USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 586 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 55 THR OG1 : rot -72:sc= 1.02 USER MOD Set 1.2: A 57 SER OG : rot -85:sc= 0.213 USER MOD Set 2.1: A 22 THR OG1 : rot -57:sc= 0.673 USER MOD Set 2.2: A 25 ASN : amide:sc= 0.574 K(o=1.2,f=-2!) USER MOD Set 3.1: A 7 THR OG1 : rot -83:sc= 0.833 USER MOD Set 3.2: A 9 THR OG1 : rot 180:sc= 0.0101 USER MOD Single : A 1 MET CE :methyl 168:sc= -0.118 (180deg=-0.19) USER MOD Single : A 1 MET N :NH3+ 178:sc= 1.83 (180deg=1.82) USER MOD Single : A 2 GLN : amide:sc= -0.417 K(o=-0.42,f=-1.3) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 178:sc= 1.13 (180deg=0.993) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -49:sc= 1.02 USER MOD Single : A 27 LYS NZ :NH3+ -163:sc= 2.31 (180deg=1.69) USER MOD Single : A 29 LYS NZ :NH3+ -127:sc= 1.21 (180deg=0.484) USER MOD Single : A 31 GLN : amide:sc= -0.0454 K(o=-0.045,f=-0.83) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.149 K(o=-0.15,f=-1.1) USER MOD Single : A 41 GLN : amide:sc= 1.64 K(o=1.6,f=-1.6) 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=-0.025) USER MOD Single : A 59 TYR OH : rot 165:sc= 0.0197 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=-0.0084) USER MOD Single : A 62 GLN : amide:sc= -0.251 X(o=-0.25,f=-0.00042) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 105:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.0153 X(o=-0.015,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.942 31.479 15.955 1.00 0.00 N ATOM 2 CA MET A 1 13.825 31.143 17.392 1.00 0.00 C ATOM 3 C MET A 1 15.158 31.391 18.103 1.00 0.00 C ATOM 4 O MET A 1 16.199 30.937 17.620 1.00 0.00 O ATOM 5 CB MET A 1 13.621 29.624 17.517 1.00 0.00 C ATOM 6 CG MET A 1 13.223 29.266 18.947 1.00 0.00 C ATOM 7 SD MET A 1 12.828 27.517 19.145 1.00 0.00 S ATOM 8 CE MET A 1 14.552 27.031 19.397 1.00 0.00 C ATOM 0 H1 MET A 1 13.042 31.275 15.476 1.00 0.00 H new ATOM 0 H2 MET A 1 14.168 32.489 15.852 1.00 0.00 H new ATOM 0 H3 MET A 1 14.699 30.910 15.526 1.00 0.00 H new ATOM 0 HA MET A 1 13.014 31.737 17.814 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.848 29.294 16.822 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.538 29.102 17.245 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.037 29.529 19.623 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.360 29.864 19.240 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.591 26.004 19.759 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.092 27.104 18.453 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.013 27.692 20.131 1.00 0.00 H new ATOM 20 N GLN A 2 15.199 32.122 19.211 1.00 0.00 N ATOM 21 CA GLN A 2 16.433 32.358 19.936 1.00 0.00 C ATOM 22 C GLN A 2 16.891 31.252 20.881 1.00 0.00 C ATOM 23 O GLN A 2 16.057 30.497 21.380 1.00 0.00 O ATOM 24 CB GLN A 2 16.230 33.607 20.787 1.00 0.00 C ATOM 25 CG GLN A 2 15.425 33.648 22.078 1.00 0.00 C ATOM 26 CD GLN A 2 15.645 34.896 22.926 1.00 0.00 C ATOM 27 OE1 GLN A 2 15.419 34.961 24.138 1.00 0.00 O ATOM 28 NE2 GLN A 2 16.111 35.999 22.343 1.00 0.00 N ATOM 0 H GLN A 2 14.379 32.564 19.627 1.00 0.00 H new ATOM 0 HA GLN A 2 17.205 32.436 19.170 1.00 0.00 H new ATOM 0 HB2 GLN A 2 17.228 33.964 21.042 1.00 0.00 H new ATOM 0 HB3 GLN A 2 15.783 34.352 20.129 1.00 0.00 H new ATOM 0 HG2 GLN A 2 14.366 33.574 21.832 1.00 0.00 H new ATOM 0 HG3 GLN A 2 15.676 32.771 22.675 1.00 0.00 H new ATOM 0 HE21 GLN A 2 16.315 36.000 21.344 1.00 0.00 H new ATOM 0 HE22 GLN A 2 16.264 36.842 22.896 1.00 0.00 H new ATOM 37 N ILE A 3 18.204 31.317 21.097 1.00 0.00 N ATOM 38 CA ILE A 3 19.005 30.526 22.017 1.00 0.00 C ATOM 39 C ILE A 3 20.115 31.453 22.511 1.00 0.00 C ATOM 40 O ILE A 3 20.271 32.564 22.006 1.00 0.00 O ATOM 41 CB ILE A 3 19.512 29.209 21.437 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.628 29.355 20.404 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.358 28.236 21.193 1.00 0.00 C ATOM 44 CD1 ILE A 3 21.139 28.062 19.785 1.00 0.00 C ATOM 0 H ILE A 3 18.781 31.985 20.585 1.00 0.00 H new ATOM 0 HA ILE A 3 18.392 30.179 22.849 1.00 0.00 H new ATOM 0 HB ILE A 3 20.099 28.678 22.187 1.00 0.00 H new ATOM 0 HG12 ILE A 3 20.271 30.002 19.602 1.00 0.00 H new ATOM 0 HG13 ILE A 3 21.468 29.865 20.876 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.748 27.306 20.780 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.851 28.030 22.135 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.652 28.678 20.490 1.00 0.00 H new ATOM 0 HD11 ILE A 3 21.928 28.289 19.068 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.535 27.415 20.568 1.00 0.00 H new ATOM 0 HD13 ILE A 3 20.320 27.554 19.275 1.00 0.00 H new ATOM 56 N PHE A 4 20.936 31.016 23.458 1.00 0.00 N ATOM 57 CA PHE A 4 22.202 31.665 23.751 1.00 0.00 C ATOM 58 C PHE A 4 23.328 30.630 23.812 1.00 0.00 C ATOM 59 O PHE A 4 23.003 29.455 23.990 1.00 0.00 O ATOM 60 CB PHE A 4 22.111 32.338 25.123 1.00 0.00 C ATOM 61 CG PHE A 4 21.108 33.472 25.144 1.00 0.00 C ATOM 62 CD1 PHE A 4 21.543 34.745 24.777 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.793 33.260 25.600 1.00 0.00 C ATOM 64 CE1 PHE A 4 20.643 35.813 24.887 1.00 0.00 C ATOM 65 CE2 PHE A 4 18.894 34.326 25.730 1.00 0.00 C ATOM 66 CZ PHE A 4 19.317 35.576 25.262 1.00 0.00 C ATOM 0 H PHE A 4 20.741 30.203 24.042 1.00 0.00 H new ATOM 0 HA PHE A 4 22.410 32.394 22.968 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.832 31.596 25.871 1.00 0.00 H new ATOM 0 HB3 PHE A 4 23.093 32.720 25.403 1.00 0.00 H new ATOM 0 HD1 PHE A 4 22.549 34.904 24.417 1.00 0.00 H new ATOM 0 HD2 PHE A 4 19.473 32.260 25.853 1.00 0.00 H new ATOM 0 HE1 PHE A 4 20.974 36.820 24.682 1.00 0.00 H new ATOM 0 HE2 PHE A 4 17.918 34.190 26.172 1.00 0.00 H new ATOM 0 HZ PHE A 4 18.599 36.379 25.189 1.00 0.00 H new ATOM 76 N VAL A 5 24.554 31.059 23.528 1.00 0.00 N ATOM 77 CA VAL A 5 25.713 30.209 23.721 1.00 0.00 C ATOM 78 C VAL A 5 26.646 31.131 24.515 1.00 0.00 C ATOM 79 O VAL A 5 27.032 32.177 24.023 1.00 0.00 O ATOM 80 CB VAL A 5 26.203 29.816 22.339 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.629 29.252 22.249 1.00 0.00 C ATOM 82 CG2 VAL A 5 25.166 29.012 21.549 1.00 0.00 C ATOM 0 H VAL A 5 24.765 31.988 23.165 1.00 0.00 H new ATOM 0 HA VAL A 5 25.579 29.268 24.254 1.00 0.00 H new ATOM 0 HB VAL A 5 26.311 30.774 21.831 1.00 0.00 H new ATOM 0 HG11 VAL A 5 27.860 29.010 21.212 1.00 0.00 H new ATOM 0 HG12 VAL A 5 28.338 29.995 22.615 1.00 0.00 H new ATOM 0 HG13 VAL A 5 27.703 28.350 22.857 1.00 0.00 H new ATOM 0 HG21 VAL A 5 25.571 28.759 20.569 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.926 28.097 22.090 1.00 0.00 H new ATOM 0 HG23 VAL A 5 24.262 29.608 21.425 1.00 0.00 H new ATOM 92 N LYS A 6 26.928 30.757 25.767 1.00 0.00 N ATOM 93 CA LYS A 6 27.861 31.386 26.679 1.00 0.00 C ATOM 94 C LYS A 6 29.246 30.873 26.294 1.00 0.00 C ATOM 95 O LYS A 6 29.439 29.685 26.032 1.00 0.00 O ATOM 96 CB LYS A 6 27.449 30.968 28.086 1.00 0.00 C ATOM 97 CG LYS A 6 27.955 31.808 29.268 1.00 0.00 C ATOM 98 CD LYS A 6 26.998 31.658 30.453 1.00 0.00 C ATOM 99 CE LYS A 6 27.738 31.776 31.778 1.00 0.00 C ATOM 100 NZ LYS A 6 26.925 31.862 33.003 1.00 0.00 N ATOM 0 H LYS A 6 26.473 29.948 26.190 1.00 0.00 H new ATOM 0 HA LYS A 6 27.868 32.475 26.636 1.00 0.00 H new ATOM 0 HB2 LYS A 6 26.360 30.959 28.126 1.00 0.00 H new ATOM 0 HB3 LYS A 6 27.782 29.942 28.240 1.00 0.00 H new ATOM 0 HG2 LYS A 6 28.956 31.486 29.554 1.00 0.00 H new ATOM 0 HG3 LYS A 6 28.028 32.856 28.977 1.00 0.00 H new ATOM 0 HD2 LYS A 6 26.223 32.423 30.397 1.00 0.00 H new ATOM 0 HD3 LYS A 6 26.497 30.692 30.399 1.00 0.00 H new ATOM 0 HE2 LYS A 6 28.399 30.915 31.872 1.00 0.00 H new ATOM 0 HE3 LYS A 6 28.372 32.661 31.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 27.551 31.938 33.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 26.312 32.700 32.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 26.338 31.008 33.091 1.00 0.00 H new ATOM 114 N THR A 7 30.211 31.782 26.202 1.00 0.00 N ATOM 115 CA THR A 7 31.651 31.611 26.151 1.00 0.00 C ATOM 116 C THR A 7 32.228 31.261 27.519 1.00 0.00 C ATOM 117 O THR A 7 31.563 31.391 28.550 1.00 0.00 O ATOM 118 CB THR A 7 32.280 32.923 25.706 1.00 0.00 C ATOM 119 OG1 THR A 7 32.032 33.971 26.613 1.00 0.00 O ATOM 120 CG2 THR A 7 31.884 33.250 24.266 1.00 0.00 C ATOM 0 H THR A 7 29.968 32.772 26.156 1.00 0.00 H new ATOM 0 HA THR A 7 31.868 30.798 25.458 1.00 0.00 H new ATOM 0 HB THR A 7 33.363 32.801 25.713 1.00 0.00 H new ATOM 0 HG1 THR A 7 31.152 34.362 26.429 1.00 0.00 H new ATOM 0 HG21 THR A 7 32.344 34.192 23.967 1.00 0.00 H new ATOM 0 HG22 THR A 7 32.225 32.453 23.605 1.00 0.00 H new ATOM 0 HG23 THR A 7 30.800 33.338 24.198 1.00 0.00 H new ATOM 128 N LEU A 8 33.528 30.979 27.639 1.00 0.00 N ATOM 129 CA LEU A 8 34.251 30.789 28.871 1.00 0.00 C ATOM 130 C LEU A 8 34.819 32.117 29.374 1.00 0.00 C ATOM 131 O LEU A 8 35.315 32.102 30.502 1.00 0.00 O ATOM 132 CB LEU A 8 35.372 29.809 28.514 1.00 0.00 C ATOM 133 CG LEU A 8 36.271 30.105 27.314 1.00 0.00 C ATOM 134 CD1 LEU A 8 37.740 30.201 27.734 1.00 0.00 C ATOM 135 CD2 LEU A 8 36.052 29.146 26.147 1.00 0.00 C ATOM 0 H LEU A 8 34.128 30.874 26.821 1.00 0.00 H new ATOM 0 HA LEU A 8 33.616 30.409 29.672 1.00 0.00 H new ATOM 0 HB2 LEU A 8 36.015 29.714 29.389 1.00 0.00 H new ATOM 0 HB3 LEU A 8 34.914 28.834 28.347 1.00 0.00 H new ATOM 0 HG LEU A 8 35.977 31.083 26.934 1.00 0.00 H new ATOM 0 HD11 LEU A 8 38.355 30.412 26.859 1.00 0.00 H new ATOM 0 HD12 LEU A 8 37.858 31.003 28.463 1.00 0.00 H new ATOM 0 HD13 LEU A 8 38.054 29.257 28.179 1.00 0.00 H new ATOM 0 HD21 LEU A 8 36.721 29.411 25.328 1.00 0.00 H new ATOM 0 HD22 LEU A 8 36.260 28.126 26.470 1.00 0.00 H new ATOM 0 HD23 LEU A 8 35.018 29.215 25.808 1.00 0.00 H new ATOM 147 N THR A 9 34.765 33.197 28.587 1.00 0.00 N ATOM 148 CA THR A 9 35.294 34.477 28.998 1.00 0.00 C ATOM 149 C THR A 9 34.196 35.408 29.500 1.00 0.00 C ATOM 150 O THR A 9 34.549 36.492 29.956 1.00 0.00 O ATOM 151 CB THR A 9 35.953 35.169 27.800 1.00 0.00 C ATOM 152 OG1 THR A 9 35.086 35.180 26.693 1.00 0.00 O ATOM 153 CG2 THR A 9 37.145 34.429 27.197 1.00 0.00 C ATOM 0 H THR A 9 34.353 33.196 27.654 1.00 0.00 H new ATOM 0 HA THR A 9 36.008 34.285 29.799 1.00 0.00 H new ATOM 0 HB THR A 9 36.230 36.137 28.217 1.00 0.00 H new ATOM 0 HG1 THR A 9 35.524 35.627 25.939 1.00 0.00 H new ATOM 0 HG21 THR A 9 37.540 35.000 26.356 1.00 0.00 H new ATOM 0 HG22 THR A 9 37.921 34.312 27.953 1.00 0.00 H new ATOM 0 HG23 THR A 9 36.826 33.446 26.850 1.00 0.00 H new ATOM 161 N GLY A 10 32.981 34.887 29.566 1.00 0.00 N ATOM 162 CA GLY A 10 31.799 35.271 30.322 1.00 0.00 C ATOM 163 C GLY A 10 30.658 35.592 29.353 1.00 0.00 C ATOM 164 O GLY A 10 29.512 35.376 29.740 1.00 0.00 O ATOM 0 H GLY A 10 32.773 34.061 29.005 1.00 0.00 H new ATOM 0 HA2 GLY A 10 31.505 34.464 30.993 1.00 0.00 H new ATOM 0 HA3 GLY A 10 32.018 36.139 30.944 1.00 0.00 H new ATOM 168 N LYS A 11 30.979 35.985 28.121 1.00 0.00 N ATOM 169 CA LYS A 11 30.156 36.818 27.275 1.00 0.00 C ATOM 170 C LYS A 11 29.155 35.845 26.631 1.00 0.00 C ATOM 171 O LYS A 11 29.508 34.762 26.177 1.00 0.00 O ATOM 172 CB LYS A 11 31.027 37.587 26.293 1.00 0.00 C ATOM 173 CG LYS A 11 31.943 36.770 25.387 1.00 0.00 C ATOM 174 CD LYS A 11 32.604 37.663 24.326 1.00 0.00 C ATOM 175 CE LYS A 11 32.896 37.074 22.949 1.00 0.00 C ATOM 176 NZ LYS A 11 33.330 38.020 21.903 1.00 0.00 N ATOM 0 H LYS A 11 31.857 35.716 27.676 1.00 0.00 H new ATOM 0 HA LYS A 11 29.611 37.599 27.806 1.00 0.00 H new ATOM 0 HB2 LYS A 11 30.374 38.187 25.660 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.646 38.281 26.862 1.00 0.00 H new ATOM 0 HG2 LYS A 11 32.711 36.281 25.986 1.00 0.00 H new ATOM 0 HG3 LYS A 11 31.369 35.982 24.899 1.00 0.00 H new ATOM 0 HD2 LYS A 11 31.965 38.535 24.184 1.00 0.00 H new ATOM 0 HD3 LYS A 11 33.547 38.023 24.738 1.00 0.00 H new ATOM 0 HE2 LYS A 11 33.668 36.313 23.061 1.00 0.00 H new ATOM 0 HE3 LYS A 11 31.997 36.567 22.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 33.530 37.499 21.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 32.576 38.715 21.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 34.190 38.513 22.216 1.00 0.00 H new ATOM 190 N THR A 12 27.880 36.212 26.617 1.00 0.00 N ATOM 191 CA THR A 12 26.771 35.439 26.095 1.00 0.00 C ATOM 192 C THR A 12 26.384 35.776 24.656 1.00 0.00 C ATOM 193 O THR A 12 25.907 36.858 24.343 1.00 0.00 O ATOM 194 CB THR A 12 25.565 35.584 27.025 1.00 0.00 C ATOM 195 OG1 THR A 12 25.988 35.322 28.348 1.00 0.00 O ATOM 196 CG2 THR A 12 24.552 34.454 26.802 1.00 0.00 C ATOM 0 H THR A 12 27.579 37.111 26.993 1.00 0.00 H new ATOM 0 HA THR A 12 27.108 34.403 26.063 1.00 0.00 H new ATOM 0 HB THR A 12 25.149 36.575 26.847 1.00 0.00 H new ATOM 0 HG1 THR A 12 25.227 35.412 28.959 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.707 34.585 27.477 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.200 34.479 25.771 1.00 0.00 H new ATOM 0 HG23 THR A 12 25.029 33.494 26.999 1.00 0.00 H new ATOM 204 N ILE A 13 26.620 34.883 23.700 1.00 0.00 N ATOM 205 CA ILE A 13 26.368 35.113 22.285 1.00 0.00 C ATOM 206 C ILE A 13 24.897 34.777 22.067 1.00 0.00 C ATOM 207 O ILE A 13 24.426 33.646 22.247 1.00 0.00 O ATOM 208 CB ILE A 13 27.235 34.206 21.406 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.723 34.428 21.684 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.926 34.385 19.919 1.00 0.00 C ATOM 211 CD1 ILE A 13 29.527 33.132 21.511 1.00 0.00 C ATOM 0 H ILE A 13 27.001 33.957 23.895 1.00 0.00 H new ATOM 0 HA ILE A 13 26.607 36.141 22.014 1.00 0.00 H new ATOM 0 HB ILE A 13 26.989 33.177 21.667 1.00 0.00 H new ATOM 0 HG12 ILE A 13 29.111 35.191 21.009 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.852 34.805 22.698 1.00 0.00 H new ATOM 0 HG21 ILE A 13 27.563 33.723 19.333 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.880 34.141 19.733 1.00 0.00 H new ATOM 0 HG23 ILE A 13 27.114 35.419 19.630 1.00 0.00 H new ATOM 0 HD11 ILE A 13 30.580 33.327 21.716 1.00 0.00 H new ATOM 0 HD12 ILE A 13 29.155 32.378 22.205 1.00 0.00 H new ATOM 0 HD13 ILE A 13 29.418 32.770 20.489 1.00 0.00 H new ATOM 223 N THR A 14 24.033 35.665 21.600 1.00 0.00 N ATOM 224 CA THR A 14 22.630 35.550 21.245 1.00 0.00 C ATOM 225 C THR A 14 22.662 34.859 19.884 1.00 0.00 C ATOM 226 O THR A 14 23.242 35.504 19.018 1.00 0.00 O ATOM 227 CB THR A 14 21.854 36.866 21.217 1.00 0.00 C ATOM 228 OG1 THR A 14 22.227 37.753 22.249 1.00 0.00 O ATOM 229 CG2 THR A 14 20.334 36.736 21.128 1.00 0.00 C ATOM 0 H THR A 14 24.350 36.621 21.439 1.00 0.00 H new ATOM 0 HA THR A 14 22.082 34.993 22.005 1.00 0.00 H new ATOM 0 HB THR A 14 22.160 37.303 20.266 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.700 38.576 22.179 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.884 37.729 21.115 1.00 0.00 H new ATOM 0 HG22 THR A 14 20.067 36.204 20.215 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.965 36.182 21.991 1.00 0.00 H new ATOM 237 N LEU A 15 22.083 33.696 19.574 1.00 0.00 N ATOM 238 CA LEU A 15 22.005 33.255 18.199 1.00 0.00 C ATOM 239 C LEU A 15 20.533 32.969 17.874 1.00 0.00 C ATOM 240 O LEU A 15 19.768 32.613 18.762 1.00 0.00 O ATOM 241 CB LEU A 15 22.602 31.883 17.931 1.00 0.00 C ATOM 242 CG LEU A 15 24.089 31.698 18.228 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.446 30.221 18.156 1.00 0.00 C ATOM 244 CD2 LEU A 15 25.069 32.557 17.428 1.00 0.00 C ATOM 0 H LEU A 15 21.670 33.058 20.254 1.00 0.00 H new ATOM 0 HA LEU A 15 22.516 34.037 17.638 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.047 31.152 18.519 1.00 0.00 H new ATOM 0 HB3 LEU A 15 22.435 31.641 16.881 1.00 0.00 H new ATOM 0 HG LEU A 15 24.219 32.079 19.241 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.507 30.092 18.368 1.00 0.00 H new ATOM 0 HD12 LEU A 15 23.860 29.669 18.890 1.00 0.00 H new ATOM 0 HD13 LEU A 15 24.227 29.842 17.158 1.00 0.00 H new ATOM 0 HD21 LEU A 15 26.089 32.328 17.736 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.954 32.345 16.365 1.00 0.00 H new ATOM 0 HD23 LEU A 15 24.863 33.611 17.612 1.00 0.00 H new ATOM 256 N GLU A 16 20.167 33.103 16.599 1.00 0.00 N ATOM 257 CA GLU A 16 18.875 32.754 16.059 1.00 0.00 C ATOM 258 C GLU A 16 19.112 31.381 15.408 1.00 0.00 C ATOM 259 O GLU A 16 20.065 31.149 14.676 1.00 0.00 O ATOM 260 CB GLU A 16 18.418 33.702 14.951 1.00 0.00 C ATOM 261 CG GLU A 16 16.988 33.506 14.450 1.00 0.00 C ATOM 262 CD GLU A 16 15.890 34.146 15.292 1.00 0.00 C ATOM 263 OE1 GLU A 16 16.119 34.998 16.179 1.00 0.00 O ATOM 264 OE2 GLU A 16 14.758 33.628 15.192 1.00 0.00 O ATOM 0 H GLU A 16 20.800 33.476 15.891 1.00 0.00 H new ATOM 0 HA GLU A 16 18.117 32.785 16.841 1.00 0.00 H new ATOM 0 HB2 GLU A 16 18.519 34.726 15.311 1.00 0.00 H new ATOM 0 HB3 GLU A 16 19.096 33.594 14.105 1.00 0.00 H new ATOM 0 HG2 GLU A 16 16.921 33.905 13.438 1.00 0.00 H new ATOM 0 HG3 GLU A 16 16.791 32.436 14.384 1.00 0.00 H new ATOM 271 N VAL A 17 18.197 30.470 15.719 1.00 0.00 N ATOM 272 CA VAL A 17 18.099 29.145 15.120 1.00 0.00 C ATOM 273 C VAL A 17 16.644 29.002 14.665 1.00 0.00 C ATOM 274 O VAL A 17 15.688 29.691 15.000 1.00 0.00 O ATOM 275 CB VAL A 17 18.532 28.118 16.173 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.013 27.747 16.276 1.00 0.00 C ATOM 277 CG2 VAL A 17 17.892 28.323 17.539 1.00 0.00 C ATOM 0 H VAL A 17 17.477 30.641 16.421 1.00 0.00 H new ATOM 0 HA VAL A 17 18.746 28.988 14.257 1.00 0.00 H new ATOM 0 HB VAL A 17 18.108 27.218 15.728 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.149 27.010 17.068 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.350 27.327 15.328 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.596 28.639 16.506 1.00 0.00 H new ATOM 0 HG21 VAL A 17 18.249 27.557 18.227 1.00 0.00 H new ATOM 0 HG22 VAL A 17 18.159 29.308 17.922 1.00 0.00 H new ATOM 0 HG23 VAL A 17 16.808 28.251 17.447 1.00 0.00 H new ATOM 287 N GLU A 18 16.503 27.952 13.859 1.00 0.00 N ATOM 288 CA GLU A 18 15.215 27.288 13.716 1.00 0.00 C ATOM 289 C GLU A 18 15.421 25.839 14.176 1.00 0.00 C ATOM 290 O GLU A 18 16.445 25.250 13.835 1.00 0.00 O ATOM 291 CB GLU A 18 14.917 27.287 12.215 1.00 0.00 C ATOM 292 CG GLU A 18 13.452 27.412 11.812 1.00 0.00 C ATOM 293 CD GLU A 18 12.642 26.159 11.518 1.00 0.00 C ATOM 294 OE1 GLU A 18 13.152 25.078 11.879 1.00 0.00 O ATOM 295 OE2 GLU A 18 11.472 26.358 11.134 1.00 0.00 O ATOM 0 H GLU A 18 17.256 27.548 13.302 1.00 0.00 H new ATOM 0 HA GLU A 18 14.414 27.763 14.282 1.00 0.00 H new ATOM 0 HB2 GLU A 18 15.468 28.109 11.757 1.00 0.00 H new ATOM 0 HB3 GLU A 18 15.310 26.364 11.790 1.00 0.00 H new ATOM 0 HG2 GLU A 18 12.940 27.951 12.609 1.00 0.00 H new ATOM 0 HG3 GLU A 18 13.411 28.042 10.923 1.00 0.00 H new ATOM 302 N PRO A 19 14.487 25.236 14.893 1.00 0.00 N ATOM 303 CA PRO A 19 14.582 23.932 15.521 1.00 0.00 C ATOM 304 C PRO A 19 14.836 22.735 14.602 1.00 0.00 C ATOM 305 O PRO A 19 14.983 21.603 15.059 1.00 0.00 O ATOM 306 CB PRO A 19 13.421 23.805 16.508 1.00 0.00 C ATOM 307 CG PRO A 19 12.318 24.566 15.762 1.00 0.00 C ATOM 308 CD PRO A 19 13.112 25.675 15.081 1.00 0.00 C ATOM 0 HA PRO A 19 15.520 23.884 16.074 1.00 0.00 H new ATOM 0 HB2 PRO A 19 13.151 22.766 16.695 1.00 0.00 H new ATOM 0 HB3 PRO A 19 13.650 24.254 17.474 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.799 23.933 15.042 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.563 24.961 16.441 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.662 25.922 14.119 1.00 0.00 H new ATOM 0 HD3 PRO A 19 13.087 26.581 15.687 1.00 0.00 H new ATOM 316 N SER A 20 14.866 22.928 13.289 1.00 0.00 N ATOM 317 CA SER A 20 15.360 22.042 12.250 1.00 0.00 C ATOM 318 C SER A 20 16.849 22.202 11.931 1.00 0.00 C ATOM 319 O SER A 20 17.287 21.314 11.207 1.00 0.00 O ATOM 320 CB SER A 20 14.530 22.182 10.980 1.00 0.00 C ATOM 321 OG SER A 20 14.360 23.454 10.384 1.00 0.00 O ATOM 0 H SER A 20 14.509 23.796 12.889 1.00 0.00 H new ATOM 0 HA SER A 20 15.251 21.037 12.657 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.974 21.528 10.229 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.536 21.790 11.197 1.00 0.00 H new ATOM 0 HG SER A 20 14.093 24.103 11.068 1.00 0.00 H new ATOM 327 N ASP A 21 17.562 23.179 12.490 1.00 0.00 N ATOM 328 CA ASP A 21 18.973 23.442 12.284 1.00 0.00 C ATOM 329 C ASP A 21 19.736 22.285 12.928 1.00 0.00 C ATOM 330 O ASP A 21 19.349 21.789 13.975 1.00 0.00 O ATOM 331 CB ASP A 21 19.423 24.779 12.875 1.00 0.00 C ATOM 332 CG ASP A 21 19.000 25.979 12.056 1.00 0.00 C ATOM 333 OD1 ASP A 21 18.751 25.921 10.829 1.00 0.00 O ATOM 334 OD2 ASP A 21 18.910 27.046 12.705 1.00 0.00 O ATOM 0 H ASP A 21 17.138 23.844 13.137 1.00 0.00 H new ATOM 0 HA ASP A 21 19.175 23.514 11.215 1.00 0.00 H new ATOM 0 HB2 ASP A 21 19.017 24.876 13.882 1.00 0.00 H new ATOM 0 HB3 ASP A 21 20.509 24.778 12.968 1.00 0.00 H new ATOM 339 N THR A 22 20.800 21.838 12.273 1.00 0.00 N ATOM 340 CA THR A 22 21.746 20.883 12.822 1.00 0.00 C ATOM 341 C THR A 22 22.627 21.575 13.872 1.00 0.00 C ATOM 342 O THR A 22 22.677 22.807 13.824 1.00 0.00 O ATOM 343 CB THR A 22 22.701 20.346 11.755 1.00 0.00 C ATOM 344 OG1 THR A 22 23.527 21.276 11.079 1.00 0.00 O ATOM 345 CG2 THR A 22 21.941 19.382 10.858 1.00 0.00 C ATOM 0 H THR A 22 21.032 22.137 11.326 1.00 0.00 H new ATOM 0 HA THR A 22 21.158 20.068 13.244 1.00 0.00 H new ATOM 0 HB THR A 22 23.482 19.806 12.289 1.00 0.00 H new ATOM 0 HG1 THR A 22 22.969 21.961 10.655 1.00 0.00 H new ATOM 0 HG21 THR A 22 22.612 18.992 10.092 1.00 0.00 H new ATOM 0 HG22 THR A 22 21.554 18.557 11.456 1.00 0.00 H new ATOM 0 HG23 THR A 22 21.112 19.905 10.382 1.00 0.00 H new ATOM 353 N ILE A 23 23.327 20.848 14.733 1.00 0.00 N ATOM 354 CA ILE A 23 24.247 21.432 15.683 1.00 0.00 C ATOM 355 C ILE A 23 25.323 22.160 14.877 1.00 0.00 C ATOM 356 O ILE A 23 25.800 23.251 15.187 1.00 0.00 O ATOM 357 CB ILE A 23 24.777 20.429 16.712 1.00 0.00 C ATOM 358 CG1 ILE A 23 23.658 19.700 17.459 1.00 0.00 C ATOM 359 CG2 ILE A 23 25.727 21.104 17.697 1.00 0.00 C ATOM 360 CD1 ILE A 23 22.689 20.396 18.419 1.00 0.00 C ATOM 0 H ILE A 23 23.268 19.831 14.787 1.00 0.00 H new ATOM 0 HA ILE A 23 23.734 22.154 16.318 1.00 0.00 H new ATOM 0 HB ILE A 23 25.329 19.675 16.151 1.00 0.00 H new ATOM 0 HG12 ILE A 23 23.043 19.219 16.698 1.00 0.00 H new ATOM 0 HG13 ILE A 23 24.138 18.905 18.030 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.088 20.369 18.416 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.573 21.527 17.155 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.200 21.899 18.224 1.00 0.00 H new ATOM 0 HD11 ILE A 23 21.988 19.665 18.822 1.00 0.00 H new ATOM 0 HD12 ILE A 23 23.250 20.850 19.236 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.138 21.169 17.883 1.00 0.00 H new ATOM 372 N GLU A 24 25.724 21.595 13.738 1.00 0.00 N ATOM 373 CA GLU A 24 26.589 22.155 12.720 1.00 0.00 C ATOM 374 C GLU A 24 26.267 23.586 12.305 1.00 0.00 C ATOM 375 O GLU A 24 27.156 24.422 12.130 1.00 0.00 O ATOM 376 CB GLU A 24 26.914 21.143 11.610 1.00 0.00 C ATOM 377 CG GLU A 24 28.357 20.892 11.192 1.00 0.00 C ATOM 378 CD GLU A 24 29.246 20.042 12.093 1.00 0.00 C ATOM 379 OE1 GLU A 24 29.098 19.882 13.324 1.00 0.00 O ATOM 380 OE2 GLU A 24 30.303 19.613 11.581 1.00 0.00 O ATOM 0 H GLU A 24 25.421 20.653 13.491 1.00 0.00 H new ATOM 0 HA GLU A 24 27.556 22.327 13.193 1.00 0.00 H new ATOM 0 HB2 GLU A 24 26.496 20.184 11.916 1.00 0.00 H new ATOM 0 HB3 GLU A 24 26.371 21.457 10.719 1.00 0.00 H new ATOM 0 HG2 GLU A 24 28.339 20.422 10.209 1.00 0.00 H new ATOM 0 HG3 GLU A 24 28.839 21.862 11.073 1.00 0.00 H new ATOM 387 N ASN A 25 24.984 23.858 12.093 1.00 0.00 N ATOM 388 CA ASN A 25 24.390 25.125 11.690 1.00 0.00 C ATOM 389 C ASN A 25 24.540 26.138 12.835 1.00 0.00 C ATOM 390 O ASN A 25 24.979 27.252 12.575 1.00 0.00 O ATOM 391 CB ASN A 25 22.936 25.144 11.238 1.00 0.00 C ATOM 392 CG ASN A 25 22.577 24.601 9.859 1.00 0.00 C ATOM 393 OD1 ASN A 25 22.143 23.461 9.705 1.00 0.00 O ATOM 394 ND2 ASN A 25 22.833 25.346 8.788 1.00 0.00 N ATOM 0 H ASN A 25 24.274 23.135 12.209 1.00 0.00 H new ATOM 0 HA ASN A 25 24.949 25.372 10.787 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.357 24.583 11.972 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.592 26.177 11.283 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.669 24.970 7.854 1.00 0.00 H new ATOM 0 HD22 ASN A 25 23.193 26.294 8.900 1.00 0.00 H new ATOM 401 N VAL A 26 24.479 25.684 14.079 1.00 0.00 N ATOM 402 CA VAL A 26 24.858 26.407 15.269 1.00 0.00 C ATOM 403 C VAL A 26 26.363 26.667 15.359 1.00 0.00 C ATOM 404 O VAL A 26 26.780 27.801 15.554 1.00 0.00 O ATOM 405 CB VAL A 26 24.192 25.782 16.502 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.548 26.419 17.848 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.672 25.733 16.419 1.00 0.00 C ATOM 0 H VAL A 26 24.143 24.744 14.289 1.00 0.00 H new ATOM 0 HA VAL A 26 24.464 27.422 15.217 1.00 0.00 H new ATOM 0 HB VAL A 26 24.613 24.777 16.475 1.00 0.00 H new ATOM 0 HG11 VAL A 26 24.021 25.898 18.648 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.623 26.344 18.013 1.00 0.00 H new ATOM 0 HG13 VAL A 26 24.254 27.468 17.843 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.273 25.279 17.326 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.280 26.745 16.317 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.374 25.140 15.554 1.00 0.00 H new ATOM 417 N LYS A 27 27.180 25.621 15.234 1.00 0.00 N ATOM 418 CA LYS A 27 28.597 25.867 15.127 1.00 0.00 C ATOM 419 C LYS A 27 29.175 26.904 14.151 1.00 0.00 C ATOM 420 O LYS A 27 30.129 27.620 14.426 1.00 0.00 O ATOM 421 CB LYS A 27 29.379 24.572 14.905 1.00 0.00 C ATOM 422 CG LYS A 27 29.285 23.492 15.982 1.00 0.00 C ATOM 423 CD LYS A 27 30.096 22.282 15.514 1.00 0.00 C ATOM 424 CE LYS A 27 29.900 21.062 16.425 1.00 0.00 C ATOM 425 NZ LYS A 27 30.381 19.791 15.859 1.00 0.00 N ATOM 0 H LYS A 27 26.893 24.643 15.206 1.00 0.00 H new ATOM 0 HA LYS A 27 28.728 26.340 16.100 1.00 0.00 H new ATOM 0 HB2 LYS A 27 29.046 24.136 13.963 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.430 24.832 14.782 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.671 23.866 16.930 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.245 23.211 16.150 1.00 0.00 H new ATOM 0 HD2 LYS A 27 29.804 22.023 14.496 1.00 0.00 H new ATOM 0 HD3 LYS A 27 31.153 22.545 15.485 1.00 0.00 H new ATOM 0 HE2 LYS A 27 30.416 21.243 17.368 1.00 0.00 H new ATOM 0 HE3 LYS A 27 28.839 20.964 16.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 29.965 18.997 16.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 30.101 19.728 14.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 31.418 19.749 15.931 1.00 0.00 H new ATOM 439 N ALA A 28 28.613 26.939 12.948 1.00 0.00 N ATOM 440 CA ALA A 28 28.918 27.862 11.878 1.00 0.00 C ATOM 441 C ALA A 28 28.376 29.271 12.146 1.00 0.00 C ATOM 442 O ALA A 28 28.984 30.248 11.696 1.00 0.00 O ATOM 443 CB ALA A 28 28.188 27.500 10.584 1.00 0.00 C ATOM 0 H ALA A 28 27.884 26.276 12.684 1.00 0.00 H new ATOM 0 HA ALA A 28 30.005 27.816 11.806 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.446 28.220 9.807 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.485 26.501 10.266 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.112 27.521 10.755 1.00 0.00 H new ATOM 449 N LYS A 29 27.221 29.386 12.780 1.00 0.00 N ATOM 450 CA LYS A 29 26.640 30.661 13.150 1.00 0.00 C ATOM 451 C LYS A 29 27.413 31.420 14.221 1.00 0.00 C ATOM 452 O LYS A 29 27.386 32.649 14.237 1.00 0.00 O ATOM 453 CB LYS A 29 25.211 30.492 13.666 1.00 0.00 C ATOM 454 CG LYS A 29 24.149 30.449 12.565 1.00 0.00 C ATOM 455 CD LYS A 29 22.696 30.618 12.987 1.00 0.00 C ATOM 456 CE LYS A 29 21.708 30.365 11.846 1.00 0.00 C ATOM 457 NZ LYS A 29 20.366 30.940 12.032 1.00 0.00 N ATOM 0 H LYS A 29 26.654 28.584 13.055 1.00 0.00 H new ATOM 0 HA LYS A 29 26.671 31.240 12.227 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.153 29.572 14.248 1.00 0.00 H new ATOM 0 HB3 LYS A 29 24.982 31.314 14.345 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.383 31.230 11.841 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.240 29.495 12.046 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.479 29.932 13.806 1.00 0.00 H new ATOM 0 HD3 LYS A 29 22.550 31.628 13.369 1.00 0.00 H new ATOM 0 HE2 LYS A 29 22.132 30.766 10.926 1.00 0.00 H new ATOM 0 HE3 LYS A 29 21.607 29.289 11.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 19.649 30.198 11.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.287 31.334 12.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.212 31.695 11.334 1.00 0.00 H new ATOM 471 N ILE A 30 28.082 30.716 15.126 1.00 0.00 N ATOM 472 CA ILE A 30 29.034 31.147 16.142 1.00 0.00 C ATOM 473 C ILE A 30 30.343 31.578 15.472 1.00 0.00 C ATOM 474 O ILE A 30 30.844 32.649 15.809 1.00 0.00 O ATOM 475 CB ILE A 30 29.350 29.922 16.985 1.00 0.00 C ATOM 476 CG1 ILE A 30 28.128 29.587 17.839 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.568 30.028 17.912 1.00 0.00 C ATOM 478 CD1 ILE A 30 28.252 28.239 18.552 1.00 0.00 C ATOM 0 H ILE A 30 27.953 29.705 15.169 1.00 0.00 H new ATOM 0 HA ILE A 30 28.623 31.971 16.725 1.00 0.00 H new ATOM 0 HB ILE A 30 29.603 29.145 16.264 1.00 0.00 H new ATOM 0 HG12 ILE A 30 27.983 30.373 18.580 1.00 0.00 H new ATOM 0 HG13 ILE A 30 27.240 29.578 17.206 1.00 0.00 H new ATOM 0 HG21 ILE A 30 30.691 29.094 18.460 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.462 30.220 17.318 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.418 30.845 18.617 1.00 0.00 H new ATOM 0 HD11 ILE A 30 27.354 28.056 19.143 1.00 0.00 H new ATOM 0 HD12 ILE A 30 28.368 27.446 17.813 1.00 0.00 H new ATOM 0 HD13 ILE A 30 29.122 28.253 19.209 1.00 0.00 H new ATOM 490 N GLN A 31 30.788 30.792 14.504 1.00 0.00 N ATOM 491 CA GLN A 31 31.856 31.125 13.578 1.00 0.00 C ATOM 492 C GLN A 31 31.662 32.474 12.879 1.00 0.00 C ATOM 493 O GLN A 31 32.436 33.429 12.930 1.00 0.00 O ATOM 494 CB GLN A 31 32.210 30.005 12.599 1.00 0.00 C ATOM 495 CG GLN A 31 33.358 30.142 11.594 1.00 0.00 C ATOM 496 CD GLN A 31 33.365 28.972 10.609 1.00 0.00 C ATOM 497 OE1 GLN A 31 32.304 28.508 10.199 1.00 0.00 O ATOM 498 NE2 GLN A 31 34.522 28.392 10.342 1.00 0.00 N ATOM 0 H GLN A 31 30.397 29.865 14.336 1.00 0.00 H new ATOM 0 HA GLN A 31 32.733 31.238 14.216 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.419 29.118 13.197 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.310 29.795 12.022 1.00 0.00 H new ATOM 0 HG2 GLN A 31 33.259 31.081 11.049 1.00 0.00 H new ATOM 0 HG3 GLN A 31 34.309 30.181 12.125 1.00 0.00 H new ATOM 0 HE21 GLN A 31 35.389 28.798 10.694 1.00 0.00 H new ATOM 0 HE22 GLN A 31 34.548 27.539 9.784 1.00 0.00 H new ATOM 507 N ASP A 32 30.507 32.615 12.228 1.00 0.00 N ATOM 508 CA ASP A 32 30.056 33.694 11.371 1.00 0.00 C ATOM 509 C ASP A 32 30.061 35.073 12.050 1.00 0.00 C ATOM 510 O ASP A 32 30.332 36.139 11.514 1.00 0.00 O ATOM 511 CB ASP A 32 28.754 33.222 10.722 1.00 0.00 C ATOM 512 CG ASP A 32 28.015 34.283 9.920 1.00 0.00 C ATOM 513 OD1 ASP A 32 28.534 34.596 8.831 1.00 0.00 O ATOM 514 OD2 ASP A 32 26.964 34.736 10.413 1.00 0.00 O ATOM 0 H ASP A 32 29.791 31.892 12.302 1.00 0.00 H new ATOM 0 HA ASP A 32 30.764 33.899 10.568 1.00 0.00 H new ATOM 0 HB2 ASP A 32 28.977 32.381 10.065 1.00 0.00 H new ATOM 0 HB3 ASP A 32 28.090 32.850 11.503 1.00 0.00 H new ATOM 519 N LYS A 33 29.904 35.026 13.370 1.00 0.00 N ATOM 520 CA LYS A 33 30.034 36.191 14.236 1.00 0.00 C ATOM 521 C LYS A 33 31.426 36.251 14.869 1.00 0.00 C ATOM 522 O LYS A 33 32.166 37.182 14.549 1.00 0.00 O ATOM 523 CB LYS A 33 28.971 36.208 15.329 1.00 0.00 C ATOM 524 CG LYS A 33 27.526 36.141 14.839 1.00 0.00 C ATOM 525 CD LYS A 33 27.000 37.237 13.918 1.00 0.00 C ATOM 526 CE LYS A 33 25.489 37.499 13.989 1.00 0.00 C ATOM 527 NZ LYS A 33 24.991 38.528 13.060 1.00 0.00 N ATOM 0 H LYS A 33 29.680 34.167 13.873 1.00 0.00 H new ATOM 0 HA LYS A 33 29.889 37.069 13.607 1.00 0.00 H new ATOM 0 HB2 LYS A 33 29.149 35.366 15.998 1.00 0.00 H new ATOM 0 HB3 LYS A 33 29.095 37.116 15.919 1.00 0.00 H new ATOM 0 HG2 LYS A 33 27.399 35.190 14.322 1.00 0.00 H new ATOM 0 HG3 LYS A 33 26.882 36.115 15.718 1.00 0.00 H new ATOM 0 HD2 LYS A 33 27.522 38.165 14.153 1.00 0.00 H new ATOM 0 HD3 LYS A 33 27.257 36.977 12.891 1.00 0.00 H new ATOM 0 HE2 LYS A 33 24.964 36.565 13.788 1.00 0.00 H new ATOM 0 HE3 LYS A 33 25.234 37.796 15.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 23.964 38.636 13.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 25.460 39.434 13.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 25.198 38.242 12.082 1.00 0.00 H new ATOM 541 N GLU A 34 31.817 35.335 15.742 1.00 0.00 N ATOM 542 CA GLU A 34 32.972 35.447 16.622 1.00 0.00 C ATOM 543 C GLU A 34 34.247 34.858 16.026 1.00 0.00 C ATOM 544 O GLU A 34 35.372 35.063 16.484 1.00 0.00 O ATOM 545 CB GLU A 34 32.727 34.598 17.866 1.00 0.00 C ATOM 546 CG GLU A 34 31.677 35.132 18.837 1.00 0.00 C ATOM 547 CD GLU A 34 31.963 36.499 19.439 1.00 0.00 C ATOM 548 OE1 GLU A 34 33.140 36.907 19.588 1.00 0.00 O ATOM 549 OE2 GLU A 34 30.997 37.147 19.893 1.00 0.00 O ATOM 0 H GLU A 34 31.316 34.454 15.862 1.00 0.00 H new ATOM 0 HA GLU A 34 33.095 36.514 16.810 1.00 0.00 H new ATOM 0 HB2 GLU A 34 32.427 33.600 17.548 1.00 0.00 H new ATOM 0 HB3 GLU A 34 33.670 34.492 18.402 1.00 0.00 H new ATOM 0 HG2 GLU A 34 30.720 35.178 18.317 1.00 0.00 H new ATOM 0 HG3 GLU A 34 31.564 34.415 19.650 1.00 0.00 H new ATOM 556 N GLY A 35 34.162 34.014 15.002 1.00 0.00 N ATOM 557 CA GLY A 35 35.317 33.533 14.270 1.00 0.00 C ATOM 558 C GLY A 35 35.742 32.065 14.416 1.00 0.00 C ATOM 559 O GLY A 35 36.686 31.548 13.823 1.00 0.00 O ATOM 0 H GLY A 35 33.276 33.644 14.657 1.00 0.00 H new ATOM 0 HA2 GLY A 35 35.134 33.717 13.211 1.00 0.00 H new ATOM 0 HA3 GLY A 35 36.168 34.150 14.558 1.00 0.00 H new ATOM 563 N ILE A 36 35.164 31.362 15.377 1.00 0.00 N ATOM 564 CA ILE A 36 35.729 30.132 15.905 1.00 0.00 C ATOM 565 C ILE A 36 35.316 28.909 15.080 1.00 0.00 C ATOM 566 O ILE A 36 34.116 28.738 14.850 1.00 0.00 O ATOM 567 CB ILE A 36 35.122 29.995 17.303 1.00 0.00 C ATOM 568 CG1 ILE A 36 35.497 31.268 18.064 1.00 0.00 C ATOM 569 CG2 ILE A 36 35.382 28.726 18.105 1.00 0.00 C ATOM 570 CD1 ILE A 36 34.814 31.491 19.413 1.00 0.00 C ATOM 0 H ILE A 36 34.283 31.632 15.815 1.00 0.00 H new ATOM 0 HA ILE A 36 36.818 30.175 15.893 1.00 0.00 H new ATOM 0 HB ILE A 36 34.048 29.878 17.157 1.00 0.00 H new ATOM 0 HG12 ILE A 36 36.575 31.262 18.226 1.00 0.00 H new ATOM 0 HG13 ILE A 36 35.275 32.123 17.426 1.00 0.00 H new ATOM 0 HG21 ILE A 36 34.879 28.796 19.070 1.00 0.00 H new ATOM 0 HG22 ILE A 36 34.999 27.865 17.558 1.00 0.00 H new ATOM 0 HG23 ILE A 36 36.454 28.608 18.262 1.00 0.00 H new ATOM 0 HD11 ILE A 36 35.166 32.426 19.849 1.00 0.00 H new ATOM 0 HD12 ILE A 36 33.734 31.540 19.271 1.00 0.00 H new ATOM 0 HD13 ILE A 36 35.054 30.666 20.083 1.00 0.00 H new ATOM 582 N PRO A 37 36.170 28.008 14.613 1.00 0.00 N ATOM 583 CA PRO A 37 35.864 27.004 13.618 1.00 0.00 C ATOM 584 C PRO A 37 35.063 25.840 14.214 1.00 0.00 C ATOM 585 O PRO A 37 35.394 25.522 15.347 1.00 0.00 O ATOM 586 CB PRO A 37 37.245 26.636 13.063 1.00 0.00 C ATOM 587 CG PRO A 37 38.315 27.072 14.064 1.00 0.00 C ATOM 588 CD PRO A 37 37.572 28.051 14.973 1.00 0.00 C ATOM 0 HA PRO A 37 35.205 27.345 12.820 1.00 0.00 H new ATOM 0 HB2 PRO A 37 37.307 25.562 12.889 1.00 0.00 H new ATOM 0 HB3 PRO A 37 37.407 27.124 12.102 1.00 0.00 H new ATOM 0 HG2 PRO A 37 38.710 26.225 14.624 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.160 27.548 13.567 1.00 0.00 H new ATOM 0 HD2 PRO A 37 37.707 27.779 16.020 1.00 0.00 H new ATOM 0 HD3 PRO A 37 37.967 29.060 14.853 1.00 0.00 H new ATOM 596 N PRO A 38 34.032 25.288 13.575 1.00 0.00 N ATOM 597 CA PRO A 38 33.306 24.100 13.964 1.00 0.00 C ATOM 598 C PRO A 38 34.238 23.011 14.513 1.00 0.00 C ATOM 599 O PRO A 38 33.999 22.567 15.637 1.00 0.00 O ATOM 600 CB PRO A 38 32.512 23.706 12.721 1.00 0.00 C ATOM 601 CG PRO A 38 32.140 25.040 12.070 1.00 0.00 C ATOM 602 CD PRO A 38 33.376 25.873 12.419 1.00 0.00 C ATOM 0 HA PRO A 38 32.627 24.268 14.800 1.00 0.00 H new ATOM 0 HB2 PRO A 38 33.107 23.088 12.049 1.00 0.00 H new ATOM 0 HB3 PRO A 38 31.624 23.130 12.982 1.00 0.00 H new ATOM 0 HG2 PRO A 38 31.991 24.949 10.994 1.00 0.00 H new ATOM 0 HG3 PRO A 38 31.224 25.463 12.484 1.00 0.00 H new ATOM 0 HD2 PRO A 38 34.062 25.902 11.572 1.00 0.00 H new ATOM 0 HD3 PRO A 38 33.088 26.903 12.631 1.00 0.00 H new ATOM 610 N ASP A 39 35.305 22.542 13.877 1.00 0.00 N ATOM 611 CA ASP A 39 36.124 21.413 14.279 1.00 0.00 C ATOM 612 C ASP A 39 37.075 21.731 15.437 1.00 0.00 C ATOM 613 O ASP A 39 37.853 20.877 15.862 1.00 0.00 O ATOM 614 CB ASP A 39 36.868 21.041 12.995 1.00 0.00 C ATOM 615 CG ASP A 39 37.642 19.735 13.024 1.00 0.00 C ATOM 616 OD1 ASP A 39 36.937 18.742 13.286 1.00 0.00 O ATOM 617 OD2 ASP A 39 38.875 19.715 12.805 1.00 0.00 O ATOM 0 H ASP A 39 35.639 22.969 13.013 1.00 0.00 H new ATOM 0 HA ASP A 39 35.525 20.594 14.677 1.00 0.00 H new ATOM 0 HB2 ASP A 39 36.144 20.993 12.181 1.00 0.00 H new ATOM 0 HB3 ASP A 39 37.563 21.846 12.756 1.00 0.00 H new ATOM 622 N GLN A 40 36.892 22.891 16.049 1.00 0.00 N ATOM 623 CA GLN A 40 37.429 23.188 17.358 1.00 0.00 C ATOM 624 C GLN A 40 36.385 23.136 18.465 1.00 0.00 C ATOM 625 O GLN A 40 36.681 22.961 19.651 1.00 0.00 O ATOM 626 CB GLN A 40 38.031 24.590 17.263 1.00 0.00 C ATOM 627 CG GLN A 40 39.040 24.837 18.383 1.00 0.00 C ATOM 628 CD GLN A 40 39.608 26.251 18.461 1.00 0.00 C ATOM 629 OE1 GLN A 40 39.470 27.068 17.557 1.00 0.00 O ATOM 630 NE2 GLN A 40 39.961 26.625 19.686 1.00 0.00 N ATOM 0 H GLN A 40 36.359 23.659 15.641 1.00 0.00 H new ATOM 0 HA GLN A 40 38.168 22.433 17.626 1.00 0.00 H new ATOM 0 HB2 GLN A 40 38.520 24.714 16.297 1.00 0.00 H new ATOM 0 HB3 GLN A 40 37.236 25.334 17.316 1.00 0.00 H new ATOM 0 HG2 GLN A 40 38.563 24.604 19.335 1.00 0.00 H new ATOM 0 HG3 GLN A 40 39.868 24.139 18.262 1.00 0.00 H new ATOM 0 HE21 GLN A 40 40.069 25.926 20.421 1.00 0.00 H new ATOM 0 HE22 GLN A 40 40.124 27.611 19.891 1.00 0.00 H new ATOM 639 N GLN A 41 35.135 23.422 18.122 1.00 0.00 N ATOM 640 CA GLN A 41 34.070 23.662 19.082 1.00 0.00 C ATOM 641 C GLN A 41 33.464 22.382 19.659 1.00 0.00 C ATOM 642 O GLN A 41 33.439 21.343 18.998 1.00 0.00 O ATOM 643 CB GLN A 41 32.936 24.479 18.473 1.00 0.00 C ATOM 644 CG GLN A 41 33.259 25.891 17.991 1.00 0.00 C ATOM 645 CD GLN A 41 32.055 26.636 17.420 1.00 0.00 C ATOM 646 OE1 GLN A 41 30.962 26.443 17.957 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.130 27.354 16.307 1.00 0.00 N ATOM 0 H GLN A 41 34.830 23.494 17.151 1.00 0.00 H new ATOM 0 HA GLN A 41 34.552 24.213 19.889 1.00 0.00 H new ATOM 0 HB2 GLN A 41 32.536 23.919 17.628 1.00 0.00 H new ATOM 0 HB3 GLN A 41 32.139 24.551 19.213 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.669 26.464 18.823 1.00 0.00 H new ATOM 0 HG3 GLN A 41 34.036 25.836 17.228 1.00 0.00 H new ATOM 0 HE21 GLN A 41 33.034 27.514 15.863 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.283 27.747 15.895 1.00 0.00 H new ATOM 656 N ARG A 42 32.994 22.476 20.897 1.00 0.00 N ATOM 657 CA ARG A 42 32.113 21.622 21.672 1.00 0.00 C ATOM 658 C ARG A 42 31.072 22.491 22.387 1.00 0.00 C ATOM 659 O ARG A 42 31.426 23.300 23.244 1.00 0.00 O ATOM 660 CB ARG A 42 32.972 20.899 22.705 1.00 0.00 C ATOM 661 CG ARG A 42 32.297 20.263 23.928 1.00 0.00 C ATOM 662 CD ARG A 42 33.189 19.220 24.603 1.00 0.00 C ATOM 663 NE ARG A 42 33.577 18.106 23.733 1.00 0.00 N ATOM 664 CZ ARG A 42 34.287 17.052 24.157 1.00 0.00 C ATOM 665 NH1 ARG A 42 34.775 16.976 25.400 1.00 0.00 N ATOM 666 NH2 ARG A 42 34.514 16.094 23.247 1.00 0.00 N ATOM 0 H ARG A 42 33.269 23.280 21.462 1.00 0.00 H new ATOM 0 HA ARG A 42 31.597 20.906 21.032 1.00 0.00 H new ATOM 0 HB2 ARG A 42 33.517 20.111 22.185 1.00 0.00 H new ATOM 0 HB3 ARG A 42 33.712 21.610 23.072 1.00 0.00 H new ATOM 0 HG2 ARG A 42 32.044 21.042 24.647 1.00 0.00 H new ATOM 0 HG3 ARG A 42 31.361 19.795 23.622 1.00 0.00 H new ATOM 0 HD2 ARG A 42 34.091 19.712 24.969 1.00 0.00 H new ATOM 0 HD3 ARG A 42 32.668 18.822 25.474 1.00 0.00 H new ATOM 0 HE ARG A 42 33.292 18.135 22.754 1.00 0.00 H new ATOM 0 HH11 ARG A 42 34.611 17.736 26.060 1.00 0.00 H new ATOM 0 HH12 ARG A 42 35.311 16.158 25.688 1.00 0.00 H new ATOM 0 HH21 ARG A 42 34.153 16.196 22.299 1.00 0.00 H new ATOM 0 HH22 ARG A 42 35.048 15.264 23.503 1.00 0.00 H new ATOM 680 N LEU A 43 29.792 22.295 22.100 1.00 0.00 N ATOM 681 CA LEU A 43 28.701 22.850 22.874 1.00 0.00 C ATOM 682 C LEU A 43 28.091 21.829 23.843 1.00 0.00 C ATOM 683 O LEU A 43 27.861 20.680 23.486 1.00 0.00 O ATOM 684 CB LEU A 43 27.649 23.158 21.819 1.00 0.00 C ATOM 685 CG LEU A 43 27.865 24.380 20.917 1.00 0.00 C ATOM 686 CD1 LEU A 43 26.858 24.448 19.772 1.00 0.00 C ATOM 687 CD2 LEU A 43 27.767 25.663 21.745 1.00 0.00 C ATOM 0 H LEU A 43 29.482 21.734 21.306 1.00 0.00 H new ATOM 0 HA LEU A 43 29.037 23.698 23.471 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.555 22.282 21.177 1.00 0.00 H new ATOM 0 HB3 LEU A 43 26.694 23.284 22.328 1.00 0.00 H new ATOM 0 HG LEU A 43 28.859 24.281 20.481 1.00 0.00 H new ATOM 0 HD11 LEU A 43 27.056 25.331 19.165 1.00 0.00 H new ATOM 0 HD12 LEU A 43 26.949 23.555 19.154 1.00 0.00 H new ATOM 0 HD13 LEU A 43 25.848 24.506 20.178 1.00 0.00 H new ATOM 0 HD21 LEU A 43 27.921 26.526 21.098 1.00 0.00 H new ATOM 0 HD22 LEU A 43 26.780 25.725 22.204 1.00 0.00 H new ATOM 0 HD23 LEU A 43 28.529 25.652 22.524 1.00 0.00 H new ATOM 699 N ILE A 44 27.929 22.293 25.082 1.00 0.00 N ATOM 700 CA ILE A 44 27.477 21.635 26.282 1.00 0.00 C ATOM 701 C ILE A 44 26.106 22.287 26.476 1.00 0.00 C ATOM 702 O ILE A 44 25.896 23.501 26.410 1.00 0.00 O ATOM 703 CB ILE A 44 28.354 21.919 27.502 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.872 21.826 27.363 1.00 0.00 C ATOM 705 CG2 ILE A 44 27.948 21.257 28.818 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.328 20.415 26.989 1.00 0.00 C ATOM 0 H ILE A 44 28.144 23.270 25.279 1.00 0.00 H new ATOM 0 HA ILE A 44 27.486 20.549 26.188 1.00 0.00 H new ATOM 0 HB ILE A 44 28.112 22.981 27.545 1.00 0.00 H new ATOM 0 HG12 ILE A 44 30.210 22.530 26.602 1.00 0.00 H new ATOM 0 HG13 ILE A 44 30.341 22.122 28.302 1.00 0.00 H new ATOM 0 HG21 ILE A 44 28.652 21.541 29.600 1.00 0.00 H new ATOM 0 HG22 ILE A 44 26.946 21.584 29.096 1.00 0.00 H new ATOM 0 HG23 ILE A 44 27.956 20.174 28.698 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.414 20.395 26.901 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.014 19.714 27.762 1.00 0.00 H new ATOM 0 HD13 ILE A 44 29.881 20.129 26.037 1.00 0.00 H new ATOM 718 N PHE A 45 25.070 21.471 26.569 1.00 0.00 N ATOM 719 CA PHE A 45 23.729 21.916 26.866 1.00 0.00 C ATOM 720 C PHE A 45 23.525 21.166 28.186 1.00 0.00 C ATOM 721 O PHE A 45 23.364 19.947 28.291 1.00 0.00 O ATOM 722 CB PHE A 45 22.691 21.518 25.817 1.00 0.00 C ATOM 723 CG PHE A 45 21.266 21.970 26.039 1.00 0.00 C ATOM 724 CD1 PHE A 45 20.989 23.263 26.495 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.184 21.179 25.644 1.00 0.00 C ATOM 726 CE1 PHE A 45 19.646 23.669 26.648 1.00 0.00 C ATOM 727 CE2 PHE A 45 18.880 21.688 25.583 1.00 0.00 C ATOM 728 CZ PHE A 45 18.560 22.900 26.226 1.00 0.00 C ATOM 0 H PHE A 45 25.144 20.462 26.437 1.00 0.00 H new ATOM 0 HA PHE A 45 23.610 22.999 26.897 1.00 0.00 H new ATOM 0 HB2 PHE A 45 23.021 21.906 24.853 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.691 20.431 25.740 1.00 0.00 H new ATOM 0 HD1 PHE A 45 21.795 23.944 26.728 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.358 20.147 25.378 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.449 24.623 27.115 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.117 21.149 25.041 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.539 23.214 26.383 1.00 0.00 H new ATOM 738 N ALA A 46 23.419 22.008 29.210 1.00 0.00 N ATOM 739 CA ALA A 46 23.022 21.510 30.509 1.00 0.00 C ATOM 740 C ALA A 46 23.694 20.224 31.007 1.00 0.00 C ATOM 741 O ALA A 46 23.029 19.276 31.392 1.00 0.00 O ATOM 742 CB ALA A 46 21.495 21.463 30.507 1.00 0.00 C ATOM 0 H ALA A 46 23.598 23.011 29.163 1.00 0.00 H new ATOM 0 HA ALA A 46 23.399 22.200 31.264 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.141 21.092 31.469 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.100 22.465 30.337 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.152 20.798 29.714 1.00 0.00 H new ATOM 748 N GLY A 47 25.024 20.220 30.985 1.00 0.00 N ATOM 749 CA GLY A 47 25.792 19.202 31.669 1.00 0.00 C ATOM 750 C GLY A 47 26.059 17.995 30.768 1.00 0.00 C ATOM 751 O GLY A 47 26.707 17.070 31.255 1.00 0.00 O ATOM 0 H GLY A 47 25.588 20.916 30.497 1.00 0.00 H new ATOM 0 HA2 GLY A 47 26.740 19.624 32.003 1.00 0.00 H new ATOM 0 HA3 GLY A 47 25.255 18.879 32.561 1.00 0.00 H new ATOM 755 N LYS A 48 25.570 18.000 29.530 1.00 0.00 N ATOM 756 CA LYS A 48 25.774 16.954 28.554 1.00 0.00 C ATOM 757 C LYS A 48 26.323 17.521 27.243 1.00 0.00 C ATOM 758 O LYS A 48 26.067 18.655 26.851 1.00 0.00 O ATOM 759 CB LYS A 48 24.496 16.129 28.409 1.00 0.00 C ATOM 760 CG LYS A 48 23.201 16.899 28.146 1.00 0.00 C ATOM 761 CD LYS A 48 22.007 16.083 27.645 1.00 0.00 C ATOM 762 CE LYS A 48 20.740 16.926 27.517 1.00 0.00 C ATOM 763 NZ LYS A 48 19.501 16.132 27.422 1.00 0.00 N ATOM 0 H LYS A 48 25.000 18.767 29.174 1.00 0.00 H new ATOM 0 HA LYS A 48 26.544 16.264 28.898 1.00 0.00 H new ATOM 0 HB2 LYS A 48 24.641 15.420 27.594 1.00 0.00 H new ATOM 0 HB3 LYS A 48 24.364 15.545 29.320 1.00 0.00 H new ATOM 0 HG2 LYS A 48 22.908 17.399 29.070 1.00 0.00 H new ATOM 0 HG3 LYS A 48 23.411 17.679 27.414 1.00 0.00 H new ATOM 0 HD2 LYS A 48 22.249 15.646 26.676 1.00 0.00 H new ATOM 0 HD3 LYS A 48 21.822 15.256 28.330 1.00 0.00 H new ATOM 0 HE2 LYS A 48 20.669 17.590 28.378 1.00 0.00 H new ATOM 0 HE3 LYS A 48 20.824 17.558 26.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 18.685 16.771 27.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 19.547 15.516 26.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 19.397 15.548 28.276 1.00 0.00 H new ATOM 777 N GLN A 49 27.011 16.585 26.591 1.00 0.00 N ATOM 778 CA GLN A 49 27.744 16.833 25.366 1.00 0.00 C ATOM 779 C GLN A 49 26.753 16.518 24.240 1.00 0.00 C ATOM 780 O GLN A 49 26.397 15.342 24.148 1.00 0.00 O ATOM 781 CB GLN A 49 28.892 15.843 25.157 1.00 0.00 C ATOM 782 CG GLN A 49 30.127 16.127 26.027 1.00 0.00 C ATOM 783 CD GLN A 49 31.404 15.365 25.699 1.00 0.00 C ATOM 784 OE1 GLN A 49 31.783 15.068 24.571 1.00 0.00 O ATOM 785 NE2 GLN A 49 32.134 15.058 26.771 1.00 0.00 N ATOM 0 H GLN A 49 27.071 15.618 26.911 1.00 0.00 H new ATOM 0 HA GLN A 49 28.143 17.847 25.392 1.00 0.00 H new ATOM 0 HB2 GLN A 49 28.533 14.836 25.370 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.187 15.861 24.108 1.00 0.00 H new ATOM 0 HG2 GLN A 49 30.345 17.193 25.965 1.00 0.00 H new ATOM 0 HG3 GLN A 49 29.865 15.915 27.064 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.804 15.312 27.702 1.00 0.00 H new ATOM 0 HE22 GLN A 49 33.022 14.569 26.660 1.00 0.00 H new ATOM 794 N LEU A 50 26.380 17.455 23.378 1.00 0.00 N ATOM 795 CA LEU A 50 25.572 17.278 22.182 1.00 0.00 C ATOM 796 C LEU A 50 26.394 16.447 21.190 1.00 0.00 C ATOM 797 O LEU A 50 27.516 16.790 20.825 1.00 0.00 O ATOM 798 CB LEU A 50 25.131 18.637 21.627 1.00 0.00 C ATOM 799 CG LEU A 50 24.396 19.507 22.638 1.00 0.00 C ATOM 800 CD1 LEU A 50 23.840 20.805 22.044 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.259 18.732 23.312 1.00 0.00 C ATOM 0 H LEU A 50 26.655 18.429 23.507 1.00 0.00 H new ATOM 0 HA LEU A 50 24.648 16.742 22.397 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.009 19.175 21.270 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.485 18.474 20.765 1.00 0.00 H new ATOM 0 HG LEU A 50 25.148 19.785 23.377 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.330 21.372 22.823 1.00 0.00 H new ATOM 0 HD12 LEU A 50 24.659 21.400 21.639 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.135 20.568 21.247 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.753 19.379 24.028 1.00 0.00 H new ATOM 0 HD22 LEU A 50 22.547 18.400 22.556 1.00 0.00 H new ATOM 0 HD23 LEU A 50 23.667 17.865 23.831 1.00 0.00 H new ATOM 813 N GLU A 51 25.814 15.333 20.764 1.00 0.00 N ATOM 814 CA GLU A 51 26.416 14.488 19.753 1.00 0.00 C ATOM 815 C GLU A 51 26.017 15.030 18.379 1.00 0.00 C ATOM 816 O GLU A 51 24.925 15.582 18.230 1.00 0.00 O ATOM 817 CB GLU A 51 25.900 13.060 19.922 1.00 0.00 C ATOM 818 CG GLU A 51 26.535 11.984 19.051 1.00 0.00 C ATOM 819 CD GLU A 51 27.651 11.163 19.682 1.00 0.00 C ATOM 820 OE1 GLU A 51 27.230 10.244 20.417 1.00 0.00 O ATOM 821 OE2 GLU A 51 28.843 11.465 19.430 1.00 0.00 O ATOM 0 H GLU A 51 24.916 14.994 21.111 1.00 0.00 H new ATOM 0 HA GLU A 51 27.502 14.485 19.849 1.00 0.00 H new ATOM 0 HB2 GLU A 51 26.034 12.773 20.965 1.00 0.00 H new ATOM 0 HB3 GLU A 51 24.827 13.063 19.728 1.00 0.00 H new ATOM 0 HG2 GLU A 51 25.750 11.300 18.729 1.00 0.00 H new ATOM 0 HG3 GLU A 51 26.929 12.461 18.154 1.00 0.00 H new ATOM 828 N ASP A 52 26.976 14.935 17.467 1.00 0.00 N ATOM 829 CA ASP A 52 26.957 15.519 16.137 1.00 0.00 C ATOM 830 C ASP A 52 25.968 14.780 15.239 1.00 0.00 C ATOM 831 O ASP A 52 25.769 13.595 15.490 1.00 0.00 O ATOM 832 CB ASP A 52 28.251 15.525 15.324 1.00 0.00 C ATOM 833 CG ASP A 52 29.421 16.200 16.026 1.00 0.00 C ATOM 834 OD1 ASP A 52 29.320 17.404 16.345 1.00 0.00 O ATOM 835 OD2 ASP A 52 30.389 15.487 16.361 1.00 0.00 O ATOM 0 H ASP A 52 27.836 14.418 17.649 1.00 0.00 H new ATOM 0 HA ASP A 52 26.709 16.553 16.377 1.00 0.00 H new ATOM 0 HB2 ASP A 52 28.526 14.496 15.090 1.00 0.00 H new ATOM 0 HB3 ASP A 52 28.069 16.030 14.375 1.00 0.00 H new ATOM 840 N GLY A 53 25.398 15.348 14.169 1.00 0.00 N ATOM 841 CA GLY A 53 24.541 14.734 13.183 1.00 0.00 C ATOM 842 C GLY A 53 23.052 14.753 13.536 1.00 0.00 C ATOM 843 O GLY A 53 22.250 14.186 12.792 1.00 0.00 O ATOM 0 H GLY A 53 25.547 16.336 13.966 1.00 0.00 H new ATOM 0 HA2 GLY A 53 24.682 15.244 12.230 1.00 0.00 H new ATOM 0 HA3 GLY A 53 24.855 13.700 13.041 1.00 0.00 H new ATOM 847 N ARG A 54 22.700 15.261 14.709 1.00 0.00 N ATOM 848 CA ARG A 54 21.333 15.477 15.161 1.00 0.00 C ATOM 849 C ARG A 54 20.955 16.954 14.973 1.00 0.00 C ATOM 850 O ARG A 54 21.798 17.828 14.764 1.00 0.00 O ATOM 851 CB ARG A 54 21.308 15.408 16.683 1.00 0.00 C ATOM 852 CG ARG A 54 21.252 13.941 17.116 1.00 0.00 C ATOM 853 CD ARG A 54 22.646 13.347 17.357 1.00 0.00 C ATOM 854 NE ARG A 54 22.688 11.892 17.544 1.00 0.00 N ATOM 855 CZ ARG A 54 23.215 10.981 16.722 1.00 0.00 C ATOM 856 NH1 ARG A 54 23.907 11.364 15.640 1.00 0.00 N ATOM 857 NH2 ARG A 54 23.011 9.683 16.985 1.00 0.00 N ATOM 0 H ARG A 54 23.391 15.547 15.403 1.00 0.00 H new ATOM 0 HA ARG A 54 20.702 14.761 14.633 1.00 0.00 H new ATOM 0 HB2 ARG A 54 22.195 15.889 17.096 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.444 15.948 17.070 1.00 0.00 H new ATOM 0 HG2 ARG A 54 20.662 13.857 18.029 1.00 0.00 H new ATOM 0 HG3 ARG A 54 20.740 13.359 16.350 1.00 0.00 H new ATOM 0 HD2 ARG A 54 23.283 13.606 16.512 1.00 0.00 H new ATOM 0 HD3 ARG A 54 23.077 13.822 18.238 1.00 0.00 H new ATOM 0 HE ARG A 54 22.266 11.535 18.401 1.00 0.00 H new ATOM 0 HH11 ARG A 54 24.034 12.356 15.441 1.00 0.00 H new ATOM 0 HH12 ARG A 54 24.307 10.663 15.016 1.00 0.00 H new ATOM 0 HH21 ARG A 54 22.462 9.408 17.800 1.00 0.00 H new ATOM 0 HH22 ARG A 54 23.404 8.970 16.370 1.00 0.00 H new ATOM 871 N THR A 55 19.649 17.189 15.051 1.00 0.00 N ATOM 872 CA THR A 55 19.146 18.548 15.123 1.00 0.00 C ATOM 873 C THR A 55 18.813 18.915 16.565 1.00 0.00 C ATOM 874 O THR A 55 18.866 18.172 17.549 1.00 0.00 O ATOM 875 CB THR A 55 17.905 18.477 14.240 1.00 0.00 C ATOM 876 OG1 THR A 55 16.867 17.640 14.703 1.00 0.00 O ATOM 877 CG2 THR A 55 18.162 18.380 12.732 1.00 0.00 C ATOM 0 H THR A 55 18.932 16.464 15.066 1.00 0.00 H new ATOM 0 HA THR A 55 19.852 19.312 14.797 1.00 0.00 H new ATOM 0 HB THR A 55 17.500 19.481 14.366 1.00 0.00 H new ATOM 0 HG1 THR A 55 17.132 16.702 14.600 1.00 0.00 H new ATOM 0 HG21 THR A 55 17.210 18.335 12.203 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.720 19.256 12.401 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.738 17.480 12.518 1.00 0.00 H new ATOM 885 N LEU A 56 18.528 20.218 16.650 1.00 0.00 N ATOM 886 CA LEU A 56 17.875 20.996 17.679 1.00 0.00 C ATOM 887 C LEU A 56 16.630 20.345 18.289 1.00 0.00 C ATOM 888 O LEU A 56 16.618 20.052 19.482 1.00 0.00 O ATOM 889 CB LEU A 56 17.642 22.454 17.302 1.00 0.00 C ATOM 890 CG LEU A 56 18.547 23.483 17.985 1.00 0.00 C ATOM 891 CD1 LEU A 56 19.996 23.402 17.479 1.00 0.00 C ATOM 892 CD2 LEU A 56 17.963 24.891 17.974 1.00 0.00 C ATOM 0 H LEU A 56 18.795 20.829 15.878 1.00 0.00 H new ATOM 0 HA LEU A 56 18.612 21.005 18.482 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.765 22.553 16.223 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.606 22.705 17.529 1.00 0.00 H new ATOM 0 HG LEU A 56 18.589 23.215 19.041 1.00 0.00 H new ATOM 0 HD11 LEU A 56 20.602 24.150 17.990 1.00 0.00 H new ATOM 0 HD12 LEU A 56 20.397 22.409 17.682 1.00 0.00 H new ATOM 0 HD13 LEU A 56 20.018 23.590 16.406 1.00 0.00 H new ATOM 0 HD21 LEU A 56 18.651 25.574 18.473 1.00 0.00 H new ATOM 0 HD22 LEU A 56 17.813 25.215 16.944 1.00 0.00 H new ATOM 0 HD23 LEU A 56 17.007 24.892 18.498 1.00 0.00 H new ATOM 904 N SER A 57 15.696 19.922 17.443 1.00 0.00 N ATOM 905 CA SER A 57 14.498 19.221 17.865 1.00 0.00 C ATOM 906 C SER A 57 14.743 17.762 18.262 1.00 0.00 C ATOM 907 O SER A 57 13.857 17.108 18.802 1.00 0.00 O ATOM 908 CB SER A 57 13.474 19.267 16.728 1.00 0.00 C ATOM 909 OG SER A 57 13.884 18.825 15.447 1.00 0.00 O ATOM 0 H SER A 57 15.755 20.060 16.434 1.00 0.00 H new ATOM 0 HA SER A 57 14.133 19.728 18.758 1.00 0.00 H new ATOM 0 HB2 SER A 57 12.614 18.668 17.028 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.128 20.296 16.631 1.00 0.00 H new ATOM 0 HG SER A 57 14.319 19.563 14.970 1.00 0.00 H new ATOM 915 N ASP A 58 15.900 17.174 17.974 1.00 0.00 N ATOM 916 CA ASP A 58 16.204 15.844 18.478 1.00 0.00 C ATOM 917 C ASP A 58 16.682 16.002 19.921 1.00 0.00 C ATOM 918 O ASP A 58 16.457 15.054 20.673 1.00 0.00 O ATOM 919 CB ASP A 58 17.254 14.985 17.773 1.00 0.00 C ATOM 920 CG ASP A 58 17.023 14.840 16.277 1.00 0.00 C ATOM 921 OD1 ASP A 58 16.056 14.119 15.933 1.00 0.00 O ATOM 922 OD2 ASP A 58 17.831 15.268 15.423 1.00 0.00 O ATOM 0 H ASP A 58 16.633 17.593 17.401 1.00 0.00 H new ATOM 0 HA ASP A 58 15.270 15.305 18.317 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.239 15.422 17.939 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.265 13.994 18.227 1.00 0.00 H new ATOM 927 N TYR A 59 17.516 16.981 20.252 1.00 0.00 N ATOM 928 CA TYR A 59 18.263 17.097 21.487 1.00 0.00 C ATOM 929 C TYR A 59 17.591 18.026 22.498 1.00 0.00 C ATOM 930 O TYR A 59 18.210 18.514 23.447 1.00 0.00 O ATOM 931 CB TYR A 59 19.659 17.586 21.098 1.00 0.00 C ATOM 932 CG TYR A 59 20.742 16.609 21.496 1.00 0.00 C ATOM 933 CD1 TYR A 59 21.059 16.313 22.823 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.602 15.998 20.570 1.00 0.00 C ATOM 935 CE1 TYR A 59 21.954 15.312 23.240 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.532 15.025 20.947 1.00 0.00 C ATOM 937 CZ TYR A 59 22.764 14.688 22.285 1.00 0.00 C ATOM 938 OH TYR A 59 23.735 13.800 22.666 1.00 0.00 O ATOM 0 H TYR A 59 17.696 17.762 19.621 1.00 0.00 H new ATOM 0 HA TYR A 59 18.312 16.133 21.994 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.697 17.748 20.021 1.00 0.00 H new ATOM 0 HB3 TYR A 59 19.849 18.549 21.572 1.00 0.00 H new ATOM 0 HD1 TYR A 59 20.578 16.900 23.591 1.00 0.00 H new ATOM 0 HD2 TYR A 59 21.543 16.289 19.532 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.015 15.029 24.281 1.00 0.00 H new ATOM 0 HE2 TYR A 59 23.092 14.515 20.177 1.00 0.00 H new ATOM 0 HH TYR A 59 24.039 13.292 21.885 1.00 0.00 H new ATOM 948 N ASN A 60 16.351 18.411 22.193 1.00 0.00 N ATOM 949 CA ASN A 60 15.363 18.926 23.119 1.00 0.00 C ATOM 950 C ASN A 60 15.369 20.439 23.275 1.00 0.00 C ATOM 951 O ASN A 60 14.781 20.906 24.247 1.00 0.00 O ATOM 952 CB ASN A 60 15.234 18.135 24.431 1.00 0.00 C ATOM 953 CG ASN A 60 14.802 16.700 24.193 1.00 0.00 C ATOM 954 OD1 ASN A 60 13.687 16.423 23.760 1.00 0.00 O ATOM 955 ND2 ASN A 60 15.683 15.711 24.321 1.00 0.00 N ATOM 0 H ASN A 60 15.998 18.366 21.237 1.00 0.00 H new ATOM 0 HA ASN A 60 14.414 18.729 22.620 1.00 0.00 H new ATOM 0 HB2 ASN A 60 16.190 18.143 24.954 1.00 0.00 H new ATOM 0 HB3 ASN A 60 14.511 18.628 25.081 1.00 0.00 H new ATOM 0 HD21 ASN A 60 15.422 14.759 24.063 1.00 0.00 H new ATOM 0 HD22 ASN A 60 16.619 15.905 24.678 1.00 0.00 H new ATOM 962 N ILE A 61 16.068 21.178 22.411 1.00 0.00 N ATOM 963 CA ILE A 61 16.315 22.601 22.537 1.00 0.00 C ATOM 964 C ILE A 61 14.979 23.296 22.261 1.00 0.00 C ATOM 965 O ILE A 61 14.405 23.137 21.184 1.00 0.00 O ATOM 966 CB ILE A 61 17.555 22.975 21.736 1.00 0.00 C ATOM 967 CG1 ILE A 61 18.875 22.550 22.375 1.00 0.00 C ATOM 968 CG2 ILE A 61 17.626 24.492 21.567 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.146 22.648 21.531 1.00 0.00 C ATOM 0 H ILE A 61 16.491 20.778 21.574 1.00 0.00 H new ATOM 0 HA ILE A 61 16.601 22.953 23.528 1.00 0.00 H new ATOM 0 HB ILE A 61 17.445 22.444 20.791 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.022 23.153 23.271 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.770 21.515 22.701 1.00 0.00 H new ATOM 0 HG21 ILE A 61 18.515 24.753 20.993 1.00 0.00 H new ATOM 0 HG22 ILE A 61 16.738 24.841 21.040 1.00 0.00 H new ATOM 0 HG23 ILE A 61 17.675 24.965 22.548 1.00 0.00 H new ATOM 0 HD11 ILE A 61 21.000 22.312 22.119 1.00 0.00 H new ATOM 0 HD12 ILE A 61 20.045 22.019 20.647 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.301 23.683 21.225 1.00 0.00 H new ATOM 981 N GLN A 62 14.697 24.273 23.114 1.00 0.00 N ATOM 982 CA GLN A 62 13.567 25.185 23.074 1.00 0.00 C ATOM 983 C GLN A 62 13.951 26.667 23.037 1.00 0.00 C ATOM 984 O GLN A 62 15.101 26.955 23.379 1.00 0.00 O ATOM 985 CB GLN A 62 12.355 24.753 23.890 1.00 0.00 C ATOM 986 CG GLN A 62 12.273 25.291 25.322 1.00 0.00 C ATOM 987 CD GLN A 62 11.171 24.611 26.122 1.00 0.00 C ATOM 988 OE1 GLN A 62 10.340 25.281 26.731 1.00 0.00 O ATOM 989 NE2 GLN A 62 11.100 23.279 26.124 1.00 0.00 N ATOM 0 H GLN A 62 15.302 24.460 23.914 1.00 0.00 H new ATOM 0 HA GLN A 62 13.136 25.081 22.078 1.00 0.00 H new ATOM 0 HB2 GLN A 62 11.456 25.062 23.357 1.00 0.00 H new ATOM 0 HB3 GLN A 62 12.342 23.664 23.933 1.00 0.00 H new ATOM 0 HG2 GLN A 62 13.230 25.140 25.822 1.00 0.00 H new ATOM 0 HG3 GLN A 62 12.093 26.366 25.296 1.00 0.00 H new ATOM 0 HE21 GLN A 62 11.794 22.731 25.616 1.00 0.00 H new ATOM 0 HE22 GLN A 62 10.352 22.809 26.634 1.00 0.00 H new ATOM 998 N LYS A 63 13.075 27.606 22.664 1.00 0.00 N ATOM 999 CA LYS A 63 13.269 29.036 22.754 1.00 0.00 C ATOM 1000 C LYS A 63 13.755 29.525 24.121 1.00 0.00 C ATOM 1001 O LYS A 63 13.145 29.187 25.132 1.00 0.00 O ATOM 1002 CB LYS A 63 11.950 29.729 22.406 1.00 0.00 C ATOM 1003 CG LYS A 63 12.156 31.246 22.311 1.00 0.00 C ATOM 1004 CD LYS A 63 10.888 32.082 22.132 1.00 0.00 C ATOM 1005 CE LYS A 63 9.940 31.943 23.327 1.00 0.00 C ATOM 1006 NZ LYS A 63 9.043 33.086 23.503 1.00 0.00 N ATOM 0 H LYS A 63 12.165 27.363 22.271 1.00 0.00 H new ATOM 0 HA LYS A 63 14.062 29.289 22.050 1.00 0.00 H new ATOM 0 HB2 LYS A 63 11.569 29.347 21.459 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.201 29.503 23.165 1.00 0.00 H new ATOM 0 HG2 LYS A 63 12.665 31.581 23.215 1.00 0.00 H new ATOM 0 HG3 LYS A 63 12.824 31.451 21.475 1.00 0.00 H new ATOM 0 HD2 LYS A 63 11.159 33.130 22.003 1.00 0.00 H new ATOM 0 HD3 LYS A 63 10.374 31.772 21.222 1.00 0.00 H new ATOM 0 HE2 LYS A 63 9.343 31.040 23.202 1.00 0.00 H new ATOM 0 HE3 LYS A 63 10.530 31.812 24.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 8.431 32.924 24.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 9.605 33.948 23.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 8.454 33.199 22.653 1.00 0.00 H new ATOM 1020 N GLU A 64 14.845 30.284 24.171 1.00 0.00 N ATOM 1021 CA GLU A 64 15.502 30.935 25.291 1.00 0.00 C ATOM 1022 C GLU A 64 16.417 29.996 26.083 1.00 0.00 C ATOM 1023 O GLU A 64 16.988 30.321 27.112 1.00 0.00 O ATOM 1024 CB GLU A 64 14.540 31.840 26.055 1.00 0.00 C ATOM 1025 CG GLU A 64 15.285 32.900 26.860 1.00 0.00 C ATOM 1026 CD GLU A 64 14.315 33.598 27.799 1.00 0.00 C ATOM 1027 OE1 GLU A 64 13.600 32.962 28.602 1.00 0.00 O ATOM 1028 OE2 GLU A 64 14.233 34.844 27.759 1.00 0.00 O ATOM 0 H GLU A 64 15.353 30.480 23.308 1.00 0.00 H new ATOM 0 HA GLU A 64 16.239 31.646 24.917 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.862 32.325 25.353 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.927 31.237 26.725 1.00 0.00 H new ATOM 0 HG2 GLU A 64 16.091 32.439 27.430 1.00 0.00 H new ATOM 0 HG3 GLU A 64 15.744 33.626 26.189 1.00 0.00 H new ATOM 1035 N SER A 65 16.499 28.738 25.651 1.00 0.00 N ATOM 1036 CA SER A 65 17.526 27.839 26.129 1.00 0.00 C ATOM 1037 C SER A 65 18.948 28.305 25.807 1.00 0.00 C ATOM 1038 O SER A 65 19.121 28.908 24.749 1.00 0.00 O ATOM 1039 CB SER A 65 17.350 26.517 25.374 1.00 0.00 C ATOM 1040 OG SER A 65 16.337 25.798 26.036 1.00 0.00 O ATOM 0 H SER A 65 15.861 28.326 24.970 1.00 0.00 H new ATOM 0 HA SER A 65 17.417 27.773 27.212 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.077 26.700 24.335 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.282 25.951 25.364 1.00 0.00 H new ATOM 0 HG SER A 65 15.510 25.839 25.511 1.00 0.00 H new ATOM 1046 N THR A 66 19.780 27.956 26.790 1.00 0.00 N ATOM 1047 CA THR A 66 21.086 28.520 27.074 1.00 0.00 C ATOM 1048 C THR A 66 22.149 27.417 27.133 1.00 0.00 C ATOM 1049 O THR A 66 22.114 26.637 28.080 1.00 0.00 O ATOM 1050 CB THR A 66 20.921 29.281 28.387 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.082 30.392 28.176 1.00 0.00 O ATOM 1052 CG2 THR A 66 22.244 29.812 28.960 1.00 0.00 C ATOM 0 H THR A 66 19.534 27.219 27.451 1.00 0.00 H new ATOM 0 HA THR A 66 21.435 29.197 26.294 1.00 0.00 H new ATOM 0 HB THR A 66 20.503 28.570 29.099 1.00 0.00 H new ATOM 0 HG1 THR A 66 19.972 30.883 29.017 1.00 0.00 H new ATOM 0 HG21 THR A 66 22.050 30.342 29.893 1.00 0.00 H new ATOM 0 HG22 THR A 66 22.919 28.978 29.150 1.00 0.00 H new ATOM 0 HG23 THR A 66 22.703 30.494 28.244 1.00 0.00 H new ATOM 1060 N LEU A 67 23.028 27.370 26.138 1.00 0.00 N ATOM 1061 CA LEU A 67 24.019 26.320 26.075 1.00 0.00 C ATOM 1062 C LEU A 67 25.312 27.034 26.472 1.00 0.00 C ATOM 1063 O LEU A 67 25.388 28.261 26.522 1.00 0.00 O ATOM 1064 CB LEU A 67 24.143 25.993 24.586 1.00 0.00 C ATOM 1065 CG LEU A 67 23.050 25.025 24.129 1.00 0.00 C ATOM 1066 CD1 LEU A 67 21.620 25.506 24.343 1.00 0.00 C ATOM 1067 CD2 LEU A 67 23.303 24.568 22.684 1.00 0.00 C ATOM 0 H LEU A 67 23.069 28.044 25.373 1.00 0.00 H new ATOM 0 HA LEU A 67 23.802 25.438 26.678 1.00 0.00 H new ATOM 0 HB2 LEU A 67 24.081 26.913 24.005 1.00 0.00 H new ATOM 0 HB3 LEU A 67 25.122 25.556 24.389 1.00 0.00 H new ATOM 0 HG LEU A 67 23.129 24.164 24.792 1.00 0.00 H new ATOM 0 HD11 LEU A 67 20.924 24.747 23.986 1.00 0.00 H new ATOM 0 HD12 LEU A 67 21.451 25.683 25.405 1.00 0.00 H new ATOM 0 HD13 LEU A 67 21.461 26.433 23.791 1.00 0.00 H new ATOM 0 HD21 LEU A 67 22.515 23.880 22.377 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.306 25.435 22.023 1.00 0.00 H new ATOM 0 HD23 LEU A 67 24.268 24.064 22.625 1.00 0.00 H new ATOM 1079 N HIS A 68 26.407 26.315 26.699 1.00 0.00 N ATOM 1080 CA HIS A 68 27.739 26.756 27.033 1.00 0.00 C ATOM 1081 C HIS A 68 28.646 26.195 25.937 1.00 0.00 C ATOM 1082 O HIS A 68 28.409 25.113 25.384 1.00 0.00 O ATOM 1083 CB HIS A 68 28.065 26.252 28.443 1.00 0.00 C ATOM 1084 CG HIS A 68 27.171 26.712 29.551 1.00 0.00 C ATOM 1085 ND1 HIS A 68 26.203 25.941 30.176 1.00 0.00 N ATOM 1086 CD2 HIS A 68 27.205 27.925 30.205 1.00 0.00 C ATOM 1087 CE1 HIS A 68 25.717 26.669 31.183 1.00 0.00 C ATOM 1088 NE2 HIS A 68 26.232 27.911 31.190 1.00 0.00 N ATOM 0 H HIS A 68 26.367 25.297 26.645 1.00 0.00 H new ATOM 0 HA HIS A 68 27.866 27.838 27.063 1.00 0.00 H new ATOM 0 HB2 HIS A 68 28.050 25.162 28.425 1.00 0.00 H new ATOM 0 HB3 HIS A 68 29.085 26.553 28.683 1.00 0.00 H new ATOM 0 HD2 HIS A 68 27.874 28.744 29.987 1.00 0.00 H new ATOM 0 HE1 HIS A 68 24.999 26.306 31.903 1.00 0.00 H new ATOM 0 HE2 HIS A 68 25.961 28.685 31.797 1.00 0.00 H new ATOM 1096 N LEU A 69 29.632 26.989 25.553 1.00 0.00 N ATOM 1097 CA LEU A 69 30.581 26.672 24.503 1.00 0.00 C ATOM 1098 C LEU A 69 31.853 26.256 25.226 1.00 0.00 C ATOM 1099 O LEU A 69 32.363 27.015 26.051 1.00 0.00 O ATOM 1100 CB LEU A 69 30.843 27.987 23.767 1.00 0.00 C ATOM 1101 CG LEU A 69 31.786 28.005 22.562 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.558 26.979 21.461 1.00 0.00 C ATOM 1103 CD2 LEU A 69 31.822 29.378 21.902 1.00 0.00 C ATOM 0 H LEU A 69 29.798 27.901 25.979 1.00 0.00 H new ATOM 0 HA LEU A 69 30.242 25.899 23.813 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.879 28.371 23.432 1.00 0.00 H new ATOM 0 HB3 LEU A 69 31.233 28.697 24.497 1.00 0.00 H new ATOM 0 HG LEU A 69 32.731 27.731 23.032 1.00 0.00 H new ATOM 0 HD11 LEU A 69 32.302 27.116 20.677 1.00 0.00 H new ATOM 0 HD12 LEU A 69 31.647 25.975 21.875 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.561 27.111 21.042 1.00 0.00 H new ATOM 0 HD21 LEU A 69 32.502 29.354 21.050 1.00 0.00 H new ATOM 0 HD22 LEU A 69 30.822 29.644 21.561 1.00 0.00 H new ATOM 0 HD23 LEU A 69 32.169 30.119 22.622 1.00 0.00 H new ATOM 1115 N VAL A 70 32.381 25.086 24.847 1.00 0.00 N ATOM 1116 CA VAL A 70 33.742 24.704 25.166 1.00 0.00 C ATOM 1117 C VAL A 70 34.566 24.665 23.883 1.00 0.00 C ATOM 1118 O VAL A 70 34.048 24.308 22.829 1.00 0.00 O ATOM 1119 CB VAL A 70 33.794 23.375 25.915 1.00 0.00 C ATOM 1120 CG1 VAL A 70 35.125 22.622 25.906 1.00 0.00 C ATOM 1121 CG2 VAL A 70 33.435 23.790 27.342 1.00 0.00 C ATOM 0 H VAL A 70 31.869 24.385 24.311 1.00 0.00 H new ATOM 0 HA VAL A 70 34.171 25.448 25.837 1.00 0.00 H new ATOM 0 HB VAL A 70 33.130 22.658 25.433 1.00 0.00 H new ATOM 0 HG11 VAL A 70 35.023 21.697 26.473 1.00 0.00 H new ATOM 0 HG12 VAL A 70 35.404 22.389 24.878 1.00 0.00 H new ATOM 0 HG13 VAL A 70 35.897 23.243 26.360 1.00 0.00 H new ATOM 0 HG21 VAL A 70 33.438 22.912 27.988 1.00 0.00 H new ATOM 0 HG22 VAL A 70 34.167 24.511 27.706 1.00 0.00 H new ATOM 0 HG23 VAL A 70 32.444 24.243 27.351 1.00 0.00 H new ATOM 1131 N LEU A 71 35.877 24.911 23.862 1.00 0.00 N ATOM 1132 CA LEU A 71 36.772 24.683 22.752 1.00 0.00 C ATOM 1133 C LEU A 71 37.821 23.595 22.983 1.00 0.00 C ATOM 1134 O LEU A 71 38.373 23.527 24.083 1.00 0.00 O ATOM 1135 CB LEU A 71 37.596 25.928 22.431 1.00 0.00 C ATOM 1136 CG LEU A 71 36.712 27.164 22.233 1.00 0.00 C ATOM 1137 CD1 LEU A 71 37.640 28.365 22.335 1.00 0.00 C ATOM 1138 CD2 LEU A 71 35.913 27.038 20.930 1.00 0.00 C ATOM 0 H LEU A 71 36.360 25.297 24.673 1.00 0.00 H new ATOM 0 HA LEU A 71 36.090 24.389 21.954 1.00 0.00 H new ATOM 0 HB2 LEU A 71 38.303 26.113 23.239 1.00 0.00 H new ATOM 0 HB3 LEU A 71 38.182 25.753 21.529 1.00 0.00 H new ATOM 0 HG LEU A 71 35.938 27.279 22.992 1.00 0.00 H new ATOM 0 HD11 LEU A 71 37.065 29.281 22.201 1.00 0.00 H new ATOM 0 HD12 LEU A 71 38.116 28.375 23.316 1.00 0.00 H new ATOM 0 HD13 LEU A 71 38.405 28.301 21.561 1.00 0.00 H new ATOM 0 HD21 LEU A 71 35.288 27.922 20.799 1.00 0.00 H new ATOM 0 HD22 LEU A 71 36.600 26.952 20.089 1.00 0.00 H new ATOM 0 HD23 LEU A 71 35.282 26.151 20.975 1.00 0.00 H new