USER MOD reduce.3.24.130724 H: found=0, std=0, add=891, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 892 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 NoAdj-H: B 219 HIS HD1 : B 219 HIS ND1 : B 301 ZNZN :(H bumps) USER MOD Set 1.1: B 196 SER OG : rot -129:sc= 0.474 USER MOD Set 1.2: B 200 THR OG1 : rot 180:sc= 0.444 USER MOD Set 2.1: A 25 ASN : amide:sc= 0.0219 K(o=0.57,f=-2.5) USER MOD Set 2.2: A 29 LYS NZ :NH3+ 169:sc= 0.55 (180deg=0.394) USER MOD Set 3.1: A 6 LYS NZ :NH3+ -117:sc= 1.2 (180deg=0) USER MOD Set 3.2: A 12 THR OG1 : rot 120:sc= 0.989 USER MOD Set 4.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: A -1 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 7 THR OG1 : rot 137:sc= 0.925 USER MOD Set 5.2: A 9 THR OG1 : rot 180:sc= 0.949 USER MOD Single : A 0 HIS : no HD1:sc= -1.08 X(o=-1.1,f=-0.99) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A -2 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 147:sc= -0.722 (180deg=-2.42!) USER MOD Single : A 14 THR OG1 : rot -82:sc= 0.242 USER MOD Single : A 20 SER OG : rot -40:sc= 0.35 USER MOD Single : A 22 THR OG1 : rot 31:sc= 0.0178 USER MOD Single : A 27 LYS NZ :NH3+ -113:sc= 0.6 (180deg=0.218) USER MOD Single : A 31 GLN : amide:sc= -0.573 X(o=-0.57,f=-0.19) USER MOD Single : A 33 LYS NZ :NH3+ -154:sc= 0.578 (180deg=0.31) USER MOD Single : A 40 GLN : amide:sc= -0.0803 X(o=-0.08,f=-0.42) USER MOD Single : A 41 GLN : amide:sc= -5.6! C(o=-5.6!,f=-9.4!) USER MOD Single : A 48 LYS NZ :NH3+ -154:sc= 0.836 (180deg=0.436) USER MOD Single : A 49 GLN : amide:sc= 0.814 K(o=0.81,f=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.0306 USER MOD Single : A 57 SER OG : rot 180:sc= -2.11! USER MOD Single : A 59 TYR OH : rot -75:sc= 0.175 USER MOD Single : A 60 ASN : amide:sc= -0.141 X(o=-0.14,f=0) USER MOD Single : A 62 GLN : amide:sc= 0.0609 X(o=0.061,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 87:sc= 0.332 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc=-0.000251 X(o=-0.00025,f=-0.00025) USER MOD Single : B 198 GLN : amide:sc= -1.38 K(o=-1.4,f=-0.68) USER MOD Single : B 201 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 210 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 214 SER OG : rot 180:sc= 0 USER MOD Single : B 215 HIS : no HD1:sc=-0.00164 K(o=-0.0016,f=-1.2) USER MOD Single : B 217 ASN : amide:sc= -1.08 X(o=-1.1,f=-0.64) USER MOD Single : B 218 LYS NZ :NH3+ -109:sc= -0.225 (180deg=-0.593) USER MOD Single : B 222 SER OG : rot 180:sc= 0 USER MOD Single : B 225 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -2 3.094 1.423 -2.110 1.00 0.00 N ATOM 2 CA GLY A -2 3.303 1.463 -3.572 1.00 0.00 C ATOM 3 C GLY A -2 4.106 2.680 -3.999 1.00 0.00 C ATOM 4 O GLY A -2 5.313 2.575 -4.258 1.00 0.00 O ATOM 0 H1 GLY A -2 2.542 0.577 -1.861 1.00 0.00 H new ATOM 0 H2 GLY A -2 4.015 1.389 -1.628 1.00 0.00 H new ATOM 0 H3 GLY A -2 2.577 2.274 -1.810 1.00 0.00 H new ATOM 0 HA2 GLY A -2 3.821 0.558 -3.889 1.00 0.00 H new ATOM 0 HA3 GLY A -2 2.337 1.471 -4.076 1.00 0.00 H new ATOM 10 N SER A -1 3.440 3.851 -4.044 1.00 0.00 N ATOM 11 CA SER A -1 4.052 5.117 -4.478 1.00 0.00 C ATOM 12 C SER A -1 3.755 6.224 -3.448 1.00 0.00 C ATOM 13 O SER A -1 2.815 7.012 -3.611 1.00 0.00 O ATOM 14 CB SER A -1 3.546 5.496 -5.895 1.00 0.00 C ATOM 15 OG SER A -1 4.186 6.670 -6.390 1.00 0.00 O ATOM 0 H SER A -1 2.459 3.943 -3.779 1.00 0.00 H new ATOM 0 HA SER A -1 5.134 4.999 -4.536 1.00 0.00 H new ATOM 0 HB2 SER A -1 3.728 4.667 -6.579 1.00 0.00 H new ATOM 0 HB3 SER A -1 2.468 5.655 -5.865 1.00 0.00 H new ATOM 0 HG SER A -1 3.843 6.877 -7.285 1.00 0.00 H new ATOM 21 N HIS A 0 4.527 6.226 -2.346 1.00 0.00 N ATOM 22 CA HIS A 0 4.455 7.281 -1.321 1.00 0.00 C ATOM 23 C HIS A 0 5.339 8.476 -1.735 1.00 0.00 C ATOM 24 O HIS A 0 6.329 8.310 -2.463 1.00 0.00 O ATOM 25 CB HIS A 0 4.849 6.732 0.085 1.00 0.00 C ATOM 26 CG HIS A 0 6.242 6.133 0.231 1.00 0.00 C ATOM 27 ND1 HIS A 0 6.460 4.848 0.685 1.00 0.00 N ATOM 28 CD2 HIS A 0 7.482 6.667 0.057 1.00 0.00 C ATOM 29 CE1 HIS A 0 7.758 4.630 0.795 1.00 0.00 C ATOM 30 NE2 HIS A 0 8.395 5.716 0.418 1.00 0.00 N ATOM 0 H HIS A 0 5.214 5.500 -2.142 1.00 0.00 H new ATOM 0 HA HIS A 0 3.424 7.627 -1.247 1.00 0.00 H new ATOM 0 HB2 HIS A 0 4.753 7.545 0.805 1.00 0.00 H new ATOM 0 HB3 HIS A 0 4.122 5.970 0.367 1.00 0.00 H new ATOM 0 HD2 HIS A 0 7.704 7.661 -0.301 1.00 0.00 H new ATOM 0 HE1 HIS A 0 8.218 3.715 1.137 1.00 0.00 H new ATOM 0 HE2 HIS A 0 9.408 5.831 0.398 1.00 0.00 H new ATOM 39 N MET A 1 4.965 9.673 -1.271 1.00 0.00 N ATOM 40 CA MET A 1 5.682 10.934 -1.569 1.00 0.00 C ATOM 41 C MET A 1 6.417 11.435 -0.317 1.00 0.00 C ATOM 42 O MET A 1 6.338 10.819 0.744 1.00 0.00 O ATOM 43 CB MET A 1 4.670 11.992 -2.088 1.00 0.00 C ATOM 44 CG MET A 1 3.864 11.512 -3.298 1.00 0.00 C ATOM 45 SD MET A 1 4.929 10.996 -4.666 1.00 0.00 S ATOM 46 CE MET A 1 3.758 10.228 -5.785 1.00 0.00 C ATOM 0 H MET A 1 4.150 9.803 -0.672 1.00 0.00 H new ATOM 0 HA MET A 1 6.428 10.757 -2.344 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.983 12.254 -1.283 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.209 12.901 -2.356 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.227 10.679 -3.001 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.205 12.312 -3.634 1.00 0.00 H new ATOM 0 HE1 MET A 1 4.283 9.867 -6.669 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.272 9.391 -5.284 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.006 10.959 -6.083 1.00 0.00 H new ATOM 56 N GLN A 2 7.134 12.560 -0.449 1.00 0.00 N ATOM 57 CA GLN A 2 7.877 13.181 0.662 1.00 0.00 C ATOM 58 C GLN A 2 7.363 14.595 0.935 1.00 0.00 C ATOM 59 O GLN A 2 7.191 15.383 0.008 1.00 0.00 O ATOM 60 CB GLN A 2 9.408 13.170 0.383 1.00 0.00 C ATOM 61 CG GLN A 2 10.093 11.830 0.735 1.00 0.00 C ATOM 62 CD GLN A 2 11.577 11.773 0.374 1.00 0.00 C ATOM 63 OE1 GLN A 2 12.028 12.411 -0.579 1.00 0.00 O ATOM 64 NE2 GLN A 2 12.350 11.012 1.131 1.00 0.00 N ATOM 0 H GLN A 2 7.217 13.068 -1.330 1.00 0.00 H new ATOM 0 HA GLN A 2 7.706 12.589 1.561 1.00 0.00 H new ATOM 0 HB2 GLN A 2 9.578 13.389 -0.671 1.00 0.00 H new ATOM 0 HB3 GLN A 2 9.879 13.970 0.955 1.00 0.00 H new ATOM 0 HG2 GLN A 2 9.983 11.648 1.804 1.00 0.00 H new ATOM 0 HG3 GLN A 2 9.574 11.022 0.219 1.00 0.00 H new ATOM 0 HE21 GLN A 2 11.948 10.495 1.913 1.00 0.00 H new ATOM 0 HE22 GLN A 2 13.348 10.942 0.932 1.00 0.00 H new ATOM 73 N ILE A 3 7.124 14.879 2.230 1.00 0.00 N ATOM 74 CA ILE A 3 6.656 16.186 2.743 1.00 0.00 C ATOM 75 C ILE A 3 7.584 16.637 3.877 1.00 0.00 C ATOM 76 O ILE A 3 8.242 15.803 4.520 1.00 0.00 O ATOM 77 CB ILE A 3 5.150 16.173 3.262 1.00 0.00 C ATOM 78 CG1 ILE A 3 4.865 15.002 4.277 1.00 0.00 C ATOM 79 CG2 ILE A 3 4.148 16.146 2.082 1.00 0.00 C ATOM 80 CD1 ILE A 3 4.742 13.609 3.652 1.00 0.00 C ATOM 0 H ILE A 3 7.254 14.189 2.970 1.00 0.00 H new ATOM 0 HA ILE A 3 6.684 16.882 1.905 1.00 0.00 H new ATOM 0 HB ILE A 3 5.005 17.104 3.811 1.00 0.00 H new ATOM 0 HG12 ILE A 3 5.666 14.981 5.016 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.942 15.224 4.813 1.00 0.00 H new ATOM 0 HG21 ILE A 3 3.129 16.138 2.470 1.00 0.00 H new ATOM 0 HG22 ILE A 3 4.293 17.030 1.461 1.00 0.00 H new ATOM 0 HG23 ILE A 3 4.315 15.251 1.483 1.00 0.00 H new ATOM 0 HD11 ILE A 3 4.546 12.875 4.434 1.00 0.00 H new ATOM 0 HD12 ILE A 3 3.921 13.603 2.935 1.00 0.00 H new ATOM 0 HD13 ILE A 3 5.671 13.356 3.141 1.00 0.00 H new ATOM 92 N PHE A 4 7.623 17.958 4.117 1.00 0.00 N ATOM 93 CA PHE A 4 8.561 18.577 5.074 1.00 0.00 C ATOM 94 C PHE A 4 7.786 19.203 6.241 1.00 0.00 C ATOM 95 O PHE A 4 7.042 20.166 6.072 1.00 0.00 O ATOM 96 CB PHE A 4 9.435 19.638 4.349 1.00 0.00 C ATOM 97 CG PHE A 4 10.181 19.066 3.138 1.00 0.00 C ATOM 98 CD1 PHE A 4 11.132 18.060 3.304 1.00 0.00 C ATOM 99 CD2 PHE A 4 9.907 19.504 1.839 1.00 0.00 C ATOM 100 CE1 PHE A 4 11.791 17.517 2.219 1.00 0.00 C ATOM 101 CE2 PHE A 4 10.567 18.956 0.754 1.00 0.00 C ATOM 102 CZ PHE A 4 11.506 17.965 0.943 1.00 0.00 C ATOM 0 H PHE A 4 7.007 18.627 3.655 1.00 0.00 H new ATOM 0 HA PHE A 4 9.221 17.810 5.479 1.00 0.00 H new ATOM 0 HB2 PHE A 4 8.801 20.463 4.023 1.00 0.00 H new ATOM 0 HB3 PHE A 4 10.157 20.050 5.054 1.00 0.00 H new ATOM 0 HD1 PHE A 4 11.357 17.700 4.297 1.00 0.00 H new ATOM 0 HD2 PHE A 4 9.172 20.279 1.681 1.00 0.00 H new ATOM 0 HE1 PHE A 4 12.529 16.742 2.367 1.00 0.00 H new ATOM 0 HE2 PHE A 4 10.346 19.306 -0.244 1.00 0.00 H new ATOM 0 HZ PHE A 4 12.019 17.538 0.094 1.00 0.00 H new ATOM 112 N VAL A 5 7.951 18.613 7.421 1.00 0.00 N ATOM 113 CA VAL A 5 7.357 19.099 8.672 1.00 0.00 C ATOM 114 C VAL A 5 8.465 19.781 9.487 1.00 0.00 C ATOM 115 O VAL A 5 9.479 19.164 9.786 1.00 0.00 O ATOM 116 CB VAL A 5 6.699 17.908 9.472 1.00 0.00 C ATOM 117 CG1 VAL A 5 6.228 18.340 10.866 1.00 0.00 C ATOM 118 CG2 VAL A 5 5.520 17.301 8.680 1.00 0.00 C ATOM 0 H VAL A 5 8.510 17.769 7.542 1.00 0.00 H new ATOM 0 HA VAL A 5 6.563 19.817 8.465 1.00 0.00 H new ATOM 0 HB VAL A 5 7.470 17.149 9.602 1.00 0.00 H new ATOM 0 HG11 VAL A 5 5.782 17.488 11.380 1.00 0.00 H new ATOM 0 HG12 VAL A 5 7.079 18.705 11.441 1.00 0.00 H new ATOM 0 HG13 VAL A 5 5.487 19.134 10.770 1.00 0.00 H new ATOM 0 HG21 VAL A 5 5.082 16.482 9.250 1.00 0.00 H new ATOM 0 HG22 VAL A 5 4.765 18.068 8.507 1.00 0.00 H new ATOM 0 HG23 VAL A 5 5.880 16.924 7.723 1.00 0.00 H new ATOM 128 N LYS A 6 8.284 21.065 9.802 1.00 0.00 N ATOM 129 CA LYS A 6 9.311 21.896 10.446 1.00 0.00 C ATOM 130 C LYS A 6 8.882 22.234 11.885 1.00 0.00 C ATOM 131 O LYS A 6 7.796 22.789 12.076 1.00 0.00 O ATOM 132 CB LYS A 6 9.496 23.206 9.628 1.00 0.00 C ATOM 133 CG LYS A 6 10.802 23.961 9.944 1.00 0.00 C ATOM 134 CD LYS A 6 12.035 23.318 9.266 1.00 0.00 C ATOM 135 CE LYS A 6 13.340 24.020 9.651 1.00 0.00 C ATOM 136 NZ LYS A 6 14.513 23.476 8.928 1.00 0.00 N ATOM 0 H LYS A 6 7.414 21.564 9.617 1.00 0.00 H new ATOM 0 HA LYS A 6 10.254 21.351 10.478 1.00 0.00 H new ATOM 0 HB2 LYS A 6 9.475 22.965 8.565 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.650 23.866 9.822 1.00 0.00 H new ATOM 0 HG2 LYS A 6 10.709 24.996 9.615 1.00 0.00 H new ATOM 0 HG3 LYS A 6 10.954 23.982 11.023 1.00 0.00 H new ATOM 0 HD2 LYS A 6 12.094 22.266 9.546 1.00 0.00 H new ATOM 0 HD3 LYS A 6 11.912 23.353 8.184 1.00 0.00 H new ATOM 0 HE2 LYS A 6 13.251 25.086 9.441 1.00 0.00 H new ATOM 0 HE3 LYS A 6 13.500 23.919 10.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 15.177 23.056 9.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 14.199 22.747 8.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 14.988 24.243 8.410 1.00 0.00 H new ATOM 150 N THR A 7 9.733 21.926 12.883 1.00 0.00 N ATOM 151 CA THR A 7 9.424 22.191 14.300 1.00 0.00 C ATOM 152 C THR A 7 9.632 23.664 14.669 1.00 0.00 C ATOM 153 O THR A 7 10.232 24.439 13.911 1.00 0.00 O ATOM 154 CB THR A 7 10.292 21.315 15.258 1.00 0.00 C ATOM 155 OG1 THR A 7 11.680 21.545 15.004 1.00 0.00 O ATOM 156 CG2 THR A 7 9.985 19.825 15.114 1.00 0.00 C ATOM 0 H THR A 7 10.643 21.492 12.732 1.00 0.00 H new ATOM 0 HA THR A 7 8.372 21.934 14.425 1.00 0.00 H new ATOM 0 HB THR A 7 10.045 21.607 16.279 1.00 0.00 H new ATOM 0 HG1 THR A 7 12.160 21.621 15.855 1.00 0.00 H new ATOM 0 HG21 THR A 7 10.613 19.256 15.800 1.00 0.00 H new ATOM 0 HG22 THR A 7 8.936 19.645 15.349 1.00 0.00 H new ATOM 0 HG23 THR A 7 10.187 19.509 14.091 1.00 0.00 H new ATOM 164 N LEU A 8 9.145 24.016 15.875 1.00 0.00 N ATOM 165 CA LEU A 8 9.388 25.327 16.509 1.00 0.00 C ATOM 166 C LEU A 8 10.879 25.474 16.884 1.00 0.00 C ATOM 167 O LEU A 8 11.404 26.591 16.945 1.00 0.00 O ATOM 168 CB LEU A 8 8.524 25.473 17.786 1.00 0.00 C ATOM 169 CG LEU A 8 6.995 25.228 17.639 1.00 0.00 C ATOM 170 CD1 LEU A 8 6.282 25.387 19.000 1.00 0.00 C ATOM 171 CD2 LEU A 8 6.367 26.136 16.552 1.00 0.00 C ATOM 0 H LEU A 8 8.568 23.394 16.441 1.00 0.00 H new ATOM 0 HA LEU A 8 9.117 26.107 15.797 1.00 0.00 H new ATOM 0 HB2 LEU A 8 8.907 24.780 18.535 1.00 0.00 H new ATOM 0 HB3 LEU A 8 8.669 26.479 18.179 1.00 0.00 H new ATOM 0 HG LEU A 8 6.854 24.200 17.306 1.00 0.00 H new ATOM 0 HD11 LEU A 8 5.214 25.211 18.874 1.00 0.00 H new ATOM 0 HD12 LEU A 8 6.687 24.665 19.709 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.441 26.397 19.379 1.00 0.00 H new ATOM 0 HD21 LEU A 8 5.298 25.933 16.481 1.00 0.00 H new ATOM 0 HD22 LEU A 8 6.521 27.182 16.818 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.839 25.933 15.591 1.00 0.00 H new ATOM 183 N THR A 9 11.539 24.319 17.138 1.00 0.00 N ATOM 184 CA THR A 9 12.977 24.253 17.459 1.00 0.00 C ATOM 185 C THR A 9 13.836 24.363 16.178 1.00 0.00 C ATOM 186 O THR A 9 15.065 24.491 16.257 1.00 0.00 O ATOM 187 CB THR A 9 13.321 22.942 18.249 1.00 0.00 C ATOM 188 OG1 THR A 9 12.942 21.786 17.485 1.00 0.00 O ATOM 189 CG2 THR A 9 12.616 22.900 19.625 1.00 0.00 C ATOM 0 H THR A 9 11.084 23.406 17.125 1.00 0.00 H new ATOM 0 HA THR A 9 13.213 25.103 18.099 1.00 0.00 H new ATOM 0 HB THR A 9 14.398 22.938 18.416 1.00 0.00 H new ATOM 0 HG1 THR A 9 13.163 20.975 17.988 1.00 0.00 H new ATOM 0 HG21 THR A 9 12.880 21.977 20.141 1.00 0.00 H new ATOM 0 HG22 THR A 9 12.935 23.754 20.223 1.00 0.00 H new ATOM 0 HG23 THR A 9 11.536 22.940 19.482 1.00 0.00 H new ATOM 197 N GLY A 10 13.173 24.299 15.007 1.00 0.00 N ATOM 198 CA GLY A 10 13.790 24.627 13.726 1.00 0.00 C ATOM 199 C GLY A 10 14.471 23.454 13.046 1.00 0.00 C ATOM 200 O GLY A 10 15.366 23.650 12.215 1.00 0.00 O ATOM 0 H GLY A 10 12.195 24.018 14.932 1.00 0.00 H new ATOM 0 HA2 GLY A 10 13.026 25.026 13.059 1.00 0.00 H new ATOM 0 HA3 GLY A 10 14.523 25.419 13.880 1.00 0.00 H new ATOM 204 N LYS A 11 14.055 22.226 13.394 1.00 0.00 N ATOM 205 CA LYS A 11 14.528 20.996 12.725 1.00 0.00 C ATOM 206 C LYS A 11 13.528 20.606 11.608 1.00 0.00 C ATOM 207 O LYS A 11 12.340 20.942 11.691 1.00 0.00 O ATOM 208 CB LYS A 11 14.718 19.837 13.759 1.00 0.00 C ATOM 209 CG LYS A 11 13.476 18.959 13.997 1.00 0.00 C ATOM 210 CD LYS A 11 13.657 17.861 15.073 1.00 0.00 C ATOM 211 CE LYS A 11 14.442 16.631 14.582 1.00 0.00 C ATOM 212 NZ LYS A 11 15.859 16.923 14.240 1.00 0.00 N ATOM 0 H LYS A 11 13.384 22.054 14.143 1.00 0.00 H new ATOM 0 HA LYS A 11 15.502 21.181 12.272 1.00 0.00 H new ATOM 0 HB2 LYS A 11 15.534 19.199 13.419 1.00 0.00 H new ATOM 0 HB3 LYS A 11 15.026 20.269 14.711 1.00 0.00 H new ATOM 0 HG2 LYS A 11 12.645 19.601 14.288 1.00 0.00 H new ATOM 0 HG3 LYS A 11 13.198 18.484 13.056 1.00 0.00 H new ATOM 0 HD2 LYS A 11 14.172 18.290 15.933 1.00 0.00 H new ATOM 0 HD3 LYS A 11 12.675 17.539 15.418 1.00 0.00 H new ATOM 0 HE2 LYS A 11 14.415 15.862 15.354 1.00 0.00 H new ATOM 0 HE3 LYS A 11 13.943 16.219 13.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 16.447 16.094 14.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 15.933 17.142 13.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 16.189 17.738 14.795 1.00 0.00 H new ATOM 226 N THR A 12 14.018 19.918 10.565 1.00 0.00 N ATOM 227 CA THR A 12 13.170 19.392 9.474 1.00 0.00 C ATOM 228 C THR A 12 12.930 17.883 9.674 1.00 0.00 C ATOM 229 O THR A 12 13.837 17.140 10.073 1.00 0.00 O ATOM 230 CB THR A 12 13.836 19.633 8.087 1.00 0.00 C ATOM 231 OG1 THR A 12 14.072 21.030 7.899 1.00 0.00 O ATOM 232 CG2 THR A 12 12.986 19.094 6.903 1.00 0.00 C ATOM 0 H THR A 12 15.010 19.709 10.451 1.00 0.00 H new ATOM 0 HA THR A 12 12.217 19.920 9.500 1.00 0.00 H new ATOM 0 HB THR A 12 14.776 19.081 8.090 1.00 0.00 H new ATOM 0 HG1 THR A 12 15.032 21.186 7.776 1.00 0.00 H new ATOM 0 HG21 THR A 12 13.503 19.292 5.964 1.00 0.00 H new ATOM 0 HG22 THR A 12 12.842 18.020 7.018 1.00 0.00 H new ATOM 0 HG23 THR A 12 12.016 19.592 6.895 1.00 0.00 H new ATOM 240 N ILE A 13 11.693 17.459 9.407 1.00 0.00 N ATOM 241 CA ILE A 13 11.266 16.054 9.462 1.00 0.00 C ATOM 242 C ILE A 13 10.649 15.686 8.101 1.00 0.00 C ATOM 243 O ILE A 13 9.541 16.132 7.785 1.00 0.00 O ATOM 244 CB ILE A 13 10.214 15.792 10.621 1.00 0.00 C ATOM 245 CG1 ILE A 13 10.767 16.238 12.023 1.00 0.00 C ATOM 246 CG2 ILE A 13 9.773 14.315 10.656 1.00 0.00 C ATOM 247 CD1 ILE A 13 10.486 17.685 12.371 1.00 0.00 C ATOM 0 H ILE A 13 10.941 18.095 9.140 1.00 0.00 H new ATOM 0 HA ILE A 13 12.136 15.433 9.677 1.00 0.00 H new ATOM 0 HB ILE A 13 9.339 16.403 10.400 1.00 0.00 H new ATOM 0 HG12 ILE A 13 10.332 15.600 12.792 1.00 0.00 H new ATOM 0 HG13 ILE A 13 11.844 16.074 12.045 1.00 0.00 H new ATOM 0 HG21 ILE A 13 9.053 14.169 11.461 1.00 0.00 H new ATOM 0 HG22 ILE A 13 9.312 14.050 9.704 1.00 0.00 H new ATOM 0 HG23 ILE A 13 10.642 13.680 10.828 1.00 0.00 H new ATOM 0 HD11 ILE A 13 10.901 17.910 13.354 1.00 0.00 H new ATOM 0 HD12 ILE A 13 10.945 18.334 11.626 1.00 0.00 H new ATOM 0 HD13 ILE A 13 9.409 17.853 12.385 1.00 0.00 H new ATOM 259 N THR A 14 11.380 14.913 7.284 1.00 0.00 N ATOM 260 CA THR A 14 10.878 14.423 5.992 1.00 0.00 C ATOM 261 C THR A 14 10.116 13.108 6.211 1.00 0.00 C ATOM 262 O THR A 14 10.677 12.159 6.759 1.00 0.00 O ATOM 263 CB THR A 14 12.040 14.189 4.965 1.00 0.00 C ATOM 264 OG1 THR A 14 12.812 15.394 4.815 1.00 0.00 O ATOM 265 CG2 THR A 14 11.509 13.742 3.584 1.00 0.00 C ATOM 0 H THR A 14 12.330 14.611 7.499 1.00 0.00 H new ATOM 0 HA THR A 14 10.215 15.183 5.578 1.00 0.00 H new ATOM 0 HB THR A 14 12.668 13.390 5.358 1.00 0.00 H new ATOM 0 HG1 THR A 14 12.365 15.992 4.180 1.00 0.00 H new ATOM 0 HG21 THR A 14 12.347 13.591 2.903 1.00 0.00 H new ATOM 0 HG22 THR A 14 10.956 12.809 3.691 1.00 0.00 H new ATOM 0 HG23 THR A 14 10.849 14.510 3.182 1.00 0.00 H new ATOM 273 N LEU A 15 8.841 13.063 5.796 1.00 0.00 N ATOM 274 CA LEU A 15 8.011 11.841 5.877 1.00 0.00 C ATOM 275 C LEU A 15 7.856 11.254 4.485 1.00 0.00 C ATOM 276 O LEU A 15 7.946 11.967 3.487 1.00 0.00 O ATOM 277 CB LEU A 15 6.596 12.094 6.484 1.00 0.00 C ATOM 278 CG LEU A 15 6.538 12.800 7.871 1.00 0.00 C ATOM 279 CD1 LEU A 15 7.520 12.172 8.869 1.00 0.00 C ATOM 280 CD2 LEU A 15 6.768 14.313 7.738 1.00 0.00 C ATOM 0 H LEU A 15 8.354 13.865 5.396 1.00 0.00 H new ATOM 0 HA LEU A 15 8.525 11.150 6.545 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.025 12.693 5.775 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.088 11.134 6.571 1.00 0.00 H new ATOM 0 HG LEU A 15 5.534 12.651 8.268 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.450 12.692 9.824 1.00 0.00 H new ATOM 0 HD12 LEU A 15 7.273 11.120 9.009 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.536 12.258 8.483 1.00 0.00 H new ATOM 0 HD21 LEU A 15 6.721 14.776 8.724 1.00 0.00 H new ATOM 0 HD22 LEU A 15 7.748 14.495 7.298 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.998 14.743 7.098 1.00 0.00 H new ATOM 292 N GLU A 16 7.582 9.956 4.445 1.00 0.00 N ATOM 293 CA GLU A 16 7.456 9.176 3.217 1.00 0.00 C ATOM 294 C GLU A 16 6.051 8.569 3.153 1.00 0.00 C ATOM 295 O GLU A 16 5.867 7.354 3.300 1.00 0.00 O ATOM 296 CB GLU A 16 8.559 8.089 3.181 1.00 0.00 C ATOM 297 CG GLU A 16 9.990 8.648 3.068 1.00 0.00 C ATOM 298 CD GLU A 16 11.058 7.556 3.163 1.00 0.00 C ATOM 299 OE1 GLU A 16 11.132 6.704 2.249 1.00 0.00 O ATOM 300 OE2 GLU A 16 11.800 7.518 4.161 1.00 0.00 O ATOM 0 H GLU A 16 7.437 9.400 5.288 1.00 0.00 H new ATOM 0 HA GLU A 16 7.590 9.812 2.342 1.00 0.00 H new ATOM 0 HB2 GLU A 16 8.487 7.484 4.085 1.00 0.00 H new ATOM 0 HB3 GLU A 16 8.372 7.425 2.337 1.00 0.00 H new ATOM 0 HG2 GLU A 16 10.097 9.174 2.119 1.00 0.00 H new ATOM 0 HG3 GLU A 16 10.153 9.380 3.858 1.00 0.00 H new ATOM 307 N VAL A 17 5.053 9.442 2.950 1.00 0.00 N ATOM 308 CA VAL A 17 3.620 9.063 2.929 1.00 0.00 C ATOM 309 C VAL A 17 2.938 9.789 1.760 1.00 0.00 C ATOM 310 O VAL A 17 3.544 10.638 1.095 1.00 0.00 O ATOM 311 CB VAL A 17 2.846 9.394 4.280 1.00 0.00 C ATOM 312 CG1 VAL A 17 3.571 8.858 5.532 1.00 0.00 C ATOM 313 CG2 VAL A 17 2.544 10.900 4.418 1.00 0.00 C ATOM 0 H VAL A 17 5.211 10.438 2.794 1.00 0.00 H new ATOM 0 HA VAL A 17 3.578 7.980 2.811 1.00 0.00 H new ATOM 0 HB VAL A 17 1.894 8.867 4.215 1.00 0.00 H new ATOM 0 HG11 VAL A 17 2.997 9.114 6.422 1.00 0.00 H new ATOM 0 HG12 VAL A 17 3.667 7.775 5.461 1.00 0.00 H new ATOM 0 HG13 VAL A 17 4.562 9.307 5.598 1.00 0.00 H new ATOM 0 HG21 VAL A 17 2.015 11.081 5.354 1.00 0.00 H new ATOM 0 HG22 VAL A 17 3.479 11.460 4.415 1.00 0.00 H new ATOM 0 HG23 VAL A 17 1.924 11.225 3.582 1.00 0.00 H new ATOM 323 N GLU A 18 1.666 9.478 1.538 1.00 0.00 N ATOM 324 CA GLU A 18 0.880 10.066 0.441 1.00 0.00 C ATOM 325 C GLU A 18 0.175 11.338 0.960 1.00 0.00 C ATOM 326 O GLU A 18 -0.110 11.436 2.160 1.00 0.00 O ATOM 327 CB GLU A 18 -0.159 9.031 -0.075 1.00 0.00 C ATOM 328 CG GLU A 18 0.371 7.589 -0.074 1.00 0.00 C ATOM 329 CD GLU A 18 -0.627 6.570 -0.631 1.00 0.00 C ATOM 330 OE1 GLU A 18 -1.600 6.225 0.073 1.00 0.00 O ATOM 331 OE2 GLU A 18 -0.457 6.121 -1.784 1.00 0.00 O ATOM 0 H GLU A 18 1.144 8.813 2.108 1.00 0.00 H new ATOM 0 HA GLU A 18 1.534 10.333 -0.389 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.053 9.083 0.546 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -0.458 9.300 -1.088 1.00 0.00 H new ATOM 0 HG2 GLU A 18 1.287 7.547 -0.663 1.00 0.00 H new ATOM 0 HG3 GLU A 18 0.634 7.308 0.946 1.00 0.00 H new ATOM 338 N PRO A 19 -0.075 12.356 0.097 1.00 0.00 N ATOM 339 CA PRO A 19 -1.020 13.443 0.433 1.00 0.00 C ATOM 340 C PRO A 19 -2.450 12.895 0.725 1.00 0.00 C ATOM 341 O PRO A 19 -3.155 13.417 1.595 1.00 0.00 O ATOM 342 CB PRO A 19 -0.965 14.398 -0.793 1.00 0.00 C ATOM 343 CG PRO A 19 -0.297 13.608 -1.885 1.00 0.00 C ATOM 344 CD PRO A 19 0.600 12.594 -1.203 1.00 0.00 C ATOM 0 HA PRO A 19 -0.751 13.966 1.351 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -1.965 14.713 -1.091 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -0.402 15.302 -0.562 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -1.038 13.110 -2.511 1.00 0.00 H new ATOM 0 HG3 PRO A 19 0.283 14.262 -2.536 1.00 0.00 H new ATOM 0 HD2 PRO A 19 0.685 11.677 -1.786 1.00 0.00 H new ATOM 0 HD3 PRO A 19 1.610 12.979 -1.066 1.00 0.00 H new ATOM 352 N SER A 20 -2.836 11.787 0.057 1.00 0.00 N ATOM 353 CA SER A 20 -4.173 11.164 0.232 1.00 0.00 C ATOM 354 C SER A 20 -4.096 9.981 1.235 1.00 0.00 C ATOM 355 O SER A 20 -5.007 9.148 1.293 1.00 0.00 O ATOM 356 CB SER A 20 -4.723 10.710 -1.152 1.00 0.00 C ATOM 357 OG SER A 20 -6.081 10.275 -1.091 1.00 0.00 O ATOM 0 H SER A 20 -2.240 11.301 -0.613 1.00 0.00 H new ATOM 0 HA SER A 20 -4.863 11.897 0.649 1.00 0.00 H new ATOM 0 HB2 SER A 20 -4.642 11.536 -1.859 1.00 0.00 H new ATOM 0 HB3 SER A 20 -4.103 9.900 -1.536 1.00 0.00 H new ATOM 0 HG SER A 20 -6.222 9.756 -0.272 1.00 0.00 H new ATOM 363 N ASP A 21 -3.011 9.942 2.044 1.00 0.00 N ATOM 364 CA ASP A 21 -2.806 8.926 3.096 1.00 0.00 C ATOM 365 C ASP A 21 -3.749 9.210 4.300 1.00 0.00 C ATOM 366 O ASP A 21 -4.925 8.844 4.228 1.00 0.00 O ATOM 367 CB ASP A 21 -1.287 8.882 3.454 1.00 0.00 C ATOM 368 CG ASP A 21 -0.902 8.114 4.720 1.00 0.00 C ATOM 369 OD1 ASP A 21 -1.110 6.882 4.777 1.00 0.00 O ATOM 370 OD2 ASP A 21 -0.395 8.752 5.663 1.00 0.00 O ATOM 0 H ASP A 21 -2.251 10.619 1.982 1.00 0.00 H new ATOM 0 HA ASP A 21 -3.076 7.928 2.751 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -0.752 8.442 2.613 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -0.932 9.907 3.557 1.00 0.00 H new ATOM 375 N THR A 22 -3.252 9.895 5.357 1.00 0.00 N ATOM 376 CA THR A 22 -4.025 10.289 6.561 1.00 0.00 C ATOM 377 C THR A 22 -3.076 10.923 7.586 1.00 0.00 C ATOM 378 O THR A 22 -1.960 10.437 7.780 1.00 0.00 O ATOM 379 CB THR A 22 -4.821 9.109 7.251 1.00 0.00 C ATOM 380 OG1 THR A 22 -5.466 9.565 8.455 1.00 0.00 O ATOM 381 CG2 THR A 22 -3.949 7.893 7.590 1.00 0.00 C ATOM 0 H THR A 22 -2.279 10.197 5.398 1.00 0.00 H new ATOM 0 HA THR A 22 -4.778 10.997 6.214 1.00 0.00 H new ATOM 0 HB THR A 22 -5.559 8.789 6.516 1.00 0.00 H new ATOM 0 HG1 THR A 22 -5.714 10.508 8.356 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.563 7.125 8.060 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.508 7.496 6.676 1.00 0.00 H new ATOM 0 HG23 THR A 22 -3.156 8.193 8.275 1.00 0.00 H new ATOM 389 N ILE A 23 -3.548 11.989 8.257 1.00 0.00 N ATOM 390 CA ILE A 23 -2.751 12.774 9.220 1.00 0.00 C ATOM 391 C ILE A 23 -2.299 11.910 10.417 1.00 0.00 C ATOM 392 O ILE A 23 -1.185 12.090 10.925 1.00 0.00 O ATOM 393 CB ILE A 23 -3.556 14.015 9.759 1.00 0.00 C ATOM 394 CG1 ILE A 23 -3.983 14.982 8.602 1.00 0.00 C ATOM 395 CG2 ILE A 23 -2.766 14.781 10.855 1.00 0.00 C ATOM 396 CD1 ILE A 23 -2.836 15.648 7.862 1.00 0.00 C ATOM 0 H ILE A 23 -4.502 12.334 8.146 1.00 0.00 H new ATOM 0 HA ILE A 23 -1.872 13.126 8.681 1.00 0.00 H new ATOM 0 HB ILE A 23 -4.465 13.623 10.215 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -4.582 14.422 7.884 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -4.626 15.758 9.017 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -3.355 15.630 11.201 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -2.565 14.113 11.693 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -1.823 15.138 10.441 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -3.234 16.296 7.082 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -2.247 16.241 8.562 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -2.202 14.885 7.411 1.00 0.00 H new ATOM 408 N GLU A 24 -3.184 10.988 10.859 1.00 0.00 N ATOM 409 CA GLU A 24 -2.892 10.053 11.971 1.00 0.00 C ATOM 410 C GLU A 24 -1.599 9.258 11.693 1.00 0.00 C ATOM 411 O GLU A 24 -0.747 9.068 12.573 1.00 0.00 O ATOM 412 CB GLU A 24 -4.077 9.073 12.179 1.00 0.00 C ATOM 413 CG GLU A 24 -3.942 8.171 13.427 1.00 0.00 C ATOM 414 CD GLU A 24 -5.118 7.193 13.598 1.00 0.00 C ATOM 415 OE1 GLU A 24 -6.192 7.616 14.077 1.00 0.00 O ATOM 416 OE2 GLU A 24 -4.977 6.003 13.252 1.00 0.00 O ATOM 0 H GLU A 24 -4.115 10.871 10.459 1.00 0.00 H new ATOM 0 HA GLU A 24 -2.752 10.641 12.878 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -5.000 9.648 12.258 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -4.170 8.441 11.296 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -3.013 7.604 13.359 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -3.868 8.799 14.315 1.00 0.00 H new ATOM 423 N ASN A 25 -1.456 8.854 10.433 1.00 0.00 N ATOM 424 CA ASN A 25 -0.309 8.079 9.961 1.00 0.00 C ATOM 425 C ASN A 25 0.927 8.964 9.865 1.00 0.00 C ATOM 426 O ASN A 25 2.004 8.562 10.283 1.00 0.00 O ATOM 427 CB ASN A 25 -0.638 7.470 8.596 1.00 0.00 C ATOM 428 CG ASN A 25 0.418 6.495 8.082 1.00 0.00 C ATOM 429 OD1 ASN A 25 0.426 5.320 8.436 1.00 0.00 O ATOM 430 ND2 ASN A 25 1.316 6.968 7.236 1.00 0.00 N ATOM 0 H ASN A 25 -2.139 9.057 9.703 1.00 0.00 H new ATOM 0 HA ASN A 25 -0.098 7.279 10.670 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -1.595 6.952 8.661 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -0.760 8.274 7.870 1.00 0.00 H new ATOM 0 HD21 ASN A 25 2.038 6.352 6.861 1.00 0.00 H new ATOM 0 HD22 ASN A 25 1.287 7.949 6.958 1.00 0.00 H new ATOM 437 N VAL A 26 0.729 10.182 9.324 1.00 0.00 N ATOM 438 CA VAL A 26 1.809 11.177 9.122 1.00 0.00 C ATOM 439 C VAL A 26 2.527 11.473 10.449 1.00 0.00 C ATOM 440 O VAL A 26 3.748 11.406 10.511 1.00 0.00 O ATOM 441 CB VAL A 26 1.275 12.536 8.504 1.00 0.00 C ATOM 442 CG1 VAL A 26 2.410 13.580 8.287 1.00 0.00 C ATOM 443 CG2 VAL A 26 0.517 12.280 7.187 1.00 0.00 C ATOM 0 H VAL A 26 -0.186 10.508 9.013 1.00 0.00 H new ATOM 0 HA VAL A 26 2.507 10.736 8.411 1.00 0.00 H new ATOM 0 HB VAL A 26 0.584 12.961 9.232 1.00 0.00 H new ATOM 0 HG11 VAL A 26 1.990 14.491 7.862 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.881 13.809 9.243 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.155 13.171 7.604 1.00 0.00 H new ATOM 0 HG21 VAL A 26 0.160 13.227 6.782 1.00 0.00 H new ATOM 0 HG22 VAL A 26 1.186 11.807 6.468 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -0.332 11.624 7.378 1.00 0.00 H new ATOM 453 N LYS A 27 1.745 11.745 11.513 1.00 0.00 N ATOM 454 CA LYS A 27 2.288 12.091 12.845 1.00 0.00 C ATOM 455 C LYS A 27 2.989 10.891 13.499 1.00 0.00 C ATOM 456 O LYS A 27 3.971 11.059 14.226 1.00 0.00 O ATOM 457 CB LYS A 27 1.182 12.655 13.767 1.00 0.00 C ATOM 458 CG LYS A 27 0.044 11.695 14.136 1.00 0.00 C ATOM 459 CD LYS A 27 -1.046 12.382 14.983 1.00 0.00 C ATOM 460 CE LYS A 27 -1.764 13.514 14.232 1.00 0.00 C ATOM 461 NZ LYS A 27 -2.701 14.258 15.121 1.00 0.00 N ATOM 0 H LYS A 27 0.726 11.732 11.476 1.00 0.00 H new ATOM 0 HA LYS A 27 3.037 12.869 12.699 1.00 0.00 H new ATOM 0 HB2 LYS A 27 1.650 13.000 14.689 1.00 0.00 H new ATOM 0 HB3 LYS A 27 0.747 13.530 13.283 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -0.403 11.297 13.225 1.00 0.00 H new ATOM 0 HG3 LYS A 27 0.450 10.848 14.688 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -1.779 11.638 15.295 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -0.594 12.784 15.890 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -1.026 14.204 13.822 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -2.315 13.099 13.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -3.680 14.090 14.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -2.585 13.929 16.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -2.492 15.276 15.071 1.00 0.00 H new ATOM 475 N ALA A 28 2.468 9.681 13.232 1.00 0.00 N ATOM 476 CA ALA A 28 3.134 8.423 13.615 1.00 0.00 C ATOM 477 C ALA A 28 4.540 8.326 12.981 1.00 0.00 C ATOM 478 O ALA A 28 5.467 7.773 13.580 1.00 0.00 O ATOM 479 CB ALA A 28 2.255 7.228 13.215 1.00 0.00 C ATOM 0 H ALA A 28 1.580 9.547 12.748 1.00 0.00 H new ATOM 0 HA ALA A 28 3.267 8.408 14.697 1.00 0.00 H new ATOM 0 HB1 ALA A 28 2.751 6.300 13.500 1.00 0.00 H new ATOM 0 HB2 ALA A 28 1.294 7.297 13.724 1.00 0.00 H new ATOM 0 HB3 ALA A 28 2.096 7.238 12.137 1.00 0.00 H new ATOM 485 N LYS A 29 4.678 8.883 11.762 1.00 0.00 N ATOM 486 CA LYS A 29 5.957 8.937 11.040 1.00 0.00 C ATOM 487 C LYS A 29 6.899 10.026 11.591 1.00 0.00 C ATOM 488 O LYS A 29 8.102 9.850 11.506 1.00 0.00 O ATOM 489 CB LYS A 29 5.733 9.126 9.520 1.00 0.00 C ATOM 490 CG LYS A 29 4.777 8.106 8.891 1.00 0.00 C ATOM 491 CD LYS A 29 5.205 6.639 9.127 1.00 0.00 C ATOM 492 CE LYS A 29 4.050 5.666 8.879 1.00 0.00 C ATOM 493 NZ LYS A 29 2.953 5.845 9.863 1.00 0.00 N ATOM 0 H LYS A 29 3.903 9.308 11.253 1.00 0.00 H new ATOM 0 HA LYS A 29 6.447 7.977 11.202 1.00 0.00 H new ATOM 0 HB2 LYS A 29 5.343 10.128 9.344 1.00 0.00 H new ATOM 0 HB3 LYS A 29 6.696 9.065 9.012 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.777 8.256 9.299 1.00 0.00 H new ATOM 0 HG3 LYS A 29 4.714 8.291 7.819 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.037 6.392 8.468 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.564 6.525 10.150 1.00 0.00 H new ATOM 0 HE2 LYS A 29 3.661 5.814 7.871 1.00 0.00 H new ATOM 0 HE3 LYS A 29 4.421 4.642 8.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 2.119 5.306 9.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 3.263 5.502 10.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.708 6.853 9.930 1.00 0.00 H new ATOM 507 N ILE A 30 6.374 11.163 12.131 1.00 0.00 N ATOM 508 CA ILE A 30 7.236 12.142 12.858 1.00 0.00 C ATOM 509 C ILE A 30 7.889 11.437 14.079 1.00 0.00 C ATOM 510 O ILE A 30 9.083 11.625 14.360 1.00 0.00 O ATOM 511 CB ILE A 30 6.477 13.473 13.306 1.00 0.00 C ATOM 512 CG1 ILE A 30 6.191 14.445 12.099 1.00 0.00 C ATOM 513 CG2 ILE A 30 7.259 14.238 14.401 1.00 0.00 C ATOM 514 CD1 ILE A 30 5.017 14.094 11.219 1.00 0.00 C ATOM 0 H ILE A 30 5.388 11.420 12.080 1.00 0.00 H new ATOM 0 HA ILE A 30 8.001 12.475 12.157 1.00 0.00 H new ATOM 0 HB ILE A 30 5.521 13.141 13.712 1.00 0.00 H new ATOM 0 HG12 ILE A 30 6.032 15.447 12.498 1.00 0.00 H new ATOM 0 HG13 ILE A 30 7.084 14.488 11.476 1.00 0.00 H new ATOM 0 HG21 ILE A 30 6.710 15.138 14.679 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.377 13.600 15.277 1.00 0.00 H new ATOM 0 HG23 ILE A 30 8.241 14.516 14.019 1.00 0.00 H new ATOM 0 HD11 ILE A 30 4.922 14.835 10.426 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.174 13.109 10.779 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.105 14.083 11.816 1.00 0.00 H new ATOM 526 N GLN A 31 7.100 10.579 14.755 1.00 0.00 N ATOM 527 CA GLN A 31 7.587 9.727 15.859 1.00 0.00 C ATOM 528 C GLN A 31 8.644 8.720 15.362 1.00 0.00 C ATOM 529 O GLN A 31 9.573 8.376 16.086 1.00 0.00 O ATOM 530 CB GLN A 31 6.402 8.986 16.539 1.00 0.00 C ATOM 531 CG GLN A 31 6.820 8.046 17.697 1.00 0.00 C ATOM 532 CD GLN A 31 5.656 7.343 18.411 1.00 0.00 C ATOM 533 OE1 GLN A 31 5.736 7.059 19.603 1.00 0.00 O ATOM 534 NE2 GLN A 31 4.577 7.044 17.704 1.00 0.00 N ATOM 0 H GLN A 31 6.108 10.457 14.552 1.00 0.00 H new ATOM 0 HA GLN A 31 8.062 10.373 16.597 1.00 0.00 H new ATOM 0 HB2 GLN A 31 5.698 9.725 16.922 1.00 0.00 H new ATOM 0 HB3 GLN A 31 5.873 8.402 15.786 1.00 0.00 H new ATOM 0 HG2 GLN A 31 7.497 7.288 17.304 1.00 0.00 H new ATOM 0 HG3 GLN A 31 7.381 8.625 18.431 1.00 0.00 H new ATOM 0 HE21 GLN A 31 4.531 7.289 16.715 1.00 0.00 H new ATOM 0 HE22 GLN A 31 3.792 6.569 18.149 1.00 0.00 H new ATOM 543 N ASP A 32 8.475 8.251 14.125 1.00 0.00 N ATOM 544 CA ASP A 32 9.429 7.341 13.462 1.00 0.00 C ATOM 545 C ASP A 32 10.755 8.065 13.111 1.00 0.00 C ATOM 546 O ASP A 32 11.840 7.482 13.232 1.00 0.00 O ATOM 547 CB ASP A 32 8.761 6.753 12.192 1.00 0.00 C ATOM 548 CG ASP A 32 9.671 5.831 11.367 1.00 0.00 C ATOM 549 OD1 ASP A 32 9.774 4.627 11.695 1.00 0.00 O ATOM 550 OD2 ASP A 32 10.296 6.304 10.394 1.00 0.00 O ATOM 0 H ASP A 32 7.670 8.489 13.546 1.00 0.00 H new ATOM 0 HA ASP A 32 9.684 6.532 14.147 1.00 0.00 H new ATOM 0 HB2 ASP A 32 7.872 6.196 12.488 1.00 0.00 H new ATOM 0 HB3 ASP A 32 8.426 7.574 11.559 1.00 0.00 H new ATOM 555 N LYS A 33 10.654 9.351 12.716 1.00 0.00 N ATOM 556 CA LYS A 33 11.791 10.107 12.149 1.00 0.00 C ATOM 557 C LYS A 33 12.612 10.788 13.253 1.00 0.00 C ATOM 558 O LYS A 33 13.777 10.436 13.447 1.00 0.00 O ATOM 559 CB LYS A 33 11.306 11.151 11.109 1.00 0.00 C ATOM 560 CG LYS A 33 10.630 10.565 9.851 1.00 0.00 C ATOM 561 CD LYS A 33 11.566 9.683 9.001 1.00 0.00 C ATOM 562 CE LYS A 33 10.856 9.107 7.763 1.00 0.00 C ATOM 563 NZ LYS A 33 11.753 8.219 6.980 1.00 0.00 N ATOM 0 H LYS A 33 9.791 9.891 12.780 1.00 0.00 H new ATOM 0 HA LYS A 33 12.437 9.392 11.639 1.00 0.00 H new ATOM 0 HB2 LYS A 33 10.604 11.826 11.597 1.00 0.00 H new ATOM 0 HB3 LYS A 33 12.160 11.751 10.796 1.00 0.00 H new ATOM 0 HG2 LYS A 33 9.765 9.975 10.155 1.00 0.00 H new ATOM 0 HG3 LYS A 33 10.257 11.383 9.235 1.00 0.00 H new ATOM 0 HD2 LYS A 33 12.427 10.271 8.683 1.00 0.00 H new ATOM 0 HD3 LYS A 33 11.947 8.865 9.613 1.00 0.00 H new ATOM 0 HE2 LYS A 33 9.974 8.549 8.076 1.00 0.00 H new ATOM 0 HE3 LYS A 33 10.509 9.923 7.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 11.445 8.203 5.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 12.728 8.576 7.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 11.714 7.256 7.370 1.00 0.00 H new ATOM 577 N GLU A 34 12.018 11.771 13.970 1.00 0.00 N ATOM 578 CA GLU A 34 12.748 12.514 15.025 1.00 0.00 C ATOM 579 C GLU A 34 12.721 11.754 16.364 1.00 0.00 C ATOM 580 O GLU A 34 13.608 11.950 17.204 1.00 0.00 O ATOM 581 CB GLU A 34 12.237 13.974 15.195 1.00 0.00 C ATOM 582 CG GLU A 34 10.799 14.159 15.723 1.00 0.00 C ATOM 583 CD GLU A 34 10.469 15.646 16.021 1.00 0.00 C ATOM 584 OE1 GLU A 34 11.092 16.223 16.942 1.00 0.00 O ATOM 585 OE2 GLU A 34 9.615 16.242 15.338 1.00 0.00 O ATOM 0 H GLU A 34 11.050 12.065 13.840 1.00 0.00 H new ATOM 0 HA GLU A 34 13.784 12.584 14.695 1.00 0.00 H new ATOM 0 HB2 GLU A 34 12.915 14.493 15.872 1.00 0.00 H new ATOM 0 HB3 GLU A 34 12.309 14.472 14.228 1.00 0.00 H new ATOM 0 HG2 GLU A 34 10.092 13.772 14.989 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.669 13.571 16.632 1.00 0.00 H new ATOM 592 N GLY A 35 11.707 10.882 16.550 1.00 0.00 N ATOM 593 CA GLY A 35 11.640 9.993 17.721 1.00 0.00 C ATOM 594 C GLY A 35 10.764 10.527 18.838 1.00 0.00 C ATOM 595 O GLY A 35 10.858 10.058 19.980 1.00 0.00 O ATOM 0 H GLY A 35 10.926 10.778 15.902 1.00 0.00 H new ATOM 0 HA2 GLY A 35 11.262 9.020 17.407 1.00 0.00 H new ATOM 0 HA3 GLY A 35 12.648 9.835 18.105 1.00 0.00 H new ATOM 599 N ILE A 36 9.892 11.499 18.510 1.00 0.00 N ATOM 600 CA ILE A 36 9.016 12.175 19.492 1.00 0.00 C ATOM 601 C ILE A 36 7.552 11.703 19.286 1.00 0.00 C ATOM 602 O ILE A 36 7.045 11.786 18.167 1.00 0.00 O ATOM 603 CB ILE A 36 9.136 13.762 19.390 1.00 0.00 C ATOM 604 CG1 ILE A 36 10.460 14.302 20.050 1.00 0.00 C ATOM 605 CG2 ILE A 36 7.917 14.475 20.029 1.00 0.00 C ATOM 606 CD1 ILE A 36 11.770 13.912 19.384 1.00 0.00 C ATOM 0 H ILE A 36 9.773 11.840 17.556 1.00 0.00 H new ATOM 0 HA ILE A 36 9.338 11.902 20.497 1.00 0.00 H new ATOM 0 HB ILE A 36 9.161 13.991 18.325 1.00 0.00 H new ATOM 0 HG12 ILE A 36 10.405 15.390 20.079 1.00 0.00 H new ATOM 0 HG13 ILE A 36 10.489 13.957 21.083 1.00 0.00 H new ATOM 0 HG21 ILE A 36 8.038 15.554 19.938 1.00 0.00 H new ATOM 0 HG22 ILE A 36 7.006 14.168 19.516 1.00 0.00 H new ATOM 0 HG23 ILE A 36 7.849 14.205 21.083 1.00 0.00 H new ATOM 0 HD11 ILE A 36 12.603 14.348 19.936 1.00 0.00 H new ATOM 0 HD12 ILE A 36 11.866 12.826 19.379 1.00 0.00 H new ATOM 0 HD13 ILE A 36 11.781 14.282 18.359 1.00 0.00 H new ATOM 618 N PRO A 37 6.845 11.214 20.372 1.00 0.00 N ATOM 619 CA PRO A 37 5.484 10.609 20.253 1.00 0.00 C ATOM 620 C PRO A 37 4.404 11.642 19.836 1.00 0.00 C ATOM 621 O PRO A 37 4.575 12.829 20.118 1.00 0.00 O ATOM 622 CB PRO A 37 5.230 10.039 21.679 1.00 0.00 C ATOM 623 CG PRO A 37 6.061 10.893 22.588 1.00 0.00 C ATOM 624 CD PRO A 37 7.306 11.236 21.794 1.00 0.00 C ATOM 0 HA PRO A 37 5.428 9.851 19.471 1.00 0.00 H new ATOM 0 HB2 PRO A 37 4.174 10.092 21.943 1.00 0.00 H new ATOM 0 HB3 PRO A 37 5.523 8.991 21.744 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.522 11.794 22.882 1.00 0.00 H new ATOM 0 HG3 PRO A 37 6.314 10.360 23.504 1.00 0.00 H new ATOM 0 HD2 PRO A 37 7.699 12.214 22.071 1.00 0.00 H new ATOM 0 HD3 PRO A 37 8.102 10.512 21.967 1.00 0.00 H new ATOM 632 N PRO A 38 3.264 11.197 19.181 1.00 0.00 N ATOM 633 CA PRO A 38 2.183 12.110 18.678 1.00 0.00 C ATOM 634 C PRO A 38 1.491 12.935 19.791 1.00 0.00 C ATOM 635 O PRO A 38 0.757 13.883 19.501 1.00 0.00 O ATOM 636 CB PRO A 38 1.185 11.139 17.977 1.00 0.00 C ATOM 637 CG PRO A 38 1.450 9.808 18.615 1.00 0.00 C ATOM 638 CD PRO A 38 2.939 9.779 18.869 1.00 0.00 C ATOM 0 HA PRO A 38 2.586 12.876 18.015 1.00 0.00 H new ATOM 0 HB2 PRO A 38 0.152 11.453 18.128 1.00 0.00 H new ATOM 0 HB3 PRO A 38 1.354 11.104 16.901 1.00 0.00 H new ATOM 0 HG2 PRO A 38 0.890 9.698 19.544 1.00 0.00 H new ATOM 0 HG3 PRO A 38 1.146 8.991 17.961 1.00 0.00 H new ATOM 0 HD2 PRO A 38 3.192 9.117 19.697 1.00 0.00 H new ATOM 0 HD3 PRO A 38 3.488 9.423 17.997 1.00 0.00 H new ATOM 646 N ASP A 39 1.726 12.535 21.049 1.00 0.00 N ATOM 647 CA ASP A 39 1.232 13.251 22.244 1.00 0.00 C ATOM 648 C ASP A 39 2.103 14.498 22.534 1.00 0.00 C ATOM 649 O ASP A 39 1.611 15.517 23.034 1.00 0.00 O ATOM 650 CB ASP A 39 1.235 12.272 23.453 1.00 0.00 C ATOM 651 CG ASP A 39 0.631 12.870 24.739 1.00 0.00 C ATOM 652 OD1 ASP A 39 -0.587 13.164 24.746 1.00 0.00 O ATOM 653 OD2 ASP A 39 1.358 13.033 25.744 1.00 0.00 O ATOM 0 H ASP A 39 2.268 11.700 21.272 1.00 0.00 H new ATOM 0 HA ASP A 39 0.215 13.600 22.067 1.00 0.00 H new ATOM 0 HB2 ASP A 39 0.677 11.375 23.184 1.00 0.00 H new ATOM 0 HB3 ASP A 39 2.260 11.961 23.655 1.00 0.00 H new ATOM 658 N GLN A 40 3.402 14.389 22.202 1.00 0.00 N ATOM 659 CA GLN A 40 4.431 15.430 22.449 1.00 0.00 C ATOM 660 C GLN A 40 4.676 16.320 21.214 1.00 0.00 C ATOM 661 O GLN A 40 5.272 17.383 21.336 1.00 0.00 O ATOM 662 CB GLN A 40 5.762 14.743 22.906 1.00 0.00 C ATOM 663 CG GLN A 40 5.970 14.617 24.433 1.00 0.00 C ATOM 664 CD GLN A 40 4.723 14.163 25.191 1.00 0.00 C ATOM 665 OE1 GLN A 40 3.951 14.992 25.658 1.00 0.00 O ATOM 666 NE2 GLN A 40 4.514 12.861 25.298 1.00 0.00 N ATOM 0 H GLN A 40 3.779 13.559 21.744 1.00 0.00 H new ATOM 0 HA GLN A 40 4.063 16.087 23.237 1.00 0.00 H new ATOM 0 HB2 GLN A 40 5.800 13.745 22.470 1.00 0.00 H new ATOM 0 HB3 GLN A 40 6.599 15.304 22.490 1.00 0.00 H new ATOM 0 HG2 GLN A 40 6.777 13.909 24.623 1.00 0.00 H new ATOM 0 HG3 GLN A 40 6.292 15.581 24.827 1.00 0.00 H new ATOM 0 HE21 GLN A 40 5.181 12.203 24.895 1.00 0.00 H new ATOM 0 HE22 GLN A 40 3.686 12.516 25.783 1.00 0.00 H new ATOM 675 N GLN A 41 4.272 15.861 20.030 1.00 0.00 N ATOM 676 CA GLN A 41 4.385 16.647 18.780 1.00 0.00 C ATOM 677 C GLN A 41 2.993 16.898 18.162 1.00 0.00 C ATOM 678 O GLN A 41 2.162 15.987 18.065 1.00 0.00 O ATOM 679 CB GLN A 41 5.373 15.947 17.807 1.00 0.00 C ATOM 680 CG GLN A 41 5.099 14.463 17.462 1.00 0.00 C ATOM 681 CD GLN A 41 4.238 14.236 16.227 1.00 0.00 C ATOM 682 OE1 GLN A 41 4.149 15.081 15.350 1.00 0.00 O ATOM 683 NE2 GLN A 41 3.718 13.047 16.092 1.00 0.00 N ATOM 0 H GLN A 41 3.857 14.938 19.900 1.00 0.00 H new ATOM 0 HA GLN A 41 4.797 17.632 19.000 1.00 0.00 H new ATOM 0 HB2 GLN A 41 5.387 16.513 16.875 1.00 0.00 H new ATOM 0 HB3 GLN A 41 6.373 16.014 18.236 1.00 0.00 H new ATOM 0 HG2 GLN A 41 6.054 13.957 17.318 1.00 0.00 H new ATOM 0 HG3 GLN A 41 4.614 13.991 18.316 1.00 0.00 H new ATOM 0 HE21 GLN A 41 3.809 12.362 16.843 1.00 0.00 H new ATOM 0 HE22 GLN A 41 3.221 12.802 15.236 1.00 0.00 H new ATOM 692 N ARG A 42 2.752 18.164 17.762 1.00 0.00 N ATOM 693 CA ARG A 42 1.429 18.666 17.348 1.00 0.00 C ATOM 694 C ARG A 42 1.500 19.192 15.903 1.00 0.00 C ATOM 695 O ARG A 42 2.339 20.034 15.586 1.00 0.00 O ATOM 696 CB ARG A 42 1.005 19.792 18.326 1.00 0.00 C ATOM 697 CG ARG A 42 -0.487 20.176 18.302 1.00 0.00 C ATOM 698 CD ARG A 42 -0.823 21.191 19.409 1.00 0.00 C ATOM 699 NE ARG A 42 -2.273 21.416 19.553 1.00 0.00 N ATOM 700 CZ ARG A 42 -2.864 22.021 20.607 1.00 0.00 C ATOM 701 NH1 ARG A 42 -2.142 22.536 21.602 1.00 0.00 N ATOM 702 NH2 ARG A 42 -4.187 22.105 20.653 1.00 0.00 N ATOM 0 H ARG A 42 3.482 18.875 17.718 1.00 0.00 H new ATOM 0 HA ARG A 42 0.691 17.865 17.378 1.00 0.00 H new ATOM 0 HB2 ARG A 42 1.265 19.484 19.339 1.00 0.00 H new ATOM 0 HB3 ARG A 42 1.593 20.682 18.102 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -0.740 20.599 17.330 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -1.097 19.281 18.429 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -0.419 20.836 20.357 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -0.332 22.139 19.188 1.00 0.00 H new ATOM 0 HE ARG A 42 -2.877 21.090 18.799 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -1.124 22.478 21.577 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -2.607 22.989 22.389 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -4.749 21.715 19.897 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -4.642 22.560 21.445 1.00 0.00 H new ATOM 716 N LEU A 43 0.577 18.724 15.052 1.00 0.00 N ATOM 717 CA LEU A 43 0.598 18.982 13.593 1.00 0.00 C ATOM 718 C LEU A 43 -0.239 20.212 13.279 1.00 0.00 C ATOM 719 O LEU A 43 -1.386 20.294 13.699 1.00 0.00 O ATOM 720 CB LEU A 43 0.046 17.745 12.811 1.00 0.00 C ATOM 721 CG LEU A 43 1.074 16.619 12.492 1.00 0.00 C ATOM 722 CD1 LEU A 43 2.165 17.136 11.526 1.00 0.00 C ATOM 723 CD2 LEU A 43 1.680 16.047 13.786 1.00 0.00 C ATOM 0 H LEU A 43 -0.213 18.152 15.351 1.00 0.00 H new ATOM 0 HA LEU A 43 1.628 19.157 13.281 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -0.770 17.311 13.389 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.380 18.096 11.871 1.00 0.00 H new ATOM 0 HG LEU A 43 0.551 15.804 11.992 1.00 0.00 H new ATOM 0 HD11 LEU A 43 2.874 16.335 11.315 1.00 0.00 H new ATOM 0 HD12 LEU A 43 1.701 17.464 10.596 1.00 0.00 H new ATOM 0 HD13 LEU A 43 2.690 17.974 11.985 1.00 0.00 H new ATOM 0 HD21 LEU A 43 2.395 15.262 13.537 1.00 0.00 H new ATOM 0 HD22 LEU A 43 2.189 16.842 14.332 1.00 0.00 H new ATOM 0 HD23 LEU A 43 0.886 15.631 14.407 1.00 0.00 H new ATOM 735 N ILE A 44 0.353 21.182 12.562 1.00 0.00 N ATOM 736 CA ILE A 44 -0.321 22.441 12.191 1.00 0.00 C ATOM 737 C ILE A 44 0.094 22.860 10.766 1.00 0.00 C ATOM 738 O ILE A 44 1.279 22.856 10.439 1.00 0.00 O ATOM 739 CB ILE A 44 0.023 23.595 13.226 1.00 0.00 C ATOM 740 CG1 ILE A 44 -0.470 23.204 14.661 1.00 0.00 C ATOM 741 CG2 ILE A 44 -0.574 24.959 12.800 1.00 0.00 C ATOM 742 CD1 ILE A 44 -0.065 24.142 15.764 1.00 0.00 C ATOM 0 H ILE A 44 1.313 21.117 12.222 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.398 22.275 12.215 1.00 0.00 H new ATOM 0 HB ILE A 44 1.107 23.708 13.239 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.558 23.137 14.646 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -0.092 22.209 14.897 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.313 25.717 13.538 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.171 25.245 11.828 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -1.659 24.876 12.733 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -0.458 23.778 16.713 1.00 0.00 H new ATOM 0 HD12 ILE A 44 1.022 24.193 15.817 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.466 25.135 15.562 1.00 0.00 H new ATOM 754 N PHE A 45 -0.901 23.209 9.931 1.00 0.00 N ATOM 755 CA PHE A 45 -0.685 23.804 8.599 1.00 0.00 C ATOM 756 C PHE A 45 -1.713 24.919 8.452 1.00 0.00 C ATOM 757 O PHE A 45 -2.877 24.704 8.773 1.00 0.00 O ATOM 758 CB PHE A 45 -0.847 22.741 7.481 1.00 0.00 C ATOM 759 CG PHE A 45 -0.627 23.248 6.046 1.00 0.00 C ATOM 760 CD1 PHE A 45 0.646 23.271 5.479 1.00 0.00 C ATOM 761 CD2 PHE A 45 -1.700 23.668 5.257 1.00 0.00 C ATOM 762 CE1 PHE A 45 0.845 23.699 4.182 1.00 0.00 C ATOM 763 CE2 PHE A 45 -1.501 24.094 3.959 1.00 0.00 C ATOM 764 CZ PHE A 45 -0.230 24.109 3.420 1.00 0.00 C ATOM 0 H PHE A 45 -1.886 23.085 10.163 1.00 0.00 H new ATOM 0 HA PHE A 45 0.328 24.195 8.505 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.145 21.929 7.672 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.850 22.319 7.548 1.00 0.00 H new ATOM 0 HD1 PHE A 45 1.493 22.948 6.066 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -2.699 23.659 5.668 1.00 0.00 H new ATOM 0 HE1 PHE A 45 1.841 23.713 3.764 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.342 24.417 3.363 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.077 24.441 2.404 1.00 0.00 H new ATOM 774 N ALA A 46 -1.260 26.110 8.021 1.00 0.00 N ATOM 775 CA ALA A 46 -2.122 27.308 7.825 1.00 0.00 C ATOM 776 C ALA A 46 -2.678 27.849 9.166 1.00 0.00 C ATOM 777 O ALA A 46 -3.652 28.617 9.189 1.00 0.00 O ATOM 778 CB ALA A 46 -3.254 27.027 6.807 1.00 0.00 C ATOM 0 H ALA A 46 -0.280 26.278 7.795 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.492 28.093 7.406 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -3.865 27.921 6.686 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -2.819 26.752 5.846 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -3.876 26.209 7.171 1.00 0.00 H new ATOM 784 N GLY A 47 -2.021 27.462 10.282 1.00 0.00 N ATOM 785 CA GLY A 47 -2.387 27.929 11.623 1.00 0.00 C ATOM 786 C GLY A 47 -3.470 27.089 12.299 1.00 0.00 C ATOM 787 O GLY A 47 -3.934 27.444 13.385 1.00 0.00 O ATOM 0 H GLY A 47 -1.228 26.821 10.271 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.497 27.930 12.252 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.731 28.961 11.556 1.00 0.00 H new ATOM 791 N LYS A 48 -3.866 25.966 11.678 1.00 0.00 N ATOM 792 CA LYS A 48 -4.923 25.073 12.219 1.00 0.00 C ATOM 793 C LYS A 48 -4.341 23.674 12.493 1.00 0.00 C ATOM 794 O LYS A 48 -3.456 23.203 11.760 1.00 0.00 O ATOM 795 CB LYS A 48 -6.110 25.011 11.221 1.00 0.00 C ATOM 796 CG LYS A 48 -5.744 24.385 9.859 1.00 0.00 C ATOM 797 CD LYS A 48 -6.757 24.667 8.740 1.00 0.00 C ATOM 798 CE LYS A 48 -6.853 26.158 8.374 1.00 0.00 C ATOM 799 NZ LYS A 48 -7.910 26.410 7.360 1.00 0.00 N ATOM 0 H LYS A 48 -3.471 25.647 10.793 1.00 0.00 H new ATOM 0 HA LYS A 48 -5.293 25.469 13.165 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -6.920 24.436 11.669 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.488 26.020 11.057 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.767 24.759 9.551 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -5.648 23.306 9.982 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -6.477 24.099 7.853 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.740 24.311 9.050 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -7.064 26.740 9.271 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.892 26.501 7.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -7.678 27.270 6.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -7.967 25.601 6.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -8.826 26.536 7.837 1.00 0.00 H new ATOM 813 N GLN A 49 -4.838 23.024 13.561 1.00 0.00 N ATOM 814 CA GLN A 49 -4.331 21.719 14.022 1.00 0.00 C ATOM 815 C GLN A 49 -4.889 20.606 13.108 1.00 0.00 C ATOM 816 O GLN A 49 -6.113 20.472 12.949 1.00 0.00 O ATOM 817 CB GLN A 49 -4.721 21.501 15.519 1.00 0.00 C ATOM 818 CG GLN A 49 -3.832 20.519 16.332 1.00 0.00 C ATOM 819 CD GLN A 49 -4.023 19.033 15.988 1.00 0.00 C ATOM 820 OE1 GLN A 49 -4.884 18.361 16.549 1.00 0.00 O ATOM 821 NE2 GLN A 49 -3.198 18.501 15.108 1.00 0.00 N ATOM 0 H GLN A 49 -5.603 23.389 14.129 1.00 0.00 H new ATOM 0 HA GLN A 49 -3.243 21.690 13.961 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -4.706 22.469 16.020 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -5.749 21.140 15.555 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -2.786 20.782 16.172 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -4.037 20.660 17.393 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -2.491 19.081 14.656 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -3.266 17.509 14.879 1.00 0.00 H new ATOM 830 N LEU A 50 -3.975 19.830 12.504 1.00 0.00 N ATOM 831 CA LEU A 50 -4.317 18.785 11.538 1.00 0.00 C ATOM 832 C LEU A 50 -4.977 17.571 12.237 1.00 0.00 C ATOM 833 O LEU A 50 -4.363 16.913 13.094 1.00 0.00 O ATOM 834 CB LEU A 50 -3.056 18.350 10.758 1.00 0.00 C ATOM 835 CG LEU A 50 -2.196 19.490 10.122 1.00 0.00 C ATOM 836 CD1 LEU A 50 -1.075 18.905 9.250 1.00 0.00 C ATOM 837 CD2 LEU A 50 -3.059 20.502 9.337 1.00 0.00 C ATOM 0 H LEU A 50 -2.973 19.914 12.676 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.041 19.193 10.833 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -2.418 17.779 11.433 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.365 17.672 9.962 1.00 0.00 H new ATOM 0 HG LEU A 50 -1.734 20.045 10.938 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -0.489 19.716 8.818 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.428 18.277 9.862 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -1.511 18.306 8.450 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.418 21.275 8.913 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -3.584 19.986 8.534 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -3.784 20.960 10.009 1.00 0.00 H new ATOM 849 N GLU A 51 -6.216 17.284 11.834 1.00 0.00 N ATOM 850 CA GLU A 51 -7.060 16.249 12.437 1.00 0.00 C ATOM 851 C GLU A 51 -6.692 14.870 11.877 1.00 0.00 C ATOM 852 O GLU A 51 -6.511 14.724 10.665 1.00 0.00 O ATOM 853 CB GLU A 51 -8.535 16.583 12.128 1.00 0.00 C ATOM 854 CG GLU A 51 -9.574 15.602 12.698 1.00 0.00 C ATOM 855 CD GLU A 51 -11.010 16.032 12.371 1.00 0.00 C ATOM 856 OE1 GLU A 51 -11.517 16.974 13.011 1.00 0.00 O ATOM 857 OE2 GLU A 51 -11.625 15.463 11.447 1.00 0.00 O ATOM 0 H GLU A 51 -6.671 17.774 11.064 1.00 0.00 H new ATOM 0 HA GLU A 51 -6.906 16.223 13.516 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -8.752 17.579 12.515 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -8.659 16.627 11.046 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -9.393 14.606 12.293 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -9.453 15.534 13.779 1.00 0.00 H new ATOM 864 N ASP A 52 -6.658 13.871 12.770 1.00 0.00 N ATOM 865 CA ASP A 52 -6.200 12.498 12.472 1.00 0.00 C ATOM 866 C ASP A 52 -7.037 11.821 11.377 1.00 0.00 C ATOM 867 O ASP A 52 -6.479 11.159 10.490 1.00 0.00 O ATOM 868 CB ASP A 52 -6.250 11.651 13.769 1.00 0.00 C ATOM 869 CG ASP A 52 -5.238 12.122 14.824 1.00 0.00 C ATOM 870 OD1 ASP A 52 -5.369 13.264 15.316 1.00 0.00 O ATOM 871 OD2 ASP A 52 -4.294 11.371 15.151 1.00 0.00 O ATOM 0 H ASP A 52 -6.953 13.992 13.739 1.00 0.00 H new ATOM 0 HA ASP A 52 -5.179 12.565 12.097 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -7.255 11.697 14.189 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -6.054 10.607 13.524 1.00 0.00 H new ATOM 876 N GLY A 53 -8.374 11.998 11.470 1.00 0.00 N ATOM 877 CA GLY A 53 -9.334 11.383 10.541 1.00 0.00 C ATOM 878 C GLY A 53 -9.348 12.013 9.152 1.00 0.00 C ATOM 879 O GLY A 53 -10.008 11.499 8.239 1.00 0.00 O ATOM 0 H GLY A 53 -8.812 12.571 12.191 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -9.102 10.322 10.445 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -10.334 11.453 10.970 1.00 0.00 H new ATOM 883 N ARG A 54 -8.640 13.141 8.995 1.00 0.00 N ATOM 884 CA ARG A 54 -8.449 13.822 7.699 1.00 0.00 C ATOM 885 C ARG A 54 -7.128 13.399 7.031 1.00 0.00 C ATOM 886 O ARG A 54 -6.362 12.614 7.591 1.00 0.00 O ATOM 887 CB ARG A 54 -8.499 15.351 7.923 1.00 0.00 C ATOM 888 CG ARG A 54 -9.854 15.829 8.478 1.00 0.00 C ATOM 889 CD ARG A 54 -9.963 17.349 8.596 1.00 0.00 C ATOM 890 NE ARG A 54 -11.291 17.778 9.064 1.00 0.00 N ATOM 891 CZ ARG A 54 -12.272 18.264 8.279 1.00 0.00 C ATOM 892 NH1 ARG A 54 -12.109 18.356 6.964 1.00 0.00 N ATOM 893 NH2 ARG A 54 -13.414 18.645 8.817 1.00 0.00 N ATOM 0 H ARG A 54 -8.177 13.614 9.771 1.00 0.00 H new ATOM 0 HA ARG A 54 -9.251 13.531 7.021 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -7.707 15.638 8.614 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -8.299 15.859 6.979 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -10.652 15.465 7.831 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -10.013 15.384 9.460 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -9.202 17.713 9.286 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -9.758 17.802 7.626 1.00 0.00 H new ATOM 0 HE ARG A 54 -11.484 17.701 10.063 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -11.233 18.057 6.537 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -12.860 18.726 6.382 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -13.553 18.571 9.825 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -14.159 19.013 8.225 1.00 0.00 H new ATOM 907 N THR A 55 -6.892 13.926 5.816 1.00 0.00 N ATOM 908 CA THR A 55 -5.669 13.661 5.019 1.00 0.00 C ATOM 909 C THR A 55 -4.869 14.957 4.864 1.00 0.00 C ATOM 910 O THR A 55 -5.367 16.045 5.198 1.00 0.00 O ATOM 911 CB THR A 55 -6.016 13.094 3.595 1.00 0.00 C ATOM 912 OG1 THR A 55 -6.923 13.981 2.919 1.00 0.00 O ATOM 913 CG2 THR A 55 -6.615 11.676 3.664 1.00 0.00 C ATOM 0 H THR A 55 -7.548 14.554 5.351 1.00 0.00 H new ATOM 0 HA THR A 55 -5.080 12.912 5.549 1.00 0.00 H new ATOM 0 HB THR A 55 -5.084 13.027 3.034 1.00 0.00 H new ATOM 0 HG1 THR A 55 -7.132 13.621 2.032 1.00 0.00 H new ATOM 0 HG21 THR A 55 -6.839 11.326 2.656 1.00 0.00 H new ATOM 0 HG22 THR A 55 -5.899 11.001 4.132 1.00 0.00 H new ATOM 0 HG23 THR A 55 -7.532 11.697 4.253 1.00 0.00 H new ATOM 921 N LEU A 56 -3.636 14.836 4.331 1.00 0.00 N ATOM 922 CA LEU A 56 -2.789 16.000 4.015 1.00 0.00 C ATOM 923 C LEU A 56 -3.525 16.881 2.983 1.00 0.00 C ATOM 924 O LEU A 56 -3.753 18.067 3.215 1.00 0.00 O ATOM 925 CB LEU A 56 -1.399 15.552 3.469 1.00 0.00 C ATOM 926 CG LEU A 56 -0.427 14.870 4.489 1.00 0.00 C ATOM 927 CD1 LEU A 56 0.817 14.291 3.776 1.00 0.00 C ATOM 928 CD2 LEU A 56 0.005 15.853 5.607 1.00 0.00 C ATOM 0 H LEU A 56 -3.205 13.938 4.110 1.00 0.00 H new ATOM 0 HA LEU A 56 -2.608 16.573 4.925 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -1.565 14.860 2.643 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -0.898 16.427 3.055 1.00 0.00 H new ATOM 0 HG LEU A 56 -0.973 14.048 4.952 1.00 0.00 H new ATOM 0 HD11 LEU A 56 1.473 13.824 4.511 1.00 0.00 H new ATOM 0 HD12 LEU A 56 0.503 13.546 3.044 1.00 0.00 H new ATOM 0 HD13 LEU A 56 1.353 15.094 3.270 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.679 15.346 6.297 1.00 0.00 H new ATOM 0 HD22 LEU A 56 0.516 16.707 5.163 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -0.876 16.198 6.148 1.00 0.00 H new ATOM 940 N SER A 57 -3.957 16.231 1.889 1.00 0.00 N ATOM 941 CA SER A 57 -4.691 16.848 0.768 1.00 0.00 C ATOM 942 C SER A 57 -5.954 17.597 1.228 1.00 0.00 C ATOM 943 O SER A 57 -6.361 18.575 0.595 1.00 0.00 O ATOM 944 CB SER A 57 -5.074 15.742 -0.241 1.00 0.00 C ATOM 945 OG SER A 57 -3.951 15.269 -0.934 1.00 0.00 O ATOM 0 H SER A 57 -3.801 15.232 1.755 1.00 0.00 H new ATOM 0 HA SER A 57 -4.038 17.588 0.304 1.00 0.00 H new ATOM 0 HB2 SER A 57 -5.552 14.916 0.286 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.804 16.132 -0.951 1.00 0.00 H new ATOM 0 HG SER A 57 -4.225 14.570 -1.563 1.00 0.00 H new ATOM 951 N ASP A 58 -6.552 17.122 2.340 1.00 0.00 N ATOM 952 CA ASP A 58 -7.769 17.715 2.912 1.00 0.00 C ATOM 953 C ASP A 58 -7.468 19.128 3.417 1.00 0.00 C ATOM 954 O ASP A 58 -8.229 20.065 3.175 1.00 0.00 O ATOM 955 CB ASP A 58 -8.295 16.824 4.059 1.00 0.00 C ATOM 956 CG ASP A 58 -9.599 17.340 4.682 1.00 0.00 C ATOM 957 OD1 ASP A 58 -9.539 18.236 5.545 1.00 0.00 O ATOM 958 OD2 ASP A 58 -10.687 16.863 4.310 1.00 0.00 O ATOM 0 H ASP A 58 -6.203 16.319 2.862 1.00 0.00 H new ATOM 0 HA ASP A 58 -8.539 17.779 2.143 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -8.456 15.815 3.680 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -7.532 16.755 4.835 1.00 0.00 H new ATOM 963 N TYR A 59 -6.318 19.261 4.097 1.00 0.00 N ATOM 964 CA TYR A 59 -5.836 20.532 4.650 1.00 0.00 C ATOM 965 C TYR A 59 -4.997 21.316 3.614 1.00 0.00 C ATOM 966 O TYR A 59 -4.207 22.177 4.003 1.00 0.00 O ATOM 967 CB TYR A 59 -5.002 20.263 5.930 1.00 0.00 C ATOM 968 CG TYR A 59 -5.834 20.028 7.182 1.00 0.00 C ATOM 969 CD1 TYR A 59 -6.420 21.110 7.835 1.00 0.00 C ATOM 970 CD2 TYR A 59 -6.028 18.759 7.715 1.00 0.00 C ATOM 971 CE1 TYR A 59 -7.152 20.941 8.983 1.00 0.00 C ATOM 972 CE2 TYR A 59 -6.763 18.588 8.862 1.00 0.00 C ATOM 973 CZ TYR A 59 -7.333 19.682 9.489 1.00 0.00 C ATOM 974 OH TYR A 59 -8.066 19.514 10.645 1.00 0.00 O ATOM 0 H TYR A 59 -5.691 18.478 4.279 1.00 0.00 H new ATOM 0 HA TYR A 59 -6.701 21.145 4.905 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -4.368 19.392 5.760 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -4.339 21.111 6.102 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -6.295 22.103 7.429 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -5.597 17.900 7.223 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -7.582 21.795 9.484 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -6.896 17.599 9.275 1.00 0.00 H new ATOM 0 HH TYR A 59 -7.528 19.790 11.416 1.00 0.00 H new ATOM 984 N ASN A 60 -5.180 21.007 2.307 1.00 0.00 N ATOM 985 CA ASN A 60 -4.519 21.710 1.174 1.00 0.00 C ATOM 986 C ASN A 60 -3.009 21.392 1.098 1.00 0.00 C ATOM 987 O ASN A 60 -2.275 22.050 0.360 1.00 0.00 O ATOM 988 CB ASN A 60 -4.762 23.258 1.222 1.00 0.00 C ATOM 989 CG ASN A 60 -6.246 23.653 1.198 1.00 0.00 C ATOM 990 OD1 ASN A 60 -6.824 23.910 0.139 1.00 0.00 O ATOM 991 ND2 ASN A 60 -6.884 23.673 2.361 1.00 0.00 N ATOM 0 H ASN A 60 -5.798 20.254 2.004 1.00 0.00 H new ATOM 0 HA ASN A 60 -4.983 21.331 0.263 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -4.303 23.661 2.125 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -4.258 23.722 0.374 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -7.877 23.905 2.394 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -6.382 23.456 3.222 1.00 0.00 H new ATOM 998 N ILE A 61 -2.562 20.358 1.832 1.00 0.00 N ATOM 999 CA ILE A 61 -1.144 19.935 1.877 1.00 0.00 C ATOM 1000 C ILE A 61 -0.885 18.930 0.742 1.00 0.00 C ATOM 1001 O ILE A 61 -1.509 17.860 0.695 1.00 0.00 O ATOM 1002 CB ILE A 61 -0.800 19.244 3.251 1.00 0.00 C ATOM 1003 CG1 ILE A 61 -1.321 20.092 4.446 1.00 0.00 C ATOM 1004 CG2 ILE A 61 0.719 18.951 3.394 1.00 0.00 C ATOM 1005 CD1 ILE A 61 -1.493 19.321 5.742 1.00 0.00 C ATOM 0 H ILE A 61 -3.174 19.787 2.415 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.517 20.820 1.763 1.00 0.00 H new ATOM 0 HB ILE A 61 -1.313 18.282 3.265 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.629 20.916 4.618 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -2.279 20.533 4.171 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.909 18.475 4.356 1.00 0.00 H new ATOM 0 HG22 ILE A 61 1.039 18.287 2.591 1.00 0.00 H new ATOM 0 HG23 ILE A 61 1.277 19.886 3.335 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -1.860 19.992 6.519 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.210 18.513 5.593 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -0.534 18.903 6.047 1.00 0.00 H new ATOM 1017 N GLN A 62 0.005 19.283 -0.175 1.00 0.00 N ATOM 1018 CA GLN A 62 0.461 18.376 -1.245 1.00 0.00 C ATOM 1019 C GLN A 62 1.851 17.830 -0.884 1.00 0.00 C ATOM 1020 O GLN A 62 2.376 18.108 0.213 1.00 0.00 O ATOM 1021 CB GLN A 62 0.505 19.118 -2.611 1.00 0.00 C ATOM 1022 CG GLN A 62 1.470 20.333 -2.657 1.00 0.00 C ATOM 1023 CD GLN A 62 1.861 20.754 -4.074 1.00 0.00 C ATOM 1024 OE1 GLN A 62 1.195 21.572 -4.710 1.00 0.00 O ATOM 1025 NE2 GLN A 62 2.958 20.197 -4.574 1.00 0.00 N ATOM 0 H GLN A 62 0.438 20.206 -0.207 1.00 0.00 H new ATOM 0 HA GLN A 62 -0.241 17.547 -1.337 1.00 0.00 H new ATOM 0 HB2 GLN A 62 0.798 18.409 -3.385 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -0.500 19.460 -2.856 1.00 0.00 H new ATOM 0 HG2 GLN A 62 1.001 21.178 -2.153 1.00 0.00 H new ATOM 0 HG3 GLN A 62 2.373 20.090 -2.097 1.00 0.00 H new ATOM 0 HE21 GLN A 62 3.486 19.523 -4.020 1.00 0.00 H new ATOM 0 HE22 GLN A 62 3.273 20.443 -5.512 1.00 0.00 H new ATOM 1034 N LYS A 63 2.454 17.065 -1.815 1.00 0.00 N ATOM 1035 CA LYS A 63 3.842 16.599 -1.674 1.00 0.00 C ATOM 1036 C LYS A 63 4.798 17.806 -1.526 1.00 0.00 C ATOM 1037 O LYS A 63 4.588 18.856 -2.156 1.00 0.00 O ATOM 1038 CB LYS A 63 4.271 15.726 -2.887 1.00 0.00 C ATOM 1039 CG LYS A 63 4.328 16.475 -4.239 1.00 0.00 C ATOM 1040 CD LYS A 63 4.868 15.609 -5.397 1.00 0.00 C ATOM 1041 CE LYS A 63 6.314 15.135 -5.169 1.00 0.00 C ATOM 1042 NZ LYS A 63 6.873 14.468 -6.373 1.00 0.00 N ATOM 0 H LYS A 63 1.998 16.758 -2.674 1.00 0.00 H new ATOM 0 HA LYS A 63 3.899 15.983 -0.777 1.00 0.00 H new ATOM 0 HB2 LYS A 63 5.254 15.302 -2.681 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.576 14.891 -2.979 1.00 0.00 H new ATOM 0 HG2 LYS A 63 3.328 16.827 -4.494 1.00 0.00 H new ATOM 0 HG3 LYS A 63 4.958 17.358 -4.131 1.00 0.00 H new ATOM 0 HD2 LYS A 63 4.223 14.740 -5.525 1.00 0.00 H new ATOM 0 HD3 LYS A 63 4.821 16.181 -6.324 1.00 0.00 H new ATOM 0 HE2 LYS A 63 6.938 15.988 -4.903 1.00 0.00 H new ATOM 0 HE3 LYS A 63 6.341 14.445 -4.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 7.848 14.163 -6.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 6.292 13.639 -6.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 6.870 15.134 -7.172 1.00 0.00 H new ATOM 1056 N GLU A 64 5.795 17.645 -0.643 1.00 0.00 N ATOM 1057 CA GLU A 64 6.888 18.616 -0.413 1.00 0.00 C ATOM 1058 C GLU A 64 6.409 19.908 0.284 1.00 0.00 C ATOM 1059 O GLU A 64 7.198 20.854 0.427 1.00 0.00 O ATOM 1060 CB GLU A 64 7.644 18.927 -1.737 1.00 0.00 C ATOM 1061 CG GLU A 64 8.216 17.688 -2.462 1.00 0.00 C ATOM 1062 CD GLU A 64 8.825 18.033 -3.829 1.00 0.00 C ATOM 1063 OE1 GLU A 64 8.061 18.248 -4.797 1.00 0.00 O ATOM 1064 OE2 GLU A 64 10.063 18.109 -3.941 1.00 0.00 O ATOM 0 H GLU A 64 5.870 16.817 -0.052 1.00 0.00 H new ATOM 0 HA GLU A 64 7.587 18.143 0.277 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.965 19.445 -2.414 1.00 0.00 H new ATOM 0 HB3 GLU A 64 8.462 19.613 -1.519 1.00 0.00 H new ATOM 0 HG2 GLU A 64 8.978 17.224 -1.835 1.00 0.00 H new ATOM 0 HG3 GLU A 64 7.423 16.952 -2.597 1.00 0.00 H new ATOM 1071 N SER A 65 5.130 19.949 0.736 1.00 0.00 N ATOM 1072 CA SER A 65 4.600 21.114 1.468 1.00 0.00 C ATOM 1073 C SER A 65 5.246 21.220 2.859 1.00 0.00 C ATOM 1074 O SER A 65 5.403 20.209 3.557 1.00 0.00 O ATOM 1075 CB SER A 65 3.069 21.030 1.594 1.00 0.00 C ATOM 1076 OG SER A 65 2.450 20.999 0.323 1.00 0.00 O ATOM 0 H SER A 65 4.457 19.194 0.605 1.00 0.00 H new ATOM 0 HA SER A 65 4.849 22.011 0.901 1.00 0.00 H new ATOM 0 HB2 SER A 65 2.797 20.136 2.155 1.00 0.00 H new ATOM 0 HB3 SER A 65 2.701 21.886 2.159 1.00 0.00 H new ATOM 0 HG SER A 65 2.399 20.073 0.007 1.00 0.00 H new ATOM 1082 N THR A 66 5.633 22.450 3.232 1.00 0.00 N ATOM 1083 CA THR A 66 6.206 22.751 4.542 1.00 0.00 C ATOM 1084 C THR A 66 5.094 23.213 5.498 1.00 0.00 C ATOM 1085 O THR A 66 4.338 24.146 5.186 1.00 0.00 O ATOM 1086 CB THR A 66 7.331 23.833 4.448 1.00 0.00 C ATOM 1087 OG1 THR A 66 8.301 23.439 3.455 1.00 0.00 O ATOM 1088 CG2 THR A 66 8.054 24.038 5.802 1.00 0.00 C ATOM 0 H THR A 66 5.554 23.266 2.625 1.00 0.00 H new ATOM 0 HA THR A 66 6.664 21.841 4.929 1.00 0.00 H new ATOM 0 HB THR A 66 6.857 24.774 4.170 1.00 0.00 H new ATOM 0 HG1 THR A 66 9.004 24.119 3.397 1.00 0.00 H new ATOM 0 HG21 THR A 66 8.827 24.798 5.690 1.00 0.00 H new ATOM 0 HG22 THR A 66 7.334 24.361 6.554 1.00 0.00 H new ATOM 0 HG23 THR A 66 8.511 23.099 6.116 1.00 0.00 H new ATOM 1096 N LEU A 67 5.000 22.541 6.646 1.00 0.00 N ATOM 1097 CA LEU A 67 4.037 22.852 7.713 1.00 0.00 C ATOM 1098 C LEU A 67 4.782 23.008 9.040 1.00 0.00 C ATOM 1099 O LEU A 67 5.967 22.679 9.132 1.00 0.00 O ATOM 1100 CB LEU A 67 2.926 21.762 7.818 1.00 0.00 C ATOM 1101 CG LEU A 67 3.376 20.263 7.882 1.00 0.00 C ATOM 1102 CD1 LEU A 67 2.318 19.394 8.593 1.00 0.00 C ATOM 1103 CD2 LEU A 67 3.674 19.686 6.468 1.00 0.00 C ATOM 0 H LEU A 67 5.602 21.748 6.869 1.00 0.00 H new ATOM 0 HA LEU A 67 3.538 23.790 7.470 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.334 21.972 8.709 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.263 21.876 6.960 1.00 0.00 H new ATOM 0 HG LEU A 67 4.300 20.236 8.460 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.658 18.359 8.622 1.00 0.00 H new ATOM 0 HD12 LEU A 67 2.173 19.757 9.610 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.375 19.451 8.049 1.00 0.00 H new ATOM 0 HD21 LEU A 67 3.983 18.645 6.558 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.776 19.747 5.854 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.473 20.262 6.001 1.00 0.00 H new ATOM 1115 N HIS A 68 4.085 23.535 10.055 1.00 0.00 N ATOM 1116 CA HIS A 68 4.663 23.760 11.394 1.00 0.00 C ATOM 1117 C HIS A 68 4.365 22.575 12.327 1.00 0.00 C ATOM 1118 O HIS A 68 3.341 21.891 12.197 1.00 0.00 O ATOM 1119 CB HIS A 68 4.145 25.086 12.003 1.00 0.00 C ATOM 1120 CG HIS A 68 4.685 26.329 11.326 1.00 0.00 C ATOM 1121 ND1 HIS A 68 4.126 26.889 10.198 1.00 0.00 N ATOM 1122 CD2 HIS A 68 5.725 27.136 11.656 1.00 0.00 C ATOM 1123 CE1 HIS A 68 4.787 27.984 9.879 1.00 0.00 C ATOM 1124 NE2 HIS A 68 5.763 28.153 10.742 1.00 0.00 N ATOM 0 H HIS A 68 3.108 23.818 9.976 1.00 0.00 H new ATOM 0 HA HIS A 68 5.745 23.839 11.285 1.00 0.00 H new ATOM 0 HB2 HIS A 68 3.057 25.098 11.947 1.00 0.00 H new ATOM 0 HB3 HIS A 68 4.410 25.116 13.060 1.00 0.00 H new ATOM 0 HD2 HIS A 68 6.400 27.000 12.488 1.00 0.00 H new ATOM 0 HE1 HIS A 68 4.563 28.634 9.046 1.00 0.00 H new ATOM 0 HE2 HIS A 68 6.438 28.917 10.732 1.00 0.00 H new ATOM 1133 N LEU A 69 5.285 22.361 13.275 1.00 0.00 N ATOM 1134 CA LEU A 69 5.226 21.268 14.249 1.00 0.00 C ATOM 1135 C LEU A 69 5.538 21.858 15.625 1.00 0.00 C ATOM 1136 O LEU A 69 6.560 22.531 15.799 1.00 0.00 O ATOM 1137 CB LEU A 69 6.254 20.167 13.841 1.00 0.00 C ATOM 1138 CG LEU A 69 6.139 18.744 14.498 1.00 0.00 C ATOM 1139 CD1 LEU A 69 6.522 18.739 15.982 1.00 0.00 C ATOM 1140 CD2 LEU A 69 4.736 18.142 14.278 1.00 0.00 C ATOM 0 H LEU A 69 6.107 22.955 13.388 1.00 0.00 H new ATOM 0 HA LEU A 69 4.241 20.803 14.278 1.00 0.00 H new ATOM 0 HB2 LEU A 69 6.188 20.038 12.761 1.00 0.00 H new ATOM 0 HB3 LEU A 69 7.251 20.550 14.056 1.00 0.00 H new ATOM 0 HG LEU A 69 6.867 18.109 13.992 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.423 17.729 16.380 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.554 19.073 16.093 1.00 0.00 H new ATOM 0 HD13 LEU A 69 5.862 19.412 16.530 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.685 17.158 14.743 1.00 0.00 H new ATOM 0 HD22 LEU A 69 3.986 18.794 14.726 1.00 0.00 H new ATOM 0 HD23 LEU A 69 4.544 18.049 13.209 1.00 0.00 H new ATOM 1152 N VAL A 70 4.649 21.612 16.587 1.00 0.00 N ATOM 1153 CA VAL A 70 4.801 22.082 17.966 1.00 0.00 C ATOM 1154 C VAL A 70 5.282 20.937 18.863 1.00 0.00 C ATOM 1155 O VAL A 70 4.543 19.982 19.124 1.00 0.00 O ATOM 1156 CB VAL A 70 3.451 22.693 18.486 1.00 0.00 C ATOM 1157 CG1 VAL A 70 3.509 23.057 19.993 1.00 0.00 C ATOM 1158 CG2 VAL A 70 3.064 23.914 17.614 1.00 0.00 C ATOM 0 H VAL A 70 3.795 21.076 16.431 1.00 0.00 H new ATOM 0 HA VAL A 70 5.554 22.870 17.995 1.00 0.00 H new ATOM 0 HB VAL A 70 2.675 21.933 18.393 1.00 0.00 H new ATOM 0 HG11 VAL A 70 2.552 23.475 20.303 1.00 0.00 H new ATOM 0 HG12 VAL A 70 3.719 22.160 20.576 1.00 0.00 H new ATOM 0 HG13 VAL A 70 4.297 23.791 20.160 1.00 0.00 H new ATOM 0 HG21 VAL A 70 2.127 24.337 17.976 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.849 24.667 17.674 1.00 0.00 H new ATOM 0 HG23 VAL A 70 2.943 23.598 16.578 1.00 0.00 H new ATOM 1168 N LEU A 71 6.548 21.041 19.292 1.00 0.00 N ATOM 1169 CA LEU A 71 7.145 20.122 20.264 1.00 0.00 C ATOM 1170 C LEU A 71 6.732 20.516 21.692 1.00 0.00 C ATOM 1171 O LEU A 71 6.578 21.702 22.003 1.00 0.00 O ATOM 1172 CB LEU A 71 8.689 20.109 20.132 1.00 0.00 C ATOM 1173 CG LEU A 71 9.262 19.468 18.829 1.00 0.00 C ATOM 1174 CD1 LEU A 71 10.808 19.495 18.821 1.00 0.00 C ATOM 1175 CD2 LEU A 71 8.734 18.027 18.633 1.00 0.00 C ATOM 0 H LEU A 71 7.187 21.769 18.972 1.00 0.00 H new ATOM 0 HA LEU A 71 6.777 19.117 20.057 1.00 0.00 H new ATOM 0 HB2 LEU A 71 9.047 21.137 20.195 1.00 0.00 H new ATOM 0 HB3 LEU A 71 9.102 19.574 20.987 1.00 0.00 H new ATOM 0 HG LEU A 71 8.914 20.069 17.989 1.00 0.00 H new ATOM 0 HD11 LEU A 71 11.175 19.041 17.900 1.00 0.00 H new ATOM 0 HD12 LEU A 71 11.154 20.527 18.880 1.00 0.00 H new ATOM 0 HD13 LEU A 71 11.186 18.936 19.677 1.00 0.00 H new ATOM 0 HD21 LEU A 71 9.151 17.608 17.717 1.00 0.00 H new ATOM 0 HD22 LEU A 71 9.032 17.412 19.482 1.00 0.00 H new ATOM 0 HD23 LEU A 71 7.646 18.045 18.561 1.00 0.00 H new ATOM 1187 N ARG A 72 6.548 19.494 22.538 1.00 0.00 N ATOM 1188 CA ARG A 72 6.132 19.650 23.941 1.00 0.00 C ATOM 1189 C ARG A 72 7.195 19.034 24.854 1.00 0.00 C ATOM 1190 O ARG A 72 7.622 19.662 25.827 1.00 0.00 O ATOM 1191 CB ARG A 72 4.744 18.985 24.167 1.00 0.00 C ATOM 1192 CG ARG A 72 3.638 19.523 23.226 1.00 0.00 C ATOM 1193 CD ARG A 72 2.284 18.818 23.407 1.00 0.00 C ATOM 1194 NE ARG A 72 1.669 19.119 24.712 1.00 0.00 N ATOM 1195 CZ ARG A 72 0.648 18.443 25.258 1.00 0.00 C ATOM 1196 NH1 ARG A 72 0.155 17.356 24.670 1.00 0.00 N ATOM 1197 NH2 ARG A 72 0.134 18.849 26.411 1.00 0.00 N ATOM 0 H ARG A 72 6.686 18.521 22.265 1.00 0.00 H new ATOM 0 HA ARG A 72 6.036 20.709 24.180 1.00 0.00 H new ATOM 0 HB2 ARG A 72 4.839 17.909 24.024 1.00 0.00 H new ATOM 0 HB3 ARG A 72 4.438 19.144 25.201 1.00 0.00 H new ATOM 0 HG2 ARG A 72 3.509 20.591 23.403 1.00 0.00 H new ATOM 0 HG3 ARG A 72 3.964 19.408 22.192 1.00 0.00 H new ATOM 0 HD2 ARG A 72 1.607 19.124 22.609 1.00 0.00 H new ATOM 0 HD3 ARG A 72 2.422 17.741 23.312 1.00 0.00 H new ATOM 0 HE ARG A 72 2.050 19.903 25.241 1.00 0.00 H new ATOM 0 HH11 ARG A 72 0.554 17.026 23.791 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -0.622 16.853 25.098 1.00 0.00 H new ATOM 0 HH21 ARG A 72 0.515 19.672 26.878 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -0.643 18.339 26.831 1.00 0.00 H new ATOM 1211 N LEU A 73 7.607 17.789 24.502 1.00 0.00 N ATOM 1212 CA LEU A 73 8.670 17.021 25.201 1.00 0.00 C ATOM 1213 C LEU A 73 8.426 16.944 26.720 1.00 0.00 C ATOM 1214 O LEU A 73 9.342 17.124 27.537 1.00 0.00 O ATOM 1215 CB LEU A 73 10.100 17.561 24.843 1.00 0.00 C ATOM 1216 CG LEU A 73 10.735 17.004 23.521 1.00 0.00 C ATOM 1217 CD1 LEU A 73 10.929 15.471 23.603 1.00 0.00 C ATOM 1218 CD2 LEU A 73 9.904 17.396 22.275 1.00 0.00 C ATOM 0 H LEU A 73 7.204 17.283 23.713 1.00 0.00 H new ATOM 0 HA LEU A 73 8.623 15.995 24.837 1.00 0.00 H new ATOM 0 HB2 LEU A 73 10.048 18.647 24.768 1.00 0.00 H new ATOM 0 HB3 LEU A 73 10.771 17.330 25.670 1.00 0.00 H new ATOM 0 HG LEU A 73 11.717 17.464 23.412 1.00 0.00 H new ATOM 0 HD11 LEU A 73 11.371 15.110 22.674 1.00 0.00 H new ATOM 0 HD12 LEU A 73 11.590 15.232 24.436 1.00 0.00 H new ATOM 0 HD13 LEU A 73 9.963 14.990 23.757 1.00 0.00 H new ATOM 0 HD21 LEU A 73 10.377 16.991 21.380 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.896 16.991 22.368 1.00 0.00 H new ATOM 0 HD23 LEU A 73 9.853 18.482 22.199 1.00 0.00 H new ATOM 1230 N ARG A 74 7.165 16.643 27.074 1.00 0.00 N ATOM 1231 CA ARG A 74 6.743 16.422 28.465 1.00 0.00 C ATOM 1232 C ARG A 74 7.324 15.103 29.017 1.00 0.00 C ATOM 1233 O ARG A 74 7.372 14.904 30.233 1.00 0.00 O ATOM 1234 CB ARG A 74 5.192 16.443 28.546 1.00 0.00 C ATOM 1235 CG ARG A 74 4.562 17.774 28.064 1.00 0.00 C ATOM 1236 CD ARG A 74 5.081 18.994 28.851 1.00 0.00 C ATOM 1237 NE ARG A 74 4.507 20.258 28.351 1.00 0.00 N ATOM 1238 CZ ARG A 74 3.672 21.058 29.028 1.00 0.00 C ATOM 1239 NH1 ARG A 74 3.259 20.731 30.240 1.00 0.00 N ATOM 1240 NH2 ARG A 74 3.263 22.194 28.489 1.00 0.00 N ATOM 0 H ARG A 74 6.407 16.546 26.399 1.00 0.00 H new ATOM 0 HA ARG A 74 7.133 17.226 29.089 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.794 15.625 27.946 1.00 0.00 H new ATOM 0 HB3 ARG A 74 4.888 16.259 29.577 1.00 0.00 H new ATOM 0 HG2 ARG A 74 4.778 17.911 27.004 1.00 0.00 H new ATOM 0 HG3 ARG A 74 3.478 17.716 28.164 1.00 0.00 H new ATOM 0 HD2 ARG A 74 4.835 18.876 29.906 1.00 0.00 H new ATOM 0 HD3 ARG A 74 6.168 19.036 28.780 1.00 0.00 H new ATOM 0 HE ARG A 74 4.768 20.548 27.409 1.00 0.00 H new ATOM 0 HH11 ARG A 74 3.576 19.862 30.670 1.00 0.00 H new ATOM 0 HH12 ARG A 74 2.623 21.348 30.746 1.00 0.00 H new ATOM 0 HH21 ARG A 74 3.583 22.461 27.558 1.00 0.00 H new ATOM 0 HH22 ARG A 74 2.627 22.803 29.004 1.00 0.00 H new ATOM 1254 N GLY A 75 7.772 14.219 28.101 1.00 0.00 N ATOM 1255 CA GLY A 75 8.496 12.995 28.462 1.00 0.00 C ATOM 1256 C GLY A 75 10.005 13.198 28.583 1.00 0.00 C ATOM 1257 O GLY A 75 10.739 12.224 28.781 1.00 0.00 O ATOM 0 H GLY A 75 7.640 14.338 27.097 1.00 0.00 H new ATOM 0 HA2 GLY A 75 8.110 12.619 29.410 1.00 0.00 H new ATOM 0 HA3 GLY A 75 8.299 12.230 27.711 1.00 0.00 H new ATOM 1261 N GLY A 76 10.464 14.463 28.462 1.00 0.00 N ATOM 1262 CA GLY A 76 11.885 14.819 28.569 1.00 0.00 C ATOM 1263 C GLY A 76 12.618 14.700 27.240 1.00 0.00 C ATOM 1264 O GLY A 76 13.217 15.671 26.750 1.00 0.00 O ATOM 0 H GLY A 76 9.855 15.262 28.287 1.00 0.00 H new ATOM 0 HA2 GLY A 76 11.973 15.841 28.939 1.00 0.00 H new ATOM 0 HA3 GLY A 76 12.364 14.172 29.304 1.00 0.00 H new TER 1268 GLY A 76 ATOM 1269 N GLY B 195 18.102 16.908 23.092 1.00 0.00 N ATOM 1270 CA GLY B 195 16.994 17.044 24.046 1.00 0.00 C ATOM 1271 C GLY B 195 16.961 18.423 24.692 1.00 0.00 C ATOM 1272 O GLY B 195 17.923 19.194 24.566 1.00 0.00 O ATOM 0 HA2 GLY B 195 16.050 16.862 23.533 1.00 0.00 H new ATOM 0 HA3 GLY B 195 17.088 16.283 24.821 1.00 0.00 H new ATOM 1276 N SER B 196 15.853 18.734 25.388 1.00 0.00 N ATOM 1277 CA SER B 196 15.679 20.011 26.102 1.00 0.00 C ATOM 1278 C SER B 196 14.730 19.805 27.299 1.00 0.00 C ATOM 1279 O SER B 196 13.512 19.673 27.123 1.00 0.00 O ATOM 1280 CB SER B 196 15.138 21.109 25.149 1.00 0.00 C ATOM 1281 OG SER B 196 15.073 22.377 25.792 1.00 0.00 O ATOM 0 H SER B 196 15.053 18.107 25.471 1.00 0.00 H new ATOM 0 HA SER B 196 16.648 20.346 26.471 1.00 0.00 H new ATOM 0 HB2 SER B 196 15.781 21.178 24.271 1.00 0.00 H new ATOM 0 HB3 SER B 196 14.146 20.828 24.796 1.00 0.00 H new ATOM 0 HG SER B 196 14.182 22.764 25.664 1.00 0.00 H new ATOM 1287 N ARG B 197 15.318 19.732 28.507 1.00 0.00 N ATOM 1288 CA ARG B 197 14.577 19.661 29.781 1.00 0.00 C ATOM 1289 C ARG B 197 14.075 21.064 30.183 1.00 0.00 C ATOM 1290 O ARG B 197 13.032 21.200 30.837 1.00 0.00 O ATOM 1291 CB ARG B 197 15.503 19.071 30.883 1.00 0.00 C ATOM 1292 CG ARG B 197 14.913 19.064 32.318 1.00 0.00 C ATOM 1293 CD ARG B 197 15.861 18.429 33.350 1.00 0.00 C ATOM 1294 NE ARG B 197 16.126 17.017 33.029 1.00 0.00 N ATOM 1295 CZ ARG B 197 17.173 16.300 33.453 1.00 0.00 C ATOM 1296 NH1 ARG B 197 18.128 16.848 34.194 1.00 0.00 N ATOM 1297 NH2 ARG B 197 17.261 15.027 33.106 1.00 0.00 N ATOM 0 H ARG B 197 16.331 19.720 28.628 1.00 0.00 H new ATOM 0 HA ARG B 197 13.709 19.012 29.663 1.00 0.00 H new ATOM 0 HB2 ARG B 197 15.758 18.047 30.609 1.00 0.00 H new ATOM 0 HB3 ARG B 197 16.433 19.639 30.894 1.00 0.00 H new ATOM 0 HG2 ARG B 197 14.689 20.088 32.619 1.00 0.00 H new ATOM 0 HG3 ARG B 197 13.969 18.519 32.315 1.00 0.00 H new ATOM 0 HD2 ARG B 197 16.800 18.982 33.374 1.00 0.00 H new ATOM 0 HD3 ARG B 197 15.422 18.503 34.345 1.00 0.00 H new ATOM 0 HE ARG B 197 15.451 16.543 32.429 1.00 0.00 H new ATOM 0 HH11 ARG B 197 18.072 17.834 34.451 1.00 0.00 H new ATOM 0 HH12 ARG B 197 18.918 16.284 34.507 1.00 0.00 H new ATOM 0 HH21 ARG B 197 16.537 14.606 32.524 1.00 0.00 H new ATOM 0 HH22 ARG B 197 18.053 14.466 33.421 1.00 0.00 H new ATOM 1311 N GLN B 198 14.828 22.097 29.754 1.00 0.00 N ATOM 1312 CA GLN B 198 14.562 23.508 30.099 1.00 0.00 C ATOM 1313 C GLN B 198 13.246 23.993 29.464 1.00 0.00 C ATOM 1314 O GLN B 198 12.780 23.419 28.467 1.00 0.00 O ATOM 1315 CB GLN B 198 15.735 24.429 29.627 1.00 0.00 C ATOM 1316 CG GLN B 198 17.091 24.241 30.355 1.00 0.00 C ATOM 1317 CD GLN B 198 17.752 22.877 30.124 1.00 0.00 C ATOM 1318 OE1 GLN B 198 18.491 22.692 29.158 1.00 0.00 O ATOM 1319 NE2 GLN B 198 17.498 21.923 31.010 1.00 0.00 N ATOM 0 H GLN B 198 15.644 21.974 29.154 1.00 0.00 H new ATOM 0 HA GLN B 198 14.476 23.567 31.184 1.00 0.00 H new ATOM 0 HB2 GLN B 198 15.893 24.263 28.561 1.00 0.00 H new ATOM 0 HB3 GLN B 198 15.424 25.467 29.745 1.00 0.00 H new ATOM 0 HG2 GLN B 198 17.776 25.023 30.028 1.00 0.00 H new ATOM 0 HG3 GLN B 198 16.937 24.380 31.425 1.00 0.00 H new ATOM 0 HE21 GLN B 198 16.880 22.111 31.799 1.00 0.00 H new ATOM 0 HE22 GLN B 198 17.921 21.001 30.902 1.00 0.00 H new ATOM 1328 N VAL B 199 12.671 25.056 30.060 1.00 0.00 N ATOM 1329 CA VAL B 199 11.523 25.770 29.499 1.00 0.00 C ATOM 1330 C VAL B 199 11.916 26.337 28.116 1.00 0.00 C ATOM 1331 O VAL B 199 12.672 27.308 28.005 1.00 0.00 O ATOM 1332 CB VAL B 199 11.001 26.891 30.485 1.00 0.00 C ATOM 1333 CG1 VAL B 199 12.125 27.850 30.966 1.00 0.00 C ATOM 1334 CG2 VAL B 199 9.815 27.671 29.868 1.00 0.00 C ATOM 0 H VAL B 199 12.996 25.440 30.947 1.00 0.00 H new ATOM 0 HA VAL B 199 10.690 25.079 29.368 1.00 0.00 H new ATOM 0 HB VAL B 199 10.642 26.376 31.376 1.00 0.00 H new ATOM 0 HG11 VAL B 199 11.703 28.596 31.639 1.00 0.00 H new ATOM 0 HG12 VAL B 199 12.891 27.279 31.491 1.00 0.00 H new ATOM 0 HG13 VAL B 199 12.571 28.349 30.105 1.00 0.00 H new ATOM 0 HG21 VAL B 199 9.478 28.435 30.569 1.00 0.00 H new ATOM 0 HG22 VAL B 199 10.135 28.146 28.940 1.00 0.00 H new ATOM 0 HG23 VAL B 199 8.996 26.983 29.660 1.00 0.00 H new ATOM 1344 N THR B 200 11.465 25.647 27.065 1.00 0.00 N ATOM 1345 CA THR B 200 11.870 25.933 25.691 1.00 0.00 C ATOM 1346 C THR B 200 11.050 27.113 25.141 1.00 0.00 C ATOM 1347 O THR B 200 9.823 27.020 25.011 1.00 0.00 O ATOM 1348 CB THR B 200 11.699 24.656 24.791 1.00 0.00 C ATOM 1349 OG1 THR B 200 12.324 23.531 25.440 1.00 0.00 O ATOM 1350 CG2 THR B 200 12.328 24.845 23.393 1.00 0.00 C ATOM 0 H THR B 200 10.807 24.872 27.146 1.00 0.00 H new ATOM 0 HA THR B 200 12.924 26.210 25.679 1.00 0.00 H new ATOM 0 HB THR B 200 10.631 24.482 24.658 1.00 0.00 H new ATOM 0 HG1 THR B 200 12.218 22.732 24.883 1.00 0.00 H new ATOM 0 HG21 THR B 200 12.187 23.938 22.805 1.00 0.00 H new ATOM 0 HG22 THR B 200 11.848 25.683 22.888 1.00 0.00 H new ATOM 0 HG23 THR B 200 13.394 25.047 23.498 1.00 0.00 H new ATOM 1358 N LYS B 201 11.738 28.240 24.871 1.00 0.00 N ATOM 1359 CA LYS B 201 11.124 29.425 24.251 1.00 0.00 C ATOM 1360 C LYS B 201 10.983 29.138 22.750 1.00 0.00 C ATOM 1361 O LYS B 201 11.963 28.797 22.082 1.00 0.00 O ATOM 1362 CB LYS B 201 11.981 30.710 24.487 1.00 0.00 C ATOM 1363 CG LYS B 201 11.948 31.302 25.931 1.00 0.00 C ATOM 1364 CD LYS B 201 12.556 30.387 27.032 1.00 0.00 C ATOM 1365 CE LYS B 201 14.031 30.008 26.770 1.00 0.00 C ATOM 1366 NZ LYS B 201 14.920 31.194 26.666 1.00 0.00 N ATOM 0 H LYS B 201 12.731 28.352 25.077 1.00 0.00 H new ATOM 0 HA LYS B 201 10.150 29.614 24.703 1.00 0.00 H new ATOM 0 HB2 LYS B 201 13.016 30.483 24.233 1.00 0.00 H new ATOM 0 HB3 LYS B 201 11.644 31.480 23.793 1.00 0.00 H new ATOM 0 HG2 LYS B 201 12.485 32.250 25.931 1.00 0.00 H new ATOM 0 HG3 LYS B 201 10.913 31.522 26.193 1.00 0.00 H new ATOM 0 HD2 LYS B 201 12.484 30.893 27.995 1.00 0.00 H new ATOM 0 HD3 LYS B 201 11.962 29.476 27.106 1.00 0.00 H new ATOM 0 HE2 LYS B 201 14.385 29.364 27.575 1.00 0.00 H new ATOM 0 HE3 LYS B 201 14.095 29.430 25.848 1.00 0.00 H new ATOM 0 HZ1 LYS B 201 15.896 30.882 26.490 1.00 0.00 H new ATOM 0 HZ2 LYS B 201 14.603 31.798 25.881 1.00 0.00 H new ATOM 0 HZ3 LYS B 201 14.884 31.734 27.554 1.00 0.00 H new ATOM 1380 N VAL B 202 9.759 29.263 22.255 1.00 0.00 N ATOM 1381 CA VAL B 202 9.348 28.841 20.903 1.00 0.00 C ATOM 1382 C VAL B 202 8.371 29.881 20.319 1.00 0.00 C ATOM 1383 O VAL B 202 8.145 30.921 20.931 1.00 0.00 O ATOM 1384 CB VAL B 202 8.692 27.399 20.945 1.00 0.00 C ATOM 1385 CG1 VAL B 202 9.756 26.288 21.147 1.00 0.00 C ATOM 1386 CG2 VAL B 202 7.599 27.316 22.041 1.00 0.00 C ATOM 0 H VAL B 202 8.994 29.672 22.792 1.00 0.00 H new ATOM 0 HA VAL B 202 10.225 28.783 20.259 1.00 0.00 H new ATOM 0 HB VAL B 202 8.221 27.231 19.977 1.00 0.00 H new ATOM 0 HG11 VAL B 202 9.266 25.315 21.170 1.00 0.00 H new ATOM 0 HG12 VAL B 202 10.471 26.315 20.324 1.00 0.00 H new ATOM 0 HG13 VAL B 202 10.280 26.453 22.088 1.00 0.00 H new ATOM 0 HG21 VAL B 202 7.166 26.316 22.048 1.00 0.00 H new ATOM 0 HG22 VAL B 202 8.043 27.526 23.014 1.00 0.00 H new ATOM 0 HG23 VAL B 202 6.819 28.048 21.833 1.00 0.00 H new ATOM 1396 N ASP B 203 7.831 29.617 19.114 1.00 0.00 N ATOM 1397 CA ASP B 203 6.859 30.523 18.453 1.00 0.00 C ATOM 1398 C ASP B 203 5.482 29.854 18.365 1.00 0.00 C ATOM 1399 O ASP B 203 5.396 28.646 18.173 1.00 0.00 O ATOM 1400 CB ASP B 203 7.347 30.907 17.033 1.00 0.00 C ATOM 1401 CG ASP B 203 6.480 31.986 16.368 1.00 0.00 C ATOM 1402 OD1 ASP B 203 6.700 33.182 16.640 1.00 0.00 O ATOM 1403 OD2 ASP B 203 5.587 31.636 15.563 1.00 0.00 O ATOM 0 H ASP B 203 8.050 28.781 18.572 1.00 0.00 H new ATOM 0 HA ASP B 203 6.777 31.430 19.052 1.00 0.00 H new ATOM 0 HB2 ASP B 203 8.376 31.262 17.093 1.00 0.00 H new ATOM 0 HB3 ASP B 203 7.353 30.016 16.405 1.00 0.00 H new ATOM 1408 N CYS B 204 4.415 30.661 18.513 1.00 0.00 N ATOM 1409 CA CYS B 204 3.021 30.235 18.302 1.00 0.00 C ATOM 1410 C CYS B 204 2.699 30.389 16.818 1.00 0.00 C ATOM 1411 O CYS B 204 2.375 31.490 16.412 1.00 0.00 O ATOM 1412 CB CYS B 204 2.065 31.093 19.162 1.00 0.00 C ATOM 1413 SG CYS B 204 0.289 30.686 19.044 1.00 0.00 S ATOM 0 H CYS B 204 4.499 31.640 18.786 1.00 0.00 H new ATOM 0 HA CYS B 204 2.892 29.195 18.602 1.00 0.00 H new ATOM 0 HB2 CYS B 204 2.368 31.003 20.205 1.00 0.00 H new ATOM 0 HB3 CYS B 204 2.196 32.138 18.881 1.00 0.00 H new ATOM 1418 N PRO B 205 2.769 29.291 15.988 1.00 0.00 N ATOM 1419 CA PRO B 205 2.807 29.395 14.498 1.00 0.00 C ATOM 1420 C PRO B 205 1.639 30.187 13.886 1.00 0.00 C ATOM 1421 O PRO B 205 1.772 30.744 12.795 1.00 0.00 O ATOM 1422 CB PRO B 205 2.786 27.912 14.029 1.00 0.00 C ATOM 1423 CG PRO B 205 2.261 27.143 15.202 1.00 0.00 C ATOM 1424 CD PRO B 205 2.791 27.868 16.413 1.00 0.00 C ATOM 0 HA PRO B 205 3.684 29.953 14.171 1.00 0.00 H new ATOM 0 HB2 PRO B 205 2.148 27.783 13.155 1.00 0.00 H new ATOM 0 HB3 PRO B 205 3.783 27.572 13.748 1.00 0.00 H new ATOM 0 HG2 PRO B 205 1.171 27.119 15.202 1.00 0.00 H new ATOM 0 HG3 PRO B 205 2.603 26.108 15.181 1.00 0.00 H new ATOM 0 HD2 PRO B 205 2.166 27.699 17.290 1.00 0.00 H new ATOM 0 HD3 PRO B 205 3.798 27.540 16.671 1.00 0.00 H new ATOM 1432 N VAL B 206 0.510 30.245 14.609 1.00 0.00 N ATOM 1433 CA VAL B 206 -0.734 30.847 14.101 1.00 0.00 C ATOM 1434 C VAL B 206 -0.627 32.387 14.089 1.00 0.00 C ATOM 1435 O VAL B 206 -0.658 33.011 13.026 1.00 0.00 O ATOM 1436 CB VAL B 206 -1.977 30.404 14.958 1.00 0.00 C ATOM 1437 CG1 VAL B 206 -3.304 30.780 14.254 1.00 0.00 C ATOM 1438 CG2 VAL B 206 -1.912 28.893 15.310 1.00 0.00 C ATOM 0 H VAL B 206 0.433 29.878 15.558 1.00 0.00 H new ATOM 0 HA VAL B 206 -0.878 30.492 13.081 1.00 0.00 H new ATOM 0 HB VAL B 206 -1.946 30.951 15.900 1.00 0.00 H new ATOM 0 HG11 VAL B 206 -4.145 30.462 14.869 1.00 0.00 H new ATOM 0 HG12 VAL B 206 -3.347 31.860 14.111 1.00 0.00 H new ATOM 0 HG13 VAL B 206 -3.355 30.284 13.285 1.00 0.00 H new ATOM 0 HG21 VAL B 206 -2.785 28.620 15.902 1.00 0.00 H new ATOM 0 HG22 VAL B 206 -1.898 28.306 14.392 1.00 0.00 H new ATOM 0 HG23 VAL B 206 -1.007 28.692 15.883 1.00 0.00 H new ATOM 1448 N CYS B 207 -0.477 32.984 15.291 1.00 0.00 N ATOM 1449 CA CYS B 207 -0.392 34.457 15.458 1.00 0.00 C ATOM 1450 C CYS B 207 1.076 34.942 15.415 1.00 0.00 C ATOM 1451 O CYS B 207 1.334 36.146 15.365 1.00 0.00 O ATOM 1452 CB CYS B 207 -1.081 34.895 16.781 1.00 0.00 C ATOM 1453 SG CYS B 207 -0.235 34.371 18.309 1.00 0.00 S ATOM 0 H CYS B 207 -0.412 32.467 16.168 1.00 0.00 H new ATOM 0 HA CYS B 207 -0.918 34.922 14.624 1.00 0.00 H new ATOM 0 HB2 CYS B 207 -1.165 35.982 16.786 1.00 0.00 H new ATOM 0 HB3 CYS B 207 -2.096 34.497 16.792 1.00 0.00 H new ATOM 1458 N GLY B 208 2.020 33.979 15.445 1.00 0.00 N ATOM 1459 CA GLY B 208 3.463 34.237 15.340 1.00 0.00 C ATOM 1460 C GLY B 208 4.023 35.114 16.452 1.00 0.00 C ATOM 1461 O GLY B 208 4.564 36.193 16.190 1.00 0.00 O ATOM 0 H GLY B 208 1.794 32.989 15.544 1.00 0.00 H new ATOM 0 HA2 GLY B 208 3.992 33.284 15.343 1.00 0.00 H new ATOM 0 HA3 GLY B 208 3.667 34.712 14.380 1.00 0.00 H new ATOM 1465 N VAL B 209 3.861 34.653 17.708 1.00 0.00 N ATOM 1466 CA VAL B 209 4.404 35.333 18.907 1.00 0.00 C ATOM 1467 C VAL B 209 5.397 34.395 19.628 1.00 0.00 C ATOM 1468 O VAL B 209 5.121 33.196 19.784 1.00 0.00 O ATOM 1469 CB VAL B 209 3.255 35.806 19.892 1.00 0.00 C ATOM 1470 CG1 VAL B 209 2.296 36.802 19.196 1.00 0.00 C ATOM 1471 CG2 VAL B 209 2.463 34.613 20.493 1.00 0.00 C ATOM 0 H VAL B 209 3.349 33.797 17.923 1.00 0.00 H new ATOM 0 HA VAL B 209 4.928 36.231 18.581 1.00 0.00 H new ATOM 0 HB VAL B 209 3.745 36.318 20.720 1.00 0.00 H new ATOM 0 HG11 VAL B 209 1.519 37.108 19.896 1.00 0.00 H new ATOM 0 HG12 VAL B 209 2.856 37.678 18.869 1.00 0.00 H new ATOM 0 HG13 VAL B 209 1.837 36.322 18.332 1.00 0.00 H new ATOM 0 HG21 VAL B 209 1.688 34.990 21.160 1.00 0.00 H new ATOM 0 HG22 VAL B 209 2.002 34.040 19.688 1.00 0.00 H new ATOM 0 HG23 VAL B 209 3.142 33.970 21.053 1.00 0.00 H new ATOM 1481 N ASN B 210 6.557 34.937 20.048 1.00 0.00 N ATOM 1482 CA ASN B 210 7.615 34.150 20.711 1.00 0.00 C ATOM 1483 C ASN B 210 7.308 34.011 22.214 1.00 0.00 C ATOM 1484 O ASN B 210 7.453 34.968 22.988 1.00 0.00 O ATOM 1485 CB ASN B 210 9.014 34.772 20.479 1.00 0.00 C ATOM 1486 CG ASN B 210 10.143 33.905 21.063 1.00 0.00 C ATOM 1487 OD1 ASN B 210 10.610 34.123 22.181 1.00 0.00 O ATOM 1488 ND2 ASN B 210 10.561 32.892 20.324 1.00 0.00 N ATOM 0 H ASN B 210 6.786 35.925 19.938 1.00 0.00 H new ATOM 0 HA ASN B 210 7.630 33.155 20.267 1.00 0.00 H new ATOM 0 HB2 ASN B 210 9.177 34.905 19.410 1.00 0.00 H new ATOM 0 HB3 ASN B 210 9.048 35.763 20.932 1.00 0.00 H new ATOM 0 HD21 ASN B 210 11.287 32.269 20.677 1.00 0.00 H new ATOM 0 HD22 ASN B 210 10.157 32.734 19.401 1.00 0.00 H new ATOM 1495 N ILE B 211 6.855 32.809 22.593 1.00 0.00 N ATOM 1496 CA ILE B 211 6.390 32.462 23.949 1.00 0.00 C ATOM 1497 C ILE B 211 6.943 31.070 24.362 1.00 0.00 C ATOM 1498 O ILE B 211 7.201 30.236 23.493 1.00 0.00 O ATOM 1499 CB ILE B 211 4.809 32.444 23.999 1.00 0.00 C ATOM 1500 CG1 ILE B 211 4.239 31.518 22.872 1.00 0.00 C ATOM 1501 CG2 ILE B 211 4.223 33.879 23.901 1.00 0.00 C ATOM 1502 CD1 ILE B 211 2.734 31.459 22.797 1.00 0.00 C ATOM 0 H ILE B 211 6.799 32.023 21.945 1.00 0.00 H new ATOM 0 HA ILE B 211 6.758 33.215 24.646 1.00 0.00 H new ATOM 0 HB ILE B 211 4.503 32.037 24.963 1.00 0.00 H new ATOM 0 HG12 ILE B 211 4.623 31.862 21.911 1.00 0.00 H new ATOM 0 HG13 ILE B 211 4.620 30.508 23.025 1.00 0.00 H new ATOM 0 HG21 ILE B 211 3.135 33.831 23.938 1.00 0.00 H new ATOM 0 HG22 ILE B 211 4.588 34.479 24.734 1.00 0.00 H new ATOM 0 HG23 ILE B 211 4.534 34.336 22.961 1.00 0.00 H new ATOM 0 HD11 ILE B 211 2.436 30.793 21.987 1.00 0.00 H new ATOM 0 HD12 ILE B 211 2.337 31.083 23.740 1.00 0.00 H new ATOM 0 HD13 ILE B 211 2.340 32.458 22.610 1.00 0.00 H new ATOM 1514 N PRO B 212 7.140 30.798 25.698 1.00 0.00 N ATOM 1515 CA PRO B 212 7.559 29.456 26.202 1.00 0.00 C ATOM 1516 C PRO B 212 6.541 28.329 25.872 1.00 0.00 C ATOM 1517 O PRO B 212 5.381 28.605 25.549 1.00 0.00 O ATOM 1518 CB PRO B 212 7.709 29.675 27.729 1.00 0.00 C ATOM 1519 CG PRO B 212 6.892 30.895 28.030 1.00 0.00 C ATOM 1520 CD PRO B 212 7.013 31.777 26.812 1.00 0.00 C ATOM 0 HA PRO B 212 8.477 29.112 25.726 1.00 0.00 H new ATOM 0 HB2 PRO B 212 7.349 28.812 28.288 1.00 0.00 H new ATOM 0 HB3 PRO B 212 8.753 29.821 28.006 1.00 0.00 H new ATOM 0 HG2 PRO B 212 5.852 30.632 28.222 1.00 0.00 H new ATOM 0 HG3 PRO B 212 7.261 31.404 28.920 1.00 0.00 H new ATOM 0 HD2 PRO B 212 6.139 32.417 26.689 1.00 0.00 H new ATOM 0 HD3 PRO B 212 7.882 32.433 26.874 1.00 0.00 H new ATOM 1528 N GLU B 213 7.007 27.071 25.982 1.00 0.00 N ATOM 1529 CA GLU B 213 6.307 25.874 25.469 1.00 0.00 C ATOM 1530 C GLU B 213 4.921 25.608 26.132 1.00 0.00 C ATOM 1531 O GLU B 213 3.977 25.204 25.444 1.00 0.00 O ATOM 1532 CB GLU B 213 7.272 24.648 25.571 1.00 0.00 C ATOM 1533 CG GLU B 213 6.709 23.273 25.098 1.00 0.00 C ATOM 1534 CD GLU B 213 5.897 22.522 26.182 1.00 0.00 C ATOM 1535 OE1 GLU B 213 6.443 22.282 27.280 1.00 0.00 O ATOM 1536 OE2 GLU B 213 4.713 22.174 25.942 1.00 0.00 O ATOM 0 H GLU B 213 7.894 26.852 26.436 1.00 0.00 H new ATOM 0 HA GLU B 213 6.055 26.055 24.424 1.00 0.00 H new ATOM 0 HB2 GLU B 213 8.166 24.869 24.987 1.00 0.00 H new ATOM 0 HB3 GLU B 213 7.586 24.548 26.610 1.00 0.00 H new ATOM 0 HG2 GLU B 213 6.074 23.432 24.227 1.00 0.00 H new ATOM 0 HG3 GLU B 213 7.538 22.643 24.777 1.00 0.00 H new ATOM 1543 N SER B 214 4.773 25.803 27.451 1.00 0.00 N ATOM 1544 CA SER B 214 3.451 25.619 28.103 1.00 0.00 C ATOM 1545 C SER B 214 2.443 26.681 27.586 1.00 0.00 C ATOM 1546 O SER B 214 1.271 26.368 27.277 1.00 0.00 O ATOM 1547 CB SER B 214 3.604 25.649 29.636 1.00 0.00 C ATOM 1548 OG SER B 214 4.472 24.611 30.070 1.00 0.00 O ATOM 0 H SER B 214 5.526 26.081 28.080 1.00 0.00 H new ATOM 0 HA SER B 214 3.049 24.641 27.839 1.00 0.00 H new ATOM 0 HB2 SER B 214 3.998 26.616 29.949 1.00 0.00 H new ATOM 0 HB3 SER B 214 2.628 25.535 30.107 1.00 0.00 H new ATOM 0 HG SER B 214 4.560 24.645 31.045 1.00 0.00 H new ATOM 1554 N HIS B 215 2.948 27.921 27.415 1.00 0.00 N ATOM 1555 CA HIS B 215 2.176 29.034 26.832 1.00 0.00 C ATOM 1556 C HIS B 215 1.884 28.807 25.345 1.00 0.00 C ATOM 1557 O HIS B 215 0.878 29.314 24.857 1.00 0.00 O ATOM 1558 CB HIS B 215 2.903 30.403 27.039 1.00 0.00 C ATOM 1559 CG HIS B 215 2.569 31.074 28.344 1.00 0.00 C ATOM 1560 ND1 HIS B 215 3.483 31.312 29.345 1.00 0.00 N ATOM 1561 CD2 HIS B 215 1.389 31.558 28.800 1.00 0.00 C ATOM 1562 CE1 HIS B 215 2.880 31.913 30.349 1.00 0.00 C ATOM 1563 NE2 HIS B 215 1.611 32.071 30.048 1.00 0.00 N ATOM 0 H HIS B 215 3.900 28.176 27.677 1.00 0.00 H new ATOM 0 HA HIS B 215 1.223 29.067 27.361 1.00 0.00 H new ATOM 0 HB2 HIS B 215 3.980 30.244 26.988 1.00 0.00 H new ATOM 0 HB3 HIS B 215 2.640 31.072 26.219 1.00 0.00 H new ATOM 0 HD2 HIS B 215 0.446 31.542 28.274 1.00 0.00 H new ATOM 0 HE1 HIS B 215 3.351 32.225 31.269 1.00 0.00 H new ATOM 0 HE2 HIS B 215 0.908 32.505 30.646 1.00 0.00 H new ATOM 1572 N ILE B 216 2.758 28.054 24.627 1.00 0.00 N ATOM 1573 CA ILE B 216 2.596 27.841 23.174 1.00 0.00 C ATOM 1574 C ILE B 216 1.366 26.958 22.922 1.00 0.00 C ATOM 1575 O ILE B 216 0.495 27.342 22.144 1.00 0.00 O ATOM 1576 CB ILE B 216 3.919 27.298 22.440 1.00 0.00 C ATOM 1577 CG1 ILE B 216 3.996 27.778 20.952 1.00 0.00 C ATOM 1578 CG2 ILE B 216 4.082 25.752 22.470 1.00 0.00 C ATOM 1579 CD1 ILE B 216 3.068 27.066 19.983 1.00 0.00 C ATOM 0 H ILE B 216 3.572 27.591 25.030 1.00 0.00 H new ATOM 0 HA ILE B 216 2.430 28.815 22.714 1.00 0.00 H new ATOM 0 HB ILE B 216 4.737 27.726 23.020 1.00 0.00 H new ATOM 0 HG12 ILE B 216 3.775 28.845 20.921 1.00 0.00 H new ATOM 0 HG13 ILE B 216 5.021 27.655 20.602 1.00 0.00 H new ATOM 0 HG21 ILE B 216 5.000 25.473 21.953 1.00 0.00 H new ATOM 0 HG22 ILE B 216 4.130 25.411 23.504 1.00 0.00 H new ATOM 0 HG23 ILE B 216 3.230 25.287 21.974 1.00 0.00 H new ATOM 0 HD11 ILE B 216 3.203 27.476 18.982 1.00 0.00 H new ATOM 0 HD12 ILE B 216 3.300 26.001 19.973 1.00 0.00 H new ATOM 0 HD13 ILE B 216 2.034 27.209 20.297 1.00 0.00 H new ATOM 1591 N ASN B 217 1.262 25.832 23.659 1.00 0.00 N ATOM 1592 CA ASN B 217 0.166 24.863 23.479 1.00 0.00 C ATOM 1593 C ASN B 217 -1.182 25.460 23.897 1.00 0.00 C ATOM 1594 O ASN B 217 -2.193 25.213 23.229 1.00 0.00 O ATOM 1595 CB ASN B 217 0.459 23.538 24.228 1.00 0.00 C ATOM 1596 CG ASN B 217 1.546 22.717 23.532 1.00 0.00 C ATOM 1597 OD1 ASN B 217 1.256 21.934 22.623 1.00 0.00 O ATOM 1598 ND2 ASN B 217 2.794 22.885 23.937 1.00 0.00 N ATOM 0 H ASN B 217 1.928 25.573 24.387 1.00 0.00 H new ATOM 0 HA ASN B 217 0.102 24.630 22.416 1.00 0.00 H new ATOM 0 HB2 ASN B 217 0.769 23.759 25.249 1.00 0.00 H new ATOM 0 HB3 ASN B 217 -0.455 22.948 24.293 1.00 0.00 H new ATOM 0 HD21 ASN B 217 3.549 22.360 23.495 1.00 0.00 H new ATOM 0 HD22 ASN B 217 3.002 23.540 24.691 1.00 0.00 H new ATOM 1605 N LYS B 218 -1.181 26.273 24.979 1.00 0.00 N ATOM 1606 CA LYS B 218 -2.400 26.962 25.445 1.00 0.00 C ATOM 1607 C LYS B 218 -2.861 28.031 24.429 1.00 0.00 C ATOM 1608 O LYS B 218 -4.071 28.147 24.117 1.00 0.00 O ATOM 1609 CB LYS B 218 -2.172 27.602 26.844 1.00 0.00 C ATOM 1610 CG LYS B 218 -3.460 28.172 27.531 1.00 0.00 C ATOM 1611 CD LYS B 218 -4.233 27.160 28.447 1.00 0.00 C ATOM 1612 CE LYS B 218 -4.734 25.887 27.734 1.00 0.00 C ATOM 1613 NZ LYS B 218 -5.602 26.198 26.572 1.00 0.00 N ATOM 0 H LYS B 218 -0.352 26.465 25.541 1.00 0.00 H new ATOM 0 HA LYS B 218 -3.190 26.216 25.531 1.00 0.00 H new ATOM 0 HB2 LYS B 218 -1.729 26.854 27.501 1.00 0.00 H new ATOM 0 HB3 LYS B 218 -1.445 28.408 26.744 1.00 0.00 H new ATOM 0 HG2 LYS B 218 -3.179 29.038 28.130 1.00 0.00 H new ATOM 0 HG3 LYS B 218 -4.139 28.527 26.756 1.00 0.00 H new ATOM 0 HD2 LYS B 218 -3.580 26.865 29.269 1.00 0.00 H new ATOM 0 HD3 LYS B 218 -5.088 27.672 28.888 1.00 0.00 H new ATOM 0 HE2 LYS B 218 -3.879 25.300 27.399 1.00 0.00 H new ATOM 0 HE3 LYS B 218 -5.286 25.270 28.443 1.00 0.00 H new ATOM 0 HZ1 LYS B 218 -6.585 25.943 26.795 1.00 0.00 H new ATOM 0 HZ2 LYS B 218 -5.548 27.215 26.360 1.00 0.00 H new ATOM 0 HZ3 LYS B 218 -5.282 25.655 25.745 1.00 0.00 H new ATOM 1627 N HIS B 219 -1.870 28.786 23.889 1.00 0.00 N ATOM 1628 CA HIS B 219 -2.106 29.825 22.871 1.00 0.00 C ATOM 1629 C HIS B 219 -2.736 29.193 21.641 1.00 0.00 C ATOM 1630 O HIS B 219 -3.593 29.796 21.023 1.00 0.00 O ATOM 1631 CB HIS B 219 -0.783 30.567 22.472 1.00 0.00 C ATOM 1632 CG HIS B 219 -0.823 32.066 22.655 1.00 0.00 C ATOM 1633 ND1 HIS B 219 -0.836 32.954 21.588 1.00 0.00 N ATOM 1634 CD2 HIS B 219 -0.816 32.778 23.811 1.00 0.00 C ATOM 1635 CE1 HIS B 219 -0.830 34.157 22.132 1.00 0.00 C ATOM 1636 NE2 HIS B 219 -0.815 34.101 23.468 1.00 0.00 N ATOM 0 H HIS B 219 -0.889 28.687 24.151 1.00 0.00 H new ATOM 0 HA HIS B 219 -2.781 30.567 23.298 1.00 0.00 H new ATOM 0 HB2 HIS B 219 0.037 30.163 23.065 1.00 0.00 H new ATOM 0 HB3 HIS B 219 -0.559 30.347 21.428 1.00 0.00 H new ATOM 0 HD2 HIS B 219 -0.812 32.375 24.813 1.00 0.00 H new ATOM 0 HE1 HIS B 219 -0.836 35.077 21.566 1.00 0.00 H new ATOM 0 HE2 HIS B 219 -0.805 34.894 24.109 1.00 0.00 H new ATOM 1644 N LEU B 220 -2.289 27.964 21.308 1.00 0.00 N ATOM 1645 CA LEU B 220 -2.820 27.200 20.176 1.00 0.00 C ATOM 1646 C LEU B 220 -4.289 26.877 20.381 1.00 0.00 C ATOM 1647 O LEU B 220 -5.063 27.076 19.478 1.00 0.00 O ATOM 1648 CB LEU B 220 -2.030 25.895 19.956 1.00 0.00 C ATOM 1649 CG LEU B 220 -0.554 26.068 19.527 1.00 0.00 C ATOM 1650 CD1 LEU B 220 0.163 24.717 19.497 1.00 0.00 C ATOM 1651 CD2 LEU B 220 -0.432 26.826 18.185 1.00 0.00 C ATOM 0 H LEU B 220 -1.551 27.480 21.820 1.00 0.00 H new ATOM 0 HA LEU B 220 -2.712 27.824 19.289 1.00 0.00 H new ATOM 0 HB2 LEU B 220 -2.055 25.317 20.880 1.00 0.00 H new ATOM 0 HB3 LEU B 220 -2.543 25.305 19.196 1.00 0.00 H new ATOM 0 HG LEU B 220 -0.056 26.686 20.274 1.00 0.00 H new ATOM 0 HD11 LEU B 220 1.200 24.862 19.193 1.00 0.00 H new ATOM 0 HD12 LEU B 220 0.136 24.268 20.490 1.00 0.00 H new ATOM 0 HD13 LEU B 220 -0.335 24.057 18.787 1.00 0.00 H new ATOM 0 HD21 LEU B 220 0.620 26.927 17.919 1.00 0.00 H new ATOM 0 HD22 LEU B 220 -0.952 26.270 17.405 1.00 0.00 H new ATOM 0 HD23 LEU B 220 -0.878 27.816 18.284 1.00 0.00 H new ATOM 1663 N ASP B 221 -4.661 26.421 21.587 1.00 0.00 N ATOM 1664 CA ASP B 221 -6.054 26.028 21.903 1.00 0.00 C ATOM 1665 C ASP B 221 -7.044 27.185 21.636 1.00 0.00 C ATOM 1666 O ASP B 221 -8.214 26.951 21.326 1.00 0.00 O ATOM 1667 CB ASP B 221 -6.180 25.549 23.370 1.00 0.00 C ATOM 1668 CG ASP B 221 -5.353 24.287 23.689 1.00 0.00 C ATOM 1669 OD1 ASP B 221 -5.515 23.268 22.987 1.00 0.00 O ATOM 1670 OD2 ASP B 221 -4.569 24.298 24.663 1.00 0.00 O ATOM 0 H ASP B 221 -4.015 26.313 22.369 1.00 0.00 H new ATOM 0 HA ASP B 221 -6.311 25.200 21.243 1.00 0.00 H new ATOM 0 HB2 ASP B 221 -5.865 26.355 24.033 1.00 0.00 H new ATOM 0 HB3 ASP B 221 -7.229 25.348 23.588 1.00 0.00 H new ATOM 1675 N SER B 222 -6.546 28.429 21.757 1.00 0.00 N ATOM 1676 CA SER B 222 -7.318 29.640 21.404 1.00 0.00 C ATOM 1677 C SER B 222 -7.121 30.020 19.909 1.00 0.00 C ATOM 1678 O SER B 222 -8.084 30.350 19.208 1.00 0.00 O ATOM 1679 CB SER B 222 -6.893 30.808 22.331 1.00 0.00 C ATOM 1680 OG SER B 222 -7.648 31.980 22.071 1.00 0.00 O ATOM 0 H SER B 222 -5.605 28.625 22.099 1.00 0.00 H new ATOM 0 HA SER B 222 -8.379 29.434 21.547 1.00 0.00 H new ATOM 0 HB2 SER B 222 -7.024 30.513 23.372 1.00 0.00 H new ATOM 0 HB3 SER B 222 -5.833 31.018 22.190 1.00 0.00 H new ATOM 0 HG SER B 222 -7.357 32.697 22.673 1.00 0.00 H new ATOM 1686 N CYS B 223 -5.873 29.909 19.423 1.00 0.00 N ATOM 1687 CA CYS B 223 -5.440 30.462 18.114 1.00 0.00 C ATOM 1688 C CYS B 223 -5.864 29.579 16.915 1.00 0.00 C ATOM 1689 O CYS B 223 -6.093 30.093 15.814 1.00 0.00 O ATOM 1690 CB CYS B 223 -3.905 30.684 18.129 1.00 0.00 C ATOM 1691 SG CYS B 223 -3.390 32.104 19.162 1.00 0.00 S ATOM 0 H CYS B 223 -5.126 29.431 19.926 1.00 0.00 H new ATOM 0 HA CYS B 223 -5.947 31.417 17.975 1.00 0.00 H new ATOM 0 HB2 CYS B 223 -3.418 29.781 18.496 1.00 0.00 H new ATOM 0 HB3 CYS B 223 -3.557 30.841 17.108 1.00 0.00 H new ATOM 1696 N LEU B 224 -6.002 28.264 17.142 1.00 0.00 N ATOM 1697 CA LEU B 224 -6.374 27.290 16.090 1.00 0.00 C ATOM 1698 C LEU B 224 -7.900 27.299 15.906 1.00 0.00 C ATOM 1699 O LEU B 224 -8.408 26.797 14.896 1.00 0.00 O ATOM 1700 CB LEU B 224 -5.809 25.854 16.411 1.00 0.00 C ATOM 1701 CG LEU B 224 -6.449 25.038 17.608 1.00 0.00 C ATOM 1702 CD1 LEU B 224 -7.724 24.247 17.202 1.00 0.00 C ATOM 1703 CD2 LEU B 224 -5.414 24.083 18.258 1.00 0.00 C ATOM 0 H LEU B 224 -5.860 27.840 18.059 1.00 0.00 H new ATOM 0 HA LEU B 224 -5.918 27.585 15.145 1.00 0.00 H new ATOM 0 HB2 LEU B 224 -5.907 25.250 15.509 1.00 0.00 H new ATOM 0 HB3 LEU B 224 -4.743 25.955 16.612 1.00 0.00 H new ATOM 0 HG LEU B 224 -6.757 25.784 18.340 1.00 0.00 H new ATOM 0 HD11 LEU B 224 -8.111 23.711 18.069 1.00 0.00 H new ATOM 0 HD12 LEU B 224 -8.481 24.940 16.836 1.00 0.00 H new ATOM 0 HD13 LEU B 224 -7.475 23.534 16.416 1.00 0.00 H new ATOM 0 HD21 LEU B 224 -5.885 23.538 19.076 1.00 0.00 H new ATOM 0 HD22 LEU B 224 -5.052 23.376 17.512 1.00 0.00 H new ATOM 0 HD23 LEU B 224 -4.576 24.663 18.644 1.00 0.00 H new ATOM 1715 N SER B 225 -8.614 27.872 16.909 1.00 0.00 N ATOM 1716 CA SER B 225 -10.071 28.053 16.880 1.00 0.00 C ATOM 1717 C SER B 225 -10.417 29.231 15.940 1.00 0.00 C ATOM 1718 O SER B 225 -10.709 30.354 16.377 1.00 0.00 O ATOM 1719 CB SER B 225 -10.616 28.266 18.319 1.00 0.00 C ATOM 1720 OG SER B 225 -12.033 28.286 18.352 1.00 0.00 O ATOM 0 H SER B 225 -8.181 28.221 17.764 1.00 0.00 H new ATOM 0 HA SER B 225 -10.553 27.157 16.489 1.00 0.00 H new ATOM 0 HB2 SER B 225 -10.249 27.470 18.967 1.00 0.00 H new ATOM 0 HB3 SER B 225 -10.231 29.205 18.718 1.00 0.00 H new ATOM 0 HG SER B 225 -12.337 28.420 19.274 1.00 0.00 H new ATOM 1726 N ARG B 226 -10.297 28.951 14.633 1.00 0.00 N ATOM 1727 CA ARG B 226 -10.580 29.896 13.542 1.00 0.00 C ATOM 1728 C ARG B 226 -12.022 29.713 13.065 1.00 0.00 C ATOM 1729 O ARG B 226 -12.767 30.678 12.870 1.00 0.00 O ATOM 1730 CB ARG B 226 -9.615 29.610 12.354 1.00 0.00 C ATOM 1731 CG ARG B 226 -9.862 30.456 11.079 1.00 0.00 C ATOM 1732 CD ARG B 226 -9.079 29.945 9.853 1.00 0.00 C ATOM 1733 NE ARG B 226 -9.324 30.786 8.663 1.00 0.00 N ATOM 1734 CZ ARG B 226 -9.860 30.373 7.499 1.00 0.00 C ATOM 1735 NH1 ARG B 226 -10.280 29.126 7.337 1.00 0.00 N ATOM 1736 NH2 ARG B 226 -9.996 31.235 6.507 1.00 0.00 N ATOM 0 H ARG B 226 -9.993 28.037 14.297 1.00 0.00 H new ATOM 0 HA ARG B 226 -10.439 30.916 13.901 1.00 0.00 H new ATOM 0 HB2 ARG B 226 -8.592 29.780 12.690 1.00 0.00 H new ATOM 0 HB3 ARG B 226 -9.693 28.555 12.090 1.00 0.00 H new ATOM 0 HG2 ARG B 226 -10.927 30.453 10.849 1.00 0.00 H new ATOM 0 HG3 ARG B 226 -9.581 31.491 11.277 1.00 0.00 H new ATOM 0 HD2 ARG B 226 -8.013 29.935 10.079 1.00 0.00 H new ATOM 0 HD3 ARG B 226 -9.369 28.916 9.638 1.00 0.00 H new ATOM 0 HE ARG B 226 -9.063 31.770 8.729 1.00 0.00 H new ATOM 0 HH11 ARG B 226 -10.200 28.457 8.103 1.00 0.00 H new ATOM 0 HH12 ARG B 226 -10.683 28.835 6.446 1.00 0.00 H new ATOM 0 HH21 ARG B 226 -9.696 32.202 6.627 1.00 0.00 H new ATOM 0 HH22 ARG B 226 -10.401 30.933 5.621 1.00 0.00 H new ATOM 1750 N GLU B 227 -12.386 28.444 12.894 1.00 0.00 N ATOM 1751 CA GLU B 227 -13.604 28.013 12.204 1.00 0.00 C ATOM 1752 C GLU B 227 -14.325 26.934 13.061 1.00 0.00 C ATOM 1753 O GLU B 227 -15.402 27.220 13.622 1.00 0.00 O ATOM 1754 CB GLU B 227 -13.213 27.513 10.770 1.00 0.00 C ATOM 1755 CG GLU B 227 -11.979 26.572 10.715 1.00 0.00 C ATOM 1756 CD GLU B 227 -11.482 26.277 9.290 1.00 0.00 C ATOM 1757 OE1 GLU B 227 -12.205 25.606 8.524 1.00 0.00 O ATOM 1758 OE2 GLU B 227 -10.368 26.718 8.922 1.00 0.00 O ATOM 1759 OXT GLU B 227 -13.773 25.831 13.239 1.00 0.00 O ATOM 0 H GLU B 227 -11.828 27.664 13.241 1.00 0.00 H new ATOM 0 HA GLU B 227 -14.310 28.834 12.081 1.00 0.00 H new ATOM 0 HB2 GLU B 227 -14.067 26.992 10.338 1.00 0.00 H new ATOM 0 HB3 GLU B 227 -13.017 28.381 10.140 1.00 0.00 H new ATOM 0 HG2 GLU B 227 -11.167 27.021 11.287 1.00 0.00 H new ATOM 0 HG3 GLU B 227 -12.230 25.631 11.204 1.00 0.00 H new TER 1766 GLU B 227 HETATM 1767 ZN ZN B 301 -1.077 32.517 19.531 1.00 0.00 ZN