USER MOD reduce.3.24.130724 H: found=0, std=0, add=630, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 629 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 60 ASN : amide:sc= 0.00883 X(o=-0.0058,f=-0.023) USER MOD Set 1.2: A 62 GLN : amide:sc= -0.0146 X(o=-0.0058,f=-0.023) USER MOD Set 2.1: A 55 THR OG1 : rot -69:sc= 1.49 USER MOD Set 2.2: A 57 SER OG : rot -38:sc= 0.274 USER MOD Single : A 1 MET CE :methyl 151:sc=-0.00866 (180deg=-1.21) USER MOD Single : A 1 MET N :NH3+ -179:sc= 1.25 (180deg=1.23) USER MOD Single : A 2 GLN : amide:sc= 0.861 K(o=0.86,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot -46:sc= 1.24 USER MOD Single : A 9 THR OG1 : rot -48:sc= 0.0236 USER MOD Single : A 11 LYS NZ :NH3+ 168:sc= 1.2 (180deg=0.772) USER MOD Single : A 12 THR OG1 : rot 64:sc= 0.126 USER MOD Single : A 14 THR OG1 : rot -53:sc= 0.116 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0595 USER MOD Single : A 22 THR OG1 : rot 180:sc=-0.00111 USER MOD Single : A 25 ASN : amide:sc= -0.562 K(o=-0.56,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 146:sc= 2.38 (180deg=1.14) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.841 K(o=-0.84,f=-0.075) USER MOD Single : A 33 LYS NZ :NH3+ -175:sc= -0.0222 (180deg=-0.101) USER MOD Single : A 40 GLN : amide:sc= 0 K(o=0,f=-1.9) USER MOD Single : A 41 GLN : amide:sc= 1.07 K(o=1.1,f=-2.4) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.578 X(o=-0.58,f=-0.3) USER MOD Single : A 59 TYR OH : rot 180:sc= 0.387 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 67:sc= 0.608 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=-0.023) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.508 31.387 16.765 1.00 0.00 N ATOM 2 CA MET A 1 13.637 30.965 18.170 1.00 0.00 C ATOM 3 C MET A 1 14.959 31.541 18.700 1.00 0.00 C ATOM 4 O MET A 1 15.959 31.371 17.996 1.00 0.00 O ATOM 5 CB MET A 1 13.432 29.461 18.300 1.00 0.00 C ATOM 6 CG MET A 1 13.233 28.976 19.741 1.00 0.00 C ATOM 7 SD MET A 1 13.128 27.189 20.021 1.00 0.00 S ATOM 8 CE MET A 1 14.865 26.820 19.683 1.00 0.00 C ATOM 0 H1 MET A 1 12.613 31.028 16.376 1.00 0.00 H new ATOM 0 H2 MET A 1 13.517 32.426 16.712 1.00 0.00 H new ATOM 0 H3 MET A 1 14.303 31.005 16.214 1.00 0.00 H new ATOM 0 HA MET A 1 12.853 31.365 18.813 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.564 29.171 17.708 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.294 28.950 17.872 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.057 29.362 20.342 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.319 29.430 20.124 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.169 25.944 20.256 1.00 0.00 H new ATOM 0 HE2 MET A 1 14.994 26.621 18.619 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.481 27.673 19.970 1.00 0.00 H new ATOM 20 N GLN A 2 14.965 32.096 19.907 1.00 0.00 N ATOM 21 CA GLN A 2 16.189 32.484 20.560 1.00 0.00 C ATOM 22 C GLN A 2 16.702 31.369 21.485 1.00 0.00 C ATOM 23 O GLN A 2 16.017 30.810 22.326 1.00 0.00 O ATOM 24 CB GLN A 2 15.938 33.755 21.374 1.00 0.00 C ATOM 25 CG GLN A 2 15.361 34.876 20.515 1.00 0.00 C ATOM 26 CD GLN A 2 15.791 36.189 21.154 1.00 0.00 C ATOM 27 OE1 GLN A 2 15.490 36.553 22.294 1.00 0.00 O ATOM 28 NE2 GLN A 2 16.380 37.071 20.342 1.00 0.00 N ATOM 0 H GLN A 2 14.122 32.285 20.449 1.00 0.00 H new ATOM 0 HA GLN A 2 16.948 32.667 19.800 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.251 33.533 22.191 1.00 0.00 H new ATOM 0 HB3 GLN A 2 16.873 34.088 21.825 1.00 0.00 H new ATOM 0 HG2 GLN A 2 15.729 34.806 19.491 1.00 0.00 H new ATOM 0 HG3 GLN A 2 14.274 34.807 20.469 1.00 0.00 H new ATOM 0 HE21 GLN A 2 16.640 36.797 19.394 1.00 0.00 H new ATOM 0 HE22 GLN A 2 16.570 38.018 20.670 1.00 0.00 H new ATOM 37 N ILE A 3 18.025 31.200 21.418 1.00 0.00 N ATOM 38 CA ILE A 3 18.860 30.513 22.382 1.00 0.00 C ATOM 39 C ILE A 3 20.123 31.356 22.597 1.00 0.00 C ATOM 40 O ILE A 3 20.385 32.309 21.868 1.00 0.00 O ATOM 41 CB ILE A 3 19.053 29.047 21.988 1.00 0.00 C ATOM 42 CG1 ILE A 3 19.650 28.847 20.595 1.00 0.00 C ATOM 43 CG2 ILE A 3 17.792 28.212 22.204 1.00 0.00 C ATOM 44 CD1 ILE A 3 20.010 27.394 20.283 1.00 0.00 C ATOM 0 H ILE A 3 18.567 31.566 20.636 1.00 0.00 H new ATOM 0 HA ILE A 3 18.392 30.430 23.363 1.00 0.00 H new ATOM 0 HB ILE A 3 19.808 28.669 22.678 1.00 0.00 H new ATOM 0 HG12 ILE A 3 18.939 29.204 19.850 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.545 29.462 20.501 1.00 0.00 H new ATOM 0 HG21 ILE A 3 17.984 27.180 21.909 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.512 28.242 23.257 1.00 0.00 H new ATOM 0 HG23 ILE A 3 16.980 28.617 21.601 1.00 0.00 H new ATOM 0 HD11 ILE A 3 20.428 27.330 19.278 1.00 0.00 H new ATOM 0 HD12 ILE A 3 20.745 27.038 21.005 1.00 0.00 H new ATOM 0 HD13 ILE A 3 19.114 26.776 20.343 1.00 0.00 H new ATOM 56 N PHE A 4 20.883 31.004 23.639 1.00 0.00 N ATOM 57 CA PHE A 4 22.083 31.708 24.048 1.00 0.00 C ATOM 58 C PHE A 4 23.238 30.711 23.964 1.00 0.00 C ATOM 59 O PHE A 4 23.049 29.594 24.431 1.00 0.00 O ATOM 60 CB PHE A 4 21.918 32.214 25.488 1.00 0.00 C ATOM 61 CG PHE A 4 21.028 33.414 25.700 1.00 0.00 C ATOM 62 CD1 PHE A 4 20.900 34.446 24.772 1.00 0.00 C ATOM 63 CD2 PHE A 4 20.307 33.424 26.908 1.00 0.00 C ATOM 64 CE1 PHE A 4 20.002 35.510 24.978 1.00 0.00 C ATOM 65 CE2 PHE A 4 19.391 34.470 27.054 1.00 0.00 C ATOM 66 CZ PHE A 4 19.204 35.506 26.118 1.00 0.00 C ATOM 0 H PHE A 4 20.668 30.201 24.230 1.00 0.00 H new ATOM 0 HA PHE A 4 22.274 32.569 23.408 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.529 31.394 26.092 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.907 32.454 25.877 1.00 0.00 H new ATOM 0 HD1 PHE A 4 21.503 34.429 23.876 1.00 0.00 H new ATOM 0 HD2 PHE A 4 20.451 32.674 27.671 1.00 0.00 H new ATOM 0 HE1 PHE A 4 19.933 36.316 24.263 1.00 0.00 H new ATOM 0 HE2 PHE A 4 18.784 34.485 27.947 1.00 0.00 H new ATOM 0 HZ PHE A 4 18.463 36.275 26.280 1.00 0.00 H new ATOM 76 N VAL A 5 24.352 31.155 23.400 1.00 0.00 N ATOM 77 CA VAL A 5 25.561 30.366 23.254 1.00 0.00 C ATOM 78 C VAL A 5 26.641 31.160 23.993 1.00 0.00 C ATOM 79 O VAL A 5 27.314 32.018 23.408 1.00 0.00 O ATOM 80 CB VAL A 5 25.840 30.146 21.773 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.107 29.377 21.411 1.00 0.00 C ATOM 82 CG2 VAL A 5 24.640 29.531 21.042 1.00 0.00 C ATOM 0 H VAL A 5 24.440 32.098 23.022 1.00 0.00 H new ATOM 0 HA VAL A 5 25.500 29.364 23.679 1.00 0.00 H new ATOM 0 HB VAL A 5 26.021 31.164 21.427 1.00 0.00 H new ATOM 0 HG11 VAL A 5 27.184 29.292 20.327 1.00 0.00 H new ATOM 0 HG12 VAL A 5 27.978 29.908 21.796 1.00 0.00 H new ATOM 0 HG13 VAL A 5 27.066 28.381 21.851 1.00 0.00 H new ATOM 0 HG21 VAL A 5 24.887 29.393 19.989 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.398 28.566 21.487 1.00 0.00 H new ATOM 0 HG23 VAL A 5 23.781 30.196 21.129 1.00 0.00 H new ATOM 92 N LYS A 6 26.797 30.893 25.287 1.00 0.00 N ATOM 93 CA LYS A 6 27.642 31.496 26.294 1.00 0.00 C ATOM 94 C LYS A 6 29.056 30.950 26.078 1.00 0.00 C ATOM 95 O LYS A 6 29.245 29.742 26.193 1.00 0.00 O ATOM 96 CB LYS A 6 27.054 31.160 27.671 1.00 0.00 C ATOM 97 CG LYS A 6 27.947 31.585 28.837 1.00 0.00 C ATOM 98 CD LYS A 6 27.330 31.125 30.156 1.00 0.00 C ATOM 99 CE LYS A 6 28.080 31.639 31.386 1.00 0.00 C ATOM 100 NZ LYS A 6 27.471 31.351 32.689 1.00 0.00 N ATOM 0 H LYS A 6 26.251 30.139 25.703 1.00 0.00 H new ATOM 0 HA LYS A 6 27.690 32.583 26.228 1.00 0.00 H new ATOM 0 HB2 LYS A 6 26.084 31.646 27.771 1.00 0.00 H new ATOM 0 HB3 LYS A 6 26.880 30.086 27.730 1.00 0.00 H new ATOM 0 HG2 LYS A 6 28.942 31.155 28.721 1.00 0.00 H new ATOM 0 HG3 LYS A 6 28.067 32.668 28.839 1.00 0.00 H new ATOM 0 HD2 LYS A 6 26.295 31.463 30.202 1.00 0.00 H new ATOM 0 HD3 LYS A 6 27.311 30.035 30.180 1.00 0.00 H new ATOM 0 HE2 LYS A 6 29.084 31.214 31.377 1.00 0.00 H new ATOM 0 HE3 LYS A 6 28.191 32.719 31.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 28.066 31.746 33.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 26.525 31.780 32.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 27.390 30.322 32.815 1.00 0.00 H new ATOM 114 N THR A 7 30.032 31.825 25.838 1.00 0.00 N ATOM 115 CA THR A 7 31.442 31.507 25.703 1.00 0.00 C ATOM 116 C THR A 7 31.968 31.483 27.141 1.00 0.00 C ATOM 117 O THR A 7 31.414 32.163 28.000 1.00 0.00 O ATOM 118 CB THR A 7 32.154 32.527 24.821 1.00 0.00 C ATOM 119 OG1 THR A 7 32.169 33.865 25.255 1.00 0.00 O ATOM 120 CG2 THR A 7 31.594 32.438 23.400 1.00 0.00 C ATOM 0 H THR A 7 29.845 32.822 25.728 1.00 0.00 H new ATOM 0 HA THR A 7 31.618 30.553 25.207 1.00 0.00 H new ATOM 0 HB THR A 7 33.204 32.241 24.874 1.00 0.00 H new ATOM 0 HG1 THR A 7 31.271 34.123 25.550 1.00 0.00 H new ATOM 0 HG21 THR A 7 32.099 33.165 22.764 1.00 0.00 H new ATOM 0 HG22 THR A 7 31.759 31.435 23.006 1.00 0.00 H new ATOM 0 HG23 THR A 7 30.525 32.651 23.416 1.00 0.00 H new ATOM 128 N LEU A 8 33.054 30.743 27.366 1.00 0.00 N ATOM 129 CA LEU A 8 33.845 30.545 28.558 1.00 0.00 C ATOM 130 C LEU A 8 34.295 31.820 29.274 1.00 0.00 C ATOM 131 O LEU A 8 34.769 31.740 30.406 1.00 0.00 O ATOM 132 CB LEU A 8 35.107 29.705 28.313 1.00 0.00 C ATOM 133 CG LEU A 8 34.765 28.312 27.792 1.00 0.00 C ATOM 134 CD1 LEU A 8 36.098 27.787 27.233 1.00 0.00 C ATOM 135 CD2 LEU A 8 34.106 27.493 28.903 1.00 0.00 C ATOM 0 H LEU A 8 33.445 30.196 26.599 1.00 0.00 H new ATOM 0 HA LEU A 8 33.139 30.019 29.200 1.00 0.00 H new ATOM 0 HB2 LEU A 8 35.750 30.215 27.595 1.00 0.00 H new ATOM 0 HB3 LEU A 8 35.672 29.618 29.241 1.00 0.00 H new ATOM 0 HG LEU A 8 34.020 28.271 26.997 1.00 0.00 H new ATOM 0 HD11 LEU A 8 35.954 26.784 26.832 1.00 0.00 H new ATOM 0 HD12 LEU A 8 36.445 28.448 26.439 1.00 0.00 H new ATOM 0 HD13 LEU A 8 36.840 27.756 28.031 1.00 0.00 H new ATOM 0 HD21 LEU A 8 33.863 26.499 28.527 1.00 0.00 H new ATOM 0 HD22 LEU A 8 34.792 27.405 29.746 1.00 0.00 H new ATOM 0 HD23 LEU A 8 33.193 27.991 29.229 1.00 0.00 H new ATOM 147 N THR A 9 34.248 32.981 28.625 1.00 0.00 N ATOM 148 CA THR A 9 34.501 34.266 29.239 1.00 0.00 C ATOM 149 C THR A 9 33.205 34.974 29.622 1.00 0.00 C ATOM 150 O THR A 9 33.208 36.153 29.980 1.00 0.00 O ATOM 151 CB THR A 9 35.410 35.167 28.398 1.00 0.00 C ATOM 152 OG1 THR A 9 36.111 36.104 29.190 1.00 0.00 O ATOM 153 CG2 THR A 9 34.677 35.869 27.256 1.00 0.00 C ATOM 0 H THR A 9 34.026 33.047 27.632 1.00 0.00 H new ATOM 0 HA THR A 9 35.049 34.057 30.158 1.00 0.00 H new ATOM 0 HB THR A 9 36.137 34.494 27.942 1.00 0.00 H new ATOM 0 HG1 THR A 9 35.487 36.545 29.804 1.00 0.00 H new ATOM 0 HG21 THR A 9 35.379 36.491 26.701 1.00 0.00 H new ATOM 0 HG22 THR A 9 34.246 35.124 26.588 1.00 0.00 H new ATOM 0 HG23 THR A 9 33.882 36.494 27.663 1.00 0.00 H new ATOM 161 N GLY A 10 32.053 34.323 29.486 1.00 0.00 N ATOM 162 CA GLY A 10 30.781 34.754 30.039 1.00 0.00 C ATOM 163 C GLY A 10 29.877 35.271 28.924 1.00 0.00 C ATOM 164 O GLY A 10 28.656 35.113 28.983 1.00 0.00 O ATOM 0 H GLY A 10 31.982 33.448 28.967 1.00 0.00 H new ATOM 0 HA2 GLY A 10 30.299 33.923 30.554 1.00 0.00 H new ATOM 0 HA3 GLY A 10 30.943 35.537 30.780 1.00 0.00 H new ATOM 168 N LYS A 11 30.476 35.936 27.940 1.00 0.00 N ATOM 169 CA LYS A 11 29.959 36.651 26.783 1.00 0.00 C ATOM 170 C LYS A 11 29.182 35.631 25.947 1.00 0.00 C ATOM 171 O LYS A 11 29.642 34.532 25.642 1.00 0.00 O ATOM 172 CB LYS A 11 31.124 37.233 25.982 1.00 0.00 C ATOM 173 CG LYS A 11 30.792 38.084 24.753 1.00 0.00 C ATOM 174 CD LYS A 11 31.983 38.442 23.865 1.00 0.00 C ATOM 175 CE LYS A 11 32.351 37.253 22.987 1.00 0.00 C ATOM 176 NZ LYS A 11 33.383 37.690 22.031 1.00 0.00 N ATOM 0 H LYS A 11 31.495 35.991 27.942 1.00 0.00 H new ATOM 0 HA LYS A 11 29.311 37.477 27.075 1.00 0.00 H new ATOM 0 HB2 LYS A 11 31.724 37.842 26.658 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.753 36.405 25.656 1.00 0.00 H new ATOM 0 HG2 LYS A 11 30.058 37.550 24.150 1.00 0.00 H new ATOM 0 HG3 LYS A 11 30.319 39.007 25.088 1.00 0.00 H new ATOM 0 HD2 LYS A 11 31.738 39.303 23.243 1.00 0.00 H new ATOM 0 HD3 LYS A 11 32.835 38.727 24.482 1.00 0.00 H new ATOM 0 HE2 LYS A 11 32.722 36.430 23.598 1.00 0.00 H new ATOM 0 HE3 LYS A 11 31.472 36.885 22.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 33.795 36.859 21.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 32.954 38.314 21.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 34.130 38.206 22.538 1.00 0.00 H new ATOM 190 N THR A 12 27.936 35.970 25.621 1.00 0.00 N ATOM 191 CA THR A 12 26.884 35.118 25.091 1.00 0.00 C ATOM 192 C THR A 12 26.464 35.639 23.719 1.00 0.00 C ATOM 193 O THR A 12 26.083 36.793 23.507 1.00 0.00 O ATOM 194 CB THR A 12 25.836 35.007 26.194 1.00 0.00 C ATOM 195 OG1 THR A 12 26.285 34.245 27.297 1.00 0.00 O ATOM 196 CG2 THR A 12 24.434 34.562 25.760 1.00 0.00 C ATOM 0 H THR A 12 27.614 36.931 25.732 1.00 0.00 H new ATOM 0 HA THR A 12 27.171 34.091 24.864 1.00 0.00 H new ATOM 0 HB THR A 12 25.712 36.045 26.504 1.00 0.00 H new ATOM 0 HG1 THR A 12 27.047 34.696 27.717 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.780 34.521 26.631 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.033 35.274 25.038 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.491 33.574 25.302 1.00 0.00 H new ATOM 204 N ILE A 13 26.550 34.752 22.731 1.00 0.00 N ATOM 205 CA ILE A 13 25.954 35.021 21.442 1.00 0.00 C ATOM 206 C ILE A 13 24.467 34.659 21.550 1.00 0.00 C ATOM 207 O ILE A 13 24.129 33.514 21.839 1.00 0.00 O ATOM 208 CB ILE A 13 26.758 34.343 20.329 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.268 34.303 20.515 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.419 34.832 18.920 1.00 0.00 C ATOM 211 CD1 ILE A 13 28.953 35.674 20.509 1.00 0.00 C ATOM 0 H ILE A 13 27.023 33.852 22.804 1.00 0.00 H new ATOM 0 HA ILE A 13 25.993 36.072 21.156 1.00 0.00 H new ATOM 0 HB ILE A 13 26.415 33.313 20.430 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.491 33.805 21.459 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.701 33.692 19.723 1.00 0.00 H new ATOM 0 HG21 ILE A 13 27.033 34.301 18.193 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.366 34.643 18.713 1.00 0.00 H new ATOM 0 HG23 ILE A 13 26.616 35.902 18.849 1.00 0.00 H new ATOM 0 HD11 ILE A 13 30.026 35.545 20.648 1.00 0.00 H new ATOM 0 HD12 ILE A 13 28.767 36.169 19.556 1.00 0.00 H new ATOM 0 HD13 ILE A 13 28.553 36.284 21.319 1.00 0.00 H new ATOM 223 N THR A 14 23.625 35.665 21.309 1.00 0.00 N ATOM 224 CA THR A 14 22.221 35.362 21.100 1.00 0.00 C ATOM 225 C THR A 14 22.039 34.745 19.713 1.00 0.00 C ATOM 226 O THR A 14 22.488 35.346 18.740 1.00 0.00 O ATOM 227 CB THR A 14 21.417 36.654 21.236 1.00 0.00 C ATOM 228 OG1 THR A 14 21.709 37.213 22.499 1.00 0.00 O ATOM 229 CG2 THR A 14 19.940 36.286 21.124 1.00 0.00 C ATOM 0 H THR A 14 23.880 36.651 21.256 1.00 0.00 H new ATOM 0 HA THR A 14 21.867 34.646 21.842 1.00 0.00 H new ATOM 0 HB THR A 14 21.664 37.382 20.464 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.557 36.542 23.197 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.333 37.186 21.217 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.753 35.821 20.156 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.678 35.588 21.919 1.00 0.00 H new ATOM 237 N LEU A 15 21.278 33.666 19.545 1.00 0.00 N ATOM 238 CA LEU A 15 21.121 33.112 18.209 1.00 0.00 C ATOM 239 C LEU A 15 19.661 32.969 17.783 1.00 0.00 C ATOM 240 O LEU A 15 18.873 32.389 18.530 1.00 0.00 O ATOM 241 CB LEU A 15 21.946 31.817 18.181 1.00 0.00 C ATOM 242 CG LEU A 15 23.241 31.868 17.373 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.144 30.654 17.609 1.00 0.00 C ATOM 244 CD2 LEU A 15 22.944 32.049 15.888 1.00 0.00 C ATOM 0 H LEU A 15 20.779 33.176 20.287 1.00 0.00 H new ATOM 0 HA LEU A 15 21.502 33.793 17.448 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.191 31.543 19.207 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.321 31.020 17.779 1.00 0.00 H new ATOM 0 HG LEU A 15 23.796 32.736 17.729 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.047 30.750 17.007 1.00 0.00 H new ATOM 0 HD12 LEU A 15 24.415 30.601 18.664 1.00 0.00 H new ATOM 0 HD13 LEU A 15 23.613 29.745 17.325 1.00 0.00 H new ATOM 0 HD21 LEU A 15 23.880 32.083 15.331 1.00 0.00 H new ATOM 0 HD22 LEU A 15 22.341 31.213 15.533 1.00 0.00 H new ATOM 0 HD23 LEU A 15 22.398 32.980 15.737 1.00 0.00 H new ATOM 256 N GLU A 16 19.332 33.467 16.597 1.00 0.00 N ATOM 257 CA GLU A 16 18.038 33.217 15.980 1.00 0.00 C ATOM 258 C GLU A 16 18.117 31.881 15.248 1.00 0.00 C ATOM 259 O GLU A 16 18.517 31.803 14.096 1.00 0.00 O ATOM 260 CB GLU A 16 17.705 34.389 15.048 1.00 0.00 C ATOM 261 CG GLU A 16 16.777 35.332 15.814 1.00 0.00 C ATOM 262 CD GLU A 16 17.511 36.416 16.576 1.00 0.00 C ATOM 263 OE1 GLU A 16 18.534 36.948 16.073 1.00 0.00 O ATOM 264 OE2 GLU A 16 16.968 36.988 17.543 1.00 0.00 O ATOM 0 H GLU A 16 19.953 34.053 16.039 1.00 0.00 H new ATOM 0 HA GLU A 16 17.236 33.151 16.715 1.00 0.00 H new ATOM 0 HB2 GLU A 16 18.614 34.908 14.744 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.223 34.031 14.138 1.00 0.00 H new ATOM 0 HG2 GLU A 16 16.085 35.797 15.112 1.00 0.00 H new ATOM 0 HG3 GLU A 16 16.177 34.750 16.514 1.00 0.00 H new ATOM 271 N VAL A 17 17.760 30.830 15.989 1.00 0.00 N ATOM 272 CA VAL A 17 17.717 29.472 15.493 1.00 0.00 C ATOM 273 C VAL A 17 16.291 29.062 15.116 1.00 0.00 C ATOM 274 O VAL A 17 15.362 29.766 15.503 1.00 0.00 O ATOM 275 CB VAL A 17 18.305 28.525 16.536 1.00 0.00 C ATOM 276 CG1 VAL A 17 19.802 28.741 16.726 1.00 0.00 C ATOM 277 CG2 VAL A 17 17.414 28.442 17.777 1.00 0.00 C ATOM 0 H VAL A 17 17.489 30.911 16.969 1.00 0.00 H new ATOM 0 HA VAL A 17 18.318 29.413 14.586 1.00 0.00 H new ATOM 0 HB VAL A 17 18.284 27.499 16.170 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.177 28.046 17.477 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.317 28.568 15.781 1.00 0.00 H new ATOM 0 HG13 VAL A 17 19.983 29.764 17.056 1.00 0.00 H new ATOM 0 HG21 VAL A 17 17.860 27.760 18.500 1.00 0.00 H new ATOM 0 HG22 VAL A 17 17.318 29.432 18.223 1.00 0.00 H new ATOM 0 HG23 VAL A 17 16.428 28.075 17.493 1.00 0.00 H new ATOM 287 N GLU A 18 16.158 27.973 14.363 1.00 0.00 N ATOM 288 CA GLU A 18 14.874 27.310 14.287 1.00 0.00 C ATOM 289 C GLU A 18 15.048 26.014 15.088 1.00 0.00 C ATOM 290 O GLU A 18 16.216 25.649 15.185 1.00 0.00 O ATOM 291 CB GLU A 18 14.714 27.014 12.790 1.00 0.00 C ATOM 292 CG GLU A 18 13.280 26.747 12.334 1.00 0.00 C ATOM 293 CD GLU A 18 12.393 27.961 12.572 1.00 0.00 C ATOM 294 OE1 GLU A 18 12.915 29.079 12.744 1.00 0.00 O ATOM 295 OE2 GLU A 18 11.157 27.792 12.667 1.00 0.00 O ATOM 0 H GLU A 18 16.904 27.546 13.814 1.00 0.00 H new ATOM 0 HA GLU A 18 14.017 27.864 14.670 1.00 0.00 H new ATOM 0 HB2 GLU A 18 15.108 27.858 12.224 1.00 0.00 H new ATOM 0 HB3 GLU A 18 15.326 26.148 12.539 1.00 0.00 H new ATOM 0 HG2 GLU A 18 13.274 26.491 11.275 1.00 0.00 H new ATOM 0 HG3 GLU A 18 12.878 25.888 12.872 1.00 0.00 H new ATOM 302 N PRO A 19 14.037 25.358 15.643 1.00 0.00 N ATOM 303 CA PRO A 19 14.149 24.044 16.230 1.00 0.00 C ATOM 304 C PRO A 19 14.609 22.893 15.335 1.00 0.00 C ATOM 305 O PRO A 19 15.119 21.894 15.829 1.00 0.00 O ATOM 306 CB PRO A 19 12.708 23.677 16.595 1.00 0.00 C ATOM 307 CG PRO A 19 12.074 25.036 16.890 1.00 0.00 C ATOM 308 CD PRO A 19 12.816 26.048 16.012 1.00 0.00 C ATOM 0 HA PRO A 19 14.898 24.130 17.017 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.202 23.164 15.777 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.666 23.015 17.460 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.009 25.028 16.660 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.170 25.291 17.945 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.230 26.321 15.134 1.00 0.00 H new ATOM 0 HD3 PRO A 19 13.026 26.970 16.554 1.00 0.00 H new ATOM 316 N SER A 20 14.386 23.029 14.027 1.00 0.00 N ATOM 317 CA SER A 20 14.757 22.024 13.042 1.00 0.00 C ATOM 318 C SER A 20 16.153 22.065 12.414 1.00 0.00 C ATOM 319 O SER A 20 16.562 21.282 11.557 1.00 0.00 O ATOM 320 CB SER A 20 13.740 22.307 11.931 1.00 0.00 C ATOM 321 OG SER A 20 13.948 23.630 11.480 1.00 0.00 O ATOM 0 H SER A 20 13.938 23.851 13.622 1.00 0.00 H new ATOM 0 HA SER A 20 14.764 21.052 13.536 1.00 0.00 H new ATOM 0 HB2 SER A 20 13.864 21.600 11.111 1.00 0.00 H new ATOM 0 HB3 SER A 20 12.723 22.186 12.305 1.00 0.00 H new ATOM 0 HG SER A 20 13.309 23.836 10.766 1.00 0.00 H new ATOM 327 N ASP A 21 16.957 23.021 12.850 1.00 0.00 N ATOM 328 CA ASP A 21 18.270 23.137 12.251 1.00 0.00 C ATOM 329 C ASP A 21 19.278 22.046 12.631 1.00 0.00 C ATOM 330 O ASP A 21 19.133 21.592 13.764 1.00 0.00 O ATOM 331 CB ASP A 21 18.747 24.522 12.707 1.00 0.00 C ATOM 332 CG ASP A 21 18.176 25.731 11.998 1.00 0.00 C ATOM 333 OD1 ASP A 21 17.717 25.696 10.838 1.00 0.00 O ATOM 334 OD2 ASP A 21 18.134 26.788 12.662 1.00 0.00 O ATOM 0 H ASP A 21 16.737 23.697 13.581 1.00 0.00 H new ATOM 0 HA ASP A 21 18.201 23.012 11.170 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.525 24.620 13.770 1.00 0.00 H new ATOM 0 HB3 ASP A 21 19.832 24.554 12.604 1.00 0.00 H new ATOM 339 N THR A 22 20.178 21.741 11.707 1.00 0.00 N ATOM 340 CA THR A 22 21.336 20.934 12.072 1.00 0.00 C ATOM 341 C THR A 22 22.234 21.697 13.046 1.00 0.00 C ATOM 342 O THR A 22 22.248 22.930 12.980 1.00 0.00 O ATOM 343 CB THR A 22 22.202 20.534 10.876 1.00 0.00 C ATOM 344 OG1 THR A 22 22.585 21.634 10.079 1.00 0.00 O ATOM 345 CG2 THR A 22 21.665 19.399 10.006 1.00 0.00 C ATOM 0 H THR A 22 20.135 22.028 10.729 1.00 0.00 H new ATOM 0 HA THR A 22 20.926 20.030 12.523 1.00 0.00 H new ATOM 0 HB THR A 22 23.089 20.125 11.360 1.00 0.00 H new ATOM 0 HG1 THR A 22 23.137 21.321 9.332 1.00 0.00 H new ATOM 0 HG21 THR A 22 22.362 19.204 9.191 1.00 0.00 H new ATOM 0 HG22 THR A 22 21.553 18.499 10.611 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.696 19.683 9.595 1.00 0.00 H new ATOM 353 N ILE A 23 22.981 21.032 13.918 1.00 0.00 N ATOM 354 CA ILE A 23 23.962 21.668 14.777 1.00 0.00 C ATOM 355 C ILE A 23 25.043 22.353 13.937 1.00 0.00 C ATOM 356 O ILE A 23 25.649 23.279 14.470 1.00 0.00 O ATOM 357 CB ILE A 23 24.523 20.560 15.658 1.00 0.00 C ATOM 358 CG1 ILE A 23 23.450 20.137 16.664 1.00 0.00 C ATOM 359 CG2 ILE A 23 25.879 20.840 16.314 1.00 0.00 C ATOM 360 CD1 ILE A 23 23.347 20.972 17.939 1.00 0.00 C ATOM 0 H ILE A 23 22.919 20.022 14.047 1.00 0.00 H new ATOM 0 HA ILE A 23 23.526 22.455 15.393 1.00 0.00 H new ATOM 0 HB ILE A 23 24.765 19.730 14.994 1.00 0.00 H new ATOM 0 HG12 ILE A 23 22.483 20.160 16.162 1.00 0.00 H new ATOM 0 HG13 ILE A 23 23.637 19.101 16.948 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.176 19.981 16.916 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.627 21.018 15.541 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.800 21.720 16.952 1.00 0.00 H new ATOM 0 HD11 ILE A 23 22.553 20.575 18.571 1.00 0.00 H new ATOM 0 HD12 ILE A 23 24.294 20.932 18.478 1.00 0.00 H new ATOM 0 HD13 ILE A 23 23.121 22.006 17.679 1.00 0.00 H new ATOM 372 N GLU A 24 25.394 21.920 12.725 1.00 0.00 N ATOM 373 CA GLU A 24 26.484 22.386 11.891 1.00 0.00 C ATOM 374 C GLU A 24 26.212 23.780 11.352 1.00 0.00 C ATOM 375 O GLU A 24 27.002 24.715 11.486 1.00 0.00 O ATOM 376 CB GLU A 24 26.778 21.407 10.754 1.00 0.00 C ATOM 377 CG GLU A 24 28.110 21.812 10.130 1.00 0.00 C ATOM 378 CD GLU A 24 28.027 22.451 8.759 1.00 0.00 C ATOM 379 OE1 GLU A 24 26.964 22.302 8.112 1.00 0.00 O ATOM 380 OE2 GLU A 24 28.971 23.150 8.331 1.00 0.00 O ATOM 0 H GLU A 24 24.873 21.170 12.270 1.00 0.00 H new ATOM 0 HA GLU A 24 27.373 22.439 12.520 1.00 0.00 H new ATOM 0 HB2 GLU A 24 26.827 20.385 11.131 1.00 0.00 H new ATOM 0 HB3 GLU A 24 25.982 21.434 10.010 1.00 0.00 H new ATOM 0 HG2 GLU A 24 28.610 22.507 10.805 1.00 0.00 H new ATOM 0 HG3 GLU A 24 28.741 20.926 10.060 1.00 0.00 H new ATOM 387 N ASN A 25 25.045 24.009 10.758 1.00 0.00 N ATOM 388 CA ASN A 25 24.488 25.286 10.331 1.00 0.00 C ATOM 389 C ASN A 25 24.528 26.348 11.439 1.00 0.00 C ATOM 390 O ASN A 25 24.919 27.495 11.252 1.00 0.00 O ATOM 391 CB ASN A 25 23.075 25.003 9.823 1.00 0.00 C ATOM 392 CG ASN A 25 22.476 26.023 8.860 1.00 0.00 C ATOM 393 OD1 ASN A 25 22.230 25.814 7.676 1.00 0.00 O ATOM 394 ND2 ASN A 25 22.321 27.217 9.406 1.00 0.00 N ATOM 0 H ASN A 25 24.411 23.239 10.545 1.00 0.00 H new ATOM 0 HA ASN A 25 25.092 25.718 9.533 1.00 0.00 H new ATOM 0 HB2 ASN A 25 23.079 24.031 9.330 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.414 24.920 10.685 1.00 0.00 H new ATOM 0 HD21 ASN A 25 21.988 27.997 8.840 1.00 0.00 H new ATOM 0 HD22 ASN A 25 22.534 27.358 10.393 1.00 0.00 H new ATOM 401 N VAL A 26 24.140 25.957 12.644 1.00 0.00 N ATOM 402 CA VAL A 26 24.024 26.805 13.817 1.00 0.00 C ATOM 403 C VAL A 26 25.437 27.170 14.284 1.00 0.00 C ATOM 404 O VAL A 26 25.693 28.345 14.545 1.00 0.00 O ATOM 405 CB VAL A 26 23.178 26.118 14.881 1.00 0.00 C ATOM 406 CG1 VAL A 26 23.185 26.729 16.282 1.00 0.00 C ATOM 407 CG2 VAL A 26 21.783 25.932 14.286 1.00 0.00 C ATOM 0 H VAL A 26 23.885 24.989 12.838 1.00 0.00 H new ATOM 0 HA VAL A 26 23.503 27.735 13.589 1.00 0.00 H new ATOM 0 HB VAL A 26 23.643 25.158 15.107 1.00 0.00 H new ATOM 0 HG11 VAL A 26 22.542 26.142 16.938 1.00 0.00 H new ATOM 0 HG12 VAL A 26 24.202 26.728 16.674 1.00 0.00 H new ATOM 0 HG13 VAL A 26 22.816 27.753 16.234 1.00 0.00 H new ATOM 0 HG21 VAL A 26 21.139 25.441 15.016 1.00 0.00 H new ATOM 0 HG22 VAL A 26 21.365 26.905 14.029 1.00 0.00 H new ATOM 0 HG23 VAL A 26 21.849 25.317 13.389 1.00 0.00 H new ATOM 417 N LYS A 27 26.347 26.205 14.358 1.00 0.00 N ATOM 418 CA LYS A 27 27.730 26.389 14.741 1.00 0.00 C ATOM 419 C LYS A 27 28.539 27.273 13.786 1.00 0.00 C ATOM 420 O LYS A 27 29.449 27.976 14.212 1.00 0.00 O ATOM 421 CB LYS A 27 28.477 25.065 14.703 1.00 0.00 C ATOM 422 CG LYS A 27 28.399 24.240 15.988 1.00 0.00 C ATOM 423 CD LYS A 27 29.343 23.036 15.993 1.00 0.00 C ATOM 424 CE LYS A 27 29.407 22.318 17.340 1.00 0.00 C ATOM 425 NZ LYS A 27 30.477 21.305 17.395 1.00 0.00 N ATOM 0 H LYS A 27 26.125 25.233 14.142 1.00 0.00 H new ATOM 0 HA LYS A 27 27.662 26.844 15.729 1.00 0.00 H new ATOM 0 HB2 LYS A 27 28.084 24.467 13.881 1.00 0.00 H new ATOM 0 HB3 LYS A 27 29.525 25.263 14.480 1.00 0.00 H new ATOM 0 HG2 LYS A 27 28.634 24.881 16.838 1.00 0.00 H new ATOM 0 HG3 LYS A 27 27.376 23.891 16.126 1.00 0.00 H new ATOM 0 HD2 LYS A 27 29.022 22.329 15.228 1.00 0.00 H new ATOM 0 HD3 LYS A 27 30.344 23.368 15.719 1.00 0.00 H new ATOM 0 HE2 LYS A 27 29.566 23.051 18.131 1.00 0.00 H new ATOM 0 HE3 LYS A 27 28.448 21.839 17.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 30.868 21.265 18.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 30.088 20.375 17.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 31.231 21.559 16.725 1.00 0.00 H new ATOM 439 N ALA A 28 28.242 27.294 12.488 1.00 0.00 N ATOM 440 CA ALA A 28 28.807 28.071 11.413 1.00 0.00 C ATOM 441 C ALA A 28 28.630 29.582 11.591 1.00 0.00 C ATOM 442 O ALA A 28 29.376 30.351 10.983 1.00 0.00 O ATOM 443 CB ALA A 28 28.098 27.694 10.111 1.00 0.00 C ATOM 0 H ALA A 28 27.505 26.685 12.133 1.00 0.00 H new ATOM 0 HA ALA A 28 29.874 27.850 11.401 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.515 28.274 9.288 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.240 26.631 9.914 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.033 27.907 10.202 1.00 0.00 H new ATOM 449 N LYS A 29 27.771 30.079 12.478 1.00 0.00 N ATOM 450 CA LYS A 29 27.630 31.491 12.782 1.00 0.00 C ATOM 451 C LYS A 29 28.719 31.843 13.802 1.00 0.00 C ATOM 452 O LYS A 29 29.202 32.969 13.792 1.00 0.00 O ATOM 453 CB LYS A 29 26.218 31.758 13.290 1.00 0.00 C ATOM 454 CG LYS A 29 25.108 32.064 12.286 1.00 0.00 C ATOM 455 CD LYS A 29 24.022 30.989 12.392 1.00 0.00 C ATOM 456 CE LYS A 29 23.133 31.020 11.149 1.00 0.00 C ATOM 457 NZ LYS A 29 21.948 31.874 11.296 1.00 0.00 N ATOM 0 H LYS A 29 27.138 29.489 13.018 1.00 0.00 H new ATOM 0 HA LYS A 29 27.762 32.123 11.904 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.907 30.887 13.867 1.00 0.00 H new ATOM 0 HB3 LYS A 29 26.273 32.597 13.984 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.683 33.048 12.484 1.00 0.00 H new ATOM 0 HG3 LYS A 29 25.513 32.090 11.274 1.00 0.00 H new ATOM 0 HD2 LYS A 29 24.481 30.006 12.497 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.419 31.156 13.285 1.00 0.00 H new ATOM 0 HE2 LYS A 29 23.721 31.371 10.301 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.812 30.005 10.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 21.391 31.849 10.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 21.366 31.528 12.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 22.246 32.851 11.489 1.00 0.00 H new ATOM 471 N ILE A 30 29.123 30.925 14.667 1.00 0.00 N ATOM 472 CA ILE A 30 30.203 31.249 15.584 1.00 0.00 C ATOM 473 C ILE A 30 31.549 31.084 14.883 1.00 0.00 C ATOM 474 O ILE A 30 32.503 31.736 15.324 1.00 0.00 O ATOM 475 CB ILE A 30 30.135 30.283 16.770 1.00 0.00 C ATOM 476 CG1 ILE A 30 28.778 30.343 17.473 1.00 0.00 C ATOM 477 CG2 ILE A 30 31.225 30.416 17.837 1.00 0.00 C ATOM 478 CD1 ILE A 30 28.388 31.668 18.122 1.00 0.00 C ATOM 0 H ILE A 30 28.737 29.985 14.753 1.00 0.00 H new ATOM 0 HA ILE A 30 30.102 32.280 15.922 1.00 0.00 H new ATOM 0 HB ILE A 30 30.301 29.321 16.285 1.00 0.00 H new ATOM 0 HG12 ILE A 30 28.009 30.084 16.746 1.00 0.00 H new ATOM 0 HG13 ILE A 30 28.762 29.572 18.243 1.00 0.00 H new ATOM 0 HG21 ILE A 30 31.061 29.675 18.619 1.00 0.00 H new ATOM 0 HG22 ILE A 30 32.202 30.253 17.382 1.00 0.00 H new ATOM 0 HG23 ILE A 30 31.190 31.415 18.271 1.00 0.00 H new ATOM 0 HD11 ILE A 30 27.405 31.572 18.583 1.00 0.00 H new ATOM 0 HD12 ILE A 30 29.122 31.930 18.884 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.358 32.450 17.363 1.00 0.00 H new ATOM 490 N GLN A 31 31.654 30.568 13.662 1.00 0.00 N ATOM 491 CA GLN A 31 32.832 30.711 12.839 1.00 0.00 C ATOM 492 C GLN A 31 32.864 32.127 12.250 1.00 0.00 C ATOM 493 O GLN A 31 33.920 32.703 12.047 1.00 0.00 O ATOM 494 CB GLN A 31 33.007 29.707 11.698 1.00 0.00 C ATOM 495 CG GLN A 31 34.379 29.629 11.035 1.00 0.00 C ATOM 496 CD GLN A 31 34.623 28.293 10.349 1.00 0.00 C ATOM 497 OE1 GLN A 31 35.717 27.840 10.003 1.00 0.00 O ATOM 498 NE2 GLN A 31 33.547 27.605 9.985 1.00 0.00 N ATOM 0 H GLN A 31 30.908 30.033 13.218 1.00 0.00 H new ATOM 0 HA GLN A 31 33.659 30.507 13.519 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.761 28.716 12.080 1.00 0.00 H new ATOM 0 HB3 GLN A 31 32.273 29.942 10.927 1.00 0.00 H new ATOM 0 HG2 GLN A 31 34.471 30.431 10.303 1.00 0.00 H new ATOM 0 HG3 GLN A 31 35.151 29.794 11.786 1.00 0.00 H new ATOM 0 HE21 GLN A 31 32.618 27.936 10.245 1.00 0.00 H new ATOM 0 HE22 GLN A 31 33.650 26.746 9.445 1.00 0.00 H new ATOM 507 N ASP A 32 31.704 32.740 12.042 1.00 0.00 N ATOM 508 CA ASP A 32 31.476 33.902 11.207 1.00 0.00 C ATOM 509 C ASP A 32 31.854 35.110 12.072 1.00 0.00 C ATOM 510 O ASP A 32 32.650 35.933 11.612 1.00 0.00 O ATOM 511 CB ASP A 32 30.020 34.117 10.804 1.00 0.00 C ATOM 512 CG ASP A 32 29.507 35.502 10.424 1.00 0.00 C ATOM 513 OD1 ASP A 32 29.064 36.265 11.302 1.00 0.00 O ATOM 514 OD2 ASP A 32 29.511 35.908 9.245 1.00 0.00 O ATOM 0 H ASP A 32 30.845 32.413 12.484 1.00 0.00 H new ATOM 0 HA ASP A 32 32.051 33.769 10.291 1.00 0.00 H new ATOM 0 HB2 ASP A 32 29.823 33.460 9.957 1.00 0.00 H new ATOM 0 HB3 ASP A 32 29.404 33.764 11.631 1.00 0.00 H new ATOM 519 N LYS A 33 31.363 35.124 13.307 1.00 0.00 N ATOM 520 CA LYS A 33 31.575 36.111 14.348 1.00 0.00 C ATOM 521 C LYS A 33 32.974 36.027 14.945 1.00 0.00 C ATOM 522 O LYS A 33 33.848 36.845 14.673 1.00 0.00 O ATOM 523 CB LYS A 33 30.537 35.988 15.461 1.00 0.00 C ATOM 524 CG LYS A 33 29.184 36.544 14.998 1.00 0.00 C ATOM 525 CD LYS A 33 28.162 36.430 16.125 1.00 0.00 C ATOM 526 CE LYS A 33 26.787 37.016 15.824 1.00 0.00 C ATOM 527 NZ LYS A 33 26.842 38.369 15.252 1.00 0.00 N ATOM 0 H LYS A 33 30.751 34.374 13.629 1.00 0.00 H new ATOM 0 HA LYS A 33 31.465 37.083 13.868 1.00 0.00 H new ATOM 0 HB2 LYS A 33 30.428 34.943 15.750 1.00 0.00 H new ATOM 0 HB3 LYS A 33 30.876 36.529 16.344 1.00 0.00 H new ATOM 0 HG2 LYS A 33 29.293 37.586 14.698 1.00 0.00 H new ATOM 0 HG3 LYS A 33 28.836 35.995 14.123 1.00 0.00 H new ATOM 0 HD2 LYS A 33 28.042 35.377 16.378 1.00 0.00 H new ATOM 0 HD3 LYS A 33 28.564 36.926 17.008 1.00 0.00 H new ATOM 0 HE2 LYS A 33 26.263 36.358 15.131 1.00 0.00 H new ATOM 0 HE3 LYS A 33 26.202 37.042 16.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 25.877 38.742 15.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 27.389 38.990 15.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 27.300 38.333 14.319 1.00 0.00 H new ATOM 541 N GLU A 34 33.127 34.968 15.743 1.00 0.00 N ATOM 542 CA GLU A 34 34.206 34.707 16.671 1.00 0.00 C ATOM 543 C GLU A 34 35.459 34.037 16.113 1.00 0.00 C ATOM 544 O GLU A 34 36.543 34.115 16.682 1.00 0.00 O ATOM 545 CB GLU A 34 33.766 33.830 17.843 1.00 0.00 C ATOM 546 CG GLU A 34 32.650 34.462 18.674 1.00 0.00 C ATOM 547 CD GLU A 34 32.866 35.656 19.593 1.00 0.00 C ATOM 548 OE1 GLU A 34 33.409 35.436 20.698 1.00 0.00 O ATOM 549 OE2 GLU A 34 32.830 36.789 19.064 1.00 0.00 O ATOM 0 H GLU A 34 32.438 34.216 15.750 1.00 0.00 H new ATOM 0 HA GLU A 34 34.466 35.724 16.964 1.00 0.00 H new ATOM 0 HB2 GLU A 34 33.427 32.867 17.462 1.00 0.00 H new ATOM 0 HB3 GLU A 34 34.624 33.634 18.486 1.00 0.00 H new ATOM 0 HG2 GLU A 34 31.869 34.752 17.971 1.00 0.00 H new ATOM 0 HG3 GLU A 34 32.240 33.666 19.295 1.00 0.00 H new ATOM 556 N GLY A 35 35.360 33.442 14.933 1.00 0.00 N ATOM 557 CA GLY A 35 36.426 32.749 14.236 1.00 0.00 C ATOM 558 C GLY A 35 36.406 31.233 14.476 1.00 0.00 C ATOM 559 O GLY A 35 37.296 30.569 13.946 1.00 0.00 O ATOM 0 H GLY A 35 34.484 33.431 14.410 1.00 0.00 H new ATOM 0 HA2 GLY A 35 36.342 32.944 13.167 1.00 0.00 H new ATOM 0 HA3 GLY A 35 37.386 33.151 14.559 1.00 0.00 H new ATOM 563 N ILE A 36 35.604 30.649 15.355 1.00 0.00 N ATOM 564 CA ILE A 36 35.835 29.300 15.816 1.00 0.00 C ATOM 565 C ILE A 36 35.335 28.253 14.818 1.00 0.00 C ATOM 566 O ILE A 36 34.113 28.261 14.627 1.00 0.00 O ATOM 567 CB ILE A 36 35.368 29.182 17.260 1.00 0.00 C ATOM 568 CG1 ILE A 36 35.901 30.212 18.259 1.00 0.00 C ATOM 569 CG2 ILE A 36 35.557 27.792 17.861 1.00 0.00 C ATOM 570 CD1 ILE A 36 37.400 30.310 18.553 1.00 0.00 C ATOM 0 H ILE A 36 34.783 31.098 15.762 1.00 0.00 H new ATOM 0 HA ILE A 36 36.900 29.069 15.846 1.00 0.00 H new ATOM 0 HB ILE A 36 34.308 29.400 17.127 1.00 0.00 H new ATOM 0 HG12 ILE A 36 35.577 31.193 17.912 1.00 0.00 H new ATOM 0 HG13 ILE A 36 35.399 30.028 19.209 1.00 0.00 H new ATOM 0 HG21 ILE A 36 35.201 27.789 18.891 1.00 0.00 H new ATOM 0 HG22 ILE A 36 34.991 27.064 17.279 1.00 0.00 H new ATOM 0 HG23 ILE A 36 36.614 27.528 17.842 1.00 0.00 H new ATOM 0 HD11 ILE A 36 37.576 31.098 19.285 1.00 0.00 H new ATOM 0 HD12 ILE A 36 37.756 29.359 18.950 1.00 0.00 H new ATOM 0 HD13 ILE A 36 37.937 30.543 17.633 1.00 0.00 H new ATOM 582 N PRO A 37 36.085 27.386 14.149 1.00 0.00 N ATOM 583 CA PRO A 37 35.604 26.283 13.349 1.00 0.00 C ATOM 584 C PRO A 37 34.685 25.318 14.108 1.00 0.00 C ATOM 585 O PRO A 37 34.935 25.211 15.312 1.00 0.00 O ATOM 586 CB PRO A 37 36.861 25.654 12.750 1.00 0.00 C ATOM 587 CG PRO A 37 38.037 26.079 13.647 1.00 0.00 C ATOM 588 CD PRO A 37 37.528 27.354 14.306 1.00 0.00 C ATOM 0 HA PRO A 37 34.933 26.618 12.558 1.00 0.00 H new ATOM 0 HB2 PRO A 37 36.772 24.568 12.716 1.00 0.00 H new ATOM 0 HB3 PRO A 37 37.013 25.993 11.725 1.00 0.00 H new ATOM 0 HG2 PRO A 37 38.278 25.313 14.384 1.00 0.00 H new ATOM 0 HG3 PRO A 37 38.942 26.259 13.066 1.00 0.00 H new ATOM 0 HD2 PRO A 37 37.798 27.373 15.362 1.00 0.00 H new ATOM 0 HD3 PRO A 37 37.982 28.231 13.845 1.00 0.00 H new ATOM 596 N PRO A 38 33.854 24.491 13.472 1.00 0.00 N ATOM 597 CA PRO A 38 32.982 23.684 14.291 1.00 0.00 C ATOM 598 C PRO A 38 33.543 22.481 15.052 1.00 0.00 C ATOM 599 O PRO A 38 32.742 21.843 15.729 1.00 0.00 O ATOM 600 CB PRO A 38 31.980 23.099 13.296 1.00 0.00 C ATOM 601 CG PRO A 38 32.625 23.267 11.913 1.00 0.00 C ATOM 602 CD PRO A 38 33.597 24.432 12.054 1.00 0.00 C ATOM 0 HA PRO A 38 32.637 24.352 15.080 1.00 0.00 H new ATOM 0 HB2 PRO A 38 31.782 22.049 13.511 1.00 0.00 H new ATOM 0 HB3 PRO A 38 31.025 23.621 13.349 1.00 0.00 H new ATOM 0 HG2 PRO A 38 33.144 22.358 11.609 1.00 0.00 H new ATOM 0 HG3 PRO A 38 31.873 23.474 11.152 1.00 0.00 H new ATOM 0 HD2 PRO A 38 34.512 24.261 11.488 1.00 0.00 H new ATOM 0 HD3 PRO A 38 33.164 25.362 11.686 1.00 0.00 H new ATOM 610 N ASP A 39 34.861 22.279 15.029 1.00 0.00 N ATOM 611 CA ASP A 39 35.591 21.269 15.774 1.00 0.00 C ATOM 612 C ASP A 39 36.390 21.719 16.995 1.00 0.00 C ATOM 613 O ASP A 39 36.973 20.989 17.792 1.00 0.00 O ATOM 614 CB ASP A 39 36.642 20.901 14.721 1.00 0.00 C ATOM 615 CG ASP A 39 36.106 20.012 13.613 1.00 0.00 C ATOM 616 OD1 ASP A 39 35.084 19.312 13.746 1.00 0.00 O ATOM 617 OD2 ASP A 39 36.798 19.838 12.587 1.00 0.00 O ATOM 0 H ASP A 39 35.478 22.853 14.454 1.00 0.00 H new ATOM 0 HA ASP A 39 34.895 20.529 16.169 1.00 0.00 H new ATOM 0 HB2 ASP A 39 37.040 21.816 14.281 1.00 0.00 H new ATOM 0 HB3 ASP A 39 37.474 20.395 15.211 1.00 0.00 H new ATOM 622 N GLN A 40 36.434 23.043 17.168 1.00 0.00 N ATOM 623 CA GLN A 40 36.770 23.706 18.414 1.00 0.00 C ATOM 624 C GLN A 40 35.570 24.162 19.237 1.00 0.00 C ATOM 625 O GLN A 40 35.690 24.603 20.379 1.00 0.00 O ATOM 626 CB GLN A 40 37.588 24.947 18.079 1.00 0.00 C ATOM 627 CG GLN A 40 38.892 24.651 17.337 1.00 0.00 C ATOM 628 CD GLN A 40 39.770 25.885 17.230 1.00 0.00 C ATOM 629 OE1 GLN A 40 39.311 27.001 17.467 1.00 0.00 O ATOM 630 NE2 GLN A 40 41.084 25.695 17.114 1.00 0.00 N ATOM 0 H GLN A 40 36.228 23.698 16.414 1.00 0.00 H new ATOM 0 HA GLN A 40 37.308 22.973 19.016 1.00 0.00 H new ATOM 0 HB2 GLN A 40 36.980 25.617 17.471 1.00 0.00 H new ATOM 0 HB3 GLN A 40 37.820 25.477 19.003 1.00 0.00 H new ATOM 0 HG2 GLN A 40 39.435 23.862 17.857 1.00 0.00 H new ATOM 0 HG3 GLN A 40 38.666 24.278 16.338 1.00 0.00 H new ATOM 0 HE21 GLN A 40 41.449 24.763 16.917 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.725 26.481 17.222 1.00 0.00 H new ATOM 639 N GLN A 41 34.353 24.039 18.697 1.00 0.00 N ATOM 640 CA GLN A 41 33.106 24.216 19.406 1.00 0.00 C ATOM 641 C GLN A 41 32.534 23.016 20.168 1.00 0.00 C ATOM 642 O GLN A 41 31.595 22.423 19.620 1.00 0.00 O ATOM 643 CB GLN A 41 32.148 24.764 18.344 1.00 0.00 C ATOM 644 CG GLN A 41 32.483 26.101 17.697 1.00 0.00 C ATOM 645 CD GLN A 41 31.324 26.620 16.857 1.00 0.00 C ATOM 646 OE1 GLN A 41 30.166 26.554 17.254 1.00 0.00 O ATOM 647 NE2 GLN A 41 31.604 27.091 15.645 1.00 0.00 N ATOM 0 H GLN A 41 34.217 23.804 17.714 1.00 0.00 H new ATOM 0 HA GLN A 41 33.273 24.888 20.248 1.00 0.00 H new ATOM 0 HB2 GLN A 41 32.069 24.020 17.551 1.00 0.00 H new ATOM 0 HB3 GLN A 41 31.161 24.852 18.799 1.00 0.00 H new ATOM 0 HG2 GLN A 41 32.728 26.829 18.470 1.00 0.00 H new ATOM 0 HG3 GLN A 41 33.368 25.991 17.070 1.00 0.00 H new ATOM 0 HE21 GLN A 41 32.572 27.140 15.328 1.00 0.00 H new ATOM 0 HE22 GLN A 41 30.850 27.403 15.033 1.00 0.00 H new ATOM 656 N ARG A 42 32.931 22.774 21.412 1.00 0.00 N ATOM 657 CA ARG A 42 32.596 21.578 22.159 1.00 0.00 C ATOM 658 C ARG A 42 31.346 21.999 22.933 1.00 0.00 C ATOM 659 O ARG A 42 31.467 22.688 23.953 1.00 0.00 O ATOM 660 CB ARG A 42 33.769 21.299 23.086 1.00 0.00 C ATOM 661 CG ARG A 42 33.464 20.322 24.232 1.00 0.00 C ATOM 662 CD ARG A 42 34.663 20.281 25.175 1.00 0.00 C ATOM 663 NE ARG A 42 34.971 18.872 25.412 1.00 0.00 N ATOM 664 CZ ARG A 42 34.951 18.210 26.572 1.00 0.00 C ATOM 665 NH1 ARG A 42 34.805 18.836 27.743 1.00 0.00 N ATOM 666 NH2 ARG A 42 35.176 16.886 26.546 1.00 0.00 N ATOM 0 H ARG A 42 33.511 23.426 21.940 1.00 0.00 H new ATOM 0 HA ARG A 42 32.415 20.679 21.570 1.00 0.00 H new ATOM 0 HB2 ARG A 42 34.594 20.899 22.496 1.00 0.00 H new ATOM 0 HB3 ARG A 42 34.110 22.242 23.512 1.00 0.00 H new ATOM 0 HG2 ARG A 42 32.571 20.639 24.771 1.00 0.00 H new ATOM 0 HG3 ARG A 42 33.261 19.327 23.836 1.00 0.00 H new ATOM 0 HD2 ARG A 42 35.518 20.794 24.735 1.00 0.00 H new ATOM 0 HD3 ARG A 42 34.435 20.789 26.112 1.00 0.00 H new ATOM 0 HE ARG A 42 35.233 18.327 24.591 1.00 0.00 H new ATOM 0 HH11 ARG A 42 34.704 19.851 27.770 1.00 0.00 H new ATOM 0 HH12 ARG A 42 34.794 18.299 28.610 1.00 0.00 H new ATOM 0 HH21 ARG A 42 35.355 16.416 25.658 1.00 0.00 H new ATOM 0 HH22 ARG A 42 35.168 16.350 27.414 1.00 0.00 H new ATOM 680 N LEU A 43 30.158 21.680 22.440 1.00 0.00 N ATOM 681 CA LEU A 43 28.924 22.292 22.870 1.00 0.00 C ATOM 682 C LEU A 43 28.363 21.403 23.978 1.00 0.00 C ATOM 683 O LEU A 43 28.422 20.183 23.860 1.00 0.00 O ATOM 684 CB LEU A 43 27.866 22.237 21.756 1.00 0.00 C ATOM 685 CG LEU A 43 27.722 23.526 20.958 1.00 0.00 C ATOM 686 CD1 LEU A 43 26.825 23.386 19.732 1.00 0.00 C ATOM 687 CD2 LEU A 43 27.105 24.614 21.853 1.00 0.00 C ATOM 0 H LEU A 43 30.030 20.973 21.716 1.00 0.00 H new ATOM 0 HA LEU A 43 29.122 23.323 23.164 1.00 0.00 H new ATOM 0 HB2 LEU A 43 28.119 21.427 21.072 1.00 0.00 H new ATOM 0 HB3 LEU A 43 26.902 21.990 22.200 1.00 0.00 H new ATOM 0 HG LEU A 43 28.725 23.785 20.619 1.00 0.00 H new ATOM 0 HD11 LEU A 43 26.768 24.342 19.212 1.00 0.00 H new ATOM 0 HD12 LEU A 43 27.239 22.633 19.062 1.00 0.00 H new ATOM 0 HD13 LEU A 43 25.826 23.083 20.045 1.00 0.00 H new ATOM 0 HD21 LEU A 43 27.001 25.538 21.284 1.00 0.00 H new ATOM 0 HD22 LEU A 43 26.124 24.288 22.198 1.00 0.00 H new ATOM 0 HD23 LEU A 43 27.752 24.788 22.712 1.00 0.00 H new ATOM 699 N ILE A 44 27.831 22.029 25.025 1.00 0.00 N ATOM 700 CA ILE A 44 27.199 21.402 26.171 1.00 0.00 C ATOM 701 C ILE A 44 25.913 22.148 26.534 1.00 0.00 C ATOM 702 O ILE A 44 25.849 23.359 26.346 1.00 0.00 O ATOM 703 CB ILE A 44 28.218 21.268 27.312 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.603 20.705 26.982 1.00 0.00 C ATOM 705 CG2 ILE A 44 27.754 20.461 28.520 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.654 20.739 28.089 1.00 0.00 C ATOM 0 H ILE A 44 27.832 23.047 25.095 1.00 0.00 H new ATOM 0 HA ILE A 44 26.883 20.385 25.938 1.00 0.00 H new ATOM 0 HB ILE A 44 28.301 22.333 27.531 1.00 0.00 H new ATOM 0 HG12 ILE A 44 29.480 19.669 26.666 1.00 0.00 H new ATOM 0 HG13 ILE A 44 29.996 21.255 26.127 1.00 0.00 H new ATOM 0 HG21 ILE A 44 28.550 20.430 29.264 1.00 0.00 H new ATOM 0 HG22 ILE A 44 26.870 20.930 28.953 1.00 0.00 H new ATOM 0 HG23 ILE A 44 27.510 19.446 28.207 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.586 20.310 27.720 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.826 21.771 28.396 1.00 0.00 H new ATOM 0 HD13 ILE A 44 30.302 20.160 28.943 1.00 0.00 H new ATOM 718 N PHE A 45 24.862 21.380 26.801 1.00 0.00 N ATOM 719 CA PHE A 45 23.502 21.746 27.145 1.00 0.00 C ATOM 720 C PHE A 45 23.170 20.944 28.407 1.00 0.00 C ATOM 721 O PHE A 45 23.013 19.732 28.351 1.00 0.00 O ATOM 722 CB PHE A 45 22.443 21.529 26.061 1.00 0.00 C ATOM 723 CG PHE A 45 21.029 21.919 26.403 1.00 0.00 C ATOM 724 CD1 PHE A 45 20.850 23.182 26.996 1.00 0.00 C ATOM 725 CD2 PHE A 45 19.975 21.012 26.308 1.00 0.00 C ATOM 726 CE1 PHE A 45 19.606 23.535 27.543 1.00 0.00 C ATOM 727 CE2 PHE A 45 18.725 21.369 26.834 1.00 0.00 C ATOM 728 CZ PHE A 45 18.556 22.623 27.426 1.00 0.00 C ATOM 0 H PHE A 45 24.961 20.365 26.777 1.00 0.00 H new ATOM 0 HA PHE A 45 23.467 22.826 27.288 1.00 0.00 H new ATOM 0 HB2 PHE A 45 22.744 22.088 25.175 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.448 20.474 25.789 1.00 0.00 H new ATOM 0 HD1 PHE A 45 21.672 23.882 27.031 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.118 20.051 25.837 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.466 24.484 28.039 1.00 0.00 H new ATOM 0 HE2 PHE A 45 17.897 20.678 26.782 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.582 22.895 27.805 1.00 0.00 H new ATOM 738 N ALA A 46 23.095 21.557 29.586 1.00 0.00 N ATOM 739 CA ALA A 46 22.560 21.024 30.824 1.00 0.00 C ATOM 740 C ALA A 46 23.168 19.696 31.277 1.00 0.00 C ATOM 741 O ALA A 46 22.527 18.751 31.729 1.00 0.00 O ATOM 742 CB ALA A 46 21.046 20.896 30.687 1.00 0.00 C ATOM 0 H ALA A 46 23.434 22.512 29.703 1.00 0.00 H new ATOM 0 HA ALA A 46 22.833 21.731 31.607 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.630 20.496 31.611 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.614 21.877 30.489 1.00 0.00 H new ATOM 0 HB3 ALA A 46 20.811 20.223 29.862 1.00 0.00 H new ATOM 748 N GLY A 47 24.487 19.594 31.144 1.00 0.00 N ATOM 749 CA GLY A 47 25.266 18.422 31.477 1.00 0.00 C ATOM 750 C GLY A 47 25.625 17.542 30.272 1.00 0.00 C ATOM 751 O GLY A 47 26.668 16.885 30.302 1.00 0.00 O ATOM 0 H GLY A 47 25.058 20.360 30.787 1.00 0.00 H new ATOM 0 HA2 GLY A 47 26.186 18.739 31.968 1.00 0.00 H new ATOM 0 HA3 GLY A 47 24.710 17.822 32.198 1.00 0.00 H new ATOM 755 N LYS A 48 24.806 17.626 29.233 1.00 0.00 N ATOM 756 CA LYS A 48 24.919 16.714 28.106 1.00 0.00 C ATOM 757 C LYS A 48 25.808 17.462 27.116 1.00 0.00 C ATOM 758 O LYS A 48 25.473 18.544 26.631 1.00 0.00 O ATOM 759 CB LYS A 48 23.545 16.488 27.472 1.00 0.00 C ATOM 760 CG LYS A 48 23.520 15.387 26.409 1.00 0.00 C ATOM 761 CD LYS A 48 22.179 15.152 25.705 1.00 0.00 C ATOM 762 CE LYS A 48 21.170 14.364 26.539 1.00 0.00 C ATOM 763 NZ LYS A 48 19.797 14.441 26.028 1.00 0.00 N ATOM 0 H LYS A 48 24.058 18.315 29.148 1.00 0.00 H new ATOM 0 HA LYS A 48 25.314 15.740 28.395 1.00 0.00 H new ATOM 0 HB2 LYS A 48 22.832 16.236 28.257 1.00 0.00 H new ATOM 0 HB3 LYS A 48 23.207 17.421 27.021 1.00 0.00 H new ATOM 0 HG2 LYS A 48 24.267 15.626 25.652 1.00 0.00 H new ATOM 0 HG3 LYS A 48 23.829 14.452 26.877 1.00 0.00 H new ATOM 0 HD2 LYS A 48 21.744 16.116 25.443 1.00 0.00 H new ATOM 0 HD3 LYS A 48 22.359 14.619 24.771 1.00 0.00 H new ATOM 0 HE2 LYS A 48 21.478 13.319 26.574 1.00 0.00 H new ATOM 0 HE3 LYS A 48 21.189 14.736 27.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 19.167 13.885 26.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 19.485 15.433 26.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 19.765 14.060 25.061 1.00 0.00 H new ATOM 777 N GLN A 49 27.001 16.910 26.885 1.00 0.00 N ATOM 778 CA GLN A 49 27.819 17.403 25.795 1.00 0.00 C ATOM 779 C GLN A 49 27.268 16.697 24.566 1.00 0.00 C ATOM 780 O GLN A 49 27.016 15.496 24.582 1.00 0.00 O ATOM 781 CB GLN A 49 29.214 16.843 26.085 1.00 0.00 C ATOM 782 CG GLN A 49 30.250 17.144 25.010 1.00 0.00 C ATOM 783 CD GLN A 49 31.693 16.717 25.250 1.00 0.00 C ATOM 784 OE1 GLN A 49 32.578 16.946 24.424 1.00 0.00 O ATOM 785 NE2 GLN A 49 32.017 16.180 26.424 1.00 0.00 N ATOM 0 H GLN A 49 27.406 16.145 27.424 1.00 0.00 H new ATOM 0 HA GLN A 49 27.833 18.486 25.672 1.00 0.00 H new ATOM 0 HB2 GLN A 49 29.565 17.249 27.034 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.140 15.763 26.208 1.00 0.00 H new ATOM 0 HG2 GLN A 49 29.915 16.674 24.086 1.00 0.00 H new ATOM 0 HG3 GLN A 49 30.247 18.221 24.839 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.291 15.987 27.114 1.00 0.00 H new ATOM 0 HE22 GLN A 49 32.991 15.962 26.634 1.00 0.00 H new ATOM 794 N LEU A 50 27.199 17.437 23.465 1.00 0.00 N ATOM 795 CA LEU A 50 26.635 17.141 22.166 1.00 0.00 C ATOM 796 C LEU A 50 27.753 16.738 21.209 1.00 0.00 C ATOM 797 O LEU A 50 28.898 17.137 21.392 1.00 0.00 O ATOM 798 CB LEU A 50 26.034 18.380 21.492 1.00 0.00 C ATOM 799 CG LEU A 50 24.826 19.055 22.141 1.00 0.00 C ATOM 800 CD1 LEU A 50 24.989 19.872 23.423 1.00 0.00 C ATOM 801 CD2 LEU A 50 24.082 19.983 21.173 1.00 0.00 C ATOM 0 H LEU A 50 27.590 18.379 23.471 1.00 0.00 H new ATOM 0 HA LEU A 50 25.883 16.371 22.340 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.824 19.126 21.408 1.00 0.00 H new ATOM 0 HB3 LEU A 50 25.751 18.100 20.477 1.00 0.00 H new ATOM 0 HG LEU A 50 24.291 18.148 22.423 1.00 0.00 H new ATOM 0 HD11 LEU A 50 24.021 20.270 23.727 1.00 0.00 H new ATOM 0 HD12 LEU A 50 25.383 19.234 24.214 1.00 0.00 H new ATOM 0 HD13 LEU A 50 25.680 20.696 23.244 1.00 0.00 H new ATOM 0 HD21 LEU A 50 23.233 20.437 21.684 1.00 0.00 H new ATOM 0 HD22 LEU A 50 24.758 20.765 20.827 1.00 0.00 H new ATOM 0 HD23 LEU A 50 23.726 19.407 20.319 1.00 0.00 H new ATOM 813 N GLU A 51 27.563 15.683 20.414 1.00 0.00 N ATOM 814 CA GLU A 51 28.523 15.027 19.553 1.00 0.00 C ATOM 815 C GLU A 51 28.243 15.421 18.096 1.00 0.00 C ATOM 816 O GLU A 51 28.945 14.954 17.212 1.00 0.00 O ATOM 817 CB GLU A 51 28.450 13.504 19.751 1.00 0.00 C ATOM 818 CG GLU A 51 29.447 13.061 20.827 1.00 0.00 C ATOM 819 CD GLU A 51 30.863 12.702 20.399 1.00 0.00 C ATOM 820 OE1 GLU A 51 31.158 12.249 19.278 1.00 0.00 O ATOM 821 OE2 GLU A 51 31.773 12.896 21.244 1.00 0.00 O ATOM 0 H GLU A 51 26.649 15.234 20.359 1.00 0.00 H new ATOM 0 HA GLU A 51 29.534 15.344 19.808 1.00 0.00 H new ATOM 0 HB2 GLU A 51 27.439 13.216 20.041 1.00 0.00 H new ATOM 0 HB3 GLU A 51 28.669 12.997 18.811 1.00 0.00 H new ATOM 0 HG2 GLU A 51 29.516 13.860 21.565 1.00 0.00 H new ATOM 0 HG3 GLU A 51 29.024 12.194 21.335 1.00 0.00 H new ATOM 828 N ASP A 52 27.175 16.185 17.870 1.00 0.00 N ATOM 829 CA ASP A 52 26.892 16.804 16.598 1.00 0.00 C ATOM 830 C ASP A 52 26.160 15.836 15.658 1.00 0.00 C ATOM 831 O ASP A 52 26.083 14.654 15.989 1.00 0.00 O ATOM 832 CB ASP A 52 27.991 17.519 15.811 1.00 0.00 C ATOM 833 CG ASP A 52 28.694 18.656 16.551 1.00 0.00 C ATOM 834 OD1 ASP A 52 28.476 18.858 17.764 1.00 0.00 O ATOM 835 OD2 ASP A 52 29.661 19.265 16.039 1.00 0.00 O ATOM 0 H ASP A 52 26.477 16.388 18.585 1.00 0.00 H new ATOM 0 HA ASP A 52 26.277 17.635 16.942 1.00 0.00 H new ATOM 0 HB2 ASP A 52 28.739 16.784 15.515 1.00 0.00 H new ATOM 0 HB3 ASP A 52 27.557 17.919 14.895 1.00 0.00 H new ATOM 840 N GLY A 53 25.624 16.330 14.543 1.00 0.00 N ATOM 841 CA GLY A 53 25.116 15.494 13.485 1.00 0.00 C ATOM 842 C GLY A 53 23.585 15.479 13.386 1.00 0.00 C ATOM 843 O GLY A 53 23.020 15.002 12.404 1.00 0.00 O ATOM 0 H GLY A 53 25.535 17.329 14.358 1.00 0.00 H new ATOM 0 HA2 GLY A 53 25.528 15.835 12.536 1.00 0.00 H new ATOM 0 HA3 GLY A 53 25.470 14.475 13.638 1.00 0.00 H new ATOM 847 N ARG A 54 22.960 15.929 14.465 1.00 0.00 N ATOM 848 CA ARG A 54 21.539 15.869 14.737 1.00 0.00 C ATOM 849 C ARG A 54 21.100 17.322 14.921 1.00 0.00 C ATOM 850 O ARG A 54 21.834 18.262 14.629 1.00 0.00 O ATOM 851 CB ARG A 54 21.361 14.988 15.981 1.00 0.00 C ATOM 852 CG ARG A 54 21.815 13.559 15.702 1.00 0.00 C ATOM 853 CD ARG A 54 21.469 12.449 16.691 1.00 0.00 C ATOM 854 NE ARG A 54 22.103 11.229 16.213 1.00 0.00 N ATOM 855 CZ ARG A 54 22.243 10.090 16.904 1.00 0.00 C ATOM 856 NH1 ARG A 54 21.849 10.064 18.186 1.00 0.00 N ATOM 857 NH2 ARG A 54 22.726 8.996 16.300 1.00 0.00 N ATOM 0 H ARG A 54 23.473 16.377 15.224 1.00 0.00 H new ATOM 0 HA ARG A 54 20.927 15.427 13.951 1.00 0.00 H new ATOM 0 HB2 ARG A 54 21.935 15.401 16.810 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.315 14.989 16.286 1.00 0.00 H new ATOM 0 HG2 ARG A 54 21.407 13.271 14.733 1.00 0.00 H new ATOM 0 HG3 ARG A 54 22.900 13.576 15.598 1.00 0.00 H new ATOM 0 HD2 ARG A 54 21.824 12.700 17.690 1.00 0.00 H new ATOM 0 HD3 ARG A 54 20.389 12.319 16.760 1.00 0.00 H new ATOM 0 HE ARG A 54 22.475 11.243 15.263 1.00 0.00 H new ATOM 0 HH11 ARG A 54 21.453 10.900 18.615 1.00 0.00 H new ATOM 0 HH12 ARG A 54 21.946 9.208 18.732 1.00 0.00 H new ATOM 0 HH21 ARG A 54 22.987 9.031 15.315 1.00 0.00 H new ATOM 0 HH22 ARG A 54 22.833 8.128 16.826 1.00 0.00 H new ATOM 871 N THR A 55 19.850 17.526 15.354 1.00 0.00 N ATOM 872 CA THR A 55 19.185 18.813 15.290 1.00 0.00 C ATOM 873 C THR A 55 18.972 19.385 16.687 1.00 0.00 C ATOM 874 O THR A 55 18.942 18.641 17.667 1.00 0.00 O ATOM 875 CB THR A 55 17.971 18.604 14.383 1.00 0.00 C ATOM 876 OG1 THR A 55 16.856 17.984 14.983 1.00 0.00 O ATOM 877 CG2 THR A 55 18.381 17.920 13.081 1.00 0.00 C ATOM 0 H THR A 55 19.275 16.789 15.761 1.00 0.00 H new ATOM 0 HA THR A 55 19.770 19.613 14.837 1.00 0.00 H new ATOM 0 HB THR A 55 17.608 19.608 14.162 1.00 0.00 H new ATOM 0 HG1 THR A 55 17.069 17.048 15.180 1.00 0.00 H new ATOM 0 HG21 THR A 55 17.503 17.781 12.451 1.00 0.00 H new ATOM 0 HG22 THR A 55 19.109 18.540 12.558 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.825 16.950 13.304 1.00 0.00 H new ATOM 885 N LEU A 56 18.606 20.667 16.721 1.00 0.00 N ATOM 886 CA LEU A 56 18.146 21.293 17.937 1.00 0.00 C ATOM 887 C LEU A 56 16.957 20.598 18.589 1.00 0.00 C ATOM 888 O LEU A 56 16.816 20.726 19.805 1.00 0.00 O ATOM 889 CB LEU A 56 18.067 22.790 17.634 1.00 0.00 C ATOM 890 CG LEU A 56 19.307 23.665 17.792 1.00 0.00 C ATOM 891 CD1 LEU A 56 20.481 23.104 17.000 1.00 0.00 C ATOM 892 CD2 LEU A 56 18.940 25.052 17.278 1.00 0.00 C ATOM 0 H LEU A 56 18.624 21.285 15.910 1.00 0.00 H new ATOM 0 HA LEU A 56 18.841 21.173 18.768 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.725 22.895 16.605 1.00 0.00 H new ATOM 0 HB3 LEU A 56 17.290 23.210 18.273 1.00 0.00 H new ATOM 0 HG LEU A 56 19.615 23.699 18.837 1.00 0.00 H new ATOM 0 HD11 LEU A 56 21.350 23.749 17.132 1.00 0.00 H new ATOM 0 HD12 LEU A 56 20.715 22.101 17.358 1.00 0.00 H new ATOM 0 HD13 LEU A 56 20.219 23.060 15.943 1.00 0.00 H new ATOM 0 HD21 LEU A 56 19.801 25.714 17.372 1.00 0.00 H new ATOM 0 HD22 LEU A 56 18.646 24.986 16.231 1.00 0.00 H new ATOM 0 HD23 LEU A 56 18.111 25.449 17.863 1.00 0.00 H new ATOM 904 N SER A 57 16.097 19.927 17.813 1.00 0.00 N ATOM 905 CA SER A 57 15.003 19.272 18.481 1.00 0.00 C ATOM 906 C SER A 57 15.380 17.965 19.185 1.00 0.00 C ATOM 907 O SER A 57 14.649 17.573 20.085 1.00 0.00 O ATOM 908 CB SER A 57 13.872 19.027 17.472 1.00 0.00 C ATOM 909 OG SER A 57 14.194 18.146 16.417 1.00 0.00 O ATOM 0 H SER A 57 16.139 19.834 16.798 1.00 0.00 H new ATOM 0 HA SER A 57 14.679 19.943 19.277 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.009 18.630 18.006 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.571 19.984 17.047 1.00 0.00 H new ATOM 0 HG SER A 57 15.119 18.301 16.132 1.00 0.00 H new ATOM 915 N ASP A 58 16.322 17.284 18.544 1.00 0.00 N ATOM 916 CA ASP A 58 16.805 15.991 18.997 1.00 0.00 C ATOM 917 C ASP A 58 17.623 16.073 20.289 1.00 0.00 C ATOM 918 O ASP A 58 17.384 15.339 21.238 1.00 0.00 O ATOM 919 CB ASP A 58 17.811 15.378 18.028 1.00 0.00 C ATOM 920 CG ASP A 58 17.224 15.000 16.672 1.00 0.00 C ATOM 921 OD1 ASP A 58 16.232 14.266 16.539 1.00 0.00 O ATOM 922 OD2 ASP A 58 17.766 15.470 15.648 1.00 0.00 O ATOM 0 H ASP A 58 16.773 17.617 17.692 1.00 0.00 H new ATOM 0 HA ASP A 58 15.887 15.414 19.107 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.627 16.084 17.874 1.00 0.00 H new ATOM 0 HB3 ASP A 58 18.243 14.488 18.485 1.00 0.00 H new ATOM 927 N TYR A 59 18.489 17.066 20.482 1.00 0.00 N ATOM 928 CA TYR A 59 19.177 17.350 21.725 1.00 0.00 C ATOM 929 C TYR A 59 18.235 18.093 22.665 1.00 0.00 C ATOM 930 O TYR A 59 18.645 18.469 23.763 1.00 0.00 O ATOM 931 CB TYR A 59 20.473 18.133 21.616 1.00 0.00 C ATOM 932 CG TYR A 59 21.593 17.243 21.114 1.00 0.00 C ATOM 933 CD1 TYR A 59 22.195 16.422 22.079 1.00 0.00 C ATOM 934 CD2 TYR A 59 22.054 17.368 19.807 1.00 0.00 C ATOM 935 CE1 TYR A 59 23.172 15.520 21.635 1.00 0.00 C ATOM 936 CE2 TYR A 59 23.153 16.569 19.432 1.00 0.00 C ATOM 937 CZ TYR A 59 23.707 15.690 20.352 1.00 0.00 C ATOM 938 OH TYR A 59 24.694 14.871 19.870 1.00 0.00 O ATOM 0 H TYR A 59 18.736 17.719 19.739 1.00 0.00 H new ATOM 0 HA TYR A 59 19.467 16.370 22.105 1.00 0.00 H new ATOM 0 HB2 TYR A 59 20.339 18.976 20.938 1.00 0.00 H new ATOM 0 HB3 TYR A 59 20.738 18.546 22.589 1.00 0.00 H new ATOM 0 HD1 TYR A 59 21.917 16.482 23.121 1.00 0.00 H new ATOM 0 HD2 TYR A 59 21.589 18.049 19.109 1.00 0.00 H new ATOM 0 HE1 TYR A 59 23.505 14.711 22.269 1.00 0.00 H new ATOM 0 HE2 TYR A 59 23.561 16.640 18.435 1.00 0.00 H new ATOM 0 HH TYR A 59 24.933 15.147 18.961 1.00 0.00 H new ATOM 948 N ASN A 60 16.980 18.378 22.302 1.00 0.00 N ATOM 949 CA ASN A 60 15.967 18.885 23.189 1.00 0.00 C ATOM 950 C ASN A 60 16.160 20.332 23.659 1.00 0.00 C ATOM 951 O ASN A 60 16.129 20.728 24.818 1.00 0.00 O ATOM 952 CB ASN A 60 15.544 17.887 24.269 1.00 0.00 C ATOM 953 CG ASN A 60 14.059 17.960 24.598 1.00 0.00 C ATOM 954 OD1 ASN A 60 13.657 18.692 25.495 1.00 0.00 O ATOM 955 ND2 ASN A 60 13.224 17.137 23.984 1.00 0.00 N ATOM 0 H ASN A 60 16.646 18.252 21.347 1.00 0.00 H new ATOM 0 HA ASN A 60 15.084 18.982 22.558 1.00 0.00 H new ATOM 0 HB2 ASN A 60 15.788 16.877 23.939 1.00 0.00 H new ATOM 0 HB3 ASN A 60 16.121 18.074 25.175 1.00 0.00 H new ATOM 0 HD21 ASN A 60 12.242 17.110 24.257 1.00 0.00 H new ATOM 0 HD22 ASN A 60 13.563 16.530 23.238 1.00 0.00 H new ATOM 962 N ILE A 61 16.412 21.164 22.655 1.00 0.00 N ATOM 963 CA ILE A 61 16.742 22.565 22.841 1.00 0.00 C ATOM 964 C ILE A 61 15.481 23.375 22.534 1.00 0.00 C ATOM 965 O ILE A 61 14.916 23.223 21.451 1.00 0.00 O ATOM 966 CB ILE A 61 17.948 22.929 21.977 1.00 0.00 C ATOM 967 CG1 ILE A 61 19.105 22.005 22.352 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.263 24.414 22.152 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.395 22.231 21.548 1.00 0.00 C ATOM 0 H ILE A 61 16.392 20.877 21.677 1.00 0.00 H new ATOM 0 HA ILE A 61 17.042 22.791 23.864 1.00 0.00 H new ATOM 0 HB ILE A 61 17.748 22.782 20.916 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.326 22.134 23.411 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.785 20.972 22.217 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.123 24.678 21.537 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.402 25.007 21.845 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.489 24.617 23.199 1.00 0.00 H new ATOM 0 HD11 ILE A 61 21.160 21.531 21.883 1.00 0.00 H new ATOM 0 HD12 ILE A 61 20.196 22.071 20.488 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.745 23.252 21.702 1.00 0.00 H new ATOM 981 N GLN A 62 15.058 24.178 23.510 1.00 0.00 N ATOM 982 CA GLN A 62 13.752 24.790 23.436 1.00 0.00 C ATOM 983 C GLN A 62 13.794 26.308 23.241 1.00 0.00 C ATOM 984 O GLN A 62 14.836 26.883 22.952 1.00 0.00 O ATOM 985 CB GLN A 62 13.080 24.544 24.782 1.00 0.00 C ATOM 986 CG GLN A 62 12.758 23.084 25.137 1.00 0.00 C ATOM 987 CD GLN A 62 12.002 22.324 24.059 1.00 0.00 C ATOM 988 OE1 GLN A 62 11.019 22.720 23.434 1.00 0.00 O ATOM 989 NE2 GLN A 62 12.371 21.059 23.831 1.00 0.00 N ATOM 0 H GLN A 62 15.597 24.411 24.344 1.00 0.00 H new ATOM 0 HA GLN A 62 13.232 24.359 22.581 1.00 0.00 H new ATOM 0 HB2 GLN A 62 13.724 24.950 25.563 1.00 0.00 H new ATOM 0 HB3 GLN A 62 12.151 25.113 24.807 1.00 0.00 H new ATOM 0 HG2 GLN A 62 13.691 22.560 25.346 1.00 0.00 H new ATOM 0 HG3 GLN A 62 12.170 23.068 26.055 1.00 0.00 H new ATOM 0 HE21 GLN A 62 13.178 20.668 24.317 1.00 0.00 H new ATOM 0 HE22 GLN A 62 11.845 20.485 23.171 1.00 0.00 H new ATOM 998 N LYS A 63 12.692 27.021 23.457 1.00 0.00 N ATOM 999 CA LYS A 63 12.631 28.467 23.416 1.00 0.00 C ATOM 1000 C LYS A 63 13.393 28.997 24.631 1.00 0.00 C ATOM 1001 O LYS A 63 13.014 28.825 25.792 1.00 0.00 O ATOM 1002 CB LYS A 63 11.138 28.813 23.430 1.00 0.00 C ATOM 1003 CG LYS A 63 10.471 28.803 22.055 1.00 0.00 C ATOM 1004 CD LYS A 63 8.958 28.941 22.230 1.00 0.00 C ATOM 1005 CE LYS A 63 8.200 28.928 20.902 1.00 0.00 C ATOM 1006 NZ LYS A 63 6.818 29.299 21.254 1.00 0.00 N ATOM 0 H LYS A 63 11.793 26.589 23.671 1.00 0.00 H new ATOM 0 HA LYS A 63 13.090 28.918 22.536 1.00 0.00 H new ATOM 0 HB2 LYS A 63 10.620 28.104 24.076 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.011 29.800 23.874 1.00 0.00 H new ATOM 0 HG2 LYS A 63 10.855 29.621 21.445 1.00 0.00 H new ATOM 0 HG3 LYS A 63 10.706 27.877 21.530 1.00 0.00 H new ATOM 0 HD2 LYS A 63 8.595 28.127 22.858 1.00 0.00 H new ATOM 0 HD3 LYS A 63 8.742 29.871 22.756 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.631 29.635 20.193 1.00 0.00 H new ATOM 0 HE3 LYS A 63 8.239 27.944 20.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 6.233 29.313 20.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 6.432 28.604 21.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 6.813 30.242 21.692 1.00 0.00 H new ATOM 1020 N GLU A 64 14.510 29.702 24.483 1.00 0.00 N ATOM 1021 CA GLU A 64 15.230 30.491 25.468 1.00 0.00 C ATOM 1022 C GLU A 64 16.276 29.674 26.231 1.00 0.00 C ATOM 1023 O GLU A 64 16.851 30.095 27.241 1.00 0.00 O ATOM 1024 CB GLU A 64 14.307 31.379 26.292 1.00 0.00 C ATOM 1025 CG GLU A 64 14.958 32.737 26.529 1.00 0.00 C ATOM 1026 CD GLU A 64 13.931 33.733 27.031 1.00 0.00 C ATOM 1027 OE1 GLU A 64 12.844 33.959 26.448 1.00 0.00 O ATOM 1028 OE2 GLU A 64 14.171 34.306 28.123 1.00 0.00 O ATOM 0 H GLU A 64 14.978 29.736 23.577 1.00 0.00 H new ATOM 0 HA GLU A 64 15.845 31.217 24.936 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.357 31.508 25.774 1.00 0.00 H new ATOM 0 HB3 GLU A 64 14.087 30.901 27.247 1.00 0.00 H new ATOM 0 HG2 GLU A 64 15.765 32.639 27.255 1.00 0.00 H new ATOM 0 HG3 GLU A 64 15.405 33.100 25.603 1.00 0.00 H new ATOM 1035 N SER A 65 16.607 28.466 25.792 1.00 0.00 N ATOM 1036 CA SER A 65 17.713 27.613 26.189 1.00 0.00 C ATOM 1037 C SER A 65 19.046 28.356 26.179 1.00 0.00 C ATOM 1038 O SER A 65 19.271 29.297 25.430 1.00 0.00 O ATOM 1039 CB SER A 65 17.661 26.312 25.372 1.00 0.00 C ATOM 1040 OG SER A 65 16.508 25.552 25.635 1.00 0.00 O ATOM 0 H SER A 65 16.044 28.014 25.071 1.00 0.00 H new ATOM 0 HA SER A 65 17.613 27.320 27.234 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.698 26.553 24.310 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.544 25.713 25.594 1.00 0.00 H new ATOM 0 HG SER A 65 15.718 26.033 25.311 1.00 0.00 H new ATOM 1046 N THR A 66 19.953 27.882 27.034 1.00 0.00 N ATOM 1047 CA THR A 66 21.350 28.260 27.020 1.00 0.00 C ATOM 1048 C THR A 66 22.230 27.055 26.701 1.00 0.00 C ATOM 1049 O THR A 66 22.252 26.084 27.449 1.00 0.00 O ATOM 1050 CB THR A 66 21.830 28.989 28.286 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.988 30.100 28.503 1.00 0.00 O ATOM 1052 CG2 THR A 66 23.297 29.402 28.377 1.00 0.00 C ATOM 0 H THR A 66 19.723 27.211 27.767 1.00 0.00 H new ATOM 0 HA THR A 66 21.448 28.997 26.223 1.00 0.00 H new ATOM 0 HB THR A 66 21.763 28.237 29.072 1.00 0.00 H new ATOM 0 HG1 THR A 66 21.278 30.578 29.308 1.00 0.00 H new ATOM 0 HG21 THR A 66 23.475 29.904 29.328 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.929 28.517 28.310 1.00 0.00 H new ATOM 0 HG23 THR A 66 23.535 30.081 27.558 1.00 0.00 H new ATOM 1060 N LEU A 67 23.144 27.203 25.754 1.00 0.00 N ATOM 1061 CA LEU A 67 24.252 26.306 25.489 1.00 0.00 C ATOM 1062 C LEU A 67 25.574 26.836 26.039 1.00 0.00 C ATOM 1063 O LEU A 67 25.892 28.006 25.847 1.00 0.00 O ATOM 1064 CB LEU A 67 24.552 26.077 24.009 1.00 0.00 C ATOM 1065 CG LEU A 67 23.342 25.978 23.080 1.00 0.00 C ATOM 1066 CD1 LEU A 67 23.790 25.753 21.624 1.00 0.00 C ATOM 1067 CD2 LEU A 67 22.472 24.891 23.688 1.00 0.00 C ATOM 0 H LEU A 67 23.129 27.998 25.115 1.00 0.00 H new ATOM 0 HA LEU A 67 23.916 25.387 25.969 1.00 0.00 H new ATOM 0 HB2 LEU A 67 25.187 26.891 23.659 1.00 0.00 H new ATOM 0 HB3 LEU A 67 25.131 25.158 23.915 1.00 0.00 H new ATOM 0 HG LEU A 67 22.756 26.894 23.008 1.00 0.00 H new ATOM 0 HD11 LEU A 67 22.913 25.685 20.980 1.00 0.00 H new ATOM 0 HD12 LEU A 67 24.413 26.587 21.302 1.00 0.00 H new ATOM 0 HD13 LEU A 67 24.361 24.827 21.558 1.00 0.00 H new ATOM 0 HD21 LEU A 67 21.578 24.757 23.079 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.030 23.956 23.724 1.00 0.00 H new ATOM 0 HD23 LEU A 67 22.182 25.180 24.698 1.00 0.00 H new ATOM 1079 N HIS A 68 26.254 26.074 26.885 1.00 0.00 N ATOM 1080 CA HIS A 68 27.588 26.457 27.324 1.00 0.00 C ATOM 1081 C HIS A 68 28.517 25.937 26.232 1.00 0.00 C ATOM 1082 O HIS A 68 28.678 24.724 26.058 1.00 0.00 O ATOM 1083 CB HIS A 68 27.804 25.716 28.636 1.00 0.00 C ATOM 1084 CG HIS A 68 28.929 26.122 29.540 1.00 0.00 C ATOM 1085 ND1 HIS A 68 29.106 27.407 30.069 1.00 0.00 N ATOM 1086 CD2 HIS A 68 30.085 25.431 29.810 1.00 0.00 C ATOM 1087 CE1 HIS A 68 30.291 27.382 30.690 1.00 0.00 C ATOM 1088 NE2 HIS A 68 30.872 26.177 30.668 1.00 0.00 N ATOM 0 H HIS A 68 25.909 25.198 27.277 1.00 0.00 H new ATOM 0 HA HIS A 68 27.750 27.524 27.476 1.00 0.00 H new ATOM 0 HB2 HIS A 68 26.881 25.793 29.210 1.00 0.00 H new ATOM 0 HB3 HIS A 68 27.943 24.662 28.396 1.00 0.00 H new ATOM 0 HD2 HIS A 68 30.339 24.459 29.415 1.00 0.00 H new ATOM 0 HE1 HIS A 68 30.734 28.247 31.161 1.00 0.00 H new ATOM 0 HE2 HIS A 68 31.707 25.876 31.171 1.00 0.00 H new ATOM 1096 N LEU A 69 29.089 26.883 25.486 1.00 0.00 N ATOM 1097 CA LEU A 69 30.122 26.718 24.485 1.00 0.00 C ATOM 1098 C LEU A 69 31.489 26.829 25.160 1.00 0.00 C ATOM 1099 O LEU A 69 32.004 27.939 25.318 1.00 0.00 O ATOM 1100 CB LEU A 69 29.909 27.779 23.395 1.00 0.00 C ATOM 1101 CG LEU A 69 30.693 27.591 22.096 1.00 0.00 C ATOM 1102 CD1 LEU A 69 30.314 26.380 21.241 1.00 0.00 C ATOM 1103 CD2 LEU A 69 30.719 28.817 21.183 1.00 0.00 C ATOM 0 H LEU A 69 28.813 27.860 25.581 1.00 0.00 H new ATOM 0 HA LEU A 69 30.075 25.737 24.012 1.00 0.00 H new ATOM 0 HB2 LEU A 69 28.847 27.809 23.151 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.168 28.752 23.812 1.00 0.00 H new ATOM 0 HG LEU A 69 31.687 27.413 22.506 1.00 0.00 H new ATOM 0 HD11 LEU A 69 30.939 26.355 20.348 1.00 0.00 H new ATOM 0 HD12 LEU A 69 30.466 25.467 21.816 1.00 0.00 H new ATOM 0 HD13 LEU A 69 29.267 26.454 20.949 1.00 0.00 H new ATOM 0 HD21 LEU A 69 31.297 28.591 20.287 1.00 0.00 H new ATOM 0 HD22 LEU A 69 29.700 29.082 20.900 1.00 0.00 H new ATOM 0 HD23 LEU A 69 31.178 29.653 21.710 1.00 0.00 H new ATOM 1115 N VAL A 70 32.137 25.693 25.356 1.00 0.00 N ATOM 1116 CA VAL A 70 33.546 25.517 25.657 1.00 0.00 C ATOM 1117 C VAL A 70 34.359 25.595 24.351 1.00 0.00 C ATOM 1118 O VAL A 70 34.154 24.768 23.469 1.00 0.00 O ATOM 1119 CB VAL A 70 33.764 24.150 26.310 1.00 0.00 C ATOM 1120 CG1 VAL A 70 35.113 23.906 26.981 1.00 0.00 C ATOM 1121 CG2 VAL A 70 32.641 23.781 27.280 1.00 0.00 C ATOM 0 H VAL A 70 31.651 24.798 25.304 1.00 0.00 H new ATOM 0 HA VAL A 70 33.873 26.301 26.340 1.00 0.00 H new ATOM 0 HB VAL A 70 33.755 23.491 25.442 1.00 0.00 H new ATOM 0 HG11 VAL A 70 35.133 22.901 27.402 1.00 0.00 H new ATOM 0 HG12 VAL A 70 35.910 24.007 26.244 1.00 0.00 H new ATOM 0 HG13 VAL A 70 35.261 24.636 27.777 1.00 0.00 H new ATOM 0 HG21 VAL A 70 32.844 22.803 27.716 1.00 0.00 H new ATOM 0 HG22 VAL A 70 32.585 24.527 28.073 1.00 0.00 H new ATOM 0 HG23 VAL A 70 31.693 23.750 26.744 1.00 0.00 H new ATOM 1131 N LEU A 71 35.218 26.609 24.287 1.00 0.00 N ATOM 1132 CA LEU A 71 36.181 26.884 23.235 1.00 0.00 C ATOM 1133 C LEU A 71 37.430 26.119 23.646 1.00 0.00 C ATOM 1134 O LEU A 71 38.052 26.604 24.586 1.00 0.00 O ATOM 1135 CB LEU A 71 36.579 28.356 23.126 1.00 0.00 C ATOM 1136 CG LEU A 71 35.562 29.272 22.436 1.00 0.00 C ATOM 1137 CD1 LEU A 71 34.244 29.482 23.184 1.00 0.00 C ATOM 1138 CD2 LEU A 71 36.183 30.662 22.320 1.00 0.00 C ATOM 0 H LEU A 71 35.258 27.310 25.027 1.00 0.00 H new ATOM 0 HA LEU A 71 35.746 26.603 22.276 1.00 0.00 H new ATOM 0 HB2 LEU A 71 36.762 28.739 24.130 1.00 0.00 H new ATOM 0 HB3 LEU A 71 37.523 28.419 22.584 1.00 0.00 H new ATOM 0 HG LEU A 71 35.333 28.779 21.491 1.00 0.00 H new ATOM 0 HD11 LEU A 71 33.600 30.146 22.607 1.00 0.00 H new ATOM 0 HD12 LEU A 71 33.746 28.522 23.321 1.00 0.00 H new ATOM 0 HD13 LEU A 71 34.445 29.928 24.158 1.00 0.00 H new ATOM 0 HD21 LEU A 71 35.479 31.335 21.831 1.00 0.00 H new ATOM 0 HD22 LEU A 71 36.416 31.041 23.315 1.00 0.00 H new ATOM 0 HD23 LEU A 71 37.098 30.604 21.730 1.00 0.00 H new ATOM 1150 N ARG A 72 37.819 25.137 22.827 1.00 0.00 N ATOM 1151 CA ARG A 72 39.162 24.612 22.825 1.00 0.00 C ATOM 1152 C ARG A 72 40.112 25.640 22.203 1.00 0.00 C ATOM 1153 O ARG A 72 39.711 26.326 21.266 1.00 0.00 O ATOM 1154 CB ARG A 72 39.295 23.339 21.992 1.00 0.00 C ATOM 1155 CG ARG A 72 38.248 22.275 22.327 1.00 0.00 C ATOM 1156 CD ARG A 72 38.647 20.989 21.606 1.00 0.00 C ATOM 1157 NE ARG A 72 37.756 19.863 21.897 1.00 0.00 N ATOM 1158 CZ ARG A 72 37.952 18.940 22.843 1.00 0.00 C ATOM 1159 NH1 ARG A 72 38.949 18.942 23.755 1.00 0.00 N ATOM 1160 NH2 ARG A 72 37.026 17.978 22.911 1.00 0.00 N ATOM 0 H ARG A 72 37.200 24.692 22.150 1.00 0.00 H new ATOM 0 HA ARG A 72 39.407 24.392 23.864 1.00 0.00 H new ATOM 0 HB2 ARG A 72 39.214 23.596 20.936 1.00 0.00 H new ATOM 0 HB3 ARG A 72 40.289 22.918 22.143 1.00 0.00 H new ATOM 0 HG2 ARG A 72 38.200 22.111 23.404 1.00 0.00 H new ATOM 0 HG3 ARG A 72 37.257 22.600 22.010 1.00 0.00 H new ATOM 0 HD2 ARG A 72 38.654 21.170 20.531 1.00 0.00 H new ATOM 0 HD3 ARG A 72 39.665 20.721 21.891 1.00 0.00 H new ATOM 0 HE ARG A 72 36.914 19.776 21.329 1.00 0.00 H new ATOM 0 HH11 ARG A 72 39.636 19.696 23.758 1.00 0.00 H new ATOM 0 HH12 ARG A 72 39.015 18.189 24.440 1.00 0.00 H new ATOM 0 HH21 ARG A 72 36.237 17.983 22.265 1.00 0.00 H new ATOM 0 HH22 ARG A 72 37.109 17.239 23.609 1.00 0.00 H new ATOM 1174 N LEU A 73 41.345 25.673 22.700 1.00 0.00 N ATOM 1175 CA LEU A 73 42.435 26.356 22.039 1.00 0.00 C ATOM 1176 C LEU A 73 43.301 25.470 21.132 1.00 0.00 C ATOM 1177 O LEU A 73 44.455 25.828 20.897 1.00 0.00 O ATOM 1178 CB LEU A 73 43.282 26.990 23.128 1.00 0.00 C ATOM 1179 CG LEU A 73 42.652 28.282 23.657 1.00 0.00 C ATOM 1180 CD1 LEU A 73 43.053 28.636 25.093 1.00 0.00 C ATOM 1181 CD2 LEU A 73 43.113 29.366 22.669 1.00 0.00 C ATOM 0 H LEU A 73 41.610 25.223 23.576 1.00 0.00 H new ATOM 0 HA LEU A 73 42.006 27.092 21.359 1.00 0.00 H new ATOM 0 HB2 LEU A 73 43.407 26.284 23.949 1.00 0.00 H new ATOM 0 HB3 LEU A 73 44.277 27.204 22.737 1.00 0.00 H new ATOM 0 HG LEU A 73 41.568 28.179 23.714 1.00 0.00 H new ATOM 0 HD11 LEU A 73 42.563 29.564 25.389 1.00 0.00 H new ATOM 0 HD12 LEU A 73 42.747 27.834 25.764 1.00 0.00 H new ATOM 0 HD13 LEU A 73 44.134 28.763 25.148 1.00 0.00 H new ATOM 0 HD21 LEU A 73 42.706 30.331 22.972 1.00 0.00 H new ATOM 0 HD22 LEU A 73 44.202 29.416 22.666 1.00 0.00 H new ATOM 0 HD23 LEU A 73 42.758 29.121 21.668 1.00 0.00 H new ATOM 1193 N ARG A 74 42.737 24.292 20.885 1.00 0.00 N ATOM 1194 CA ARG A 74 43.386 23.234 20.139 1.00 0.00 C ATOM 1195 C ARG A 74 42.230 22.523 19.441 1.00 0.00 C ATOM 1196 O ARG A 74 41.148 23.099 19.383 1.00 0.00 O ATOM 1197 CB ARG A 74 44.262 22.483 21.134 1.00 0.00 C ATOM 1198 CG ARG A 74 45.220 21.464 20.520 1.00 0.00 C ATOM 1199 CD ARG A 74 46.139 22.039 19.447 1.00 0.00 C ATOM 1200 NE ARG A 74 47.402 21.306 19.314 1.00 0.00 N ATOM 1201 CZ ARG A 74 48.499 21.927 18.868 1.00 0.00 C ATOM 1202 NH1 ARG A 74 48.459 23.077 18.186 1.00 0.00 N ATOM 1203 NH2 ARG A 74 49.642 21.299 19.174 1.00 0.00 N ATOM 0 H ARG A 74 41.800 24.047 21.206 1.00 0.00 H new ATOM 0 HA ARG A 74 44.089 23.489 19.346 1.00 0.00 H new ATOM 0 HB2 ARG A 74 44.845 23.209 21.701 1.00 0.00 H new ATOM 0 HB3 ARG A 74 43.616 21.968 21.845 1.00 0.00 H new ATOM 0 HG2 ARG A 74 45.831 21.032 21.313 1.00 0.00 H new ATOM 0 HG3 ARG A 74 44.639 20.650 20.087 1.00 0.00 H new ATOM 0 HD2 ARG A 74 45.619 22.030 18.489 1.00 0.00 H new ATOM 0 HD3 ARG A 74 46.354 23.081 19.683 1.00 0.00 H new ATOM 0 HE ARG A 74 47.444 20.318 19.563 1.00 0.00 H new ATOM 0 HH11 ARG A 74 47.562 23.520 17.985 1.00 0.00 H new ATOM 0 HH12 ARG A 74 49.325 23.511 17.867 1.00 0.00 H new ATOM 0 HH21 ARG A 74 49.619 20.427 19.703 1.00 0.00 H new ATOM 0 HH22 ARG A 74 50.535 21.693 18.878 1.00 0.00 H new ATOM 1217 N GLY A 75 42.402 21.303 18.922 1.00 0.00 N ATOM 1218 CA GLY A 75 41.357 20.486 18.339 1.00 0.00 C ATOM 1219 C GLY A 75 41.053 19.297 19.250 1.00 0.00 C ATOM 1220 O GLY A 75 41.913 19.038 20.092 1.00 0.00 O ATOM 0 H GLY A 75 43.315 20.848 18.901 1.00 0.00 H new ATOM 0 HA2 GLY A 75 40.456 21.083 18.193 1.00 0.00 H new ATOM 0 HA3 GLY A 75 41.667 20.132 17.356 1.00 0.00 H new ATOM 1224 N GLY A 76 39.863 18.728 19.057 1.00 0.00 N ATOM 1225 CA GLY A 76 39.429 17.506 19.687 1.00 0.00 C ATOM 1226 C GLY A 76 38.888 16.512 18.665 1.00 0.00 C ATOM 1227 O GLY A 76 38.757 16.849 17.479 1.00 0.00 O ATOM 1228 OXT GLY A 76 38.478 15.414 19.103 1.00 0.00 O ATOM 0 H GLY A 76 39.160 19.127 18.435 1.00 0.00 H new ATOM 0 HA2 GLY A 76 40.263 17.057 20.226 1.00 0.00 H new ATOM 0 HA3 GLY A 76 38.657 17.729 20.423 1.00 0.00 H new TER 1232 GLY A 76