.00 C ATOM 1499 C VAL B 19 7.909 10.440 -1.145 1.00 0.00 C ATOM 1500 O VAL B 19 6.882 10.623 -1.811 1.00 0.00 O ATOM 1501 CB VAL B 19 8.248 8.042 -0.540 1.00 0.00 C ATOM 1502 CG1 VAL B 19 8.761 7.130 0.565 1.00 0.00 C ATOM 1503 CG2 VAL B 19 7.025 7.437 -1.211 1.00 0.00 C ATOM 0 H VAL B 19 5.842 9.436 0.124 1.00 0.00 H new ATOM 0 HA VAL B 19 8.697 9.727 0.730 1.00 0.00 H new ATOM 0 HB VAL B 19 9.035 8.143 -1.287 1.00 0.00 H new ATOM 0 HG11 VAL B 19 8.981 6.146 0.152 1.00 0.00 H new ATOM 0 HG12 VAL B 19 9.668 7.554 0.995 1.00 0.00 H new ATOM 0 HG13 VAL B 19 8.001 7.036 1.341 1.00 0.00 H new ATOM 0 HG21 VAL B 19 7.272 6.447 -1.593 1.00 0.00 H new ATOM 0 HG22 VAL B 19 6.215 7.355 -0.486 1.00 0.00 H new ATOM 0 HG23 VAL B 19 6.709 8.076 -2.036 1.00 0.00 H new ATOM 1513 N SER B 20 9.036 11.088 -1.371 1.00 0.00 N ATOM 1514 CA SER B 20 9.159 12.039 -2.460 1.00 0.00 C ATOM 1515 C SER B 20 9.824 11.360 -3.648 1.00 0.00 C ATOM 1516 O SER B 20 10.592 10.413 -3.475 1.00 0.00 O ATOM 1517 CB SER B 20 9.975 13.257 -2.017 1.00 0.00 C ATOM 1518 OG SER B 20 10.021 14.248 -3.033 1.00 0.00 O ATOM 0 H SER B 20 9.882 10.973 -0.813 1.00 0.00 H new ATOM 0 HA SER B 20 8.166 12.383 -2.750 1.00 0.00 H new ATOM 0 HB2 SER B 20 9.537 13.681 -1.113 1.00 0.00 H new ATOM 0 HB3 SER B 20 10.989 12.945 -1.765 1.00 0.00 H new ATOM 0 HG SER B 20 10.547 15.013 -2.720 1.00 0.00 H new ATOM 1524 N GLU B 21 9.535 11.832 -4.850 1.00 0.00 N ATOM 1525 CA GLU B 21 10.128 11.251 -6.047 1.00 0.00 C ATOM 1526 C GLU B 21 11.613 11.596 -6.123 1.00 0.00 C ATOM 1527 O GLU B 21 12.368 10.977 -6.872 1.00 0.00 O ATOM 1528 CB GLU B 21 9.394 11.712 -7.311 1.00 0.00 C ATOM 1529 CG GLU B 21 9.372 13.220 -7.515 1.00 0.00 C ATOM 1530 CD GLU B 21 8.714 13.610 -8.822 1.00 0.00 C ATOM 1531 OE1 GLU B 21 9.220 13.203 -9.892 1.00 0.00 O ATOM 1532 OE2 GLU B 21 7.683 14.313 -8.791 1.00 0.00 O ATOM 0 H GLU B 21 8.899 12.610 -5.024 1.00 0.00 H new ATOM 0 HA GLU B 21 10.026 10.168 -5.985 1.00 0.00 H new ATOM 0 HB2 GLU B 21 9.864 11.248 -8.178 1.00 0.00 H new ATOM 0 HB3 GLU B 21 8.367 11.349 -7.272 1.00 0.00 H new ATOM 0 HG2 GLU B 21 8.840 13.689 -6.688 1.00 0.00 H new ATOM 0 HG3 GLU B 21 10.392 13.603 -7.495 1.00 0.00 H new ATOM 1539 N ASP B 22 12.025 12.578 -5.328 1.00 0.00 N ATOM 1540 CA ASP B 22 13.420 13.003 -5.285 1.00 0.00 C ATOM 1541 C ASP B 22 14.145 12.319 -4.136 1.00 0.00 C ATOM 1542 O ASP B 22 15.333 12.543 -3.903 1.00 0.00 O ATOM 1543 CB ASP B 22 13.524 14.521 -5.124 1.00 0.00 C ATOM 1544 CG ASP B 22 14.131 15.183 -6.340 1.00 0.00 C ATOM 1545 OD1 ASP B 22 15.331 14.967 -6.606 1.00 0.00 O ATOM 1546 OD2 ASP B 22 13.413 15.925 -7.037 1.00 0.00 O ATOM 0 H ASP B 22 11.409 13.097 -4.702 1.00 0.00 H new ATOM 0 HA ASP B 22 13.887 12.718 -6.228 1.00 0.00 H new ATOM 0 HB2 ASP B 22 12.532 14.935 -4.944 1.00 0.00 H new ATOM 0 HB3 ASP B 22 14.129 14.751 -4.247 1.00 0.00 H new ATOM 1551 N MET B 23 13.411 11.480 -3.419 1.00 0.00 N ATOM 1552 CA MET B 23 13.961 10.751 -2.289 1.00 0.00 C ATOM 1553 C MET B 23 14.690 9.514 -2.790 1.00 0.00 C ATOM 1554 O MET B 23 14.188 8.796 -3.657 1.00 0.00 O ATOM 1555 CB MET B 23 12.844 10.367 -1.312 1.00 0.00 C ATOM 1556 CG MET B 23 13.295 9.533 -0.122 1.00 0.00 C ATOM 1557 SD MET B 23 11.946 9.229 1.037 1.00 0.00 S ATOM 1558 CE MET B 23 12.753 8.167 2.231 1.00 0.00 C ATOM 0 H MET B 23 12.426 11.288 -3.603 1.00 0.00 H new ATOM 0 HA MET B 23 14.670 11.386 -1.758 1.00 0.00 H new ATOM 0 HB2 MET B 23 12.375 11.279 -0.942 1.00 0.00 H new ATOM 0 HB3 MET B 23 12.079 9.814 -1.856 1.00 0.00 H new ATOM 0 HG2 MET B 23 13.691 8.581 -0.475 1.00 0.00 H new ATOM 0 HG3 MET B 23 14.108 10.045 0.393 1.00 0.00 H new ATOM 0 HE1 MET B 23 12.006 7.737 2.899 1.00 0.00 H new ATOM 0 HE2 MET B 23 13.278 7.366 1.710 1.00 0.00 H new ATOM 0 HE3 MET B 23 13.467 8.750 2.813 1.00 0.00 H new ATOM 1568 N ALA B 24 15.887 9.289 -2.269 1.00 0.00 N ATOM 1569 CA ALA B 24 16.688 8.144 -2.668 1.00 0.00 C ATOM 1570 C ALA B 24 16.008 6.847 -2.255 1.00 0.00 C ATOM 1571 O ALA B 24 15.421 6.763 -1.175 1.00 0.00 O ATOM 1572 CB ALA B 24 18.079 8.226 -2.057 1.00 0.00 C ATOM 0 H ALA B 24 16.325 9.886 -1.568 1.00 0.00 H new ATOM 0 HA ALA B 24 16.784 8.156 -3.754 1.00 0.00 H new ATOM 0 HB1 ALA B 24 18.664 7.360 -2.367 1.00 0.00 H new ATOM 0 HB2 ALA B 24 18.572 9.137 -2.396 1.00 0.00 H new ATOM 0 HB3 ALA B 24 17.999 8.239 -0.970 1.00 0.00 H new ATOM 1578 N LEU B 25 16.081 5.834 -3.112 1.00 0.00 N ATOM 1579 CA LEU B 25 15.472 4.547 -2.803 1.00 0.00 C ATOM 1580 C LEU B 25 16.183 3.916 -1.613 1.00 0.00 C ATOM 1581 O LEU B 25 15.571 3.234 -0.795 1.00 0.00 O ATOM 1582 CB LEU B 25 15.505 3.600 -4.014 1.00 0.00 C ATOM 1583 CG LEU B 25 16.811 2.822 -4.229 1.00 0.00 C ATOM 1584 CD1 LEU B 25 16.524 1.429 -4.772 1.00 0.00 C ATOM 1585 CD2 LEU B 25 17.735 3.576 -5.173 1.00 0.00 C ATOM 0 H LEU B 25 16.551 5.878 -4.016 1.00 0.00 H new ATOM 0 HA LEU B 25 14.425 4.717 -2.551 1.00 0.00 H new ATOM 0 HB2 LEU B 25 14.691 2.882 -3.910 1.00 0.00 H new ATOM 0 HB3 LEU B 25 15.302 4.184 -4.912 1.00 0.00 H new ATOM 0 HG LEU B 25 17.308 2.721 -3.264 1.00 0.00 H new ATOM 0 HD11 LEU B 25 17.463 0.895 -4.917 1.00 0.00 H new ATOM 0 HD12 LEU B 25 15.902 0.883 -4.063 1.00 0.00 H new ATOM 0 HD13 LEU B 25 16.002 1.511 -5.725 1.00 0.00 H new ATOM 0 HD21 LEU B 25 18.655 3.008 -5.312 1.00 0.00 H new ATOM 0 HD22 LEU B 25 17.242 3.709 -6.136 1.00 0.00 H new ATOM 0 HD23 LEU B 25 17.972 4.552 -4.748 1.00 0.00 H new ATOM 1597 N THR B 26 17.478 4.189 -1.514 1.00 0.00 N ATOM 1598 CA THR B 26 18.307 3.683 -0.436 1.00 0.00 C ATOM 1599 C THR B 26 17.817 4.216 0.905 1.00 0.00 C ATOM 1600 O THR B 26 17.822 3.505 1.910 1.00 0.00 O ATOM 1601 CB THR B 26 19.763 4.114 -0.662 1.00 0.00 C ATOM 1602 OG1 THR B 26 19.782 5.245 -1.543 1.00 0.00 O ATOM 1603 CG2 THR B 26 20.576 2.980 -1.264 1.00 0.00 C ATOM 0 H THR B 26 17.982 4.770 -2.184 1.00 0.00 H new ATOM 0 HA THR B 26 18.245 2.595 -0.425 1.00 0.00 H new ATOM 0 HB THR B 26 20.208 4.379 0.297 1.00 0.00 H new ATOM 0 HG1 THR B 26 20.708 5.528 -1.692 1.00 0.00 H new ATOM 0 HG21 THR B 26 21.604 3.310 -1.415 1.00 0.00 H new ATOM 0 HG22 THR B 26 20.564 2.125 -0.588 1.00 0.00 H new ATOM 0 HG23 THR B 26 20.143 2.691 -2.222 1.00 0.00 H new ATOM 1611 N ASP B 27 17.372 5.469 0.893 1.00 0.00 N ATOM 1612 CA ASP B 27 16.858 6.124 2.090 1.00 0.00 C ATOM 1613 C ASP B 27 15.634 5.373 2.599 1.00 0.00 C ATOM 1614 O ASP B 27 15.525 5.065 3.789 1.00 0.00 O ATOM 1615 CB ASP B 27 16.492 7.580 1.775 1.00 0.00 C ATOM 1616 CG ASP B 27 16.469 8.466 3.006 1.00 0.00 C ATOM 1617 OD1 ASP B 27 15.605 8.265 3.882 1.00 0.00 O ATOM 1618 OD2 ASP B 27 17.315 9.379 3.093 1.00 0.00 O ATOM 0 H ASP B 27 17.358 6.055 0.058 1.00 0.00 H new ATOM 0 HA ASP B 27 17.627 6.116 2.862 1.00 0.00 H new ATOM 0 HB2 ASP B 27 17.208 7.982 1.058 1.00 0.00 H new ATOM 0 HB3 ASP B 27 15.513 7.607 1.296 1.00 0.00 H new ATOM 1623 N LEU B 28 14.734 5.060 1.674 1.00 0.00 N ATOM 1624 CA LEU B 28 13.514 4.332 1.997 1.00 0.00 C ATOM 1625 C LEU B 28 13.859 2.932 2.503 1.00 0.00 C ATOM 1626 O LEU B 28 13.302 2.468 3.497 1.00 0.00 O ATOM 1627 CB LEU B 28 12.609 4.249 0.758 1.00 0.00 C ATOM 1628 CG LEU B 28 11.133 3.892 1.011 1.00 0.00 C ATOM 1629 CD1 LEU B 28 10.937 2.380 1.039 1.00 0.00 C ATOM 1630 CD2 LEU B 28 10.633 4.513 2.309 1.00 0.00 C ATOM 0 H LEU B 28 14.828 5.301 0.687 1.00 0.00 H new ATOM 0 HA LEU B 28 12.979 4.863 2.784 1.00 0.00 H new ATOM 0 HB2 LEU B 28 12.645 5.209 0.244 1.00 0.00 H new ATOM 0 HB3 LEU B 28 13.028 3.507 0.078 1.00 0.00 H new ATOM 0 HG LEU B 28 10.548 4.302 0.188 1.00 0.00 H new ATOM 0 HD11 LEU B 28 9.886 2.153 1.219 1.00 0.00 H new ATOM 0 HD12 LEU B 28 11.241 1.956 0.082 1.00 0.00 H new ATOM 0 HD13 LEU B 28 11.543 1.949 1.836 1.00 0.00 H new ATOM 0 HD21 LEU B 28 9.588 4.244 2.462 1.00 0.00 H new ATOM 0 HD22 LEU B 28 11.229 4.142 3.143 1.00 0.00 H new ATOM 0 HD23 LEU B 28 10.724 5.598 2.252 1.00 0.00 H new ATOM 1642 N ILE B 29 14.796 2.274 1.823 1.00 0.00 N ATOM 1643 CA ILE B 29 15.218 0.932 2.211 1.00 0.00 C ATOM 1644 C ILE B 29 15.819 0.952 3.616 1.00 0.00 C ATOM 1645 O ILE B 29 15.580 0.049 4.416 1.00 0.00 O ATOM 1646 CB ILE B 29 16.239 0.333 1.214 1.00 0.00 C ATOM 1647 CG1 ILE B 29 15.645 0.264 -0.198 1.00 0.00 C ATOM 1648 CG2 ILE B 29 16.675 -1.053 1.661 1.00 0.00 C ATOM 1649 CD1 ILE B 29 14.354 -0.526 -0.288 1.00 0.00 C ATOM 0 H ILE B 29 15.275 2.648 1.004 1.00 0.00 H new ATOM 0 HA ILE B 29 14.331 0.298 2.200 1.00 0.00 H new ATOM 0 HB ILE B 29 17.111 0.987 1.194 1.00 0.00 H new ATOM 0 HG12 ILE B 29 15.464 1.278 -0.554 1.00 0.00 H new ATOM 0 HG13 ILE B 29 16.379 -0.183 -0.868 1.00 0.00 H new ATOM 0 HG21 ILE B 29 17.393 -1.457 0.947 1.00 0.00 H new ATOM 0 HG22 ILE B 29 17.139 -0.989 2.645 1.00 0.00 H new ATOM 0 HG23 ILE B 29 15.806 -1.709 1.712 1.00 0.00 H new ATOM 0 HD11 ILE B 29 13.999 -0.527 -1.319 1.00 0.00 H new ATOM 0 HD12 ILE B 29 14.532 -1.552 0.036 1.00 0.00 H new ATOM 0 HD13 ILE B 29 13.602 -0.068 0.354 1.00 0.00 H new ATOM 1661 N ALA B 30 16.593 1.992 3.913 1.00 0.00 N ATOM 1662 CA ALA B 30 17.214 2.142 5.224 1.00 0.00 C ATOM 1663 C ALA B 30 16.151 2.203 6.314 1.00 0.00 C ATOM 1664 O ALA B 30 16.228 1.488 7.315 1.00 0.00 O ATOM 1665 CB ALA B 30 18.081 3.389 5.255 1.00 0.00 C ATOM 0 H ALA B 30 16.805 2.746 3.260 1.00 0.00 H new ATOM 0 HA ALA B 30 17.847 1.274 5.411 1.00 0.00 H new ATOM 0 HB1 ALA B 30 18.539 3.489 6.239 1.00 0.00 H new ATOM 0 HB2 ALA B 30 18.861 3.308 4.498 1.00 0.00 H new ATOM 0 HB3 ALA B 30 17.466 4.265 5.050 1.00 0.00 H new ATOM 1671 N LEU B 31 15.146 3.045 6.099 1.00 0.00 N ATOM 1672 CA LEU B 31 14.049 3.192 7.051 1.00 0.00 C ATOM 1673 C LEU B 31 13.276 1.888 7.146 1.00 0.00 C ATOM 1674 O LEU B 31 12.833 1.486 8.218 1.00 0.00 O ATOM 1675 CB LEU B 31 13.108 4.319 6.618 1.00 0.00 C ATOM 1676 CG LEU B 31 13.762 5.690 6.453 1.00 0.00 C ATOM 1677 CD1 LEU B 31 12.784 6.676 5.842 1.00 0.00 C ATOM 1678 CD2 LEU B 31 14.275 6.208 7.788 1.00 0.00 C ATOM 0 H LEU B 31 15.068 3.638 5.272 1.00 0.00 H new ATOM 0 HA LEU B 31 14.465 3.441 8.027 1.00 0.00 H new ATOM 0 HB2 LEU B 31 12.645 4.040 5.672 1.00 0.00 H new ATOM 0 HB3 LEU B 31 12.307 4.403 7.352 1.00 0.00 H new ATOM 0 HG LEU B 31 14.612 5.582 5.779 1.00 0.00 H new ATOM 0 HD11 LEU B 31 13.267 7.647 5.732 1.00 0.00 H new ATOM 0 HD12 LEU B 31 12.467 6.315 4.863 1.00 0.00 H new ATOM 0 HD13 LEU B 31 11.914 6.775 6.491 1.00 0.00 H new ATOM 0 HD21 LEU B 31 14.737 7.185 7.646 1.00 0.00 H new ATOM 0 HD22 LEU B 31 13.444 6.297 8.487 1.00 0.00 H new ATOM 0 HD23 LEU B 31 15.013 5.513 8.189 1.00 0.00 H new ATOM 1690 N LEU B 32 13.135 1.222 6.007 1.00 0.00 N ATOM 1691 CA LEU B 32 12.422 -0.048 5.927 1.00 0.00 C ATOM 1692 C LEU B 32 13.147 -1.131 6.726 1.00 0.00 C ATOM 1693 O LEU B 32 12.519 -1.989 7.348 1.00 0.00 O ATOM 1694 CB LEU B 32 12.288 -0.465 4.460 1.00 0.00 C ATOM 1695 CG LEU B 32 11.397 -1.675 4.188 1.00 0.00 C ATOM 1696 CD1 LEU B 32 9.951 -1.370 4.545 1.00 0.00 C ATOM 1697 CD2 LEU B 32 11.516 -2.083 2.729 1.00 0.00 C ATOM 0 H LEU B 32 13.510 1.545 5.115 1.00 0.00 H new ATOM 0 HA LEU B 32 11.429 0.077 6.359 1.00 0.00 H new ATOM 0 HB2 LEU B 32 11.899 0.382 3.896 1.00 0.00 H new ATOM 0 HB3 LEU B 32 13.284 -0.677 4.070 1.00 0.00 H new ATOM 0 HG LEU B 32 11.728 -2.504 4.814 1.00 0.00 H new ATOM 0 HD11 LEU B 32 9.334 -2.246 4.343 1.00 0.00 H new ATOM 0 HD12 LEU B 32 9.883 -1.114 5.602 1.00 0.00 H new ATOM 0 HD13 LEU B 32 9.597 -0.531 3.946 1.00 0.00 H new ATOM 0 HD21 LEU B 32 10.879 -2.947 2.540 1.00 0.00 H new ATOM 0 HD22 LEU B 32 11.203 -1.255 2.093 1.00 0.00 H new ATOM 0 HD23 LEU B 32 12.552 -2.341 2.507 1.00 0.00 H new ATOM 1709 N GLN B 33 14.469 -1.075 6.719 1.00 0.00 N ATOM 1710 CA GLN B 33 15.286 -2.045 7.437 1.00 0.00 C ATOM 1711 C GLN B 33 15.315 -1.753 8.937 1.00 0.00 C ATOM 1712 O GLN B 33 15.683 -2.613 9.739 1.00 0.00 O ATOM 1713 CB GLN B 33 16.707 -2.052 6.881 1.00 0.00 C ATOM 1714 CG GLN B 33 16.801 -2.600 5.465 1.00 0.00 C ATOM 1715 CD GLN B 33 18.231 -2.835 5.023 1.00 0.00 C ATOM 1716 OE1 GLN B 33 18.793 -3.906 5.246 1.00 0.00 O ATOM 1717 NE2 GLN B 33 18.828 -1.839 4.394 1.00 0.00 N ATOM 0 H GLN B 33 15.004 -0.364 6.221 1.00 0.00 H new ATOM 0 HA GLN B 33 14.837 -3.028 7.294 1.00 0.00 H new ATOM 0 HB2 GLN B 33 17.100 -1.035 6.896 1.00 0.00 H new ATOM 0 HB3 GLN B 33 17.342 -2.648 7.536 1.00 0.00 H new ATOM 0 HG2 GLN B 33 16.248 -3.537 5.405 1.00 0.00 H new ATOM 0 HG3 GLN B 33 16.322 -1.903 4.777 1.00 0.00 H new ATOM 0 HE21 GLN B 33 18.326 -0.966 4.229 1.00 0.00 H new ATOM 0 HE22 GLN B 33 19.791 -1.942 4.073 1.00 0.00 H new ATOM 1726 N ALA B 34 14.917 -0.546 9.308 1.00 0.00 N ATOM 1727 CA ALA B 34 14.904 -0.148 10.710 1.00 0.00 C ATOM 1728 C ALA B 34 13.499 -0.227 11.308 1.00 0.00 C ATOM 1729 O ALA B 34 13.297 -0.856 12.344 1.00 0.00 O ATOM 1730 CB ALA B 34 15.464 1.257 10.858 1.00 0.00 C ATOM 0 H ALA B 34 14.599 0.175 8.660 1.00 0.00 H new ATOM 0 HA ALA B 34 15.534 -0.846 11.261 1.00 0.00 H new ATOM 0 HB1 ALA B 34 15.450 1.545 11.909 1.00 0.00 H new ATOM 0 HB2 ALA B 34 16.489 1.281 10.489 1.00 0.00 H new ATOM 0 HB3 ALA B 34 14.855 1.954 10.282 1.00 0.00 H new ATOM 1736 N ASP B 35 12.535 0.397 10.644 1.00 0.00 N ATOM 1737 CA ASP B 35 11.155 0.412 11.121 1.00 0.00 C ATOM 1738 C ASP B 35 10.493 -0.948 10.929 1.00 0.00 C ATOM 1739 O ASP B 35 10.171 -1.639 11.899 1.00 0.00 O ATOM 1740 CB ASP B 35 10.350 1.482 10.374 1.00 0.00 C ATOM 1741 CG ASP B 35 9.019 1.789 11.032 1.00 0.00 C ATOM 1742 OD1 ASP B 35 8.195 0.869 11.184 1.00 0.00 O ATOM 1743 OD2 ASP B 35 8.794 2.957 11.411 1.00 0.00 O ATOM 0 H ASP B 35 12.682 0.902 9.770 1.00 0.00 H new ATOM 0 HA ASP B 35 11.171 0.644 12.186 1.00 0.00 H new ATOM 0 HB2 ASP B 35 10.939 2.397 10.315 1.00 0.00 H new ATOM 0 HB3 ASP B 35 10.175 1.149 9.351 1.00 0.00 H new ATOM 1748 N CYS B 36 10.308 -1.324 9.674 1.00 0.00 N ATOM 1749 CA CYS B 36 9.673 -2.589 9.329 1.00 0.00 C ATOM 1750 C CYS B 36 10.529 -3.778 9.747 1.00 0.00 C ATOM 1751 O CYS B 36 10.017 -4.804 10.195 1.00 0.00 O ATOM 1752 CB CYS B 36 9.411 -2.638 7.826 1.00 0.00 C ATOM 1753 SG CYS B 36 8.743 -4.211 7.236 1.00 0.00 S ATOM 0 H CYS B 36 10.591 -0.766 8.869 1.00 0.00 H new ATOM 0 HA CYS B 36 8.729 -2.653 9.870 1.00 0.00 H new ATOM 0 HB2 CYS B 36 8.715 -1.841 7.564 1.00 0.00 H new ATOM 0 HB3 CYS B 36 10.343 -2.433 7.300 1.00 0.00 H new ATOM 0 HG CYS B 36 9.695 -4.910 6.693 1.00 0.00 H new ATOM 1759 N GLY B 37 11.833 -3.633 9.611 1.00 0.00 N ATOM 1760 CA GLY B 37 12.730 -4.707 9.967 1.00 0.00 C ATOM 1761 C GLY B 37 13.177 -5.486 8.749 1.00 0.00 C ATOM 1762 O GLY B 37 13.445 -6.684 8.824 1.00 0.00 O ATOM 0 H GLY B 37 12.288 -2.790 9.260 1.00 0.00 H new ATOM 0 HA2 GLY B 37 13.602 -4.299 10.479 1.00 0.00 H new ATOM 0 HA3 GLY B 37 12.234 -5.379 10.668 1.00 0.00 H new ATOM 1766 N PHE B 38 13.230 -4.803 7.615 1.00 0.00 N ATOM 1767 CA PHE B 38 13.657 -5.417 6.370 1.00 0.00 C ATOM 1768 C PHE B 38 15.172 -5.639 6.399 1.00 0.00 C ATOM 1769 O PHE B 38 15.871 -5.098 7.253 1.00 0.00 O ATOM 1770 CB PHE B 38 13.251 -4.518 5.189 1.00 0.00 C ATOM 1771 CG PHE B 38 13.651 -5.039 3.837 1.00 0.00 C ATOM 1772 CD1 PHE B 38 12.991 -6.118 3.274 1.00 0.00 C ATOM 1773 CD2 PHE B 38 14.689 -4.443 3.133 1.00 0.00 C ATOM 1774 CE1 PHE B 38 13.359 -6.596 2.030 1.00 0.00 C ATOM 1775 CE2 PHE B 38 15.061 -4.918 1.893 1.00 0.00 C ATOM 1776 CZ PHE B 38 14.394 -5.997 1.340 1.00 0.00 C ATOM 0 H PHE B 38 12.981 -3.817 7.533 1.00 0.00 H new ATOM 0 HA PHE B 38 13.172 -6.386 6.248 1.00 0.00 H new ATOM 0 HB2 PHE B 38 12.169 -4.385 5.207 1.00 0.00 H new ATOM 0 HB3 PHE B 38 13.696 -3.533 5.330 1.00 0.00 H new ATOM 0 HD1 PHE B 38 12.182 -6.590 3.811 1.00 0.00 H new ATOM 0 HD2 PHE B 38 15.210 -3.599 3.561 1.00 0.00 H new ATOM 0 HE1 PHE B 38 12.837 -7.437 1.598 1.00 0.00 H new ATOM 0 HE2 PHE B 38 15.871 -4.449 1.355 1.00 0.00 H new ATOM 0 HZ PHE B 38 14.683 -6.371 0.369 1.00 0.00 H new ATOM 1786 N ASP B 39 15.666 -6.459 5.489 1.00 0.00 N ATOM 1787 CA ASP B 39 17.091 -6.745 5.398 1.00 0.00 C ATOM 1788 C ASP B 39 17.412 -7.198 3.981 1.00 0.00 C ATOM 1789 O ASP B 39 16.712 -8.041 3.428 1.00 0.00 O ATOM 1790 CB ASP B 39 17.497 -7.817 6.409 1.00 0.00 C ATOM 1791 CG ASP B 39 18.995 -8.029 6.449 1.00 0.00 C ATOM 1792 OD1 ASP B 39 19.490 -8.863 5.671 1.00 0.00 O ATOM 1793 OD2 ASP B 39 19.679 -7.362 7.250 1.00 0.00 O ATOM 0 H ASP B 39 15.097 -6.944 4.795 1.00 0.00 H new ATOM 0 HA ASP B 39 17.656 -5.842 5.631 1.00 0.00 H new ATOM 0 HB2 ASP B 39 17.146 -7.530 7.400 1.00 0.00 H new ATOM 0 HB3 ASP B 39 17.006 -8.757 6.156 1.00 0.00 H new ATOM 1798 N LYS B 40 18.461 -6.640 3.399 1.00 0.00 N ATOM 1799 CA LYS B 40 18.843 -6.969 2.028 1.00 0.00 C ATOM 1800 C LYS B 40 19.539 -8.325 1.911 1.00 0.00 C ATOM 1801 O LYS B 40 19.842 -8.771 0.803 1.00 0.00 O ATOM 1802 CB LYS B 40 19.749 -5.874 1.459 1.00 0.00 C ATOM 1803 CG LYS B 40 19.004 -4.752 0.749 1.00 0.00 C ATOM 1804 CD LYS B 40 18.378 -5.234 -0.553 1.00 0.00 C ATOM 1805 CE LYS B 40 18.634 -4.258 -1.696 1.00 0.00 C ATOM 1806 NZ LYS B 40 20.000 -4.416 -2.268 1.00 0.00 N ATOM 0 H LYS B 40 19.066 -5.956 3.852 1.00 0.00 H new ATOM 0 HA LYS B 40 17.920 -7.032 1.452 1.00 0.00 H new ATOM 0 HB2 LYS B 40 20.337 -5.447 2.271 1.00 0.00 H new ATOM 0 HB3 LYS B 40 20.452 -6.327 0.760 1.00 0.00 H new ATOM 0 HG2 LYS B 40 18.227 -4.359 1.404 1.00 0.00 H new ATOM 0 HG3 LYS B 40 19.691 -3.932 0.542 1.00 0.00 H new ATOM 0 HD2 LYS B 40 18.784 -6.212 -0.812 1.00 0.00 H new ATOM 0 HD3 LYS B 40 17.304 -5.360 -0.416 1.00 0.00 H new ATOM 0 HE2 LYS B 40 17.892 -4.414 -2.479 1.00 0.00 H new ATOM 0 HE3 LYS B 40 18.507 -3.237 -1.336 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 20.133 -3.734 -3.042 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 20.709 -4.242 -1.527 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 20.113 -5.383 -2.635 1.00 0.00 H new ATOM 1820 N THR B 41 19.789 -8.991 3.025 1.00 0.00 N ATOM 1821 CA THR B 41 20.464 -10.278 2.981 1.00 0.00 C ATOM 1822 C THR B 41 19.525 -11.448 3.271 1.00 0.00 C ATOM 1823 O THR B 41 19.760 -12.560 2.801 1.00 0.00 O ATOM 1824 CB THR B 41 21.645 -10.329 3.971 1.00 0.00 C ATOM 1825 OG1 THR B 41 21.878 -9.028 4.531 1.00 0.00 O ATOM 1826 CG2 THR B 41 22.908 -10.828 3.280 1.00 0.00 C ATOM 0 H THR B 41 19.539 -8.668 3.960 1.00 0.00 H new ATOM 0 HA THR B 41 20.834 -10.380 1.961 1.00 0.00 H new ATOM 0 HB THR B 41 21.389 -11.023 4.771 1.00 0.00 H new ATOM 0 HG1 THR B 41 21.147 -8.800 5.143 1.00 0.00 H new ATOM 0 HG21 THR B 41 23.728 -10.856 3.997 1.00 0.00 H new ATOM 0 HG22 THR B 41 22.736 -11.830 2.886 1.00 0.00 H new ATOM 0 HG23 THR B 41 23.165 -10.156 2.461 1.00 0.00 H new ATOM 1834 N LYS B 42 18.462 -11.217 4.037 1.00 0.00 N ATOM 1835 CA LYS B 42 17.542 -12.304 4.372 1.00 0.00 C ATOM 1836 C LYS B 42 16.072 -11.870 4.352 1.00 0.00 C ATOM 1837 O LYS B 42 15.296 -12.212 5.249 1.00 0.00 O ATOM 1838 CB LYS B 42 17.909 -12.889 5.740 1.00 0.00 C ATOM 1839 CG LYS B 42 17.993 -11.854 6.850 1.00 0.00 C ATOM 1840 CD LYS B 42 18.718 -12.413 8.063 1.00 0.00 C ATOM 1841 CE LYS B 42 18.684 -11.449 9.237 1.00 0.00 C ATOM 1842 NZ LYS B 42 19.865 -11.618 10.125 1.00 0.00 N ATOM 0 H LYS B 42 18.218 -10.308 4.431 1.00 0.00 H new ATOM 0 HA LYS B 42 17.649 -13.067 3.601 1.00 0.00 H new ATOM 0 HB2 LYS B 42 17.169 -13.641 6.013 1.00 0.00 H new ATOM 0 HB3 LYS B 42 18.868 -13.400 5.660 1.00 0.00 H new ATOM 0 HG2 LYS B 42 18.514 -10.968 6.487 1.00 0.00 H new ATOM 0 HG3 LYS B 42 16.989 -11.539 7.135 1.00 0.00 H new ATOM 0 HD2 LYS B 42 18.261 -13.358 8.356 1.00 0.00 H new ATOM 0 HD3 LYS B 42 19.754 -12.628 7.800 1.00 0.00 H new ATOM 0 HE2 LYS B 42 18.652 -10.425 8.865 1.00 0.00 H new ATOM 0 HE3 LYS B 42 17.772 -11.608 9.812 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 19.806 -10.943 10.914 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 19.882 -12.588 10.500 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 20.735 -11.441 9.583 1.00 0.00 H new ATOM 1856 N HIS B 43 15.686 -11.133 3.320 1.00 0.00 N ATOM 1857 CA HIS B 43 14.308 -10.669 3.171 1.00 0.00 C ATOM 1858 C HIS B 43 14.024 -10.380 1.706 1.00 0.00 C ATOM 1859 O HIS B 43 14.922 -9.981 0.969 1.00 0.00 O ATOM 1860 CB HIS B 43 14.051 -9.406 4.000 1.00 0.00 C ATOM 1861 CG HIS B 43 13.610 -9.663 5.411 1.00 0.00 C ATOM 1862 ND1 HIS B 43 14.207 -9.070 6.501 1.00 0.00 N ATOM 1863 CD2 HIS B 43 12.607 -10.429 5.907 1.00 0.00 C ATOM 1864 CE1 HIS B 43 13.590 -9.452 7.601 1.00 0.00 C ATOM 1865 NE2 HIS B 43 12.615 -10.277 7.271 1.00 0.00 N ATOM 0 H HIS B 43 16.310 -10.841 2.568 1.00 0.00 H new ATOM 0 HA HIS B 43 13.645 -11.455 3.533 1.00 0.00 H new ATOM 0 HB2 HIS B 43 14.963 -8.810 4.021 1.00 0.00 H new ATOM 0 HB3 HIS B 43 13.290 -8.807 3.499 1.00 0.00 H new ATOM 0 HD2 HIS B 43 11.928 -11.044 5.335 1.00 0.00 H new ATOM 0 HE1 HIS B 43 13.841 -9.142 8.605 1.00 0.00 H new ATOM 0 HE2 HIS B 43 11.973 -10.728 7.922 1.00 0.00 H new ATOM 1874 N ASP B 44 12.781 -10.583 1.284 1.00 0.00 N ATOM 1875 CA ASP B 44 12.398 -10.337 -0.099 1.00 0.00 C ATOM 1876 C ASP B 44 11.463 -9.139 -0.186 1.00 0.00 C ATOM 1877 O ASP B 44 10.416 -9.105 0.468 1.00 0.00 O ATOM 1878 CB ASP B 44 11.717 -11.564 -0.707 1.00 0.00 C ATOM 1879 CG ASP B 44 12.679 -12.714 -0.924 1.00 0.00 C ATOM 1880 OD1 ASP B 44 13.371 -12.731 -1.964 1.00 0.00 O ATOM 1881 OD2 ASP B 44 12.744 -13.614 -0.059 1.00 0.00 O ATOM 0 H ASP B 44 12.023 -10.917 1.880 1.00 0.00 H new ATOM 0 HA ASP B 44 13.306 -10.127 -0.664 1.00 0.00 H new ATOM 0 HB2 ASP B 44 10.909 -11.889 -0.051 1.00 0.00 H new ATOM 0 HB3 ASP B 44 11.264 -11.289 -1.659 1.00 0.00 H new ATOM 1886 N LEU B 45 11.847 -8.154 -0.982 1.00 0.00 N ATOM 1887 CA LEU B 45 11.038 -6.956 -1.154 1.00 0.00 C ATOM 1888 C LEU B 45 10.174 -7.077 -2.401 1.00 0.00 C ATOM 1889 O LEU B 45 10.684 -7.286 -3.506 1.00 0.00 O ATOM 1890 CB LEU B 45 11.922 -5.711 -1.244 1.00 0.00 C ATOM 1891 CG LEU B 45 11.167 -4.382 -1.289 1.00 0.00 C ATOM 1892 CD1 LEU B 45 10.239 -4.257 -0.092 1.00 0.00 C ATOM 1893 CD2 LEU B 45 12.146 -3.222 -1.323 1.00 0.00 C ATOM 0 H LEU B 45 12.714 -8.160 -1.520 1.00 0.00 H new ATOM 0 HA LEU B 45 10.390 -6.855 -0.284 1.00 0.00 H new ATOM 0 HB2 LEU B 45 12.596 -5.700 -0.387 1.00 0.00 H new ATOM 0 HB3 LEU B 45 12.543 -5.789 -2.136 1.00 0.00 H new ATOM 0 HG LEU B 45 10.564 -4.356 -2.197 1.00 0.00 H new ATOM 0 HD11 LEU B 45 9.710 -3.305 -0.140 1.00 0.00 H new ATOM 0 HD12 LEU B 45 9.518 -5.074 -0.104 1.00 0.00 H new ATOM 0 HD13 LEU B 45 10.823 -4.301 0.827 1.00 0.00 H new ATOM 0 HD21 LEU B 45 11.595 -2.282 -1.355 1.00 0.00 H new ATOM 0 HD22 LEU B 45 12.770 -3.247 -0.430 1.00 0.00 H new ATOM 0 HD23 LEU B 45 12.776 -3.304 -2.209 1.00 0.00 H new ATOM 1905 N TYR B 46 8.871 -6.946 -2.218 1.00 0.00 N ATOM 1906 CA TYR B 46 7.929 -7.053 -3.319 1.00 0.00 C ATOM 1907 C TYR B 46 7.387 -5.686 -3.719 1.00 0.00 C ATOM 1908 O TYR B 46 6.807 -4.970 -2.897 1.00 0.00 O ATOM 1909 CB TYR B 46 6.768 -7.976 -2.935 1.00 0.00 C ATOM 1910 CG TYR B 46 7.082 -9.454 -3.068 1.00 0.00 C ATOM 1911 CD1 TYR B 46 8.174 -10.018 -2.417 1.00 0.00 C ATOM 1912 CD2 TYR B 46 6.278 -10.286 -3.839 1.00 0.00 C ATOM 1913 CE1 TYR B 46 8.452 -11.367 -2.528 1.00 0.00 C ATOM 1914 CE2 TYR B 46 6.552 -11.636 -3.956 1.00 0.00 C ATOM 1915 CZ TYR B 46 7.640 -12.170 -3.297 1.00 0.00 C ATOM 1916 OH TYR B 46 7.912 -13.516 -3.400 1.00 0.00 O ATOM 0 H TYR B 46 8.440 -6.764 -1.312 1.00 0.00 H new ATOM 0 HA TYR B 46 8.461 -7.474 -4.172 1.00 0.00 H new ATOM 0 HB2 TYR B 46 6.478 -7.768 -1.905 1.00 0.00 H new ATOM 0 HB3 TYR B 46 5.908 -7.740 -3.562 1.00 0.00 H new ATOM 0 HD1 TYR B 46 8.815 -9.391 -1.815 1.00 0.00 H new ATOM 0 HD2 TYR B 46 5.425 -9.871 -4.355 1.00 0.00 H new ATOM 0 HE1 TYR B 46 9.303 -11.790 -2.014 1.00 0.00 H new ATOM 0 HE2 TYR B 46 5.918 -12.269 -4.560 1.00 0.00 H new ATOM 0 HH TYR B 46 7.245 -13.941 -3.978 1.00 0.00 H new ATOM 1926 N TYR B 47 7.593 -5.334 -4.978 1.00 0.00 N ATOM 1927 CA TYR B 47 7.110 -4.079 -5.527 1.00 0.00 C ATOM 1928 C TYR B 47 5.897 -4.376 -6.404 1.00 0.00 C ATOM 1929 O TYR B 47 6.034 -4.747 -7.572 1.00 0.00 O ATOM 1930 CB TYR B 47 8.236 -3.377 -6.313 1.00 0.00 C ATOM 1931 CG TYR B 47 7.769 -2.470 -7.440 1.00 0.00 C ATOM 1932 CD1 TYR B 47 7.040 -1.314 -7.182 1.00 0.00 C ATOM 1933 CD2 TYR B 47 8.051 -2.784 -8.765 1.00 0.00 C ATOM 1934 CE1 TYR B 47 6.607 -0.497 -8.213 1.00 0.00 C ATOM 1935 CE2 TYR B 47 7.625 -1.972 -9.798 1.00 0.00 C ATOM 1936 CZ TYR B 47 6.901 -0.834 -9.519 1.00 0.00 C ATOM 1937 OH TYR B 47 6.461 -0.034 -10.550 1.00 0.00 O ATOM 0 H TYR B 47 8.101 -5.912 -5.648 1.00 0.00 H new ATOM 0 HA TYR B 47 6.808 -3.399 -4.731 1.00 0.00 H new ATOM 0 HB2 TYR B 47 8.831 -2.787 -5.616 1.00 0.00 H new ATOM 0 HB3 TYR B 47 8.896 -4.138 -6.730 1.00 0.00 H new ATOM 0 HD1 TYR B 47 6.808 -1.049 -6.161 1.00 0.00 H new ATOM 0 HD2 TYR B 47 8.613 -3.678 -8.990 1.00 0.00 H new ATOM 0 HE1 TYR B 47 6.043 0.398 -7.997 1.00 0.00 H new ATOM 0 HE2 TYR B 47 7.859 -2.228 -10.821 1.00 0.00 H new ATOM 0 HH TYR B 47 7.113 0.679 -10.712 1.00 0.00 H new ATOM 1947 N ASN B 48 4.715 -4.263 -5.804 1.00 0.00 N ATOM 1948 CA ASN B 48 3.442 -4.527 -6.484 1.00 0.00 C ATOM 1949 C ASN B 48 3.337 -5.994 -6.919 1.00 0.00 C ATOM 1950 O ASN B 48 2.730 -6.809 -6.227 1.00 0.00 O ATOM 1951 CB ASN B 48 3.244 -3.591 -7.686 1.00 0.00 C ATOM 1952 CG ASN B 48 2.635 -2.254 -7.298 1.00 0.00 C ATOM 1953 OD1 ASN B 48 1.413 -2.103 -7.239 1.00 0.00 O ATOM 1954 ND2 ASN B 48 3.481 -1.268 -7.039 1.00 0.00 N ATOM 0 H ASN B 48 4.609 -3.985 -4.828 1.00 0.00 H new ATOM 0 HA ASN B 48 2.645 -4.328 -5.768 1.00 0.00 H new ATOM 0 HB2 ASN B 48 4.206 -3.420 -8.170 1.00 0.00 H new ATOM 0 HB3 ASN B 48 2.601 -4.079 -8.418 1.00 0.00 H new ATOM 0 HD21 ASN B 48 3.127 -0.347 -6.781 1.00 0.00 H new ATOM 0 HD22 ASN B 48 4.486 -1.430 -7.098 1.00 0.00 H new ATOM 1961 N MET B 49 3.936 -6.321 -8.062 1.00 0.00 N ATOM 1962 CA MET B 49 3.909 -7.684 -8.590 1.00 0.00 C ATOM 1963 C MET B 49 5.299 -8.133 -9.037 1.00 0.00 C ATOM 1964 O MET B 49 5.450 -9.197 -9.636 1.00 0.00 O ATOM 1965 CB MET B 49 2.943 -7.778 -9.778 1.00 0.00 C ATOM 1966 CG MET B 49 1.491 -7.984 -9.380 1.00 0.00 C ATOM 1967 SD MET B 49 0.384 -8.068 -10.801 1.00 0.00 S ATOM 1968 CE MET B 49 0.499 -6.387 -11.412 1.00 0.00 C ATOM 0 H MET B 49 4.448 -5.657 -8.643 1.00 0.00 H new ATOM 0 HA MET B 49 3.570 -8.340 -7.788 1.00 0.00 H new ATOM 0 HB2 MET B 49 3.021 -6.866 -10.369 1.00 0.00 H new ATOM 0 HB3 MET B 49 3.253 -8.602 -10.421 1.00 0.00 H new ATOM 0 HG2 MET B 49 1.404 -8.904 -8.802 1.00 0.00 H new ATOM 0 HG3 MET B 49 1.178 -7.168 -8.729 1.00 0.00 H new ATOM 0 HE1 MET B 49 -0.344 -6.181 -12.072 1.00 0.00 H new ATOM 0 HE2 MET B 49 0.481 -5.693 -10.572 1.00 0.00 H new ATOM 0 HE3 MET B 49 1.431 -6.264 -11.964 1.00 0.00 H new ATOM 1978 N ASP B 50 6.314 -7.337 -8.730 1.00 0.00 N ATOM 1979 CA ASP B 50 7.682 -7.664 -9.121 1.00 0.00 C ATOM 1980 C ASP B 50 8.604 -7.708 -7.911 1.00 0.00 C ATOM 1981 O ASP B 50 8.412 -6.966 -6.952 1.00 0.00 O ATOM 1982 CB ASP B 50 8.202 -6.640 -10.130 1.00 0.00 C ATOM 1983 CG ASP B 50 9.540 -7.040 -10.718 1.00 0.00 C ATOM 1984 OD1 ASP B 50 9.605 -8.078 -11.407 1.00 0.00 O ATOM 1985 OD2 ASP B 50 10.530 -6.312 -10.510 1.00 0.00 O ATOM 0 H ASP B 50 6.219 -6.463 -8.213 1.00 0.00 H new ATOM 0 HA ASP B 50 7.672 -8.652 -9.581 1.00 0.00 H new ATOM 0 HB2 ASP B 50 7.475 -6.523 -10.934 1.00 0.00 H new ATOM 0 HB3 ASP B 50 8.297 -5.669 -9.643 1.00 0.00 H new ATOM 1990 N ILE B 51 9.595 -8.581 -7.954 1.00 0.00 N ATOM 1991 CA ILE B 51 10.546 -8.708 -6.859 1.00 0.00 C ATOM 1992 C ILE B 51 11.736 -7.780 -7.076 1.00 0.00 C ATOM 1993 O ILE B 51 12.310 -7.739 -8.165 1.00 0.00 O ATOM 1994 CB ILE B 51 11.041 -10.164 -6.712 1.00 0.00 C ATOM 1995 CG1 ILE B 51 9.852 -11.101 -6.490 1.00 0.00 C ATOM 1996 CG2 ILE B 51 12.042 -10.284 -5.567 1.00 0.00 C ATOM 1997 CD1 ILE B 51 10.225 -12.570 -6.501 1.00 0.00 C ATOM 0 H ILE B 51 9.764 -9.214 -8.736 1.00 0.00 H new ATOM 0 HA ILE B 51 10.032 -8.425 -5.941 1.00 0.00 H new ATOM 0 HB ILE B 51 11.548 -10.453 -7.632 1.00 0.00 H new ATOM 0 HG12 ILE B 51 9.385 -10.861 -5.535 1.00 0.00 H new ATOM 0 HG13 ILE B 51 9.107 -10.918 -7.264 1.00 0.00 H new ATOM 0 HG21 ILE B 51 12.376 -11.318 -5.483 1.00 0.00 H new ATOM 0 HG22 ILE B 51 12.899 -9.640 -5.764 1.00 0.00 H new ATOM 0 HG23 ILE B 51 11.567 -9.979 -4.635 1.00 0.00 H new ATOM 0 HD11 ILE B 51 9.332 -13.173 -6.338 1.00 0.00 H new ATOM 0 HD12 ILE B 51 10.665 -12.826 -7.465 1.00 0.00 H new ATOM 0 HD13 ILE B 51 10.947 -12.768 -5.709 1.00 0.00 H new ATOM 2009 N LEU B 52 12.098 -7.036 -6.040 1.00 0.00 N ATOM 2010 CA LEU B 52 13.215 -6.103 -6.117 1.00 0.00 C ATOM 2011 C LEU B 52 14.540 -6.839 -6.297 1.00 0.00 C ATOM 2012 O LEU B 52 15.101 -7.383 -5.347 1.00 0.00 O ATOM 2013 CB LEU B 52 13.264 -5.228 -4.861 1.00 0.00 C ATOM 2014 CG LEU B 52 13.252 -3.716 -5.110 1.00 0.00 C ATOM 2015 CD1 LEU B 52 14.476 -3.288 -5.905 1.00 0.00 C ATOM 2016 CD2 LEU B 52 11.981 -3.297 -5.831 1.00 0.00 C ATOM 0 H LEU B 52 11.633 -7.060 -5.133 1.00 0.00 H new ATOM 0 HA LEU B 52 13.061 -5.467 -6.989 1.00 0.00 H new ATOM 0 HB2 LEU B 52 12.413 -5.481 -4.229 1.00 0.00 H new ATOM 0 HB3 LEU B 52 14.164 -5.479 -4.299 1.00 0.00 H new ATOM 0 HG LEU B 52 13.279 -3.217 -4.141 1.00 0.00 H new ATOM 0 HD11 LEU B 52 14.445 -2.211 -6.069 1.00 0.00 H new ATOM 0 HD12 LEU B 52 15.378 -3.545 -5.350 1.00 0.00 H new ATOM 0 HD13 LEU B 52 14.483 -3.801 -6.866 1.00 0.00 H new ATOM 0 HD21 LEU B 52 11.995 -2.220 -5.997 1.00 0.00 H new ATOM 0 HD22 LEU B 52 11.921 -3.811 -6.790 1.00 0.00 H new ATOM 0 HD23 LEU B 52 11.115 -3.559 -5.224 1.00 0.00 H new ATOM 2028 N ASP B 53 15.023 -6.859 -7.532 1.00 0.00 N ATOM 2029 CA ASP B 53 16.278 -7.519 -7.862 1.00 0.00 C ATOM 2030 C ASP B 53 17.443 -6.532 -7.772 1.00 0.00 C ATOM 2031 O ASP B 53 17.232 -5.316 -7.754 1.00 0.00 O ATOM 2032 CB ASP B 53 16.191 -8.131 -9.266 1.00 0.00 C ATOM 2033 CG ASP B 53 17.505 -8.717 -9.739 1.00 0.00 C ATOM 2034 OD1 ASP B 53 18.017 -9.642 -9.083 1.00 0.00 O ATOM 2035 OD2 ASP B 53 18.037 -8.236 -10.760 1.00 0.00 O ATOM 0 H ASP B 53 14.559 -6.421 -8.328 1.00 0.00 H new ATOM 0 HA ASP B 53 16.457 -8.318 -7.143 1.00 0.00 H new ATOM 0 HB2 ASP B 53 15.430 -8.911 -9.270 1.00 0.00 H new ATOM 0 HB3 ASP B 53 15.867 -7.365 -9.971 1.00 0.00 H new ATOM 2040 N SER B 54 18.662 -7.057 -7.719 1.00 0.00 N ATOM 2041 CA SER B 54 19.866 -6.241 -7.624 1.00 0.00 C ATOM 2042 C SER B 54 20.064 -5.366 -8.864 1.00 0.00 C ATOM 2043 O SER B 54 20.714 -4.323 -8.794 1.00 0.00 O ATOM 2044 CB SER B 54 21.077 -7.147 -7.421 1.00 0.00 C ATOM 2045 OG SER B 54 20.773 -8.197 -6.515 1.00 0.00 O ATOM 0 H SER B 54 18.843 -8.061 -7.741 1.00 0.00 H new ATOM 0 HA SER B 54 19.755 -5.572 -6.771 1.00 0.00 H new ATOM 0 HB2 SER B 54 21.389 -7.565 -8.378 1.00 0.00 H new ATOM 0 HB3 SER B 54 21.915 -6.563 -7.040 1.00 0.00 H new ATOM 0 HG SER B 54 21.561 -8.768 -6.399 1.00 0.00 H new ATOM 2051 N ASN B 55 19.496 -5.779 -9.993 1.00 0.00 N ATOM 2052 CA ASN B 55 19.632 -5.008 -11.224 1.00 0.00 C ATOM 2053 C ASN B 55 18.693 -3.800 -11.215 1.00 0.00 C ATOM 2054 O ASN B 55 18.875 -2.848 -11.975 1.00 0.00 O ATOM 2055 CB ASN B 55 19.356 -5.886 -12.447 1.00 0.00 C ATOM 2056 CG ASN B 55 20.360 -5.651 -13.564 1.00 0.00 C ATOM 2057 OD1 ASN B 55 20.816 -4.530 -13.785 1.00 0.00 O ATOM 2058 ND2 ASN B 55 20.729 -6.712 -14.264 1.00 0.00 N ATOM 0 H ASN B 55 18.944 -6.632 -10.081 1.00 0.00 H new ATOM 0 HA ASN B 55 20.659 -4.646 -11.283 1.00 0.00 H new ATOM 0 HB2 ASN B 55 19.383 -6.935 -12.152 1.00 0.00 H new ATOM 0 HB3 ASN B 55 18.351 -5.685 -12.817 1.00 0.00 H new ATOM 0 HD21 ASN B 55 21.413 -6.615 -15.015 1.00 0.00 H new ATOM 0 HD22 ASN B 55 20.330 -7.626 -14.053 1.00 0.00 H new ATOM 2065 N ARG B 56 17.689 -3.845 -10.346 1.00 0.00 N ATOM 2066 CA ARG B 56 16.735 -2.750 -10.227 1.00 0.00 C ATOM 2067 C ARG B 56 17.332 -1.629 -9.380 1.00 0.00 C ATOM 2068 O ARG B 56 17.012 -1.490 -8.201 1.00 0.00 O ATOM 2069 CB ARG B 56 15.428 -3.232 -9.594 1.00 0.00 C ATOM 2070 CG ARG B 56 14.364 -3.646 -10.595 1.00 0.00 C ATOM 2071 CD ARG B 56 12.985 -3.192 -10.139 1.00 0.00 C ATOM 2072 NE ARG B 56 11.905 -3.932 -10.793 1.00 0.00 N ATOM 2073 CZ ARG B 56 11.119 -3.433 -11.748 1.00 0.00 C ATOM 2074 NH1 ARG B 56 11.333 -2.223 -12.245 1.00 0.00 N ATOM 2075 NH2 ARG B 56 10.121 -4.166 -12.220 1.00 0.00 N ATOM 0 H ARG B 56 17.515 -4.627 -9.715 1.00 0.00 H new ATOM 0 HA ARG B 56 16.519 -2.375 -11.227 1.00 0.00 H new ATOM 0 HB2 ARG B 56 15.644 -4.078 -8.941 1.00 0.00 H new ATOM 0 HB3 ARG B 56 15.028 -2.437 -8.964 1.00 0.00 H new ATOM 0 HG2 ARG B 56 14.589 -3.215 -11.571 1.00 0.00 H new ATOM 0 HG3 ARG B 56 14.374 -4.729 -10.715 1.00 0.00 H new ATOM 0 HD2 ARG B 56 12.904 -3.317 -9.059 1.00 0.00 H new ATOM 0 HD3 ARG B 56 12.869 -2.128 -10.347 1.00 0.00 H new ATOM 0 HE ARG B 56 11.742 -4.895 -10.498 1.00 0.00 H new ATOM 0 HH11 ARG B 56 12.108 -1.659 -11.897 1.00 0.00 H new ATOM 0 HH12 ARG B 56 10.722 -1.856 -12.975 1.00 0.00 H new ATOM 0 HH21 ARG B 56 9.959 -5.104 -11.853 1.00 0.00 H new ATOM 0 HH22 ARG B 56 9.515 -3.792 -12.950 1.00 0.00 H new ATOM 2089 N THR B 57 18.205 -0.845 -9.989 1.00 0.00 N ATOM 2090 CA THR B 57 18.855 0.263 -9.303 1.00 0.00 C ATOM 2091 C THR B 57 18.101 1.573 -9.558 1.00 0.00 C ATOM 2092 O THR B 57 18.621 2.667 -9.345 1.00 0.00 O ATOM 2093 CB THR B 57 20.335 0.387 -9.745 1.00 0.00 C ATOM 2094 OG1 THR B 57 21.069 1.203 -8.826 1.00 0.00 O ATOM 2095 CG2 THR B 57 20.452 0.970 -11.147 1.00 0.00 C ATOM 0 H THR B 57 18.483 -0.955 -10.964 1.00 0.00 H new ATOM 0 HA THR B 57 18.835 0.061 -8.232 1.00 0.00 H new ATOM 0 HB THR B 57 20.756 -0.618 -9.753 1.00 0.00 H new ATOM 0 HG1 THR B 57 20.557 2.015 -8.629 1.00 0.00 H new ATOM 0 HG21 THR B 57 21.504 1.043 -11.424 1.00 0.00 H new ATOM 0 HG22 THR B 57 19.934 0.323 -11.855 1.00 0.00 H new ATOM 0 HG23 THR B 57 20.002 1.963 -11.167 1.00 0.00 H new ATOM 2103 N GLN B 58 16.859 1.442 -9.997 1.00 0.00 N ATOM 2104 CA GLN B 58 16.019 2.592 -10.287 1.00 0.00 C ATOM 2105 C GLN B 58 15.539 3.238 -8.995 1.00 0.00 C ATOM 2106 O GLN B 58 15.159 2.540 -8.052 1.00 0.00 O ATOM 2107 CB GLN B 58 14.809 2.158 -11.118 1.00 0.00 C ATOM 2108 CG GLN B 58 15.131 1.140 -12.196 1.00 0.00 C ATOM 2109 CD GLN B 58 13.902 0.393 -12.659 1.00 0.00 C ATOM 2110 OE1 GLN B 58 13.488 -0.586 -12.039 1.00 0.00 O ATOM 2111 NE2 GLN B 58 13.307 0.848 -13.748 1.00 0.00 N ATOM 0 H GLN B 58 16.408 0.542 -10.161 1.00 0.00 H new ATOM 0 HA GLN B 58 16.607 3.317 -10.850 1.00 0.00 H new ATOM 0 HB2 GLN B 58 14.055 1.739 -10.451 1.00 0.00 H new ATOM 0 HB3 GLN B 58 14.368 3.039 -11.585 1.00 0.00 H new ATOM 0 HG2 GLN B 58 15.589 1.646 -13.046 1.00 0.00 H new ATOM 0 HG3 GLN B 58 15.864 0.429 -11.815 1.00 0.00 H new ATOM 0 HE21 GLN B 58 13.683 1.663 -14.232 1.00 0.00 H new ATOM 0 HE22 GLN B 58 12.471 0.384 -14.104 1.00 0.00 H new ATOM 2120 N SER B 59 15.553 4.562 -8.950 1.00 0.00 N ATOM 2121 CA SER B 59 15.102 5.285 -7.772 1.00 0.00 C ATOM 2122 C SER B 59 13.576 5.277 -7.731 1.00 0.00 C ATOM 2123 O SER B 59 12.937 4.752 -8.638 1.00 0.00 O ATOM 2124 CB SER B 59 15.633 6.724 -7.786 1.00 0.00 C ATOM 2125 OG SER B 59 16.779 6.850 -8.618 1.00 0.00 O ATOM 0 H SER B 59 15.872 5.156 -9.715 1.00 0.00 H new ATOM 0 HA SER B 59 15.489 4.794 -6.879 1.00 0.00 H new ATOM 0 HB2 SER B 59 14.851 7.398 -8.137 1.00 0.00 H new ATOM 0 HB3 SER B 59 15.884 7.030 -6.770 1.00 0.00 H new ATOM 0 HG SER B 59 16.501 7.117 -9.519 1.00 0.00 H new ATOM 2131 N LEU B 60 12.993 5.885 -6.705 1.00 0.00 N ATOM 2132 CA LEU B 60 11.538 5.914 -6.546 1.00 0.00 C ATOM 2133 C LEU B 60 10.829 6.447 -7.798 1.00 0.00 C ATOM 2134 O LEU B 60 9.848 5.860 -8.265 1.00 0.00 O ATOM 2135 CB LEU B 60 11.157 6.770 -5.334 1.00 0.00 C ATOM 2136 CG LEU B 60 11.928 6.477 -4.040 1.00 0.00 C ATOM 2137 CD1 LEU B 60 11.368 7.305 -2.896 1.00 0.00 C ATOM 2138 CD2 LEU B 60 11.876 4.994 -3.699 1.00 0.00 C ATOM 0 H LEU B 60 13.505 6.367 -5.966 1.00 0.00 H new ATOM 0 HA LEU B 60 11.210 4.886 -6.391 1.00 0.00 H new ATOM 0 HB2 LEU B 60 11.304 7.819 -5.593 1.00 0.00 H new ATOM 0 HB3 LEU B 60 10.093 6.636 -5.139 1.00 0.00 H new ATOM 0 HG LEU B 60 12.972 6.751 -4.194 1.00 0.00 H new ATOM 0 HD11 LEU B 60 11.924 7.088 -1.984 1.00 0.00 H new ATOM 0 HD12 LEU B 60 11.461 8.365 -3.134 1.00 0.00 H new ATOM 0 HD13 LEU B 60 10.317 7.057 -2.748 1.00 0.00 H new ATOM 0 HD21 LEU B 60 12.430 4.813 -2.778 1.00 0.00 H new ATOM 0 HD22 LEU B 60 10.839 4.688 -3.565 1.00 0.00 H new ATOM 0 HD23 LEU B 60 12.322 4.418 -4.510 1.00 0.00 H new ATOM 2150 N LYS B 61 11.336 7.546 -8.349 1.00 0.00 N ATOM 2151 CA LYS B 61 10.729 8.156 -9.535 1.00 0.00 C ATOM 2152 C LYS B 61 10.872 7.269 -10.775 1.00 0.00 C ATOM 2153 O LYS B 61 10.021 7.308 -11.662 1.00 0.00 O ATOM 2154 CB LYS B 61 11.317 9.554 -9.803 1.00 0.00 C ATOM 2155 CG LYS B 61 12.722 9.554 -10.390 1.00 0.00 C ATOM 2156 CD LYS B 61 13.779 9.325 -9.323 1.00 0.00 C ATOM 2157 CE LYS B 61 14.734 10.501 -9.213 1.00 0.00 C ATOM 2158 NZ LYS B 61 15.550 10.665 -10.441 1.00 0.00 N ATOM 0 H LYS B 61 12.161 8.033 -7.998 1.00 0.00 H new ATOM 0 HA LYS B 61 9.664 8.261 -9.326 1.00 0.00 H new ATOM 0 HB2 LYS B 61 10.654 10.087 -10.484 1.00 0.00 H new ATOM 0 HB3 LYS B 61 11.329 10.113 -8.867 1.00 0.00 H new ATOM 0 HG2 LYS B 61 12.798 8.777 -11.150 1.00 0.00 H new ATOM 0 HG3 LYS B 61 12.908 10.506 -10.888 1.00 0.00 H new ATOM 0 HD2 LYS B 61 13.294 9.159 -8.361 1.00 0.00 H new ATOM 0 HD3 LYS B 61 14.341 8.421 -9.557 1.00 0.00 H new ATOM 0 HE2 LYS B 61 14.167 11.414 -9.029 1.00 0.00 H new ATOM 0 HE3 LYS B 61 15.392 10.356 -8.356 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 16.556 10.544 -10.208 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 15.269 9.950 -11.142 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 15.397 11.615 -10.835 1.00 0.00 H new ATOM 2172 N GLU B 62 11.929 6.461 -10.834 1.00 0.00 N ATOM 2173 CA GLU B 62 12.144 5.582 -11.984 1.00 0.00 C ATOM 2174 C GLU B 62 11.399 4.263 -11.795 1.00 0.00 C ATOM 2175 O GLU B 62 10.876 3.689 -12.752 1.00 0.00 O ATOM 2176 CB GLU B 62 13.635 5.323 -12.212 1.00 0.00 C ATOM 2177 CG GLU B 62 14.364 6.495 -12.848 1.00 0.00 C ATOM 2178 CD GLU B 62 15.288 7.199 -11.879 1.00 0.00 C ATOM 2179 OE1 GLU B 62 15.863 6.521 -11.005 1.00 0.00 O ATOM 2180 OE2 GLU B 62 15.447 8.438 -11.988 1.00 0.00 O ATOM 0 H GLU B 62 12.643 6.396 -10.109 1.00 0.00 H new ATOM 0 HA GLU B 62 11.750 6.084 -12.867 1.00 0.00 H new ATOM 0 HB2 GLU B 62 14.105 5.088 -11.257 1.00 0.00 H new ATOM 0 HB3 GLU B 62 13.750 4.445 -12.848 1.00 0.00 H new ATOM 0 HG2 GLU B 62 14.941 6.139 -13.702 1.00 0.00 H new ATOM 0 HG3 GLU B 62 13.634 7.208 -13.231 1.00 0.00 H new ATOM 2187 N LEU B 63 11.352 3.793 -10.553 1.00 0.00 N ATOM 2188 CA LEU B 63 10.654 2.553 -10.223 1.00 0.00 C ATOM 2189 C LEU B 63 9.173 2.674 -10.566 1.00 0.00 C ATOM 2190 O LEU B 63 8.529 1.698 -10.948 1.00 0.00 O ATOM 2191 CB LEU B 63 10.822 2.222 -8.737 1.00 0.00 C ATOM 2192 CG LEU B 63 11.791 1.078 -8.435 1.00 0.00 C ATOM 2193 CD1 LEU B 63 12.224 1.115 -6.979 1.00 0.00 C ATOM 2194 CD2 LEU B 63 11.154 -0.263 -8.770 1.00 0.00 C ATOM 0 H LEU B 63 11.790 4.253 -9.755 1.00 0.00 H new ATOM 0 HA LEU B 63 11.089 1.745 -10.812 1.00 0.00 H new ATOM 0 HB2 LEU B 63 11.166 3.116 -8.218 1.00 0.00 H new ATOM 0 HB3 LEU B 63 9.845 1.970 -8.324 1.00 0.00 H new ATOM 0 HG LEU B 63 12.676 1.203 -9.059 1.00 0.00 H new ATOM 0 HD11 LEU B 63 12.913 0.293 -6.783 1.00 0.00 H new ATOM 0 HD12 LEU B 63 12.721 2.063 -6.771 1.00 0.00 H new ATOM 0 HD13 LEU B 63 11.349 1.015 -6.337 1.00 0.00 H new ATOM 0 HD21 LEU B 63 11.858 -1.065 -8.549 1.00 0.00 H new ATOM 0 HD22 LEU B 63 10.252 -0.397 -8.173 1.00 0.00 H new ATOM 0 HD23 LEU B 63 10.895 -0.289 -9.829 1.00 0.00 H new ATOM 2206 N GLY B 64 8.645 3.882 -10.435 1.00 0.00 N ATOM 2207 CA GLY B 64 7.250 4.121 -10.758 1.00 0.00 C ATOM 2208 C GLY B 64 6.366 4.193 -9.533 1.00 0.00 C ATOM 2209 O GLY B 64 5.317 3.559 -9.480 1.00 0.00 O ATOM 0 H GLY B 64 9.157 4.703 -10.111 1.00 0.00 H new ATOM 0 HA2 GLY B 64 7.166 5.054 -11.316 1.00 0.00 H new ATOM 0 HA3 GLY B 64 6.892 3.326 -11.412 1.00 0.00 H new ATOM 2213 N LEU B 65 6.798 4.959 -8.543 1.00 0.00 N ATOM 2214 CA LEU B 65 6.026 5.127 -7.320 1.00 0.00 C ATOM 2215 C LEU B 65 5.389 6.508 -7.311 1.00 0.00 C ATOM 2216 O LEU B 65 6.015 7.490 -7.721 1.00 0.00 O ATOM 2217 CB LEU B 65 6.914 4.932 -6.087 1.00 0.00 C ATOM 2218 CG LEU B 65 7.644 3.587 -6.011 1.00 0.00 C ATOM 2219 CD1 LEU B 65 8.438 3.492 -4.719 1.00 0.00 C ATOM 2220 CD2 LEU B 65 6.665 2.425 -6.119 1.00 0.00 C ATOM 0 H LEU B 65 7.678 5.474 -8.562 1.00 0.00 H new ATOM 0 HA LEU B 65 5.241 4.371 -7.287 1.00 0.00 H new ATOM 0 HB2 LEU B 65 7.655 5.731 -6.064 1.00 0.00 H new ATOM 0 HB3 LEU B 65 6.298 5.043 -5.195 1.00 0.00 H new ATOM 0 HG LEU B 65 8.333 3.526 -6.854 1.00 0.00 H new ATOM 0 HD11 LEU B 65 8.952 2.532 -4.678 1.00 0.00 H new ATOM 0 HD12 LEU B 65 9.171 4.298 -4.682 1.00 0.00 H new ATOM 0 HD13 LEU B 65 7.761 3.578 -3.869 1.00 0.00 H new ATOM 0 HD21 LEU B 65 7.211 1.483 -6.062 1.00 0.00 H new ATOM 0 HD22 LEU B 65 5.946 2.478 -5.301 1.00 0.00 H new ATOM 0 HD23 LEU B 65 6.137 2.481 -7.071 1.00 0.00 H new ATOM 2232 N LYS B 66 4.141 6.589 -6.872 1.00 0.00 N ATOM 2233 CA LYS B 66 3.440 7.862 -6.836 1.00 0.00 C ATOM 2234 C LYS B 66 2.631 8.030 -5.549 1.00 0.00 C ATOM 2235 O LYS B 66 2.842 8.998 -4.813 1.00 0.00 O ATOM 2236 CB LYS B 66 2.541 8.028 -8.075 1.00 0.00 C ATOM 2237 CG LYS B 66 1.970 6.729 -8.632 1.00 0.00 C ATOM 2238 CD LYS B 66 1.957 6.748 -10.158 1.00 0.00 C ATOM 2239 CE LYS B 66 0.977 5.734 -10.741 1.00 0.00 C ATOM 2240 NZ LYS B 66 -0.439 6.132 -10.511 1.00 0.00 N ATOM 0 H LYS B 66 3.597 5.793 -6.538 1.00 0.00 H new ATOM 0 HA LYS B 66 4.194 8.649 -6.850 1.00 0.00 H new ATOM 0 HB2 LYS B 66 1.715 8.691 -7.820 1.00 0.00 H new ATOM 0 HB3 LYS B 66 3.115 8.521 -8.859 1.00 0.00 H new ATOM 0 HG2 LYS B 66 2.564 5.886 -8.280 1.00 0.00 H new ATOM 0 HG3 LYS B 66 0.957 6.583 -8.258 1.00 0.00 H new ATOM 0 HD2 LYS B 66 1.692 7.747 -10.505 1.00 0.00 H new ATOM 0 HD3 LYS B 66 2.959 6.537 -10.530 1.00 0.00 H new ATOM 0 HE2 LYS B 66 1.156 5.631 -11.811 1.00 0.00 H new ATOM 0 HE3 LYS B 66 1.157 4.757 -10.293 1.00 0.00 H new ATOM 0 HZ1 LYS B 66 -1.054 5.633 -11.185 1.00 0.00 H new ATOM 0 HZ2 LYS B 66 -0.716 5.884 -9.540 1.00 0.00 H new ATOM 0 HZ3 LYS B 66 -0.538 7.158 -10.647 1.00 0.00 H new ATOM 2254 N THR B 67 1.737 7.081 -5.265 1.00 0.00 N ATOM 2255 CA THR B 67 0.883 7.146 -4.075 1.00 0.00 C ATOM 2256 C THR B 67 -0.097 5.970 -4.019 1.00 0.00 C ATOM 2257 O THR B 67 -0.406 5.467 -2.943 1.00 0.00 O ATOM 2258 CB THR B 67 0.111 8.494 -4.010 1.00 0.00 C ATOM 2259 OG1 THR B 67 0.842 9.416 -3.194 1.00 0.00 O ATOM 2260 CG2 THR B 67 -1.302 8.345 -3.458 1.00 0.00 C ATOM 0 H THR B 67 1.585 6.255 -5.844 1.00 0.00 H new ATOM 0 HA THR B 67 1.539 7.081 -3.207 1.00 0.00 H new ATOM 0 HB THR B 67 0.019 8.862 -5.032 1.00 0.00 H new ATOM 0 HG1 THR B 67 1.773 9.456 -3.498 1.00 0.00 H new ATOM 0 HG21 THR B 67 -1.789 9.320 -3.437 1.00 0.00 H new ATOM 0 HG22 THR B 67 -1.872 7.668 -4.094 1.00 0.00 H new ATOM 0 HG23 THR B 67 -1.257 7.941 -2.447 1.00 0.00 H new ATOM 2268 N ASP B 68 -0.578 5.522 -5.174 1.00 0.00 N ATOM 2269 CA ASP B 68 -1.530 4.408 -5.212 1.00 0.00 C ATOM 2270 C ASP B 68 -0.807 3.066 -5.196 1.00 0.00 C ATOM 2271 O ASP B 68 -1.426 2.001 -5.306 1.00 0.00 O ATOM 2272 CB ASP B 68 -2.431 4.505 -6.443 1.00 0.00 C ATOM 2273 CG ASP B 68 -1.650 4.475 -7.735 1.00 0.00 C ATOM 2274 OD1 ASP B 68 -1.044 5.503 -8.084 1.00 0.00 O ATOM 2275 OD2 ASP B 68 -1.644 3.422 -8.408 1.00 0.00 O ATOM 0 H ASP B 68 -0.331 5.904 -6.087 1.00 0.00 H new ATOM 0 HA ASP B 68 -2.151 4.474 -4.319 1.00 0.00 H new ATOM 0 HB2 ASP B 68 -3.143 3.680 -6.434 1.00 0.00 H new ATOM 0 HB3 ASP B 68 -3.010 5.427 -6.394 1.00 0.00 H new ATOM 2280 N ASP B 69 0.503 3.124 -5.061 1.00 0.00 N ATOM 2281 CA ASP B 69 1.346 1.940 -5.012 1.00 0.00 C ATOM 2282 C ASP B 69 1.525 1.477 -3.570 1.00 0.00 C ATOM 2283 O ASP B 69 0.980 2.082 -2.643 1.00 0.00 O ATOM 2284 CB ASP B 69 2.707 2.235 -5.652 1.00 0.00 C ATOM 2285 CG ASP B 69 3.177 3.656 -5.393 1.00 0.00 C ATOM 2286 OD1 ASP B 69 2.594 4.597 -5.983 1.00 0.00 O ATOM 2287 OD2 ASP B 69 4.119 3.838 -4.606 1.00 0.00 O ATOM 0 H ASP B 69 1.019 4.000 -4.981 1.00 0.00 H new ATOM 0 HA ASP B 69 0.862 1.141 -5.574 1.00 0.00 H new ATOM 0 HB2 ASP B 69 3.447 1.535 -5.264 1.00 0.00 H new ATOM 0 HB3 ASP B 69 2.643 2.067 -6.727 1.00 0.00 H new ATOM 2292 N LEU B 70 2.257 0.386 -3.381 1.00 0.00 N ATOM 2293 CA LEU B 70 2.492 -0.155 -2.049 1.00 0.00 C ATOM 2294 C LEU B 70 3.753 -1.012 -2.021 1.00 0.00 C ATOM 2295 O LEU B 70 4.351 -1.295 -3.064 1.00 0.00 O ATOM 2296 CB LEU B 70 1.279 -0.968 -1.524 1.00 0.00 C ATOM 2297 CG LEU B 70 0.537 -1.915 -2.506 1.00 0.00 C ATOM 2298 CD1 LEU B 70 -0.487 -1.156 -3.337 1.00 0.00 C ATOM 2299 CD2 LEU B 70 1.497 -2.681 -3.413 1.00 0.00 C ATOM 0 H LEU B 70 2.698 -0.142 -4.134 1.00 0.00 H new ATOM 0 HA LEU B 70 2.630 0.697 -1.384 1.00 0.00 H new ATOM 0 HB2 LEU B 70 1.623 -1.568 -0.682 1.00 0.00 H new ATOM 0 HB3 LEU B 70 0.549 -0.259 -1.133 1.00 0.00 H new ATOM 0 HG LEU B 70 0.013 -2.648 -1.893 1.00 0.00 H new ATOM 0 HD11 LEU B 70 -0.990 -1.846 -4.015 1.00 0.00 H new ATOM 0 HD12 LEU B 70 -1.222 -0.696 -2.677 1.00 0.00 H new ATOM 0 HD13 LEU B 70 0.016 -0.381 -3.916 1.00 0.00 H new ATOM 0 HD21 LEU B 70 0.928 -3.329 -4.080 1.00 0.00 H new ATOM 0 HD22 LEU B 70 2.081 -1.975 -4.003 1.00 0.00 H new ATOM 0 HD23 LEU B 70 2.168 -3.287 -2.804 1.00 0.00 H new ATOM 2311 N LEU B 71 4.145 -1.417 -0.824 1.00 0.00 N ATOM 2312 CA LEU B 71 5.324 -2.252 -0.639 1.00 0.00 C ATOM 2313 C LEU B 71 4.973 -3.443 0.241 1.00 0.00 C ATOM 2314 O LEU B 71 4.276 -3.298 1.251 1.00 0.00 O ATOM 2315 CB LEU B 71 6.461 -1.442 -0.009 1.00 0.00 C ATOM 2316 CG LEU B 71 7.807 -1.528 -0.728 1.00 0.00 C ATOM 2317 CD1 LEU B 71 7.706 -0.965 -2.139 1.00 0.00 C ATOM 2318 CD2 LEU B 71 8.875 -0.785 0.065 1.00 0.00 C ATOM 0 H LEU B 71 3.660 -1.179 0.041 1.00 0.00 H new ATOM 0 HA LEU B 71 5.660 -2.612 -1.611 1.00 0.00 H new ATOM 0 HB2 LEU B 71 6.158 -0.396 0.034 1.00 0.00 H new ATOM 0 HB3 LEU B 71 6.596 -1.777 1.019 1.00 0.00 H new ATOM 0 HG LEU B 71 8.090 -2.578 -0.802 1.00 0.00 H new ATOM 0 HD11 LEU B 71 8.676 -1.037 -2.630 1.00 0.00 H new ATOM 0 HD12 LEU B 71 6.969 -1.534 -2.706 1.00 0.00 H new ATOM 0 HD13 LEU B 71 7.400 0.080 -2.093 1.00 0.00 H new ATOM 0 HD21 LEU B 71 9.829 -0.853 -0.457 1.00 0.00 H new ATOM 0 HD22 LEU B 71 8.591 0.262 0.166 1.00 0.00 H new ATOM 0 HD23 LEU B 71 8.970 -1.232 1.055 1.00 0.00 H new ATOM 2330 N LEU B 72 5.439 -4.621 -0.142 1.00 0.00 N ATOM 2331 CA LEU B 72 5.149 -5.829 0.617 1.00 0.00 C ATOM 2332 C LEU B 72 6.421 -6.554 1.031 1.00 0.00 C ATOM 2333 O LEU B 72 7.339 -6.729 0.228 1.00 0.00 O ATOM 2334 CB LEU B 72 4.264 -6.763 -0.206 1.00 0.00 C ATOM 2335 CG LEU B 72 2.886 -6.207 -0.551 1.00 0.00 C ATOM 2336 CD1 LEU B 72 2.653 -6.246 -2.053 1.00 0.00 C ATOM 2337 CD2 LEU B 72 1.804 -6.983 0.185 1.00 0.00 C ATOM 0 H LEU B 72 6.017 -4.767 -0.970 1.00 0.00 H new ATOM 0 HA LEU B 72 4.624 -5.532 1.525 1.00 0.00 H new ATOM 0 HB2 LEU B 72 4.783 -7.008 -1.133 1.00 0.00 H new ATOM 0 HB3 LEU B 72 4.136 -7.696 0.344 1.00 0.00 H new ATOM 0 HG LEU B 72 2.841 -5.166 -0.230 1.00 0.00 H new ATOM 0 HD11 LEU B 72 1.665 -5.845 -2.278 1.00 0.00 H new ATOM 0 HD12 LEU B 72 3.411 -5.645 -2.555 1.00 0.00 H new ATOM 0 HD13 LEU B 72 2.716 -7.276 -2.404 1.00 0.00 H new ATOM 0 HD21 LEU B 72 0.826 -6.575 -0.071 1.00 0.00 H new ATOM 0 HD22 LEU B 72 1.847 -8.033 -0.106 1.00 0.00 H new ATOM 0 HD23 LEU B 72 1.963 -6.898 1.260 1.00 0.00 H new ATOM 2349 N ILE B 73 6.463 -6.977 2.289 1.00 0.00 N ATOM 2350 CA ILE B 73 7.610 -7.701 2.823 1.00 0.00 C ATOM 2351 C ILE B 73 7.274 -9.183 2.938 1.00 0.00 C ATOM 2352 O ILE B 73 6.416 -9.574 3.733 1.00 0.00 O ATOM 2353 CB ILE B 73 8.030 -7.165 4.210 1.00 0.00 C ATOM 2354 CG1 ILE B 73 8.235 -5.648 4.162 1.00 0.00 C ATOM 2355 CG2 ILE B 73 9.297 -7.861 4.694 1.00 0.00 C ATOM 2356 CD1 ILE B 73 9.410 -5.202 3.316 1.00 0.00 C ATOM 0 H ILE B 73 5.711 -6.830 2.962 1.00 0.00 H new ATOM 0 HA ILE B 73 8.443 -7.555 2.136 1.00 0.00 H new ATOM 0 HB ILE B 73 7.229 -7.381 4.917 1.00 0.00 H new ATOM 0 HG12 ILE B 73 7.328 -5.183 3.776 1.00 0.00 H new ATOM 0 HG13 ILE B 73 8.374 -5.280 5.179 1.00 0.00 H new ATOM 0 HG21 ILE B 73 9.576 -7.469 5.672 1.00 0.00 H new ATOM 0 HG22 ILE B 73 9.117 -8.933 4.770 1.00 0.00 H new ATOM 0 HG23 ILE B 73 10.105 -7.679 3.986 1.00 0.00 H new ATOM 0 HD11 ILE B 73 9.482 -4.115 3.338 1.00 0.00 H new ATOM 0 HD12 ILE B 73 10.329 -5.634 3.712 1.00 0.00 H new ATOM 0 HD13 ILE B 73 9.266 -5.536 2.288 1.00 0.00 H new ATOM 2368 N ARG B 74 7.924 -9.999 2.123 1.00 0.00 N ATOM 2369 CA ARG B 74 7.691 -11.437 2.135 1.00 0.00 C ATOM 2370 C ARG B 74 9.020 -12.183 2.162 1.00 0.00 C ATOM 2371 O ARG B 74 10.066 -11.603 2.463 1.00 0.00 O ATOM 2372 CB ARG B 74 6.862 -11.867 0.912 1.00 0.00 C ATOM 2373 CG ARG B 74 5.707 -10.930 0.591 1.00 0.00 C ATOM 2374 CD ARG B 74 4.800 -11.488 -0.500 1.00 0.00 C ATOM 2375 NE ARG B 74 3.741 -12.331 0.046 1.00 0.00 N ATOM 2376 CZ ARG B 74 2.584 -11.862 0.527 1.00 0.00 C ATOM 2377 NH1 ARG B 74 2.324 -10.561 0.501 1.00 0.00 N ATOM 2378 NH2 ARG B 74 1.680 -12.695 1.020 1.00 0.00 N ATOM 0 H ARG B 74 8.619 -9.690 1.443 1.00 0.00 H new ATOM 0 HA ARG B 74 7.127 -11.687 3.034 1.00 0.00 H new ATOM 0 HB2 ARG B 74 7.518 -11.930 0.044 1.00 0.00 H new ATOM 0 HB3 ARG B 74 6.467 -12.868 1.086 1.00 0.00 H new ATOM 0 HG2 ARG B 74 5.122 -10.755 1.494 1.00 0.00 H new ATOM 0 HG3 ARG B 74 6.102 -9.964 0.275 1.00 0.00 H new ATOM 0 HD2 ARG B 74 4.356 -10.664 -1.058 1.00 0.00 H new ATOM 0 HD3 ARG B 74 5.396 -12.067 -1.206 1.00 0.00 H new ATOM 0 HE ARG B 74 3.892 -13.340 0.062 1.00 0.00 H new ATOM 0 HH11 ARG B 74 3.008 -9.912 0.113 1.00 0.00 H new ATOM 0 HH12 ARG B 74 1.440 -10.210 0.869 1.00 0.00 H new ATOM 0 HH21 ARG B 74 1.865 -13.698 1.034 1.00 0.00 H new ATOM 0 HH22 ARG B 74 0.799 -12.333 1.386 1.00 0.00 H new ATOM 2392 N GLY B 75 8.976 -13.468 1.850 1.00 0.00 N ATOM 2393 CA GLY B 75 10.179 -14.266 1.838 1.00 0.00 C ATOM 2394 C GLY B 75 10.285 -15.177 3.042 1.00 0.00 C ATOM 2395 O GLY B 75 9.386 -15.982 3.302 1.00 0.00 O ATOM 0 H GLY B 75 8.124 -13.973 1.604 1.00 0.00 H new ATOM 0 HA2 GLY B 75 10.203 -14.867 0.929 1.00 0.00 H new ATOM 0 HA3 GLY B 75 11.047 -13.608 1.808 1.00 0.00 H new ATOM 2399 N LYS B 76 11.388 -15.039 3.775 1.00 0.00 N ATOM 2400 CA LYS B 76 11.660 -15.842 4.967 1.00 0.00 C ATOM 2401 C LYS B 76 11.866 -17.309 4.597 1.00 0.00 C ATOM 2402 O LYS B 76 12.949 -17.694 4.155 1.00 0.00 O ATOM 2403 CB LYS B 76 10.543 -15.696 6.014 1.00 0.00 C ATOM 2404 CG LYS B 76 10.587 -14.393 6.805 1.00 0.00 C ATOM 2405 CD LYS B 76 11.873 -14.261 7.616 1.00 0.00 C ATOM 2406 CE LYS B 76 11.934 -15.259 8.772 1.00 0.00 C ATOM 2407 NZ LYS B 76 13.270 -15.266 9.427 1.00 0.00 N ATOM 0 H LYS B 76 12.122 -14.364 3.558 1.00 0.00 H new ATOM 0 HA LYS B 76 12.581 -15.467 5.413 1.00 0.00 H new ATOM 0 HB2 LYS B 76 9.579 -15.769 5.511 1.00 0.00 H new ATOM 0 HB3 LYS B 76 10.603 -16.532 6.711 1.00 0.00 H new ATOM 0 HG2 LYS B 76 10.502 -13.550 6.120 1.00 0.00 H new ATOM 0 HG3 LYS B 76 9.729 -14.347 7.476 1.00 0.00 H new ATOM 0 HD2 LYS B 76 12.731 -14.414 6.961 1.00 0.00 H new ATOM 0 HD3 LYS B 76 11.950 -13.247 8.009 1.00 0.00 H new ATOM 0 HE2 LYS B 76 11.170 -15.010 9.508 1.00 0.00 H new ATOM 0 HE3 LYS B 76 11.706 -16.258 8.402 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 13.271 -15.955 10.206 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 13.997 -15.529 8.731 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 13.477 -14.319 9.803 1.00 0.00 H new ATOM 2421 N ILE B 77 10.835 -18.125 4.759 1.00 0.00 N ATOM 2422 CA ILE B 77 10.938 -19.543 4.439 1.00 0.00 C ATOM 2423 C ILE B 77 9.751 -19.996 3.593 1.00 0.00 C ATOM 2424 O ILE B 77 9.924 -20.571 2.519 1.00 0.00 O ATOM 2425 CB ILE B 77 11.008 -20.421 5.713 1.00 0.00 C ATOM 2426 CG1 ILE B 77 12.009 -19.849 6.724 1.00 0.00 C ATOM 2427 CG2 ILE B 77 11.396 -21.847 5.346 1.00 0.00 C ATOM 2428 CD1 ILE B 77 11.350 -19.179 7.911 1.00 0.00 C ATOM 0 H ILE B 77 9.922 -17.833 5.108 1.00 0.00 H new ATOM 0 HA ILE B 77 11.863 -19.669 3.877 1.00 0.00 H new ATOM 0 HB ILE B 77 10.021 -20.425 6.176 1.00 0.00 H new ATOM 0 HG12 ILE B 77 12.652 -20.653 7.081 1.00 0.00 H new ATOM 0 HG13 ILE B 77 12.651 -19.127 6.219 1.00 0.00 H new ATOM 0 HG21 ILE B 77 11.442 -22.455 6.249 1.00 0.00 H new ATOM 0 HG22 ILE B 77 10.652 -22.263 4.666 1.00 0.00 H new ATOM 0 HG23 ILE B 77 12.371 -21.845 4.860 1.00 0.00 H new ATOM 0 HD11 ILE B 77 12.117 -18.797 8.585 1.00 0.00 H new ATOM 0 HD12 ILE B 77 10.728 -18.354 7.564 1.00 0.00 H new ATOM 0 HD13 ILE B 77 10.730 -19.903 8.439 1.00 0.00 H new ATOM 2440 N SER B 78 8.549 -19.711 4.069 1.00 0.00 N ATOM 2441 CA SER B 78 7.333 -20.096 3.365 1.00 0.00 C ATOM 2442 C SER B 78 6.981 -19.077 2.277 1.00 0.00 C ATOM 2443 O SER B 78 5.930 -18.436 2.332 1.00 0.00 O ATOM 2444 CB SER B 78 6.181 -20.219 4.365 1.00 0.00 C ATOM 2445 OG SER B 78 6.628 -20.793 5.587 1.00 0.00 O ATOM 0 H SER B 78 8.388 -19.212 4.944 1.00 0.00 H new ATOM 0 HA SER B 78 7.501 -21.059 2.882 1.00 0.00 H new ATOM 0 HB2 SER B 78 5.753 -19.235 4.556 1.00 0.00 H new ATOM 0 HB3 SER B 78 5.388 -20.834 3.939 1.00 0.00 H new ATOM 0 HG SER B 78 5.876 -20.860 6.211 1.00 0.00 H new ATOM 2451 N ASN B 79 7.869 -18.921 1.301 1.00 0.00 N ATOM 2452 CA ASN B 79 7.644 -17.985 0.202 1.00 0.00 C ATOM 2453 C ASN B 79 8.696 -18.158 -0.883 1.00 0.00 C ATOM 2454 O ASN B 79 8.393 -18.587 -1.994 1.00 0.00 O ATOM 2455 CB ASN B 79 7.658 -16.534 0.695 1.00 0.00 C ATOM 2456 CG ASN B 79 7.326 -15.540 -0.402 1.00 0.00 C ATOM 2457 OD1 ASN B 79 6.166 -15.192 -0.604 1.00 0.00 O ATOM 2458 ND2 ASN B 79 8.339 -15.075 -1.115 1.00 0.00 N ATOM 0 H ASN B 79 8.751 -19.430 1.247 1.00 0.00 H new ATOM 0 HA ASN B 79 6.661 -18.206 -0.213 1.00 0.00 H new ATOM 0 HB2 ASN B 79 6.941 -16.424 1.509 1.00 0.00 H new ATOM 0 HB3 ASN B 79 8.642 -16.303 1.104 1.00 0.00 H new ATOM 0 HD21 ASN B 79 8.170 -14.403 -1.863 1.00 0.00 H new ATOM 0 HD22 ASN B 79 9.289 -15.389 -0.916 1.00 0.00 H new ATOM 2465 N SER B 80 9.934 -17.822 -0.554 1.00 0.00 N ATOM 2466 CA SER B 80 11.034 -17.921 -1.501 1.00 0.00 C ATOM 2467 C SER B 80 11.843 -19.190 -1.254 1.00 0.00 C ATOM 2468 O SER B 80 12.029 -19.555 -0.073 1.00 0.00 O ATOM 2469 CB SER B 80 11.923 -16.682 -1.381 1.00 0.00 C ATOM 2470 OG SER B 80 11.180 -15.591 -0.865 1.00 0.00 O ATOM 0 H SER B 80 10.203 -17.476 0.367 1.00 0.00 H new ATOM 0 HA SER B 80 10.631 -17.973 -2.512 1.00 0.00 H new ATOM 0 HB2 SER B 80 12.769 -16.895 -0.728 1.00 0.00 H new ATOM 0 HB3 SER B 80 12.331 -16.423 -2.358 1.00 0.00 H new ATOM 0 HG SER B 80 11.763 -15.030 -0.312 1.00 0.00 H new TER 2476 SER B 80